USER MOD reduce.3.24.130724 H: found=0, std=0, add=816, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 820 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 68 SER OG : rot 180:sc=-0.00122 USER MOD Set 1.2: A 70 ASN : amide:sc= -1.28! C(o=-1.3!,f=-2.3!) USER MOD Set 2.1: A 57 LYS NZ :NH3+ 157:sc= 1.01 (180deg=0) USER MOD Set 2.2: B 181 GLN : amide:sc= 0.878 K(o=1.9,f=-2.4) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0.844 K(o=0.84,f=-0.0062) USER MOD Single : A 29 LYS NZ :NH3+ -172:sc= 2.43 (180deg=2.17) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 162:sc= 1.84 (180deg=1.37) USER MOD Single : A 71 GLN : amide:sc= 1.1 K(o=1.1,f=-5.1!) USER MOD Single : A 73 MET CE :methyl -113:sc= 0 (180deg=-0.122) USER MOD Single : A 78 LYS NZ :NH3+ -157:sc= 2.44 (180deg=1.17) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= 0.0155 X(o=0.015,f=-0.24) USER MOD Single : B 113 SER OG : rot 180:sc= 0 USER MOD Single : B 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 129 LYS NZ :NH3+ -176:sc= 1.24 (180deg=1.17) USER MOD Single : B 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 TYR OH : rot 166:sc= 0 USER MOD Single : B 162 SER OG : rot 160:sc= 0.481 USER MOD Single : B 165 SER OG : rot -60:sc= 0.2 USER MOD Single : B 168 SER OG : rot 180:sc=-0.000809 USER MOD Single : B 169 LYS NZ :NH3+ 151:sc= 1.04 (180deg=0.593) USER MOD Single : B 170 ASN :FLIP amide:sc=-0.00766 F(o=-2.2!,f=-0.0077) USER MOD Single : B 171 GLN : amide:sc= 1.02 K(o=1,f=-4.4!) USER MOD Single : B 173 MET CE :methyl -165:sc= -0.0305 (180deg=-0.147) USER MOD Single : B 178 LYS NZ :NH3+ -179:sc= 1.21 (180deg=1.21) USER MOD Single : B 180 LYS NZ :NH3+ -150:sc= 1.19 (180deg=0.578) USER MOD Single : B 182 GLN : amide:sc= 0.121 K(o=0.12,f=-0.46) USER MOD ----------------------------------------------------------------- ATOM 132 N GLU A 11 -7.772 -8.229 7.375 1.00 0.00 N ATOM 133 CA GLU A 11 -8.084 -7.102 6.480 1.00 0.00 C ATOM 134 C GLU A 11 -7.597 -7.342 5.037 1.00 0.00 C ATOM 135 O GLU A 11 -8.263 -6.951 4.077 1.00 0.00 O ATOM 136 CB GLU A 11 -7.473 -5.808 7.052 1.00 0.00 C ATOM 137 CG GLU A 11 -7.962 -5.432 8.465 1.00 0.00 C ATOM 138 CD GLU A 11 -9.497 -5.388 8.624 1.00 0.00 C ATOM 139 OE1 GLU A 11 -9.994 -5.683 9.740 1.00 0.00 O ATOM 140 OE2 GLU A 11 -10.216 -5.040 7.656 1.00 0.00 O1- ATOM 0 HA GLU A 11 -9.169 -7.007 6.430 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -6.388 -5.914 7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -7.699 -4.985 6.374 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -7.557 -6.150 9.178 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.555 -4.456 8.728 1.00 0.00 H new ATOM 147 N LEU A 12 -6.481 -8.063 4.873 1.00 0.00 N ATOM 148 CA LEU A 12 -5.964 -8.502 3.574 1.00 0.00 C ATOM 149 C LEU A 12 -6.933 -9.484 2.884 1.00 0.00 C ATOM 150 O LEU A 12 -7.209 -9.334 1.694 1.00 0.00 O ATOM 151 CB LEU A 12 -4.574 -9.165 3.741 1.00 0.00 C ATOM 152 CG LEU A 12 -3.369 -8.271 4.090 1.00 0.00 C ATOM 153 CD1 LEU A 12 -3.149 -7.175 3.050 1.00 0.00 C ATOM 154 CD2 LEU A 12 -3.443 -7.625 5.475 1.00 0.00 C ATOM 0 H LEU A 12 -5.901 -8.363 5.657 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.867 -7.619 2.943 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.660 -9.923 4.519 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.342 -9.686 2.812 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.524 -8.960 4.093 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.289 -6.569 3.336 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.965 -7.629 2.076 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -4.036 -6.544 2.994 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.556 -7.013 5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -4.333 -6.998 5.537 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -3.493 -8.403 6.237 1.00 0.00 H new ATOM 166 N SER A 13 -7.485 -10.454 3.629 1.00 0.00 N ATOM 167 CA SER A 13 -8.472 -11.413 3.117 1.00 0.00 C ATOM 168 C SER A 13 -9.780 -10.729 2.693 1.00 0.00 C ATOM 169 O SER A 13 -10.383 -11.101 1.683 1.00 0.00 O ATOM 170 CB SER A 13 -8.747 -12.494 4.176 1.00 0.00 C ATOM 171 OG SER A 13 -9.597 -13.514 3.673 1.00 0.00 O ATOM 0 H SER A 13 -7.256 -10.595 4.613 1.00 0.00 H new ATOM 0 HA SER A 13 -8.052 -11.877 2.225 1.00 0.00 H new ATOM 0 HB2 SER A 13 -7.804 -12.933 4.502 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.206 -12.037 5.053 1.00 0.00 H new ATOM 0 HG SER A 13 -9.750 -14.185 4.370 1.00 0.00 H new ATOM 177 N GLU A 14 -10.204 -9.684 3.407 1.00 0.00 N ATOM 178 CA GLU A 14 -11.351 -8.856 3.006 1.00 0.00 C ATOM 179 C GLU A 14 -11.070 -8.055 1.720 1.00 0.00 C ATOM 180 O GLU A 14 -11.846 -8.158 0.770 1.00 0.00 O ATOM 181 CB GLU A 14 -11.789 -7.960 4.181 1.00 0.00 C ATOM 182 CG GLU A 14 -13.002 -7.087 3.814 1.00 0.00 C ATOM 183 CD GLU A 14 -13.844 -6.702 5.045 1.00 0.00 C ATOM 184 OE1 GLU A 14 -14.394 -7.603 5.721 1.00 0.00 O ATOM 185 OE2 GLU A 14 -13.987 -5.487 5.326 1.00 0.00 O1- ATOM 0 H GLU A 14 -9.765 -9.386 4.278 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.183 -9.516 2.760 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.037 -8.583 5.040 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -10.958 -7.321 4.480 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -12.656 -6.181 3.316 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -13.629 -7.623 3.102 1.00 0.00 H new ATOM 192 N ILE A 15 -9.949 -7.323 1.641 1.00 0.00 N ATOM 193 CA ILE A 15 -9.528 -6.539 0.459 1.00 0.00 C ATOM 194 C ILE A 15 -9.288 -7.407 -0.796 1.00 0.00 C ATOM 195 O ILE A 15 -9.545 -6.947 -1.912 1.00 0.00 O ATOM 196 CB ILE A 15 -8.307 -5.656 0.840 1.00 0.00 C ATOM 197 CG1 ILE A 15 -8.691 -4.526 1.823 1.00 0.00 C ATOM 198 CG2 ILE A 15 -7.601 -5.030 -0.375 1.00 0.00 C ATOM 199 CD1 ILE A 15 -9.695 -3.494 1.291 1.00 0.00 C ATOM 0 H ILE A 15 -9.289 -7.255 2.416 1.00 0.00 H new ATOM 0 HA ILE A 15 -10.349 -5.884 0.169 1.00 0.00 H new ATOM 0 HB ILE A 15 -7.613 -6.344 1.322 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -9.106 -4.978 2.724 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -7.782 -4.002 2.119 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -6.759 -4.427 -0.036 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -7.240 -5.820 -1.033 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -8.304 -4.398 -0.919 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -9.893 -2.748 2.061 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -9.281 -3.004 0.410 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -10.625 -3.995 1.024 1.00 0.00 H new ATOM 211 N GLU A 16 -8.876 -8.670 -0.645 1.00 0.00 N ATOM 212 CA GLU A 16 -8.844 -9.665 -1.738 1.00 0.00 C ATOM 213 C GLU A 16 -10.251 -10.061 -2.251 1.00 0.00 C ATOM 214 O GLU A 16 -10.394 -10.443 -3.417 1.00 0.00 O ATOM 215 CB GLU A 16 -8.124 -10.939 -1.247 1.00 0.00 C ATOM 216 CG GLU A 16 -6.589 -10.838 -1.191 1.00 0.00 C ATOM 217 CD GLU A 16 -5.892 -11.276 -2.497 1.00 0.00 C ATOM 218 OE1 GLU A 16 -6.428 -11.056 -3.609 1.00 0.00 O ATOM 219 OE2 GLU A 16 -4.778 -11.859 -2.441 1.00 0.00 O1- ATOM 0 H GLU A 16 -8.550 -9.041 0.248 1.00 0.00 H new ATOM 0 HA GLU A 16 -8.314 -9.198 -2.568 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -8.493 -11.186 -0.252 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -8.395 -11.767 -1.902 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -6.309 -9.809 -0.967 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.223 -11.454 -0.370 1.00 0.00 H new ATOM 226 N GLY A 17 -11.287 -9.986 -1.403 1.00 0.00 N ATOM 227 CA GLY A 17 -12.651 -10.439 -1.698 1.00 0.00 C ATOM 228 C GLY A 17 -13.612 -9.370 -2.245 1.00 0.00 C ATOM 229 O GLY A 17 -14.407 -9.667 -3.140 1.00 0.00 O ATOM 0 H GLY A 17 -11.194 -9.596 -0.465 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -12.594 -11.253 -2.421 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -13.081 -10.853 -0.786 1.00 0.00 H new ATOM 233 N LEU A 18 -13.560 -8.136 -1.728 1.00 0.00 N ATOM 234 CA LEU A 18 -14.469 -7.037 -2.108 1.00 0.00 C ATOM 235 C LEU A 18 -14.156 -6.406 -3.480 1.00 0.00 C ATOM 236 O LEU A 18 -13.078 -6.601 -4.048 1.00 0.00 O ATOM 237 CB LEU A 18 -14.585 -6.026 -0.945 1.00 0.00 C ATOM 238 CG LEU A 18 -13.319 -5.322 -0.430 1.00 0.00 C ATOM 239 CD1 LEU A 18 -12.680 -4.346 -1.409 1.00 0.00 C ATOM 240 CD2 LEU A 18 -13.682 -4.567 0.853 1.00 0.00 C ATOM 0 H LEU A 18 -12.876 -7.864 -1.022 1.00 0.00 H new ATOM 0 HA LEU A 18 -15.460 -7.462 -2.268 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -15.288 -5.252 -1.253 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -15.036 -6.548 -0.101 1.00 0.00 H new ATOM 0 HG LEU A 18 -12.577 -6.104 -0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -11.795 -3.901 -0.954 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -12.394 -4.877 -2.317 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -13.394 -3.560 -1.658 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -12.798 -4.058 1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -14.458 -3.833 0.636 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -14.049 -5.272 1.599 1.00 0.00 H new ATOM 252 N GLN A 19 -15.140 -5.686 -4.031 1.00 0.00 N ATOM 253 CA GLN A 19 -15.093 -5.113 -5.389 1.00 0.00 C ATOM 254 C GLN A 19 -14.661 -3.634 -5.415 1.00 0.00 C ATOM 255 O GLN A 19 -14.577 -2.972 -4.377 1.00 0.00 O ATOM 256 CB GLN A 19 -16.420 -5.359 -6.124 1.00 0.00 C ATOM 257 CG GLN A 19 -17.596 -4.490 -5.652 1.00 0.00 C ATOM 258 CD GLN A 19 -18.824 -5.352 -5.375 1.00 0.00 C ATOM 259 OE1 GLN A 19 -19.708 -5.546 -6.201 1.00 0.00 O ATOM 260 NE2 GLN A 19 -18.878 -5.948 -4.210 1.00 0.00 N ATOM 0 H GLN A 19 -16.009 -5.479 -3.539 1.00 0.00 H new ATOM 0 HA GLN A 19 -14.308 -5.638 -5.933 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -16.265 -5.186 -7.189 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -16.693 -6.408 -6.007 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -17.315 -3.947 -4.749 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -17.832 -3.745 -6.411 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -18.143 -5.788 -3.521 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -19.655 -6.572 -3.992 1.00 0.00 H new ATOM 269 N ASP A 20 -14.418 -3.081 -6.609 1.00 0.00 N ATOM 270 CA ASP A 20 -13.949 -1.697 -6.784 1.00 0.00 C ATOM 271 C ASP A 20 -14.938 -0.637 -6.246 1.00 0.00 C ATOM 272 O ASP A 20 -14.511 0.424 -5.789 1.00 0.00 O ATOM 273 CB ASP A 20 -13.656 -1.408 -8.270 1.00 0.00 C ATOM 274 CG ASP A 20 -12.601 -2.319 -8.927 1.00 0.00 C ATOM 275 OD1 ASP A 20 -12.590 -2.397 -10.178 1.00 0.00 O ATOM 276 OD2 ASP A 20 -11.780 -2.948 -8.220 1.00 0.00 O1- ATOM 0 H ASP A 20 -14.541 -3.583 -7.488 1.00 0.00 H new ATOM 0 HA ASP A 20 -13.036 -1.617 -6.194 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -14.587 -1.497 -8.830 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -13.326 -0.373 -8.363 1.00 0.00 H new ATOM 281 N ASP A 21 -16.243 -0.921 -6.243 1.00 0.00 N ATOM 282 CA ASP A 21 -17.268 -0.048 -5.647 1.00 0.00 C ATOM 283 C ASP A 21 -17.146 0.041 -4.112 1.00 0.00 C ATOM 284 O ASP A 21 -17.396 1.091 -3.520 1.00 0.00 O ATOM 285 CB ASP A 21 -18.682 -0.534 -6.015 1.00 0.00 C ATOM 286 CG ASP A 21 -19.017 -0.512 -7.519 1.00 0.00 C ATOM 287 OD1 ASP A 21 -19.986 -1.204 -7.921 1.00 0.00 O ATOM 288 OD2 ASP A 21 -18.351 0.204 -8.306 1.00 0.00 O1- ATOM 0 H ASP A 21 -16.626 -1.771 -6.657 1.00 0.00 H new ATOM 0 HA ASP A 21 -17.101 0.947 -6.058 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -18.805 -1.553 -5.647 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -19.409 0.085 -5.489 1.00 0.00 H new ATOM 293 N ASP A 22 -16.716 -1.045 -3.459 1.00 0.00 N ATOM 294 CA ASP A 22 -16.457 -1.084 -2.012 1.00 0.00 C ATOM 295 C ASP A 22 -15.147 -0.356 -1.639 1.00 0.00 C ATOM 296 O ASP A 22 -15.060 0.241 -0.565 1.00 0.00 O ATOM 297 CB ASP A 22 -16.428 -2.543 -1.524 1.00 0.00 C ATOM 298 CG ASP A 22 -17.681 -3.364 -1.873 1.00 0.00 C ATOM 299 OD1 ASP A 22 -18.817 -2.847 -1.750 1.00 0.00 O ATOM 300 OD2 ASP A 22 -17.517 -4.556 -2.235 1.00 0.00 O1- ATOM 0 H ASP A 22 -16.535 -1.934 -3.925 1.00 0.00 H new ATOM 0 HA ASP A 22 -17.269 -0.555 -1.512 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -15.556 -3.037 -1.952 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -16.298 -2.547 -0.442 1.00 0.00 H new ATOM 305 N LEU A 23 -14.151 -0.340 -2.538 1.00 0.00 N ATOM 306 CA LEU A 23 -12.956 0.512 -2.414 1.00 0.00 C ATOM 307 C LEU A 23 -13.316 1.995 -2.571 1.00 0.00 C ATOM 308 O LEU A 23 -12.952 2.810 -1.725 1.00 0.00 O ATOM 309 CB LEU A 23 -11.883 0.112 -3.450 1.00 0.00 C ATOM 310 CG LEU A 23 -11.362 -1.332 -3.337 1.00 0.00 C ATOM 311 CD1 LEU A 23 -10.443 -1.647 -4.518 1.00 0.00 C ATOM 312 CD2 LEU A 23 -10.544 -1.550 -2.067 1.00 0.00 C ATOM 0 H LEU A 23 -14.151 -0.921 -3.377 1.00 0.00 H new ATOM 0 HA LEU A 23 -12.547 0.361 -1.415 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -12.296 0.254 -4.449 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -11.038 0.794 -3.354 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.239 -1.979 -3.322 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.078 -2.670 -4.432 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.997 -1.537 -5.450 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.598 -0.959 -4.515 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.197 -2.583 -2.030 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.685 -0.879 -2.068 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.164 -1.344 -1.195 1.00 0.00 H new ATOM 324 N ALA A 24 -14.079 2.354 -3.611 1.00 0.00 N ATOM 325 CA ALA A 24 -14.525 3.727 -3.857 1.00 0.00 C ATOM 326 C ALA A 24 -15.373 4.293 -2.703 1.00 0.00 C ATOM 327 O ALA A 24 -15.292 5.486 -2.404 1.00 0.00 O ATOM 328 CB ALA A 24 -15.287 3.753 -5.188 1.00 0.00 C ATOM 0 H ALA A 24 -14.407 1.690 -4.312 1.00 0.00 H new ATOM 0 HA ALA A 24 -13.652 4.377 -3.915 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -15.629 4.768 -5.392 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -14.628 3.424 -5.991 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -16.147 3.085 -5.128 1.00 0.00 H new ATOM 334 N ALA A 25 -16.132 3.440 -2.007 1.00 0.00 N ATOM 335 CA ALA A 25 -16.929 3.812 -0.835 1.00 0.00 C ATOM 336 C ALA A 25 -16.097 4.289 0.385 1.00 0.00 C ATOM 337 O ALA A 25 -16.663 4.942 1.268 1.00 0.00 O ATOM 338 CB ALA A 25 -17.825 2.621 -0.466 1.00 0.00 C ATOM 0 H ALA A 25 -16.210 2.452 -2.248 1.00 0.00 H new ATOM 0 HA ALA A 25 -17.527 4.682 -1.108 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -18.428 2.876 0.405 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -18.480 2.385 -1.305 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -17.203 1.755 -0.236 1.00 0.00 H new ATOM 344 N LEU A 26 -14.788 3.996 0.450 1.00 0.00 N ATOM 345 CA LEU A 26 -13.897 4.444 1.540 1.00 0.00 C ATOM 346 C LEU A 26 -12.696 5.298 1.069 1.00 0.00 C ATOM 347 O LEU A 26 -12.211 6.128 1.845 1.00 0.00 O ATOM 348 CB LEU A 26 -13.514 3.238 2.434 1.00 0.00 C ATOM 349 CG LEU A 26 -12.371 2.337 1.911 1.00 0.00 C ATOM 350 CD1 LEU A 26 -11.040 2.674 2.593 1.00 0.00 C ATOM 351 CD2 LEU A 26 -12.654 0.859 2.189 1.00 0.00 C ATOM 0 H LEU A 26 -14.311 3.437 -0.257 1.00 0.00 H new ATOM 0 HA LEU A 26 -14.455 5.147 2.158 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -13.230 3.616 3.416 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -14.401 2.620 2.574 1.00 0.00 H new ATOM 0 HG LEU A 26 -12.309 2.519 0.838 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -10.257 2.023 2.204 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -10.781 3.714 2.392 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -11.134 2.525 3.669 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -11.831 0.253 1.809 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -12.753 0.703 3.263 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -13.579 0.566 1.693 1.00 0.00 H new ATOM 363 N LEU A 27 -12.241 5.154 -0.182 1.00 0.00 N ATOM 364 CA LEU A 27 -11.231 6.035 -0.796 1.00 0.00 C ATOM 365 C LEU A 27 -11.819 7.393 -1.221 1.00 0.00 C ATOM 366 O LEU A 27 -11.141 8.422 -1.119 1.00 0.00 O ATOM 367 CB LEU A 27 -10.592 5.326 -2.006 1.00 0.00 C ATOM 368 CG LEU A 27 -9.340 4.499 -1.673 1.00 0.00 C ATOM 369 CD1 LEU A 27 -9.557 3.395 -0.647 1.00 0.00 C ATOM 370 CD2 LEU A 27 -8.802 3.850 -2.945 1.00 0.00 C ATOM 0 H LEU A 27 -12.565 4.415 -0.806 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.470 6.240 -0.044 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -11.335 4.670 -2.460 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -10.329 6.075 -2.753 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.638 5.210 -1.236 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.619 2.867 -0.477 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.902 3.832 0.290 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -10.305 2.695 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.914 3.264 -2.707 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.564 3.197 -3.371 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.543 4.624 -3.667 1.00 0.00 H new ATOM 382 N GLY A 28 -13.066 7.412 -1.697 1.00 0.00 N ATOM 383 CA GLY A 28 -13.808 8.624 -2.075 1.00 0.00 C ATOM 384 C GLY A 28 -13.090 9.470 -3.128 1.00 0.00 C ATOM 385 O GLY A 28 -12.684 8.970 -4.182 1.00 0.00 O ATOM 0 H GLY A 28 -13.607 6.559 -1.836 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -14.788 8.337 -2.456 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -13.977 9.230 -1.185 1.00 0.00 H new ATOM 389 N LYS A 29 -12.897 10.768 -2.845 1.00 0.00 N ATOM 390 CA LYS A 29 -12.145 11.709 -3.695 1.00 0.00 C ATOM 391 C LYS A 29 -10.661 11.353 -3.890 1.00 0.00 C ATOM 392 O LYS A 29 -10.041 11.863 -4.821 1.00 0.00 O ATOM 393 CB LYS A 29 -12.380 13.165 -3.237 1.00 0.00 C ATOM 394 CG LYS A 29 -12.128 13.517 -1.764 1.00 0.00 C ATOM 395 CD LYS A 29 -10.657 13.629 -1.352 1.00 0.00 C ATOM 396 CE LYS A 29 -10.587 13.966 0.139 1.00 0.00 C ATOM 397 NZ LYS A 29 -9.200 14.195 0.598 1.00 0.00 N1+ ATOM 0 H LYS A 29 -13.267 11.204 -2.000 1.00 0.00 H new ATOM 0 HA LYS A 29 -12.553 11.610 -4.701 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -11.747 13.811 -3.846 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -13.414 13.423 -3.468 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -12.621 14.465 -1.546 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -12.604 12.760 -1.142 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -10.137 12.692 -1.552 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -10.159 14.402 -1.937 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -11.184 14.856 0.336 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -11.028 13.152 0.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.188 14.285 1.634 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.603 13.392 0.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.832 15.069 0.170 1.00 0.00 H new ATOM 411 N GLU A 30 -10.102 10.450 -3.080 1.00 0.00 N ATOM 412 CA GLU A 30 -8.738 9.915 -3.243 1.00 0.00 C ATOM 413 C GLU A 30 -8.658 8.651 -4.131 1.00 0.00 C ATOM 414 O GLU A 30 -7.554 8.186 -4.431 1.00 0.00 O ATOM 415 CB GLU A 30 -8.095 9.662 -1.864 1.00 0.00 C ATOM 416 CG GLU A 30 -6.820 10.497 -1.671 1.00 0.00 C ATOM 417 CD GLU A 30 -7.163 11.958 -1.359 1.00 0.00 C ATOM 418 OE1 GLU A 30 -7.285 12.772 -2.300 1.00 0.00 O ATOM 419 OE2 GLU A 30 -7.333 12.299 -0.163 1.00 0.00 O1- ATOM 0 H GLU A 30 -10.591 10.059 -2.275 1.00 0.00 H new ATOM 0 HA GLU A 30 -8.173 10.680 -3.776 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -8.811 9.904 -1.079 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -7.856 8.603 -1.762 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -6.226 10.078 -0.859 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -6.209 10.448 -2.572 1.00 0.00 H new ATOM 426 N PHE A 31 -9.793 8.092 -4.572 1.00 0.00 N ATOM 427 CA PHE A 31 -9.842 6.941 -5.492 1.00 0.00 C ATOM 428 C PHE A 31 -9.170 7.271 -6.838 1.00 0.00 C ATOM 429 O PHE A 31 -9.236 8.412 -7.302 1.00 0.00 O ATOM 430 CB PHE A 31 -11.303 6.497 -5.663 1.00 0.00 C ATOM 431 CG PHE A 31 -11.505 5.229 -6.470 1.00 0.00 C ATOM 432 CD1 PHE A 31 -11.639 5.308 -7.867 1.00 0.00 C ATOM 433 CD2 PHE A 31 -11.577 3.976 -5.831 1.00 0.00 C ATOM 434 CE1 PHE A 31 -11.809 4.141 -8.629 1.00 0.00 C ATOM 435 CE2 PHE A 31 -11.790 2.810 -6.587 1.00 0.00 C ATOM 436 CZ PHE A 31 -11.894 2.890 -7.986 1.00 0.00 C ATOM 0 H PHE A 31 -10.716 8.429 -4.298 1.00 0.00 H new ATOM 0 HA PHE A 31 -9.276 6.111 -5.068 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -11.740 6.352 -4.675 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -11.857 7.305 -6.141 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -11.611 6.270 -8.356 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -11.468 3.911 -4.758 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -11.874 4.202 -9.705 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -11.874 1.853 -6.093 1.00 0.00 H new ATOM 0 HZ PHE A 31 -12.039 1.992 -8.569 1.00 0.00 H new ATOM 446 N ILE A 32 -8.514 6.292 -7.476 1.00 0.00 N ATOM 447 CA ILE A 32 -7.735 6.515 -8.705 1.00 0.00 C ATOM 448 C ILE A 32 -8.607 7.026 -9.873 1.00 0.00 C ATOM 449 O ILE A 32 -9.727 6.557 -10.082 1.00 0.00 O ATOM 450 CB ILE A 32 -6.912 5.252 -9.069 1.00 0.00 C ATOM 451 CG1 ILE A 32 -5.550 5.605 -9.712 1.00 0.00 C ATOM 452 CG2 ILE A 32 -7.662 4.285 -10.006 1.00 0.00 C ATOM 453 CD1 ILE A 32 -4.529 6.116 -8.686 1.00 0.00 C ATOM 0 H ILE A 32 -8.507 5.323 -7.156 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.024 7.317 -8.508 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.747 4.750 -8.116 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.148 4.723 -10.211 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -5.700 6.365 -10.479 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -7.030 3.423 -10.221 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.581 3.950 -9.524 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -7.907 4.797 -10.937 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.591 6.349 -9.191 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -4.915 7.015 -8.205 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.354 5.348 -7.933 1.00 0.00 H new ATOM 722 N TRP A 56 5.802 -13.290 8.641 1.00 0.00 N ATOM 723 CA TRP A 56 5.012 -12.042 8.648 1.00 0.00 C ATOM 724 C TRP A 56 5.407 -11.065 7.531 1.00 0.00 C ATOM 725 O TRP A 56 4.585 -10.251 7.102 1.00 0.00 O ATOM 726 CB TRP A 56 5.164 -11.358 10.019 1.00 0.00 C ATOM 727 CG TRP A 56 6.535 -10.842 10.366 1.00 0.00 C ATOM 728 CD1 TRP A 56 7.442 -11.488 11.137 1.00 0.00 C ATOM 729 CD2 TRP A 56 7.190 -9.600 9.943 1.00 0.00 C ATOM 730 NE1 TRP A 56 8.613 -10.754 11.194 1.00 0.00 N ATOM 731 CE2 TRP A 56 8.518 -9.583 10.472 1.00 0.00 C ATOM 732 CE3 TRP A 56 6.809 -8.494 9.149 1.00 0.00 C ATOM 733 CZ2 TRP A 56 9.419 -8.541 10.206 1.00 0.00 C ATOM 734 CZ3 TRP A 56 7.710 -7.446 8.875 1.00 0.00 C ATOM 735 CH2 TRP A 56 9.015 -7.469 9.400 1.00 0.00 C ATOM 0 HA TRP A 56 3.973 -12.317 8.463 1.00 0.00 H new ATOM 0 HB2 TRP A 56 4.465 -10.523 10.063 1.00 0.00 H new ATOM 0 HB3 TRP A 56 4.862 -12.068 10.789 1.00 0.00 H new ATOM 0 HD1 TRP A 56 7.276 -12.433 11.632 1.00 0.00 H new ATOM 0 HE1 TRP A 56 9.445 -11.044 11.708 1.00 0.00 H new ATOM 0 HE3 TRP A 56 5.808 -8.452 8.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 10.416 -8.565 10.620 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 7.396 -6.618 8.257 1.00 0.00 H new ATOM 0 HH2 TRP A 56 9.702 -6.664 9.183 1.00 0.00 H new ATOM 746 N LYS A 57 6.664 -11.135 7.067 1.00 0.00 N ATOM 747 CA LYS A 57 7.243 -10.314 5.994 1.00 0.00 C ATOM 748 C LYS A 57 6.955 -10.903 4.613 1.00 0.00 C ATOM 749 O LYS A 57 6.465 -10.204 3.727 1.00 0.00 O ATOM 750 CB LYS A 57 8.751 -10.173 6.261 1.00 0.00 C ATOM 751 CG LYS A 57 9.459 -9.230 5.274 1.00 0.00 C ATOM 752 CD LYS A 57 10.958 -9.071 5.576 1.00 0.00 C ATOM 753 CE LYS A 57 11.176 -8.312 6.890 1.00 0.00 C ATOM 754 NZ LYS A 57 12.613 -8.069 7.157 1.00 0.00 N1+ ATOM 0 H LYS A 57 7.337 -11.799 7.449 1.00 0.00 H new ATOM 0 HA LYS A 57 6.782 -9.327 5.994 1.00 0.00 H new ATOM 0 HB2 LYS A 57 8.900 -9.804 7.276 1.00 0.00 H new ATOM 0 HB3 LYS A 57 9.216 -11.158 6.209 1.00 0.00 H new ATOM 0 HG2 LYS A 57 9.335 -9.612 4.261 1.00 0.00 H new ATOM 0 HG3 LYS A 57 8.980 -8.251 5.306 1.00 0.00 H new ATOM 0 HD2 LYS A 57 11.427 -10.053 5.637 1.00 0.00 H new ATOM 0 HD3 LYS A 57 11.443 -8.537 4.759 1.00 0.00 H new ATOM 0 HE2 LYS A 57 10.648 -7.359 6.851 1.00 0.00 H new ATOM 0 HE3 LYS A 57 10.745 -8.881 7.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 12.714 -7.257 7.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 13.032 -8.913 7.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 13.103 -7.866 6.262 1.00 0.00 H new ATOM 768 N ASP A 58 7.244 -12.193 4.431 1.00 0.00 N ATOM 769 CA ASP A 58 7.181 -12.875 3.127 1.00 0.00 C ATOM 770 C ASP A 58 5.750 -12.982 2.563 1.00 0.00 C ATOM 771 O ASP A 58 5.531 -12.696 1.384 1.00 0.00 O ATOM 772 CB ASP A 58 7.801 -14.283 3.226 1.00 0.00 C ATOM 773 CG ASP A 58 9.307 -14.317 3.562 1.00 0.00 C ATOM 774 OD1 ASP A 58 9.821 -15.424 3.853 1.00 0.00 O ATOM 775 OD2 ASP A 58 9.995 -13.266 3.516 1.00 0.00 O1- ATOM 0 H ASP A 58 7.533 -12.806 5.193 1.00 0.00 H new ATOM 0 HA ASP A 58 7.754 -12.259 2.435 1.00 0.00 H new ATOM 0 HB2 ASP A 58 7.263 -14.847 3.988 1.00 0.00 H new ATOM 0 HB3 ASP A 58 7.645 -14.798 2.278 1.00 0.00 H new ATOM 780 N ASP A 59 4.768 -13.360 3.391 1.00 0.00 N ATOM 781 CA ASP A 59 3.357 -13.420 2.990 1.00 0.00 C ATOM 782 C ASP A 59 2.812 -12.016 2.658 1.00 0.00 C ATOM 783 O ASP A 59 2.207 -11.803 1.610 1.00 0.00 O ATOM 784 CB ASP A 59 2.545 -14.074 4.125 1.00 0.00 C ATOM 785 CG ASP A 59 1.038 -14.237 3.828 1.00 0.00 C ATOM 786 OD1 ASP A 59 0.618 -14.307 2.646 1.00 0.00 O ATOM 787 OD2 ASP A 59 0.259 -14.327 4.805 1.00 0.00 O1- ATOM 0 H ASP A 59 4.930 -13.633 4.360 1.00 0.00 H new ATOM 0 HA ASP A 59 3.265 -14.020 2.085 1.00 0.00 H new ATOM 0 HB2 ASP A 59 2.968 -15.056 4.337 1.00 0.00 H new ATOM 0 HB3 ASP A 59 2.661 -13.475 5.028 1.00 0.00 H new ATOM 792 N TYR A 60 3.089 -11.036 3.523 1.00 0.00 N ATOM 793 CA TYR A 60 2.604 -9.662 3.396 1.00 0.00 C ATOM 794 C TYR A 60 3.169 -8.944 2.159 1.00 0.00 C ATOM 795 O TYR A 60 2.407 -8.394 1.367 1.00 0.00 O ATOM 796 CB TYR A 60 2.942 -8.923 4.692 1.00 0.00 C ATOM 797 CG TYR A 60 2.419 -7.504 4.801 1.00 0.00 C ATOM 798 CD1 TYR A 60 3.301 -6.412 4.662 1.00 0.00 C ATOM 799 CD2 TYR A 60 1.057 -7.278 5.090 1.00 0.00 C ATOM 800 CE1 TYR A 60 2.826 -5.097 4.835 1.00 0.00 C ATOM 801 CE2 TYR A 60 0.577 -5.964 5.258 1.00 0.00 C ATOM 802 CZ TYR A 60 1.464 -4.870 5.133 1.00 0.00 C ATOM 803 OH TYR A 60 1.015 -3.601 5.311 1.00 0.00 O ATOM 0 H TYR A 60 3.670 -11.181 4.349 1.00 0.00 H new ATOM 0 HA TYR A 60 1.525 -9.674 3.244 1.00 0.00 H new ATOM 0 HB2 TYR A 60 2.549 -9.500 5.529 1.00 0.00 H new ATOM 0 HB3 TYR A 60 4.026 -8.899 4.802 1.00 0.00 H new ATOM 0 HD1 TYR A 60 4.340 -6.584 4.423 1.00 0.00 H new ATOM 0 HD2 TYR A 60 0.380 -8.115 5.183 1.00 0.00 H new ATOM 0 HE1 TYR A 60 3.504 -4.262 4.740 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -0.466 -5.793 5.482 1.00 0.00 H new ATOM 0 HH TYR A 60 0.055 -3.618 5.508 1.00 0.00 H new ATOM 813 N LEU A 61 4.486 -8.993 1.938 1.00 0.00 N ATOM 814 CA LEU A 61 5.116 -8.344 0.778 1.00 0.00 C ATOM 815 C LEU A 61 4.638 -8.946 -0.554 1.00 0.00 C ATOM 816 O LEU A 61 4.411 -8.221 -1.525 1.00 0.00 O ATOM 817 CB LEU A 61 6.646 -8.413 0.952 1.00 0.00 C ATOM 818 CG LEU A 61 7.442 -7.626 -0.105 1.00 0.00 C ATOM 819 CD1 LEU A 61 7.173 -6.115 -0.037 1.00 0.00 C ATOM 820 CD2 LEU A 61 8.940 -7.850 0.117 1.00 0.00 C ATOM 0 H LEU A 61 5.142 -9.478 2.550 1.00 0.00 H new ATOM 0 HA LEU A 61 4.814 -7.298 0.736 1.00 0.00 H new ATOM 0 HB2 LEU A 61 6.905 -8.034 1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 61 6.956 -9.457 0.920 1.00 0.00 H new ATOM 0 HG LEU A 61 7.123 -7.990 -1.082 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.758 -5.606 -0.803 1.00 0.00 H new ATOM 0 HD12 LEU A 61 6.113 -5.926 -0.206 1.00 0.00 H new ATOM 0 HD13 LEU A 61 7.457 -5.739 0.946 1.00 0.00 H new ATOM 0 HD21 LEU A 61 9.506 -7.294 -0.630 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.216 -7.504 1.113 1.00 0.00 H new ATOM 0 HD23 LEU A 61 9.166 -8.912 0.027 1.00 0.00 H new ATOM 832 N SER A 62 4.396 -10.263 -0.593 1.00 0.00 N ATOM 833 CA SER A 62 3.800 -10.949 -1.748 1.00 0.00 C ATOM 834 C SER A 62 2.325 -10.555 -1.965 1.00 0.00 C ATOM 835 O SER A 62 1.907 -10.286 -3.093 1.00 0.00 O ATOM 836 CB SER A 62 3.943 -12.466 -1.565 1.00 0.00 C ATOM 837 OG SER A 62 3.491 -13.166 -2.710 1.00 0.00 O ATOM 0 H SER A 62 4.610 -10.889 0.184 1.00 0.00 H new ATOM 0 HA SER A 62 4.337 -10.637 -2.644 1.00 0.00 H new ATOM 0 HB2 SER A 62 4.987 -12.715 -1.372 1.00 0.00 H new ATOM 0 HB3 SER A 62 3.373 -12.785 -0.692 1.00 0.00 H new ATOM 0 HG SER A 62 3.595 -14.130 -2.566 1.00 0.00 H new ATOM 843 N ARG A 63 1.542 -10.425 -0.885 1.00 0.00 N ATOM 844 CA ARG A 63 0.150 -9.948 -0.926 1.00 0.00 C ATOM 845 C ARG A 63 0.050 -8.522 -1.463 1.00 0.00 C ATOM 846 O ARG A 63 -0.738 -8.254 -2.363 1.00 0.00 O ATOM 847 CB ARG A 63 -0.463 -10.053 0.488 1.00 0.00 C ATOM 848 CG ARG A 63 -2.001 -9.971 0.521 1.00 0.00 C ATOM 849 CD ARG A 63 -2.703 -11.160 -0.150 1.00 0.00 C ATOM 850 NE ARG A 63 -2.273 -12.455 0.419 1.00 0.00 N ATOM 851 CZ ARG A 63 -2.653 -13.656 0.030 1.00 0.00 C ATOM 852 NH1 ARG A 63 -3.528 -13.844 -0.921 1.00 0.00 N1+ ATOM 853 NH2 ARG A 63 -2.140 -14.708 0.603 1.00 0.00 N ATOM 0 H ARG A 63 1.862 -10.651 0.057 1.00 0.00 H new ATOM 0 HA ARG A 63 -0.413 -10.579 -1.614 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -0.152 -10.996 0.937 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -0.055 -9.255 1.108 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.329 -9.906 1.558 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -2.316 -9.051 0.029 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -3.782 -11.055 -0.035 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -2.493 -11.147 -1.220 1.00 0.00 H new ATOM 0 HE ARG A 63 -1.612 -12.415 1.195 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.946 -13.043 -1.395 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -3.793 -14.791 -1.190 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -1.450 -14.598 1.346 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -2.428 -15.641 0.308 1.00 0.00 H new ATOM 867 N LEU A 64 0.890 -7.610 -0.977 1.00 0.00 N ATOM 868 CA LEU A 64 0.945 -6.229 -1.467 1.00 0.00 C ATOM 869 C LEU A 64 1.460 -6.136 -2.923 1.00 0.00 C ATOM 870 O LEU A 64 1.046 -5.237 -3.659 1.00 0.00 O ATOM 871 CB LEU A 64 1.775 -5.368 -0.493 1.00 0.00 C ATOM 872 CG LEU A 64 0.962 -4.809 0.696 1.00 0.00 C ATOM 873 CD1 LEU A 64 0.473 -5.830 1.724 1.00 0.00 C ATOM 874 CD2 LEU A 64 1.803 -3.777 1.444 1.00 0.00 C ATOM 0 H LEU A 64 1.555 -7.806 -0.229 1.00 0.00 H new ATOM 0 HA LEU A 64 -0.071 -5.835 -1.497 1.00 0.00 H new ATOM 0 HB2 LEU A 64 2.600 -5.967 -0.107 1.00 0.00 H new ATOM 0 HB3 LEU A 64 2.215 -4.536 -1.043 1.00 0.00 H new ATOM 0 HG LEU A 64 0.068 -4.391 0.233 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -0.084 -5.318 2.509 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -0.175 -6.557 1.235 1.00 0.00 H new ATOM 0 HD13 LEU A 64 1.329 -6.343 2.162 1.00 0.00 H new ATOM 0 HD21 LEU A 64 1.231 -3.381 2.283 1.00 0.00 H new ATOM 0 HD22 LEU A 64 2.713 -4.249 1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 64 2.066 -2.963 0.768 1.00 0.00 H new ATOM 886 N SER A 65 2.295 -7.085 -3.373 1.00 0.00 N ATOM 887 CA SER A 65 2.699 -7.219 -4.780 1.00 0.00 C ATOM 888 C SER A 65 1.541 -7.671 -5.701 1.00 0.00 C ATOM 889 O SER A 65 1.404 -7.140 -6.807 1.00 0.00 O ATOM 890 CB SER A 65 3.912 -8.152 -4.882 1.00 0.00 C ATOM 891 OG SER A 65 4.349 -8.292 -6.225 1.00 0.00 O ATOM 0 H SER A 65 2.713 -7.788 -2.763 1.00 0.00 H new ATOM 0 HA SER A 65 2.983 -6.230 -5.141 1.00 0.00 H new ATOM 0 HB2 SER A 65 4.726 -7.760 -4.272 1.00 0.00 H new ATOM 0 HB3 SER A 65 3.654 -9.131 -4.478 1.00 0.00 H new ATOM 0 HG SER A 65 5.124 -8.891 -6.256 1.00 0.00 H new ATOM 897 N ARG A 66 0.638 -8.564 -5.255 1.00 0.00 N ATOM 898 CA ARG A 66 -0.603 -8.902 -5.995 1.00 0.00 C ATOM 899 C ARG A 66 -1.537 -7.700 -6.184 1.00 0.00 C ATOM 900 O ARG A 66 -2.005 -7.445 -7.294 1.00 0.00 O ATOM 901 CB ARG A 66 -1.397 -9.993 -5.257 1.00 0.00 C ATOM 902 CG ARG A 66 -0.800 -11.400 -5.350 1.00 0.00 C ATOM 903 CD ARG A 66 -1.583 -12.403 -4.475 1.00 0.00 C ATOM 904 NE ARG A 66 -3.057 -12.333 -4.639 1.00 0.00 N ATOM 905 CZ ARG A 66 -3.781 -12.549 -5.718 1.00 0.00 C ATOM 906 NH1 ARG A 66 -3.281 -12.987 -6.838 1.00 0.00 N1+ ATOM 907 NH2 ARG A 66 -5.050 -12.289 -5.720 1.00 0.00 N ATOM 0 H ARG A 66 0.742 -9.072 -4.377 1.00 0.00 H new ATOM 0 HA ARG A 66 -0.272 -9.248 -6.974 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -1.475 -9.716 -4.206 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -2.411 -10.017 -5.657 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.811 -11.734 -6.388 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.243 -11.376 -5.034 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -1.250 -13.413 -4.713 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -1.336 -12.225 -3.428 1.00 0.00 H new ATOM 0 HE ARG A 66 -3.581 -12.083 -3.800 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -2.282 -13.180 -6.910 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -3.888 -13.137 -7.644 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -5.495 -11.914 -4.882 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -5.604 -12.459 -6.559 1.00 0.00 H new ATOM 921 N LEU A 67 -1.840 -7.008 -5.090 1.00 0.00 N ATOM 922 CA LEU A 67 -2.950 -6.055 -4.986 1.00 0.00 C ATOM 923 C LEU A 67 -2.772 -4.778 -5.831 1.00 0.00 C ATOM 924 O LEU A 67 -1.659 -4.314 -6.093 1.00 0.00 O ATOM 925 CB LEU A 67 -3.174 -5.743 -3.488 1.00 0.00 C ATOM 926 CG LEU A 67 -4.234 -6.636 -2.811 1.00 0.00 C ATOM 927 CD1 LEU A 67 -4.087 -8.143 -3.008 1.00 0.00 C ATOM 928 CD2 LEU A 67 -4.217 -6.366 -1.308 1.00 0.00 C ATOM 0 H LEU A 67 -1.307 -7.094 -4.224 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.839 -6.520 -5.413 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.228 -5.856 -2.959 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.474 -4.700 -3.386 1.00 0.00 H new ATOM 0 HG LEU A 67 -5.169 -6.364 -3.301 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.892 -8.659 -2.484 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -4.138 -8.378 -4.071 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -3.127 -8.470 -2.610 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -4.963 -6.992 -0.817 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -3.230 -6.597 -0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -4.447 -5.316 -1.124 1.00 0.00 H new ATOM 940 N SER A 68 -3.900 -4.204 -6.259 1.00 0.00 N ATOM 941 CA SER A 68 -4.004 -2.912 -6.961 1.00 0.00 C ATOM 942 C SER A 68 -3.602 -1.728 -6.065 1.00 0.00 C ATOM 943 O SER A 68 -3.655 -1.828 -4.838 1.00 0.00 O ATOM 944 CB SER A 68 -5.451 -2.742 -7.445 1.00 0.00 C ATOM 945 OG SER A 68 -5.661 -1.493 -8.081 1.00 0.00 O ATOM 0 H SER A 68 -4.810 -4.644 -6.121 1.00 0.00 H new ATOM 0 HA SER A 68 -3.312 -2.916 -7.803 1.00 0.00 H new ATOM 0 HB2 SER A 68 -5.697 -3.546 -8.138 1.00 0.00 H new ATOM 0 HB3 SER A 68 -6.129 -2.834 -6.597 1.00 0.00 H new ATOM 0 HG SER A 68 -6.594 -1.428 -8.374 1.00 0.00 H new ATOM 951 N LYS A 69 -3.258 -0.571 -6.651 1.00 0.00 N ATOM 952 CA LYS A 69 -3.010 0.691 -5.916 1.00 0.00 C ATOM 953 C LYS A 69 -4.214 1.121 -5.058 1.00 0.00 C ATOM 954 O LYS A 69 -4.035 1.617 -3.945 1.00 0.00 O ATOM 955 CB LYS A 69 -2.589 1.771 -6.932 1.00 0.00 C ATOM 956 CG LYS A 69 -2.395 3.137 -6.252 1.00 0.00 C ATOM 957 CD LYS A 69 -1.538 4.084 -7.094 1.00 0.00 C ATOM 958 CE LYS A 69 -1.525 5.472 -6.443 1.00 0.00 C ATOM 959 NZ LYS A 69 -0.594 6.391 -7.144 1.00 0.00 N1+ ATOM 0 H LYS A 69 -3.141 -0.478 -7.660 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.202 0.538 -5.201 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.662 1.471 -7.421 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -3.347 1.855 -7.711 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.368 3.593 -6.072 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.926 2.993 -5.279 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -0.522 3.698 -7.174 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.936 4.149 -8.107 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.531 5.891 -6.457 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -1.231 5.382 -5.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -0.822 7.374 -6.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 0.383 6.179 -6.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.690 6.265 -8.172 1.00 0.00 H new ATOM 973 N ASN A 70 -5.432 0.871 -5.532 1.00 0.00 N ATOM 974 CA ASN A 70 -6.675 1.121 -4.790 1.00 0.00 C ATOM 975 C ASN A 70 -6.808 0.199 -3.556 1.00 0.00 C ATOM 976 O ASN A 70 -7.170 0.644 -2.468 1.00 0.00 O ATOM 977 CB ASN A 70 -7.871 0.957 -5.747 1.00 0.00 C ATOM 978 CG ASN A 70 -7.797 1.857 -6.972 1.00 0.00 C ATOM 979 OD1 ASN A 70 -6.964 1.698 -7.850 1.00 0.00 O ATOM 980 ND2 ASN A 70 -8.672 2.825 -7.090 1.00 0.00 N ATOM 0 H ASN A 70 -5.591 0.481 -6.461 1.00 0.00 H new ATOM 0 HA ASN A 70 -6.656 2.141 -4.406 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -7.926 -0.082 -6.072 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -8.792 1.170 -5.204 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -8.651 3.434 -7.908 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -9.374 2.969 -6.364 1.00 0.00 H new ATOM 987 N GLN A 71 -6.450 -1.084 -3.703 1.00 0.00 N ATOM 988 CA GLN A 71 -6.423 -2.073 -2.620 1.00 0.00 C ATOM 989 C GLN A 71 -5.295 -1.785 -1.608 1.00 0.00 C ATOM 990 O GLN A 71 -5.518 -1.881 -0.402 1.00 0.00 O ATOM 991 CB GLN A 71 -6.263 -3.475 -3.231 1.00 0.00 C ATOM 992 CG GLN A 71 -7.517 -3.949 -3.981 1.00 0.00 C ATOM 993 CD GLN A 71 -7.293 -5.290 -4.680 1.00 0.00 C ATOM 994 OE1 GLN A 71 -6.474 -5.415 -5.578 1.00 0.00 O ATOM 995 NE2 GLN A 71 -7.996 -6.346 -4.319 1.00 0.00 N ATOM 0 H GLN A 71 -6.164 -1.471 -4.602 1.00 0.00 H new ATOM 0 HA GLN A 71 -7.362 -2.015 -2.069 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -5.416 -3.472 -3.917 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -6.030 -4.186 -2.439 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -8.346 -4.040 -3.280 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -7.804 -3.199 -4.718 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -8.686 -6.268 -3.572 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -7.849 -7.240 -4.787 1.00 0.00 H new ATOM 1004 N LEU A 72 -4.114 -1.364 -2.080 1.00 0.00 N ATOM 1005 CA LEU A 72 -2.980 -0.901 -1.263 1.00 0.00 C ATOM 1006 C LEU A 72 -3.341 0.307 -0.390 1.00 0.00 C ATOM 1007 O LEU A 72 -3.003 0.332 0.794 1.00 0.00 O ATOM 1008 CB LEU A 72 -1.796 -0.574 -2.196 1.00 0.00 C ATOM 1009 CG LEU A 72 -1.053 -1.824 -2.705 1.00 0.00 C ATOM 1010 CD1 LEU A 72 -0.262 -1.548 -3.984 1.00 0.00 C ATOM 1011 CD2 LEU A 72 -0.055 -2.310 -1.659 1.00 0.00 C ATOM 0 H LEU A 72 -3.913 -1.335 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.703 -1.700 -0.575 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.163 -0.006 -3.051 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.092 0.067 -1.666 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.820 -2.573 -2.905 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.244 -2.459 -4.303 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.943 -1.217 -4.769 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.478 -0.770 -3.794 1.00 0.00 H new ATOM 0 HD21 LEU A 72 0.462 -3.194 -2.033 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.671 -1.523 -1.456 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.584 -2.561 -0.740 1.00 0.00 H new ATOM 1023 N MET A 73 -4.074 1.276 -0.939 1.00 0.00 N ATOM 1024 CA MET A 73 -4.658 2.367 -0.152 1.00 0.00 C ATOM 1025 C MET A 73 -5.649 1.857 0.903 1.00 0.00 C ATOM 1026 O MET A 73 -5.590 2.297 2.053 1.00 0.00 O ATOM 1027 CB MET A 73 -5.343 3.383 -1.080 1.00 0.00 C ATOM 1028 CG MET A 73 -4.377 4.491 -1.520 1.00 0.00 C ATOM 1029 SD MET A 73 -5.138 5.870 -2.428 1.00 0.00 S ATOM 1030 CE MET A 73 -5.363 5.123 -4.063 1.00 0.00 C ATOM 0 H MET A 73 -4.280 1.329 -1.937 1.00 0.00 H new ATOM 0 HA MET A 73 -3.842 2.856 0.381 1.00 0.00 H new ATOM 0 HB2 MET A 73 -5.732 2.869 -1.959 1.00 0.00 H new ATOM 0 HB3 MET A 73 -6.196 3.827 -0.567 1.00 0.00 H new ATOM 0 HG2 MET A 73 -3.881 4.890 -0.635 1.00 0.00 H new ATOM 0 HG3 MET A 73 -3.603 4.048 -2.147 1.00 0.00 H new ATOM 0 HE1 MET A 73 -4.712 5.619 -4.783 1.00 0.00 H new ATOM 0 HE2 MET A 73 -5.112 4.063 -4.017 1.00 0.00 H new ATOM 0 HE3 MET A 73 -6.401 5.236 -4.375 1.00 0.00 H new ATOM 1040 N ALA A 74 -6.544 0.930 0.554 1.00 0.00 N ATOM 1041 CA ALA A 74 -7.617 0.488 1.443 1.00 0.00 C ATOM 1042 C ALA A 74 -7.129 -0.409 2.600 1.00 0.00 C ATOM 1043 O ALA A 74 -7.545 -0.207 3.741 1.00 0.00 O ATOM 1044 CB ALA A 74 -8.679 -0.203 0.585 1.00 0.00 C ATOM 0 H ALA A 74 -6.544 0.465 -0.354 1.00 0.00 H new ATOM 0 HA ALA A 74 -8.042 1.359 1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -9.495 -0.545 1.222 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.065 0.500 -0.153 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.235 -1.057 0.074 1.00 0.00 H new ATOM 1050 N LEU A 75 -6.224 -1.367 2.353 1.00 0.00 N ATOM 1051 CA LEU A 75 -5.637 -2.213 3.408 1.00 0.00 C ATOM 1052 C LEU A 75 -4.829 -1.393 4.427 1.00 0.00 C ATOM 1053 O LEU A 75 -4.867 -1.683 5.623 1.00 0.00 O ATOM 1054 CB LEU A 75 -4.826 -3.372 2.778 1.00 0.00 C ATOM 1055 CG LEU A 75 -3.419 -3.024 2.235 1.00 0.00 C ATOM 1056 CD1 LEU A 75 -2.310 -3.211 3.274 1.00 0.00 C ATOM 1057 CD2 LEU A 75 -3.069 -3.924 1.056 1.00 0.00 C ATOM 0 H LEU A 75 -5.877 -1.579 1.418 1.00 0.00 H new ATOM 0 HA LEU A 75 -6.449 -2.660 3.981 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -4.717 -4.157 3.527 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -5.412 -3.791 1.960 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.469 -1.974 1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.349 -2.951 2.831 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.502 -2.565 4.131 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.289 -4.251 3.601 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.077 -3.668 0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.078 -4.965 1.378 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.801 -3.784 0.261 1.00 0.00 H new ATOM 1069 N ALA A 76 -4.134 -0.348 3.967 1.00 0.00 N ATOM 1070 CA ALA A 76 -3.354 0.553 4.813 1.00 0.00 C ATOM 1071 C ALA A 76 -4.258 1.423 5.709 1.00 0.00 C ATOM 1072 O ALA A 76 -3.980 1.578 6.898 1.00 0.00 O ATOM 1073 CB ALA A 76 -2.471 1.411 3.905 1.00 0.00 C ATOM 0 H ALA A 76 -4.099 -0.102 2.978 1.00 0.00 H new ATOM 0 HA ALA A 76 -2.731 -0.030 5.491 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.878 2.093 4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -1.806 0.767 3.330 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.099 1.985 3.224 1.00 0.00 H new ATOM 1079 N LEU A 77 -5.372 1.930 5.160 1.00 0.00 N ATOM 1080 CA LEU A 77 -6.413 2.649 5.902 1.00 0.00 C ATOM 1081 C LEU A 77 -7.036 1.744 6.984 1.00 0.00 C ATOM 1082 O LEU A 77 -7.105 2.122 8.156 1.00 0.00 O ATOM 1083 CB LEU A 77 -7.462 3.153 4.880 1.00 0.00 C ATOM 1084 CG LEU A 77 -8.292 4.388 5.262 1.00 0.00 C ATOM 1085 CD1 LEU A 77 -9.190 4.199 6.487 1.00 0.00 C ATOM 1086 CD2 LEU A 77 -7.408 5.617 5.484 1.00 0.00 C ATOM 0 H LEU A 77 -5.577 1.848 4.164 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.990 3.504 6.430 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.943 3.373 3.947 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -8.152 2.334 4.676 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.946 4.541 4.404 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.738 5.121 6.682 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.896 3.390 6.299 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -8.576 3.951 7.353 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -8.031 6.470 5.752 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -6.701 5.416 6.289 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -6.861 5.842 4.569 1.00 0.00 H new ATOM 1098 N LYS A 78 -7.389 0.505 6.612 1.00 0.00 N ATOM 1099 CA LYS A 78 -7.943 -0.512 7.524 1.00 0.00 C ATOM 1100 C LYS A 78 -7.015 -0.869 8.690 1.00 0.00 C ATOM 1101 O LYS A 78 -7.450 -0.769 9.839 1.00 0.00 O ATOM 1102 CB LYS A 78 -8.287 -1.776 6.724 1.00 0.00 C ATOM 1103 CG LYS A 78 -9.634 -1.669 6.007 1.00 0.00 C ATOM 1104 CD LYS A 78 -9.806 -2.868 5.071 1.00 0.00 C ATOM 1105 CE LYS A 78 -11.263 -3.204 4.744 1.00 0.00 C ATOM 1106 NZ LYS A 78 -11.988 -3.674 5.949 1.00 0.00 N1+ ATOM 0 H LYS A 78 -7.297 0.173 5.652 1.00 0.00 H new ATOM 0 HA LYS A 78 -8.838 -0.079 7.972 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -7.503 -1.962 5.990 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -8.304 -2.634 7.396 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -10.445 -1.642 6.735 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -9.684 -0.740 5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -9.273 -2.668 4.141 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -9.337 -3.740 5.526 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -11.760 -2.323 4.338 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -11.297 -3.973 3.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -12.807 -4.246 5.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -11.351 -4.251 6.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.315 -2.854 6.499 1.00 0.00 H new ATOM 1120 N LEU A 79 -5.756 -1.249 8.425 1.00 0.00 N ATOM 1121 CA LEU A 79 -4.827 -1.693 9.477 1.00 0.00 C ATOM 1122 C LEU A 79 -4.469 -0.579 10.477 1.00 0.00 C ATOM 1123 O LEU A 79 -4.222 -0.867 11.651 1.00 0.00 O ATOM 1124 CB LEU A 79 -3.597 -2.388 8.864 1.00 0.00 C ATOM 1125 CG LEU A 79 -2.513 -1.506 8.214 1.00 0.00 C ATOM 1126 CD1 LEU A 79 -1.482 -0.968 9.212 1.00 0.00 C ATOM 1127 CD2 LEU A 79 -1.729 -2.316 7.187 1.00 0.00 C ATOM 0 H LEU A 79 -5.356 -1.258 7.487 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.347 -2.439 10.078 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.121 -2.977 9.648 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.952 -3.090 8.110 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.051 -0.669 7.769 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -0.750 -0.356 8.685 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.986 -0.362 9.965 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -0.975 -1.802 9.697 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.965 -1.685 6.732 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.253 -3.164 7.679 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.407 -2.678 6.414 1.00 0.00 H new ATOM 1139 N LYS A 80 -4.496 0.690 10.033 1.00 0.00 N ATOM 1140 CA LYS A 80 -4.309 1.885 10.872 1.00 0.00 C ATOM 1141 C LYS A 80 -5.555 2.217 11.699 1.00 0.00 C ATOM 1142 O LYS A 80 -5.423 2.641 12.845 1.00 0.00 O ATOM 1143 CB LYS A 80 -3.885 3.059 9.974 1.00 0.00 C ATOM 1144 CG LYS A 80 -3.571 4.370 10.716 1.00 0.00 C ATOM 1145 CD LYS A 80 -2.438 4.224 11.743 1.00 0.00 C ATOM 1146 CE LYS A 80 -2.107 5.590 12.361 1.00 0.00 C ATOM 1147 NZ LYS A 80 -1.013 5.479 13.363 1.00 0.00 N1+ ATOM 0 H LYS A 80 -4.653 0.918 9.051 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.522 1.686 11.599 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.004 2.761 9.406 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.680 3.250 9.253 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -3.298 5.136 9.989 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -4.471 4.718 11.223 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.733 3.524 12.525 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.552 3.809 11.262 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -1.814 6.286 11.575 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.997 6.002 12.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -0.812 6.418 13.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.304 4.833 14.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -0.157 5.108 12.903 1.00 0.00 H new ATOM 1161 N GLN A 81 -6.757 1.995 11.167 1.00 0.00 N ATOM 1162 CA GLN A 81 -8.023 2.254 11.869 1.00 0.00 C ATOM 1163 C GLN A 81 -8.325 1.195 12.948 1.00 0.00 C ATOM 1164 O GLN A 81 -8.795 1.534 14.031 1.00 0.00 O ATOM 1165 CB GLN A 81 -9.136 2.353 10.814 1.00 0.00 C ATOM 1166 CG GLN A 81 -10.530 2.622 11.412 1.00 0.00 C ATOM 1167 CD GLN A 81 -11.544 3.059 10.355 1.00 0.00 C ATOM 1168 OE1 GLN A 81 -12.133 4.132 10.424 1.00 0.00 O ATOM 1169 NE2 GLN A 81 -11.785 2.268 9.328 1.00 0.00 N ATOM 0 H GLN A 81 -6.885 1.626 10.225 1.00 0.00 H new ATOM 0 HA GLN A 81 -7.953 3.195 12.415 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -8.891 3.151 10.113 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -9.168 1.425 10.243 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -10.890 1.720 11.906 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -10.451 3.394 12.177 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -11.306 1.371 9.252 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -12.451 2.553 8.610 1.00 0.00 H new ATOM 1178 N GLN A 82 -8.035 -0.083 12.683 1.00 0.00 N ATOM 1179 CA GLN A 82 -8.287 -1.182 13.629 1.00 0.00 C ATOM 1180 C GLN A 82 -7.282 -1.239 14.797 1.00 0.00 C ATOM 1181 O GLN A 82 -7.645 -1.698 15.881 1.00 0.00 O ATOM 1182 CB GLN A 82 -8.394 -2.517 12.865 1.00 0.00 C ATOM 1183 CG GLN A 82 -7.090 -3.005 12.211 1.00 0.00 C ATOM 1184 CD GLN A 82 -6.196 -3.839 13.131 1.00 0.00 C ATOM 1185 OE1 GLN A 82 -6.616 -4.801 13.763 1.00 0.00 O ATOM 1186 NE2 GLN A 82 -4.927 -3.511 13.237 1.00 0.00 N ATOM 0 H GLN A 82 -7.617 -0.388 11.804 1.00 0.00 H new ATOM 0 HA GLN A 82 -9.244 -0.984 14.112 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -8.745 -3.285 13.555 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -9.154 -2.414 12.090 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -7.339 -3.598 11.331 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -6.526 -2.140 11.863 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -4.561 -2.713 12.718 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -4.308 -4.055 13.839 1.00 0.00 H new ATOM 1403 N GLU B 111 9.407 7.401 7.689 1.00 0.00 N ATOM 1404 CA GLU B 111 9.521 6.496 6.534 1.00 0.00 C ATOM 1405 C GLU B 111 8.837 7.047 5.268 1.00 0.00 C ATOM 1406 O GLU B 111 9.359 6.850 4.173 1.00 0.00 O ATOM 1407 CB GLU B 111 9.034 5.075 6.884 1.00 0.00 C ATOM 1408 CG GLU B 111 7.582 4.908 7.369 1.00 0.00 C ATOM 1409 CD GLU B 111 7.420 5.234 8.869 1.00 0.00 C ATOM 1410 OE1 GLU B 111 7.498 4.304 9.706 1.00 0.00 O ATOM 1411 OE2 GLU B 111 7.220 6.427 9.214 1.00 0.00 O1- ATOM 0 HA GLU B 111 10.582 6.431 6.293 1.00 0.00 H new ATOM 0 HB2 GLU B 111 9.165 4.450 6.001 1.00 0.00 H new ATOM 0 HB3 GLU B 111 9.692 4.677 7.657 1.00 0.00 H new ATOM 0 HG2 GLU B 111 6.930 5.559 6.786 1.00 0.00 H new ATOM 0 HG3 GLU B 111 7.256 3.884 7.186 1.00 0.00 H new ATOM 1418 N LEU B 112 7.728 7.788 5.386 1.00 0.00 N ATOM 1419 CA LEU B 112 7.027 8.390 4.239 1.00 0.00 C ATOM 1420 C LEU B 112 7.935 9.372 3.476 1.00 0.00 C ATOM 1421 O LEU B 112 8.098 9.254 2.261 1.00 0.00 O ATOM 1422 CB LEU B 112 5.728 9.083 4.705 1.00 0.00 C ATOM 1423 CG LEU B 112 4.453 8.215 4.767 1.00 0.00 C ATOM 1424 CD1 LEU B 112 4.001 7.776 3.374 1.00 0.00 C ATOM 1425 CD2 LEU B 112 4.589 6.975 5.646 1.00 0.00 C ATOM 0 H LEU B 112 7.287 7.989 6.284 1.00 0.00 H new ATOM 0 HA LEU B 112 6.762 7.590 3.548 1.00 0.00 H new ATOM 0 HB2 LEU B 112 5.903 9.499 5.697 1.00 0.00 H new ATOM 0 HB3 LEU B 112 5.534 9.923 4.037 1.00 0.00 H new ATOM 0 HG LEU B 112 3.704 8.865 5.221 1.00 0.00 H new ATOM 0 HD11 LEU B 112 3.101 7.167 3.459 1.00 0.00 H new ATOM 0 HD12 LEU B 112 3.788 8.656 2.767 1.00 0.00 H new ATOM 0 HD13 LEU B 112 4.791 7.192 2.902 1.00 0.00 H new ATOM 0 HD21 LEU B 112 3.652 6.418 5.637 1.00 0.00 H new ATOM 0 HD22 LEU B 112 5.390 6.343 5.262 1.00 0.00 H new ATOM 0 HD23 LEU B 112 4.823 7.277 6.667 1.00 0.00 H new ATOM 1437 N SER B 113 8.569 10.304 4.193 1.00 0.00 N ATOM 1438 CA SER B 113 9.503 11.281 3.618 1.00 0.00 C ATOM 1439 C SER B 113 10.779 10.621 3.073 1.00 0.00 C ATOM 1440 O SER B 113 11.334 11.094 2.081 1.00 0.00 O ATOM 1441 CB SER B 113 9.870 12.336 4.671 1.00 0.00 C ATOM 1442 OG SER B 113 8.704 12.957 5.195 1.00 0.00 O ATOM 0 H SER B 113 8.448 10.404 5.201 1.00 0.00 H new ATOM 0 HA SER B 113 8.998 11.755 2.777 1.00 0.00 H new ATOM 0 HB2 SER B 113 10.432 11.868 5.479 1.00 0.00 H new ATOM 0 HB3 SER B 113 10.519 13.090 4.225 1.00 0.00 H new ATOM 0 HG SER B 113 8.962 13.624 5.865 1.00 0.00 H new ATOM 1448 N GLU B 114 11.238 9.519 3.676 1.00 0.00 N ATOM 1449 CA GLU B 114 12.378 8.736 3.177 1.00 0.00 C ATOM 1450 C GLU B 114 12.068 8.024 1.850 1.00 0.00 C ATOM 1451 O GLU B 114 12.842 8.146 0.900 1.00 0.00 O ATOM 1452 CB GLU B 114 12.848 7.761 4.267 1.00 0.00 C ATOM 1453 CG GLU B 114 14.048 6.916 3.818 1.00 0.00 C ATOM 1454 CD GLU B 114 14.692 6.191 5.014 1.00 0.00 C ATOM 1455 OE1 GLU B 114 15.793 6.595 5.462 1.00 0.00 O ATOM 1456 OE2 GLU B 114 14.114 5.182 5.485 1.00 0.00 O1- ATOM 0 H GLU B 114 10.827 9.141 4.530 1.00 0.00 H new ATOM 0 HA GLU B 114 13.194 9.423 2.951 1.00 0.00 H new ATOM 0 HB2 GLU B 114 13.117 8.323 5.162 1.00 0.00 H new ATOM 0 HB3 GLU B 114 12.024 7.101 4.540 1.00 0.00 H new ATOM 0 HG2 GLU B 114 13.725 6.185 3.076 1.00 0.00 H new ATOM 0 HG3 GLU B 114 14.787 7.555 3.335 1.00 0.00 H new ATOM 1463 N ILE B 115 10.915 7.347 1.741 1.00 0.00 N ATOM 1464 CA ILE B 115 10.440 6.665 0.521 1.00 0.00 C ATOM 1465 C ILE B 115 10.206 7.639 -0.649 1.00 0.00 C ATOM 1466 O ILE B 115 10.434 7.282 -1.805 1.00 0.00 O ATOM 1467 CB ILE B 115 9.192 5.803 0.855 1.00 0.00 C ATOM 1468 CG1 ILE B 115 9.520 4.597 1.770 1.00 0.00 C ATOM 1469 CG2 ILE B 115 8.467 5.287 -0.398 1.00 0.00 C ATOM 1470 CD1 ILE B 115 10.601 3.642 1.252 1.00 0.00 C ATOM 0 H ILE B 115 10.265 7.254 2.522 1.00 0.00 H new ATOM 0 HA ILE B 115 11.226 5.996 0.171 1.00 0.00 H new ATOM 0 HB ILE B 115 8.530 6.484 1.390 1.00 0.00 H new ATOM 0 HG12 ILE B 115 9.833 4.977 2.742 1.00 0.00 H new ATOM 0 HG13 ILE B 115 8.605 4.027 1.930 1.00 0.00 H new ATOM 0 HG21 ILE B 115 7.604 4.692 -0.100 1.00 0.00 H new ATOM 0 HG22 ILE B 115 8.134 6.133 -1.000 1.00 0.00 H new ATOM 0 HG23 ILE B 115 9.148 4.670 -0.984 1.00 0.00 H new ATOM 0 HD11 ILE B 115 10.749 2.836 1.971 1.00 0.00 H new ATOM 0 HD12 ILE B 115 10.288 3.222 0.296 1.00 0.00 H new ATOM 0 HD13 ILE B 115 11.536 4.187 1.120 1.00 0.00 H new ATOM 1482 N GLU B 116 9.817 8.889 -0.379 1.00 0.00 N ATOM 1483 CA GLU B 116 9.743 9.959 -1.390 1.00 0.00 C ATOM 1484 C GLU B 116 11.121 10.525 -1.807 1.00 0.00 C ATOM 1485 O GLU B 116 11.251 11.081 -2.901 1.00 0.00 O ATOM 1486 CB GLU B 116 8.838 11.101 -0.895 1.00 0.00 C ATOM 1487 CG GLU B 116 7.359 10.705 -0.925 1.00 0.00 C ATOM 1488 CD GLU B 116 6.410 11.888 -0.649 1.00 0.00 C ATOM 1489 OE1 GLU B 116 6.595 12.997 -1.211 1.00 0.00 O ATOM 1490 OE2 GLU B 116 5.393 11.713 0.061 1.00 0.00 O1- ATOM 0 H GLU B 116 9.541 9.194 0.555 1.00 0.00 H new ATOM 0 HA GLU B 116 9.317 9.498 -2.281 1.00 0.00 H new ATOM 0 HB2 GLU B 116 9.121 11.375 0.121 1.00 0.00 H new ATOM 0 HB3 GLU B 116 8.991 11.983 -1.517 1.00 0.00 H new ATOM 0 HG2 GLU B 116 7.123 10.278 -1.900 1.00 0.00 H new ATOM 0 HG3 GLU B 116 7.183 9.925 -0.184 1.00 0.00 H new ATOM 1497 N GLY B 117 12.148 10.396 -0.958 1.00 0.00 N ATOM 1498 CA GLY B 117 13.497 10.936 -1.192 1.00 0.00 C ATOM 1499 C GLY B 117 14.429 10.043 -2.030 1.00 0.00 C ATOM 1500 O GLY B 117 15.411 10.539 -2.591 1.00 0.00 O ATOM 0 H GLY B 117 12.064 9.903 -0.069 1.00 0.00 H new ATOM 0 HA2 GLY B 117 13.402 11.901 -1.690 1.00 0.00 H new ATOM 0 HA3 GLY B 117 13.969 11.120 -0.227 1.00 0.00 H new ATOM 1504 N LEU B 118 14.127 8.741 -2.131 1.00 0.00 N ATOM 1505 CA LEU B 118 14.908 7.714 -2.845 1.00 0.00 C ATOM 1506 C LEU B 118 14.315 7.332 -4.223 1.00 0.00 C ATOM 1507 O LEU B 118 13.273 7.857 -4.628 1.00 0.00 O ATOM 1508 CB LEU B 118 15.145 6.525 -1.895 1.00 0.00 C ATOM 1509 CG LEU B 118 13.904 5.815 -1.326 1.00 0.00 C ATOM 1510 CD1 LEU B 118 13.149 4.935 -2.320 1.00 0.00 C ATOM 1511 CD2 LEU B 118 14.332 4.935 -0.149 1.00 0.00 C ATOM 0 H LEU B 118 13.290 8.353 -1.696 1.00 0.00 H new ATOM 0 HA LEU B 118 15.880 8.127 -3.115 1.00 0.00 H new ATOM 0 HB2 LEU B 118 15.743 5.784 -2.425 1.00 0.00 H new ATOM 0 HB3 LEU B 118 15.745 6.878 -1.056 1.00 0.00 H new ATOM 0 HG LEU B 118 13.220 6.612 -1.035 1.00 0.00 H new ATOM 0 HD11 LEU B 118 12.292 4.479 -1.824 1.00 0.00 H new ATOM 0 HD12 LEU B 118 12.803 5.544 -3.155 1.00 0.00 H new ATOM 0 HD13 LEU B 118 13.812 4.153 -2.691 1.00 0.00 H new ATOM 0 HD21 LEU B 118 13.459 4.427 0.262 1.00 0.00 H new ATOM 0 HD22 LEU B 118 15.055 4.195 -0.492 1.00 0.00 H new ATOM 0 HD23 LEU B 118 14.787 5.556 0.623 1.00 0.00 H new ATOM 1523 N GLN B 119 14.990 6.430 -4.950 1.00 0.00 N ATOM 1524 CA GLN B 119 14.616 5.984 -6.306 1.00 0.00 C ATOM 1525 C GLN B 119 14.391 4.464 -6.414 1.00 0.00 C ATOM 1526 O GLN B 119 14.603 3.711 -5.459 1.00 0.00 O ATOM 1527 CB GLN B 119 15.633 6.515 -7.327 1.00 0.00 C ATOM 1528 CG GLN B 119 16.987 5.776 -7.319 1.00 0.00 C ATOM 1529 CD GLN B 119 18.147 6.762 -7.300 1.00 0.00 C ATOM 1530 OE1 GLN B 119 18.800 7.024 -8.304 1.00 0.00 O ATOM 1531 NE2 GLN B 119 18.426 7.363 -6.167 1.00 0.00 N ATOM 0 H GLN B 119 15.835 5.976 -4.604 1.00 0.00 H new ATOM 0 HA GLN B 119 13.641 6.413 -6.539 1.00 0.00 H new ATOM 0 HB2 GLN B 119 15.200 6.444 -8.325 1.00 0.00 H new ATOM 0 HB3 GLN B 119 15.809 7.573 -7.131 1.00 0.00 H new ATOM 0 HG2 GLN B 119 17.045 5.125 -6.447 1.00 0.00 H new ATOM 0 HG3 GLN B 119 17.062 5.138 -8.199 1.00 0.00 H new ATOM 0 HE21 GLN B 119 17.885 7.148 -5.329 1.00 0.00 H new ATOM 0 HE22 GLN B 119 19.183 8.045 -6.124 1.00 0.00 H new ATOM 1540 N ASP B 120 13.967 3.982 -7.591 1.00 0.00 N ATOM 1541 CA ASP B 120 13.562 2.587 -7.832 1.00 0.00 C ATOM 1542 C ASP B 120 14.672 1.552 -7.545 1.00 0.00 C ATOM 1543 O ASP B 120 14.373 0.439 -7.116 1.00 0.00 O ATOM 1544 CB ASP B 120 13.054 2.411 -9.275 1.00 0.00 C ATOM 1545 CG ASP B 120 11.876 3.310 -9.700 1.00 0.00 C ATOM 1546 OD1 ASP B 120 11.621 3.398 -10.925 1.00 0.00 O ATOM 1547 OD2 ASP B 120 11.203 3.932 -8.841 1.00 0.00 O1- ATOM 0 H ASP B 120 13.894 4.566 -8.424 1.00 0.00 H new ATOM 0 HA ASP B 120 12.759 2.390 -7.121 1.00 0.00 H new ATOM 0 HB2 ASP B 120 13.886 2.594 -9.955 1.00 0.00 H new ATOM 0 HB3 ASP B 120 12.756 1.371 -9.408 1.00 0.00 H new ATOM 1552 N ASP B 121 15.947 1.917 -7.725 1.00 0.00 N ATOM 1553 CA ASP B 121 17.099 1.068 -7.384 1.00 0.00 C ATOM 1554 C ASP B 121 17.229 0.828 -5.869 1.00 0.00 C ATOM 1555 O ASP B 121 17.617 -0.254 -5.429 1.00 0.00 O ATOM 1556 CB ASP B 121 18.370 1.739 -7.935 1.00 0.00 C ATOM 1557 CG ASP B 121 19.624 0.846 -7.854 1.00 0.00 C ATOM 1558 OD1 ASP B 121 19.526 -0.387 -8.085 1.00 0.00 O ATOM 1559 OD2 ASP B 121 20.734 1.388 -7.622 1.00 0.00 O1- ATOM 0 H ASP B 121 16.213 2.821 -8.116 1.00 0.00 H new ATOM 0 HA ASP B 121 16.953 0.087 -7.836 1.00 0.00 H new ATOM 0 HB2 ASP B 121 18.201 2.020 -8.974 1.00 0.00 H new ATOM 0 HB3 ASP B 121 18.554 2.660 -7.382 1.00 0.00 H new ATOM 1564 N ASP B 122 16.845 1.817 -5.054 1.00 0.00 N ATOM 1565 CA ASP B 122 16.803 1.720 -3.589 1.00 0.00 C ATOM 1566 C ASP B 122 15.553 0.966 -3.092 1.00 0.00 C ATOM 1567 O ASP B 122 15.615 0.271 -2.073 1.00 0.00 O ATOM 1568 CB ASP B 122 16.868 3.123 -2.975 1.00 0.00 C ATOM 1569 CG ASP B 122 18.049 3.975 -3.476 1.00 0.00 C ATOM 1570 OD1 ASP B 122 17.819 5.133 -3.900 1.00 0.00 O ATOM 1571 OD2 ASP B 122 19.211 3.501 -3.412 1.00 0.00 O1- ATOM 0 H ASP B 122 16.548 2.729 -5.402 1.00 0.00 H new ATOM 0 HA ASP B 122 17.670 1.143 -3.267 1.00 0.00 H new ATOM 0 HB2 ASP B 122 15.938 3.647 -3.194 1.00 0.00 H new ATOM 0 HB3 ASP B 122 16.935 3.031 -1.891 1.00 0.00 H new ATOM 1576 N LEU B 123 14.435 1.034 -3.830 1.00 0.00 N ATOM 1577 CA LEU B 123 13.253 0.190 -3.591 1.00 0.00 C ATOM 1578 C LEU B 123 13.561 -1.286 -3.893 1.00 0.00 C ATOM 1579 O LEU B 123 13.289 -2.156 -3.063 1.00 0.00 O ATOM 1580 CB LEU B 123 12.048 0.682 -4.418 1.00 0.00 C ATOM 1581 CG LEU B 123 11.580 2.104 -4.062 1.00 0.00 C ATOM 1582 CD1 LEU B 123 10.535 2.600 -5.052 1.00 0.00 C ATOM 1583 CD2 LEU B 123 10.938 2.163 -2.673 1.00 0.00 C ATOM 0 H LEU B 123 14.324 1.678 -4.613 1.00 0.00 H new ATOM 0 HA LEU B 123 12.991 0.269 -2.536 1.00 0.00 H new ATOM 0 HB2 LEU B 123 12.310 0.651 -5.476 1.00 0.00 H new ATOM 0 HB3 LEU B 123 11.217 -0.009 -4.276 1.00 0.00 H new ATOM 0 HG LEU B 123 12.473 2.728 -4.090 1.00 0.00 H new ATOM 0 HD11 LEU B 123 10.222 3.607 -4.777 1.00 0.00 H new ATOM 0 HD12 LEU B 123 10.962 2.614 -6.055 1.00 0.00 H new ATOM 0 HD13 LEU B 123 9.672 1.934 -5.034 1.00 0.00 H new ATOM 0 HD21 LEU B 123 10.622 3.184 -2.461 1.00 0.00 H new ATOM 0 HD22 LEU B 123 10.072 1.502 -2.644 1.00 0.00 H new ATOM 0 HD23 LEU B 123 11.663 1.845 -1.923 1.00 0.00 H new ATOM 1595 N ALA B 124 14.202 -1.579 -5.028 1.00 0.00 N ATOM 1596 CA ALA B 124 14.635 -2.935 -5.386 1.00 0.00 C ATOM 1597 C ALA B 124 15.616 -3.553 -4.373 1.00 0.00 C ATOM 1598 O ALA B 124 15.592 -4.767 -4.153 1.00 0.00 O ATOM 1599 CB ALA B 124 15.240 -2.897 -6.792 1.00 0.00 C ATOM 0 H ALA B 124 14.437 -0.878 -5.730 1.00 0.00 H new ATOM 0 HA ALA B 124 13.760 -3.585 -5.366 1.00 0.00 H new ATOM 0 HB1 ALA B 124 15.567 -3.898 -7.074 1.00 0.00 H new ATOM 0 HB2 ALA B 124 14.490 -2.547 -7.501 1.00 0.00 H new ATOM 0 HB3 ALA B 124 16.094 -2.219 -6.803 1.00 0.00 H new ATOM 1605 N ALA B 125 16.421 -2.733 -3.693 1.00 0.00 N ATOM 1606 CA ALA B 125 17.346 -3.163 -2.642 1.00 0.00 C ATOM 1607 C ALA B 125 16.655 -3.648 -1.339 1.00 0.00 C ATOM 1608 O ALA B 125 17.295 -4.342 -0.545 1.00 0.00 O ATOM 1609 CB ALA B 125 18.344 -2.025 -2.379 1.00 0.00 C ATOM 0 H ALA B 125 16.448 -1.727 -3.862 1.00 0.00 H new ATOM 0 HA ALA B 125 17.870 -4.049 -3.001 1.00 0.00 H new ATOM 0 HB1 ALA B 125 19.042 -2.327 -1.598 1.00 0.00 H new ATOM 0 HB2 ALA B 125 18.895 -1.806 -3.294 1.00 0.00 H new ATOM 0 HB3 ALA B 125 17.804 -1.134 -2.058 1.00 0.00 H new ATOM 1615 N LEU B 126 15.368 -3.328 -1.111 1.00 0.00 N ATOM 1616 CA LEU B 126 14.589 -3.771 0.063 1.00 0.00 C ATOM 1617 C LEU B 126 13.358 -4.644 -0.285 1.00 0.00 C ATOM 1618 O LEU B 126 12.979 -5.496 0.522 1.00 0.00 O ATOM 1619 CB LEU B 126 14.283 -2.557 0.969 1.00 0.00 C ATOM 1620 CG LEU B 126 13.076 -1.678 0.564 1.00 0.00 C ATOM 1621 CD1 LEU B 126 11.822 -2.072 1.345 1.00 0.00 C ATOM 1622 CD2 LEU B 126 13.345 -0.201 0.861 1.00 0.00 C ATOM 0 H LEU B 126 14.829 -2.743 -1.749 1.00 0.00 H new ATOM 0 HA LEU B 126 15.206 -4.462 0.637 1.00 0.00 H new ATOM 0 HB2 LEU B 126 14.114 -2.922 1.982 1.00 0.00 H new ATOM 0 HB3 LEU B 126 15.170 -1.924 1.002 1.00 0.00 H new ATOM 0 HG LEU B 126 12.926 -1.832 -0.505 1.00 0.00 H new ATOM 0 HD11 LEU B 126 10.989 -1.438 1.040 1.00 0.00 H new ATOM 0 HD12 LEU B 126 11.578 -3.114 1.140 1.00 0.00 H new ATOM 0 HD13 LEU B 126 12.003 -1.945 2.412 1.00 0.00 H new ATOM 0 HD21 LEU B 126 12.480 0.393 0.566 1.00 0.00 H new ATOM 0 HD22 LEU B 126 13.527 -0.072 1.928 1.00 0.00 H new ATOM 0 HD23 LEU B 126 14.220 0.129 0.301 1.00 0.00 H new ATOM 1634 N LEU B 127 12.775 -4.504 -1.484 1.00 0.00 N ATOM 1635 CA LEU B 127 11.769 -5.430 -2.032 1.00 0.00 C ATOM 1636 C LEU B 127 12.403 -6.765 -2.478 1.00 0.00 C ATOM 1637 O LEU B 127 11.765 -7.818 -2.408 1.00 0.00 O ATOM 1638 CB LEU B 127 11.041 -4.760 -3.217 1.00 0.00 C ATOM 1639 CG LEU B 127 9.799 -3.944 -2.824 1.00 0.00 C ATOM 1640 CD1 LEU B 127 10.045 -2.832 -1.807 1.00 0.00 C ATOM 1641 CD2 LEU B 127 9.203 -3.288 -4.068 1.00 0.00 C ATOM 0 H LEU B 127 12.992 -3.731 -2.113 1.00 0.00 H new ATOM 0 HA LEU B 127 11.052 -5.658 -1.243 1.00 0.00 H new ATOM 0 HB2 LEU B 127 11.742 -4.105 -3.734 1.00 0.00 H new ATOM 0 HB3 LEU B 127 10.743 -5.532 -3.927 1.00 0.00 H new ATOM 0 HG LEU B 127 9.131 -4.668 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU B 127 9.108 -2.317 -1.597 1.00 0.00 H new ATOM 0 HD12 LEU B 127 10.437 -3.262 -0.885 1.00 0.00 H new ATOM 0 HD13 LEU B 127 10.766 -2.122 -2.212 1.00 0.00 H new ATOM 0 HD21 LEU B 127 8.322 -2.710 -3.788 1.00 0.00 H new ATOM 0 HD22 LEU B 127 9.942 -2.627 -4.520 1.00 0.00 H new ATOM 0 HD23 LEU B 127 8.918 -4.058 -4.785 1.00 0.00 H new ATOM 1653 N GLY B 128 13.649 -6.715 -2.951 1.00 0.00 N ATOM 1654 CA GLY B 128 14.433 -7.884 -3.369 1.00 0.00 C ATOM 1655 C GLY B 128 13.826 -8.590 -4.586 1.00 0.00 C ATOM 1656 O GLY B 128 13.317 -7.951 -5.511 1.00 0.00 O ATOM 0 H GLY B 128 14.157 -5.837 -3.058 1.00 0.00 H new ATOM 0 HA2 GLY B 128 15.450 -7.571 -3.604 1.00 0.00 H new ATOM 0 HA3 GLY B 128 14.500 -8.588 -2.540 1.00 0.00 H new ATOM 1660 N LYS B 129 13.831 -9.928 -4.576 1.00 0.00 N ATOM 1661 CA LYS B 129 13.196 -10.758 -5.620 1.00 0.00 C ATOM 1662 C LYS B 129 11.666 -10.620 -5.692 1.00 0.00 C ATOM 1663 O LYS B 129 11.069 -11.024 -6.686 1.00 0.00 O ATOM 1664 CB LYS B 129 13.687 -12.213 -5.522 1.00 0.00 C ATOM 1665 CG LYS B 129 13.480 -12.955 -4.181 1.00 0.00 C ATOM 1666 CD LYS B 129 12.038 -13.304 -3.769 1.00 0.00 C ATOM 1667 CE LYS B 129 11.305 -14.131 -4.832 1.00 0.00 C ATOM 1668 NZ LYS B 129 9.975 -14.578 -4.352 1.00 0.00 N1+ ATOM 0 H LYS B 129 14.278 -10.474 -3.840 1.00 0.00 H new ATOM 0 HA LYS B 129 13.523 -10.367 -6.583 1.00 0.00 H new ATOM 0 HB2 LYS B 129 13.189 -12.788 -6.303 1.00 0.00 H new ATOM 0 HB3 LYS B 129 14.753 -12.223 -5.749 1.00 0.00 H new ATOM 0 HG2 LYS B 129 14.051 -13.883 -4.220 1.00 0.00 H new ATOM 0 HG3 LYS B 129 13.916 -12.345 -3.390 1.00 0.00 H new ATOM 0 HD2 LYS B 129 12.056 -13.859 -2.831 1.00 0.00 H new ATOM 0 HD3 LYS B 129 11.484 -12.384 -3.584 1.00 0.00 H new ATOM 0 HE2 LYS B 129 11.185 -13.537 -5.738 1.00 0.00 H new ATOM 0 HE3 LYS B 129 11.908 -14.999 -5.098 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 9.535 -15.191 -5.068 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 10.087 -15.108 -3.464 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 9.369 -13.749 -4.186 1.00 0.00 H new ATOM 1682 N GLU B 130 11.034 -10.031 -4.677 1.00 0.00 N ATOM 1683 CA GLU B 130 9.598 -9.727 -4.648 1.00 0.00 C ATOM 1684 C GLU B 130 9.241 -8.382 -5.325 1.00 0.00 C ATOM 1685 O GLU B 130 8.073 -7.984 -5.352 1.00 0.00 O ATOM 1686 CB GLU B 130 9.084 -9.815 -3.195 1.00 0.00 C ATOM 1687 CG GLU B 130 7.617 -10.261 -3.056 1.00 0.00 C ATOM 1688 CD GLU B 130 7.334 -11.636 -3.702 1.00 0.00 C ATOM 1689 OE1 GLU B 130 8.237 -12.512 -3.727 1.00 0.00 O ATOM 1690 OE2 GLU B 130 6.195 -11.857 -4.183 1.00 0.00 O1- ATOM 0 H GLU B 130 11.518 -9.743 -3.827 1.00 0.00 H new ATOM 0 HA GLU B 130 9.084 -10.478 -5.248 1.00 0.00 H new ATOM 0 HB2 GLU B 130 9.715 -10.511 -2.643 1.00 0.00 H new ATOM 0 HB3 GLU B 130 9.199 -8.839 -2.724 1.00 0.00 H new ATOM 0 HG2 GLU B 130 7.356 -10.303 -1.999 1.00 0.00 H new ATOM 0 HG3 GLU B 130 6.971 -9.512 -3.514 1.00 0.00 H new ATOM 1697 N PHE B 131 10.230 -7.674 -5.894 1.00 0.00 N ATOM 1698 CA PHE B 131 10.030 -6.458 -6.701 1.00 0.00 C ATOM 1699 C PHE B 131 9.090 -6.706 -7.898 1.00 0.00 C ATOM 1700 O PHE B 131 9.045 -7.808 -8.460 1.00 0.00 O ATOM 1701 CB PHE B 131 11.399 -5.904 -7.131 1.00 0.00 C ATOM 1702 CG PHE B 131 11.367 -4.579 -7.877 1.00 0.00 C ATOM 1703 CD1 PHE B 131 11.216 -4.553 -9.277 1.00 0.00 C ATOM 1704 CD2 PHE B 131 11.530 -3.373 -7.172 1.00 0.00 C ATOM 1705 CE1 PHE B 131 11.223 -3.325 -9.962 1.00 0.00 C ATOM 1706 CE2 PHE B 131 11.558 -2.149 -7.860 1.00 0.00 C ATOM 1707 CZ PHE B 131 11.395 -2.120 -9.256 1.00 0.00 C ATOM 0 H PHE B 131 11.212 -7.936 -5.804 1.00 0.00 H new ATOM 0 HA PHE B 131 9.530 -5.706 -6.091 1.00 0.00 H new ATOM 0 HB2 PHE B 131 12.018 -5.785 -6.242 1.00 0.00 H new ATOM 0 HB3 PHE B 131 11.888 -6.645 -7.763 1.00 0.00 H new ATOM 0 HD1 PHE B 131 11.095 -5.476 -9.824 1.00 0.00 H new ATOM 0 HD2 PHE B 131 11.634 -3.388 -6.097 1.00 0.00 H new ATOM 0 HE1 PHE B 131 11.096 -3.307 -11.034 1.00 0.00 H new ATOM 0 HE2 PHE B 131 11.705 -1.228 -7.315 1.00 0.00 H new ATOM 0 HZ PHE B 131 11.402 -1.178 -9.784 1.00 0.00 H new ATOM 1717 N ILE B 132 8.315 -5.681 -8.263 1.00 0.00 N ATOM 1718 CA ILE B 132 7.175 -5.789 -9.190 1.00 0.00 C ATOM 1719 C ILE B 132 7.560 -6.193 -10.628 1.00 0.00 C ATOM 1720 O ILE B 132 8.676 -5.933 -11.085 1.00 0.00 O ATOM 1721 CB ILE B 132 6.334 -4.485 -9.127 1.00 0.00 C ATOM 1722 CG1 ILE B 132 4.854 -4.697 -9.491 1.00 0.00 C ATOM 1723 CG2 ILE B 132 6.911 -3.387 -10.040 1.00 0.00 C ATOM 1724 CD1 ILE B 132 4.102 -5.665 -8.564 1.00 0.00 C ATOM 0 H ILE B 132 8.462 -4.732 -7.918 1.00 0.00 H new ATOM 0 HA ILE B 132 6.558 -6.622 -8.854 1.00 0.00 H new ATOM 0 HB ILE B 132 6.389 -4.168 -8.085 1.00 0.00 H new ATOM 0 HG12 ILE B 132 4.347 -3.732 -9.476 1.00 0.00 H new ATOM 0 HG13 ILE B 132 4.794 -5.072 -10.513 1.00 0.00 H new ATOM 0 HG21 ILE B 132 6.294 -2.492 -9.967 1.00 0.00 H new ATOM 0 HG22 ILE B 132 7.929 -3.153 -9.729 1.00 0.00 H new ATOM 0 HG23 ILE B 132 6.919 -3.739 -11.072 1.00 0.00 H new ATOM 0 HD11 ILE B 132 3.067 -5.755 -8.894 1.00 0.00 H new ATOM 0 HD12 ILE B 132 4.579 -6.644 -8.596 1.00 0.00 H new ATOM 0 HD13 ILE B 132 4.125 -5.283 -7.543 1.00 0.00 H new ATOM 1993 N TRP B 156 -6.632 12.246 10.508 1.00 0.00 N ATOM 1994 CA TRP B 156 -5.427 11.420 10.334 1.00 0.00 C ATOM 1995 C TRP B 156 -5.580 10.432 9.169 1.00 0.00 C ATOM 1996 O TRP B 156 -4.641 10.239 8.397 1.00 0.00 O ATOM 1997 CB TRP B 156 -5.122 10.683 11.656 1.00 0.00 C ATOM 1998 CG TRP B 156 -6.268 9.918 12.260 1.00 0.00 C ATOM 1999 CD1 TRP B 156 -7.102 10.397 13.210 1.00 0.00 C ATOM 2000 CD2 TRP B 156 -6.764 8.573 11.949 1.00 0.00 C ATOM 2001 NE1 TRP B 156 -8.114 9.488 13.452 1.00 0.00 N ATOM 2002 CE2 TRP B 156 -7.974 8.360 12.675 1.00 0.00 C ATOM 2003 CE3 TRP B 156 -6.327 7.526 11.106 1.00 0.00 C ATOM 2004 CZ2 TRP B 156 -8.744 7.195 12.522 1.00 0.00 C ATOM 2005 CZ3 TRP B 156 -7.084 6.344 10.959 1.00 0.00 C ATOM 2006 CH2 TRP B 156 -8.300 6.191 11.645 1.00 0.00 C ATOM 0 HA TRP B 156 -4.589 12.070 10.083 1.00 0.00 H new ATOM 0 HB2 TRP B 156 -4.299 9.990 11.482 1.00 0.00 H new ATOM 0 HB3 TRP B 156 -4.774 11.414 12.385 1.00 0.00 H new ATOM 0 HD1 TRP B 156 -6.993 11.350 13.707 1.00 0.00 H new ATOM 0 HE1 TRP B 156 -8.869 9.634 14.122 1.00 0.00 H new ATOM 0 HE3 TRP B 156 -5.398 7.632 10.565 1.00 0.00 H new ATOM 0 HZ2 TRP B 156 -9.666 7.073 13.072 1.00 0.00 H new ATOM 0 HZ3 TRP B 156 -6.727 5.553 10.316 1.00 0.00 H new ATOM 0 HH2 TRP B 156 -8.894 5.301 11.498 1.00 0.00 H new ATOM 2017 N LYS B 157 -6.784 9.869 8.990 1.00 0.00 N ATOM 2018 CA LYS B 157 -7.144 8.963 7.883 1.00 0.00 C ATOM 2019 C LYS B 157 -7.089 9.659 6.521 1.00 0.00 C ATOM 2020 O LYS B 157 -6.525 9.105 5.579 1.00 0.00 O ATOM 2021 CB LYS B 157 -8.509 8.309 8.163 1.00 0.00 C ATOM 2022 CG LYS B 157 -9.704 9.269 8.333 1.00 0.00 C ATOM 2023 CD LYS B 157 -10.965 8.485 8.727 1.00 0.00 C ATOM 2024 CE LYS B 157 -12.161 9.428 8.878 1.00 0.00 C ATOM 2025 NZ LYS B 157 -13.402 8.688 9.223 1.00 0.00 N1+ ATOM 0 H LYS B 157 -7.560 10.035 9.630 1.00 0.00 H new ATOM 0 HA LYS B 157 -6.397 8.171 7.831 1.00 0.00 H new ATOM 0 HB2 LYS B 157 -8.734 7.624 7.346 1.00 0.00 H new ATOM 0 HB3 LYS B 157 -8.421 7.708 9.068 1.00 0.00 H new ATOM 0 HG2 LYS B 157 -9.476 10.013 9.097 1.00 0.00 H new ATOM 0 HG3 LYS B 157 -9.880 9.810 7.403 1.00 0.00 H new ATOM 0 HD2 LYS B 157 -11.183 7.732 7.970 1.00 0.00 H new ATOM 0 HD3 LYS B 157 -10.792 7.955 9.664 1.00 0.00 H new ATOM 0 HE2 LYS B 157 -11.949 10.164 9.653 1.00 0.00 H new ATOM 0 HE3 LYS B 157 -12.311 9.978 7.949 1.00 0.00 H new ATOM 0 HZ1 LYS B 157 -14.191 9.359 9.317 1.00 0.00 H new ATOM 0 HZ2 LYS B 157 -13.618 8.003 8.471 1.00 0.00 H new ATOM 0 HZ3 LYS B 157 -13.267 8.184 10.122 1.00 0.00 H new ATOM 2039 N ASP B 158 -7.595 10.890 6.437 1.00 0.00 N ATOM 2040 CA ASP B 158 -7.575 11.708 5.218 1.00 0.00 C ATOM 2041 C ASP B 158 -6.141 12.088 4.810 1.00 0.00 C ATOM 2042 O ASP B 158 -5.749 11.907 3.658 1.00 0.00 O ATOM 2043 CB ASP B 158 -8.445 12.958 5.440 1.00 0.00 C ATOM 2044 CG ASP B 158 -8.415 13.911 4.234 1.00 0.00 C ATOM 2045 OD1 ASP B 158 -9.254 13.742 3.318 1.00 0.00 O ATOM 2046 OD2 ASP B 158 -7.572 14.837 4.211 1.00 0.00 O1- ATOM 0 H ASP B 158 -8.039 11.357 7.227 1.00 0.00 H new ATOM 0 HA ASP B 158 -7.985 11.125 4.394 1.00 0.00 H new ATOM 0 HB2 ASP B 158 -9.473 12.653 5.634 1.00 0.00 H new ATOM 0 HB3 ASP B 158 -8.097 13.487 6.327 1.00 0.00 H new ATOM 2051 N ASP B 159 -5.331 12.576 5.756 1.00 0.00 N ATOM 2052 CA ASP B 159 -3.972 13.039 5.452 1.00 0.00 C ATOM 2053 C ASP B 159 -2.987 11.887 5.157 1.00 0.00 C ATOM 2054 O ASP B 159 -2.087 12.044 4.328 1.00 0.00 O ATOM 2055 CB ASP B 159 -3.466 13.951 6.581 1.00 0.00 C ATOM 2056 CG ASP B 159 -2.329 14.848 6.086 1.00 0.00 C ATOM 2057 OD1 ASP B 159 -1.210 14.808 6.648 1.00 0.00 O ATOM 2058 OD2 ASP B 159 -2.520 15.587 5.089 1.00 0.00 O1- ATOM 0 H ASP B 159 -5.593 12.661 6.738 1.00 0.00 H new ATOM 0 HA ASP B 159 -4.023 13.615 4.528 1.00 0.00 H new ATOM 0 HB2 ASP B 159 -4.285 14.566 6.952 1.00 0.00 H new ATOM 0 HB3 ASP B 159 -3.119 13.344 7.417 1.00 0.00 H new ATOM 2063 N TYR B 160 -3.174 10.713 5.774 1.00 0.00 N ATOM 2064 CA TYR B 160 -2.430 9.488 5.442 1.00 0.00 C ATOM 2065 C TYR B 160 -2.802 8.958 4.046 1.00 0.00 C ATOM 2066 O TYR B 160 -1.915 8.726 3.220 1.00 0.00 O ATOM 2067 CB TYR B 160 -2.682 8.439 6.532 1.00 0.00 C ATOM 2068 CG TYR B 160 -1.976 7.113 6.328 1.00 0.00 C ATOM 2069 CD1 TYR B 160 -2.710 5.910 6.384 1.00 0.00 C ATOM 2070 CD2 TYR B 160 -0.580 7.076 6.122 1.00 0.00 C ATOM 2071 CE1 TYR B 160 -2.053 4.674 6.244 1.00 0.00 C ATOM 2072 CE2 TYR B 160 0.076 5.840 5.962 1.00 0.00 C ATOM 2073 CZ TYR B 160 -0.659 4.638 6.033 1.00 0.00 C ATOM 2074 OH TYR B 160 -0.008 3.449 5.908 1.00 0.00 O ATOM 0 H TYR B 160 -3.852 10.584 6.525 1.00 0.00 H new ATOM 0 HA TYR B 160 -1.365 9.717 5.408 1.00 0.00 H new ATOM 0 HB2 TYR B 160 -2.372 8.854 7.491 1.00 0.00 H new ATOM 0 HB3 TYR B 160 -3.754 8.255 6.596 1.00 0.00 H new ATOM 0 HD1 TYR B 160 -3.779 5.938 6.535 1.00 0.00 H new ATOM 0 HD2 TYR B 160 -0.015 7.996 6.087 1.00 0.00 H new ATOM 0 HE1 TYR B 160 -2.615 3.754 6.298 1.00 0.00 H new ATOM 0 HE2 TYR B 160 1.141 5.812 5.785 1.00 0.00 H new ATOM 0 HH TYR B 160 0.888 3.604 5.543 1.00 0.00 H new ATOM 2084 N LEU B 161 -4.099 8.836 3.735 1.00 0.00 N ATOM 2085 CA LEU B 161 -4.575 8.398 2.418 1.00 0.00 C ATOM 2086 C LEU B 161 -4.108 9.341 1.286 1.00 0.00 C ATOM 2087 O LEU B 161 -3.735 8.884 0.202 1.00 0.00 O ATOM 2088 CB LEU B 161 -6.111 8.300 2.487 1.00 0.00 C ATOM 2089 CG LEU B 161 -6.774 7.663 1.259 1.00 0.00 C ATOM 2090 CD1 LEU B 161 -6.544 6.156 1.216 1.00 0.00 C ATOM 2091 CD2 LEU B 161 -8.279 7.916 1.293 1.00 0.00 C ATOM 0 H LEU B 161 -4.851 9.040 4.394 1.00 0.00 H new ATOM 0 HA LEU B 161 -4.148 7.425 2.176 1.00 0.00 H new ATOM 0 HB2 LEU B 161 -6.384 7.722 3.370 1.00 0.00 H new ATOM 0 HB3 LEU B 161 -6.519 9.302 2.623 1.00 0.00 H new ATOM 0 HG LEU B 161 -6.326 8.116 0.375 1.00 0.00 H new ATOM 0 HD11 LEU B 161 -7.028 5.739 0.333 1.00 0.00 H new ATOM 0 HD12 LEU B 161 -5.474 5.952 1.174 1.00 0.00 H new ATOM 0 HD13 LEU B 161 -6.965 5.698 2.111 1.00 0.00 H new ATOM 0 HD21 LEU B 161 -8.744 7.461 0.418 1.00 0.00 H new ATOM 0 HD22 LEU B 161 -8.701 7.478 2.198 1.00 0.00 H new ATOM 0 HD23 LEU B 161 -8.468 8.990 1.287 1.00 0.00 H new ATOM 2103 N SER B 162 -4.040 10.648 1.568 1.00 0.00 N ATOM 2104 CA SER B 162 -3.505 11.678 0.674 1.00 0.00 C ATOM 2105 C SER B 162 -2.053 11.398 0.251 1.00 0.00 C ATOM 2106 O SER B 162 -1.726 11.560 -0.926 1.00 0.00 O ATOM 2107 CB SER B 162 -3.636 13.052 1.346 1.00 0.00 C ATOM 2108 OG SER B 162 -2.894 14.054 0.667 1.00 0.00 O ATOM 0 H SER B 162 -4.368 11.029 2.456 1.00 0.00 H new ATOM 0 HA SER B 162 -4.092 11.666 -0.245 1.00 0.00 H new ATOM 0 HB2 SER B 162 -4.687 13.340 1.379 1.00 0.00 H new ATOM 0 HB3 SER B 162 -3.292 12.984 2.378 1.00 0.00 H new ATOM 0 HG SER B 162 -3.241 14.938 0.909 1.00 0.00 H new ATOM 2114 N ARG B 163 -1.180 10.905 1.150 1.00 0.00 N ATOM 2115 CA ARG B 163 0.182 10.468 0.776 1.00 0.00 C ATOM 2116 C ARG B 163 0.142 9.266 -0.173 1.00 0.00 C ATOM 2117 O ARG B 163 0.744 9.311 -1.245 1.00 0.00 O ATOM 2118 CB ARG B 163 1.056 10.116 1.997 1.00 0.00 C ATOM 2119 CG ARG B 163 1.322 11.230 3.017 1.00 0.00 C ATOM 2120 CD ARG B 163 1.769 12.575 2.419 1.00 0.00 C ATOM 2121 NE ARG B 163 0.626 13.483 2.196 1.00 0.00 N ATOM 2122 CZ ARG B 163 -0.014 14.151 3.137 1.00 0.00 C ATOM 2123 NH1 ARG B 163 0.408 14.200 4.371 1.00 0.00 N1+ ATOM 2124 NH2 ARG B 163 -1.115 14.775 2.861 1.00 0.00 N ATOM 0 H ARG B 163 -1.392 10.799 2.142 1.00 0.00 H new ATOM 0 HA ARG B 163 0.635 11.321 0.270 1.00 0.00 H new ATOM 0 HB2 ARG B 163 0.584 9.285 2.521 1.00 0.00 H new ATOM 0 HB3 ARG B 163 2.018 9.757 1.631 1.00 0.00 H new ATOM 0 HG2 ARG B 163 0.414 11.393 3.598 1.00 0.00 H new ATOM 0 HG3 ARG B 163 2.088 10.888 3.713 1.00 0.00 H new ATOM 0 HD2 ARG B 163 2.486 13.050 3.089 1.00 0.00 H new ATOM 0 HD3 ARG B 163 2.284 12.400 1.474 1.00 0.00 H new ATOM 0 HE ARG B 163 0.305 13.604 1.235 1.00 0.00 H new ATOM 0 HH11 ARG B 163 1.262 13.710 4.638 1.00 0.00 H new ATOM 0 HH12 ARG B 163 -0.116 14.728 5.069 1.00 0.00 H new ATOM 0 HH21 ARG B 163 -1.491 14.751 1.913 1.00 0.00 H new ATOM 0 HH22 ARG B 163 -1.606 15.290 3.592 1.00 0.00 H new ATOM 2138 N LEU B 164 -0.584 8.212 0.193 1.00 0.00 N ATOM 2139 CA LEU B 164 -0.596 6.935 -0.529 1.00 0.00 C ATOM 2140 C LEU B 164 -1.174 7.046 -1.954 1.00 0.00 C ATOM 2141 O LEU B 164 -0.750 6.304 -2.842 1.00 0.00 O ATOM 2142 CB LEU B 164 -1.340 5.885 0.326 1.00 0.00 C ATOM 2143 CG LEU B 164 -0.467 5.174 1.380 1.00 0.00 C ATOM 2144 CD1 LEU B 164 0.100 6.075 2.471 1.00 0.00 C ATOM 2145 CD2 LEU B 164 -1.274 4.064 2.051 1.00 0.00 C ATOM 0 H LEU B 164 -1.191 8.218 1.012 1.00 0.00 H new ATOM 0 HA LEU B 164 0.436 6.615 -0.676 1.00 0.00 H new ATOM 0 HB2 LEU B 164 -2.172 6.373 0.833 1.00 0.00 H new ATOM 0 HB3 LEU B 164 -1.768 5.134 -0.338 1.00 0.00 H new ATOM 0 HG LEU B 164 0.387 4.789 0.823 1.00 0.00 H new ATOM 0 HD11 LEU B 164 0.698 5.479 3.161 1.00 0.00 H new ATOM 0 HD12 LEU B 164 0.726 6.844 2.019 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.718 6.547 3.015 1.00 0.00 H new ATOM 0 HD21 LEU B 164 -0.655 3.563 2.795 1.00 0.00 H new ATOM 0 HD22 LEU B 164 -2.150 4.494 2.537 1.00 0.00 H new ATOM 0 HD23 LEU B 164 -1.594 3.342 1.300 1.00 0.00 H new ATOM 2157 N SER B 165 -2.067 8.009 -2.212 1.00 0.00 N ATOM 2158 CA SER B 165 -2.600 8.261 -3.562 1.00 0.00 C ATOM 2159 C SER B 165 -1.550 8.801 -4.557 1.00 0.00 C ATOM 2160 O SER B 165 -1.706 8.634 -5.769 1.00 0.00 O ATOM 2161 CB SER B 165 -3.808 9.201 -3.484 1.00 0.00 C ATOM 2162 OG SER B 165 -3.421 10.556 -3.300 1.00 0.00 O ATOM 0 H SER B 165 -2.441 8.634 -1.497 1.00 0.00 H new ATOM 0 HA SER B 165 -2.910 7.293 -3.957 1.00 0.00 H new ATOM 0 HB2 SER B 165 -4.395 9.113 -4.398 1.00 0.00 H new ATOM 0 HB3 SER B 165 -4.453 8.894 -2.661 1.00 0.00 H new ATOM 0 HG SER B 165 -2.918 10.642 -2.463 1.00 0.00 H new ATOM 2168 N ARG B 166 -0.459 9.418 -4.073 1.00 0.00 N ATOM 2169 CA ARG B 166 0.612 10.027 -4.893 1.00 0.00 C ATOM 2170 C ARG B 166 1.722 9.042 -5.281 1.00 0.00 C ATOM 2171 O ARG B 166 2.299 9.162 -6.363 1.00 0.00 O ATOM 2172 CB ARG B 166 1.223 11.192 -4.100 1.00 0.00 C ATOM 2173 CG ARG B 166 0.250 12.371 -3.890 1.00 0.00 C ATOM 2174 CD ARG B 166 0.651 13.276 -2.714 1.00 0.00 C ATOM 2175 NE ARG B 166 2.028 13.813 -2.827 1.00 0.00 N ATOM 2176 CZ ARG B 166 3.101 13.414 -2.165 1.00 0.00 C ATOM 2177 NH1 ARG B 166 3.097 12.381 -1.375 1.00 0.00 N1+ ATOM 2178 NH2 ARG B 166 4.222 14.062 -2.280 1.00 0.00 N ATOM 0 H ARG B 166 -0.289 9.512 -3.072 1.00 0.00 H new ATOM 0 HA ARG B 166 0.158 10.364 -5.825 1.00 0.00 H new ATOM 0 HB2 ARG B 166 1.553 10.826 -3.128 1.00 0.00 H new ATOM 0 HB3 ARG B 166 2.109 11.551 -4.623 1.00 0.00 H new ATOM 0 HG2 ARG B 166 0.207 12.967 -4.802 1.00 0.00 H new ATOM 0 HG3 ARG B 166 -0.753 11.981 -3.716 1.00 0.00 H new ATOM 0 HD2 ARG B 166 -0.051 14.107 -2.649 1.00 0.00 H new ATOM 0 HD3 ARG B 166 0.564 12.712 -1.785 1.00 0.00 H new ATOM 0 HE ARG B 166 2.163 14.576 -3.490 1.00 0.00 H new ATOM 0 HH11 ARG B 166 2.241 11.841 -1.246 1.00 0.00 H new ATOM 0 HH12 ARG B 166 3.950 12.111 -0.885 1.00 0.00 H new ATOM 0 HH21 ARG B 166 4.277 14.883 -2.883 1.00 0.00 H new ATOM 0 HH22 ARG B 166 5.046 13.750 -1.767 1.00 0.00 H new ATOM 2192 N LEU B 167 2.037 8.090 -4.399 1.00 0.00 N ATOM 2193 CA LEU B 167 3.185 7.179 -4.510 1.00 0.00 C ATOM 2194 C LEU B 167 2.974 6.039 -5.531 1.00 0.00 C ATOM 2195 O LEU B 167 1.848 5.673 -5.878 1.00 0.00 O ATOM 2196 CB LEU B 167 3.524 6.653 -3.097 1.00 0.00 C ATOM 2197 CG LEU B 167 4.545 7.528 -2.337 1.00 0.00 C ATOM 2198 CD1 LEU B 167 4.145 8.999 -2.206 1.00 0.00 C ATOM 2199 CD2 LEU B 167 4.732 6.990 -0.919 1.00 0.00 C ATOM 0 H LEU B 167 1.483 7.925 -3.559 1.00 0.00 H new ATOM 0 HA LEU B 167 4.033 7.736 -4.909 1.00 0.00 H new ATOM 0 HB2 LEU B 167 2.606 6.590 -2.512 1.00 0.00 H new ATOM 0 HB3 LEU B 167 3.918 5.640 -3.181 1.00 0.00 H new ATOM 0 HG LEU B 167 5.457 7.479 -2.932 1.00 0.00 H new ATOM 0 HD11 LEU B 167 4.918 9.539 -1.659 1.00 0.00 H new ATOM 0 HD12 LEU B 167 4.031 9.435 -3.199 1.00 0.00 H new ATOM 0 HD13 LEU B 167 3.201 9.073 -1.667 1.00 0.00 H new ATOM 0 HD21 LEU B 167 5.453 7.610 -0.387 1.00 0.00 H new ATOM 0 HD22 LEU B 167 3.777 7.011 -0.393 1.00 0.00 H new ATOM 0 HD23 LEU B 167 5.099 5.965 -0.964 1.00 0.00 H new ATOM 2211 N SER B 168 4.086 5.484 -6.024 1.00 0.00 N ATOM 2212 CA SER B 168 4.138 4.306 -6.911 1.00 0.00 C ATOM 2213 C SER B 168 3.868 2.995 -6.153 1.00 0.00 C ATOM 2214 O SER B 168 3.977 2.952 -4.926 1.00 0.00 O ATOM 2215 CB SER B 168 5.510 4.270 -7.598 1.00 0.00 C ATOM 2216 OG SER B 168 5.591 3.201 -8.523 1.00 0.00 O ATOM 0 H SER B 168 5.013 5.853 -5.811 1.00 0.00 H new ATOM 0 HA SER B 168 3.349 4.395 -7.658 1.00 0.00 H new ATOM 0 HB2 SER B 168 5.687 5.214 -8.113 1.00 0.00 H new ATOM 0 HB3 SER B 168 6.293 4.165 -6.847 1.00 0.00 H new ATOM 0 HG SER B 168 6.474 3.202 -8.948 1.00 0.00 H new ATOM 2222 N LYS B 169 3.545 1.897 -6.853 1.00 0.00 N ATOM 2223 CA LYS B 169 3.278 0.570 -6.251 1.00 0.00 C ATOM 2224 C LYS B 169 4.484 0.005 -5.482 1.00 0.00 C ATOM 2225 O LYS B 169 4.318 -0.558 -4.402 1.00 0.00 O ATOM 2226 CB LYS B 169 2.779 -0.373 -7.356 1.00 0.00 C ATOM 2227 CG LYS B 169 2.406 -1.752 -6.798 1.00 0.00 C ATOM 2228 CD LYS B 169 1.569 -2.563 -7.788 1.00 0.00 C ATOM 2229 CE LYS B 169 1.326 -3.953 -7.200 1.00 0.00 C ATOM 2230 NZ LYS B 169 0.479 -4.777 -8.088 1.00 0.00 N1+ ATOM 0 H LYS B 169 3.459 1.900 -7.869 1.00 0.00 H new ATOM 0 HA LYS B 169 2.502 0.674 -5.492 1.00 0.00 H new ATOM 0 HB2 LYS B 169 1.911 0.068 -7.847 1.00 0.00 H new ATOM 0 HB3 LYS B 169 3.552 -0.485 -8.116 1.00 0.00 H new ATOM 0 HG2 LYS B 169 3.315 -2.303 -6.555 1.00 0.00 H new ATOM 0 HG3 LYS B 169 1.850 -1.629 -5.869 1.00 0.00 H new ATOM 0 HD2 LYS B 169 0.620 -2.062 -7.979 1.00 0.00 H new ATOM 0 HD3 LYS B 169 2.086 -2.642 -8.744 1.00 0.00 H new ATOM 0 HE2 LYS B 169 2.281 -4.453 -7.040 1.00 0.00 H new ATOM 0 HE3 LYS B 169 0.848 -3.858 -6.225 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 0.716 -5.781 -7.960 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -0.522 -4.625 -7.852 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 0.647 -4.505 -9.078 1.00 0.00 H new ATOM 2244 N ASN B 170 5.700 0.223 -5.977 1.00 0.00 N ATOM 2245 CA ASN B 170 6.949 -0.111 -5.277 1.00 0.00 C ATOM 2246 C ASN B 170 7.133 0.690 -3.968 1.00 0.00 C ATOM 2247 O ASN B 170 7.522 0.132 -2.940 1.00 0.00 O ATOM 2248 CB ASN B 170 8.132 0.120 -6.229 1.00 0.00 C ATOM 2249 CG ASN B 170 8.047 -0.723 -7.483 1.00 0.00 C ATOM 2250 OD1 ASN B 170 8.419 -1.977 -7.408 1.00 0.00 O flip ATOM 2251 ND2 ASN B 170 7.626 -0.269 -8.532 1.00 0.00 N flip ATOM 0 H ASN B 170 5.853 0.645 -6.893 1.00 0.00 H new ATOM 0 HA ASN B 170 6.902 -1.160 -4.985 1.00 0.00 H new ATOM 0 HB2 ASN B 170 8.169 1.173 -6.506 1.00 0.00 H new ATOM 0 HB3 ASN B 170 9.062 -0.105 -5.707 1.00 0.00 H new ATOM 0 HD21 ASN B 170 7.338 0.708 -8.586 1.00 0.00 H new ATOM 0 HD22 ASN B 170 7.562 -0.866 -9.357 1.00 0.00 H new ATOM 2258 N GLN B 171 6.800 1.984 -3.992 1.00 0.00 N ATOM 2259 CA GLN B 171 6.821 2.860 -2.813 1.00 0.00 C ATOM 2260 C GLN B 171 5.733 2.479 -1.795 1.00 0.00 C ATOM 2261 O GLN B 171 6.000 2.462 -0.593 1.00 0.00 O ATOM 2262 CB GLN B 171 6.660 4.321 -3.254 1.00 0.00 C ATOM 2263 CG GLN B 171 7.867 4.864 -4.028 1.00 0.00 C ATOM 2264 CD GLN B 171 7.639 6.308 -4.469 1.00 0.00 C ATOM 2265 OE1 GLN B 171 6.702 6.613 -5.199 1.00 0.00 O ATOM 2266 NE2 GLN B 171 8.458 7.250 -4.043 1.00 0.00 N ATOM 0 H GLN B 171 6.503 2.461 -4.843 1.00 0.00 H new ATOM 0 HA GLN B 171 7.782 2.734 -2.315 1.00 0.00 H new ATOM 0 HB2 GLN B 171 5.770 4.408 -3.877 1.00 0.00 H new ATOM 0 HB3 GLN B 171 6.494 4.942 -2.373 1.00 0.00 H new ATOM 0 HG2 GLN B 171 8.758 4.809 -3.402 1.00 0.00 H new ATOM 0 HG3 GLN B 171 8.052 4.239 -4.902 1.00 0.00 H new ATOM 0 HE21 GLN B 171 9.241 7.009 -3.435 1.00 0.00 H new ATOM 0 HE22 GLN B 171 8.308 8.220 -4.321 1.00 0.00 H new ATOM 2275 N LEU B 172 4.534 2.118 -2.264 1.00 0.00 N ATOM 2276 CA LEU B 172 3.428 1.600 -1.444 1.00 0.00 C ATOM 2277 C LEU B 172 3.793 0.289 -0.736 1.00 0.00 C ATOM 2278 O LEU B 172 3.513 0.146 0.453 1.00 0.00 O ATOM 2279 CB LEU B 172 2.181 1.425 -2.335 1.00 0.00 C ATOM 2280 CG LEU B 172 1.481 2.757 -2.668 1.00 0.00 C ATOM 2281 CD1 LEU B 172 0.597 2.643 -3.909 1.00 0.00 C ATOM 2282 CD2 LEU B 172 0.595 3.170 -1.498 1.00 0.00 C ATOM 0 H LEU B 172 4.297 2.179 -3.254 1.00 0.00 H new ATOM 0 HA LEU B 172 3.216 2.321 -0.655 1.00 0.00 H new ATOM 0 HB2 LEU B 172 2.472 0.933 -3.263 1.00 0.00 H new ATOM 0 HB3 LEU B 172 1.473 0.766 -1.833 1.00 0.00 H new ATOM 0 HG LEU B 172 2.260 3.495 -2.857 1.00 0.00 H new ATOM 0 HD11 LEU B 172 0.123 3.604 -4.108 1.00 0.00 H new ATOM 0 HD12 LEU B 172 1.207 2.356 -4.765 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -0.171 1.888 -3.741 1.00 0.00 H new ATOM 0 HD21 LEU B 172 0.099 4.112 -1.732 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -0.155 2.399 -1.320 1.00 0.00 H new ATOM 0 HD23 LEU B 172 1.207 3.294 -0.604 1.00 0.00 H new ATOM 2294 N MET B 173 4.475 -0.639 -1.415 1.00 0.00 N ATOM 2295 CA MET B 173 5.072 -1.816 -0.767 1.00 0.00 C ATOM 2296 C MET B 173 6.109 -1.408 0.291 1.00 0.00 C ATOM 2297 O MET B 173 6.035 -1.868 1.427 1.00 0.00 O ATOM 2298 CB MET B 173 5.712 -2.746 -1.811 1.00 0.00 C ATOM 2299 CG MET B 173 4.701 -3.735 -2.394 1.00 0.00 C ATOM 2300 SD MET B 173 5.413 -5.027 -3.452 1.00 0.00 S ATOM 2301 CE MET B 173 5.623 -4.125 -5.008 1.00 0.00 C ATOM 0 H MET B 173 4.629 -0.598 -2.422 1.00 0.00 H new ATOM 0 HA MET B 173 4.271 -2.356 -0.263 1.00 0.00 H new ATOM 0 HB2 MET B 173 6.139 -2.148 -2.616 1.00 0.00 H new ATOM 0 HB3 MET B 173 6.533 -3.296 -1.352 1.00 0.00 H new ATOM 0 HG2 MET B 173 4.168 -4.213 -1.572 1.00 0.00 H new ATOM 0 HG3 MET B 173 3.963 -3.179 -2.972 1.00 0.00 H new ATOM 0 HE1 MET B 173 5.795 -4.833 -5.819 1.00 0.00 H new ATOM 0 HE2 MET B 173 4.724 -3.546 -5.217 1.00 0.00 H new ATOM 0 HE3 MET B 173 6.477 -3.453 -4.926 1.00 0.00 H new ATOM 2311 N ALA B 174 7.054 -0.529 -0.054 1.00 0.00 N ATOM 2312 CA ALA B 174 8.167 -0.177 0.823 1.00 0.00 C ATOM 2313 C ALA B 174 7.747 0.573 2.105 1.00 0.00 C ATOM 2314 O ALA B 174 8.190 0.205 3.194 1.00 0.00 O ATOM 2315 CB ALA B 174 9.188 0.619 0.004 1.00 0.00 C ATOM 0 H ALA B 174 7.066 -0.043 -0.951 1.00 0.00 H new ATOM 0 HA ALA B 174 8.612 -1.101 1.191 1.00 0.00 H new ATOM 0 HB1 ALA B 174 10.030 0.893 0.640 1.00 0.00 H new ATOM 0 HB2 ALA B 174 9.544 0.009 -0.826 1.00 0.00 H new ATOM 0 HB3 ALA B 174 8.718 1.522 -0.385 1.00 0.00 H new ATOM 2321 N LEU B 175 6.862 1.577 2.011 1.00 0.00 N ATOM 2322 CA LEU B 175 6.386 2.330 3.178 1.00 0.00 C ATOM 2323 C LEU B 175 5.598 1.431 4.145 1.00 0.00 C ATOM 2324 O LEU B 175 5.788 1.518 5.358 1.00 0.00 O ATOM 2325 CB LEU B 175 5.609 3.596 2.729 1.00 0.00 C ATOM 2326 CG LEU B 175 4.124 3.423 2.334 1.00 0.00 C ATOM 2327 CD1 LEU B 175 3.171 3.649 3.516 1.00 0.00 C ATOM 2328 CD2 LEU B 175 3.715 4.428 1.261 1.00 0.00 C ATOM 0 H LEU B 175 6.458 1.888 1.127 1.00 0.00 H new ATOM 0 HA LEU B 175 7.247 2.682 3.747 1.00 0.00 H new ATOM 0 HB2 LEU B 175 5.659 4.325 3.538 1.00 0.00 H new ATOM 0 HB3 LEU B 175 6.135 4.028 1.878 1.00 0.00 H new ATOM 0 HG LEU B 175 4.044 2.397 1.974 1.00 0.00 H new ATOM 0 HD11 LEU B 175 2.141 3.515 3.184 1.00 0.00 H new ATOM 0 HD12 LEU B 175 3.394 2.931 4.305 1.00 0.00 H new ATOM 0 HD13 LEU B 175 3.300 4.661 3.899 1.00 0.00 H new ATOM 0 HD21 LEU B 175 2.666 4.280 1.005 1.00 0.00 H new ATOM 0 HD22 LEU B 175 3.858 5.441 1.638 1.00 0.00 H new ATOM 0 HD23 LEU B 175 4.329 4.282 0.372 1.00 0.00 H new ATOM 2340 N ALA B 176 4.767 0.525 3.612 1.00 0.00 N ATOM 2341 CA ALA B 176 3.988 -0.438 4.385 1.00 0.00 C ATOM 2342 C ALA B 176 4.883 -1.464 5.105 1.00 0.00 C ATOM 2343 O ALA B 176 4.666 -1.759 6.282 1.00 0.00 O ATOM 2344 CB ALA B 176 3.001 -1.113 3.430 1.00 0.00 C ATOM 0 H ALA B 176 4.618 0.444 2.606 1.00 0.00 H new ATOM 0 HA ALA B 176 3.446 0.079 5.177 1.00 0.00 H new ATOM 0 HB1 ALA B 176 2.403 -1.840 3.979 1.00 0.00 H new ATOM 0 HB2 ALA B 176 2.345 -0.360 2.992 1.00 0.00 H new ATOM 0 HB3 ALA B 176 3.551 -1.620 2.637 1.00 0.00 H new ATOM 2350 N LEU B 177 5.925 -1.965 4.431 1.00 0.00 N ATOM 2351 CA LEU B 177 6.910 -2.886 5.007 1.00 0.00 C ATOM 2352 C LEU B 177 7.676 -2.214 6.164 1.00 0.00 C ATOM 2353 O LEU B 177 7.773 -2.781 7.256 1.00 0.00 O ATOM 2354 CB LEU B 177 7.846 -3.365 3.874 1.00 0.00 C ATOM 2355 CG LEU B 177 8.500 -4.754 4.029 1.00 0.00 C ATOM 2356 CD1 LEU B 177 9.441 -4.872 5.227 1.00 0.00 C ATOM 2357 CD2 LEU B 177 7.447 -5.860 4.109 1.00 0.00 C ATOM 0 H LEU B 177 6.110 -1.738 3.454 1.00 0.00 H new ATOM 0 HA LEU B 177 6.414 -3.755 5.439 1.00 0.00 H new ATOM 0 HB2 LEU B 177 7.277 -3.363 2.944 1.00 0.00 H new ATOM 0 HB3 LEU B 177 8.642 -2.629 3.762 1.00 0.00 H new ATOM 0 HG LEU B 177 9.106 -4.876 3.131 1.00 0.00 H new ATOM 0 HD11 LEU B 177 9.858 -5.878 5.264 1.00 0.00 H new ATOM 0 HD12 LEU B 177 10.249 -4.147 5.128 1.00 0.00 H new ATOM 0 HD13 LEU B 177 8.888 -4.675 6.145 1.00 0.00 H new ATOM 0 HD21 LEU B 177 7.941 -6.826 4.218 1.00 0.00 H new ATOM 0 HD22 LEU B 177 6.800 -5.685 4.968 1.00 0.00 H new ATOM 0 HD23 LEU B 177 6.849 -5.859 3.198 1.00 0.00 H new ATOM 2369 N LYS B 178 8.140 -0.968 5.969 1.00 0.00 N ATOM 2370 CA LYS B 178 8.844 -0.190 7.007 1.00 0.00 C ATOM 2371 C LYS B 178 7.981 0.047 8.248 1.00 0.00 C ATOM 2372 O LYS B 178 8.411 -0.290 9.354 1.00 0.00 O ATOM 2373 CB LYS B 178 9.371 1.133 6.428 1.00 0.00 C ATOM 2374 CG LYS B 178 10.615 0.909 5.557 1.00 0.00 C ATOM 2375 CD LYS B 178 11.194 2.241 5.061 1.00 0.00 C ATOM 2376 CE LYS B 178 12.473 1.961 4.265 1.00 0.00 C ATOM 2377 NZ LYS B 178 13.139 3.202 3.814 1.00 0.00 N1+ ATOM 0 H LYS B 178 8.038 -0.469 5.085 1.00 0.00 H new ATOM 0 HA LYS B 178 9.696 -0.786 7.335 1.00 0.00 H new ATOM 0 HB2 LYS B 178 8.590 1.608 5.834 1.00 0.00 H new ATOM 0 HB3 LYS B 178 9.613 1.817 7.242 1.00 0.00 H new ATOM 0 HG2 LYS B 178 11.371 0.372 6.130 1.00 0.00 H new ATOM 0 HG3 LYS B 178 10.356 0.282 4.704 1.00 0.00 H new ATOM 0 HD2 LYS B 178 10.467 2.759 4.436 1.00 0.00 H new ATOM 0 HD3 LYS B 178 11.411 2.895 5.905 1.00 0.00 H new ATOM 0 HE2 LYS B 178 13.163 1.385 4.882 1.00 0.00 H new ATOM 0 HE3 LYS B 178 12.231 1.346 3.398 1.00 0.00 H new ATOM 0 HZ1 LYS B 178 13.989 2.960 3.266 1.00 0.00 H new ATOM 0 HZ2 LYS B 178 12.486 3.749 3.217 1.00 0.00 H new ATOM 0 HZ3 LYS B 178 13.411 3.771 4.641 1.00 0.00 H new ATOM 2391 N LEU B 179 6.755 0.566 8.086 1.00 0.00 N ATOM 2392 CA LEU B 179 5.889 0.869 9.234 1.00 0.00 C ATOM 2393 C LEU B 179 5.407 -0.392 9.971 1.00 0.00 C ATOM 2394 O LEU B 179 5.179 -0.323 11.185 1.00 0.00 O ATOM 2395 CB LEU B 179 4.757 1.836 8.838 1.00 0.00 C ATOM 2396 CG LEU B 179 3.664 1.307 7.895 1.00 0.00 C ATOM 2397 CD1 LEU B 179 2.528 0.567 8.612 1.00 0.00 C ATOM 2398 CD2 LEU B 179 3.019 2.482 7.157 1.00 0.00 C ATOM 0 H LEU B 179 6.343 0.783 7.178 1.00 0.00 H new ATOM 0 HA LEU B 179 6.495 1.395 9.972 1.00 0.00 H new ATOM 0 HB2 LEU B 179 4.274 2.179 9.753 1.00 0.00 H new ATOM 0 HB3 LEU B 179 5.210 2.710 8.370 1.00 0.00 H new ATOM 0 HG LEU B 179 4.167 0.606 7.229 1.00 0.00 H new ATOM 0 HD11 LEU B 179 1.797 0.225 7.879 1.00 0.00 H new ATOM 0 HD12 LEU B 179 2.934 -0.291 9.148 1.00 0.00 H new ATOM 0 HD13 LEU B 179 2.044 1.241 9.319 1.00 0.00 H new ATOM 0 HD21 LEU B 179 2.244 2.110 6.488 1.00 0.00 H new ATOM 0 HD22 LEU B 179 2.576 3.167 7.880 1.00 0.00 H new ATOM 0 HD23 LEU B 179 3.777 3.008 6.577 1.00 0.00 H new ATOM 2410 N LYS B 180 5.297 -1.544 9.289 1.00 0.00 N ATOM 2411 CA LYS B 180 5.014 -2.849 9.913 1.00 0.00 C ATOM 2412 C LYS B 180 6.207 -3.378 10.715 1.00 0.00 C ATOM 2413 O LYS B 180 6.034 -3.835 11.845 1.00 0.00 O ATOM 2414 CB LYS B 180 4.573 -3.858 8.832 1.00 0.00 C ATOM 2415 CG LYS B 180 4.105 -5.186 9.453 1.00 0.00 C ATOM 2416 CD LYS B 180 3.587 -6.166 8.397 1.00 0.00 C ATOM 2417 CE LYS B 180 3.018 -7.410 9.102 1.00 0.00 C ATOM 2418 NZ LYS B 180 2.565 -8.433 8.129 1.00 0.00 N1+ ATOM 0 H LYS B 180 5.403 -1.597 8.276 1.00 0.00 H new ATOM 0 HA LYS B 180 4.201 -2.714 10.626 1.00 0.00 H new ATOM 0 HB2 LYS B 180 3.765 -3.428 8.240 1.00 0.00 H new ATOM 0 HB3 LYS B 180 5.402 -4.047 8.150 1.00 0.00 H new ATOM 0 HG2 LYS B 180 4.932 -5.643 9.996 1.00 0.00 H new ATOM 0 HG3 LYS B 180 3.317 -4.988 10.180 1.00 0.00 H new ATOM 0 HD2 LYS B 180 2.816 -5.692 7.790 1.00 0.00 H new ATOM 0 HD3 LYS B 180 4.393 -6.452 7.722 1.00 0.00 H new ATOM 0 HE2 LYS B 180 3.779 -7.839 9.753 1.00 0.00 H new ATOM 0 HE3 LYS B 180 2.182 -7.118 9.738 1.00 0.00 H new ATOM 0 HZ1 LYS B 180 1.778 -8.976 8.537 1.00 0.00 H new ATOM 0 HZ2 LYS B 180 2.247 -7.965 7.256 1.00 0.00 H new ATOM 0 HZ3 LYS B 180 3.352 -9.076 7.910 1.00 0.00 H new ATOM 2432 N GLN B 181 7.414 -3.291 10.154 1.00 0.00 N ATOM 2433 CA GLN B 181 8.634 -3.840 10.753 1.00 0.00 C ATOM 2434 C GLN B 181 9.004 -3.145 12.071 1.00 0.00 C ATOM 2435 O GLN B 181 9.449 -3.793 13.016 1.00 0.00 O ATOM 2436 CB GLN B 181 9.771 -3.751 9.718 1.00 0.00 C ATOM 2437 CG GLN B 181 11.103 -4.332 10.223 1.00 0.00 C ATOM 2438 CD GLN B 181 12.067 -4.668 9.089 1.00 0.00 C ATOM 2439 OE1 GLN B 181 12.492 -5.806 8.911 1.00 0.00 O ATOM 2440 NE2 GLN B 181 12.428 -3.717 8.249 1.00 0.00 N ATOM 0 H GLN B 181 7.575 -2.831 9.258 1.00 0.00 H new ATOM 0 HA GLN B 181 8.461 -4.884 11.015 1.00 0.00 H new ATOM 0 HB2 GLN B 181 9.472 -4.281 8.814 1.00 0.00 H new ATOM 0 HB3 GLN B 181 9.920 -2.707 9.441 1.00 0.00 H new ATOM 0 HG2 GLN B 181 11.575 -3.616 10.895 1.00 0.00 H new ATOM 0 HG3 GLN B 181 10.905 -5.232 10.804 1.00 0.00 H new ATOM 0 HE21 GLN B 181 12.086 -2.765 8.379 1.00 0.00 H new ATOM 0 HE22 GLN B 181 13.049 -3.934 7.469 1.00 0.00 H new ATOM 2449 N GLN B 182 8.783 -1.828 12.146 1.00 0.00 N ATOM 2450 CA GLN B 182 9.049 -1.030 13.348 1.00 0.00 C ATOM 2451 C GLN B 182 7.923 -1.088 14.402 1.00 0.00 C ATOM 2452 O GLN B 182 8.216 -0.951 15.590 1.00 0.00 O ATOM 2453 CB GLN B 182 9.402 0.411 12.929 1.00 0.00 C ATOM 2454 CG GLN B 182 8.247 1.209 12.290 1.00 0.00 C ATOM 2455 CD GLN B 182 7.356 1.931 13.306 1.00 0.00 C ATOM 2456 OE1 GLN B 182 7.816 2.584 14.236 1.00 0.00 O ATOM 2457 NE2 GLN B 182 6.050 1.845 13.164 1.00 0.00 N ATOM 0 H GLN B 182 8.412 -1.282 11.369 1.00 0.00 H new ATOM 0 HA GLN B 182 9.904 -1.473 13.860 1.00 0.00 H new ATOM 0 HB2 GLN B 182 9.754 0.952 13.807 1.00 0.00 H new ATOM 0 HB3 GLN B 182 10.232 0.374 12.223 1.00 0.00 H new ATOM 0 HG2 GLN B 182 8.663 1.943 11.600 1.00 0.00 H new ATOM 0 HG3 GLN B 182 7.632 0.530 11.700 1.00 0.00 H new ATOM 0 HE21 GLN B 182 5.655 1.305 12.394 1.00 0.00 H new ATOM 0 HE22 GLN B 182 5.433 2.319 13.824 1.00 0.00 H new