USER MOD reduce.3.24.130724 H: found=0, std=0, add=802, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 802 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 396 HIS : no HD1:sc= -2.94! K(o=-3.1!,f=-4.6) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 149:sc= -0.163 (180deg=-0.955) USER MOD Set 2.1: A 386 THR OG1 : rot -170:sc= -1.48 USER MOD Set 2.2: A 389 LYS NZ :NH3+ 158:sc= 1.2 (180deg=0.591) USER MOD Set 3.1: A 343 GLN : amide:sc= -2.6! K(o=-2.6!,f=-0.97) USER MOD Set 3.2: A 350 TYR OH : rot 180:sc= 0 USER MOD Single : A 340 TYR OH : rot 121:sc= 0.431 USER MOD Single : A 342 TYR OH : rot 122:sc= -0.817 USER MOD Single : A 346 SER OG : rot 180:sc= 0 USER MOD Single : A 348 SER OG : rot 180:sc= 0.171 USER MOD Single : A 352 ASN : amide:sc= 0.0367 X(o=0.037,f=-0.00013) USER MOD Single : A 359 LYS NZ :NH3+ -172:sc=-0.00159 (180deg=-0.0671) USER MOD Single : A 361 SER OG : rot 79:sc= 0.673 USER MOD Single : A 362 LYS NZ :NH3+ -162:sc= 0.152 (180deg=-0.175) USER MOD Single : A 370 ASN : amide:sc= -0.0434 X(o=-0.043,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.187 K(o=-0.19,f=-0.84) USER MOD Single : A 379 HIS : no HD1:sc= -0.584 X(o=-0.58,f=-0.12) USER MOD Single : A 380 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 387 TYR OH : rot 180:sc=-0.00493 USER MOD Single : A 390 MET CE :methyl -159:sc= -0.471 (180deg=-1.06) USER MOD Single : A 391 SER OG : rot -36:sc= 1.25 USER MOD Single : A 397 TYR OH : rot 60:sc= -1.59! USER MOD Single : A 398 TYR OH : rot -14:sc= 0.333 USER MOD Single : A 401 ASN : amide:sc= -0.0452 K(o=-0.045,f=-1.2!) USER MOD Single : A 405 LYS NZ :NH3+ 172:sc= 1.01 (180deg=0.76) USER MOD Single : A 409 GLN : amide:sc= -4.23! C(o=-4.2!,f=-2.5!) USER MOD Single : A 416 MET CE :methyl -171:sc= -0.931 (180deg=-0.952) USER MOD Single : A 417 LYS NZ :NH3+ -110:sc= -2.99! (180deg=-3.64!) USER MOD Single : A 418 THR OG1 : rot -77:sc= 1.26 USER MOD Single : A 423 MET CE :methyl 132:sc= -0.31 (180deg=-1.02) USER MOD Single : A 424 SER OG : rot -56:sc= 0.286 USER MOD Single : A 427 THR OG1 : rot -47:sc= -0.747 USER MOD ----------------------------------------------------------------- ATOM 56 N ARG A 335 -8.019 -2.660 6.645 1.00 0.40 N ATOM 57 CA ARG A 335 -6.928 -1.875 6.088 1.00 0.32 C ATOM 58 C ARG A 335 -7.045 -1.800 4.580 1.00 0.28 C ATOM 59 O ARG A 335 -7.328 -2.804 3.924 1.00 0.42 O ATOM 60 CB ARG A 335 -5.579 -2.474 6.454 1.00 0.37 C ATOM 61 CG ARG A 335 -5.339 -2.547 7.940 1.00 0.56 C ATOM 62 CD ARG A 335 -3.884 -2.808 8.223 1.00 0.93 C ATOM 63 NE ARG A 335 -3.561 -2.651 9.638 1.00 1.32 N ATOM 64 CZ ARG A 335 -3.408 -3.664 10.489 1.00 2.05 C ATOM 65 NH1 ARG A 335 -3.601 -4.917 10.086 1.00 2.81 N ATOM 66 NH2 ARG A 335 -3.072 -3.419 11.745 1.00 2.51 N ATOM 0 HA ARG A 335 -6.996 -0.872 6.510 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.509 -3.477 6.033 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.789 -1.879 5.995 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -5.646 -1.613 8.411 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -5.949 -3.339 8.375 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.629 -3.819 7.904 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.273 -2.124 7.634 1.00 0.93 H new ATOM 0 HE ARG A 335 -3.445 -1.704 9.998 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -3.868 -5.107 9.120 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -3.482 -5.688 10.743 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -2.932 -2.458 12.057 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -2.953 -4.191 12.401 1.00 2.51 H new ATOM 80 N LEU A 336 -6.835 -0.604 4.045 1.00 0.23 N ATOM 81 CA LEU A 336 -6.742 -0.403 2.604 1.00 0.28 C ATOM 82 C LEU A 336 -5.459 -1.023 2.107 1.00 0.14 C ATOM 83 O LEU A 336 -4.688 -1.543 2.899 1.00 0.20 O ATOM 84 CB LEU A 336 -6.731 1.086 2.242 1.00 0.48 C ATOM 85 CG LEU A 336 -8.022 1.866 2.482 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.472 2.505 1.192 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.108 0.974 3.030 1.00 0.67 C ATOM 0 H LEU A 336 -6.725 0.249 4.593 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.612 -0.867 2.140 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -5.934 1.567 2.809 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.471 1.177 1.187 1.00 0.48 H new ATOM 0 HG LEU A 336 -7.824 2.641 3.223 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.393 3.062 1.364 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.699 3.185 0.834 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.649 1.731 0.445 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.014 1.559 3.190 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.314 0.173 2.320 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -8.782 0.544 3.977 1.00 0.67 H new ATOM 99 N LEU A 337 -5.197 -0.947 0.818 1.00 0.15 N ATOM 100 CA LEU A 337 -3.956 -1.487 0.301 1.00 0.12 C ATOM 101 C LEU A 337 -2.787 -0.709 0.897 1.00 0.11 C ATOM 102 O LEU A 337 -1.839 -1.296 1.415 1.00 0.12 O ATOM 103 CB LEU A 337 -3.956 -1.442 -1.233 1.00 0.14 C ATOM 104 CG LEU A 337 -2.752 -2.054 -1.940 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.670 -1.022 -2.083 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.228 -3.265 -1.191 1.00 0.15 C ATOM 0 H LEU A 337 -5.812 -0.526 0.122 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.852 -2.533 0.590 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.852 -1.951 -1.587 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -4.038 -0.400 -1.542 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.068 -2.387 -2.929 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.811 -1.463 -2.589 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.044 -0.182 -2.668 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.369 -0.671 -1.096 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.370 -3.678 -1.721 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.926 -2.969 -0.187 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -3.012 -4.020 -1.126 1.00 0.15 H new ATOM 118 N TRP A 338 -2.890 0.614 0.888 1.00 0.12 N ATOM 119 CA TRP A 338 -1.859 1.454 1.488 1.00 0.14 C ATOM 120 C TRP A 338 -1.881 1.326 3.015 1.00 0.14 C ATOM 121 O TRP A 338 -0.842 1.411 3.667 1.00 0.17 O ATOM 122 CB TRP A 338 -2.022 2.927 1.060 1.00 0.16 C ATOM 123 CG TRP A 338 -3.296 3.575 1.510 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.420 3.772 0.766 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.574 4.122 2.802 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.379 4.399 1.516 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.885 4.621 2.771 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.841 4.230 3.983 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.480 5.220 3.873 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.430 4.821 5.077 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.742 5.311 5.015 1.00 0.21 C ATOM 0 H TRP A 338 -3.670 1.126 0.476 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.890 1.108 1.127 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.181 3.500 1.452 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.967 2.983 -0.027 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.538 3.476 -0.266 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.310 4.658 1.191 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.829 3.857 4.038 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.490 5.600 3.827 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.873 4.909 5.998 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.177 5.770 5.890 1.00 0.21 H new ATOM 142 N ASP A 339 -3.066 1.098 3.577 1.00 0.14 N ATOM 143 CA ASP A 339 -3.213 0.965 5.027 1.00 0.17 C ATOM 144 C ASP A 339 -2.608 -0.356 5.474 1.00 0.16 C ATOM 145 O ASP A 339 -2.094 -0.496 6.585 1.00 0.23 O ATOM 146 CB ASP A 339 -4.690 1.036 5.428 1.00 0.23 C ATOM 147 CG ASP A 339 -4.876 1.305 6.909 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.244 2.240 7.433 1.00 0.86 O ATOM 149 OD2 ASP A 339 -5.657 0.577 7.554 1.00 1.15 O ATOM 0 H ASP A 339 -3.936 1.002 3.054 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.690 1.787 5.516 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.182 1.822 4.854 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.180 0.098 5.168 1.00 0.23 H new ATOM 154 N TYR A 340 -2.677 -1.314 4.573 1.00 0.11 N ATOM 155 CA TYR A 340 -2.134 -2.637 4.779 1.00 0.10 C ATOM 156 C TYR A 340 -0.611 -2.619 4.725 1.00 0.08 C ATOM 157 O TYR A 340 0.045 -3.214 5.579 1.00 0.09 O ATOM 158 CB TYR A 340 -2.680 -3.568 3.708 1.00 0.11 C ATOM 159 CG TYR A 340 -2.387 -5.006 3.980 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.707 -5.560 5.204 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.790 -5.806 3.026 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.442 -6.877 5.477 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.522 -7.130 3.285 1.00 0.14 C ATOM 164 CZ TYR A 340 -1.849 -7.665 4.515 1.00 0.16 C ATOM 165 OH TYR A 340 -1.579 -8.987 4.787 1.00 0.20 O ATOM 0 H TYR A 340 -3.120 -1.191 3.662 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.430 -2.990 5.767 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.759 -3.431 3.631 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.254 -3.292 2.743 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.174 -4.945 5.959 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.530 -5.387 2.065 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.696 -7.294 6.440 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.058 -7.748 2.530 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.045 -9.556 4.139 1.00 0.20 H new ATOM 175 N VAL A 341 -0.047 -1.931 3.729 1.00 0.08 N ATOM 176 CA VAL A 341 1.406 -1.893 3.574 1.00 0.07 C ATOM 177 C VAL A 341 2.050 -1.311 4.820 1.00 0.08 C ATOM 178 O VAL A 341 3.131 -1.718 5.196 1.00 0.08 O ATOM 179 CB VAL A 341 1.882 -1.094 2.329 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.080 -1.459 1.100 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.861 0.410 2.551 1.00 0.09 C ATOM 0 H VAL A 341 -0.566 -1.401 3.029 1.00 0.08 H new ATOM 0 HA VAL A 341 1.719 -2.927 3.425 1.00 0.07 H new ATOM 0 HB VAL A 341 2.921 -1.379 2.165 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.438 -0.882 0.247 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.195 -2.523 0.893 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.027 -1.235 1.273 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.203 0.916 1.648 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.845 0.729 2.783 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.520 0.664 3.381 1.00 0.09 H new ATOM 191 N TYR A 342 1.366 -0.368 5.457 1.00 0.08 N ATOM 192 CA TYR A 342 1.841 0.210 6.718 1.00 0.10 C ATOM 193 C TYR A 342 2.081 -0.867 7.769 1.00 0.11 C ATOM 194 O TYR A 342 3.092 -0.850 8.470 1.00 0.14 O ATOM 195 CB TYR A 342 0.843 1.222 7.278 1.00 0.11 C ATOM 196 CG TYR A 342 1.132 2.647 6.889 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.247 3.296 7.396 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.298 3.344 6.029 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.525 4.604 7.052 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.571 4.647 5.682 1.00 0.19 C ATOM 201 CZ TYR A 342 1.687 5.272 6.192 1.00 0.17 C ATOM 202 OH TYR A 342 1.959 6.576 5.845 1.00 0.21 O ATOM 0 H TYR A 342 0.481 0.015 5.125 1.00 0.08 H new ATOM 0 HA TYR A 342 2.781 0.713 6.493 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.157 0.958 6.935 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.837 1.147 8.365 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.908 2.771 8.070 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.578 2.858 5.626 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.396 5.099 7.456 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.088 5.178 5.011 1.00 0.19 H new ATOM 0 HH TYR A 342 2.042 6.645 4.871 1.00 0.21 H new ATOM 212 N GLN A 343 1.152 -1.810 7.863 1.00 0.12 N ATOM 213 CA GLN A 343 1.228 -2.855 8.864 1.00 0.18 C ATOM 214 C GLN A 343 2.359 -3.804 8.502 1.00 0.18 C ATOM 215 O GLN A 343 3.052 -4.341 9.364 1.00 0.25 O ATOM 216 CB GLN A 343 -0.120 -3.590 8.937 1.00 0.28 C ATOM 217 CG GLN A 343 -0.176 -4.899 8.176 1.00 0.55 C ATOM 218 CD GLN A 343 -0.077 -6.100 9.091 1.00 0.99 C ATOM 219 OE1 GLN A 343 -1.088 -6.665 9.503 1.00 1.40 O ATOM 220 NE2 GLN A 343 1.136 -6.461 9.456 1.00 1.15 N ATOM 0 H GLN A 343 0.336 -1.869 7.254 1.00 0.12 H new ATOM 0 HA GLN A 343 1.435 -2.430 9.846 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.355 -3.785 9.983 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.898 -2.930 8.553 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.108 -4.950 7.613 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.637 -4.930 7.450 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.948 -5.964 9.089 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.263 -7.237 10.105 1.00 1.15 H new ATOM 229 N LEU A 344 2.529 -3.995 7.206 1.00 0.15 N ATOM 230 CA LEU A 344 3.561 -4.862 6.679 1.00 0.16 C ATOM 231 C LEU A 344 4.927 -4.195 6.796 1.00 0.18 C ATOM 232 O LEU A 344 5.946 -4.847 6.996 1.00 0.27 O ATOM 233 CB LEU A 344 3.245 -5.155 5.217 1.00 0.13 C ATOM 234 CG LEU A 344 1.843 -5.696 4.961 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.570 -5.744 3.481 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.677 -7.073 5.562 1.00 0.18 C ATOM 0 H LEU A 344 1.953 -3.551 6.490 1.00 0.15 H new ATOM 0 HA LEU A 344 3.588 -5.791 7.249 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.376 -4.239 4.641 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.971 -5.875 4.840 1.00 0.13 H new ATOM 0 HG LEU A 344 1.127 -5.026 5.437 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.566 -6.132 3.309 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.648 -4.740 3.064 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.298 -6.395 2.998 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.668 -7.437 5.366 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.402 -7.754 5.116 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.841 -7.022 6.638 1.00 0.18 H new ATOM 248 N LEU A 345 4.903 -2.882 6.674 1.00 0.12 N ATOM 249 CA LEU A 345 6.095 -2.046 6.688 1.00 0.13 C ATOM 250 C LEU A 345 6.761 -2.048 8.051 1.00 0.19 C ATOM 251 O LEU A 345 7.987 -2.085 8.158 1.00 0.29 O ATOM 252 CB LEU A 345 5.697 -0.615 6.317 1.00 0.10 C ATOM 253 CG LEU A 345 6.130 -0.130 4.929 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.438 -1.297 4.016 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.055 0.757 4.308 1.00 0.10 C ATOM 0 H LEU A 345 4.039 -2.353 6.560 1.00 0.12 H new ATOM 0 HA LEU A 345 6.808 -2.446 5.967 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.612 -0.532 6.386 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.116 0.061 7.062 1.00 0.10 H new ATOM 0 HG LEU A 345 7.040 0.458 5.051 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.742 -0.924 3.038 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.245 -1.891 4.445 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.549 -1.918 3.906 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.383 1.090 3.323 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.128 0.191 4.210 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.885 1.624 4.947 1.00 0.10 H new ATOM 267 N SER A 346 5.948 -1.999 9.089 1.00 0.25 N ATOM 268 CA SER A 346 6.453 -1.901 10.442 1.00 0.33 C ATOM 269 C SER A 346 6.764 -3.270 11.053 1.00 0.30 C ATOM 270 O SER A 346 7.322 -3.348 12.149 1.00 0.53 O ATOM 271 CB SER A 346 5.465 -1.129 11.294 1.00 0.51 C ATOM 272 OG SER A 346 5.471 0.251 10.960 1.00 1.43 O ATOM 0 H SER A 346 4.931 -2.026 9.019 1.00 0.25 H new ATOM 0 HA SER A 346 7.401 -1.363 10.411 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.464 -1.536 11.154 1.00 0.51 H new ATOM 0 HB3 SER A 346 5.715 -1.252 12.348 1.00 0.51 H new ATOM 0 HG SER A 346 4.824 0.726 11.522 1.00 1.43 H new ATOM 278 N ASP A 347 6.424 -4.351 10.352 1.00 0.32 N ATOM 279 CA ASP A 347 6.710 -5.692 10.860 1.00 0.32 C ATOM 280 C ASP A 347 7.697 -6.419 9.958 1.00 0.30 C ATOM 281 O ASP A 347 7.594 -6.403 8.734 1.00 0.30 O ATOM 282 CB ASP A 347 5.422 -6.503 11.009 1.00 0.35 C ATOM 283 CG ASP A 347 5.561 -7.651 11.997 1.00 0.49 C ATOM 284 OD1 ASP A 347 6.701 -8.114 12.220 1.00 0.58 O ATOM 285 OD2 ASP A 347 4.537 -8.111 12.547 1.00 0.67 O ATOM 0 H ASP A 347 5.958 -4.327 9.445 1.00 0.32 H new ATOM 0 HA ASP A 347 7.165 -5.586 11.845 1.00 0.32 H new ATOM 0 HB2 ASP A 347 4.618 -5.843 11.336 1.00 0.35 H new ATOM 0 HB3 ASP A 347 5.133 -6.900 10.036 1.00 0.35 H new ATOM 290 N SER A 348 8.630 -7.090 10.598 1.00 0.34 N ATOM 291 CA SER A 348 9.787 -7.665 9.944 1.00 0.35 C ATOM 292 C SER A 348 9.461 -8.909 9.130 1.00 0.31 C ATOM 293 O SER A 348 10.126 -9.200 8.139 1.00 0.32 O ATOM 294 CB SER A 348 10.797 -7.996 11.018 1.00 0.46 C ATOM 295 OG SER A 348 10.169 -8.055 12.292 1.00 1.53 O ATOM 0 H SER A 348 8.606 -7.254 11.604 1.00 0.34 H new ATOM 0 HA SER A 348 10.178 -6.939 9.231 1.00 0.35 H new ATOM 0 HB2 SER A 348 11.273 -8.951 10.796 1.00 0.46 H new ATOM 0 HB3 SER A 348 11.585 -7.243 11.029 1.00 0.46 H new ATOM 0 HG SER A 348 10.836 -8.272 12.976 1.00 1.53 H new ATOM 301 N ARG A 349 8.451 -9.650 9.544 1.00 0.33 N ATOM 302 CA ARG A 349 8.079 -10.876 8.838 1.00 0.35 C ATOM 303 C ARG A 349 7.657 -10.592 7.394 1.00 0.29 C ATOM 304 O ARG A 349 7.610 -11.498 6.564 1.00 0.34 O ATOM 305 CB ARG A 349 6.957 -11.611 9.560 1.00 0.42 C ATOM 306 CG ARG A 349 5.612 -10.940 9.433 1.00 0.55 C ATOM 307 CD ARG A 349 5.030 -10.634 10.787 1.00 0.59 C ATOM 308 NE ARG A 349 4.628 -11.840 11.502 1.00 1.23 N ATOM 309 CZ ARG A 349 4.141 -11.842 12.740 1.00 1.67 C ATOM 310 NH1 ARG A 349 4.003 -10.699 13.407 1.00 1.93 N ATOM 311 NH2 ARG A 349 3.792 -12.991 13.308 1.00 2.56 N ATOM 0 H ARG A 349 7.874 -9.433 10.357 1.00 0.33 H new ATOM 0 HA ARG A 349 8.966 -11.509 8.822 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.886 -12.625 9.166 1.00 0.42 H new ATOM 0 HB3 ARG A 349 7.212 -11.697 10.616 1.00 0.42 H new ATOM 0 HG2 ARG A 349 5.715 -10.018 8.861 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.931 -11.585 8.878 1.00 0.55 H new ATOM 0 HD2 ARG A 349 5.764 -10.090 11.381 1.00 0.59 H new ATOM 0 HD3 ARG A 349 4.167 -9.979 10.669 1.00 0.59 H new ATOM 0 HE ARG A 349 4.726 -12.736 11.024 1.00 1.23 H new ATOM 0 HH11 ARG A 349 4.271 -9.818 12.969 1.00 1.93 H new ATOM 0 HH12 ARG A 349 3.629 -10.704 14.356 1.00 1.93 H new ATOM 0 HH21 ARG A 349 3.898 -13.866 12.795 1.00 2.56 H new ATOM 0 HH22 ARG A 349 3.418 -12.998 14.257 1.00 2.56 H new ATOM 325 N TYR A 350 7.336 -9.337 7.099 1.00 0.22 N ATOM 326 CA TYR A 350 6.886 -8.966 5.769 1.00 0.17 C ATOM 327 C TYR A 350 7.954 -8.186 5.026 1.00 0.16 C ATOM 328 O TYR A 350 7.765 -7.830 3.867 1.00 0.15 O ATOM 329 CB TYR A 350 5.637 -8.102 5.843 1.00 0.17 C ATOM 330 CG TYR A 350 4.586 -8.598 6.789 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.855 -9.738 6.513 1.00 0.24 C ATOM 332 CD2 TYR A 350 4.301 -7.895 7.939 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.864 -10.166 7.357 1.00 0.29 C ATOM 334 CE2 TYR A 350 3.319 -8.314 8.798 1.00 0.28 C ATOM 335 CZ TYR A 350 2.595 -9.451 8.508 1.00 0.31 C ATOM 336 OH TYR A 350 1.603 -9.861 9.367 1.00 0.39 O ATOM 0 H TYR A 350 7.380 -8.564 7.763 1.00 0.22 H new ATOM 0 HA TYR A 350 6.670 -9.893 5.237 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.926 -7.094 6.140 1.00 0.17 H new ATOM 0 HB3 TYR A 350 5.203 -8.029 4.846 1.00 0.17 H new ATOM 0 HD1 TYR A 350 4.069 -10.301 5.617 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.860 -7.000 8.167 1.00 0.23 H new ATOM 0 HE1 TYR A 350 2.298 -11.056 7.124 1.00 0.29 H new ATOM 0 HE2 TYR A 350 3.113 -7.756 9.699 1.00 0.28 H new ATOM 0 HH TYR A 350 1.551 -9.243 10.125 1.00 0.39 H new ATOM 346 N GLU A 351 9.080 -7.931 5.682 1.00 0.18 N ATOM 347 CA GLU A 351 10.119 -7.080 5.104 1.00 0.21 C ATOM 348 C GLU A 351 10.777 -7.748 3.895 1.00 0.21 C ATOM 349 O GLU A 351 11.601 -7.145 3.204 1.00 0.24 O ATOM 350 CB GLU A 351 11.166 -6.706 6.150 1.00 0.28 C ATOM 351 CG GLU A 351 12.127 -7.825 6.469 1.00 0.48 C ATOM 352 CD GLU A 351 13.215 -7.401 7.427 1.00 0.99 C ATOM 353 OE1 GLU A 351 14.022 -6.525 7.061 1.00 1.05 O ATOM 354 OE2 GLU A 351 13.273 -7.949 8.547 1.00 1.78 O ATOM 0 H GLU A 351 9.298 -8.297 6.609 1.00 0.18 H new ATOM 0 HA GLU A 351 9.639 -6.164 4.760 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.730 -5.844 5.795 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.660 -6.401 7.066 1.00 0.28 H new ATOM 0 HG2 GLU A 351 11.575 -8.661 6.899 1.00 0.48 H new ATOM 0 HG3 GLU A 351 12.581 -8.184 5.545 1.00 0.48 H new ATOM 361 N ASN A 352 10.419 -9.004 3.657 1.00 0.19 N ATOM 362 CA ASN A 352 10.854 -9.718 2.465 1.00 0.21 C ATOM 363 C ASN A 352 9.915 -9.416 1.299 1.00 0.16 C ATOM 364 O ASN A 352 10.272 -9.595 0.144 1.00 0.18 O ATOM 365 CB ASN A 352 10.893 -11.221 2.740 1.00 0.27 C ATOM 366 CG ASN A 352 11.419 -12.040 1.571 1.00 1.03 C ATOM 367 OD1 ASN A 352 12.627 -12.227 1.426 1.00 1.83 O ATOM 368 ND2 ASN A 352 10.519 -12.559 0.746 1.00 1.62 N ATOM 0 H ASN A 352 9.824 -9.551 4.279 1.00 0.19 H new ATOM 0 HA ASN A 352 11.857 -9.385 2.199 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.519 -11.406 3.613 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.888 -11.563 2.989 1.00 0.27 H new ATOM 0 HD21 ASN A 352 10.820 -13.135 -0.040 1.00 1.62 H new ATOM 0 HD22 ASN A 352 9.526 -12.382 0.898 1.00 1.62 H new ATOM 375 N PHE A 353 8.710 -8.960 1.621 1.00 0.13 N ATOM 376 CA PHE A 353 7.718 -8.608 0.616 1.00 0.10 C ATOM 377 C PHE A 353 7.638 -7.095 0.430 1.00 0.08 C ATOM 378 O PHE A 353 7.320 -6.608 -0.653 1.00 0.07 O ATOM 379 CB PHE A 353 6.342 -9.132 1.028 1.00 0.09 C ATOM 380 CG PHE A 353 6.293 -10.612 1.282 1.00 0.12 C ATOM 381 CD1 PHE A 353 6.966 -11.498 0.462 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.575 -11.111 2.351 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.924 -12.856 0.703 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.530 -12.468 2.601 1.00 0.17 C ATOM 385 CZ PHE A 353 6.206 -13.342 1.773 1.00 0.18 C ATOM 0 H PHE A 353 8.396 -8.825 2.582 1.00 0.13 H new ATOM 0 HA PHE A 353 8.022 -9.065 -0.326 1.00 0.10 H new ATOM 0 HB2 PHE A 353 6.023 -8.610 1.930 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.624 -8.886 0.246 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.532 -11.123 -0.378 1.00 0.17 H new ATOM 0 HD2 PHE A 353 5.042 -10.431 2.999 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.454 -13.537 0.053 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.967 -12.845 3.442 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.172 -14.404 1.964 1.00 0.18 H new ATOM 395 N ILE A 354 7.940 -6.356 1.484 1.00 0.08 N ATOM 396 CA ILE A 354 7.824 -4.903 1.477 1.00 0.07 C ATOM 397 C ILE A 354 8.552 -4.346 2.694 1.00 0.08 C ATOM 398 O ILE A 354 8.649 -5.021 3.713 1.00 0.10 O ATOM 399 CB ILE A 354 6.337 -4.474 1.495 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.164 -3.005 1.104 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.728 -4.732 2.863 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.720 -2.546 1.109 1.00 0.07 C ATOM 0 H ILE A 354 8.272 -6.743 2.368 1.00 0.08 H new ATOM 0 HA ILE A 354 8.274 -4.508 0.567 1.00 0.07 H new ATOM 0 HB ILE A 354 5.813 -5.076 0.753 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.737 -2.384 1.792 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.583 -2.850 0.110 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.682 -4.425 2.859 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.793 -5.795 3.096 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.271 -4.161 3.616 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.671 -1.495 0.823 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.146 -3.143 0.400 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.302 -2.669 2.108 1.00 0.07 H new ATOM 414 N ARG A 355 9.081 -3.142 2.595 1.00 0.09 N ATOM 415 CA ARG A 355 9.866 -2.586 3.694 1.00 0.11 C ATOM 416 C ARG A 355 9.955 -1.072 3.595 1.00 0.10 C ATOM 417 O ARG A 355 9.927 -0.512 2.502 1.00 0.14 O ATOM 418 CB ARG A 355 11.282 -3.167 3.672 1.00 0.16 C ATOM 419 CG ARG A 355 12.142 -2.586 2.564 1.00 0.22 C ATOM 420 CD ARG A 355 13.527 -3.193 2.539 1.00 0.25 C ATOM 421 NE ARG A 355 14.421 -2.448 1.660 1.00 0.98 N ATOM 422 CZ ARG A 355 15.466 -2.971 1.033 1.00 1.40 C ATOM 423 NH1 ARG A 355 15.766 -4.258 1.179 1.00 1.43 N ATOM 424 NH2 ARG A 355 16.211 -2.195 0.261 1.00 2.08 N ATOM 0 H ARG A 355 8.988 -2.534 1.781 1.00 0.09 H new ATOM 0 HA ARG A 355 9.366 -2.850 4.626 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.761 -2.980 4.633 1.00 0.16 H new ATOM 0 HB3 ARG A 355 11.224 -4.249 3.550 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.656 -2.754 1.603 1.00 0.22 H new ATOM 0 HG3 ARG A 355 12.222 -1.507 2.696 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.937 -3.208 3.549 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.466 -4.229 2.204 1.00 0.25 H new ATOM 0 HE ARG A 355 14.229 -1.456 1.518 1.00 0.98 H new ATOM 0 HH11 ARG A 355 15.191 -4.851 1.777 1.00 1.43 H new ATOM 0 HH12 ARG A 355 16.572 -4.652 0.693 1.00 1.43 H new ATOM 0 HH21 ARG A 355 15.978 -1.208 0.154 1.00 2.08 H new ATOM 0 HH22 ARG A 355 17.018 -2.585 -0.227 1.00 2.08 H new ATOM 438 N TRP A 356 10.053 -0.414 4.740 1.00 0.10 N ATOM 439 CA TRP A 356 10.363 1.003 4.769 1.00 0.09 C ATOM 440 C TRP A 356 11.777 1.241 4.259 1.00 0.09 C ATOM 441 O TRP A 356 12.730 0.624 4.735 1.00 0.14 O ATOM 442 CB TRP A 356 10.283 1.566 6.184 1.00 0.10 C ATOM 443 CG TRP A 356 8.907 1.745 6.739 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.420 1.190 7.884 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.854 2.554 6.203 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.136 1.615 8.106 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.764 2.446 7.085 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.722 3.354 5.066 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.570 3.116 6.871 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.532 4.018 4.852 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.469 3.897 5.750 1.00 0.13 C ATOM 0 H TRP A 356 9.922 -0.839 5.658 1.00 0.10 H new ATOM 0 HA TRP A 356 9.630 1.502 4.135 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.839 0.905 6.849 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.788 2.532 6.199 1.00 0.10 H new ATOM 0 HD1 TRP A 356 8.967 0.513 8.524 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.554 1.354 8.902 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.538 3.451 4.366 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.747 3.026 7.564 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.421 4.641 3.977 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.549 4.430 5.557 1.00 0.13 H new ATOM 462 N GLU A 357 11.901 2.125 3.293 1.00 0.10 N ATOM 463 CA GLU A 357 13.200 2.613 2.866 1.00 0.12 C ATOM 464 C GLU A 357 13.546 3.832 3.702 1.00 0.14 C ATOM 465 O GLU A 357 14.695 4.047 4.089 1.00 0.21 O ATOM 466 CB GLU A 357 13.165 2.976 1.392 1.00 0.16 C ATOM 467 CG GLU A 357 12.968 1.778 0.482 1.00 0.25 C ATOM 468 CD GLU A 357 14.245 1.008 0.205 1.00 0.36 C ATOM 469 OE1 GLU A 357 14.600 0.128 1.012 1.00 0.61 O ATOM 470 OE2 GLU A 357 14.882 1.264 -0.843 1.00 0.78 O ATOM 0 H GLU A 357 11.113 2.525 2.783 1.00 0.10 H new ATOM 0 HA GLU A 357 13.956 1.840 3.004 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.360 3.690 1.220 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.096 3.476 1.126 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.239 1.105 0.934 1.00 0.25 H new ATOM 0 HG3 GLU A 357 12.546 2.117 -0.464 1.00 0.25 H new ATOM 477 N ASP A 358 12.514 4.615 3.977 1.00 0.14 N ATOM 478 CA ASP A 358 12.598 5.753 4.879 1.00 0.16 C ATOM 479 C ASP A 358 11.275 5.900 5.613 1.00 0.16 C ATOM 480 O ASP A 358 10.348 6.520 5.102 1.00 0.20 O ATOM 481 CB ASP A 358 12.860 7.048 4.121 1.00 0.20 C ATOM 482 CG ASP A 358 13.607 8.054 4.971 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.039 8.523 5.978 1.00 1.46 O ATOM 484 OD2 ASP A 358 14.757 8.394 4.625 1.00 1.33 O ATOM 0 H ASP A 358 11.586 4.477 3.576 1.00 0.14 H new ATOM 0 HA ASP A 358 13.421 5.574 5.570 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.436 6.833 3.221 1.00 0.20 H new ATOM 0 HB3 ASP A 358 11.912 7.478 3.797 1.00 0.20 H new ATOM 489 N LYS A 359 11.187 5.330 6.802 1.00 0.15 N ATOM 490 CA LYS A 359 9.943 5.318 7.565 1.00 0.17 C ATOM 491 C LYS A 359 9.430 6.720 7.856 1.00 0.19 C ATOM 492 O LYS A 359 8.237 6.999 7.734 1.00 0.23 O ATOM 493 CB LYS A 359 10.158 4.572 8.870 1.00 0.23 C ATOM 494 CG LYS A 359 8.906 4.463 9.717 1.00 0.29 C ATOM 495 CD LYS A 359 8.970 3.259 10.634 1.00 0.38 C ATOM 496 CE LYS A 359 7.702 3.106 11.449 1.00 0.91 C ATOM 497 NZ LYS A 359 7.501 4.231 12.398 1.00 1.50 N ATOM 0 H LYS A 359 11.967 4.865 7.266 1.00 0.15 H new ATOM 0 HA LYS A 359 9.189 4.815 6.959 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.527 3.570 8.650 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.933 5.078 9.445 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.785 5.369 10.310 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.032 4.385 9.071 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.132 2.359 10.041 1.00 0.38 H new ATOM 0 HD3 LYS A 359 9.824 3.357 11.305 1.00 0.38 H new ATOM 0 HE2 LYS A 359 6.846 3.044 10.777 1.00 0.91 H new ATOM 0 HE3 LYS A 359 7.740 2.168 12.004 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 6.699 4.017 13.025 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.361 4.362 12.968 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 7.302 5.102 11.866 1.00 1.50 H new ATOM 511 N GLU A 360 10.334 7.600 8.236 1.00 0.21 N ATOM 512 CA GLU A 360 9.956 8.944 8.633 1.00 0.27 C ATOM 513 C GLU A 360 9.718 9.845 7.426 1.00 0.24 C ATOM 514 O GLU A 360 9.120 10.910 7.551 1.00 0.37 O ATOM 515 CB GLU A 360 11.009 9.530 9.557 1.00 0.41 C ATOM 516 CG GLU A 360 11.242 8.674 10.788 1.00 0.63 C ATOM 517 CD GLU A 360 12.274 9.258 11.727 1.00 1.75 C ATOM 518 OE1 GLU A 360 13.402 9.549 11.277 1.00 2.67 O ATOM 519 OE2 GLU A 360 11.961 9.426 12.924 1.00 1.97 O ATOM 0 H GLU A 360 11.335 7.410 8.279 1.00 0.21 H new ATOM 0 HA GLU A 360 9.011 8.884 9.174 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.946 9.639 9.012 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.702 10.529 9.866 1.00 0.41 H new ATOM 0 HG2 GLU A 360 10.300 8.552 11.323 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.563 7.680 10.477 1.00 0.63 H new ATOM 526 N SER A 361 10.187 9.415 6.263 1.00 0.19 N ATOM 527 CA SER A 361 9.885 10.099 5.016 1.00 0.21 C ATOM 528 C SER A 361 8.714 9.401 4.328 1.00 0.19 C ATOM 529 O SER A 361 8.264 9.802 3.252 1.00 0.24 O ATOM 530 CB SER A 361 11.126 10.097 4.121 1.00 0.26 C ATOM 531 OG SER A 361 12.201 10.786 4.742 1.00 0.31 O ATOM 0 H SER A 361 10.780 8.592 6.158 1.00 0.19 H new ATOM 0 HA SER A 361 9.604 11.133 5.214 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.423 9.070 3.907 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.891 10.567 3.166 1.00 0.26 H new ATOM 0 HG SER A 361 12.625 10.201 5.404 1.00 0.31 H new ATOM 537 N LYS A 362 8.228 8.349 4.995 1.00 0.15 N ATOM 538 CA LYS A 362 7.137 7.512 4.504 1.00 0.14 C ATOM 539 C LYS A 362 7.466 6.915 3.145 1.00 0.12 C ATOM 540 O LYS A 362 6.618 6.818 2.263 1.00 0.15 O ATOM 541 CB LYS A 362 5.823 8.285 4.470 1.00 0.20 C ATOM 542 CG LYS A 362 5.305 8.604 5.860 1.00 0.48 C ATOM 543 CD LYS A 362 5.204 7.347 6.712 1.00 0.48 C ATOM 544 CE LYS A 362 4.761 7.656 8.135 1.00 0.51 C ATOM 545 NZ LYS A 362 5.723 8.542 8.840 1.00 1.23 N ATOM 0 H LYS A 362 8.588 8.054 5.902 1.00 0.15 H new ATOM 0 HA LYS A 362 7.014 6.684 5.202 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.964 9.213 3.916 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.076 7.703 3.931 1.00 0.20 H new ATOM 0 HG2 LYS A 362 5.969 9.321 6.343 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.325 9.076 5.786 1.00 0.48 H new ATOM 0 HD2 LYS A 362 4.497 6.655 6.255 1.00 0.48 H new ATOM 0 HD3 LYS A 362 6.172 6.846 6.734 1.00 0.48 H new ATOM 0 HE2 LYS A 362 3.780 8.131 8.114 1.00 0.51 H new ATOM 0 HE3 LYS A 362 4.652 6.725 8.691 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.561 8.484 9.866 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 6.695 8.240 8.626 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 5.588 9.523 8.523 1.00 1.23 H new ATOM 559 N ILE A 363 8.709 6.503 3.005 1.00 0.09 N ATOM 560 CA ILE A 363 9.193 5.880 1.793 1.00 0.09 C ATOM 561 C ILE A 363 9.354 4.392 2.023 1.00 0.08 C ATOM 562 O ILE A 363 9.943 3.979 3.021 1.00 0.10 O ATOM 563 CB ILE A 363 10.550 6.476 1.382 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.384 7.943 0.994 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.166 5.672 0.245 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.680 8.717 0.998 1.00 0.46 C ATOM 0 H ILE A 363 9.416 6.592 3.735 1.00 0.09 H new ATOM 0 HA ILE A 363 8.472 6.061 0.996 1.00 0.09 H new ATOM 0 HB ILE A 363 11.230 6.423 2.232 1.00 0.10 H new ATOM 0 HG12 ILE A 363 9.939 8.000 0.001 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.685 8.416 1.684 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.125 6.109 -0.032 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.316 4.642 0.568 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.498 5.689 -0.616 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.487 9.751 0.713 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.116 8.691 1.997 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.374 8.268 0.287 1.00 0.46 H new ATOM 578 N PHE A 364 8.851 3.589 1.111 1.00 0.09 N ATOM 579 CA PHE A 364 8.932 2.157 1.254 1.00 0.09 C ATOM 580 C PHE A 364 9.232 1.515 -0.089 1.00 0.10 C ATOM 581 O PHE A 364 8.917 2.061 -1.144 1.00 0.13 O ATOM 582 CB PHE A 364 7.633 1.591 1.843 1.00 0.09 C ATOM 583 CG PHE A 364 6.478 1.572 0.893 1.00 0.08 C ATOM 584 CD1 PHE A 364 5.630 2.650 0.808 1.00 0.13 C ATOM 585 CD2 PHE A 364 6.241 0.467 0.099 1.00 0.12 C ATOM 586 CE1 PHE A 364 4.555 2.638 -0.062 1.00 0.14 C ATOM 587 CE2 PHE A 364 5.171 0.441 -0.774 1.00 0.12 C ATOM 588 CZ PHE A 364 4.325 1.526 -0.854 1.00 0.08 C ATOM 0 H PHE A 364 8.382 3.906 0.263 1.00 0.09 H new ATOM 0 HA PHE A 364 9.743 1.925 1.944 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.819 0.574 2.190 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.358 2.181 2.718 1.00 0.09 H new ATOM 0 HD1 PHE A 364 5.805 3.517 1.428 1.00 0.13 H new ATOM 0 HD2 PHE A 364 6.900 -0.386 0.161 1.00 0.12 H new ATOM 0 HE1 PHE A 364 3.898 3.493 -0.123 1.00 0.14 H new ATOM 0 HE2 PHE A 364 4.998 -0.427 -1.392 1.00 0.12 H new ATOM 0 HZ PHE A 364 3.485 1.509 -1.533 1.00 0.08 H new ATOM 598 N ARG A 365 9.868 0.374 -0.032 1.00 0.10 N ATOM 599 CA ARG A 365 10.138 -0.431 -1.196 1.00 0.12 C ATOM 600 C ARG A 365 9.299 -1.694 -1.133 1.00 0.11 C ATOM 601 O ARG A 365 9.203 -2.315 -0.072 1.00 0.18 O ATOM 602 CB ARG A 365 11.607 -0.825 -1.195 1.00 0.17 C ATOM 603 CG ARG A 365 12.016 -1.654 -2.388 1.00 0.17 C ATOM 604 CD ARG A 365 12.589 -0.790 -3.483 1.00 0.31 C ATOM 605 NE ARG A 365 13.902 -0.281 -3.088 1.00 0.77 N ATOM 606 CZ ARG A 365 15.045 -0.939 -3.277 1.00 0.63 C ATOM 607 NH1 ARG A 365 15.050 -2.100 -3.921 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.177 -0.439 -2.799 1.00 0.99 N ATOM 0 H ARG A 365 10.218 -0.029 0.837 1.00 0.10 H new ATOM 0 HA ARG A 365 9.899 0.134 -2.097 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.216 0.079 -1.166 1.00 0.17 H new ATOM 0 HB3 ARG A 365 11.823 -1.384 -0.285 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.754 -2.396 -2.083 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.153 -2.201 -2.767 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.676 -1.367 -4.404 1.00 0.31 H new ATOM 0 HD3 ARG A 365 11.916 0.042 -3.690 1.00 0.31 H new ATOM 0 HE ARG A 365 13.945 0.634 -2.640 1.00 0.77 H new ATOM 0 HH11 ARG A 365 14.177 -2.492 -4.273 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.927 -2.600 -4.063 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.169 0.445 -2.290 1.00 0.99 H new ATOM 0 HH22 ARG A 365 17.055 -0.938 -2.941 1.00 0.99 H new ATOM 622 N ILE A 366 8.684 -2.080 -2.234 1.00 0.07 N ATOM 623 CA ILE A 366 8.078 -3.378 -2.296 1.00 0.06 C ATOM 624 C ILE A 366 9.153 -4.383 -2.649 1.00 0.07 C ATOM 625 O ILE A 366 9.677 -4.413 -3.758 1.00 0.10 O ATOM 626 CB ILE A 366 6.899 -3.421 -3.275 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.725 -2.657 -2.655 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.516 -4.861 -3.602 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.617 -2.353 -3.620 1.00 0.09 C ATOM 0 H ILE A 366 8.596 -1.518 -3.080 1.00 0.07 H new ATOM 0 HA ILE A 366 7.651 -3.628 -1.325 1.00 0.06 H new ATOM 0 HB ILE A 366 7.181 -2.948 -4.216 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.322 -3.240 -1.827 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.095 -1.721 -2.236 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.677 -4.865 -4.298 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.367 -5.370 -4.055 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.230 -5.378 -2.686 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.824 -1.811 -3.105 1.00 0.09 H new ATOM 0 HD12 ILE A 366 5.003 -1.742 -4.436 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.218 -3.285 -4.021 1.00 0.09 H new ATOM 641 N VAL A 367 9.505 -5.162 -1.662 1.00 0.07 N ATOM 642 CA VAL A 367 10.656 -6.037 -1.740 1.00 0.08 C ATOM 643 C VAL A 367 10.337 -7.277 -2.561 1.00 0.09 C ATOM 644 O VAL A 367 11.114 -7.686 -3.427 1.00 0.12 O ATOM 645 CB VAL A 367 11.113 -6.412 -0.327 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.269 -7.383 -0.372 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.491 -5.152 0.437 1.00 0.10 C ATOM 0 H VAL A 367 9.003 -5.212 -0.775 1.00 0.07 H new ATOM 0 HA VAL A 367 11.469 -5.513 -2.242 1.00 0.08 H new ATOM 0 HB VAL A 367 10.291 -6.906 0.190 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.574 -7.633 0.644 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.962 -8.290 -0.892 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.106 -6.928 -0.901 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.816 -5.420 1.442 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.302 -4.641 -0.082 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.626 -4.491 0.499 1.00 0.10 H new ATOM 657 N ASP A 368 9.185 -7.856 -2.294 1.00 0.08 N ATOM 658 CA ASP A 368 8.680 -8.958 -3.090 1.00 0.09 C ATOM 659 C ASP A 368 7.183 -8.796 -3.267 1.00 0.08 C ATOM 660 O ASP A 368 6.381 -9.216 -2.437 1.00 0.09 O ATOM 661 CB ASP A 368 9.004 -10.302 -2.460 1.00 0.12 C ATOM 662 CG ASP A 368 8.745 -11.458 -3.404 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.565 -11.706 -3.727 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.709 -12.136 -3.813 1.00 0.78 O ATOM 0 H ASP A 368 8.575 -7.579 -1.525 1.00 0.08 H new ATOM 0 HA ASP A 368 9.170 -8.937 -4.064 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.050 -10.314 -2.153 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.406 -10.431 -1.558 1.00 0.12 H new ATOM 669 N PRO A 369 6.814 -8.142 -4.359 1.00 0.09 N ATOM 670 CA PRO A 369 5.430 -7.803 -4.688 1.00 0.10 C ATOM 671 C PRO A 369 4.527 -9.023 -4.803 1.00 0.12 C ATOM 672 O PRO A 369 3.347 -8.970 -4.460 1.00 0.14 O ATOM 673 CB PRO A 369 5.555 -7.097 -6.041 1.00 0.12 C ATOM 674 CG PRO A 369 6.888 -7.484 -6.567 1.00 0.12 C ATOM 675 CD PRO A 369 7.753 -7.671 -5.371 1.00 0.10 C ATOM 0 HA PRO A 369 4.969 -7.196 -3.909 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.760 -7.406 -6.720 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.476 -6.016 -5.929 1.00 0.12 H new ATOM 0 HG2 PRO A 369 6.827 -8.401 -7.153 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.289 -6.712 -7.224 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.546 -8.396 -5.555 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.236 -6.740 -5.072 1.00 0.10 H new ATOM 683 N ASN A 370 5.092 -10.117 -5.278 1.00 0.13 N ATOM 684 CA ASN A 370 4.354 -11.361 -5.431 1.00 0.17 C ATOM 685 C ASN A 370 3.977 -11.898 -4.061 1.00 0.17 C ATOM 686 O ASN A 370 2.848 -12.336 -3.827 1.00 0.21 O ATOM 687 CB ASN A 370 5.223 -12.368 -6.169 1.00 0.21 C ATOM 688 CG ASN A 370 4.412 -13.395 -6.926 1.00 0.36 C ATOM 689 OD1 ASN A 370 3.982 -13.155 -8.053 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.244 -14.563 -6.339 1.00 0.59 N ATOM 0 H ASN A 370 6.069 -10.171 -5.567 1.00 0.13 H new ATOM 0 HA ASN A 370 3.443 -11.185 -6.003 1.00 0.17 H new ATOM 0 HB2 ASN A 370 5.873 -11.839 -6.866 1.00 0.21 H new ATOM 0 HB3 ASN A 370 5.869 -12.877 -5.454 1.00 0.21 H new ATOM 0 HD21 ASN A 370 3.741 -15.308 -6.821 1.00 0.59 H new ATOM 0 HD22 ASN A 370 4.617 -14.722 -5.403 1.00 0.59 H new ATOM 697 N GLY A 371 4.942 -11.836 -3.162 1.00 0.16 N ATOM 698 CA GLY A 371 4.714 -12.200 -1.782 1.00 0.19 C ATOM 699 C GLY A 371 3.796 -11.221 -1.078 1.00 0.13 C ATOM 700 O GLY A 371 3.022 -11.598 -0.198 1.00 0.13 O ATOM 0 H GLY A 371 5.895 -11.535 -3.368 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.280 -13.199 -1.738 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.668 -12.244 -1.257 1.00 0.19 H new ATOM 704 N LEU A 372 3.873 -9.965 -1.488 1.00 0.10 N ATOM 705 CA LEU A 372 3.150 -8.894 -0.819 1.00 0.08 C ATOM 706 C LEU A 372 1.682 -8.957 -1.203 1.00 0.11 C ATOM 707 O LEU A 372 0.791 -8.757 -0.383 1.00 0.13 O ATOM 708 CB LEU A 372 3.747 -7.536 -1.209 1.00 0.08 C ATOM 709 CG LEU A 372 3.555 -6.406 -0.191 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.122 -5.908 -0.165 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.947 -6.887 1.190 1.00 0.09 C ATOM 0 H LEU A 372 4.432 -9.661 -2.285 1.00 0.10 H new ATOM 0 HA LEU A 372 3.240 -9.014 0.261 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.815 -7.666 -1.382 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.306 -7.225 -2.156 1.00 0.08 H new ATOM 0 HG LEU A 372 4.194 -5.577 -0.494 1.00 0.08 H new ATOM 0 HD11 LEU A 372 2.028 -5.108 0.569 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.850 -5.530 -1.151 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.457 -6.728 0.105 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.809 -6.080 1.909 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.322 -7.735 1.471 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.993 -7.193 1.185 1.00 0.09 H new ATOM 723 N ALA A 373 1.444 -9.246 -2.463 1.00 0.12 N ATOM 724 CA ALA A 373 0.099 -9.334 -2.982 1.00 0.15 C ATOM 725 C ALA A 373 -0.632 -10.536 -2.413 1.00 0.14 C ATOM 726 O ALA A 373 -1.852 -10.513 -2.258 1.00 0.16 O ATOM 727 CB ALA A 373 0.139 -9.408 -4.481 1.00 0.20 C ATOM 0 H ALA A 373 2.174 -9.426 -3.153 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.446 -8.440 -2.679 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.877 -9.474 -4.869 1.00 0.20 H new ATOM 0 HB2 ALA A 373 0.621 -8.514 -4.877 1.00 0.20 H new ATOM 0 HB3 ALA A 373 0.702 -10.290 -4.787 1.00 0.20 H new ATOM 733 N ARG A 374 0.111 -11.592 -2.111 1.00 0.14 N ATOM 734 CA ARG A 374 -0.479 -12.745 -1.461 1.00 0.17 C ATOM 735 C ARG A 374 -0.903 -12.362 -0.049 1.00 0.14 C ATOM 736 O ARG A 374 -1.864 -12.901 0.480 1.00 0.16 O ATOM 737 CB ARG A 374 0.467 -13.947 -1.464 1.00 0.24 C ATOM 738 CG ARG A 374 1.243 -14.140 -0.191 1.00 0.28 C ATOM 739 CD ARG A 374 2.147 -15.354 -0.293 1.00 0.47 C ATOM 740 NE ARG A 374 2.887 -15.374 -1.553 1.00 1.44 N ATOM 741 CZ ARG A 374 4.150 -15.776 -1.677 1.00 2.04 C ATOM 742 NH1 ARG A 374 4.844 -16.171 -0.619 1.00 2.01 N ATOM 743 NH2 ARG A 374 4.717 -15.783 -2.872 1.00 3.03 N ATOM 0 H ARG A 374 1.109 -11.671 -2.304 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.361 -13.053 -2.023 1.00 0.17 H new ATOM 0 HB2 ARG A 374 -0.114 -14.848 -1.659 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.171 -13.836 -2.289 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.840 -13.252 0.015 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.555 -14.262 0.645 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.849 -15.356 0.541 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.549 -16.261 -0.208 1.00 0.47 H new ATOM 0 HE ARG A 374 2.403 -15.059 -2.394 1.00 1.44 H new ATOM 0 HH11 ARG A 374 4.411 -16.169 0.305 1.00 2.01 H new ATOM 0 HH12 ARG A 374 5.811 -16.477 -0.728 1.00 2.01 H new ATOM 0 HH21 ARG A 374 4.187 -15.482 -3.690 1.00 3.03 H new ATOM 0 HH22 ARG A 374 5.684 -16.090 -2.976 1.00 3.03 H new ATOM 757 N LEU A 375 -0.185 -11.409 0.546 1.00 0.13 N ATOM 758 CA LEU A 375 -0.597 -10.812 1.814 1.00 0.15 C ATOM 759 C LEU A 375 -1.893 -10.049 1.607 1.00 0.16 C ATOM 760 O LEU A 375 -2.837 -10.175 2.381 1.00 0.18 O ATOM 761 CB LEU A 375 0.470 -9.840 2.313 1.00 0.17 C ATOM 762 CG LEU A 375 1.492 -10.363 3.317 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.878 -11.799 3.035 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.720 -9.483 3.256 1.00 0.15 C ATOM 0 H LEU A 375 0.685 -11.034 0.169 1.00 0.13 H new ATOM 0 HA LEU A 375 -0.735 -11.605 2.549 1.00 0.15 H new ATOM 0 HB2 LEU A 375 1.014 -9.465 1.446 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.038 -8.988 2.764 1.00 0.17 H new ATOM 0 HG LEU A 375 1.046 -10.336 4.311 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.608 -12.131 3.774 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.992 -12.431 3.090 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.313 -11.870 2.038 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.462 -9.844 3.969 1.00 0.15 H new ATOM 0 HD22 LEU A 375 3.139 -9.512 2.250 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.446 -8.458 3.505 1.00 0.15 H new ATOM 776 N TRP A 376 -1.919 -9.260 0.544 1.00 0.16 N ATOM 777 CA TRP A 376 -3.081 -8.463 0.194 1.00 0.18 C ATOM 778 C TRP A 376 -4.307 -9.351 0.009 1.00 0.20 C ATOM 779 O TRP A 376 -5.366 -9.100 0.588 1.00 0.25 O ATOM 780 CB TRP A 376 -2.795 -7.679 -1.081 1.00 0.19 C ATOM 781 CG TRP A 376 -3.812 -6.622 -1.396 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.250 -6.257 -2.636 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.507 -5.779 -0.467 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.179 -5.254 -2.532 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.348 -4.940 -1.218 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.504 -5.649 0.925 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.170 -3.992 -0.632 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.319 -4.699 1.505 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.143 -3.885 0.724 1.00 0.24 C ATOM 0 H TRP A 376 -1.134 -9.155 -0.099 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.289 -7.765 1.005 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.815 -7.209 -0.993 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.741 -8.376 -1.918 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.914 -6.695 -3.564 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.665 -4.814 -3.313 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -3.875 -6.281 1.535 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.810 -3.360 -1.230 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.320 -4.583 2.579 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.773 -3.154 1.208 1.00 0.24 H new ATOM 800 N GLY A 377 -4.157 -10.394 -0.794 1.00 0.21 N ATOM 801 CA GLY A 377 -5.228 -11.346 -0.979 1.00 0.27 C ATOM 802 C GLY A 377 -5.533 -12.116 0.290 1.00 0.30 C ATOM 803 O GLY A 377 -6.667 -12.508 0.513 1.00 0.38 O ATOM 0 H GLY A 377 -3.308 -10.597 -1.322 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.125 -10.822 -1.309 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -4.958 -12.045 -1.771 1.00 0.27 H new ATOM 807 N ASN A 378 -4.517 -12.337 1.113 1.00 0.27 N ATOM 808 CA ASN A 378 -4.699 -12.981 2.411 1.00 0.30 C ATOM 809 C ASN A 378 -5.558 -12.123 3.332 1.00 0.30 C ATOM 810 O ASN A 378 -6.450 -12.622 4.021 1.00 0.35 O ATOM 811 CB ASN A 378 -3.349 -13.245 3.058 1.00 0.32 C ATOM 812 CG ASN A 378 -2.884 -14.673 2.862 1.00 0.38 C ATOM 813 OD1 ASN A 378 -3.675 -15.616 2.900 1.00 0.76 O ATOM 814 ND2 ASN A 378 -1.598 -14.829 2.623 1.00 0.42 N ATOM 0 H ASN A 378 -3.552 -12.079 0.905 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.212 -13.929 2.250 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.609 -12.564 2.638 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.412 -13.029 4.125 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.219 -15.762 2.460 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -0.981 -14.017 2.601 1.00 0.42 H new ATOM 821 N HIS A 379 -5.277 -10.828 3.328 1.00 0.28 N ATOM 822 CA HIS A 379 -6.011 -9.863 4.133 1.00 0.30 C ATOM 823 C HIS A 379 -7.462 -9.756 3.676 1.00 0.32 C ATOM 824 O HIS A 379 -8.383 -9.832 4.489 1.00 0.38 O ATOM 825 CB HIS A 379 -5.317 -8.496 4.055 1.00 0.28 C ATOM 826 CG HIS A 379 -6.062 -7.370 4.710 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.031 -7.175 6.069 1.00 0.43 N ATOM 828 CD2 HIS A 379 -6.820 -6.401 4.142 1.00 0.31 C ATOM 829 CE1 HIS A 379 -6.767 -6.098 6.294 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.264 -5.593 5.154 1.00 0.38 N ATOM 0 H HIS A 379 -4.532 -10.416 2.765 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.017 -10.204 5.168 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.333 -8.578 4.516 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.158 -8.245 3.006 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.034 -6.288 3.089 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -6.945 -5.678 7.273 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -7.857 -4.768 5.060 1.00 0.38 H new ATOM 838 N LYS A 380 -7.665 -9.596 2.373 1.00 0.32 N ATOM 839 CA LYS A 380 -9.007 -9.408 1.834 1.00 0.36 C ATOM 840 C LYS A 380 -9.688 -10.750 1.557 1.00 0.41 C ATOM 841 O LYS A 380 -10.843 -10.804 1.134 1.00 0.45 O ATOM 842 CB LYS A 380 -8.954 -8.564 0.559 1.00 0.36 C ATOM 843 CG LYS A 380 -8.085 -7.323 0.692 1.00 0.38 C ATOM 844 CD LYS A 380 -8.508 -6.227 -0.268 1.00 0.63 C ATOM 845 CE LYS A 380 -8.439 -6.685 -1.708 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.793 -5.587 -2.658 1.00 0.77 N ATOM 0 H LYS A 380 -6.922 -9.593 1.674 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.599 -8.881 2.582 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.576 -9.178 -0.259 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -9.966 -8.263 0.289 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -8.140 -6.950 1.715 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.044 -7.587 0.504 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -9.525 -5.912 -0.035 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -7.866 -5.357 -0.132 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.434 -7.045 -1.927 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.117 -7.525 -1.855 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -8.734 -5.940 -3.634 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.762 -5.260 -2.466 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -8.130 -4.795 -2.536 1.00 0.77 H new ATOM 943 N THR A 386 -3.540 -10.231 -7.112 1.00 0.23 N ATOM 944 CA THR A 386 -2.166 -10.293 -7.550 1.00 0.24 C ATOM 945 C THR A 386 -1.494 -8.947 -7.352 1.00 0.16 C ATOM 946 O THR A 386 -2.141 -7.994 -6.906 1.00 0.18 O ATOM 947 CB THR A 386 -2.068 -10.710 -9.028 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.500 -9.642 -9.881 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.930 -11.932 -9.287 1.00 0.44 C ATOM 0 HA THR A 386 -1.657 -11.046 -6.948 1.00 0.24 H new ATOM 0 HB THR A 386 -1.026 -10.945 -9.245 1.00 0.33 H new ATOM 0 HG1 THR A 386 -2.583 -9.971 -10.800 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.852 -12.217 -10.336 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.590 -12.757 -8.661 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.969 -11.701 -9.050 1.00 0.44 H new ATOM 957 N TYR A 387 -0.215 -8.848 -7.678 1.00 0.16 N ATOM 958 CA TYR A 387 0.466 -7.570 -7.549 1.00 0.13 C ATOM 959 C TYR A 387 -0.112 -6.578 -8.543 1.00 0.14 C ATOM 960 O TYR A 387 -0.121 -5.372 -8.296 1.00 0.17 O ATOM 961 CB TYR A 387 1.975 -7.669 -7.745 1.00 0.15 C ATOM 962 CG TYR A 387 2.619 -6.327 -7.512 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.519 -5.718 -6.269 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.265 -5.637 -8.532 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.045 -4.474 -6.044 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.790 -4.380 -8.313 1.00 0.14 C ATOM 967 CZ TYR A 387 3.678 -3.802 -7.066 1.00 0.12 C ATOM 968 OH TYR A 387 4.191 -2.545 -6.847 1.00 0.13 O ATOM 0 H TYR A 387 0.360 -9.615 -8.025 1.00 0.16 H new ATOM 0 HA TYR A 387 0.301 -7.229 -6.527 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.391 -8.405 -7.057 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.196 -8.016 -8.754 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.017 -6.235 -5.464 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.357 -6.091 -9.508 1.00 0.14 H new ATOM 0 HE1 TYR A 387 2.964 -4.021 -5.067 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.286 -3.852 -9.114 1.00 0.14 H new ATOM 0 HH TYR A 387 4.605 -2.213 -7.671 1.00 0.13 H new ATOM 978 N GLU A 388 -0.615 -7.088 -9.660 1.00 0.17 N ATOM 979 CA GLU A 388 -1.264 -6.242 -10.639 1.00 0.24 C ATOM 980 C GLU A 388 -2.438 -5.530 -9.986 1.00 0.25 C ATOM 981 O GLU A 388 -2.589 -4.317 -10.108 1.00 0.31 O ATOM 982 CB GLU A 388 -1.737 -7.063 -11.834 1.00 0.30 C ATOM 983 CG GLU A 388 -2.594 -6.278 -12.797 1.00 0.44 C ATOM 984 CD GLU A 388 -4.034 -6.737 -12.817 1.00 1.53 C ATOM 985 OE1 GLU A 388 -4.329 -7.733 -13.501 1.00 1.96 O ATOM 986 OE2 GLU A 388 -4.875 -6.115 -12.142 1.00 2.21 O ATOM 0 H GLU A 388 -0.584 -8.078 -9.905 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.549 -5.504 -11.002 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.868 -7.452 -12.365 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.302 -7.923 -11.474 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.559 -5.222 -12.528 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -2.177 -6.366 -13.800 1.00 0.44 H new ATOM 993 N LYS A 389 -3.239 -6.298 -9.259 1.00 0.23 N ATOM 994 CA LYS A 389 -4.381 -5.757 -8.535 1.00 0.28 C ATOM 995 C LYS A 389 -3.930 -4.712 -7.519 1.00 0.28 C ATOM 996 O LYS A 389 -4.553 -3.661 -7.374 1.00 0.40 O ATOM 997 CB LYS A 389 -5.162 -6.875 -7.827 1.00 0.32 C ATOM 998 CG LYS A 389 -6.060 -7.703 -8.744 1.00 0.45 C ATOM 999 CD LYS A 389 -5.267 -8.451 -9.801 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.182 -9.180 -10.773 1.00 0.46 C ATOM 1001 NZ LYS A 389 -5.454 -9.634 -11.986 1.00 1.39 N ATOM 0 H LYS A 389 -3.117 -7.305 -9.155 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.040 -5.280 -9.261 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.452 -7.542 -7.337 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.776 -6.431 -7.043 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.628 -8.416 -8.146 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.783 -7.048 -9.230 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.637 -7.750 -10.349 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.602 -9.167 -9.319 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -6.629 -10.040 -10.275 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -6.999 -8.521 -11.066 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -5.975 -10.416 -12.431 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -5.374 -8.845 -12.658 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -4.503 -9.959 -11.719 1.00 1.39 H new ATOM 1015 N MET A 390 -2.831 -5.004 -6.830 1.00 0.19 N ATOM 1016 CA MET A 390 -2.255 -4.077 -5.862 1.00 0.17 C ATOM 1017 C MET A 390 -1.783 -2.798 -6.543 1.00 0.16 C ATOM 1018 O MET A 390 -2.006 -1.698 -6.040 1.00 0.17 O ATOM 1019 CB MET A 390 -1.081 -4.725 -5.127 1.00 0.15 C ATOM 1020 CG MET A 390 -0.426 -3.797 -4.123 1.00 0.14 C ATOM 1021 SD MET A 390 0.985 -4.541 -3.289 1.00 0.18 S ATOM 1022 CE MET A 390 1.481 -3.187 -2.228 1.00 1.57 C ATOM 0 H MET A 390 -2.319 -5.881 -6.925 1.00 0.19 H new ATOM 0 HA MET A 390 -3.035 -3.826 -5.143 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.431 -5.620 -4.612 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.337 -5.047 -5.855 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.102 -2.890 -4.633 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.164 -3.498 -3.379 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.521 -3.321 -1.929 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.377 -2.245 -2.767 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.848 -3.169 -1.341 1.00 1.57 H new ATOM 1032 N SER A 391 -1.125 -2.941 -7.688 1.00 0.15 N ATOM 1033 CA SER A 391 -0.604 -1.789 -8.403 1.00 0.17 C ATOM 1034 C SER A 391 -1.743 -0.892 -8.890 1.00 0.19 C ATOM 1035 O SER A 391 -1.591 0.324 -8.933 1.00 0.21 O ATOM 1036 CB SER A 391 0.299 -2.223 -9.567 1.00 0.23 C ATOM 1037 OG SER A 391 -0.430 -2.870 -10.594 1.00 1.02 O ATOM 0 H SER A 391 -0.942 -3.839 -8.136 1.00 0.15 H new ATOM 0 HA SER A 391 0.007 -1.209 -7.711 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.805 -1.349 -9.978 1.00 0.23 H new ATOM 0 HB3 SER A 391 1.073 -2.894 -9.194 1.00 0.23 H new ATOM 0 HG SER A 391 -1.141 -3.415 -10.197 1.00 1.02 H new ATOM 1043 N ARG A 392 -2.891 -1.494 -9.227 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.084 -0.727 -9.600 1.00 0.26 C ATOM 1045 C ARG A 392 -4.406 0.267 -8.506 1.00 0.22 C ATOM 1046 O ARG A 392 -4.560 1.465 -8.747 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.295 -1.634 -9.767 1.00 0.38 C ATOM 1048 CG ARG A 392 -5.078 -2.810 -10.685 1.00 1.12 C ATOM 1049 CD ARG A 392 -5.144 -2.416 -12.151 1.00 2.05 C ATOM 1050 NE ARG A 392 -5.198 -3.594 -13.012 1.00 2.61 N ATOM 1051 CZ ARG A 392 -5.539 -3.570 -14.298 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -5.818 -2.420 -14.901 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -5.601 -4.706 -14.979 1.00 4.06 N ATOM 0 H ARG A 392 -3.018 -2.506 -9.249 1.00 0.21 H new ATOM 0 HA ARG A 392 -3.872 -0.225 -10.544 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.592 -2.006 -8.786 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -6.126 -1.041 -10.148 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -4.107 -3.258 -10.475 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.831 -3.571 -10.481 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -6.023 -1.795 -12.324 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -4.273 -1.814 -12.408 1.00 2.05 H new ATOM 0 HE ARG A 392 -4.958 -4.496 -12.600 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -5.772 -1.546 -14.378 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -6.078 -2.411 -15.887 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -5.388 -5.590 -14.517 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -5.862 -4.696 -15.965 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.509 -0.268 -7.297 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.770 0.529 -6.115 1.00 0.17 C ATOM 1069 C ALA A 393 -3.734 1.630 -5.959 1.00 0.12 C ATOM 1070 O ALA A 393 -4.076 2.769 -5.658 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.789 -0.359 -4.882 1.00 0.20 C ATOM 0 H ALA A 393 -4.413 -1.267 -7.112 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.746 1.000 -6.228 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.986 0.249 -3.999 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.571 -1.111 -4.987 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.823 -0.853 -4.775 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.472 1.299 -6.210 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.390 2.263 -6.064 1.00 0.10 C ATOM 1079 C LEU A 394 -1.564 3.390 -7.063 1.00 0.11 C ATOM 1080 O LEU A 394 -1.454 4.564 -6.719 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.042 1.576 -6.279 1.00 0.11 C ATOM 1082 CG LEU A 394 0.302 0.505 -5.251 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.513 -0.291 -5.700 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.567 1.150 -3.908 1.00 0.13 C ATOM 0 H LEU A 394 -2.175 0.372 -6.515 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.417 2.675 -5.055 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.035 1.123 -7.270 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.741 2.334 -6.269 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.542 -0.178 -5.157 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.745 -1.052 -4.955 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.299 -0.772 -6.655 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.366 0.378 -5.814 1.00 0.13 H new ATOM 0 HD21 LEU A 394 0.812 0.380 -3.177 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.402 1.845 -3.997 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.322 1.690 -3.582 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.865 3.019 -8.294 1.00 0.12 N ATOM 1097 CA ARG A 395 -2.095 3.981 -9.359 1.00 0.14 C ATOM 1098 C ARG A 395 -3.244 4.914 -9.002 1.00 0.14 C ATOM 1099 O ARG A 395 -3.248 6.082 -9.381 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.405 3.246 -10.658 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.314 2.281 -11.079 1.00 0.33 C ATOM 1102 CD ARG A 395 -0.198 2.976 -11.826 1.00 0.52 C ATOM 1103 NE ARG A 395 0.802 2.028 -12.314 1.00 1.30 N ATOM 1104 CZ ARG A 395 1.536 2.215 -13.408 1.00 1.72 C ATOM 1105 NH1 ARG A 395 1.416 3.337 -14.110 1.00 1.66 N ATOM 1106 NH2 ARG A 395 2.397 1.281 -13.790 1.00 2.64 N ATOM 0 H ARG A 395 -1.957 2.046 -8.584 1.00 0.12 H new ATOM 0 HA ARG A 395 -1.193 4.580 -9.489 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.340 2.698 -10.542 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.560 3.976 -11.452 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -0.907 1.787 -10.197 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.743 1.503 -11.710 1.00 0.33 H new ATOM 0 HD2 ARG A 395 -0.614 3.530 -12.667 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.280 3.703 -11.170 1.00 0.52 H new ATOM 0 HE ARG A 395 0.946 1.169 -11.783 1.00 1.30 H new ATOM 0 HH11 ARG A 395 0.760 4.058 -13.811 1.00 1.66 H new ATOM 0 HH12 ARG A 395 1.980 3.477 -14.948 1.00 1.66 H new ATOM 0 HH21 ARG A 395 2.494 0.424 -13.246 1.00 2.64 H new ATOM 0 HH22 ARG A 395 2.962 1.420 -14.628 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.221 4.392 -8.269 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.349 5.196 -7.832 1.00 0.13 C ATOM 1122 C HIS A 396 -4.935 6.088 -6.669 1.00 0.11 C ATOM 1123 O HIS A 396 -5.362 7.237 -6.569 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.532 4.310 -7.436 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.853 4.973 -7.661 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -8.067 5.759 -8.765 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.977 4.948 -6.909 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.309 6.192 -8.665 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.902 5.728 -7.556 1.00 0.26 N ATOM 0 H HIS A 396 -4.252 3.418 -7.967 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.666 5.826 -8.663 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.494 3.383 -8.008 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.441 4.039 -6.384 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -9.119 4.417 -5.979 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.788 6.839 -9.386 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.857 5.918 -7.252 1.00 0.26 H new ATOM 1137 N TYR A 397 -4.067 5.558 -5.811 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.586 6.289 -4.645 1.00 0.10 C ATOM 1139 C TYR A 397 -2.814 7.532 -5.055 1.00 0.09 C ATOM 1140 O TYR A 397 -2.800 8.525 -4.335 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.697 5.398 -3.769 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.442 4.251 -3.144 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.822 4.273 -3.066 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.772 3.146 -2.646 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.524 3.231 -2.512 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -3.468 2.089 -2.085 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.846 2.138 -2.020 1.00 0.24 C ATOM 1148 OH TYR A 397 -5.544 1.095 -1.455 1.00 0.30 O ATOM 0 H TYR A 397 -3.681 4.618 -5.904 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.460 6.594 -4.070 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.879 5.006 -4.373 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -2.249 6.004 -2.982 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.359 5.128 -3.449 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.694 3.108 -2.696 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.602 3.268 -2.462 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.936 1.231 -1.701 1.00 0.24 H new ATOM 0 HH TYR A 397 -6.158 0.715 -2.118 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.169 7.472 -6.211 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.360 8.591 -6.677 1.00 0.12 C ATOM 1160 C TYR A 398 -2.235 9.813 -6.934 1.00 0.14 C ATOM 1161 O TYR A 398 -1.933 10.915 -6.476 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.604 8.241 -7.962 1.00 0.14 C ATOM 1163 CG TYR A 398 0.250 6.988 -7.898 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.794 6.525 -6.699 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.510 6.266 -9.053 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.569 5.384 -6.664 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.282 5.128 -9.024 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.808 4.691 -7.830 1.00 0.14 C ATOM 1169 OH TYR A 398 2.577 3.556 -7.806 1.00 0.18 O ATOM 0 H TYR A 398 -2.189 6.669 -6.839 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.636 8.813 -5.893 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.328 8.125 -8.768 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.036 9.083 -8.227 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.605 7.068 -5.785 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.099 6.604 -9.993 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.985 5.037 -5.730 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.474 4.580 -9.934 1.00 0.16 H new ATOM 0 HH TYR A 398 3.054 3.502 -6.952 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.327 9.602 -7.663 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.249 10.682 -7.993 1.00 0.19 C ATOM 1181 C LYS A 399 -4.901 11.240 -6.745 1.00 0.19 C ATOM 1182 O LYS A 399 -5.072 12.451 -6.606 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.338 10.203 -8.945 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.867 10.023 -10.378 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.653 8.562 -10.718 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.973 7.809 -10.735 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.797 6.380 -11.107 1.00 0.71 N ATOM 0 H LYS A 399 -3.595 8.691 -8.037 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.665 11.464 -8.478 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.734 9.255 -8.581 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.160 10.918 -8.930 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.602 10.451 -11.059 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.937 10.571 -10.527 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.170 8.478 -11.691 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.981 8.110 -9.989 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -6.439 7.872 -9.752 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.653 8.286 -11.441 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.522 5.806 -10.632 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.892 6.275 -12.137 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.853 6.058 -10.812 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.243 10.349 -5.833 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.950 10.725 -4.627 1.00 0.18 C ATOM 1203 C LEU A 400 -4.988 11.245 -3.568 1.00 0.18 C ATOM 1204 O LEU A 400 -5.334 11.348 -2.393 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.747 9.527 -4.130 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.599 8.878 -5.218 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.247 7.609 -4.712 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.644 9.855 -5.733 1.00 0.21 C ATOM 0 H LEU A 400 -5.040 9.352 -5.908 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.640 11.540 -4.846 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -6.060 8.784 -3.725 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.394 9.843 -3.312 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.945 8.610 -6.048 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.848 7.166 -5.506 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.475 6.904 -4.405 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.886 7.841 -3.860 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.241 9.374 -6.508 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.293 10.160 -4.912 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.148 10.732 -6.149 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.774 11.572 -4.012 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.773 12.223 -3.168 1.00 0.20 C ATOM 1222 C ASN A 401 -2.424 11.384 -1.946 1.00 0.17 C ATOM 1223 O ASN A 401 -2.312 11.899 -0.831 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.272 13.595 -2.742 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.128 14.636 -3.834 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -2.191 14.592 -4.632 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -4.062 15.574 -3.887 1.00 1.21 N ATOM 0 H ASN A 401 -3.458 11.393 -4.965 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.862 12.332 -3.756 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.320 13.522 -2.452 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.719 13.920 -1.861 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -4.021 16.295 -4.608 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -4.822 15.576 -3.207 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.263 10.092 -2.173 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.986 9.139 -1.118 1.00 0.10 C ATOM 1236 C ILE A 402 -0.548 8.651 -1.169 1.00 0.09 C ATOM 1237 O ILE A 402 0.241 8.915 -0.265 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.947 7.957 -1.277 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.367 8.469 -1.156 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.689 6.866 -0.254 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.377 7.485 -1.637 1.00 0.13 C ATOM 0 H ILE A 402 -2.322 9.674 -3.102 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.128 9.624 -0.152 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.787 7.510 -2.258 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.573 8.714 -0.114 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.466 9.393 -1.726 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.395 6.050 -0.407 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.672 6.492 -0.369 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.815 7.271 0.750 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.376 7.906 -1.526 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.193 7.258 -2.687 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.302 6.570 -1.050 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.213 7.934 -2.227 1.00 0.07 N ATOM 1254 CA ILE A 403 1.137 7.452 -2.423 1.00 0.07 C ATOM 1255 C ILE A 403 1.681 8.041 -3.715 1.00 0.08 C ATOM 1256 O ILE A 403 0.911 8.473 -4.568 1.00 0.10 O ATOM 1257 CB ILE A 403 1.200 5.906 -2.493 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.536 5.266 -1.277 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.641 5.432 -2.601 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.606 3.756 -1.307 1.00 0.11 C ATOM 0 H ILE A 403 -0.865 7.673 -2.967 1.00 0.07 H new ATOM 0 HA ILE A 403 1.738 7.764 -1.569 1.00 0.07 H new ATOM 0 HB ILE A 403 0.654 5.597 -3.385 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.018 5.631 -0.370 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.508 5.577 -1.231 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.663 4.343 -2.649 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.093 5.844 -3.503 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.201 5.768 -1.728 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.119 3.351 -0.420 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.100 3.386 -2.199 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.649 3.440 -1.324 1.00 0.11 H new ATOM 1272 N ARG A 404 2.993 8.093 -3.847 1.00 0.10 N ATOM 1273 CA ARG A 404 3.610 8.564 -5.067 1.00 0.13 C ATOM 1274 C ARG A 404 4.647 7.570 -5.541 1.00 0.14 C ATOM 1275 O ARG A 404 5.031 6.648 -4.818 1.00 0.16 O ATOM 1276 CB ARG A 404 4.267 9.924 -4.854 1.00 0.17 C ATOM 1277 CG ARG A 404 5.654 9.831 -4.279 1.00 0.25 C ATOM 1278 CD ARG A 404 6.315 11.188 -4.201 1.00 0.36 C ATOM 1279 NE ARG A 404 6.697 11.690 -5.520 1.00 1.14 N ATOM 1280 CZ ARG A 404 7.934 12.058 -5.847 1.00 1.56 C ATOM 1281 NH1 ARG A 404 8.907 11.981 -4.946 1.00 1.63 N ATOM 1282 NH2 ARG A 404 8.195 12.507 -7.071 1.00 2.39 N ATOM 0 H ARG A 404 3.652 7.813 -3.120 1.00 0.10 H new ATOM 0 HA ARG A 404 2.832 8.667 -5.823 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.311 10.452 -5.807 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.644 10.520 -4.187 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.607 9.391 -3.283 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.260 9.165 -4.894 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.635 11.896 -3.727 1.00 0.36 H new ATOM 0 HD3 ARG A 404 7.200 11.124 -3.568 1.00 0.36 H new ATOM 0 HE ARG A 404 5.971 11.763 -6.233 1.00 1.14 H new ATOM 0 HH11 ARG A 404 8.706 11.640 -4.006 1.00 1.63 H new ATOM 0 HH12 ARG A 404 9.855 12.262 -5.194 1.00 1.63 H new ATOM 0 HH21 ARG A 404 7.447 12.570 -7.761 1.00 2.39 H new ATOM 0 HH22 ARG A 404 9.143 12.788 -7.320 1.00 2.39 H new ATOM 1296 N LYS A 405 5.107 7.790 -6.745 1.00 0.17 N ATOM 1297 CA LYS A 405 6.094 6.936 -7.362 1.00 0.19 C ATOM 1298 C LYS A 405 7.369 7.734 -7.581 1.00 0.22 C ATOM 1299 O LYS A 405 7.320 8.873 -8.051 1.00 0.27 O ATOM 1300 CB LYS A 405 5.563 6.408 -8.686 1.00 0.22 C ATOM 1301 CG LYS A 405 6.391 5.266 -9.234 1.00 0.34 C ATOM 1302 CD LYS A 405 6.639 4.232 -8.181 1.00 0.29 C ATOM 1303 CE LYS A 405 7.321 3.029 -8.769 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.570 3.377 -9.499 1.00 1.08 N ATOM 0 H LYS A 405 4.807 8.570 -7.330 1.00 0.17 H new ATOM 0 HA LYS A 405 6.308 6.086 -6.714 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.534 6.074 -8.553 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.543 7.219 -9.414 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.876 4.812 -10.081 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.342 5.647 -9.606 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.256 4.654 -7.388 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.694 3.935 -7.726 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.555 2.323 -7.972 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.636 2.524 -9.450 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 9.070 2.505 -9.767 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 8.333 3.917 -10.355 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 9.182 3.952 -8.886 1.00 1.08 H new ATOM 1318 N GLU A 406 8.498 7.149 -7.226 1.00 0.23 N ATOM 1319 CA GLU A 406 9.778 7.824 -7.331 1.00 0.28 C ATOM 1320 C GLU A 406 10.343 7.742 -8.746 1.00 0.34 C ATOM 1321 O GLU A 406 9.903 6.940 -9.578 1.00 0.43 O ATOM 1322 CB GLU A 406 10.771 7.221 -6.333 1.00 0.29 C ATOM 1323 CG GLU A 406 10.577 5.749 -6.124 1.00 0.63 C ATOM 1324 CD GLU A 406 10.816 4.958 -7.383 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.679 5.354 -8.185 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.140 3.935 -7.568 1.00 2.42 O ATOM 0 H GLU A 406 8.554 6.199 -6.859 1.00 0.23 H new ATOM 0 HA GLU A 406 9.621 8.877 -7.096 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.786 7.401 -6.687 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.671 7.734 -5.376 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.256 5.402 -5.345 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.563 5.565 -5.769 1.00 0.63 H new ATOM 1333 N PRO A 407 11.263 8.649 -9.043 1.00 0.41 N ATOM 1334 CA PRO A 407 12.055 8.627 -10.259 1.00 0.51 C ATOM 1335 C PRO A 407 13.144 7.546 -10.246 1.00 0.52 C ATOM 1336 O PRO A 407 14.099 7.632 -9.466 1.00 0.54 O ATOM 1337 CB PRO A 407 12.673 10.023 -10.326 1.00 0.61 C ATOM 1338 CG PRO A 407 12.518 10.635 -8.974 1.00 0.58 C ATOM 1339 CD PRO A 407 11.627 9.745 -8.154 1.00 0.45 C ATOM 0 HA PRO A 407 11.441 8.385 -11.126 1.00 0.51 H new ATOM 0 HB2 PRO A 407 13.725 9.966 -10.605 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.175 10.629 -11.083 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.490 10.746 -8.494 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.087 11.633 -9.056 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.144 9.378 -7.267 1.00 0.45 H new ATOM 0 HD3 PRO A 407 10.744 10.282 -7.808 1.00 0.45 H new ATOM 1347 N GLY A 408 13.013 6.533 -11.094 1.00 0.54 N ATOM 1348 CA GLY A 408 14.136 5.643 -11.345 1.00 0.58 C ATOM 1349 C GLY A 408 14.014 4.253 -10.735 1.00 0.58 C ATOM 1350 O GLY A 408 14.440 3.274 -11.351 1.00 0.86 O ATOM 0 H GLY A 408 12.160 6.311 -11.608 1.00 0.54 H new ATOM 0 HA2 GLY A 408 14.262 5.539 -12.423 1.00 0.58 H new ATOM 0 HA3 GLY A 408 15.042 6.112 -10.962 1.00 0.58 H new ATOM 1354 N GLN A 409 13.457 4.145 -9.535 1.00 0.47 N ATOM 1355 CA GLN A 409 13.407 2.857 -8.851 1.00 0.51 C ATOM 1356 C GLN A 409 12.223 2.038 -9.358 1.00 0.48 C ATOM 1357 O GLN A 409 11.322 2.563 -10.021 1.00 0.61 O ATOM 1358 CB GLN A 409 13.320 3.009 -7.324 1.00 0.63 C ATOM 1359 CG GLN A 409 14.123 4.173 -6.749 1.00 0.45 C ATOM 1360 CD GLN A 409 14.554 3.935 -5.312 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.690 4.873 -4.530 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.789 2.677 -4.955 1.00 0.45 N ATOM 0 H GLN A 409 13.039 4.920 -9.021 1.00 0.47 H new ATOM 0 HA GLN A 409 14.339 2.338 -9.076 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.274 3.135 -7.045 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.665 2.084 -6.861 1.00 0.63 H new ATOM 0 HG2 GLN A 409 15.006 4.340 -7.366 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.524 5.082 -6.798 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.665 1.923 -5.631 1.00 0.45 H new ATOM 0 HE22 GLN A 409 15.093 2.465 -4.005 1.00 0.45 H new ATOM 1371 N ARG A 410 12.226 0.753 -9.057 1.00 0.41 N ATOM 1372 CA ARG A 410 11.168 -0.136 -9.519 1.00 0.39 C ATOM 1373 C ARG A 410 9.986 -0.130 -8.571 1.00 0.31 C ATOM 1374 O ARG A 410 8.935 0.438 -8.868 1.00 0.42 O ATOM 1375 CB ARG A 410 11.695 -1.569 -9.703 1.00 0.47 C ATOM 1376 CG ARG A 410 13.134 -1.766 -9.262 1.00 0.86 C ATOM 1377 CD ARG A 410 13.219 -2.037 -7.770 1.00 1.11 C ATOM 1378 NE ARG A 410 14.575 -1.858 -7.259 1.00 1.27 N ATOM 1379 CZ ARG A 410 15.479 -2.834 -7.160 1.00 2.04 C ATOM 1380 NH1 ARG A 410 15.162 -4.082 -7.486 1.00 2.65 N ATOM 1381 NH2 ARG A 410 16.700 -2.558 -6.716 1.00 2.43 N ATOM 0 H ARG A 410 12.946 0.299 -8.496 1.00 0.41 H new ATOM 0 HA ARG A 410 10.829 0.237 -10.485 1.00 0.39 H new ATOM 0 HB2 ARG A 410 11.058 -2.253 -9.142 1.00 0.47 H new ATOM 0 HB3 ARG A 410 11.609 -1.843 -10.754 1.00 0.47 H new ATOM 0 HG2 ARG A 410 13.575 -2.598 -9.811 1.00 0.86 H new ATOM 0 HG3 ARG A 410 13.717 -0.878 -9.507 1.00 0.86 H new ATOM 0 HD2 ARG A 410 12.541 -1.368 -7.241 1.00 1.11 H new ATOM 0 HD3 ARG A 410 12.886 -3.055 -7.567 1.00 1.11 H new ATOM 0 HE ARG A 410 14.850 -0.923 -6.957 1.00 1.27 H new ATOM 0 HH11 ARG A 410 14.221 -4.300 -7.815 1.00 2.65 H new ATOM 0 HH12 ARG A 410 15.859 -4.822 -7.407 1.00 2.65 H new ATOM 0 HH21 ARG A 410 16.943 -1.603 -6.452 1.00 2.43 H new ATOM 0 HH22 ARG A 410 17.395 -3.301 -6.639 1.00 2.43 H new ATOM 1395 N LEU A 411 10.172 -0.749 -7.429 1.00 0.21 N ATOM 1396 CA LEU A 411 9.100 -0.937 -6.476 1.00 0.14 C ATOM 1397 C LEU A 411 9.221 0.012 -5.301 1.00 0.11 C ATOM 1398 O LEU A 411 8.842 -0.316 -4.182 1.00 0.12 O ATOM 1399 CB LEU A 411 9.089 -2.387 -6.021 1.00 0.11 C ATOM 1400 CG LEU A 411 8.697 -3.359 -7.125 1.00 0.11 C ATOM 1401 CD1 LEU A 411 8.934 -4.789 -6.696 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.246 -3.138 -7.503 1.00 0.16 C ATOM 0 H LEU A 411 11.068 -1.136 -7.133 1.00 0.21 H new ATOM 0 HA LEU A 411 8.152 -0.706 -6.961 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.078 -2.651 -5.647 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.395 -2.494 -5.188 1.00 0.11 H new ATOM 0 HG LEU A 411 9.322 -3.173 -7.999 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.646 -5.463 -7.502 1.00 0.15 H new ATOM 0 HD12 LEU A 411 9.990 -4.929 -6.465 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.337 -5.007 -5.810 1.00 0.15 H new ATOM 0 HD21 LEU A 411 6.966 -3.834 -8.294 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.613 -3.305 -6.631 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.114 -2.115 -7.856 1.00 0.16 H new ATOM 1414 N LEU A 412 9.766 1.183 -5.554 1.00 0.13 N ATOM 1415 CA LEU A 412 9.889 2.190 -4.518 1.00 0.11 C ATOM 1416 C LEU A 412 8.656 3.083 -4.553 1.00 0.10 C ATOM 1417 O LEU A 412 8.204 3.484 -5.622 1.00 0.11 O ATOM 1418 CB LEU A 412 11.148 3.019 -4.750 1.00 0.13 C ATOM 1419 CG LEU A 412 11.759 3.726 -3.537 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.747 4.548 -2.765 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.415 2.719 -2.633 1.00 0.16 C ATOM 0 H LEU A 412 10.130 1.462 -6.465 1.00 0.13 H new ATOM 0 HA LEU A 412 9.965 1.712 -3.541 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.908 2.365 -5.177 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.920 3.775 -5.501 1.00 0.13 H new ATOM 0 HG LEU A 412 12.506 4.424 -3.914 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.237 5.026 -1.917 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.325 5.312 -3.418 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.950 3.898 -2.404 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.847 3.230 -1.773 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.672 1.998 -2.292 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.202 2.198 -3.179 1.00 0.16 H new ATOM 1433 N PHE A 413 8.104 3.378 -3.392 1.00 0.10 N ATOM 1434 CA PHE A 413 6.951 4.241 -3.308 1.00 0.11 C ATOM 1435 C PHE A 413 7.069 5.123 -2.081 1.00 0.12 C ATOM 1436 O PHE A 413 7.552 4.686 -1.038 1.00 0.19 O ATOM 1437 CB PHE A 413 5.661 3.425 -3.233 1.00 0.12 C ATOM 1438 CG PHE A 413 5.482 2.464 -4.368 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.998 1.185 -4.287 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.809 2.837 -5.514 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.848 0.291 -5.327 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.653 1.950 -6.558 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.173 0.675 -6.467 1.00 0.11 C ATOM 0 H PHE A 413 8.439 3.030 -2.494 1.00 0.10 H new ATOM 0 HA PHE A 413 6.914 4.858 -4.206 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.648 2.870 -2.295 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.812 4.108 -3.211 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.527 0.880 -3.396 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.401 3.834 -5.594 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.257 -0.705 -5.249 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.123 2.254 -7.449 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.052 -0.019 -7.285 1.00 0.11 H new ATOM 1453 N ARG A 414 6.650 6.363 -2.204 1.00 0.10 N ATOM 1454 CA ARG A 414 6.655 7.263 -1.079 1.00 0.12 C ATOM 1455 C ARG A 414 5.244 7.737 -0.802 1.00 0.11 C ATOM 1456 O ARG A 414 4.543 8.197 -1.701 1.00 0.15 O ATOM 1457 CB ARG A 414 7.596 8.445 -1.327 1.00 0.20 C ATOM 1458 CG ARG A 414 7.121 9.739 -0.692 1.00 0.35 C ATOM 1459 CD ARG A 414 8.265 10.574 -0.152 1.00 0.37 C ATOM 1460 NE ARG A 414 9.276 10.868 -1.166 1.00 1.21 N ATOM 1461 CZ ARG A 414 9.766 12.083 -1.396 1.00 1.46 C ATOM 1462 NH1 ARG A 414 9.267 13.140 -0.767 1.00 1.06 N ATOM 1463 NH2 ARG A 414 10.742 12.243 -2.276 1.00 2.58 N ATOM 0 H ARG A 414 6.302 6.768 -3.073 1.00 0.10 H new ATOM 0 HA ARG A 414 7.025 6.732 -0.202 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.585 8.200 -0.939 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.704 8.595 -2.401 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.568 10.320 -1.430 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.429 9.510 0.118 1.00 0.35 H new ATOM 0 HD2 ARG A 414 7.871 11.510 0.244 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.733 10.047 0.680 1.00 0.37 H new ATOM 0 HE ARG A 414 9.627 10.095 -1.731 1.00 1.21 H new ATOM 0 HH11 ARG A 414 8.502 13.024 -0.102 1.00 1.06 H new ATOM 0 HH12 ARG A 414 9.648 14.069 -0.949 1.00 1.06 H new ATOM 0 HH21 ARG A 414 11.116 11.436 -2.775 1.00 2.58 H new ATOM 0 HH22 ARG A 414 11.120 13.173 -2.455 1.00 2.58 H new ATOM 1477 N PHE A 415 4.826 7.591 0.434 1.00 0.10 N ATOM 1478 CA PHE A 415 3.528 8.073 0.855 1.00 0.09 C ATOM 1479 C PHE A 415 3.492 9.593 0.780 1.00 0.11 C ATOM 1480 O PHE A 415 4.187 10.279 1.532 1.00 0.14 O ATOM 1481 CB PHE A 415 3.218 7.616 2.284 1.00 0.10 C ATOM 1482 CG PHE A 415 2.519 6.296 2.384 1.00 0.10 C ATOM 1483 CD1 PHE A 415 3.240 5.125 2.485 1.00 0.10 C ATOM 1484 CD2 PHE A 415 1.135 6.235 2.396 1.00 0.11 C ATOM 1485 CE1 PHE A 415 2.606 3.913 2.590 1.00 0.11 C ATOM 1486 CE2 PHE A 415 0.483 5.024 2.500 1.00 0.13 C ATOM 1487 CZ PHE A 415 1.223 3.858 2.596 1.00 0.12 C ATOM 0 H PHE A 415 5.369 7.140 1.170 1.00 0.10 H new ATOM 0 HA PHE A 415 2.772 7.659 0.187 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.152 7.560 2.843 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.602 8.375 2.767 1.00 0.10 H new ATOM 0 HD1 PHE A 415 4.319 5.163 2.481 1.00 0.10 H new ATOM 0 HD2 PHE A 415 0.560 7.146 2.323 1.00 0.11 H new ATOM 0 HE1 PHE A 415 3.184 3.004 2.668 1.00 0.11 H new ATOM 0 HE2 PHE A 415 -0.596 4.986 2.506 1.00 0.13 H new ATOM 0 HZ PHE A 415 0.721 2.905 2.676 1.00 0.12 H new ATOM 1497 N MET A 416 2.708 10.099 -0.168 1.00 0.11 N ATOM 1498 CA MET A 416 2.472 11.533 -0.316 1.00 0.15 C ATOM 1499 C MET A 416 1.989 12.116 1.000 1.00 0.17 C ATOM 1500 O MET A 416 2.373 13.216 1.392 1.00 0.23 O ATOM 1501 CB MET A 416 1.402 11.792 -1.380 1.00 0.15 C ATOM 1502 CG MET A 416 1.818 11.478 -2.800 1.00 0.24 C ATOM 1503 SD MET A 416 0.572 12.005 -3.993 1.00 1.41 S ATOM 1504 CE MET A 416 1.338 11.513 -5.533 1.00 1.47 C ATOM 0 H MET A 416 2.218 9.527 -0.856 1.00 0.11 H new ATOM 0 HA MET A 416 3.409 12.002 -0.615 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.520 11.200 -1.137 1.00 0.15 H new ATOM 0 HB3 MET A 416 1.107 12.840 -1.328 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.764 11.973 -3.020 1.00 0.24 H new ATOM 0 HG3 MET A 416 1.988 10.406 -2.901 1.00 0.24 H new ATOM 0 HE1 MET A 416 0.765 11.914 -6.369 1.00 1.47 H new ATOM 0 HE2 MET A 416 2.356 11.900 -5.573 1.00 1.47 H new ATOM 0 HE3 MET A 416 1.360 10.425 -5.597 1.00 1.47 H new ATOM 1514 N LYS A 417 1.132 11.361 1.662 1.00 0.16 N ATOM 1515 CA LYS A 417 0.566 11.756 2.934 1.00 0.21 C ATOM 1516 C LYS A 417 0.639 10.598 3.906 1.00 0.21 C ATOM 1517 O LYS A 417 0.992 9.481 3.532 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.898 12.149 2.773 1.00 0.29 C ATOM 1519 CG LYS A 417 -1.139 13.456 2.051 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.604 13.839 2.149 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.906 15.143 1.438 1.00 0.84 C ATOM 1522 NZ LYS A 417 -2.583 15.077 -0.007 1.00 1.36 N ATOM 0 H LYS A 417 0.809 10.453 1.329 1.00 0.16 H new ATOM 0 HA LYS A 417 1.135 12.607 3.308 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.414 11.354 2.234 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.352 12.210 3.762 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.519 14.241 2.485 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.848 13.362 1.005 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -3.215 13.044 1.721 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -2.885 13.926 3.199 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -3.961 15.388 1.563 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -2.335 15.948 1.900 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -1.754 15.674 -0.205 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -2.373 14.093 -0.271 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -3.395 15.418 -0.560 1.00 1.36 H new ATOM 1536 N THR A 418 0.296 10.866 5.147 1.00 0.24 N ATOM 1537 CA THR A 418 0.151 9.818 6.129 1.00 0.24 C ATOM 1538 C THR A 418 -1.332 9.546 6.362 1.00 0.26 C ATOM 1539 O THR A 418 -2.162 10.396 6.043 1.00 0.28 O ATOM 1540 CB THR A 418 0.854 10.191 7.443 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.367 11.448 7.933 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.356 10.263 7.225 1.00 0.22 C ATOM 0 H THR A 418 0.112 11.805 5.499 1.00 0.24 H new ATOM 0 HA THR A 418 0.626 8.912 5.753 1.00 0.24 H new ATOM 0 HB THR A 418 0.638 9.422 8.185 1.00 0.26 H new ATOM 0 HG1 THR A 418 0.770 12.178 7.418 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.847 10.528 8.161 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.721 9.294 6.885 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.579 11.019 6.472 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.688 8.368 6.899 1.00 0.25 N ATOM 1551 CA PRO A 419 -3.086 7.916 7.002 1.00 0.28 C ATOM 1552 C PRO A 419 -4.035 8.970 7.569 1.00 0.31 C ATOM 1553 O PRO A 419 -5.164 9.110 7.100 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.984 6.706 7.927 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.629 6.164 7.641 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.756 7.368 7.453 1.00 0.25 C ATOM 0 HA PRO A 419 -3.512 7.696 6.023 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -3.090 6.991 8.974 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.762 5.973 7.716 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.272 5.543 8.462 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.635 5.539 6.748 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.319 7.701 8.394 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.071 7.165 6.772 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.560 9.724 8.550 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.358 10.783 9.170 1.00 0.42 C ATOM 1566 C ASP A 420 -4.774 11.816 8.131 1.00 0.43 C ATOM 1567 O ASP A 420 -5.932 12.222 8.060 1.00 0.48 O ATOM 1568 CB ASP A 420 -3.549 11.456 10.283 1.00 0.49 C ATOM 1569 CG ASP A 420 -4.238 12.670 10.878 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -5.142 12.494 11.727 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -3.907 13.802 10.480 1.00 0.72 O ATOM 0 H ASP A 420 -2.622 9.625 8.938 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.258 10.340 9.596 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.360 10.731 11.074 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -2.579 11.756 9.887 1.00 0.49 H new ATOM 1576 N GLU A 421 -3.815 12.205 7.313 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.031 13.173 6.258 1.00 0.45 C ATOM 1578 C GLU A 421 -4.828 12.558 5.113 1.00 0.42 C ATOM 1579 O GLU A 421 -5.719 13.187 4.542 1.00 0.49 O ATOM 1580 CB GLU A 421 -2.677 13.630 5.739 1.00 0.49 C ATOM 1581 CG GLU A 421 -1.758 14.162 6.818 1.00 0.81 C ATOM 1582 CD GLU A 421 -0.363 14.427 6.304 1.00 1.60 C ATOM 1583 OE1 GLU A 421 0.458 13.492 6.302 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -0.083 15.578 5.904 1.00 2.17 O ATOM 0 H GLU A 421 -2.858 11.855 7.363 1.00 0.42 H new ATOM 0 HA GLU A 421 -4.596 14.016 6.656 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.189 12.794 5.239 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -2.829 14.406 4.989 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.174 15.084 7.224 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.711 13.445 7.638 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.490 11.319 4.787 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.104 10.617 3.667 1.00 0.33 C ATOM 1593 C ILE A 422 -6.595 10.382 3.905 1.00 0.36 C ATOM 1594 O ILE A 422 -7.405 10.424 2.975 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.412 9.262 3.417 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -2.920 9.454 3.156 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.055 8.552 2.245 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.184 8.159 2.886 1.00 0.27 C ATOM 0 H ILE A 422 -3.787 10.774 5.287 1.00 0.34 H new ATOM 0 HA ILE A 422 -4.982 11.252 2.789 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.530 8.650 4.311 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -2.791 10.121 2.303 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.469 9.947 4.017 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.556 7.597 2.080 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.110 8.379 2.459 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -4.963 9.169 1.351 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.129 8.370 2.709 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.282 7.498 3.747 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.610 7.675 2.007 1.00 0.27 H new ATOM 1610 N MET A 423 -6.958 10.153 5.159 1.00 0.42 N ATOM 1611 CA MET A 423 -8.332 9.845 5.519 1.00 0.51 C ATOM 1612 C MET A 423 -9.214 11.082 5.548 1.00 0.58 C ATOM 1613 O MET A 423 -10.372 11.023 5.953 1.00 0.71 O ATOM 1614 CB MET A 423 -8.383 9.125 6.858 1.00 0.58 C ATOM 1615 CG MET A 423 -7.891 7.703 6.752 1.00 0.58 C ATOM 1616 SD MET A 423 -8.565 6.628 8.033 1.00 0.90 S ATOM 1617 CE MET A 423 -10.314 6.681 7.639 1.00 2.01 C ATOM 0 H MET A 423 -6.313 10.175 5.949 1.00 0.42 H new ATOM 0 HA MET A 423 -8.726 9.188 4.744 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.776 9.666 7.584 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.407 9.128 7.233 1.00 0.58 H new ATOM 0 HG2 MET A 423 -8.157 7.304 5.773 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.803 7.695 6.814 1.00 0.58 H new ATOM 0 HE1 MET A 423 -10.715 5.667 7.625 1.00 2.01 H new ATOM 0 HE2 MET A 423 -10.839 7.269 8.392 1.00 2.01 H new ATOM 0 HE3 MET A 423 -10.453 7.139 6.660 1.00 2.01 H new ATOM 1627 N SER A 424 -8.671 12.186 5.090 1.00 0.59 N ATOM 1628 CA SER A 424 -9.410 13.441 5.044 1.00 0.72 C ATOM 1629 C SER A 424 -10.187 13.561 3.725 1.00 0.67 C ATOM 1630 O SER A 424 -10.272 14.637 3.133 1.00 1.09 O ATOM 1631 CB SER A 424 -8.457 14.629 5.223 1.00 0.92 C ATOM 1632 OG SER A 424 -9.170 15.840 5.424 1.00 1.57 O ATOM 0 H SER A 424 -7.715 12.247 4.740 1.00 0.59 H new ATOM 0 HA SER A 424 -10.128 13.451 5.864 1.00 0.72 H new ATOM 0 HB2 SER A 424 -7.801 14.446 6.074 1.00 0.92 H new ATOM 0 HB3 SER A 424 -7.820 14.722 4.343 1.00 0.92 H new ATOM 0 HG SER A 424 -9.793 15.980 4.680 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.737 12.442 3.259 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.555 12.463 2.059 1.00 0.42 C ATOM 1640 C GLY A 425 -10.867 11.846 0.855 1.00 0.37 C ATOM 1641 O GLY A 425 -11.527 11.449 -0.104 1.00 0.50 O ATOM 0 H GLY A 425 -10.631 11.524 3.690 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.485 11.928 2.252 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.823 13.494 1.828 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.545 11.749 0.910 1.00 0.38 N ATOM 1646 CA ARG A 426 -8.764 11.256 -0.224 1.00 0.36 C ATOM 1647 C ARG A 426 -9.061 9.783 -0.495 1.00 0.33 C ATOM 1648 O ARG A 426 -9.404 9.396 -1.610 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.268 11.464 0.046 1.00 0.39 C ATOM 1650 CG ARG A 426 -6.902 12.889 0.387 1.00 0.56 C ATOM 1651 CD ARG A 426 -6.877 13.758 -0.851 1.00 0.92 C ATOM 1652 NE ARG A 426 -8.194 13.867 -1.475 1.00 1.37 N ATOM 1653 CZ ARG A 426 -9.141 14.720 -1.080 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -8.887 15.621 -0.140 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -10.338 14.680 -1.648 1.00 2.67 N ATOM 0 H ARG A 426 -8.989 12.004 1.726 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.047 11.821 -1.112 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -6.963 10.814 0.866 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -6.703 11.154 -0.833 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -7.620 13.291 1.102 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -5.925 12.911 0.870 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -6.518 14.753 -0.587 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -6.169 13.344 -1.569 1.00 0.92 H new ATOM 0 HE ARG A 426 -8.402 13.252 -2.262 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.962 15.666 0.287 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -9.617 16.269 0.156 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -10.531 14.000 -2.383 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -11.066 15.330 -1.350 1.00 2.67 H new ATOM 1669 N THR A 427 -8.944 8.972 0.538 1.00 0.33 N ATOM 1670 CA THR A 427 -9.215 7.545 0.432 1.00 0.37 C ATOM 1671 C THR A 427 -10.592 7.206 0.999 1.00 0.43 C ATOM 1672 O THR A 427 -10.887 6.054 1.314 1.00 0.58 O ATOM 1673 CB THR A 427 -8.111 6.737 1.144 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.396 5.348 1.119 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.946 7.179 2.571 1.00 0.41 C ATOM 0 H THR A 427 -8.661 9.277 1.469 1.00 0.33 H new ATOM 0 HA THR A 427 -9.215 7.272 -0.623 1.00 0.37 H new ATOM 0 HB THR A 427 -7.183 6.923 0.603 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.327 5.200 1.388 1.00 1.24 H new ATOM 0 HG21 THR A 427 -7.161 6.591 3.046 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.674 8.234 2.596 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.883 7.033 3.108 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.444 8.218 1.094 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.814 8.025 1.555 1.00 0.62 C ATOM 1685 C ASP A 428 -13.569 7.107 0.603 1.00 0.61 C ATOM 1686 O ASP A 428 -14.208 6.147 1.022 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.532 9.372 1.663 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.994 9.223 2.026 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -15.303 9.102 3.229 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -15.844 9.217 1.111 1.00 1.75 O ATOM 0 H ASP A 428 -11.211 9.183 0.858 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.785 7.561 2.541 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -13.035 9.985 2.415 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.449 9.901 0.714 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.467 7.395 -0.688 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.124 6.589 -1.712 1.00 0.65 C ATOM 1697 C ARG A 429 -13.472 5.223 -1.786 1.00 0.55 C ATOM 1698 O ARG A 429 -14.121 4.202 -2.022 1.00 0.66 O ATOM 1699 CB ARG A 429 -14.014 7.273 -3.069 1.00 0.81 C ATOM 1700 CG ARG A 429 -14.106 8.782 -2.993 1.00 0.98 C ATOM 1701 CD ARG A 429 -14.094 9.411 -4.376 1.00 1.12 C ATOM 1702 NE ARG A 429 -15.270 9.031 -5.160 1.00 1.64 N ATOM 1703 CZ ARG A 429 -15.611 9.604 -6.317 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -14.825 10.523 -6.871 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -16.727 9.240 -6.937 1.00 3.05 N ATOM 0 H ARG A 429 -12.934 8.184 -1.053 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.176 6.479 -1.449 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -13.066 6.997 -3.530 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -14.805 6.901 -3.720 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -15.020 9.066 -2.471 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.271 9.169 -2.409 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -14.057 10.496 -4.281 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -13.191 9.106 -4.905 1.00 1.12 H new ATOM 0 HE ARG A 429 -15.865 8.284 -4.801 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -13.955 10.794 -6.412 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -15.092 10.956 -7.755 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -17.326 8.522 -6.530 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -16.986 9.679 -7.821 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.177 5.237 -1.549 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.332 4.064 -1.656 1.00 0.36 C ATOM 1721 C LEU A 430 -11.756 2.947 -0.723 1.00 0.39 C ATOM 1722 O LEU A 430 -11.728 1.774 -1.094 1.00 0.45 O ATOM 1723 CB LEU A 430 -9.914 4.467 -1.353 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.163 5.084 -2.505 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.841 5.561 -1.997 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -8.972 4.078 -3.625 1.00 0.56 C ATOM 0 H LEU A 430 -11.672 6.079 -1.272 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.423 3.676 -2.671 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -9.923 5.176 -0.525 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.368 3.587 -1.013 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.732 5.920 -2.912 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.278 6.012 -2.814 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -7.998 6.301 -1.213 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.281 4.718 -1.593 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.428 4.546 -4.445 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.406 3.224 -3.254 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.945 3.741 -3.981 1.00 0.56 H new