USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 394 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 212 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 213 ASN : amide:sc= 0 K(o=0,f=-1.9!) USER MOD Set 2.1: A 195 ASN : amide:sc= 0.173 K(o=0.93,f=-3.2!) USER MOD Set 2.2: A 202 THR OG1 : rot -4:sc= 0.753! USER MOD Single : A 188 SER OG : rot 180:sc= 0 USER MOD Single : A 191 SER OG : rot 180:sc= 0 USER MOD Single : A 194 ASN : amide:sc= -0.894 K(o=-0.89,f=0) USER MOD Single : A 198 ASN : amide:sc= -1.29 K(o=-1.3,f=-11!) USER MOD Single : A 203 ASN : amide:sc= -0.929 K(o=-0.93,f=0) USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD Single : A 216 SER OG : rot 180:sc= 0 USER MOD Single : A 218 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 219 THR OG1 : rot 180:sc= 0 USER MOD Single : A 220 SER OG : rot 82:sc= 0.369 USER MOD Single : A 224 LYS NZ :NH3+ -165:sc= -0.269 (180deg=-0.767) USER MOD Single : A 225 HIS : no HD1:sc= -3.83! C(o=-3.8!,f=-14!) USER MOD Single : A 229 LYS NZ :NH3+ 161:sc= -0.0208 (180deg=-0.279) USER MOD Single : A 230 THR OG1 : rot 180:sc= 0 USER MOD Single : A 231 LYS NZ :NH3+ -110:sc= -9.31! (180deg=-16.4!) USER MOD Single : A 233 GLN : amide:sc= -1.78! C(o=-1.8!,f=-1.1!) USER MOD Single : A 235 THR OG1 : rot -170:sc= 0 USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 243 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 187 17.075 4.886 -7.356 1.00 0.00 N ATOM 2 CA GLY A 187 16.995 5.649 -6.079 1.00 0.00 C ATOM 3 C GLY A 187 18.223 5.339 -5.220 1.00 0.00 C ATOM 4 O GLY A 187 19.244 4.902 -5.715 1.00 0.00 O ATOM 0 HA2 GLY A 187 16.943 6.718 -6.285 1.00 0.00 H new ATOM 0 HA3 GLY A 187 16.085 5.383 -5.541 1.00 0.00 H new ATOM 7 N SER A 188 18.136 5.558 -3.936 1.00 0.00 N ATOM 8 CA SER A 188 19.303 5.271 -3.055 1.00 0.00 C ATOM 9 C SER A 188 19.318 3.783 -2.707 1.00 0.00 C ATOM 10 O SER A 188 20.216 3.298 -2.047 1.00 0.00 O ATOM 11 CB SER A 188 19.185 6.094 -1.773 1.00 0.00 C ATOM 12 OG SER A 188 19.233 7.478 -2.096 1.00 0.00 O ATOM 0 H SER A 188 17.310 5.922 -3.461 1.00 0.00 H new ATOM 0 HA SER A 188 20.226 5.534 -3.571 1.00 0.00 H new ATOM 0 HB2 SER A 188 18.251 5.860 -1.262 1.00 0.00 H new ATOM 0 HB3 SER A 188 19.995 5.840 -1.089 1.00 0.00 H new ATOM 0 HG SER A 188 19.156 8.008 -1.275 1.00 0.00 H new ATOM 18 N CYS A 189 18.334 3.051 -3.153 1.00 0.00 N ATOM 19 CA CYS A 189 18.297 1.592 -2.855 1.00 0.00 C ATOM 20 C CYS A 189 19.517 0.922 -3.491 1.00 0.00 C ATOM 21 O CYS A 189 20.017 -0.073 -3.005 1.00 0.00 O ATOM 22 CB CYS A 189 17.016 0.984 -3.427 1.00 0.00 C ATOM 23 SG CYS A 189 15.589 1.578 -2.484 1.00 0.00 S ATOM 0 H CYS A 189 17.555 3.400 -3.711 1.00 0.00 H new ATOM 0 HA CYS A 189 18.314 1.435 -1.776 1.00 0.00 H new ATOM 0 HB2 CYS A 189 16.910 1.256 -4.477 1.00 0.00 H new ATOM 0 HB3 CYS A 189 17.067 -0.104 -3.383 1.00 0.00 H new ATOM 28 N ALA A 190 20.003 1.468 -4.571 1.00 0.00 N ATOM 29 CA ALA A 190 21.194 0.875 -5.240 1.00 0.00 C ATOM 30 C ALA A 190 20.866 -0.535 -5.745 1.00 0.00 C ATOM 31 O ALA A 190 20.610 -0.739 -6.914 1.00 0.00 O ATOM 32 CB ALA A 190 22.357 0.809 -4.245 1.00 0.00 C ATOM 0 H ALA A 190 19.625 2.302 -5.020 1.00 0.00 H new ATOM 0 HA ALA A 190 21.475 1.498 -6.089 1.00 0.00 H new ATOM 0 HB1 ALA A 190 23.230 0.375 -4.733 1.00 0.00 H new ATOM 0 HB2 ALA A 190 22.597 1.814 -3.899 1.00 0.00 H new ATOM 0 HB3 ALA A 190 22.073 0.191 -3.394 1.00 0.00 H new ATOM 38 N SER A 191 20.889 -1.511 -4.878 1.00 0.00 N ATOM 39 CA SER A 191 20.595 -2.907 -5.313 1.00 0.00 C ATOM 40 C SER A 191 19.179 -2.999 -5.893 1.00 0.00 C ATOM 41 O SER A 191 18.937 -3.729 -6.833 1.00 0.00 O ATOM 42 CB SER A 191 20.712 -3.846 -4.113 1.00 0.00 C ATOM 43 OG SER A 191 22.023 -3.753 -3.569 1.00 0.00 O ATOM 0 H SER A 191 21.099 -1.402 -3.886 1.00 0.00 H new ATOM 0 HA SER A 191 21.311 -3.195 -6.083 1.00 0.00 H new ATOM 0 HB2 SER A 191 19.973 -3.582 -3.357 1.00 0.00 H new ATOM 0 HB3 SER A 191 20.504 -4.872 -4.418 1.00 0.00 H new ATOM 0 HG SER A 191 22.101 -4.353 -2.798 1.00 0.00 H new ATOM 49 N CYS A 192 18.241 -2.278 -5.339 1.00 0.00 N ATOM 50 CA CYS A 192 16.844 -2.344 -5.864 1.00 0.00 C ATOM 51 C CYS A 192 16.286 -0.929 -6.058 1.00 0.00 C ATOM 52 O CYS A 192 15.529 -0.440 -5.244 1.00 0.00 O ATOM 53 CB CYS A 192 15.963 -3.103 -4.869 1.00 0.00 C ATOM 54 SG CYS A 192 16.362 -2.575 -3.185 1.00 0.00 S ATOM 0 H CYS A 192 18.380 -1.648 -4.549 1.00 0.00 H new ATOM 0 HA CYS A 192 16.849 -2.861 -6.824 1.00 0.00 H new ATOM 0 HB2 CYS A 192 14.911 -2.914 -5.081 1.00 0.00 H new ATOM 0 HB3 CYS A 192 16.121 -4.177 -4.972 1.00 0.00 H new ATOM 59 N PRO A 193 16.658 -0.276 -7.129 1.00 0.00 N ATOM 60 CA PRO A 193 16.182 1.105 -7.432 1.00 0.00 C ATOM 61 C PRO A 193 14.697 1.146 -7.804 1.00 0.00 C ATOM 62 O PRO A 193 14.083 2.194 -7.826 1.00 0.00 O ATOM 63 CB PRO A 193 17.042 1.545 -8.618 1.00 0.00 C ATOM 64 CG PRO A 193 17.522 0.285 -9.260 1.00 0.00 C ATOM 65 CD PRO A 193 17.563 -0.787 -8.171 1.00 0.00 C ATOM 0 HA PRO A 193 16.276 1.757 -6.563 1.00 0.00 H new ATOM 0 HB2 PRO A 193 16.463 2.146 -9.320 1.00 0.00 H new ATOM 0 HB3 PRO A 193 17.879 2.159 -8.288 1.00 0.00 H new ATOM 0 HG2 PRO A 193 16.855 -0.013 -10.069 1.00 0.00 H new ATOM 0 HG3 PRO A 193 18.510 0.428 -9.697 1.00 0.00 H new ATOM 0 HD2 PRO A 193 17.229 -1.753 -8.550 1.00 0.00 H new ATOM 0 HD3 PRO A 193 18.574 -0.927 -7.787 1.00 0.00 H new ATOM 73 N ASN A 194 14.116 0.015 -8.104 1.00 0.00 N ATOM 74 CA ASN A 194 12.674 -0.006 -8.485 1.00 0.00 C ATOM 75 C ASN A 194 11.803 -0.208 -7.241 1.00 0.00 C ATOM 76 O ASN A 194 10.604 -0.378 -7.335 1.00 0.00 O ATOM 77 CB ASN A 194 12.429 -1.142 -9.477 1.00 0.00 C ATOM 78 CG ASN A 194 13.308 -0.928 -10.710 1.00 0.00 C ATOM 79 OD1 ASN A 194 13.747 -1.878 -11.329 1.00 0.00 O ATOM 80 ND2 ASN A 194 13.591 0.288 -11.091 1.00 0.00 N ATOM 0 H ASN A 194 14.577 -0.895 -8.102 1.00 0.00 H new ATOM 0 HA ASN A 194 12.411 0.946 -8.947 1.00 0.00 H new ATOM 0 HB2 ASN A 194 12.658 -2.102 -9.014 1.00 0.00 H new ATOM 0 HB3 ASN A 194 11.378 -1.170 -9.765 1.00 0.00 H new ATOM 0 HD21 ASN A 194 14.181 0.442 -11.909 1.00 0.00 H new ATOM 0 HD22 ASN A 194 13.222 1.084 -10.571 1.00 0.00 H new ATOM 87 N ASN A 195 12.390 -0.190 -6.076 1.00 0.00 N ATOM 88 CA ASN A 195 11.582 -0.375 -4.838 1.00 0.00 C ATOM 89 C ASN A 195 12.180 0.469 -3.712 1.00 0.00 C ATOM 90 O ASN A 195 13.179 0.112 -3.117 1.00 0.00 O ATOM 91 CB ASN A 195 11.592 -1.853 -4.435 1.00 0.00 C ATOM 92 CG ASN A 195 10.501 -2.108 -3.391 1.00 0.00 C ATOM 93 OD1 ASN A 195 9.906 -1.182 -2.877 1.00 0.00 O ATOM 94 ND2 ASN A 195 10.214 -3.336 -3.052 1.00 0.00 N ATOM 0 H ASN A 195 13.390 -0.056 -5.928 1.00 0.00 H new ATOM 0 HA ASN A 195 10.555 -0.060 -5.022 1.00 0.00 H new ATOM 0 HB2 ASN A 195 11.425 -2.480 -5.311 1.00 0.00 H new ATOM 0 HB3 ASN A 195 12.567 -2.123 -4.030 1.00 0.00 H new ATOM 0 HD21 ASN A 195 9.491 -3.517 -2.356 1.00 0.00 H new ATOM 0 HD22 ASN A 195 10.713 -4.114 -3.483 1.00 0.00 H new ATOM 101 N CYS A 196 11.580 1.589 -3.416 1.00 0.00 N ATOM 102 CA CYS A 196 12.117 2.457 -2.331 1.00 0.00 C ATOM 103 C CYS A 196 10.985 3.307 -1.744 1.00 0.00 C ATOM 104 O CYS A 196 10.683 4.375 -2.238 1.00 0.00 O ATOM 105 CB CYS A 196 13.189 3.383 -2.909 1.00 0.00 C ATOM 106 SG CYS A 196 14.381 2.414 -3.872 1.00 0.00 S ATOM 0 H CYS A 196 10.741 1.940 -3.878 1.00 0.00 H new ATOM 0 HA CYS A 196 12.548 1.832 -1.549 1.00 0.00 H new ATOM 0 HB2 CYS A 196 12.726 4.140 -3.542 1.00 0.00 H new ATOM 0 HB3 CYS A 196 13.701 3.910 -2.104 1.00 0.00 H new ATOM 111 N GLU A 197 10.365 2.853 -0.688 1.00 0.00 N ATOM 112 CA GLU A 197 9.266 3.653 -0.076 1.00 0.00 C ATOM 113 C GLU A 197 9.828 5.008 0.357 1.00 0.00 C ATOM 114 O GLU A 197 9.192 6.035 0.220 1.00 0.00 O ATOM 115 CB GLU A 197 8.713 2.912 1.144 1.00 0.00 C ATOM 116 CG GLU A 197 7.546 3.703 1.739 1.00 0.00 C ATOM 117 CD GLU A 197 6.367 3.683 0.765 1.00 0.00 C ATOM 118 OE1 GLU A 197 5.541 4.578 0.847 1.00 0.00 O ATOM 119 OE2 GLU A 197 6.309 2.774 -0.046 1.00 0.00 O ATOM 0 H GLU A 197 10.571 1.968 -0.225 1.00 0.00 H new ATOM 0 HA GLU A 197 8.463 3.799 -0.799 1.00 0.00 H new ATOM 0 HB2 GLU A 197 8.380 1.915 0.856 1.00 0.00 H new ATOM 0 HB3 GLU A 197 9.497 2.784 1.890 1.00 0.00 H new ATOM 0 HG2 GLU A 197 7.249 3.271 2.695 1.00 0.00 H new ATOM 0 HG3 GLU A 197 7.852 4.731 1.935 1.00 0.00 H new ATOM 127 N ASN A 198 11.025 5.010 0.868 1.00 0.00 N ATOM 128 CA ASN A 198 11.665 6.280 1.308 1.00 0.00 C ATOM 129 C ASN A 198 13.178 6.119 1.191 1.00 0.00 C ATOM 130 O ASN A 198 13.937 6.628 1.993 1.00 0.00 O ATOM 131 CB ASN A 198 11.282 6.572 2.762 1.00 0.00 C ATOM 132 CG ASN A 198 11.951 5.549 3.684 1.00 0.00 C ATOM 133 OD1 ASN A 198 12.397 4.511 3.236 1.00 0.00 O ATOM 134 ND2 ASN A 198 12.038 5.800 4.963 1.00 0.00 N ATOM 0 H ASN A 198 11.595 4.175 1.002 1.00 0.00 H new ATOM 0 HA ASN A 198 11.329 7.109 0.685 1.00 0.00 H new ATOM 0 HB2 ASN A 198 11.592 7.581 3.035 1.00 0.00 H new ATOM 0 HB3 ASN A 198 10.199 6.529 2.879 1.00 0.00 H new ATOM 0 HD21 ASN A 198 12.480 5.125 5.586 1.00 0.00 H new ATOM 0 HD22 ASN A 198 11.664 6.671 5.338 1.00 0.00 H new ATOM 141 N GLY A 199 13.616 5.391 0.201 1.00 0.00 N ATOM 142 CA GLY A 199 15.075 5.158 0.024 1.00 0.00 C ATOM 143 C GLY A 199 15.420 3.791 0.613 1.00 0.00 C ATOM 144 O GLY A 199 16.533 3.319 0.513 1.00 0.00 O ATOM 0 H GLY A 199 13.021 4.945 -0.497 1.00 0.00 H new ATOM 0 HA2 GLY A 199 15.339 5.193 -1.033 1.00 0.00 H new ATOM 0 HA3 GLY A 199 15.647 5.941 0.522 1.00 0.00 H new ATOM 148 N LEU A 200 14.460 3.154 1.226 1.00 0.00 N ATOM 149 CA LEU A 200 14.705 1.815 1.824 1.00 0.00 C ATOM 150 C LEU A 200 14.016 0.746 0.973 1.00 0.00 C ATOM 151 O LEU A 200 12.921 0.940 0.486 1.00 0.00 O ATOM 152 CB LEU A 200 14.131 1.787 3.242 1.00 0.00 C ATOM 153 CG LEU A 200 14.805 2.868 4.090 1.00 0.00 C ATOM 154 CD1 LEU A 200 14.200 2.871 5.497 1.00 0.00 C ATOM 155 CD2 LEU A 200 16.305 2.577 4.186 1.00 0.00 C ATOM 0 H LEU A 200 13.510 3.508 1.338 1.00 0.00 H new ATOM 0 HA LEU A 200 15.776 1.616 1.858 1.00 0.00 H new ATOM 0 HB2 LEU A 200 13.054 1.953 3.213 1.00 0.00 H new ATOM 0 HB3 LEU A 200 14.291 0.806 3.691 1.00 0.00 H new ATOM 0 HG LEU A 200 14.648 3.841 3.625 1.00 0.00 H new ATOM 0 HD11 LEU A 200 14.682 3.642 6.099 1.00 0.00 H new ATOM 0 HD12 LEU A 200 13.131 3.076 5.433 1.00 0.00 H new ATOM 0 HD13 LEU A 200 14.356 1.898 5.962 1.00 0.00 H new ATOM 0 HD21 LEU A 200 16.787 3.346 4.790 1.00 0.00 H new ATOM 0 HD22 LEU A 200 16.458 1.603 4.650 1.00 0.00 H new ATOM 0 HD23 LEU A 200 16.740 2.575 3.187 1.00 0.00 H new ATOM 167 N CYS A 201 14.646 -0.382 0.792 1.00 0.00 N ATOM 168 CA CYS A 201 14.020 -1.457 -0.028 1.00 0.00 C ATOM 169 C CYS A 201 12.946 -2.165 0.798 1.00 0.00 C ATOM 170 O CYS A 201 13.243 -2.900 1.717 1.00 0.00 O ATOM 171 CB CYS A 201 15.087 -2.470 -0.445 1.00 0.00 C ATOM 172 SG CYS A 201 14.725 -3.071 -2.112 1.00 0.00 S ATOM 0 H CYS A 201 15.564 -0.605 1.175 1.00 0.00 H new ATOM 0 HA CYS A 201 13.568 -1.018 -0.917 1.00 0.00 H new ATOM 0 HB2 CYS A 201 16.073 -2.007 -0.420 1.00 0.00 H new ATOM 0 HB3 CYS A 201 15.108 -3.303 0.257 1.00 0.00 H new ATOM 177 N THR A 202 11.701 -1.951 0.474 1.00 0.00 N ATOM 178 CA THR A 202 10.610 -2.614 1.237 1.00 0.00 C ATOM 179 C THR A 202 9.940 -3.660 0.348 1.00 0.00 C ATOM 180 O THR A 202 9.432 -3.354 -0.712 1.00 0.00 O ATOM 181 CB THR A 202 9.577 -1.567 1.661 1.00 0.00 C ATOM 182 OG1 THR A 202 8.731 -1.265 0.559 1.00 0.00 O ATOM 183 CG2 THR A 202 10.294 -0.298 2.119 1.00 0.00 C ATOM 0 H THR A 202 11.393 -1.345 -0.287 1.00 0.00 H new ATOM 0 HA THR A 202 11.022 -3.096 2.124 1.00 0.00 H new ATOM 0 HB THR A 202 8.977 -1.959 2.483 1.00 0.00 H new ATOM 0 HG1 THR A 202 9.046 -1.743 -0.236 1.00 0.00 H new ATOM 0 HG21 THR A 202 9.558 0.447 2.421 1.00 0.00 H new ATOM 0 HG22 THR A 202 10.942 -0.531 2.964 1.00 0.00 H new ATOM 0 HG23 THR A 202 10.895 0.097 1.299 1.00 0.00 H new ATOM 191 N ASN A 203 9.929 -4.891 0.771 1.00 0.00 N ATOM 192 CA ASN A 203 9.283 -5.950 -0.054 1.00 0.00 C ATOM 193 C ASN A 203 7.805 -6.040 0.322 1.00 0.00 C ATOM 194 O ASN A 203 7.070 -6.859 -0.194 1.00 0.00 O ATOM 195 CB ASN A 203 9.962 -7.297 0.210 1.00 0.00 C ATOM 196 CG ASN A 203 11.463 -7.172 -0.052 1.00 0.00 C ATOM 197 OD1 ASN A 203 12.254 -7.891 0.527 1.00 0.00 O ATOM 198 ND2 ASN A 203 11.892 -6.279 -0.902 1.00 0.00 N ATOM 0 H ASN A 203 10.338 -5.211 1.649 1.00 0.00 H new ATOM 0 HA ASN A 203 9.381 -5.703 -1.111 1.00 0.00 H new ATOM 0 HB2 ASN A 203 9.787 -7.609 1.240 1.00 0.00 H new ATOM 0 HB3 ASN A 203 9.533 -8.065 -0.433 1.00 0.00 H new ATOM 0 HD21 ASN A 203 12.892 -6.184 -1.081 1.00 0.00 H new ATOM 0 HD22 ASN A 203 11.228 -5.676 -1.387 1.00 0.00 H new ATOM 205 N SER A 204 7.366 -5.201 1.218 1.00 0.00 N ATOM 206 CA SER A 204 5.937 -5.229 1.632 1.00 0.00 C ATOM 207 C SER A 204 5.093 -4.477 0.602 1.00 0.00 C ATOM 208 O SER A 204 5.587 -3.639 -0.127 1.00 0.00 O ATOM 209 CB SER A 204 5.795 -4.546 2.992 1.00 0.00 C ATOM 210 OG SER A 204 5.850 -3.136 2.817 1.00 0.00 O ATOM 0 H SER A 204 7.938 -4.495 1.682 1.00 0.00 H new ATOM 0 HA SER A 204 5.596 -6.262 1.699 1.00 0.00 H new ATOM 0 HB2 SER A 204 4.851 -4.830 3.458 1.00 0.00 H new ATOM 0 HB3 SER A 204 6.591 -4.872 3.661 1.00 0.00 H new ATOM 0 HG SER A 204 5.758 -2.695 3.687 1.00 0.00 H new ATOM 216 N CYS A 205 3.821 -4.759 0.543 1.00 0.00 N ATOM 217 CA CYS A 205 2.949 -4.051 -0.432 1.00 0.00 C ATOM 218 C CYS A 205 3.460 -4.290 -1.854 1.00 0.00 C ATOM 219 O CYS A 205 4.395 -3.657 -2.303 1.00 0.00 O ATOM 220 CB CYS A 205 2.972 -2.551 -0.129 1.00 0.00 C ATOM 221 SG CYS A 205 1.543 -1.754 -0.902 1.00 0.00 S ATOM 0 H CYS A 205 3.349 -5.449 1.128 1.00 0.00 H new ATOM 0 HA CYS A 205 1.930 -4.430 -0.349 1.00 0.00 H new ATOM 0 HB2 CYS A 205 2.954 -2.387 0.948 1.00 0.00 H new ATOM 0 HB3 CYS A 205 3.895 -2.108 -0.503 1.00 0.00 H new ATOM 226 N ASP A 206 2.849 -5.194 -2.568 1.00 0.00 N ATOM 227 CA ASP A 206 3.292 -5.468 -3.964 1.00 0.00 C ATOM 228 C ASP A 206 3.182 -4.179 -4.782 1.00 0.00 C ATOM 229 O ASP A 206 3.904 -3.973 -5.737 1.00 0.00 O ATOM 230 CB ASP A 206 2.401 -6.548 -4.585 1.00 0.00 C ATOM 231 CG ASP A 206 2.610 -7.872 -3.848 1.00 0.00 C ATOM 232 OD1 ASP A 206 1.800 -8.764 -4.034 1.00 0.00 O ATOM 233 OD2 ASP A 206 3.576 -7.971 -3.110 1.00 0.00 O ATOM 0 H ASP A 206 2.061 -5.756 -2.245 1.00 0.00 H new ATOM 0 HA ASP A 206 4.325 -5.817 -3.961 1.00 0.00 H new ATOM 0 HB2 ASP A 206 1.355 -6.249 -4.526 1.00 0.00 H new ATOM 0 HB3 ASP A 206 2.639 -6.667 -5.642 1.00 0.00 H new ATOM 239 N PHE A 207 2.274 -3.318 -4.416 1.00 0.00 N ATOM 240 CA PHE A 207 2.096 -2.043 -5.167 1.00 0.00 C ATOM 241 C PHE A 207 2.753 -0.891 -4.415 1.00 0.00 C ATOM 242 O PHE A 207 3.159 -1.018 -3.276 1.00 0.00 O ATOM 243 CB PHE A 207 0.609 -1.727 -5.286 1.00 0.00 C ATOM 244 CG PHE A 207 -0.018 -2.495 -6.416 1.00 0.00 C ATOM 245 CD1 PHE A 207 0.450 -2.333 -7.722 1.00 0.00 C ATOM 246 CD2 PHE A 207 -1.087 -3.354 -6.153 1.00 0.00 C ATOM 247 CE1 PHE A 207 -0.150 -3.042 -8.769 1.00 0.00 C ATOM 248 CE2 PHE A 207 -1.689 -4.061 -7.197 1.00 0.00 C ATOM 249 CZ PHE A 207 -1.223 -3.905 -8.507 1.00 0.00 C ATOM 0 H PHE A 207 1.643 -3.443 -3.624 1.00 0.00 H new ATOM 0 HA PHE A 207 2.551 -2.158 -6.151 1.00 0.00 H new ATOM 0 HB2 PHE A 207 0.106 -1.973 -4.351 1.00 0.00 H new ATOM 0 HB3 PHE A 207 0.473 -0.658 -5.449 1.00 0.00 H new ATOM 0 HD1 PHE A 207 1.272 -1.663 -7.923 1.00 0.00 H new ATOM 0 HD2 PHE A 207 -1.449 -3.472 -5.142 1.00 0.00 H new ATOM 0 HE1 PHE A 207 0.214 -2.924 -9.779 1.00 0.00 H new ATOM 0 HE2 PHE A 207 -2.514 -4.728 -6.993 1.00 0.00 H new ATOM 0 HZ PHE A 207 -1.689 -4.449 -9.315 1.00 0.00 H new ATOM 259 N GLU A 208 2.833 0.245 -5.049 1.00 0.00 N ATOM 260 CA GLU A 208 3.427 1.436 -4.390 1.00 0.00 C ATOM 261 C GLU A 208 2.468 2.613 -4.570 1.00 0.00 C ATOM 262 O GLU A 208 1.956 2.847 -5.647 1.00 0.00 O ATOM 263 CB GLU A 208 4.775 1.764 -5.034 1.00 0.00 C ATOM 264 CG GLU A 208 5.723 0.577 -4.858 1.00 0.00 C ATOM 265 CD GLU A 208 7.100 0.938 -5.416 1.00 0.00 C ATOM 266 OE1 GLU A 208 7.202 1.967 -6.065 1.00 0.00 O ATOM 267 OE2 GLU A 208 8.029 0.182 -5.187 1.00 0.00 O ATOM 0 H GLU A 208 2.509 0.398 -6.004 1.00 0.00 H new ATOM 0 HA GLU A 208 3.584 1.239 -3.330 1.00 0.00 H new ATOM 0 HB2 GLU A 208 4.641 1.983 -6.093 1.00 0.00 H new ATOM 0 HB3 GLU A 208 5.202 2.656 -4.576 1.00 0.00 H new ATOM 0 HG2 GLU A 208 5.803 0.315 -3.803 1.00 0.00 H new ATOM 0 HG3 GLU A 208 5.327 -0.298 -5.374 1.00 0.00 H new ATOM 275 N ASP A 209 2.213 3.357 -3.532 1.00 0.00 N ATOM 276 CA ASP A 209 1.281 4.508 -3.667 1.00 0.00 C ATOM 277 C ASP A 209 1.976 5.632 -4.429 1.00 0.00 C ATOM 278 O ASP A 209 2.909 6.241 -3.945 1.00 0.00 O ATOM 279 CB ASP A 209 0.871 5.008 -2.281 1.00 0.00 C ATOM 280 CG ASP A 209 2.042 4.842 -1.312 1.00 0.00 C ATOM 281 OD1 ASP A 209 3.139 4.582 -1.778 1.00 0.00 O ATOM 282 OD2 ASP A 209 1.823 4.976 -0.120 1.00 0.00 O ATOM 0 H ASP A 209 2.607 3.219 -2.601 1.00 0.00 H new ATOM 0 HA ASP A 209 0.391 4.191 -4.211 1.00 0.00 H new ATOM 0 HB2 ASP A 209 0.574 6.056 -2.334 1.00 0.00 H new ATOM 0 HB3 ASP A 209 0.006 4.450 -1.922 1.00 0.00 H new ATOM 288 N LEU A 210 1.526 5.915 -5.618 1.00 0.00 N ATOM 289 CA LEU A 210 2.158 7.003 -6.407 1.00 0.00 C ATOM 290 C LEU A 210 2.045 8.317 -5.627 1.00 0.00 C ATOM 291 O LEU A 210 2.850 9.213 -5.783 1.00 0.00 O ATOM 292 CB LEU A 210 1.450 7.128 -7.759 1.00 0.00 C ATOM 293 CG LEU A 210 1.957 6.041 -8.712 1.00 0.00 C ATOM 294 CD1 LEU A 210 3.408 6.332 -9.100 1.00 0.00 C ATOM 295 CD2 LEU A 210 1.881 4.676 -8.022 1.00 0.00 C ATOM 0 H LEU A 210 0.748 5.440 -6.076 1.00 0.00 H new ATOM 0 HA LEU A 210 3.210 6.777 -6.579 1.00 0.00 H new ATOM 0 HB2 LEU A 210 0.372 7.034 -7.626 1.00 0.00 H new ATOM 0 HB3 LEU A 210 1.634 8.114 -8.186 1.00 0.00 H new ATOM 0 HG LEU A 210 1.336 6.032 -9.608 1.00 0.00 H new ATOM 0 HD11 LEU A 210 3.766 5.557 -9.778 1.00 0.00 H new ATOM 0 HD12 LEU A 210 3.465 7.302 -9.595 1.00 0.00 H new ATOM 0 HD13 LEU A 210 4.029 6.345 -8.204 1.00 0.00 H new ATOM 0 HD21 LEU A 210 2.242 3.904 -8.702 1.00 0.00 H new ATOM 0 HD22 LEU A 210 2.499 4.687 -7.124 1.00 0.00 H new ATOM 0 HD23 LEU A 210 0.848 4.464 -7.748 1.00 0.00 H new ATOM 307 N LEU A 211 1.051 8.436 -4.783 1.00 0.00 N ATOM 308 CA LEU A 211 0.889 9.689 -3.989 1.00 0.00 C ATOM 309 C LEU A 211 1.150 9.403 -2.505 1.00 0.00 C ATOM 310 O LEU A 211 0.811 8.353 -1.997 1.00 0.00 O ATOM 311 CB LEU A 211 -0.535 10.220 -4.160 1.00 0.00 C ATOM 312 CG LEU A 211 -0.838 10.401 -5.647 1.00 0.00 C ATOM 313 CD1 LEU A 211 -2.226 11.023 -5.813 1.00 0.00 C ATOM 314 CD2 LEU A 211 0.213 11.321 -6.274 1.00 0.00 C ATOM 0 H LEU A 211 0.346 7.719 -4.611 1.00 0.00 H new ATOM 0 HA LEU A 211 1.603 10.432 -4.343 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -1.249 9.527 -3.715 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -0.645 11.170 -3.638 1.00 0.00 H new ATOM 0 HG LEU A 211 -0.813 9.431 -6.143 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -2.442 11.152 -6.873 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -2.974 10.367 -5.367 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -2.252 11.993 -5.317 1.00 0.00 H new ATOM 0 HD21 LEU A 211 -0.003 11.450 -7.335 1.00 0.00 H new ATOM 0 HD22 LEU A 211 0.190 12.291 -5.778 1.00 0.00 H new ATOM 0 HD23 LEU A 211 1.202 10.877 -6.156 1.00 0.00 H new ATOM 326 N SER A 212 1.747 10.333 -1.808 1.00 0.00 N ATOM 327 CA SER A 212 2.027 10.121 -0.358 1.00 0.00 C ATOM 328 C SER A 212 0.775 10.450 0.456 1.00 0.00 C ATOM 329 O SER A 212 0.759 10.328 1.665 1.00 0.00 O ATOM 330 CB SER A 212 3.169 11.040 0.078 1.00 0.00 C ATOM 331 OG SER A 212 2.680 12.370 0.202 1.00 0.00 O ATOM 0 H SER A 212 2.053 11.232 -2.181 1.00 0.00 H new ATOM 0 HA SER A 212 2.309 9.081 -0.190 1.00 0.00 H new ATOM 0 HB2 SER A 212 3.581 10.702 1.029 1.00 0.00 H new ATOM 0 HB3 SER A 212 3.979 11.004 -0.651 1.00 0.00 H new ATOM 0 HG SER A 212 3.409 12.962 0.483 1.00 0.00 H new ATOM 337 N ASN A 213 -0.273 10.873 -0.196 1.00 0.00 N ATOM 338 CA ASN A 213 -1.523 11.211 0.538 1.00 0.00 C ATOM 339 C ASN A 213 -2.646 10.271 0.095 1.00 0.00 C ATOM 340 O ASN A 213 -3.812 10.605 0.164 1.00 0.00 O ATOM 341 CB ASN A 213 -1.910 12.658 0.233 1.00 0.00 C ATOM 342 CG ASN A 213 -0.860 13.599 0.825 1.00 0.00 C ATOM 343 OD1 ASN A 213 -0.075 13.199 1.662 1.00 0.00 O ATOM 344 ND2 ASN A 213 -0.811 14.840 0.425 1.00 0.00 N ATOM 0 H ASN A 213 -0.317 10.999 -1.207 1.00 0.00 H new ATOM 0 HA ASN A 213 -1.362 11.096 1.610 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -1.983 12.808 -0.844 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -2.891 12.880 0.652 1.00 0.00 H new ATOM 0 HD21 ASN A 213 -0.114 15.474 0.815 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -1.470 15.176 -0.278 1.00 0.00 H new ATOM 351 N CYS A 214 -2.302 9.100 -0.365 1.00 0.00 N ATOM 352 CA CYS A 214 -3.348 8.141 -0.821 1.00 0.00 C ATOM 353 C CYS A 214 -4.336 7.860 0.308 1.00 0.00 C ATOM 354 O CYS A 214 -5.534 7.866 0.107 1.00 0.00 O ATOM 355 CB CYS A 214 -2.684 6.838 -1.254 1.00 0.00 C ATOM 356 SG CYS A 214 -2.080 7.021 -2.944 1.00 0.00 S ATOM 0 H CYS A 214 -1.342 8.765 -0.445 1.00 0.00 H new ATOM 0 HA CYS A 214 -3.888 8.577 -1.661 1.00 0.00 H new ATOM 0 HB2 CYS A 214 -1.860 6.595 -0.584 1.00 0.00 H new ATOM 0 HB3 CYS A 214 -3.396 6.015 -1.196 1.00 0.00 H new ATOM 361 N GLU A 215 -3.856 7.622 1.495 1.00 0.00 N ATOM 362 CA GLU A 215 -4.797 7.353 2.612 1.00 0.00 C ATOM 363 C GLU A 215 -5.705 8.571 2.772 1.00 0.00 C ATOM 364 O GLU A 215 -6.883 8.451 3.042 1.00 0.00 O ATOM 365 CB GLU A 215 -4.015 7.112 3.906 1.00 0.00 C ATOM 366 CG GLU A 215 -4.963 6.565 4.975 1.00 0.00 C ATOM 367 CD GLU A 215 -5.420 5.160 4.579 1.00 0.00 C ATOM 368 OE1 GLU A 215 -4.698 4.508 3.842 1.00 0.00 O ATOM 369 OE2 GLU A 215 -6.482 4.756 5.022 1.00 0.00 O ATOM 0 H GLU A 215 -2.865 7.602 1.737 1.00 0.00 H new ATOM 0 HA GLU A 215 -5.392 6.465 2.398 1.00 0.00 H new ATOM 0 HB2 GLU A 215 -3.203 6.407 3.728 1.00 0.00 H new ATOM 0 HB3 GLU A 215 -3.560 8.042 4.248 1.00 0.00 H new ATOM 0 HG2 GLU A 215 -4.461 6.537 5.942 1.00 0.00 H new ATOM 0 HG3 GLU A 215 -5.825 7.223 5.083 1.00 0.00 H new ATOM 377 N SER A 216 -5.165 9.746 2.584 1.00 0.00 N ATOM 378 CA SER A 216 -6.001 10.973 2.698 1.00 0.00 C ATOM 379 C SER A 216 -7.092 10.914 1.630 1.00 0.00 C ATOM 380 O SER A 216 -8.248 11.179 1.889 1.00 0.00 O ATOM 381 CB SER A 216 -5.131 12.207 2.474 1.00 0.00 C ATOM 382 OG SER A 216 -5.869 13.372 2.822 1.00 0.00 O ATOM 0 H SER A 216 -4.184 9.907 2.357 1.00 0.00 H new ATOM 0 HA SER A 216 -6.450 11.031 3.690 1.00 0.00 H new ATOM 0 HB2 SER A 216 -4.226 12.142 3.078 1.00 0.00 H new ATOM 0 HB3 SER A 216 -4.816 12.260 1.432 1.00 0.00 H new ATOM 0 HG SER A 216 -5.312 14.166 2.681 1.00 0.00 H new ATOM 388 N LEU A 217 -6.727 10.545 0.430 1.00 0.00 N ATOM 389 CA LEU A 217 -7.738 10.440 -0.658 1.00 0.00 C ATOM 390 C LEU A 217 -8.700 9.307 -0.314 1.00 0.00 C ATOM 391 O LEU A 217 -9.868 9.342 -0.641 1.00 0.00 O ATOM 392 CB LEU A 217 -7.043 10.116 -1.983 1.00 0.00 C ATOM 393 CG LEU A 217 -5.991 11.182 -2.291 1.00 0.00 C ATOM 394 CD1 LEU A 217 -5.386 10.912 -3.670 1.00 0.00 C ATOM 395 CD2 LEU A 217 -6.645 12.564 -2.282 1.00 0.00 C ATOM 0 H LEU A 217 -5.772 10.312 0.158 1.00 0.00 H new ATOM 0 HA LEU A 217 -8.275 11.384 -0.755 1.00 0.00 H new ATOM 0 HB2 LEU A 217 -6.573 9.134 -1.927 1.00 0.00 H new ATOM 0 HB3 LEU A 217 -7.777 10.073 -2.788 1.00 0.00 H new ATOM 0 HG LEU A 217 -5.206 11.149 -1.535 1.00 0.00 H new ATOM 0 HD11 LEU A 217 -4.635 11.670 -3.893 1.00 0.00 H new ATOM 0 HD12 LEU A 217 -4.919 9.927 -3.676 1.00 0.00 H new ATOM 0 HD13 LEU A 217 -6.171 10.946 -4.425 1.00 0.00 H new ATOM 0 HD21 LEU A 217 -5.894 13.323 -2.502 1.00 0.00 H new ATOM 0 HD22 LEU A 217 -7.430 12.600 -3.038 1.00 0.00 H new ATOM 0 HD23 LEU A 217 -7.078 12.755 -1.300 1.00 0.00 H new ATOM 407 N LYS A 218 -8.204 8.296 0.345 1.00 0.00 N ATOM 408 CA LYS A 218 -9.067 7.145 0.719 1.00 0.00 C ATOM 409 C LYS A 218 -10.261 7.645 1.526 1.00 0.00 C ATOM 410 O LYS A 218 -11.400 7.364 1.209 1.00 0.00 O ATOM 411 CB LYS A 218 -8.249 6.179 1.566 1.00 0.00 C ATOM 412 CG LYS A 218 -8.995 4.855 1.679 1.00 0.00 C ATOM 413 CD LYS A 218 -8.026 3.775 2.144 1.00 0.00 C ATOM 414 CE LYS A 218 -8.660 2.403 1.929 1.00 0.00 C ATOM 415 NZ LYS A 218 -8.762 1.690 3.234 1.00 0.00 N ATOM 0 H LYS A 218 -7.231 8.219 0.641 1.00 0.00 H new ATOM 0 HA LYS A 218 -9.427 6.641 -0.178 1.00 0.00 H new ATOM 0 HB2 LYS A 218 -7.270 6.021 1.115 1.00 0.00 H new ATOM 0 HB3 LYS A 218 -8.079 6.600 2.557 1.00 0.00 H new ATOM 0 HG2 LYS A 218 -9.821 4.948 2.384 1.00 0.00 H new ATOM 0 HG3 LYS A 218 -9.427 4.583 0.716 1.00 0.00 H new ATOM 0 HD2 LYS A 218 -7.090 3.847 1.590 1.00 0.00 H new ATOM 0 HD3 LYS A 218 -7.784 3.916 3.198 1.00 0.00 H new ATOM 0 HE2 LYS A 218 -9.649 2.514 1.485 1.00 0.00 H new ATOM 0 HE3 LYS A 218 -8.061 1.820 1.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 218 -9.194 0.756 3.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 218 -7.812 1.572 3.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 218 -9.351 2.244 3.887 1.00 0.00 H new ATOM 429 N THR A 219 -10.011 8.393 2.560 1.00 0.00 N ATOM 430 CA THR A 219 -11.130 8.922 3.384 1.00 0.00 C ATOM 431 C THR A 219 -11.937 9.939 2.567 1.00 0.00 C ATOM 432 O THR A 219 -13.144 10.017 2.675 1.00 0.00 O ATOM 433 CB THR A 219 -10.559 9.592 4.635 1.00 0.00 C ATOM 434 OG1 THR A 219 -9.728 8.665 5.322 1.00 0.00 O ATOM 435 CG2 THR A 219 -11.704 10.031 5.550 1.00 0.00 C ATOM 0 H THR A 219 -9.078 8.662 2.872 1.00 0.00 H new ATOM 0 HA THR A 219 -11.788 8.105 3.679 1.00 0.00 H new ATOM 0 HB THR A 219 -9.974 10.466 4.348 1.00 0.00 H new ATOM 0 HG1 THR A 219 -9.358 9.089 6.124 1.00 0.00 H new ATOM 0 HG21 THR A 219 -11.295 10.508 6.441 1.00 0.00 H new ATOM 0 HG22 THR A 219 -12.343 10.738 5.020 1.00 0.00 H new ATOM 0 HG23 THR A 219 -12.291 9.160 5.842 1.00 0.00 H new ATOM 443 N SER A 220 -11.281 10.720 1.750 1.00 0.00 N ATOM 444 CA SER A 220 -12.010 11.728 0.930 1.00 0.00 C ATOM 445 C SER A 220 -12.673 11.040 -0.265 1.00 0.00 C ATOM 446 O SER A 220 -13.735 11.429 -0.710 1.00 0.00 O ATOM 447 CB SER A 220 -11.021 12.781 0.431 1.00 0.00 C ATOM 448 OG SER A 220 -10.331 13.339 1.543 1.00 0.00 O ATOM 0 H SER A 220 -10.270 10.702 1.616 1.00 0.00 H new ATOM 0 HA SER A 220 -12.778 12.206 1.539 1.00 0.00 H new ATOM 0 HB2 SER A 220 -10.312 12.331 -0.264 1.00 0.00 H new ATOM 0 HB3 SER A 220 -11.549 13.563 -0.115 1.00 0.00 H new ATOM 0 HG SER A 220 -9.595 12.746 1.802 1.00 0.00 H new ATOM 454 N ALA A 221 -12.052 10.019 -0.788 1.00 0.00 N ATOM 455 CA ALA A 221 -12.638 9.304 -1.956 1.00 0.00 C ATOM 456 C ALA A 221 -12.892 7.843 -1.584 1.00 0.00 C ATOM 457 O ALA A 221 -13.979 7.468 -1.190 1.00 0.00 O ATOM 458 CB ALA A 221 -11.663 9.366 -3.135 1.00 0.00 C ATOM 0 H ALA A 221 -11.162 9.648 -0.456 1.00 0.00 H new ATOM 0 HA ALA A 221 -13.579 9.778 -2.236 1.00 0.00 H new ATOM 0 HB1 ALA A 221 -12.092 8.843 -3.990 1.00 0.00 H new ATOM 0 HB2 ALA A 221 -11.480 10.407 -3.401 1.00 0.00 H new ATOM 0 HB3 ALA A 221 -10.722 8.892 -2.854 1.00 0.00 H new ATOM 464 N GLY A 222 -11.892 7.014 -1.705 1.00 0.00 N ATOM 465 CA GLY A 222 -12.068 5.577 -1.358 1.00 0.00 C ATOM 466 C GLY A 222 -11.149 4.728 -2.238 1.00 0.00 C ATOM 467 O GLY A 222 -11.000 4.977 -3.418 1.00 0.00 O ATOM 0 H GLY A 222 -10.960 7.271 -2.030 1.00 0.00 H new ATOM 0 HA2 GLY A 222 -11.835 5.414 -0.306 1.00 0.00 H new ATOM 0 HA3 GLY A 222 -13.107 5.280 -1.504 1.00 0.00 H new ATOM 471 N CYS A 223 -10.531 3.729 -1.675 1.00 0.00 N ATOM 472 CA CYS A 223 -9.620 2.867 -2.477 1.00 0.00 C ATOM 473 C CYS A 223 -10.405 2.205 -3.610 1.00 0.00 C ATOM 474 O CYS A 223 -9.911 2.040 -4.709 1.00 0.00 O ATOM 475 CB CYS A 223 -9.016 1.801 -1.565 1.00 0.00 C ATOM 476 SG CYS A 223 -9.468 0.149 -2.155 1.00 0.00 S ATOM 0 H CYS A 223 -10.618 3.471 -0.692 1.00 0.00 H new ATOM 0 HA CYS A 223 -8.822 3.471 -2.909 1.00 0.00 H new ATOM 0 HB2 CYS A 223 -7.931 1.903 -1.542 1.00 0.00 H new ATOM 0 HB3 CYS A 223 -9.371 1.941 -0.544 1.00 0.00 H new ATOM 481 N LYS A 224 -11.627 1.834 -3.356 1.00 0.00 N ATOM 482 CA LYS A 224 -12.449 1.194 -4.419 1.00 0.00 C ATOM 483 C LYS A 224 -12.585 2.163 -5.595 1.00 0.00 C ATOM 484 O LYS A 224 -12.830 1.766 -6.717 1.00 0.00 O ATOM 485 CB LYS A 224 -13.832 0.856 -3.857 1.00 0.00 C ATOM 486 CG LYS A 224 -13.682 -0.177 -2.736 1.00 0.00 C ATOM 487 CD LYS A 224 -15.063 -0.606 -2.236 1.00 0.00 C ATOM 488 CE LYS A 224 -14.897 -1.545 -1.039 1.00 0.00 C ATOM 489 NZ LYS A 224 -13.712 -2.423 -1.256 1.00 0.00 N ATOM 0 H LYS A 224 -12.094 1.946 -2.456 1.00 0.00 H new ATOM 0 HA LYS A 224 -11.970 0.276 -4.760 1.00 0.00 H new ATOM 0 HB2 LYS A 224 -14.313 1.757 -3.476 1.00 0.00 H new ATOM 0 HB3 LYS A 224 -14.472 0.463 -4.647 1.00 0.00 H new ATOM 0 HG2 LYS A 224 -13.132 -1.045 -3.100 1.00 0.00 H new ATOM 0 HG3 LYS A 224 -13.103 0.246 -1.915 1.00 0.00 H new ATOM 0 HD2 LYS A 224 -15.647 0.269 -1.949 1.00 0.00 H new ATOM 0 HD3 LYS A 224 -15.612 -1.108 -3.033 1.00 0.00 H new ATOM 0 HE2 LYS A 224 -14.771 -0.966 -0.124 1.00 0.00 H new ATOM 0 HE3 LYS A 224 -15.794 -2.151 -0.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 224 -13.742 -3.218 -0.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 224 -13.725 -2.790 -2.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 224 -12.841 -1.875 -1.104 1.00 0.00 H new ATOM 503 N HIS A 225 -12.431 3.435 -5.341 1.00 0.00 N ATOM 504 CA HIS A 225 -12.554 4.440 -6.433 1.00 0.00 C ATOM 505 C HIS A 225 -11.484 4.167 -7.498 1.00 0.00 C ATOM 506 O HIS A 225 -10.388 3.738 -7.197 1.00 0.00 O ATOM 507 CB HIS A 225 -12.360 5.843 -5.848 1.00 0.00 C ATOM 508 CG HIS A 225 -12.732 6.870 -6.875 1.00 0.00 C ATOM 509 ND1 HIS A 225 -12.034 7.005 -8.063 1.00 0.00 N ATOM 510 CD2 HIS A 225 -13.719 7.824 -6.908 1.00 0.00 C ATOM 511 CE1 HIS A 225 -12.603 8.008 -8.757 1.00 0.00 C ATOM 512 NE2 HIS A 225 -13.633 8.537 -8.097 1.00 0.00 N ATOM 0 H HIS A 225 -12.224 3.821 -4.420 1.00 0.00 H new ATOM 0 HA HIS A 225 -13.541 4.372 -6.891 1.00 0.00 H new ATOM 0 HB2 HIS A 225 -12.976 5.965 -4.957 1.00 0.00 H new ATOM 0 HB3 HIS A 225 -11.323 5.980 -5.540 1.00 0.00 H new ATOM 0 HD2 HIS A 225 -14.449 7.994 -6.130 1.00 0.00 H new ATOM 0 HE1 HIS A 225 -12.267 8.342 -9.727 1.00 0.00 H new ATOM 0 HE2 HIS A 225 -14.232 9.304 -8.401 1.00 0.00 H new ATOM 521 N GLU A 226 -11.803 4.396 -8.747 1.00 0.00 N ATOM 522 CA GLU A 226 -10.817 4.130 -9.838 1.00 0.00 C ATOM 523 C GLU A 226 -9.605 5.061 -9.709 1.00 0.00 C ATOM 524 O GLU A 226 -8.482 4.663 -9.952 1.00 0.00 O ATOM 525 CB GLU A 226 -11.490 4.369 -11.192 1.00 0.00 C ATOM 526 CG GLU A 226 -12.636 3.373 -11.381 1.00 0.00 C ATOM 527 CD GLU A 226 -12.081 1.947 -11.384 1.00 0.00 C ATOM 528 OE1 GLU A 226 -12.859 1.031 -11.170 1.00 0.00 O ATOM 529 OE2 GLU A 226 -10.892 1.795 -11.604 1.00 0.00 O ATOM 0 H GLU A 226 -12.705 4.756 -9.058 1.00 0.00 H new ATOM 0 HA GLU A 226 -10.478 3.097 -9.761 1.00 0.00 H new ATOM 0 HB2 GLU A 226 -11.870 5.389 -11.245 1.00 0.00 H new ATOM 0 HB3 GLU A 226 -10.762 4.257 -11.996 1.00 0.00 H new ATOM 0 HG2 GLU A 226 -13.367 3.488 -10.581 1.00 0.00 H new ATOM 0 HG3 GLU A 226 -13.155 3.574 -12.318 1.00 0.00 H new ATOM 537 N LEU A 227 -9.817 6.294 -9.344 1.00 0.00 N ATOM 538 CA LEU A 227 -8.672 7.240 -9.219 1.00 0.00 C ATOM 539 C LEU A 227 -7.583 6.602 -8.356 1.00 0.00 C ATOM 540 O LEU A 227 -6.431 6.557 -8.729 1.00 0.00 O ATOM 541 CB LEU A 227 -9.157 8.533 -8.557 1.00 0.00 C ATOM 542 CG LEU A 227 -8.538 9.743 -9.258 1.00 0.00 C ATOM 543 CD1 LEU A 227 -9.471 10.209 -10.376 1.00 0.00 C ATOM 544 CD2 LEU A 227 -8.360 10.877 -8.246 1.00 0.00 C ATOM 0 H LEU A 227 -10.732 6.688 -9.127 1.00 0.00 H new ATOM 0 HA LEU A 227 -8.269 7.465 -10.206 1.00 0.00 H new ATOM 0 HB2 LEU A 227 -10.244 8.591 -8.606 1.00 0.00 H new ATOM 0 HB3 LEU A 227 -8.885 8.535 -7.501 1.00 0.00 H new ATOM 0 HG LEU A 227 -7.570 9.469 -9.677 1.00 0.00 H new ATOM 0 HD11 LEU A 227 -9.034 11.072 -10.879 1.00 0.00 H new ATOM 0 HD12 LEU A 227 -9.609 9.401 -11.095 1.00 0.00 H new ATOM 0 HD13 LEU A 227 -10.436 10.487 -9.952 1.00 0.00 H new ATOM 0 HD21 LEU A 227 -7.919 11.741 -8.742 1.00 0.00 H new ATOM 0 HD22 LEU A 227 -9.331 11.152 -7.833 1.00 0.00 H new ATOM 0 HD23 LEU A 227 -7.704 10.547 -7.441 1.00 0.00 H new ATOM 556 N LEU A 228 -7.949 6.095 -7.211 1.00 0.00 N ATOM 557 CA LEU A 228 -6.951 5.444 -6.319 1.00 0.00 C ATOM 558 C LEU A 228 -6.441 4.167 -6.979 1.00 0.00 C ATOM 559 O LEU A 228 -5.349 3.706 -6.713 1.00 0.00 O ATOM 560 CB LEU A 228 -7.606 5.107 -4.974 1.00 0.00 C ATOM 561 CG LEU A 228 -7.541 6.330 -4.049 1.00 0.00 C ATOM 562 CD1 LEU A 228 -8.624 7.336 -4.440 1.00 0.00 C ATOM 563 CD2 LEU A 228 -7.762 5.887 -2.601 1.00 0.00 C ATOM 0 H LEU A 228 -8.904 6.104 -6.853 1.00 0.00 H new ATOM 0 HA LEU A 228 -6.115 6.123 -6.149 1.00 0.00 H new ATOM 0 HB2 LEU A 228 -8.643 4.809 -5.128 1.00 0.00 H new ATOM 0 HB3 LEU A 228 -7.097 4.261 -4.512 1.00 0.00 H new ATOM 0 HG LEU A 228 -6.562 6.799 -4.145 1.00 0.00 H new ATOM 0 HD11 LEU A 228 -8.572 8.202 -3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 228 -8.468 7.656 -5.470 1.00 0.00 H new ATOM 0 HD13 LEU A 228 -9.605 6.869 -4.349 1.00 0.00 H new ATOM 0 HD21 LEU A 228 -7.716 6.755 -1.944 1.00 0.00 H new ATOM 0 HD22 LEU A 228 -8.740 5.415 -2.510 1.00 0.00 H new ATOM 0 HD23 LEU A 228 -6.988 5.175 -2.316 1.00 0.00 H new ATOM 575 N LYS A 229 -7.242 3.582 -7.820 1.00 0.00 N ATOM 576 CA LYS A 229 -6.843 2.319 -8.493 1.00 0.00 C ATOM 577 C LYS A 229 -5.708 2.560 -9.496 1.00 0.00 C ATOM 578 O LYS A 229 -5.142 1.624 -10.023 1.00 0.00 O ATOM 579 CB LYS A 229 -8.052 1.742 -9.229 1.00 0.00 C ATOM 580 CG LYS A 229 -7.822 0.255 -9.501 1.00 0.00 C ATOM 581 CD LYS A 229 -7.932 -0.525 -8.189 1.00 0.00 C ATOM 582 CE LYS A 229 -8.967 -1.639 -8.348 1.00 0.00 C ATOM 583 NZ LYS A 229 -8.470 -2.643 -9.332 1.00 0.00 N ATOM 0 H LYS A 229 -8.167 3.929 -8.073 1.00 0.00 H new ATOM 0 HA LYS A 229 -6.488 1.620 -7.735 1.00 0.00 H new ATOM 0 HB2 LYS A 229 -8.954 1.878 -8.632 1.00 0.00 H new ATOM 0 HB3 LYS A 229 -8.208 2.274 -10.167 1.00 0.00 H new ATOM 0 HG2 LYS A 229 -8.556 -0.113 -10.218 1.00 0.00 H new ATOM 0 HG3 LYS A 229 -6.838 0.103 -9.946 1.00 0.00 H new ATOM 0 HD2 LYS A 229 -6.964 -0.948 -7.922 1.00 0.00 H new ATOM 0 HD3 LYS A 229 -8.222 0.144 -7.378 1.00 0.00 H new ATOM 0 HE2 LYS A 229 -9.152 -2.118 -7.386 1.00 0.00 H new ATOM 0 HE3 LYS A 229 -9.916 -1.223 -8.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 229 -8.990 -3.535 -9.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 229 -8.617 -2.285 -10.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 229 -7.455 -2.810 -9.176 1.00 0.00 H new ATOM 597 N THR A 230 -5.380 3.790 -9.796 1.00 0.00 N ATOM 598 CA THR A 230 -4.293 4.023 -10.794 1.00 0.00 C ATOM 599 C THR A 230 -3.031 4.593 -10.124 1.00 0.00 C ATOM 600 O THR A 230 -1.929 4.336 -10.567 1.00 0.00 O ATOM 601 CB THR A 230 -4.805 4.959 -11.898 1.00 0.00 C ATOM 602 OG1 THR A 230 -4.151 4.648 -13.120 1.00 0.00 O ATOM 603 CG2 THR A 230 -4.536 6.417 -11.537 1.00 0.00 C ATOM 0 H THR A 230 -5.808 4.628 -9.403 1.00 0.00 H new ATOM 0 HA THR A 230 -4.014 3.068 -11.239 1.00 0.00 H new ATOM 0 HB THR A 230 -5.881 4.818 -12.004 1.00 0.00 H new ATOM 0 HG1 THR A 230 -4.478 5.243 -13.827 1.00 0.00 H new ATOM 0 HG21 THR A 230 -4.907 7.063 -12.333 1.00 0.00 H new ATOM 0 HG22 THR A 230 -5.045 6.661 -10.605 1.00 0.00 H new ATOM 0 HG23 THR A 230 -3.464 6.570 -11.415 1.00 0.00 H new ATOM 611 N LYS A 231 -3.163 5.347 -9.060 1.00 0.00 N ATOM 612 CA LYS A 231 -1.943 5.897 -8.386 1.00 0.00 C ATOM 613 C LYS A 231 -1.892 5.397 -6.939 1.00 0.00 C ATOM 614 O LYS A 231 -0.839 5.319 -6.337 1.00 0.00 O ATOM 615 CB LYS A 231 -1.958 7.433 -8.402 1.00 0.00 C ATOM 616 CG LYS A 231 -3.389 7.944 -8.496 1.00 0.00 C ATOM 617 CD LYS A 231 -4.161 7.473 -7.272 1.00 0.00 C ATOM 618 CE LYS A 231 -5.195 8.531 -6.884 1.00 0.00 C ATOM 619 NZ LYS A 231 -6.107 8.779 -8.034 1.00 0.00 N ATOM 0 H LYS A 231 -4.052 5.604 -8.632 1.00 0.00 H new ATOM 0 HA LYS A 231 -1.060 5.555 -8.927 1.00 0.00 H new ATOM 0 HB2 LYS A 231 -1.485 7.818 -7.498 1.00 0.00 H new ATOM 0 HB3 LYS A 231 -1.377 7.801 -9.247 1.00 0.00 H new ATOM 0 HG2 LYS A 231 -3.398 9.033 -8.552 1.00 0.00 H new ATOM 0 HG3 LYS A 231 -3.862 7.575 -9.406 1.00 0.00 H new ATOM 0 HD2 LYS A 231 -4.656 6.525 -7.484 1.00 0.00 H new ATOM 0 HD3 LYS A 231 -3.476 7.297 -6.442 1.00 0.00 H new ATOM 0 HE2 LYS A 231 -5.767 8.196 -6.019 1.00 0.00 H new ATOM 0 HE3 LYS A 231 -4.695 9.456 -6.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 231 -5.924 9.725 -8.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 231 -5.941 8.063 -8.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 231 -7.094 8.722 -7.712 1.00 0.00 H new ATOM 633 N CYS A 232 -3.019 5.049 -6.378 1.00 0.00 N ATOM 634 CA CYS A 232 -3.030 4.545 -4.973 1.00 0.00 C ATOM 635 C CYS A 232 -3.264 3.037 -4.982 1.00 0.00 C ATOM 636 O CYS A 232 -3.819 2.474 -4.059 1.00 0.00 O ATOM 637 CB CYS A 232 -4.145 5.224 -4.191 1.00 0.00 C ATOM 638 SG CYS A 232 -3.775 6.987 -4.037 1.00 0.00 S ATOM 0 H CYS A 232 -3.932 5.092 -6.831 1.00 0.00 H new ATOM 0 HA CYS A 232 -2.073 4.768 -4.501 1.00 0.00 H new ATOM 0 HB2 CYS A 232 -5.099 5.083 -4.699 1.00 0.00 H new ATOM 0 HB3 CYS A 232 -4.240 4.773 -3.203 1.00 0.00 H new ATOM 643 N GLN A 233 -2.843 2.388 -6.025 1.00 0.00 N ATOM 644 CA GLN A 233 -3.028 0.916 -6.124 1.00 0.00 C ATOM 645 C GLN A 233 -2.510 0.235 -4.857 1.00 0.00 C ATOM 646 O GLN A 233 -3.001 -0.800 -4.457 1.00 0.00 O ATOM 647 CB GLN A 233 -2.248 0.411 -7.339 1.00 0.00 C ATOM 648 CG GLN A 233 -2.897 0.958 -8.610 1.00 0.00 C ATOM 649 CD GLN A 233 -2.027 0.630 -9.824 1.00 0.00 C ATOM 650 OE1 GLN A 233 -1.006 -0.017 -9.699 1.00 0.00 O ATOM 651 NE2 GLN A 233 -2.389 1.060 -11.003 1.00 0.00 N ATOM 0 H GLN A 233 -2.374 2.817 -6.822 1.00 0.00 H new ATOM 0 HA GLN A 233 -4.087 0.683 -6.234 1.00 0.00 H new ATOM 0 HB2 GLN A 233 -1.208 0.733 -7.279 1.00 0.00 H new ATOM 0 HB3 GLN A 233 -2.244 -0.679 -7.357 1.00 0.00 H new ATOM 0 HG2 GLN A 233 -3.890 0.526 -8.736 1.00 0.00 H new ATOM 0 HG3 GLN A 233 -3.027 2.037 -8.526 1.00 0.00 H new ATOM 0 HE21 GLN A 233 -3.246 1.603 -11.107 1.00 0.00 H new ATOM 0 HE22 GLN A 233 -1.815 0.853 -11.820 1.00 0.00 H new ATOM 660 N ALA A 234 -1.522 0.797 -4.219 1.00 0.00 N ATOM 661 CA ALA A 234 -0.986 0.162 -2.986 1.00 0.00 C ATOM 662 C ALA A 234 -1.946 0.379 -1.821 1.00 0.00 C ATOM 663 O ALA A 234 -2.251 -0.531 -1.081 1.00 0.00 O ATOM 664 CB ALA A 234 0.375 0.768 -2.648 1.00 0.00 C ATOM 0 H ALA A 234 -1.065 1.665 -4.497 1.00 0.00 H new ATOM 0 HA ALA A 234 -0.876 -0.909 -3.159 1.00 0.00 H new ATOM 0 HB1 ALA A 234 0.767 0.302 -1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 234 1.065 0.595 -3.474 1.00 0.00 H new ATOM 0 HB3 ALA A 234 0.265 1.840 -2.485 1.00 0.00 H new ATOM 670 N THR A 235 -2.424 1.576 -1.646 1.00 0.00 N ATOM 671 CA THR A 235 -3.360 1.840 -0.523 1.00 0.00 C ATOM 672 C THR A 235 -4.671 1.085 -0.765 1.00 0.00 C ATOM 673 O THR A 235 -5.416 0.801 0.152 1.00 0.00 O ATOM 674 CB THR A 235 -3.623 3.344 -0.435 1.00 0.00 C ATOM 675 OG1 THR A 235 -2.649 3.947 0.405 1.00 0.00 O ATOM 676 CG2 THR A 235 -5.018 3.599 0.131 1.00 0.00 C ATOM 0 H THR A 235 -2.207 2.383 -2.232 1.00 0.00 H new ATOM 0 HA THR A 235 -2.924 1.497 0.415 1.00 0.00 H new ATOM 0 HB THR A 235 -3.561 3.777 -1.434 1.00 0.00 H new ATOM 0 HG1 THR A 235 -2.905 4.875 0.589 1.00 0.00 H new ATOM 0 HG21 THR A 235 -5.196 4.673 0.190 1.00 0.00 H new ATOM 0 HG22 THR A 235 -5.764 3.143 -0.520 1.00 0.00 H new ATOM 0 HG23 THR A 235 -5.091 3.164 1.128 1.00 0.00 H new ATOM 684 N CYS A 236 -4.964 0.769 -1.996 1.00 0.00 N ATOM 685 CA CYS A 236 -6.231 0.045 -2.303 1.00 0.00 C ATOM 686 C CYS A 236 -5.969 -1.450 -2.507 1.00 0.00 C ATOM 687 O CYS A 236 -6.408 -2.279 -1.735 1.00 0.00 O ATOM 688 CB CYS A 236 -6.829 0.629 -3.585 1.00 0.00 C ATOM 689 SG CYS A 236 -8.463 -0.084 -3.891 1.00 0.00 S ATOM 0 H CYS A 236 -4.380 0.981 -2.805 1.00 0.00 H new ATOM 0 HA CYS A 236 -6.920 0.164 -1.467 1.00 0.00 H new ATOM 0 HB2 CYS A 236 -6.907 1.713 -3.498 1.00 0.00 H new ATOM 0 HB3 CYS A 236 -6.170 0.424 -4.429 1.00 0.00 H new ATOM 694 N LEU A 237 -5.285 -1.797 -3.558 1.00 0.00 N ATOM 695 CA LEU A 237 -5.022 -3.236 -3.845 1.00 0.00 C ATOM 696 C LEU A 237 -4.125 -3.869 -2.774 1.00 0.00 C ATOM 697 O LEU A 237 -4.248 -5.042 -2.483 1.00 0.00 O ATOM 698 CB LEU A 237 -4.361 -3.353 -5.218 1.00 0.00 C ATOM 699 CG LEU A 237 -5.261 -2.691 -6.264 1.00 0.00 C ATOM 700 CD1 LEU A 237 -4.646 -2.861 -7.653 1.00 0.00 C ATOM 701 CD2 LEU A 237 -6.644 -3.348 -6.241 1.00 0.00 C ATOM 0 H LEU A 237 -4.893 -1.143 -4.236 1.00 0.00 H new ATOM 0 HA LEU A 237 -5.971 -3.773 -3.836 1.00 0.00 H new ATOM 0 HB2 LEU A 237 -3.382 -2.874 -5.206 1.00 0.00 H new ATOM 0 HB3 LEU A 237 -4.200 -4.401 -5.470 1.00 0.00 H new ATOM 0 HG LEU A 237 -5.356 -1.630 -6.035 1.00 0.00 H new ATOM 0 HD11 LEU A 237 -5.289 -2.389 -8.396 1.00 0.00 H new ATOM 0 HD12 LEU A 237 -3.662 -2.393 -7.675 1.00 0.00 H new ATOM 0 HD13 LEU A 237 -4.548 -3.923 -7.880 1.00 0.00 H new ATOM 0 HD21 LEU A 237 -7.284 -2.875 -6.986 1.00 0.00 H new ATOM 0 HD22 LEU A 237 -6.546 -4.410 -6.467 1.00 0.00 H new ATOM 0 HD23 LEU A 237 -7.088 -3.227 -5.253 1.00 0.00 H new ATOM 713 N CYS A 238 -3.224 -3.126 -2.187 1.00 0.00 N ATOM 714 CA CYS A 238 -2.340 -3.735 -1.148 1.00 0.00 C ATOM 715 C CYS A 238 -2.664 -3.162 0.233 1.00 0.00 C ATOM 716 O CYS A 238 -2.430 -2.006 0.517 1.00 0.00 O ATOM 717 CB CYS A 238 -0.874 -3.464 -1.489 1.00 0.00 C ATOM 718 SG CYS A 238 -0.050 -2.684 -0.081 1.00 0.00 S ATOM 0 H CYS A 238 -3.062 -2.137 -2.378 1.00 0.00 H new ATOM 0 HA CYS A 238 -2.514 -4.811 -1.130 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -0.372 -4.397 -1.744 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -0.808 -2.817 -2.364 1.00 0.00 H new ATOM 723 N GLU A 239 -3.188 -3.981 1.100 1.00 0.00 N ATOM 724 CA GLU A 239 -3.514 -3.515 2.474 1.00 0.00 C ATOM 725 C GLU A 239 -2.522 -4.162 3.438 1.00 0.00 C ATOM 726 O GLU A 239 -2.864 -4.539 4.542 1.00 0.00 O ATOM 727 CB GLU A 239 -4.938 -3.943 2.835 1.00 0.00 C ATOM 728 CG GLU A 239 -5.933 -3.260 1.895 1.00 0.00 C ATOM 729 CD GLU A 239 -5.864 -1.746 2.094 1.00 0.00 C ATOM 730 OE1 GLU A 239 -6.340 -1.032 1.227 1.00 0.00 O ATOM 731 OE2 GLU A 239 -5.340 -1.326 3.112 1.00 0.00 O ATOM 0 H GLU A 239 -3.406 -4.960 0.914 1.00 0.00 H new ATOM 0 HA GLU A 239 -3.448 -2.429 2.535 1.00 0.00 H new ATOM 0 HB2 GLU A 239 -5.034 -5.026 2.758 1.00 0.00 H new ATOM 0 HB3 GLU A 239 -5.157 -3.677 3.869 1.00 0.00 H new ATOM 0 HG2 GLU A 239 -5.704 -3.512 0.860 1.00 0.00 H new ATOM 0 HG3 GLU A 239 -6.943 -3.618 2.094 1.00 0.00 H new ATOM 739 N ASP A 240 -1.301 -4.326 3.007 1.00 0.00 N ATOM 740 CA ASP A 240 -0.285 -4.985 3.869 1.00 0.00 C ATOM 741 C ASP A 240 -0.824 -6.358 4.261 1.00 0.00 C ATOM 742 O ASP A 240 -0.603 -6.845 5.351 1.00 0.00 O ATOM 743 CB ASP A 240 -0.031 -4.141 5.121 1.00 0.00 C ATOM 744 CG ASP A 240 0.644 -2.829 4.718 1.00 0.00 C ATOM 745 OD1 ASP A 240 1.028 -2.713 3.566 1.00 0.00 O ATOM 746 OD2 ASP A 240 0.767 -1.962 5.567 1.00 0.00 O ATOM 0 H ASP A 240 -0.964 -4.030 2.091 1.00 0.00 H new ATOM 0 HA ASP A 240 0.659 -5.088 3.333 1.00 0.00 H new ATOM 0 HB2 ASP A 240 -0.971 -3.937 5.633 1.00 0.00 H new ATOM 0 HB3 ASP A 240 0.601 -4.688 5.821 1.00 0.00 H new ATOM 752 N LYS A 241 -1.533 -6.984 3.359 1.00 0.00 N ATOM 753 CA LYS A 241 -2.103 -8.329 3.641 1.00 0.00 C ATOM 754 C LYS A 241 -1.818 -9.257 2.462 1.00 0.00 C ATOM 755 O LYS A 241 -1.998 -8.893 1.316 1.00 0.00 O ATOM 756 CB LYS A 241 -3.614 -8.223 3.847 1.00 0.00 C ATOM 757 CG LYS A 241 -4.161 -9.597 4.239 1.00 0.00 C ATOM 758 CD LYS A 241 -5.678 -9.521 4.413 1.00 0.00 C ATOM 759 CE LYS A 241 -6.190 -10.854 4.962 1.00 0.00 C ATOM 760 NZ LYS A 241 -6.541 -10.698 6.403 1.00 0.00 N ATOM 0 H LYS A 241 -1.742 -6.615 2.431 1.00 0.00 H new ATOM 0 HA LYS A 241 -1.645 -8.729 4.546 1.00 0.00 H new ATOM 0 HB2 LYS A 241 -3.838 -7.493 4.625 1.00 0.00 H new ATOM 0 HB3 LYS A 241 -4.095 -7.873 2.934 1.00 0.00 H new ATOM 0 HG2 LYS A 241 -3.910 -10.330 3.473 1.00 0.00 H new ATOM 0 HG3 LYS A 241 -3.696 -9.933 5.166 1.00 0.00 H new ATOM 0 HD2 LYS A 241 -5.938 -8.710 5.094 1.00 0.00 H new ATOM 0 HD3 LYS A 241 -6.155 -9.300 3.458 1.00 0.00 H new ATOM 0 HE2 LYS A 241 -7.063 -11.180 4.397 1.00 0.00 H new ATOM 0 HE3 LYS A 241 -5.428 -11.625 4.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 241 -6.889 -11.604 6.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 241 -5.697 -10.405 6.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 241 -7.282 -9.975 6.504 1.00 0.00 H new ATOM 774 N ILE A 242 -1.378 -10.453 2.728 1.00 0.00 N ATOM 775 CA ILE A 242 -1.084 -11.399 1.616 1.00 0.00 C ATOM 776 C ILE A 242 -2.245 -12.386 1.468 1.00 0.00 C ATOM 777 O ILE A 242 -2.729 -12.937 2.437 1.00 0.00 O ATOM 778 CB ILE A 242 0.197 -12.172 1.931 1.00 0.00 C ATOM 779 CG1 ILE A 242 1.320 -11.192 2.287 1.00 0.00 C ATOM 780 CG2 ILE A 242 0.605 -12.987 0.704 1.00 0.00 C ATOM 781 CD1 ILE A 242 1.416 -10.106 1.213 1.00 0.00 C ATOM 0 H ILE A 242 -1.209 -10.817 3.666 1.00 0.00 H new ATOM 0 HA ILE A 242 -0.956 -10.841 0.688 1.00 0.00 H new ATOM 0 HB ILE A 242 0.021 -12.838 2.776 1.00 0.00 H new ATOM 0 HG12 ILE A 242 1.126 -10.739 3.259 1.00 0.00 H new ATOM 0 HG13 ILE A 242 2.268 -11.724 2.366 1.00 0.00 H new ATOM 0 HG21 ILE A 242 1.518 -13.541 0.922 1.00 0.00 H new ATOM 0 HG22 ILE A 242 -0.192 -13.686 0.450 1.00 0.00 H new ATOM 0 HG23 ILE A 242 0.780 -12.316 -0.137 1.00 0.00 H new ATOM 0 HD11 ILE A 242 2.215 -9.411 1.469 1.00 0.00 H new ATOM 0 HD12 ILE A 242 1.630 -10.566 0.248 1.00 0.00 H new ATOM 0 HD13 ILE A 242 0.471 -9.567 1.156 1.00 0.00 H new ATOM 793 N HIS A 243 -2.695 -12.616 0.264 1.00 0.00 N ATOM 794 CA HIS A 243 -3.825 -13.567 0.059 1.00 0.00 C ATOM 795 C HIS A 243 -3.368 -14.716 -0.844 1.00 0.00 C ATOM 796 O HIS A 243 -2.215 -14.759 -1.268 1.00 0.00 O ATOM 797 CB HIS A 243 -4.995 -12.837 -0.602 1.00 0.00 C ATOM 798 CG HIS A 243 -6.282 -13.269 0.045 1.00 0.00 C ATOM 799 ND1 HIS A 243 -6.891 -12.529 1.050 1.00 0.00 N ATOM 800 CD2 HIS A 243 -7.089 -14.362 -0.155 1.00 0.00 C ATOM 801 CE1 HIS A 243 -8.011 -13.181 1.413 1.00 0.00 C ATOM 802 NE2 HIS A 243 -8.175 -14.302 0.710 1.00 0.00 N ATOM 0 H HIS A 243 -2.329 -12.187 -0.586 1.00 0.00 H new ATOM 0 HA HIS A 243 -4.142 -13.965 1.023 1.00 0.00 H new ATOM 0 HB2 HIS A 243 -4.869 -11.759 -0.502 1.00 0.00 H new ATOM 0 HB3 HIS A 243 -5.020 -13.057 -1.669 1.00 0.00 H new ATOM 0 HD2 HIS A 243 -6.908 -15.147 -0.874 1.00 0.00 H new ATOM 0 HE1 HIS A 243 -8.692 -12.839 2.178 1.00 0.00 H new ATOM 0 HE2 HIS A 243 -8.938 -14.975 0.790 1.00 0.00 H new TER 811 HIS A 243