USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 914 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= -5.35! C(o=-6.4!,f=-7.5!) USER MOD Set 1.2: A 399 LYS NZ :NH3+ 169:sc= -1.05! (180deg=-1.48!) USER MOD Set 2.1: A 343 GLN : amide:sc= -1.09 K(o=-0.98,f=-0.022) USER MOD Set 2.2: A 350 TYR OH : rot -126:sc= 0.106 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 333 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 334 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 340 TYR OH : rot 118:sc= -0.443 USER MOD Single : A 342 TYR OH : rot 118:sc= -0.86! USER MOD Single : A 346 SER OG : rot 180:sc= 0 USER MOD Single : A 348 SER OG : rot 86:sc= 1.17 USER MOD Single : A 352 ASN : amide:sc= -0.0826 X(o=-0.083,f=-0.038) USER MOD Single : A 359 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 361 SER OG : rot 82:sc= 1.32 USER MOD Single : A 362 LYS NZ :NH3+ 166:sc= 0.214 (180deg=-0.0772) USER MOD Single : A 370 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 378 ASN : amide:sc= -0.139 K(o=-0.14,f=-0.99) USER MOD Single : A 379 HIS : no HD1:sc= 0 X(o=0,f=-0.03) USER MOD Single : A 380 LYS NZ :NH3+ -147:sc= 2.54 (180deg=0.64) USER MOD Single : A 381 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 383 THR OG1 : rot 180:sc= 0 USER MOD Single : A 384 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 385 MET CE :methyl 169:sc= -4.22! (180deg=-4.5!) USER MOD Single : A 386 THR OG1 : rot -156:sc= -1.23 USER MOD Single : A 387 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 LYS NZ :NH3+ 163:sc= -0.0429 (180deg=-0.391) USER MOD Single : A 390 MET CE :methyl -170:sc= -0.701 (180deg=-0.905) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 397 TYR OH : rot -31:sc= -2.34! USER MOD Single : A 398 TYR OH : rot -34:sc= 0.428 USER MOD Single : A 401 ASN : amide:sc=-0.00865 K(o=-0.0086,f=-0.74) USER MOD Single : A 405 LYS NZ :NH3+ 165:sc= 1.41 (180deg=1) USER MOD Single : A 409 GLN : amide:sc= -5.24! C(o=-5.2!,f=-3.3!) USER MOD Single : A 416 MET CE :methyl -155:sc= -0.239 (180deg=-0.953) USER MOD Single : A 417 LYS NZ :NH3+ 161:sc= 1.27 (180deg=1.16) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0.013 USER MOD Single : A 423 MET CE :methyl -167:sc= -0.0468 (180deg=-0.326) USER MOD Single : A 424 SER OG : rot -50:sc= 0.846 USER MOD Single : A 427 THR OG1 : rot -35:sc= -0.951! USER MOD Single : A 432 HIS : no HD1:sc= -0.311 X(o=-0.31,f=0.04) USER MOD Single : A 435 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 1.05 K(o=1.1,f=-4.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 331 -9.731 2.609 14.956 1.00 6.78 N ATOM 2 CA GLY A 331 -10.461 1.469 14.353 1.00 6.11 C ATOM 3 C GLY A 331 -10.674 1.663 12.869 1.00 5.22 C ATOM 4 O GLY A 331 -11.114 2.729 12.433 1.00 5.14 O ATOM 0 HA2 GLY A 331 -9.903 0.548 14.523 1.00 6.11 H new ATOM 0 HA3 GLY A 331 -11.426 1.353 14.847 1.00 6.11 H new ATOM 10 N SER A 332 -10.348 0.644 12.091 1.00 4.99 N ATOM 11 CA SER A 332 -10.489 0.704 10.650 1.00 4.63 C ATOM 12 C SER A 332 -11.288 -0.490 10.138 1.00 3.82 C ATOM 13 O SER A 332 -11.158 -1.607 10.651 1.00 4.13 O ATOM 14 CB SER A 332 -9.105 0.753 9.990 1.00 5.44 C ATOM 15 OG SER A 332 -8.256 -0.273 10.486 1.00 6.08 O ATOM 0 H SER A 332 -9.981 -0.241 12.440 1.00 4.99 H new ATOM 0 HA SER A 332 -11.034 1.611 10.388 1.00 4.63 H new ATOM 0 HB2 SER A 332 -9.212 0.649 8.910 1.00 5.44 H new ATOM 0 HB3 SER A 332 -8.648 1.725 10.173 1.00 5.44 H new ATOM 0 HG SER A 332 -7.383 -0.216 10.045 1.00 6.08 H new ATOM 21 N HIS A 333 -12.126 -0.249 9.140 1.00 3.28 N ATOM 22 CA HIS A 333 -12.925 -1.307 8.539 1.00 2.94 C ATOM 23 C HIS A 333 -12.139 -1.965 7.407 1.00 2.02 C ATOM 24 O HIS A 333 -12.355 -1.659 6.231 1.00 2.49 O ATOM 25 CB HIS A 333 -14.247 -0.738 8.015 1.00 3.89 C ATOM 26 CG HIS A 333 -15.217 -1.779 7.546 1.00 4.68 C ATOM 27 ND1 HIS A 333 -15.475 -2.029 6.217 1.00 5.34 N ATOM 28 CD2 HIS A 333 -16.002 -2.632 8.245 1.00 5.35 C ATOM 29 CE1 HIS A 333 -16.375 -2.990 6.117 1.00 6.24 C ATOM 30 NE2 HIS A 333 -16.711 -3.374 7.336 1.00 6.26 N ATOM 0 H HIS A 333 -12.270 0.673 8.728 1.00 3.28 H new ATOM 0 HA HIS A 333 -13.151 -2.059 9.295 1.00 2.94 H new ATOM 0 HB2 HIS A 333 -14.715 -0.150 8.804 1.00 3.89 H new ATOM 0 HB3 HIS A 333 -14.036 -0.056 7.191 1.00 3.89 H new ATOM 0 HD2 HIS A 333 -16.059 -2.713 9.320 1.00 5.35 H new ATOM 0 HE1 HIS A 333 -16.769 -3.393 5.196 1.00 6.24 H new ATOM 0 HE2 HIS A 333 -17.387 -4.103 7.563 1.00 6.26 H new ATOM 39 N MET A 334 -11.229 -2.865 7.790 1.00 1.20 N ATOM 40 CA MET A 334 -10.316 -3.540 6.859 1.00 0.62 C ATOM 41 C MET A 334 -9.245 -2.584 6.352 1.00 0.57 C ATOM 42 O MET A 334 -9.539 -1.474 5.910 1.00 0.92 O ATOM 43 CB MET A 334 -11.059 -4.177 5.677 1.00 1.35 C ATOM 44 CG MET A 334 -11.888 -5.388 6.059 1.00 2.01 C ATOM 45 SD MET A 334 -10.898 -6.684 6.827 1.00 3.03 S ATOM 46 CE MET A 334 -12.151 -7.932 7.100 1.00 3.71 C ATOM 0 H MET A 334 -11.103 -3.149 8.762 1.00 1.20 H new ATOM 0 HA MET A 334 -9.836 -4.342 7.419 1.00 0.62 H new ATOM 0 HB2 MET A 334 -11.711 -3.430 5.224 1.00 1.35 H new ATOM 0 HB3 MET A 334 -10.333 -4.469 4.918 1.00 1.35 H new ATOM 0 HG2 MET A 334 -12.677 -5.083 6.746 1.00 2.01 H new ATOM 0 HG3 MET A 334 -12.376 -5.786 5.169 1.00 2.01 H new ATOM 0 HE1 MET A 334 -11.699 -8.804 7.572 1.00 3.71 H new ATOM 0 HE2 MET A 334 -12.929 -7.531 7.750 1.00 3.71 H new ATOM 0 HE3 MET A 334 -12.590 -8.222 6.145 1.00 3.71 H new ATOM 56 N ARG A 335 -7.996 -3.016 6.439 1.00 0.40 N ATOM 57 CA ARG A 335 -6.879 -2.216 5.966 1.00 0.32 C ATOM 58 C ARG A 335 -6.925 -2.088 4.456 1.00 0.28 C ATOM 59 O ARG A 335 -6.979 -3.092 3.746 1.00 0.42 O ATOM 60 CB ARG A 335 -5.548 -2.833 6.378 1.00 0.37 C ATOM 61 CG ARG A 335 -5.480 -3.158 7.851 1.00 0.56 C ATOM 62 CD ARG A 335 -4.057 -3.333 8.317 1.00 0.93 C ATOM 63 NE ARG A 335 -3.982 -3.369 9.777 1.00 1.32 N ATOM 64 CZ ARG A 335 -3.565 -4.419 10.487 1.00 2.05 C ATOM 65 NH1 ARG A 335 -3.171 -5.529 9.878 1.00 2.81 N ATOM 66 NH2 ARG A 335 -3.558 -4.363 11.811 1.00 2.51 N ATOM 0 H ARG A 335 -7.731 -3.918 6.834 1.00 0.40 H new ATOM 0 HA ARG A 335 -6.963 -1.228 6.420 1.00 0.32 H new ATOM 0 HB2 ARG A 335 -5.382 -3.744 5.802 1.00 0.37 H new ATOM 0 HB3 ARG A 335 -4.741 -2.145 6.126 1.00 0.37 H new ATOM 0 HG2 ARG A 335 -5.955 -2.360 8.422 1.00 0.56 H new ATOM 0 HG3 ARG A 335 -6.043 -4.070 8.049 1.00 0.56 H new ATOM 0 HD2 ARG A 335 -3.647 -4.256 7.906 1.00 0.93 H new ATOM 0 HD3 ARG A 335 -3.444 -2.515 7.938 1.00 0.93 H new ATOM 0 HE ARG A 335 -4.268 -2.534 10.288 1.00 1.32 H new ATOM 0 HH11 ARG A 335 -3.185 -5.585 8.860 1.00 2.81 H new ATOM 0 HH12 ARG A 335 -2.854 -6.327 10.428 1.00 2.81 H new ATOM 0 HH21 ARG A 335 -3.871 -3.517 12.287 1.00 2.51 H new ATOM 0 HH22 ARG A 335 -3.239 -5.166 12.354 1.00 2.51 H new ATOM 80 N LEU A 336 -6.941 -0.849 3.980 1.00 0.23 N ATOM 81 CA LEU A 336 -6.794 -0.570 2.555 1.00 0.28 C ATOM 82 C LEU A 336 -5.449 -1.059 2.085 1.00 0.14 C ATOM 83 O LEU A 336 -4.634 -1.449 2.900 1.00 0.20 O ATOM 84 CB LEU A 336 -6.905 0.926 2.266 1.00 0.48 C ATOM 85 CG LEU A 336 -8.271 1.545 2.522 1.00 0.39 C ATOM 86 CD1 LEU A 336 -8.654 2.412 1.354 1.00 0.33 C ATOM 87 CD2 LEU A 336 -9.308 0.472 2.746 1.00 0.67 C ATOM 0 H LEU A 336 -7.055 -0.018 4.561 1.00 0.23 H new ATOM 0 HA LEU A 336 -7.595 -1.086 2.026 1.00 0.28 H new ATOM 0 HB2 LEU A 336 -6.168 1.451 2.874 1.00 0.48 H new ATOM 0 HB3 LEU A 336 -6.638 1.097 1.223 1.00 0.48 H new ATOM 0 HG LEU A 336 -8.221 2.157 3.422 1.00 0.39 H new ATOM 0 HD11 LEU A 336 -9.633 2.856 1.536 1.00 0.33 H new ATOM 0 HD12 LEU A 336 -7.914 3.203 1.230 1.00 0.33 H new ATOM 0 HD13 LEU A 336 -8.693 1.806 0.449 1.00 0.33 H new ATOM 0 HD21 LEU A 336 -10.278 0.935 2.927 1.00 0.67 H new ATOM 0 HD22 LEU A 336 -9.369 -0.165 1.863 1.00 0.67 H new ATOM 0 HD23 LEU A 336 -9.027 -0.131 3.609 1.00 0.67 H new ATOM 99 N LEU A 337 -5.193 -1.024 0.798 1.00 0.15 N ATOM 100 CA LEU A 337 -3.927 -1.512 0.291 1.00 0.12 C ATOM 101 C LEU A 337 -2.775 -0.721 0.923 1.00 0.11 C ATOM 102 O LEU A 337 -1.819 -1.310 1.421 1.00 0.12 O ATOM 103 CB LEU A 337 -3.921 -1.445 -1.239 1.00 0.14 C ATOM 104 CG LEU A 337 -2.719 -2.052 -1.945 1.00 0.14 C ATOM 105 CD1 LEU A 337 -1.641 -1.018 -2.092 1.00 0.14 C ATOM 106 CD2 LEU A 337 -2.192 -3.265 -1.197 1.00 0.15 C ATOM 0 H LEU A 337 -5.834 -0.668 0.089 1.00 0.15 H new ATOM 0 HA LEU A 337 -3.788 -2.557 0.567 1.00 0.12 H new ATOM 0 HB2 LEU A 337 -4.818 -1.944 -1.605 1.00 0.14 H new ATOM 0 HB3 LEU A 337 -3.996 -0.398 -1.534 1.00 0.14 H new ATOM 0 HG LEU A 337 -3.035 -2.386 -2.933 1.00 0.14 H new ATOM 0 HD11 LEU A 337 -0.782 -1.458 -2.598 1.00 0.14 H new ATOM 0 HD12 LEU A 337 -2.018 -0.180 -2.678 1.00 0.14 H new ATOM 0 HD13 LEU A 337 -1.339 -0.664 -1.106 1.00 0.14 H new ATOM 0 HD21 LEU A 337 -1.333 -3.675 -1.728 1.00 0.15 H new ATOM 0 HD22 LEU A 337 -1.890 -2.970 -0.192 1.00 0.15 H new ATOM 0 HD23 LEU A 337 -2.974 -4.021 -1.134 1.00 0.15 H new ATOM 118 N TRP A 338 -2.894 0.602 0.962 1.00 0.12 N ATOM 119 CA TRP A 338 -1.885 1.428 1.635 1.00 0.14 C ATOM 120 C TRP A 338 -1.930 1.232 3.153 1.00 0.14 C ATOM 121 O TRP A 338 -0.890 1.208 3.810 1.00 0.17 O ATOM 122 CB TRP A 338 -2.039 2.921 1.287 1.00 0.16 C ATOM 123 CG TRP A 338 -3.327 3.545 1.737 1.00 0.14 C ATOM 124 CD1 TRP A 338 -4.457 3.708 0.996 1.00 0.15 C ATOM 125 CD2 TRP A 338 -3.612 4.106 3.022 1.00 0.15 C ATOM 126 NE1 TRP A 338 -5.425 4.320 1.739 1.00 0.15 N ATOM 127 CE2 TRP A 338 -4.935 4.573 2.986 1.00 0.16 C ATOM 128 CE3 TRP A 338 -2.880 4.250 4.202 1.00 0.18 C ATOM 129 CZ2 TRP A 338 -5.542 5.172 4.079 1.00 0.19 C ATOM 130 CZ3 TRP A 338 -3.484 4.846 5.288 1.00 0.21 C ATOM 131 CH2 TRP A 338 -4.805 5.300 5.219 1.00 0.21 C ATOM 0 H TRP A 338 -3.665 1.124 0.544 1.00 0.12 H new ATOM 0 HA TRP A 338 -0.913 1.097 1.270 1.00 0.14 H new ATOM 0 HB2 TRP A 338 -1.210 3.471 1.734 1.00 0.16 H new ATOM 0 HB3 TRP A 338 -1.953 3.038 0.207 1.00 0.16 H new ATOM 0 HD1 TRP A 338 -4.571 3.398 -0.032 1.00 0.15 H new ATOM 0 HE1 TRP A 338 -6.364 4.551 1.414 1.00 0.15 H new ATOM 0 HE3 TRP A 338 -1.860 3.901 4.263 1.00 0.18 H new ATOM 0 HZ2 TRP A 338 -6.562 5.524 4.029 1.00 0.19 H new ATOM 0 HZ3 TRP A 338 -2.929 4.964 6.207 1.00 0.21 H new ATOM 0 HH2 TRP A 338 -5.251 5.762 6.087 1.00 0.21 H new ATOM 142 N ASP A 339 -3.129 1.080 3.710 1.00 0.14 N ATOM 143 CA ASP A 339 -3.275 0.892 5.154 1.00 0.17 C ATOM 144 C ASP A 339 -2.712 -0.465 5.548 1.00 0.16 C ATOM 145 O ASP A 339 -2.246 -0.678 6.668 1.00 0.23 O ATOM 146 CB ASP A 339 -4.745 1.036 5.580 1.00 0.23 C ATOM 147 CG ASP A 339 -4.909 0.997 7.090 1.00 0.34 C ATOM 148 OD1 ASP A 339 -4.563 1.985 7.763 1.00 1.15 O ATOM 149 OD2 ASP A 339 -5.405 -0.025 7.610 1.00 0.86 O ATOM 0 H ASP A 339 -4.007 1.083 3.191 1.00 0.14 H new ATOM 0 HA ASP A 339 -2.713 1.667 5.675 1.00 0.17 H new ATOM 0 HB2 ASP A 339 -5.143 1.976 5.197 1.00 0.23 H new ATOM 0 HB3 ASP A 339 -5.332 0.235 5.131 1.00 0.23 H new ATOM 154 N TYR A 340 -2.748 -1.362 4.590 1.00 0.11 N ATOM 155 CA TYR A 340 -2.188 -2.684 4.714 1.00 0.10 C ATOM 156 C TYR A 340 -0.662 -2.631 4.668 1.00 0.08 C ATOM 157 O TYR A 340 0.002 -3.209 5.523 1.00 0.09 O ATOM 158 CB TYR A 340 -2.717 -3.546 3.576 1.00 0.11 C ATOM 159 CG TYR A 340 -2.488 -5.004 3.781 1.00 0.12 C ATOM 160 CD1 TYR A 340 -2.871 -5.610 4.963 1.00 0.15 C ATOM 161 CD2 TYR A 340 -1.892 -5.772 2.801 1.00 0.12 C ATOM 162 CE1 TYR A 340 -2.664 -6.948 5.169 1.00 0.18 C ATOM 163 CE2 TYR A 340 -1.680 -7.116 2.993 1.00 0.14 C ATOM 164 CZ TYR A 340 -2.067 -7.704 4.183 1.00 0.16 C ATOM 165 OH TYR A 340 -1.854 -9.046 4.389 1.00 0.20 O ATOM 0 H TYR A 340 -3.178 -1.187 3.682 1.00 0.11 H new ATOM 0 HA TYR A 340 -2.480 -3.112 5.673 1.00 0.10 H new ATOM 0 HB2 TYR A 340 -3.786 -3.366 3.461 1.00 0.11 H new ATOM 0 HB3 TYR A 340 -2.240 -3.238 2.645 1.00 0.11 H new ATOM 0 HD1 TYR A 340 -3.341 -5.019 5.736 1.00 0.15 H new ATOM 0 HD2 TYR A 340 -1.589 -5.311 1.873 1.00 0.12 H new ATOM 0 HE1 TYR A 340 -2.967 -7.408 6.098 1.00 0.18 H new ATOM 0 HE2 TYR A 340 -1.214 -7.709 2.220 1.00 0.14 H new ATOM 0 HH TYR A 340 -2.363 -9.563 3.730 1.00 0.20 H new ATOM 175 N VAL A 341 -0.103 -1.923 3.676 1.00 0.08 N ATOM 176 CA VAL A 341 1.353 -1.867 3.527 1.00 0.07 C ATOM 177 C VAL A 341 1.993 -1.283 4.772 1.00 0.08 C ATOM 178 O VAL A 341 3.077 -1.685 5.145 1.00 0.08 O ATOM 179 CB VAL A 341 1.843 -1.062 2.289 1.00 0.08 C ATOM 180 CG1 VAL A 341 1.078 -1.442 1.044 1.00 0.07 C ATOM 181 CG2 VAL A 341 1.803 0.443 2.507 1.00 0.09 C ATOM 0 H VAL A 341 -0.626 -1.392 2.980 1.00 0.08 H new ATOM 0 HA VAL A 341 1.661 -2.902 3.375 1.00 0.07 H new ATOM 0 HB VAL A 341 2.889 -1.334 2.148 1.00 0.08 H new ATOM 0 HG11 VAL A 341 1.446 -0.860 0.199 1.00 0.07 H new ATOM 0 HG12 VAL A 341 1.217 -2.504 0.842 1.00 0.07 H new ATOM 0 HG13 VAL A 341 0.018 -1.236 1.191 1.00 0.07 H new ATOM 0 HG21 VAL A 341 2.156 0.950 1.609 1.00 0.09 H new ATOM 0 HG22 VAL A 341 0.780 0.753 2.720 1.00 0.09 H new ATOM 0 HG23 VAL A 341 2.444 0.706 3.348 1.00 0.09 H new ATOM 191 N TYR A 342 1.315 -0.339 5.415 1.00 0.08 N ATOM 192 CA TYR A 342 1.806 0.228 6.679 1.00 0.10 C ATOM 193 C TYR A 342 2.040 -0.860 7.724 1.00 0.11 C ATOM 194 O TYR A 342 3.010 -0.806 8.483 1.00 0.14 O ATOM 195 CB TYR A 342 0.833 1.255 7.261 1.00 0.11 C ATOM 196 CG TYR A 342 1.049 2.670 6.788 1.00 0.11 C ATOM 197 CD1 TYR A 342 2.212 3.354 7.116 1.00 0.14 C ATOM 198 CD2 TYR A 342 0.088 3.331 6.044 1.00 0.16 C ATOM 199 CE1 TYR A 342 2.410 4.660 6.711 1.00 0.16 C ATOM 200 CE2 TYR A 342 0.281 4.632 5.633 1.00 0.19 C ATOM 201 CZ TYR A 342 1.445 5.293 5.967 1.00 0.17 C ATOM 202 OH TYR A 342 1.633 6.598 5.568 1.00 0.21 O ATOM 0 H TYR A 342 0.430 0.051 5.091 1.00 0.08 H new ATOM 0 HA TYR A 342 2.749 0.721 6.442 1.00 0.10 H new ATOM 0 HB2 TYR A 342 -0.184 0.954 7.010 1.00 0.11 H new ATOM 0 HB3 TYR A 342 0.912 1.234 8.348 1.00 0.11 H new ATOM 0 HD1 TYR A 342 2.974 2.857 7.697 1.00 0.14 H new ATOM 0 HD2 TYR A 342 -0.827 2.820 5.782 1.00 0.16 H new ATOM 0 HE1 TYR A 342 3.318 5.180 6.978 1.00 0.16 H new ATOM 0 HE2 TYR A 342 -0.478 5.133 5.050 1.00 0.19 H new ATOM 0 HH TYR A 342 1.646 6.642 4.589 1.00 0.21 H new ATOM 212 N GLN A 343 1.150 -1.847 7.758 1.00 0.12 N ATOM 213 CA GLN A 343 1.241 -2.922 8.730 1.00 0.18 C ATOM 214 C GLN A 343 2.372 -3.851 8.331 1.00 0.18 C ATOM 215 O GLN A 343 3.119 -4.351 9.170 1.00 0.25 O ATOM 216 CB GLN A 343 -0.105 -3.668 8.814 1.00 0.28 C ATOM 217 CG GLN A 343 -0.200 -4.959 8.011 1.00 0.55 C ATOM 218 CD GLN A 343 0.011 -6.211 8.849 1.00 0.99 C ATOM 219 OE1 GLN A 343 -0.561 -7.260 8.562 1.00 1.40 O ATOM 220 NE2 GLN A 343 0.835 -6.114 9.877 1.00 1.15 N ATOM 0 H GLN A 343 0.357 -1.921 7.121 1.00 0.12 H new ATOM 0 HA GLN A 343 1.456 -2.520 9.720 1.00 0.18 H new ATOM 0 HB2 GLN A 343 -0.307 -3.898 9.860 1.00 0.28 H new ATOM 0 HB3 GLN A 343 -0.893 -2.995 8.478 1.00 0.28 H new ATOM 0 HG2 GLN A 343 -1.179 -5.011 7.535 1.00 0.55 H new ATOM 0 HG3 GLN A 343 0.542 -4.936 7.212 1.00 0.55 H new ATOM 0 HE21 GLN A 343 1.291 -5.225 10.083 1.00 1.15 H new ATOM 0 HE22 GLN A 343 1.015 -6.928 10.465 1.00 1.15 H new ATOM 229 N LEU A 344 2.498 -4.044 7.031 1.00 0.15 N ATOM 230 CA LEU A 344 3.521 -4.900 6.474 1.00 0.16 C ATOM 231 C LEU A 344 4.889 -4.229 6.590 1.00 0.18 C ATOM 232 O LEU A 344 5.915 -4.883 6.755 1.00 0.27 O ATOM 233 CB LEU A 344 3.184 -5.173 5.012 1.00 0.13 C ATOM 234 CG LEU A 344 1.739 -5.610 4.752 1.00 0.12 C ATOM 235 CD1 LEU A 344 1.460 -5.647 3.272 1.00 0.10 C ATOM 236 CD2 LEU A 344 1.458 -6.971 5.357 1.00 0.18 C ATOM 0 H LEU A 344 1.892 -3.610 6.334 1.00 0.15 H new ATOM 0 HA LEU A 344 3.558 -5.841 7.023 1.00 0.16 H new ATOM 0 HB2 LEU A 344 3.385 -4.271 4.434 1.00 0.13 H new ATOM 0 HB3 LEU A 344 3.855 -5.947 4.638 1.00 0.13 H new ATOM 0 HG LEU A 344 1.083 -4.880 5.226 1.00 0.12 H new ATOM 0 HD11 LEU A 344 0.429 -5.959 3.104 1.00 0.10 H new ATOM 0 HD12 LEU A 344 1.612 -4.654 2.848 1.00 0.10 H new ATOM 0 HD13 LEU A 344 2.136 -6.354 2.792 1.00 0.10 H new ATOM 0 HD21 LEU A 344 0.425 -7.253 5.155 1.00 0.18 H new ATOM 0 HD22 LEU A 344 2.128 -7.710 4.917 1.00 0.18 H new ATOM 0 HD23 LEU A 344 1.619 -6.931 6.434 1.00 0.18 H new ATOM 248 N LEU A 345 4.865 -2.906 6.504 1.00 0.12 N ATOM 249 CA LEU A 345 6.051 -2.061 6.604 1.00 0.13 C ATOM 250 C LEU A 345 6.660 -2.137 7.996 1.00 0.19 C ATOM 251 O LEU A 345 7.880 -2.095 8.160 1.00 0.29 O ATOM 252 CB LEU A 345 5.668 -0.607 6.287 1.00 0.10 C ATOM 253 CG LEU A 345 6.095 -0.076 4.911 1.00 0.10 C ATOM 254 CD1 LEU A 345 6.418 -1.210 3.964 1.00 0.12 C ATOM 255 CD2 LEU A 345 5.011 0.815 4.312 1.00 0.10 C ATOM 0 H LEU A 345 4.004 -2.378 6.360 1.00 0.12 H new ATOM 0 HA LEU A 345 6.791 -2.416 5.887 1.00 0.13 H new ATOM 0 HB2 LEU A 345 4.585 -0.513 6.369 1.00 0.10 H new ATOM 0 HB3 LEU A 345 6.103 0.036 7.052 1.00 0.10 H new ATOM 0 HG LEU A 345 6.997 0.519 5.054 1.00 0.10 H new ATOM 0 HD11 LEU A 345 6.717 -0.803 2.998 1.00 0.12 H new ATOM 0 HD12 LEU A 345 7.233 -1.806 4.375 1.00 0.12 H new ATOM 0 HD13 LEU A 345 5.537 -1.839 3.836 1.00 0.12 H new ATOM 0 HD21 LEU A 345 5.337 1.179 3.338 1.00 0.10 H new ATOM 0 HD22 LEU A 345 4.091 0.241 4.196 1.00 0.10 H new ATOM 0 HD23 LEU A 345 4.830 1.662 4.974 1.00 0.10 H new ATOM 267 N SER A 346 5.802 -2.263 8.997 1.00 0.25 N ATOM 268 CA SER A 346 6.242 -2.234 10.379 1.00 0.33 C ATOM 269 C SER A 346 6.595 -3.632 10.885 1.00 0.30 C ATOM 270 O SER A 346 7.552 -3.797 11.646 1.00 0.53 O ATOM 271 CB SER A 346 5.161 -1.606 11.262 1.00 0.51 C ATOM 272 OG SER A 346 5.649 -1.340 12.566 1.00 1.43 O ATOM 0 H SER A 346 4.797 -2.386 8.876 1.00 0.25 H new ATOM 0 HA SER A 346 7.145 -1.626 10.431 1.00 0.33 H new ATOM 0 HB2 SER A 346 4.810 -0.680 10.807 1.00 0.51 H new ATOM 0 HB3 SER A 346 4.304 -2.276 11.322 1.00 0.51 H new ATOM 0 HG SER A 346 4.937 -0.938 13.106 1.00 1.43 H new ATOM 278 N ASP A 347 5.841 -4.638 10.459 1.00 0.32 N ATOM 279 CA ASP A 347 6.039 -5.991 10.968 1.00 0.32 C ATOM 280 C ASP A 347 7.054 -6.747 10.115 1.00 0.30 C ATOM 281 O ASP A 347 6.970 -6.753 8.888 1.00 0.30 O ATOM 282 CB ASP A 347 4.717 -6.753 11.020 1.00 0.35 C ATOM 283 CG ASP A 347 4.731 -7.843 12.071 1.00 0.49 C ATOM 284 OD1 ASP A 347 5.617 -8.720 12.011 1.00 0.58 O ATOM 285 OD2 ASP A 347 3.842 -7.843 12.952 1.00 0.67 O ATOM 0 H ASP A 347 5.095 -4.546 9.770 1.00 0.32 H new ATOM 0 HA ASP A 347 6.430 -5.913 11.983 1.00 0.32 H new ATOM 0 HB2 ASP A 347 3.905 -6.057 11.231 1.00 0.35 H new ATOM 0 HB3 ASP A 347 4.514 -7.193 10.044 1.00 0.35 H new ATOM 290 N SER A 348 7.989 -7.410 10.777 1.00 0.34 N ATOM 291 CA SER A 348 9.149 -7.984 10.108 1.00 0.35 C ATOM 292 C SER A 348 8.806 -9.242 9.310 1.00 0.31 C ATOM 293 O SER A 348 9.587 -9.670 8.465 1.00 0.32 O ATOM 294 CB SER A 348 10.231 -8.293 11.141 1.00 0.46 C ATOM 295 OG SER A 348 11.419 -8.773 10.538 1.00 1.53 O ATOM 0 H SER A 348 7.968 -7.565 11.785 1.00 0.34 H new ATOM 0 HA SER A 348 9.513 -7.247 9.392 1.00 0.35 H new ATOM 0 HB2 SER A 348 10.453 -7.392 11.713 1.00 0.46 H new ATOM 0 HB3 SER A 348 9.857 -9.035 11.847 1.00 0.46 H new ATOM 0 HG SER A 348 11.981 -8.015 10.273 1.00 1.53 H new ATOM 301 N ARG A 349 7.653 -9.847 9.559 1.00 0.33 N ATOM 302 CA ARG A 349 7.290 -11.042 8.800 1.00 0.35 C ATOM 303 C ARG A 349 6.987 -10.686 7.344 1.00 0.29 C ATOM 304 O ARG A 349 6.969 -11.552 6.473 1.00 0.34 O ATOM 305 CB ARG A 349 6.114 -11.795 9.420 1.00 0.42 C ATOM 306 CG ARG A 349 4.775 -11.136 9.202 1.00 0.55 C ATOM 307 CD ARG A 349 4.135 -10.767 10.514 1.00 0.59 C ATOM 308 NE ARG A 349 3.816 -11.937 11.324 1.00 1.23 N ATOM 309 CZ ARG A 349 4.094 -12.027 12.621 1.00 1.67 C ATOM 310 NH1 ARG A 349 4.711 -11.024 13.236 1.00 1.93 N ATOM 311 NH2 ARG A 349 3.760 -13.117 13.299 1.00 2.56 N ATOM 0 H ARG A 349 6.971 -9.546 10.255 1.00 0.33 H new ATOM 0 HA ARG A 349 8.151 -11.709 8.832 1.00 0.35 H new ATOM 0 HB2 ARG A 349 6.083 -12.802 9.005 1.00 0.42 H new ATOM 0 HB3 ARG A 349 6.286 -11.897 10.491 1.00 0.42 H new ATOM 0 HG2 ARG A 349 4.901 -10.242 8.591 1.00 0.55 H new ATOM 0 HG3 ARG A 349 4.120 -11.810 8.650 1.00 0.55 H new ATOM 0 HD2 ARG A 349 4.806 -10.114 11.072 1.00 0.59 H new ATOM 0 HD3 ARG A 349 3.224 -10.200 10.324 1.00 0.59 H new ATOM 0 HE ARG A 349 3.356 -12.727 10.872 1.00 1.23 H new ATOM 0 HH11 ARG A 349 4.970 -10.187 12.713 1.00 1.93 H new ATOM 0 HH12 ARG A 349 4.925 -11.090 14.231 1.00 1.93 H new ATOM 0 HH21 ARG A 349 3.289 -13.888 12.825 1.00 2.56 H new ATOM 0 HH22 ARG A 349 3.974 -13.184 14.294 1.00 2.56 H new ATOM 325 N TYR A 350 6.750 -9.404 7.085 1.00 0.22 N ATOM 326 CA TYR A 350 6.431 -8.952 5.744 1.00 0.17 C ATOM 327 C TYR A 350 7.565 -8.133 5.160 1.00 0.16 C ATOM 328 O TYR A 350 7.516 -7.750 3.993 1.00 0.15 O ATOM 329 CB TYR A 350 5.181 -8.091 5.751 1.00 0.17 C ATOM 330 CG TYR A 350 4.060 -8.631 6.583 1.00 0.20 C ATOM 331 CD1 TYR A 350 3.391 -9.784 6.219 1.00 0.24 C ATOM 332 CD2 TYR A 350 3.647 -7.957 7.715 1.00 0.23 C ATOM 333 CE1 TYR A 350 2.336 -10.253 6.958 1.00 0.29 C ATOM 334 CE2 TYR A 350 2.599 -8.417 8.469 1.00 0.28 C ATOM 335 CZ TYR A 350 1.937 -9.567 8.089 1.00 0.31 C ATOM 336 OH TYR A 350 0.877 -10.026 8.836 1.00 0.39 O ATOM 0 H TYR A 350 6.774 -8.665 7.787 1.00 0.22 H new ATOM 0 HA TYR A 350 6.269 -9.842 5.136 1.00 0.17 H new ATOM 0 HB2 TYR A 350 5.442 -7.097 6.116 1.00 0.17 H new ATOM 0 HB3 TYR A 350 4.831 -7.972 4.726 1.00 0.17 H new ATOM 0 HD1 TYR A 350 3.704 -10.324 5.338 1.00 0.24 H new ATOM 0 HD2 TYR A 350 4.158 -7.053 8.011 1.00 0.23 H new ATOM 0 HE1 TYR A 350 1.820 -11.153 6.658 1.00 0.29 H new ATOM 0 HE2 TYR A 350 2.293 -7.882 9.356 1.00 0.28 H new ATOM 0 HH TYR A 350 0.216 -9.310 8.941 1.00 0.39 H new ATOM 346 N GLU A 351 8.588 -7.878 5.967 1.00 0.18 N ATOM 347 CA GLU A 351 9.698 -7.012 5.558 1.00 0.21 C ATOM 348 C GLU A 351 10.436 -7.585 4.338 1.00 0.21 C ATOM 349 O GLU A 351 11.241 -6.903 3.703 1.00 0.24 O ATOM 350 CB GLU A 351 10.677 -6.805 6.718 1.00 0.28 C ATOM 351 CG GLU A 351 11.532 -8.015 7.002 1.00 0.48 C ATOM 352 CD GLU A 351 12.708 -7.708 7.900 1.00 0.99 C ATOM 353 OE1 GLU A 351 12.523 -7.028 8.931 1.00 1.78 O ATOM 354 OE2 GLU A 351 13.831 -8.138 7.572 1.00 1.05 O ATOM 0 H GLU A 351 8.676 -8.257 6.910 1.00 0.18 H new ATOM 0 HA GLU A 351 9.276 -6.047 5.276 1.00 0.21 H new ATOM 0 HB2 GLU A 351 11.324 -5.957 6.491 1.00 0.28 H new ATOM 0 HB3 GLU A 351 10.116 -6.547 7.616 1.00 0.28 H new ATOM 0 HG2 GLU A 351 10.918 -8.786 7.467 1.00 0.48 H new ATOM 0 HG3 GLU A 351 11.898 -8.424 6.060 1.00 0.48 H new ATOM 361 N ASN A 352 10.149 -8.844 4.021 1.00 0.19 N ATOM 362 CA ASN A 352 10.740 -9.509 2.868 1.00 0.21 C ATOM 363 C ASN A 352 9.872 -9.312 1.626 1.00 0.16 C ATOM 364 O ASN A 352 10.293 -9.585 0.510 1.00 0.18 O ATOM 365 CB ASN A 352 10.910 -10.998 3.160 1.00 0.27 C ATOM 366 CG ASN A 352 11.698 -11.731 2.094 1.00 1.03 C ATOM 367 OD1 ASN A 352 12.926 -11.792 2.150 1.00 1.83 O ATOM 368 ND2 ASN A 352 11.006 -12.311 1.127 1.00 1.62 N ATOM 0 H ASN A 352 9.504 -9.428 4.554 1.00 0.19 H new ATOM 0 HA ASN A 352 11.718 -9.067 2.675 1.00 0.21 H new ATOM 0 HB2 ASN A 352 11.412 -11.118 4.120 1.00 0.27 H new ATOM 0 HB3 ASN A 352 9.926 -11.457 3.255 1.00 0.27 H new ATOM 0 HD21 ASN A 352 11.490 -12.831 0.395 1.00 1.62 H new ATOM 0 HD22 ASN A 352 9.989 -12.239 1.114 1.00 1.62 H new ATOM 375 N PHE A 353 8.649 -8.855 1.834 1.00 0.13 N ATOM 376 CA PHE A 353 7.737 -8.555 0.742 1.00 0.10 C ATOM 377 C PHE A 353 7.668 -7.054 0.508 1.00 0.08 C ATOM 378 O PHE A 353 7.381 -6.593 -0.592 1.00 0.07 O ATOM 379 CB PHE A 353 6.339 -9.073 1.064 1.00 0.09 C ATOM 380 CG PHE A 353 6.293 -10.534 1.386 1.00 0.12 C ATOM 381 CD1 PHE A 353 7.016 -11.442 0.639 1.00 0.17 C ATOM 382 CD2 PHE A 353 5.541 -10.993 2.449 1.00 0.13 C ATOM 383 CE1 PHE A 353 6.988 -12.784 0.939 1.00 0.19 C ATOM 384 CE2 PHE A 353 5.511 -12.337 2.761 1.00 0.17 C ATOM 385 CZ PHE A 353 6.237 -13.235 2.001 1.00 0.18 C ATOM 0 H PHE A 353 8.261 -8.682 2.761 1.00 0.13 H new ATOM 0 HA PHE A 353 8.109 -9.046 -0.157 1.00 0.10 H new ATOM 0 HB2 PHE A 353 5.940 -8.512 1.909 1.00 0.09 H new ATOM 0 HB3 PHE A 353 5.685 -8.877 0.214 1.00 0.09 H new ATOM 0 HD1 PHE A 353 7.612 -11.094 -0.192 1.00 0.17 H new ATOM 0 HD2 PHE A 353 4.971 -10.293 3.042 1.00 0.13 H new ATOM 0 HE1 PHE A 353 7.555 -13.483 0.342 1.00 0.19 H new ATOM 0 HE2 PHE A 353 4.922 -12.686 3.596 1.00 0.17 H new ATOM 0 HZ PHE A 353 6.215 -14.288 2.240 1.00 0.18 H new ATOM 395 N ILE A 354 7.944 -6.302 1.556 1.00 0.08 N ATOM 396 CA ILE A 354 7.836 -4.852 1.528 1.00 0.07 C ATOM 397 C ILE A 354 8.486 -4.295 2.787 1.00 0.08 C ATOM 398 O ILE A 354 8.505 -4.960 3.818 1.00 0.10 O ATOM 399 CB ILE A 354 6.352 -4.422 1.461 1.00 0.07 C ATOM 400 CG1 ILE A 354 6.190 -2.954 1.061 1.00 0.07 C ATOM 401 CG2 ILE A 354 5.671 -4.682 2.793 1.00 0.08 C ATOM 402 CD1 ILE A 354 4.745 -2.494 1.044 1.00 0.07 C ATOM 0 H ILE A 354 8.250 -6.678 2.453 1.00 0.08 H new ATOM 0 HA ILE A 354 8.341 -4.463 0.644 1.00 0.07 H new ATOM 0 HB ILE A 354 5.875 -5.022 0.686 1.00 0.07 H new ATOM 0 HG12 ILE A 354 6.754 -2.331 1.755 1.00 0.07 H new ATOM 0 HG13 ILE A 354 6.624 -2.804 0.072 1.00 0.07 H new ATOM 0 HG21 ILE A 354 4.627 -4.375 2.734 1.00 0.08 H new ATOM 0 HG22 ILE A 354 5.724 -5.745 3.027 1.00 0.08 H new ATOM 0 HG23 ILE A 354 6.173 -4.112 3.575 1.00 0.08 H new ATOM 0 HD11 ILE A 354 4.701 -1.445 0.753 1.00 0.07 H new ATOM 0 HD12 ILE A 354 4.181 -3.093 0.329 1.00 0.07 H new ATOM 0 HD13 ILE A 354 4.314 -2.613 2.038 1.00 0.07 H new ATOM 414 N ARG A 355 9.036 -3.101 2.704 1.00 0.09 N ATOM 415 CA ARG A 355 9.715 -2.508 3.851 1.00 0.11 C ATOM 416 C ARG A 355 10.006 -1.039 3.621 1.00 0.10 C ATOM 417 O ARG A 355 10.154 -0.590 2.482 1.00 0.14 O ATOM 418 CB ARG A 355 11.022 -3.235 4.143 1.00 0.16 C ATOM 419 CG ARG A 355 11.937 -3.299 2.946 1.00 0.22 C ATOM 420 CD ARG A 355 13.369 -3.521 3.360 1.00 0.25 C ATOM 421 NE ARG A 355 13.528 -4.662 4.254 1.00 0.98 N ATOM 422 CZ ARG A 355 14.216 -4.607 5.392 1.00 1.40 C ATOM 423 NH1 ARG A 355 14.816 -3.477 5.752 1.00 1.43 N ATOM 424 NH2 ARG A 355 14.318 -5.680 6.159 1.00 2.08 N ATOM 0 H ARG A 355 9.030 -2.522 1.864 1.00 0.09 H new ATOM 0 HA ARG A 355 9.046 -2.606 4.706 1.00 0.11 H new ATOM 0 HB2 ARG A 355 11.537 -2.732 4.961 1.00 0.16 H new ATOM 0 HB3 ARG A 355 10.801 -4.248 4.480 1.00 0.16 H new ATOM 0 HG2 ARG A 355 11.618 -4.105 2.285 1.00 0.22 H new ATOM 0 HG3 ARG A 355 11.860 -2.372 2.378 1.00 0.22 H new ATOM 0 HD2 ARG A 355 13.980 -3.674 2.470 1.00 0.25 H new ATOM 0 HD3 ARG A 355 13.743 -2.624 3.853 1.00 0.25 H new ATOM 0 HE ARG A 355 13.090 -5.546 3.994 1.00 0.98 H new ATOM 0 HH11 ARG A 355 14.749 -2.652 5.156 1.00 1.43 H new ATOM 0 HH12 ARG A 355 15.343 -3.435 6.624 1.00 1.43 H new ATOM 0 HH21 ARG A 355 13.869 -6.552 5.879 1.00 2.08 H new ATOM 0 HH22 ARG A 355 14.846 -5.635 7.031 1.00 2.08 H new ATOM 438 N TRP A 356 10.079 -0.301 4.716 1.00 0.10 N ATOM 439 CA TRP A 356 10.436 1.105 4.674 1.00 0.09 C ATOM 440 C TRP A 356 11.863 1.299 4.174 1.00 0.09 C ATOM 441 O TRP A 356 12.786 0.610 4.607 1.00 0.14 O ATOM 442 CB TRP A 356 10.342 1.726 6.063 1.00 0.10 C ATOM 443 CG TRP A 356 8.957 1.898 6.599 1.00 0.10 C ATOM 444 CD1 TRP A 356 8.453 1.351 7.742 1.00 0.12 C ATOM 445 CD2 TRP A 356 7.905 2.692 6.036 1.00 0.10 C ATOM 446 NE1 TRP A 356 7.160 1.766 7.930 1.00 0.12 N ATOM 447 CE2 TRP A 356 6.801 2.591 6.899 1.00 0.12 C ATOM 448 CE3 TRP A 356 7.791 3.484 4.893 1.00 0.11 C ATOM 449 CZ2 TRP A 356 5.602 3.254 6.656 1.00 0.13 C ATOM 450 CZ3 TRP A 356 6.604 4.138 4.650 1.00 0.12 C ATOM 451 CH2 TRP A 356 5.523 4.027 5.526 1.00 0.13 C ATOM 0 H TRP A 356 9.893 -0.658 5.653 1.00 0.10 H new ATOM 0 HA TRP A 356 9.736 1.589 3.992 1.00 0.09 H new ATOM 0 HB2 TRP A 356 10.907 1.106 6.758 1.00 0.10 H new ATOM 0 HB3 TRP A 356 10.827 2.702 6.039 1.00 0.10 H new ATOM 0 HD1 TRP A 356 8.993 0.688 8.402 1.00 0.12 H new ATOM 0 HE1 TRP A 356 6.562 1.502 8.713 1.00 0.12 H new ATOM 0 HE3 TRP A 356 8.621 3.583 4.209 1.00 0.11 H new ATOM 0 HZ2 TRP A 356 4.765 3.163 7.332 1.00 0.13 H new ATOM 0 HZ3 TRP A 356 6.507 4.749 3.764 1.00 0.12 H new ATOM 0 HH2 TRP A 356 4.608 4.559 5.310 1.00 0.13 H new ATOM 462 N GLU A 357 12.026 2.239 3.265 1.00 0.10 N ATOM 463 CA GLU A 357 13.342 2.707 2.869 1.00 0.12 C ATOM 464 C GLU A 357 13.652 3.992 3.625 1.00 0.14 C ATOM 465 O GLU A 357 14.794 4.259 4.003 1.00 0.21 O ATOM 466 CB GLU A 357 13.390 2.938 1.366 1.00 0.16 C ATOM 467 CG GLU A 357 13.587 1.660 0.574 1.00 0.25 C ATOM 468 CD GLU A 357 14.990 1.110 0.714 1.00 0.36 C ATOM 469 OE1 GLU A 357 15.900 1.574 -0.008 1.00 0.78 O ATOM 470 OE2 GLU A 357 15.187 0.203 1.550 1.00 0.61 O ATOM 0 H GLU A 357 11.255 2.699 2.781 1.00 0.10 H new ATOM 0 HA GLU A 357 14.092 1.955 3.113 1.00 0.12 H new ATOM 0 HB2 GLU A 357 12.464 3.416 1.048 1.00 0.16 H new ATOM 0 HB3 GLU A 357 14.201 3.629 1.136 1.00 0.16 H new ATOM 0 HG2 GLU A 357 12.870 0.912 0.911 1.00 0.25 H new ATOM 0 HG3 GLU A 357 13.377 1.851 -0.478 1.00 0.25 H new ATOM 477 N ASP A 358 12.606 4.777 3.841 1.00 0.14 N ATOM 478 CA ASP A 358 12.666 5.955 4.691 1.00 0.16 C ATOM 479 C ASP A 358 11.331 6.101 5.389 1.00 0.16 C ATOM 480 O ASP A 358 10.428 6.763 4.882 1.00 0.20 O ATOM 481 CB ASP A 358 12.946 7.230 3.896 1.00 0.20 C ATOM 482 CG ASP A 358 13.817 8.204 4.667 1.00 0.92 C ATOM 483 OD1 ASP A 358 13.266 9.003 5.453 1.00 1.46 O ATOM 484 OD2 ASP A 358 15.053 8.191 4.480 1.00 1.33 O ATOM 0 H ASP A 358 11.688 4.613 3.429 1.00 0.14 H new ATOM 0 HA ASP A 358 13.482 5.822 5.401 1.00 0.16 H new ATOM 0 HB2 ASP A 358 13.436 6.971 2.957 1.00 0.20 H new ATOM 0 HB3 ASP A 358 12.002 7.712 3.641 1.00 0.20 H new ATOM 489 N LYS A 359 11.212 5.461 6.536 1.00 0.15 N ATOM 490 CA LYS A 359 9.960 5.404 7.277 1.00 0.17 C ATOM 491 C LYS A 359 9.370 6.785 7.523 1.00 0.19 C ATOM 492 O LYS A 359 8.174 7.004 7.325 1.00 0.23 O ATOM 493 CB LYS A 359 10.193 4.707 8.607 1.00 0.23 C ATOM 494 CG LYS A 359 8.954 4.638 9.479 1.00 0.29 C ATOM 495 CD LYS A 359 9.177 3.747 10.683 1.00 0.38 C ATOM 496 CE LYS A 359 7.985 3.775 11.619 1.00 0.91 C ATOM 497 NZ LYS A 359 8.238 2.983 12.850 1.00 1.50 N ATOM 0 H LYS A 359 11.981 4.963 6.984 1.00 0.15 H new ATOM 0 HA LYS A 359 9.245 4.846 6.673 1.00 0.17 H new ATOM 0 HB2 LYS A 359 10.553 3.695 8.420 1.00 0.23 H new ATOM 0 HB3 LYS A 359 10.981 5.230 9.149 1.00 0.23 H new ATOM 0 HG2 LYS A 359 8.684 5.641 9.811 1.00 0.29 H new ATOM 0 HG3 LYS A 359 8.116 4.259 8.894 1.00 0.29 H new ATOM 0 HD2 LYS A 359 9.358 2.724 10.352 1.00 0.38 H new ATOM 0 HD3 LYS A 359 10.069 4.072 11.218 1.00 0.38 H new ATOM 0 HE2 LYS A 359 7.758 4.806 11.889 1.00 0.91 H new ATOM 0 HE3 LYS A 359 7.109 3.380 11.105 1.00 0.91 H new ATOM 0 HZ1 LYS A 359 7.402 3.024 13.467 1.00 1.50 H new ATOM 0 HZ2 LYS A 359 8.430 1.994 12.593 1.00 1.50 H new ATOM 0 HZ3 LYS A 359 9.059 3.376 13.353 1.00 1.50 H new ATOM 511 N GLU A 360 10.211 7.708 7.951 1.00 0.21 N ATOM 512 CA GLU A 360 9.765 9.049 8.292 1.00 0.27 C ATOM 513 C GLU A 360 9.442 9.880 7.051 1.00 0.24 C ATOM 514 O GLU A 360 8.645 10.816 7.111 1.00 0.37 O ATOM 515 CB GLU A 360 10.797 9.732 9.163 1.00 0.41 C ATOM 516 CG GLU A 360 10.957 9.035 10.498 1.00 0.63 C ATOM 517 CD GLU A 360 9.721 9.148 11.365 1.00 1.75 C ATOM 518 OE1 GLU A 360 9.535 10.201 12.007 1.00 1.97 O ATOM 519 OE2 GLU A 360 8.928 8.181 11.405 1.00 2.67 O ATOM 0 H GLU A 360 11.212 7.554 8.072 1.00 0.21 H new ATOM 0 HA GLU A 360 8.836 8.962 8.855 1.00 0.27 H new ATOM 0 HB2 GLU A 360 11.756 9.749 8.645 1.00 0.41 H new ATOM 0 HB3 GLU A 360 10.505 10.769 9.327 1.00 0.41 H new ATOM 0 HG2 GLU A 360 11.183 7.982 10.329 1.00 0.63 H new ATOM 0 HG3 GLU A 360 11.808 9.463 11.028 1.00 0.63 H new ATOM 526 N SER A 361 10.049 9.531 5.924 1.00 0.19 N ATOM 527 CA SER A 361 9.710 10.150 4.650 1.00 0.21 C ATOM 528 C SER A 361 8.581 9.372 3.982 1.00 0.19 C ATOM 529 O SER A 361 8.157 9.684 2.868 1.00 0.24 O ATOM 530 CB SER A 361 10.944 10.175 3.749 1.00 0.26 C ATOM 531 OG SER A 361 11.965 10.982 4.307 1.00 0.31 O ATOM 0 H SER A 361 10.780 8.822 5.867 1.00 0.19 H new ATOM 0 HA SER A 361 9.376 11.173 4.820 1.00 0.21 H new ATOM 0 HB2 SER A 361 11.315 9.160 3.607 1.00 0.26 H new ATOM 0 HB3 SER A 361 10.672 10.556 2.765 1.00 0.26 H new ATOM 0 HG SER A 361 12.458 10.467 4.979 1.00 0.31 H new ATOM 537 N LYS A 362 8.109 8.350 4.699 1.00 0.15 N ATOM 538 CA LYS A 362 7.078 7.443 4.220 1.00 0.14 C ATOM 539 C LYS A 362 7.459 6.825 2.886 1.00 0.12 C ATOM 540 O LYS A 362 6.620 6.608 2.017 1.00 0.15 O ATOM 541 CB LYS A 362 5.719 8.131 4.152 1.00 0.20 C ATOM 542 CG LYS A 362 4.927 8.004 5.442 1.00 0.48 C ATOM 543 CD LYS A 362 5.628 8.697 6.592 1.00 0.48 C ATOM 544 CE LYS A 362 5.036 8.309 7.935 1.00 0.51 C ATOM 545 NZ LYS A 362 5.288 6.881 8.254 1.00 1.23 N ATOM 0 H LYS A 362 8.439 8.131 5.639 1.00 0.15 H new ATOM 0 HA LYS A 362 6.995 6.631 4.942 1.00 0.14 H new ATOM 0 HB2 LYS A 362 5.863 9.187 3.922 1.00 0.20 H new ATOM 0 HB3 LYS A 362 5.141 7.703 3.333 1.00 0.20 H new ATOM 0 HG2 LYS A 362 3.935 8.435 5.306 1.00 0.48 H new ATOM 0 HG3 LYS A 362 4.786 6.950 5.682 1.00 0.48 H new ATOM 0 HD2 LYS A 362 6.688 8.444 6.576 1.00 0.48 H new ATOM 0 HD3 LYS A 362 5.556 9.777 6.463 1.00 0.48 H new ATOM 0 HE2 LYS A 362 5.463 8.937 8.716 1.00 0.51 H new ATOM 0 HE3 LYS A 362 3.962 8.496 7.927 1.00 0.51 H new ATOM 0 HZ1 LYS A 362 5.087 6.709 9.260 1.00 1.23 H new ATOM 0 HZ2 LYS A 362 4.671 6.281 7.670 1.00 1.23 H new ATOM 0 HZ3 LYS A 362 6.283 6.651 8.056 1.00 1.23 H new ATOM 559 N ILE A 363 8.736 6.528 2.755 1.00 0.09 N ATOM 560 CA ILE A 363 9.267 5.876 1.581 1.00 0.09 C ATOM 561 C ILE A 363 9.442 4.399 1.861 1.00 0.08 C ATOM 562 O ILE A 363 10.068 4.024 2.851 1.00 0.10 O ATOM 563 CB ILE A 363 10.625 6.479 1.184 1.00 0.10 C ATOM 564 CG1 ILE A 363 10.446 7.922 0.720 1.00 0.16 C ATOM 565 CG2 ILE A 363 11.286 5.636 0.104 1.00 0.13 C ATOM 566 CD1 ILE A 363 11.731 8.713 0.697 1.00 0.46 C ATOM 0 H ILE A 363 9.437 6.735 3.466 1.00 0.09 H new ATOM 0 HA ILE A 363 8.566 6.023 0.759 1.00 0.09 H new ATOM 0 HB ILE A 363 11.278 6.480 2.057 1.00 0.10 H new ATOM 0 HG12 ILE A 363 10.011 7.922 -0.279 1.00 0.16 H new ATOM 0 HG13 ILE A 363 9.734 8.421 1.378 1.00 0.16 H new ATOM 0 HG21 ILE A 363 12.246 6.077 -0.165 1.00 0.13 H new ATOM 0 HG22 ILE A 363 11.443 4.624 0.478 1.00 0.13 H new ATOM 0 HG23 ILE A 363 10.643 5.602 -0.775 1.00 0.13 H new ATOM 0 HD11 ILE A 363 11.527 9.728 0.357 1.00 0.46 H new ATOM 0 HD12 ILE A 363 12.157 8.744 1.700 1.00 0.46 H new ATOM 0 HD13 ILE A 363 12.438 8.238 0.017 1.00 0.46 H new ATOM 578 N PHE A 364 8.901 3.563 1.002 1.00 0.09 N ATOM 579 CA PHE A 364 9.001 2.133 1.182 1.00 0.09 C ATOM 580 C PHE A 364 9.308 1.470 -0.153 1.00 0.10 C ATOM 581 O PHE A 364 8.980 1.997 -1.215 1.00 0.13 O ATOM 582 CB PHE A 364 7.708 1.559 1.790 1.00 0.09 C ATOM 583 CG PHE A 364 6.536 1.534 0.857 1.00 0.08 C ATOM 584 CD1 PHE A 364 6.330 0.454 0.019 1.00 0.12 C ATOM 585 CD2 PHE A 364 5.643 2.581 0.828 1.00 0.13 C ATOM 586 CE1 PHE A 364 5.248 0.420 -0.838 1.00 0.12 C ATOM 587 CE2 PHE A 364 4.556 2.558 -0.028 1.00 0.14 C ATOM 588 CZ PHE A 364 4.359 1.474 -0.863 1.00 0.08 C ATOM 0 H PHE A 364 8.386 3.851 0.170 1.00 0.09 H new ATOM 0 HA PHE A 364 9.813 1.925 1.879 1.00 0.09 H new ATOM 0 HB2 PHE A 364 7.904 0.543 2.133 1.00 0.09 H new ATOM 0 HB3 PHE A 364 7.443 2.147 2.669 1.00 0.09 H new ATOM 0 HD1 PHE A 364 7.024 -0.373 0.035 1.00 0.12 H new ATOM 0 HD2 PHE A 364 5.792 3.429 1.480 1.00 0.13 H new ATOM 0 HE1 PHE A 364 5.098 -0.430 -1.487 1.00 0.12 H new ATOM 0 HE2 PHE A 364 3.862 3.386 -0.044 1.00 0.14 H new ATOM 0 HZ PHE A 364 3.512 1.453 -1.533 1.00 0.08 H new ATOM 598 N ARG A 365 9.955 0.332 -0.089 1.00 0.10 N ATOM 599 CA ARG A 365 10.238 -0.459 -1.262 1.00 0.12 C ATOM 600 C ARG A 365 9.456 -1.759 -1.180 1.00 0.11 C ATOM 601 O ARG A 365 9.490 -2.434 -0.148 1.00 0.18 O ATOM 602 CB ARG A 365 11.733 -0.769 -1.322 1.00 0.17 C ATOM 603 CG ARG A 365 12.117 -1.686 -2.466 1.00 0.17 C ATOM 604 CD ARG A 365 12.514 -0.914 -3.709 1.00 0.31 C ATOM 605 NE ARG A 365 13.870 -0.373 -3.592 1.00 0.77 N ATOM 606 CZ ARG A 365 14.978 -1.070 -3.853 1.00 0.63 C ATOM 607 NH1 ARG A 365 14.893 -2.338 -4.238 1.00 1.48 N ATOM 608 NH2 ARG A 365 16.168 -0.502 -3.716 1.00 0.99 N ATOM 0 H ARG A 365 10.301 -0.073 0.781 1.00 0.10 H new ATOM 0 HA ARG A 365 9.949 0.093 -2.157 1.00 0.12 H new ATOM 0 HB2 ARG A 365 12.286 0.166 -1.415 1.00 0.17 H new ATOM 0 HB3 ARG A 365 12.039 -1.228 -0.382 1.00 0.17 H new ATOM 0 HG2 ARG A 365 12.945 -2.324 -2.156 1.00 0.17 H new ATOM 0 HG3 ARG A 365 11.279 -2.343 -2.700 1.00 0.17 H new ATOM 0 HD2 ARG A 365 12.455 -1.568 -4.579 1.00 0.31 H new ATOM 0 HD3 ARG A 365 11.809 -0.099 -3.874 1.00 0.31 H new ATOM 0 HE ARG A 365 13.974 0.596 -3.293 1.00 0.77 H new ATOM 0 HH11 ARG A 365 13.980 -2.781 -4.335 1.00 1.48 H new ATOM 0 HH12 ARG A 365 15.741 -2.869 -4.437 1.00 1.48 H new ATOM 0 HH21 ARG A 365 16.238 0.469 -3.411 1.00 0.99 H new ATOM 0 HH22 ARG A 365 17.014 -1.036 -3.916 1.00 0.99 H new ATOM 622 N ILE A 366 8.732 -2.105 -2.229 1.00 0.07 N ATOM 623 CA ILE A 366 8.136 -3.409 -2.296 1.00 0.06 C ATOM 624 C ILE A 366 9.217 -4.411 -2.642 1.00 0.07 C ATOM 625 O ILE A 366 9.757 -4.431 -3.746 1.00 0.10 O ATOM 626 CB ILE A 366 6.965 -3.454 -3.290 1.00 0.06 C ATOM 627 CG1 ILE A 366 5.782 -2.695 -2.683 1.00 0.07 C ATOM 628 CG2 ILE A 366 6.589 -4.898 -3.616 1.00 0.07 C ATOM 629 CD1 ILE A 366 4.685 -2.389 -3.663 1.00 0.09 C ATOM 0 H ILE A 366 8.549 -1.504 -3.032 1.00 0.07 H new ATOM 0 HA ILE A 366 7.707 -3.663 -1.327 1.00 0.06 H new ATOM 0 HB ILE A 366 7.255 -2.979 -4.227 1.00 0.06 H new ATOM 0 HG12 ILE A 366 5.369 -3.282 -1.863 1.00 0.07 H new ATOM 0 HG13 ILE A 366 6.144 -1.760 -2.255 1.00 0.07 H new ATOM 0 HG21 ILE A 366 5.758 -4.907 -4.321 1.00 0.07 H new ATOM 0 HG22 ILE A 366 7.446 -5.406 -4.058 1.00 0.07 H new ATOM 0 HG23 ILE A 366 6.294 -5.413 -2.701 1.00 0.07 H new ATOM 0 HD11 ILE A 366 3.884 -1.851 -3.156 1.00 0.09 H new ATOM 0 HD12 ILE A 366 5.081 -1.774 -4.472 1.00 0.09 H new ATOM 0 HD13 ILE A 366 4.293 -3.320 -4.073 1.00 0.09 H new ATOM 641 N VAL A 367 9.557 -5.193 -1.651 1.00 0.07 N ATOM 642 CA VAL A 367 10.701 -6.084 -1.717 1.00 0.08 C ATOM 643 C VAL A 367 10.374 -7.326 -2.521 1.00 0.09 C ATOM 644 O VAL A 367 11.140 -7.747 -3.388 1.00 0.12 O ATOM 645 CB VAL A 367 11.141 -6.462 -0.297 1.00 0.09 C ATOM 646 CG1 VAL A 367 12.234 -7.508 -0.314 1.00 0.12 C ATOM 647 CG2 VAL A 367 11.593 -5.219 0.437 1.00 0.10 C ATOM 0 H VAL A 367 9.049 -5.235 -0.767 1.00 0.07 H new ATOM 0 HA VAL A 367 11.519 -5.568 -2.220 1.00 0.08 H new ATOM 0 HB VAL A 367 10.290 -6.898 0.226 1.00 0.09 H new ATOM 0 HG11 VAL A 367 12.521 -7.751 0.709 1.00 0.12 H new ATOM 0 HG12 VAL A 367 11.870 -8.407 -0.812 1.00 0.12 H new ATOM 0 HG13 VAL A 367 13.100 -7.121 -0.851 1.00 0.12 H new ATOM 0 HG21 VAL A 367 11.906 -5.486 1.446 1.00 0.10 H new ATOM 0 HG22 VAL A 367 12.430 -4.767 -0.095 1.00 0.10 H new ATOM 0 HG23 VAL A 367 10.769 -4.507 0.489 1.00 0.10 H new ATOM 657 N ASP A 368 9.221 -7.885 -2.239 1.00 0.08 N ATOM 658 CA ASP A 368 8.731 -9.041 -2.954 1.00 0.09 C ATOM 659 C ASP A 368 7.241 -8.878 -3.173 1.00 0.08 C ATOM 660 O ASP A 368 6.419 -9.288 -2.359 1.00 0.09 O ATOM 661 CB ASP A 368 9.064 -10.317 -2.188 1.00 0.12 C ATOM 662 CG ASP A 368 8.644 -11.599 -2.897 1.00 0.22 C ATOM 663 OD1 ASP A 368 7.797 -11.520 -3.816 1.00 0.45 O ATOM 664 OD2 ASP A 368 9.142 -12.691 -2.542 1.00 0.78 O ATOM 0 H ASP A 368 8.595 -7.551 -1.506 1.00 0.08 H new ATOM 0 HA ASP A 368 9.217 -9.122 -3.926 1.00 0.09 H new ATOM 0 HB2 ASP A 368 10.139 -10.350 -2.009 1.00 0.12 H new ATOM 0 HB3 ASP A 368 8.579 -10.279 -1.213 1.00 0.12 H new ATOM 669 N PRO A 369 6.904 -8.228 -4.283 1.00 0.09 N ATOM 670 CA PRO A 369 5.529 -7.915 -4.668 1.00 0.10 C ATOM 671 C PRO A 369 4.680 -9.160 -4.821 1.00 0.12 C ATOM 672 O PRO A 369 3.482 -9.135 -4.578 1.00 0.14 O ATOM 673 CB PRO A 369 5.686 -7.206 -6.015 1.00 0.12 C ATOM 674 CG PRO A 369 7.040 -7.582 -6.493 1.00 0.12 C ATOM 675 CD PRO A 369 7.869 -7.743 -5.265 1.00 0.10 C ATOM 0 HA PRO A 369 5.022 -7.313 -3.914 1.00 0.10 H new ATOM 0 HB2 PRO A 369 4.917 -7.523 -6.719 1.00 0.12 H new ATOM 0 HB3 PRO A 369 5.592 -6.126 -5.905 1.00 0.12 H new ATOM 0 HG2 PRO A 369 7.009 -8.507 -7.069 1.00 0.12 H new ATOM 0 HG3 PRO A 369 7.452 -6.813 -7.146 1.00 0.12 H new ATOM 0 HD2 PRO A 369 8.683 -8.452 -5.417 1.00 0.10 H new ATOM 0 HD3 PRO A 369 8.321 -6.801 -4.956 1.00 0.10 H new ATOM 683 N ASN A 370 5.318 -10.249 -5.211 1.00 0.13 N ATOM 684 CA ASN A 370 4.640 -11.525 -5.347 1.00 0.17 C ATOM 685 C ASN A 370 4.201 -11.997 -3.979 1.00 0.17 C ATOM 686 O ASN A 370 3.064 -12.424 -3.776 1.00 0.21 O ATOM 687 CB ASN A 370 5.586 -12.539 -5.962 1.00 0.21 C ATOM 688 CG ASN A 370 4.854 -13.709 -6.588 1.00 0.36 C ATOM 689 OD1 ASN A 370 4.445 -13.653 -7.751 1.00 0.62 O ATOM 690 ND2 ASN A 370 4.694 -14.781 -5.831 1.00 0.59 N ATOM 0 H ASN A 370 6.312 -10.274 -5.440 1.00 0.13 H new ATOM 0 HA ASN A 370 3.769 -11.415 -5.992 1.00 0.17 H new ATOM 0 HB2 ASN A 370 6.196 -12.049 -6.720 1.00 0.21 H new ATOM 0 HB3 ASN A 370 6.266 -12.908 -5.195 1.00 0.21 H new ATOM 0 HD21 ASN A 370 4.218 -15.602 -6.204 1.00 0.59 H new ATOM 0 HD22 ASN A 370 5.047 -14.787 -4.874 1.00 0.59 H new ATOM 697 N GLY A 371 5.128 -11.895 -3.042 1.00 0.16 N ATOM 698 CA GLY A 371 4.841 -12.211 -1.660 1.00 0.19 C ATOM 699 C GLY A 371 3.860 -11.236 -1.047 1.00 0.13 C ATOM 700 O GLY A 371 3.018 -11.613 -0.234 1.00 0.13 O ATOM 0 H GLY A 371 6.087 -11.595 -3.217 1.00 0.16 H new ATOM 0 HA2 GLY A 371 4.436 -13.221 -1.596 1.00 0.19 H new ATOM 0 HA3 GLY A 371 5.768 -12.202 -1.086 1.00 0.19 H new ATOM 704 N LEU A 372 3.961 -9.983 -1.467 1.00 0.10 N ATOM 705 CA LEU A 372 3.195 -8.901 -0.865 1.00 0.08 C ATOM 706 C LEU A 372 1.755 -8.967 -1.338 1.00 0.11 C ATOM 707 O LEU A 372 0.815 -8.780 -0.572 1.00 0.13 O ATOM 708 CB LEU A 372 3.816 -7.551 -1.245 1.00 0.08 C ATOM 709 CG LEU A 372 3.557 -6.396 -0.274 1.00 0.08 C ATOM 710 CD1 LEU A 372 2.116 -5.921 -0.330 1.00 0.10 C ATOM 711 CD2 LEU A 372 3.899 -6.830 1.136 1.00 0.09 C ATOM 0 H LEU A 372 4.572 -9.689 -2.229 1.00 0.10 H new ATOM 0 HA LEU A 372 3.215 -9.005 0.220 1.00 0.08 H new ATOM 0 HB2 LEU A 372 4.894 -7.684 -1.342 1.00 0.08 H new ATOM 0 HB3 LEU A 372 3.441 -7.265 -2.227 1.00 0.08 H new ATOM 0 HG LEU A 372 4.192 -5.562 -0.572 1.00 0.08 H new ATOM 0 HD11 LEU A 372 1.976 -5.101 0.374 1.00 0.10 H new ATOM 0 HD12 LEU A 372 1.885 -5.577 -1.338 1.00 0.10 H new ATOM 0 HD13 LEU A 372 1.451 -6.744 -0.066 1.00 0.10 H new ATOM 0 HD21 LEU A 372 3.714 -6.006 1.825 1.00 0.09 H new ATOM 0 HD22 LEU A 372 3.280 -7.682 1.415 1.00 0.09 H new ATOM 0 HD23 LEU A 372 4.950 -7.114 1.184 1.00 0.09 H new ATOM 723 N ALA A 373 1.604 -9.246 -2.614 1.00 0.12 N ATOM 724 CA ALA A 373 0.305 -9.327 -3.243 1.00 0.15 C ATOM 725 C ALA A 373 -0.498 -10.473 -2.663 1.00 0.14 C ATOM 726 O ALA A 373 -1.710 -10.364 -2.473 1.00 0.16 O ATOM 727 CB ALA A 373 0.486 -9.513 -4.725 1.00 0.20 C ATOM 0 H ALA A 373 2.383 -9.424 -3.247 1.00 0.12 H new ATOM 0 HA ALA A 373 -0.243 -8.403 -3.056 1.00 0.15 H new ATOM 0 HB1 ALA A 373 -0.490 -9.575 -5.206 1.00 0.20 H new ATOM 0 HB2 ALA A 373 1.038 -8.667 -5.133 1.00 0.20 H new ATOM 0 HB3 ALA A 373 1.041 -10.432 -4.911 1.00 0.20 H new ATOM 733 N ARG A 374 0.190 -11.568 -2.368 1.00 0.14 N ATOM 734 CA ARG A 374 -0.447 -12.726 -1.773 1.00 0.17 C ATOM 735 C ARG A 374 -1.013 -12.360 -0.406 1.00 0.14 C ATOM 736 O ARG A 374 -2.026 -12.903 0.018 1.00 0.16 O ATOM 737 CB ARG A 374 0.541 -13.894 -1.685 1.00 0.24 C ATOM 738 CG ARG A 374 0.956 -14.274 -0.285 1.00 0.28 C ATOM 739 CD ARG A 374 1.717 -15.585 -0.290 1.00 0.47 C ATOM 740 NE ARG A 374 0.956 -16.655 -0.935 1.00 1.44 N ATOM 741 CZ ARG A 374 1.019 -17.938 -0.584 1.00 2.04 C ATOM 742 NH1 ARG A 374 1.771 -18.318 0.441 1.00 2.01 N ATOM 743 NH2 ARG A 374 0.310 -18.836 -1.255 1.00 3.03 N ATOM 0 H ARG A 374 1.191 -11.675 -2.533 1.00 0.14 H new ATOM 0 HA ARG A 374 -1.275 -13.048 -2.405 1.00 0.17 H new ATOM 0 HB2 ARG A 374 0.094 -14.765 -2.164 1.00 0.24 H new ATOM 0 HB3 ARG A 374 1.434 -13.639 -2.256 1.00 0.24 H new ATOM 0 HG2 ARG A 374 1.579 -13.488 0.141 1.00 0.28 H new ATOM 0 HG3 ARG A 374 0.074 -14.362 0.350 1.00 0.28 H new ATOM 0 HD2 ARG A 374 2.667 -15.452 -0.808 1.00 0.47 H new ATOM 0 HD3 ARG A 374 1.951 -15.873 0.735 1.00 0.47 H new ATOM 0 HE ARG A 374 0.336 -16.402 -1.704 1.00 1.44 H new ATOM 0 HH11 ARG A 374 2.306 -17.626 0.966 1.00 2.01 H new ATOM 0 HH12 ARG A 374 1.815 -19.302 0.704 1.00 2.01 H new ATOM 0 HH21 ARG A 374 -0.279 -18.542 -2.034 1.00 3.03 H new ATOM 0 HH22 ARG A 374 0.354 -19.820 -0.992 1.00 3.03 H new ATOM 757 N LEU A 375 -0.357 -11.417 0.263 1.00 0.13 N ATOM 758 CA LEU A 375 -0.867 -10.854 1.513 1.00 0.15 C ATOM 759 C LEU A 375 -2.175 -10.127 1.243 1.00 0.16 C ATOM 760 O LEU A 375 -3.157 -10.291 1.963 1.00 0.18 O ATOM 761 CB LEU A 375 0.138 -9.852 2.094 1.00 0.17 C ATOM 762 CG LEU A 375 1.219 -10.383 3.038 1.00 0.16 C ATOM 763 CD1 LEU A 375 1.677 -11.771 2.658 1.00 0.29 C ATOM 764 CD2 LEU A 375 2.402 -9.435 3.018 1.00 0.15 C ATOM 0 H LEU A 375 0.534 -11.023 -0.040 1.00 0.13 H new ATOM 0 HA LEU A 375 -1.023 -11.666 2.223 1.00 0.15 H new ATOM 0 HB2 LEU A 375 0.637 -9.358 1.260 1.00 0.17 H new ATOM 0 HB3 LEU A 375 -0.425 -9.086 2.628 1.00 0.17 H new ATOM 0 HG LEU A 375 0.791 -10.443 4.039 1.00 0.16 H new ATOM 0 HD11 LEU A 375 2.444 -12.105 3.357 1.00 0.29 H new ATOM 0 HD12 LEU A 375 0.830 -12.456 2.694 1.00 0.29 H new ATOM 0 HD13 LEU A 375 2.088 -11.755 1.649 1.00 0.29 H new ATOM 0 HD21 LEU A 375 3.177 -9.806 3.688 1.00 0.15 H new ATOM 0 HD22 LEU A 375 2.799 -9.370 2.005 1.00 0.15 H new ATOM 0 HD23 LEU A 375 2.082 -8.446 3.346 1.00 0.15 H new ATOM 776 N TRP A 376 -2.166 -9.335 0.178 1.00 0.16 N ATOM 777 CA TRP A 376 -3.306 -8.511 -0.197 1.00 0.18 C ATOM 778 C TRP A 376 -4.547 -9.371 -0.452 1.00 0.20 C ATOM 779 O TRP A 376 -5.603 -9.137 0.132 1.00 0.25 O ATOM 780 CB TRP A 376 -2.945 -7.683 -1.437 1.00 0.19 C ATOM 781 CG TRP A 376 -3.938 -6.617 -1.794 1.00 0.18 C ATOM 782 CD1 TRP A 376 -4.341 -6.269 -3.051 1.00 0.20 C ATOM 783 CD2 TRP A 376 -4.644 -5.754 -0.895 1.00 0.18 C ATOM 784 NE1 TRP A 376 -5.245 -5.240 -2.987 1.00 0.21 N ATOM 785 CE2 TRP A 376 -5.454 -4.911 -1.678 1.00 0.21 C ATOM 786 CE3 TRP A 376 -4.672 -5.610 0.494 1.00 0.19 C ATOM 787 CZ2 TRP A 376 -6.281 -3.942 -1.120 1.00 0.24 C ATOM 788 CZ3 TRP A 376 -5.489 -4.645 1.045 1.00 0.22 C ATOM 789 CH2 TRP A 376 -6.287 -3.827 0.237 1.00 0.24 C ATOM 0 H TRP A 376 -1.367 -9.247 -0.450 1.00 0.16 H new ATOM 0 HA TRP A 376 -3.545 -7.837 0.626 1.00 0.18 H new ATOM 0 HB2 TRP A 376 -1.974 -7.215 -1.274 1.00 0.19 H new ATOM 0 HB3 TRP A 376 -2.835 -8.357 -2.287 1.00 0.19 H new ATOM 0 HD1 TRP A 376 -3.998 -6.736 -3.962 1.00 0.20 H new ATOM 0 HE1 TRP A 376 -5.690 -4.792 -3.788 1.00 0.21 H new ATOM 0 HE3 TRP A 376 -4.065 -6.243 1.125 1.00 0.19 H new ATOM 0 HZ2 TRP A 376 -6.895 -3.305 -1.739 1.00 0.24 H new ATOM 0 HZ3 TRP A 376 -5.513 -4.519 2.117 1.00 0.22 H new ATOM 0 HH2 TRP A 376 -6.923 -3.087 0.701 1.00 0.24 H new ATOM 800 N GLY A 377 -4.416 -10.372 -1.315 1.00 0.21 N ATOM 801 CA GLY A 377 -5.522 -11.273 -1.582 1.00 0.27 C ATOM 802 C GLY A 377 -5.880 -12.115 -0.377 1.00 0.30 C ATOM 803 O GLY A 377 -7.038 -12.472 -0.191 1.00 0.38 O ATOM 0 H GLY A 377 -3.563 -10.576 -1.835 1.00 0.21 H new ATOM 0 HA2 GLY A 377 -6.393 -10.694 -1.890 1.00 0.27 H new ATOM 0 HA3 GLY A 377 -5.263 -11.926 -2.415 1.00 0.27 H new ATOM 807 N ASN A 378 -4.881 -12.431 0.438 1.00 0.27 N ATOM 808 CA ASN A 378 -5.098 -13.166 1.679 1.00 0.30 C ATOM 809 C ASN A 378 -5.971 -12.359 2.635 1.00 0.30 C ATOM 810 O ASN A 378 -6.894 -12.890 3.252 1.00 0.35 O ATOM 811 CB ASN A 378 -3.768 -13.501 2.335 1.00 0.32 C ATOM 812 CG ASN A 378 -3.373 -14.951 2.138 1.00 0.38 C ATOM 813 OD1 ASN A 378 -4.215 -15.851 2.131 1.00 0.76 O ATOM 814 ND2 ASN A 378 -2.090 -15.179 1.951 1.00 0.42 N ATOM 0 H ASN A 378 -3.906 -12.188 0.260 1.00 0.27 H new ATOM 0 HA ASN A 378 -5.615 -14.096 1.442 1.00 0.30 H new ATOM 0 HB2 ASN A 378 -2.991 -12.857 1.923 1.00 0.32 H new ATOM 0 HB3 ASN A 378 -3.828 -13.286 3.402 1.00 0.32 H new ATOM 0 HD21 ASN A 378 -1.759 -16.131 1.792 1.00 0.42 H new ATOM 0 HD22 ASN A 378 -1.427 -14.404 1.965 1.00 0.42 H new ATOM 821 N HIS A 379 -5.673 -11.067 2.727 1.00 0.28 N ATOM 822 CA HIS A 379 -6.425 -10.145 3.570 1.00 0.30 C ATOM 823 C HIS A 379 -7.830 -9.913 3.014 1.00 0.32 C ATOM 824 O HIS A 379 -8.812 -9.932 3.757 1.00 0.38 O ATOM 825 CB HIS A 379 -5.659 -8.816 3.682 1.00 0.28 C ATOM 826 CG HIS A 379 -6.411 -7.702 4.352 1.00 0.32 C ATOM 827 ND1 HIS A 379 -6.534 -7.628 5.717 1.00 0.43 N ATOM 828 CD2 HIS A 379 -7.033 -6.636 3.794 1.00 0.31 C ATOM 829 CE1 HIS A 379 -7.221 -6.526 5.959 1.00 0.46 C ATOM 830 NE2 HIS A 379 -7.544 -5.889 4.823 1.00 0.38 N ATOM 0 H HIS A 379 -4.904 -10.630 2.219 1.00 0.28 H new ATOM 0 HA HIS A 379 -6.533 -10.583 4.562 1.00 0.30 H new ATOM 0 HB2 HIS A 379 -4.735 -8.992 4.233 1.00 0.28 H new ATOM 0 HB3 HIS A 379 -5.376 -8.492 2.680 1.00 0.28 H new ATOM 0 HD2 HIS A 379 -7.111 -6.417 2.739 1.00 0.31 H new ATOM 0 HE1 HIS A 379 -7.489 -6.181 6.947 1.00 0.46 H new ATOM 0 HE2 HIS A 379 -8.068 -5.018 4.741 1.00 0.38 H new ATOM 838 N LYS A 380 -7.928 -9.715 1.704 1.00 0.32 N ATOM 839 CA LYS A 380 -9.213 -9.412 1.087 1.00 0.36 C ATOM 840 C LYS A 380 -10.009 -10.682 0.798 1.00 0.41 C ATOM 841 O LYS A 380 -11.127 -10.621 0.284 1.00 0.45 O ATOM 842 CB LYS A 380 -9.029 -8.613 -0.205 1.00 0.36 C ATOM 843 CG LYS A 380 -8.127 -7.400 -0.052 1.00 0.38 C ATOM 844 CD LYS A 380 -8.428 -6.332 -1.094 1.00 0.63 C ATOM 845 CE LYS A 380 -8.442 -6.884 -2.511 1.00 0.33 C ATOM 846 NZ LYS A 380 -8.683 -5.813 -3.515 1.00 0.77 N ATOM 0 H LYS A 380 -7.142 -9.758 1.055 1.00 0.32 H new ATOM 0 HA LYS A 380 -9.774 -8.807 1.800 1.00 0.36 H new ATOM 0 HB2 LYS A 380 -8.614 -9.268 -0.971 1.00 0.36 H new ATOM 0 HB3 LYS A 380 -10.006 -8.285 -0.561 1.00 0.36 H new ATOM 0 HG2 LYS A 380 -8.252 -6.979 0.946 1.00 0.38 H new ATOM 0 HG3 LYS A 380 -7.085 -7.709 -0.140 1.00 0.38 H new ATOM 0 HD2 LYS A 380 -9.395 -5.879 -0.875 1.00 0.63 H new ATOM 0 HD3 LYS A 380 -7.682 -5.541 -1.024 1.00 0.63 H new ATOM 0 HE2 LYS A 380 -7.490 -7.372 -2.721 1.00 0.33 H new ATOM 0 HE3 LYS A 380 -9.217 -7.645 -2.598 1.00 0.33 H new ATOM 0 HZ1 LYS A 380 -9.221 -6.202 -4.316 1.00 0.77 H new ATOM 0 HZ2 LYS A 380 -9.225 -5.042 -3.076 1.00 0.77 H new ATOM 0 HZ3 LYS A 380 -7.772 -5.445 -3.856 1.00 0.77 H new ATOM 860 N ASN A 381 -9.419 -11.830 1.144 1.00 0.44 N ATOM 861 CA ASN A 381 -10.038 -13.138 0.940 1.00 0.52 C ATOM 862 C ASN A 381 -10.365 -13.370 -0.531 1.00 0.53 C ATOM 863 O ASN A 381 -11.468 -13.805 -0.871 1.00 0.60 O ATOM 864 CB ASN A 381 -11.307 -13.273 1.787 1.00 0.58 C ATOM 865 CG ASN A 381 -11.028 -13.263 3.277 1.00 1.20 C ATOM 866 OD1 ASN A 381 -10.820 -14.312 3.884 1.00 1.87 O ATOM 867 ND2 ASN A 381 -11.024 -12.085 3.879 1.00 2.01 N ATOM 0 H ASN A 381 -8.496 -11.876 1.575 1.00 0.44 H new ATOM 0 HA ASN A 381 -9.321 -13.896 1.255 1.00 0.52 H new ATOM 0 HB2 ASN A 381 -11.987 -12.457 1.545 1.00 0.58 H new ATOM 0 HB3 ASN A 381 -11.816 -14.201 1.524 1.00 0.58 H new ATOM 0 HD21 ASN A 381 -10.844 -12.025 4.881 1.00 2.01 H new ATOM 0 HD22 ASN A 381 -11.201 -11.237 3.341 1.00 2.01 H new ATOM 874 N ARG A 382 -9.404 -13.088 -1.404 1.00 0.50 N ATOM 875 CA ARG A 382 -9.634 -13.169 -2.839 1.00 0.55 C ATOM 876 C ARG A 382 -8.620 -14.055 -3.536 1.00 0.68 C ATOM 877 O ARG A 382 -7.420 -14.001 -3.255 1.00 0.78 O ATOM 878 CB ARG A 382 -9.569 -11.782 -3.488 1.00 0.49 C ATOM 879 CG ARG A 382 -10.576 -10.790 -2.940 1.00 0.48 C ATOM 880 CD ARG A 382 -11.990 -11.198 -3.315 1.00 0.57 C ATOM 881 NE ARG A 382 -12.987 -10.214 -2.903 1.00 0.65 N ATOM 882 CZ ARG A 382 -13.689 -9.465 -3.756 1.00 1.11 C ATOM 883 NH1 ARG A 382 -13.477 -9.565 -5.064 1.00 1.69 N ATOM 884 NH2 ARG A 382 -14.602 -8.619 -3.301 1.00 1.27 N ATOM 0 H ARG A 382 -8.461 -12.802 -1.142 1.00 0.50 H new ATOM 0 HA ARG A 382 -10.628 -13.599 -2.957 1.00 0.55 H new ATOM 0 HB2 ARG A 382 -8.566 -11.377 -3.352 1.00 0.49 H new ATOM 0 HB3 ARG A 382 -9.728 -11.888 -4.561 1.00 0.49 H new ATOM 0 HG2 ARG A 382 -10.484 -10.733 -1.855 1.00 0.48 H new ATOM 0 HG3 ARG A 382 -10.363 -9.795 -3.331 1.00 0.48 H new ATOM 0 HD2 ARG A 382 -12.049 -11.339 -4.394 1.00 0.57 H new ATOM 0 HD3 ARG A 382 -12.221 -12.159 -2.854 1.00 0.57 H new ATOM 0 HE ARG A 382 -13.157 -10.092 -1.905 1.00 0.65 H new ATOM 0 HH11 ARG A 382 -12.776 -10.216 -5.419 1.00 1.69 H new ATOM 0 HH12 ARG A 382 -14.015 -8.991 -5.713 1.00 1.69 H new ATOM 0 HH21 ARG A 382 -14.769 -8.540 -2.298 1.00 1.27 H new ATOM 0 HH22 ARG A 382 -15.138 -8.047 -3.954 1.00 1.27 H new ATOM 898 N THR A 383 -9.121 -14.869 -4.443 1.00 0.76 N ATOM 899 CA THR A 383 -8.295 -15.483 -5.457 1.00 0.95 C ATOM 900 C THR A 383 -8.176 -14.469 -6.597 1.00 0.94 C ATOM 901 O THR A 383 -8.755 -13.380 -6.492 1.00 1.22 O ATOM 902 CB THR A 383 -8.927 -16.804 -5.952 1.00 1.17 C ATOM 903 OG1 THR A 383 -9.545 -17.477 -4.846 1.00 1.24 O ATOM 904 CG2 THR A 383 -7.883 -17.723 -6.578 1.00 1.37 C ATOM 0 H THR A 383 -10.108 -15.121 -4.496 1.00 0.76 H new ATOM 0 HA THR A 383 -7.312 -15.737 -5.061 1.00 0.95 H new ATOM 0 HB THR A 383 -9.668 -16.561 -6.713 1.00 1.17 H new ATOM 0 HG1 THR A 383 -9.948 -18.314 -5.157 1.00 1.24 H new ATOM 0 HG21 THR A 383 -8.362 -18.642 -6.915 1.00 1.37 H new ATOM 0 HG22 THR A 383 -7.421 -17.222 -7.429 1.00 1.37 H new ATOM 0 HG23 THR A 383 -7.119 -17.962 -5.839 1.00 1.37 H new ATOM 912 N ASN A 384 -7.414 -14.786 -7.646 1.00 0.84 N ATOM 913 CA ASN A 384 -7.233 -13.887 -8.795 1.00 0.81 C ATOM 914 C ASN A 384 -6.314 -12.722 -8.463 1.00 0.64 C ATOM 915 O ASN A 384 -5.824 -12.035 -9.360 1.00 0.77 O ATOM 916 CB ASN A 384 -8.565 -13.322 -9.268 1.00 0.89 C ATOM 917 CG ASN A 384 -9.435 -14.328 -9.998 1.00 1.40 C ATOM 918 OD1 ASN A 384 -9.382 -15.531 -9.738 1.00 2.21 O ATOM 919 ND2 ASN A 384 -10.256 -13.834 -10.912 1.00 1.70 N ATOM 0 H ASN A 384 -6.906 -15.667 -7.726 1.00 0.84 H new ATOM 0 HA ASN A 384 -6.782 -14.489 -9.584 1.00 0.81 H new ATOM 0 HB2 ASN A 384 -9.113 -12.940 -8.407 1.00 0.89 H new ATOM 0 HB3 ASN A 384 -8.376 -12.474 -9.927 1.00 0.89 H new ATOM 0 HD21 ASN A 384 -10.875 -14.456 -11.431 1.00 1.70 H new ATOM 0 HD22 ASN A 384 -10.269 -12.831 -11.097 1.00 1.70 H new ATOM 926 N MET A 385 -6.111 -12.485 -7.177 1.00 0.55 N ATOM 927 CA MET A 385 -5.291 -11.380 -6.719 1.00 0.42 C ATOM 928 C MET A 385 -3.867 -11.510 -7.234 1.00 0.53 C ATOM 929 O MET A 385 -3.305 -12.606 -7.290 1.00 0.94 O ATOM 930 CB MET A 385 -5.340 -11.288 -5.184 1.00 0.47 C ATOM 931 CG MET A 385 -4.011 -10.946 -4.515 1.00 0.92 C ATOM 932 SD MET A 385 -2.869 -12.350 -4.435 1.00 2.54 S ATOM 933 CE MET A 385 -3.847 -13.564 -3.555 1.00 3.18 C ATOM 0 H MET A 385 -6.508 -13.051 -6.427 1.00 0.55 H new ATOM 0 HA MET A 385 -5.692 -10.451 -7.124 1.00 0.42 H new ATOM 0 HB2 MET A 385 -6.075 -10.534 -4.904 1.00 0.47 H new ATOM 0 HB3 MET A 385 -5.694 -12.240 -4.789 1.00 0.47 H new ATOM 0 HG2 MET A 385 -3.536 -10.131 -5.061 1.00 0.92 H new ATOM 0 HG3 MET A 385 -4.203 -10.584 -3.505 1.00 0.92 H new ATOM 0 HE1 MET A 385 -3.353 -14.534 -3.604 1.00 3.18 H new ATOM 0 HE2 MET A 385 -3.951 -13.262 -2.513 1.00 3.18 H new ATOM 0 HE3 MET A 385 -4.834 -13.636 -4.012 1.00 3.18 H new ATOM 943 N THR A 386 -3.318 -10.388 -7.654 1.00 0.23 N ATOM 944 CA THR A 386 -1.955 -10.325 -8.127 1.00 0.24 C ATOM 945 C THR A 386 -1.313 -9.044 -7.623 1.00 0.16 C ATOM 946 O THR A 386 -1.970 -8.250 -6.942 1.00 0.18 O ATOM 947 CB THR A 386 -1.888 -10.346 -9.668 1.00 0.33 C ATOM 948 OG1 THR A 386 -2.511 -9.173 -10.203 1.00 0.34 O ATOM 949 CG2 THR A 386 -2.578 -11.575 -10.229 1.00 0.44 C ATOM 0 H THR A 386 -3.808 -9.494 -7.676 1.00 0.23 H new ATOM 0 HA THR A 386 -1.424 -11.199 -7.749 1.00 0.24 H new ATOM 0 HB THR A 386 -0.837 -10.372 -9.956 1.00 0.33 H new ATOM 0 HG1 THR A 386 -2.808 -9.350 -11.120 1.00 0.34 H new ATOM 0 HG21 THR A 386 -2.515 -11.563 -11.317 1.00 0.44 H new ATOM 0 HG22 THR A 386 -2.090 -12.472 -9.847 1.00 0.44 H new ATOM 0 HG23 THR A 386 -3.625 -11.574 -9.926 1.00 0.44 H new ATOM 957 N TYR A 387 -0.052 -8.826 -7.953 1.00 0.16 N ATOM 958 CA TYR A 387 0.577 -7.551 -7.643 1.00 0.13 C ATOM 959 C TYR A 387 -0.095 -6.448 -8.448 1.00 0.14 C ATOM 960 O TYR A 387 -0.130 -5.296 -8.032 1.00 0.17 O ATOM 961 CB TYR A 387 2.077 -7.569 -7.930 1.00 0.15 C ATOM 962 CG TYR A 387 2.695 -6.231 -7.641 1.00 0.13 C ATOM 963 CD1 TYR A 387 2.659 -5.711 -6.357 1.00 0.12 C ATOM 964 CD2 TYR A 387 3.258 -5.461 -8.650 1.00 0.14 C ATOM 965 CE1 TYR A 387 3.170 -4.473 -6.083 1.00 0.12 C ATOM 966 CE2 TYR A 387 3.768 -4.210 -8.383 1.00 0.14 C ATOM 967 CZ TYR A 387 3.722 -3.718 -7.097 1.00 0.12 C ATOM 968 OH TYR A 387 4.219 -2.465 -6.830 1.00 0.13 O ATOM 0 H TYR A 387 0.549 -9.500 -8.427 1.00 0.16 H new ATOM 0 HA TYR A 387 0.453 -7.364 -6.576 1.00 0.13 H new ATOM 0 HB2 TYR A 387 2.558 -8.335 -7.322 1.00 0.15 H new ATOM 0 HB3 TYR A 387 2.248 -7.835 -8.973 1.00 0.15 H new ATOM 0 HD1 TYR A 387 2.220 -6.293 -5.560 1.00 0.12 H new ATOM 0 HD2 TYR A 387 3.296 -5.848 -9.657 1.00 0.14 H new ATOM 0 HE1 TYR A 387 3.142 -4.087 -5.075 1.00 0.12 H new ATOM 0 HE2 TYR A 387 4.201 -3.619 -9.176 1.00 0.14 H new ATOM 0 HH TYR A 387 4.572 -2.070 -7.655 1.00 0.13 H new ATOM 978 N GLU A 388 -0.654 -6.813 -9.591 1.00 0.17 N ATOM 979 CA GLU A 388 -1.386 -5.865 -10.408 1.00 0.24 C ATOM 980 C GLU A 388 -2.638 -5.395 -9.672 1.00 0.25 C ATOM 981 O GLU A 388 -2.999 -4.223 -9.732 1.00 0.31 O ATOM 982 CB GLU A 388 -1.763 -6.481 -11.743 1.00 0.30 C ATOM 983 CG GLU A 388 -2.377 -5.478 -12.692 1.00 0.44 C ATOM 984 CD GLU A 388 -1.399 -4.395 -13.104 1.00 1.53 C ATOM 985 OE1 GLU A 388 -0.222 -4.721 -13.379 1.00 1.96 O ATOM 986 OE2 GLU A 388 -1.796 -3.215 -13.151 1.00 2.21 O ATOM 0 H GLU A 388 -0.614 -7.758 -9.972 1.00 0.17 H new ATOM 0 HA GLU A 388 -0.742 -5.006 -10.598 1.00 0.24 H new ATOM 0 HB2 GLU A 388 -0.875 -6.915 -12.203 1.00 0.30 H new ATOM 0 HB3 GLU A 388 -2.467 -7.297 -11.577 1.00 0.30 H new ATOM 0 HG2 GLU A 388 -2.736 -5.996 -13.581 1.00 0.44 H new ATOM 0 HG3 GLU A 388 -3.245 -5.019 -12.219 1.00 0.44 H new ATOM 993 N LYS A 389 -3.290 -6.316 -8.967 1.00 0.23 N ATOM 994 CA LYS A 389 -4.430 -5.966 -8.122 1.00 0.28 C ATOM 995 C LYS A 389 -4.009 -4.973 -7.041 1.00 0.28 C ATOM 996 O LYS A 389 -4.798 -4.132 -6.605 1.00 0.40 O ATOM 997 CB LYS A 389 -5.042 -7.211 -7.470 1.00 0.32 C ATOM 998 CG LYS A 389 -6.023 -7.956 -8.364 1.00 0.45 C ATOM 999 CD LYS A 389 -5.363 -8.483 -9.624 1.00 0.33 C ATOM 1000 CE LYS A 389 -6.378 -9.053 -10.600 1.00 0.46 C ATOM 1001 NZ LYS A 389 -7.356 -8.030 -11.055 1.00 1.39 N ATOM 0 H LYS A 389 -3.050 -7.307 -8.963 1.00 0.23 H new ATOM 0 HA LYS A 389 -5.184 -5.505 -8.760 1.00 0.28 H new ATOM 0 HB2 LYS A 389 -4.239 -7.890 -7.183 1.00 0.32 H new ATOM 0 HB3 LYS A 389 -5.553 -6.915 -6.554 1.00 0.32 H new ATOM 0 HG2 LYS A 389 -6.459 -8.787 -7.809 1.00 0.45 H new ATOM 0 HG3 LYS A 389 -6.842 -7.290 -8.636 1.00 0.45 H new ATOM 0 HD2 LYS A 389 -4.808 -7.679 -10.106 1.00 0.33 H new ATOM 0 HD3 LYS A 389 -4.641 -9.255 -9.360 1.00 0.33 H new ATOM 0 HE2 LYS A 389 -5.857 -9.465 -11.464 1.00 0.46 H new ATOM 0 HE3 LYS A 389 -6.911 -9.878 -10.127 1.00 0.46 H new ATOM 0 HZ1 LYS A 389 -7.837 -8.367 -11.913 1.00 1.39 H new ATOM 0 HZ2 LYS A 389 -8.059 -7.865 -10.307 1.00 1.39 H new ATOM 0 HZ3 LYS A 389 -6.857 -7.142 -11.264 1.00 1.39 H new ATOM 1015 N MET A 390 -2.764 -5.089 -6.603 1.00 0.19 N ATOM 1016 CA MET A 390 -2.189 -4.147 -5.656 1.00 0.17 C ATOM 1017 C MET A 390 -1.845 -2.836 -6.353 1.00 0.16 C ATOM 1018 O MET A 390 -2.166 -1.754 -5.866 1.00 0.17 O ATOM 1019 CB MET A 390 -0.925 -4.728 -5.023 1.00 0.15 C ATOM 1020 CG MET A 390 -0.301 -3.796 -4.003 1.00 0.14 C ATOM 1021 SD MET A 390 1.218 -4.438 -3.287 1.00 0.18 S ATOM 1022 CE MET A 390 1.648 -3.091 -2.185 1.00 1.57 C ATOM 0 H MET A 390 -2.129 -5.833 -6.892 1.00 0.19 H new ATOM 0 HA MET A 390 -2.927 -3.959 -4.876 1.00 0.17 H new ATOM 0 HB2 MET A 390 -1.167 -5.676 -4.543 1.00 0.15 H new ATOM 0 HB3 MET A 390 -0.197 -4.943 -5.806 1.00 0.15 H new ATOM 0 HG2 MET A 390 -0.094 -2.837 -4.477 1.00 0.14 H new ATOM 0 HG3 MET A 390 -1.020 -3.609 -3.205 1.00 0.14 H new ATOM 0 HE1 MET A 390 2.654 -3.246 -1.796 1.00 1.57 H new ATOM 0 HE2 MET A 390 1.612 -2.148 -2.731 1.00 1.57 H new ATOM 0 HE3 MET A 390 0.940 -3.058 -1.357 1.00 1.57 H new ATOM 1032 N SER A 391 -1.187 -2.954 -7.496 1.00 0.15 N ATOM 1033 CA SER A 391 -0.780 -1.802 -8.284 1.00 0.17 C ATOM 1034 C SER A 391 -1.998 -0.973 -8.689 1.00 0.19 C ATOM 1035 O SER A 391 -1.954 0.250 -8.666 1.00 0.21 O ATOM 1036 CB SER A 391 -0.002 -2.263 -9.526 1.00 0.23 C ATOM 1037 OG SER A 391 0.553 -1.166 -10.233 1.00 1.02 O ATOM 0 H SER A 391 -0.920 -3.851 -7.903 1.00 0.15 H new ATOM 0 HA SER A 391 -0.128 -1.174 -7.677 1.00 0.17 H new ATOM 0 HB2 SER A 391 0.795 -2.943 -9.225 1.00 0.23 H new ATOM 0 HB3 SER A 391 -0.666 -2.822 -10.185 1.00 0.23 H new ATOM 0 HG SER A 391 1.042 -1.495 -11.016 1.00 1.02 H new ATOM 1043 N ARG A 392 -3.092 -1.653 -9.023 1.00 0.21 N ATOM 1044 CA ARG A 392 -4.340 -0.995 -9.393 1.00 0.26 C ATOM 1045 C ARG A 392 -4.794 -0.054 -8.279 1.00 0.22 C ATOM 1046 O ARG A 392 -5.353 1.014 -8.538 1.00 0.30 O ATOM 1047 CB ARG A 392 -5.373 -2.059 -9.745 1.00 0.38 C ATOM 1048 CG ARG A 392 -6.333 -2.432 -8.654 1.00 1.12 C ATOM 1049 CD ARG A 392 -7.475 -1.444 -8.575 1.00 2.05 C ATOM 1050 NE ARG A 392 -8.694 -2.047 -8.028 1.00 2.61 N ATOM 1051 CZ ARG A 392 -9.919 -1.562 -8.223 1.00 3.35 C ATOM 1052 NH1 ARG A 392 -10.095 -0.474 -8.965 1.00 3.75 N ATOM 1053 NH2 ARG A 392 -10.968 -2.173 -7.684 1.00 4.06 N ATOM 0 H ARG A 392 -3.137 -2.672 -9.044 1.00 0.21 H new ATOM 0 HA ARG A 392 -4.200 -0.370 -10.275 1.00 0.26 H new ATOM 0 HB2 ARG A 392 -5.947 -1.709 -10.603 1.00 0.38 H new ATOM 0 HB3 ARG A 392 -4.845 -2.959 -10.060 1.00 0.38 H new ATOM 0 HG2 ARG A 392 -6.725 -3.433 -8.836 1.00 1.12 H new ATOM 0 HG3 ARG A 392 -5.809 -2.464 -7.699 1.00 1.12 H new ATOM 0 HD2 ARG A 392 -7.179 -0.599 -7.953 1.00 2.05 H new ATOM 0 HD3 ARG A 392 -7.682 -1.050 -9.570 1.00 2.05 H new ATOM 0 HE ARG A 392 -8.598 -2.891 -7.463 1.00 2.61 H new ATOM 0 HH11 ARG A 392 -9.291 -0.009 -9.387 1.00 3.75 H new ATOM 0 HH12 ARG A 392 -11.034 -0.104 -9.113 1.00 3.75 H new ATOM 0 HH21 ARG A 392 -10.835 -3.013 -7.121 1.00 4.06 H new ATOM 0 HH22 ARG A 392 -11.906 -1.802 -7.833 1.00 4.06 H new ATOM 1067 N ALA A 393 -4.524 -0.454 -7.044 1.00 0.19 N ATOM 1068 CA ALA A 393 -4.781 0.389 -5.887 1.00 0.17 C ATOM 1069 C ALA A 393 -3.744 1.512 -5.808 1.00 0.12 C ATOM 1070 O ALA A 393 -4.095 2.686 -5.713 1.00 0.14 O ATOM 1071 CB ALA A 393 -4.772 -0.450 -4.616 1.00 0.20 C ATOM 0 H ALA A 393 -4.124 -1.365 -6.818 1.00 0.19 H new ATOM 0 HA ALA A 393 -5.766 0.844 -5.991 1.00 0.17 H new ATOM 0 HB1 ALA A 393 -4.965 0.191 -3.756 1.00 0.20 H new ATOM 0 HB2 ALA A 393 -5.546 -1.215 -4.680 1.00 0.20 H new ATOM 0 HB3 ALA A 393 -3.799 -0.927 -4.502 1.00 0.20 H new ATOM 1077 N LEU A 394 -2.465 1.136 -5.881 1.00 0.13 N ATOM 1078 CA LEU A 394 -1.353 2.090 -5.821 1.00 0.10 C ATOM 1079 C LEU A 394 -1.499 3.211 -6.845 1.00 0.11 C ATOM 1080 O LEU A 394 -1.351 4.383 -6.506 1.00 0.12 O ATOM 1081 CB LEU A 394 -0.024 1.363 -6.056 1.00 0.11 C ATOM 1082 CG LEU A 394 0.372 0.363 -4.976 1.00 0.12 C ATOM 1083 CD1 LEU A 394 1.519 -0.510 -5.455 1.00 0.13 C ATOM 1084 CD2 LEU A 394 0.761 1.101 -3.711 1.00 0.13 C ATOM 0 H LEU A 394 -2.171 0.165 -5.983 1.00 0.13 H new ATOM 0 HA LEU A 394 -1.368 2.538 -4.827 1.00 0.10 H new ATOM 0 HB2 LEU A 394 -0.079 0.839 -7.010 1.00 0.11 H new ATOM 0 HB3 LEU A 394 0.767 2.107 -6.146 1.00 0.11 H new ATOM 0 HG LEU A 394 -0.481 -0.281 -4.762 1.00 0.12 H new ATOM 0 HD11 LEU A 394 1.789 -1.218 -4.672 1.00 0.13 H new ATOM 0 HD12 LEU A 394 1.213 -1.056 -6.348 1.00 0.13 H new ATOM 0 HD13 LEU A 394 2.379 0.116 -5.690 1.00 0.13 H new ATOM 0 HD21 LEU A 394 1.043 0.382 -2.942 1.00 0.13 H new ATOM 0 HD22 LEU A 394 1.604 1.760 -3.919 1.00 0.13 H new ATOM 0 HD23 LEU A 394 -0.084 1.693 -3.361 1.00 0.13 H new ATOM 1096 N ARG A 395 -1.795 2.857 -8.091 1.00 0.12 N ATOM 1097 CA ARG A 395 -1.885 3.849 -9.159 1.00 0.14 C ATOM 1098 C ARG A 395 -3.007 4.839 -8.870 1.00 0.14 C ATOM 1099 O ARG A 395 -2.956 5.997 -9.288 1.00 0.19 O ATOM 1100 CB ARG A 395 -2.114 3.188 -10.522 1.00 0.18 C ATOM 1101 CG ARG A 395 -1.163 2.044 -10.814 1.00 0.33 C ATOM 1102 CD ARG A 395 0.291 2.462 -10.733 1.00 0.52 C ATOM 1103 NE ARG A 395 0.659 3.436 -11.755 1.00 1.30 N ATOM 1104 CZ ARG A 395 1.918 3.759 -12.045 1.00 1.72 C ATOM 1105 NH1 ARG A 395 2.921 3.212 -11.361 1.00 1.66 N ATOM 1106 NH2 ARG A 395 2.172 4.635 -13.004 1.00 2.64 N ATOM 0 H ARG A 395 -1.976 1.898 -8.386 1.00 0.12 H new ATOM 0 HA ARG A 395 -0.934 4.381 -9.195 1.00 0.14 H new ATOM 0 HB2 ARG A 395 -3.138 2.818 -10.568 1.00 0.18 H new ATOM 0 HB3 ARG A 395 -2.012 3.942 -11.303 1.00 0.18 H new ATOM 0 HG2 ARG A 395 -1.345 1.235 -10.106 1.00 0.33 H new ATOM 0 HG3 ARG A 395 -1.369 1.649 -11.809 1.00 0.33 H new ATOM 0 HD2 ARG A 395 0.488 2.885 -9.748 1.00 0.52 H new ATOM 0 HD3 ARG A 395 0.924 1.580 -10.834 1.00 0.52 H new ATOM 0 HE ARG A 395 -0.089 3.894 -12.276 1.00 1.30 H new ATOM 0 HH11 ARG A 395 2.725 2.545 -10.614 1.00 1.66 H new ATOM 0 HH12 ARG A 395 3.885 3.460 -11.584 1.00 1.66 H new ATOM 0 HH21 ARG A 395 1.404 5.063 -13.521 1.00 2.64 H new ATOM 0 HH22 ARG A 395 3.136 4.883 -13.226 1.00 2.64 H new ATOM 1120 N HIS A 396 -4.019 4.374 -8.149 1.00 0.12 N ATOM 1121 CA HIS A 396 -5.142 5.215 -7.773 1.00 0.13 C ATOM 1122 C HIS A 396 -4.741 6.130 -6.624 1.00 0.11 C ATOM 1123 O HIS A 396 -5.164 7.284 -6.553 1.00 0.13 O ATOM 1124 CB HIS A 396 -6.352 4.358 -7.401 1.00 0.14 C ATOM 1125 CG HIS A 396 -7.656 5.059 -7.622 1.00 0.18 C ATOM 1126 ND1 HIS A 396 -7.864 5.844 -8.729 1.00 0.31 N ATOM 1127 CD2 HIS A 396 -8.767 5.075 -6.854 1.00 0.20 C ATOM 1128 CE1 HIS A 396 -9.092 6.321 -8.606 1.00 0.34 C ATOM 1129 NE2 HIS A 396 -9.678 5.882 -7.484 1.00 0.26 N ATOM 0 H HIS A 396 -4.083 3.413 -7.813 1.00 0.12 H new ATOM 0 HA HIS A 396 -5.424 5.835 -8.624 1.00 0.13 H new ATOM 0 HB2 HIS A 396 -6.335 3.440 -7.989 1.00 0.14 H new ATOM 0 HB3 HIS A 396 -6.276 4.067 -6.353 1.00 0.14 H new ATOM 0 HD2 HIS A 396 -8.910 4.551 -5.920 1.00 0.20 H new ATOM 0 HE1 HIS A 396 -9.563 6.981 -9.320 1.00 0.34 H new ATOM 0 HE2 HIS A 396 -10.620 6.105 -7.161 1.00 0.26 H new ATOM 1137 N TYR A 397 -3.876 5.610 -5.762 1.00 0.10 N ATOM 1138 CA TYR A 397 -3.396 6.335 -4.591 1.00 0.10 C ATOM 1139 C TYR A 397 -2.697 7.629 -4.964 1.00 0.09 C ATOM 1140 O TYR A 397 -2.771 8.613 -4.232 1.00 0.11 O ATOM 1141 CB TYR A 397 -2.429 5.465 -3.793 1.00 0.12 C ATOM 1142 CG TYR A 397 -3.100 4.325 -3.098 1.00 0.16 C ATOM 1143 CD1 TYR A 397 -4.476 4.289 -2.982 1.00 0.17 C ATOM 1144 CD2 TYR A 397 -2.361 3.303 -2.535 1.00 0.19 C ATOM 1145 CE1 TYR A 397 -5.102 3.269 -2.328 1.00 0.21 C ATOM 1146 CE2 TYR A 397 -2.979 2.277 -1.864 1.00 0.24 C ATOM 1147 CZ TYR A 397 -4.347 2.262 -1.765 1.00 0.24 C ATOM 1148 OH TYR A 397 -4.949 1.265 -1.059 1.00 0.30 O ATOM 0 H TYR A 397 -3.487 4.672 -5.855 1.00 0.10 H new ATOM 0 HA TYR A 397 -4.271 6.580 -3.990 1.00 0.10 H new ATOM 0 HB2 TYR A 397 -1.664 5.074 -4.464 1.00 0.12 H new ATOM 0 HB3 TYR A 397 -1.919 6.083 -3.054 1.00 0.12 H new ATOM 0 HD1 TYR A 397 -5.066 5.082 -3.417 1.00 0.17 H new ATOM 0 HD2 TYR A 397 -1.285 3.311 -2.624 1.00 0.19 H new ATOM 0 HE1 TYR A 397 -6.179 3.250 -2.252 1.00 0.21 H new ATOM 0 HE2 TYR A 397 -2.392 1.488 -1.417 1.00 0.24 H new ATOM 0 HH TYR A 397 -5.756 1.613 -0.625 1.00 0.30 H new ATOM 1158 N TYR A 398 -2.011 7.623 -6.093 1.00 0.10 N ATOM 1159 CA TYR A 398 -1.214 8.773 -6.492 1.00 0.12 C ATOM 1160 C TYR A 398 -2.098 9.993 -6.702 1.00 0.14 C ATOM 1161 O TYR A 398 -1.790 11.088 -6.234 1.00 0.17 O ATOM 1162 CB TYR A 398 -0.440 8.485 -7.779 1.00 0.14 C ATOM 1163 CG TYR A 398 0.355 7.188 -7.787 1.00 0.12 C ATOM 1164 CD1 TYR A 398 0.833 6.603 -6.614 1.00 0.11 C ATOM 1165 CD2 TYR A 398 0.627 6.548 -8.987 1.00 0.15 C ATOM 1166 CE1 TYR A 398 1.551 5.425 -6.644 1.00 0.12 C ATOM 1167 CE2 TYR A 398 1.343 5.372 -9.023 1.00 0.16 C ATOM 1168 CZ TYR A 398 1.802 4.813 -7.853 1.00 0.14 C ATOM 1169 OH TYR A 398 2.515 3.639 -7.895 1.00 0.18 O ATOM 0 H TYR A 398 -1.988 6.841 -6.747 1.00 0.10 H new ATOM 0 HA TYR A 398 -0.505 8.974 -5.689 1.00 0.12 H new ATOM 0 HB2 TYR A 398 -1.145 8.464 -8.610 1.00 0.14 H new ATOM 0 HB3 TYR A 398 0.245 9.312 -7.963 1.00 0.14 H new ATOM 0 HD1 TYR A 398 0.638 7.081 -5.665 1.00 0.11 H new ATOM 0 HD2 TYR A 398 0.271 6.980 -9.911 1.00 0.15 H new ATOM 0 HE1 TYR A 398 1.914 4.986 -5.726 1.00 0.12 H new ATOM 0 HE2 TYR A 398 1.544 4.890 -9.968 1.00 0.16 H new ATOM 0 HH TYR A 398 3.197 3.645 -7.191 1.00 0.18 H new ATOM 1179 N LYS A 399 -3.201 9.788 -7.407 1.00 0.15 N ATOM 1180 CA LYS A 399 -4.153 10.856 -7.673 1.00 0.19 C ATOM 1181 C LYS A 399 -4.838 11.305 -6.398 1.00 0.19 C ATOM 1182 O LYS A 399 -5.116 12.487 -6.209 1.00 0.23 O ATOM 1183 CB LYS A 399 -5.215 10.408 -8.666 1.00 0.20 C ATOM 1184 CG LYS A 399 -4.715 10.271 -10.098 1.00 0.23 C ATOM 1185 CD LYS A 399 -4.349 8.836 -10.437 1.00 0.27 C ATOM 1186 CE LYS A 399 -5.542 7.918 -10.240 1.00 0.32 C ATOM 1187 NZ LYS A 399 -5.285 6.540 -10.736 1.00 0.71 N ATOM 0 H LYS A 399 -3.460 8.886 -7.807 1.00 0.15 H new ATOM 0 HA LYS A 399 -3.589 11.688 -8.095 1.00 0.19 H new ATOM 0 HB2 LYS A 399 -5.618 9.449 -8.341 1.00 0.20 H new ATOM 0 HB3 LYS A 399 -6.038 11.123 -8.647 1.00 0.20 H new ATOM 0 HG2 LYS A 399 -5.484 10.621 -10.786 1.00 0.23 H new ATOM 0 HG3 LYS A 399 -3.844 10.911 -10.241 1.00 0.23 H new ATOM 0 HD2 LYS A 399 -4.005 8.777 -11.470 1.00 0.27 H new ATOM 0 HD3 LYS A 399 -3.523 8.507 -9.807 1.00 0.27 H new ATOM 0 HE2 LYS A 399 -5.796 7.878 -9.181 1.00 0.32 H new ATOM 0 HE3 LYS A 399 -6.406 8.333 -10.759 1.00 0.32 H new ATOM 0 HZ1 LYS A 399 -6.046 5.908 -10.416 1.00 0.71 H new ATOM 0 HZ2 LYS A 399 -5.254 6.545 -11.776 1.00 0.71 H new ATOM 0 HZ3 LYS A 399 -4.375 6.201 -10.364 1.00 0.71 H new ATOM 1201 N LEU A 400 -5.108 10.352 -5.525 1.00 0.17 N ATOM 1202 CA LEU A 400 -5.842 10.624 -4.307 1.00 0.18 C ATOM 1203 C LEU A 400 -4.907 11.075 -3.195 1.00 0.18 C ATOM 1204 O LEU A 400 -5.244 10.996 -2.019 1.00 0.21 O ATOM 1205 CB LEU A 400 -6.625 9.382 -3.910 1.00 0.18 C ATOM 1206 CG LEU A 400 -7.440 8.783 -5.053 1.00 0.19 C ATOM 1207 CD1 LEU A 400 -8.047 7.467 -4.632 1.00 0.20 C ATOM 1208 CD2 LEU A 400 -8.514 9.757 -5.517 1.00 0.21 C ATOM 0 H LEU A 400 -4.827 9.378 -5.640 1.00 0.17 H new ATOM 0 HA LEU A 400 -6.542 11.441 -4.481 1.00 0.18 H new ATOM 0 HB2 LEU A 400 -5.931 8.629 -3.536 1.00 0.18 H new ATOM 0 HB3 LEU A 400 -7.296 9.633 -3.089 1.00 0.18 H new ATOM 0 HG LEU A 400 -6.772 8.597 -5.894 1.00 0.19 H new ATOM 0 HD11 LEU A 400 -8.625 7.052 -5.458 1.00 0.20 H new ATOM 0 HD12 LEU A 400 -7.254 6.771 -4.359 1.00 0.20 H new ATOM 0 HD13 LEU A 400 -8.701 7.626 -3.775 1.00 0.20 H new ATOM 0 HD21 LEU A 400 -9.083 9.310 -6.332 1.00 0.21 H new ATOM 0 HD22 LEU A 400 -9.184 9.982 -4.687 1.00 0.21 H new ATOM 0 HD23 LEU A 400 -8.045 10.678 -5.864 1.00 0.21 H new ATOM 1220 N ASN A 401 -3.726 11.543 -3.590 1.00 0.18 N ATOM 1221 CA ASN A 401 -2.789 12.179 -2.662 1.00 0.20 C ATOM 1222 C ASN A 401 -2.317 11.229 -1.574 1.00 0.17 C ATOM 1223 O ASN A 401 -2.008 11.650 -0.458 1.00 0.22 O ATOM 1224 CB ASN A 401 -3.457 13.389 -2.022 1.00 0.27 C ATOM 1225 CG ASN A 401 -3.618 14.551 -2.976 1.00 0.60 C ATOM 1226 OD1 ASN A 401 -2.779 14.786 -3.845 1.00 1.08 O ATOM 1227 ND2 ASN A 401 -4.705 15.286 -2.823 1.00 1.21 N ATOM 0 H ASN A 401 -3.392 11.494 -4.552 1.00 0.18 H new ATOM 0 HA ASN A 401 -1.913 12.482 -3.235 1.00 0.20 H new ATOM 0 HB2 ASN A 401 -4.437 13.098 -1.644 1.00 0.27 H new ATOM 0 HB3 ASN A 401 -2.867 13.710 -1.163 1.00 0.27 H new ATOM 0 HD21 ASN A 401 -4.873 16.082 -3.438 1.00 1.21 H new ATOM 0 HD22 ASN A 401 -5.376 15.057 -2.090 1.00 1.21 H new ATOM 1234 N ILE A 402 -2.255 9.956 -1.902 1.00 0.11 N ATOM 1235 CA ILE A 402 -1.934 8.929 -0.937 1.00 0.10 C ATOM 1236 C ILE A 402 -0.482 8.495 -1.036 1.00 0.09 C ATOM 1237 O ILE A 402 0.307 8.715 -0.121 1.00 0.13 O ATOM 1238 CB ILE A 402 -2.863 7.743 -1.181 1.00 0.10 C ATOM 1239 CG1 ILE A 402 -4.292 8.232 -1.054 1.00 0.14 C ATOM 1240 CG2 ILE A 402 -2.595 6.603 -0.215 1.00 0.15 C ATOM 1241 CD1 ILE A 402 -5.312 7.242 -1.507 1.00 0.13 C ATOM 0 H ILE A 402 -2.426 9.605 -2.844 1.00 0.11 H new ATOM 0 HA ILE A 402 -2.075 9.326 0.068 1.00 0.10 H new ATOM 0 HB ILE A 402 -2.684 7.347 -2.181 1.00 0.10 H new ATOM 0 HG12 ILE A 402 -4.487 8.489 -0.013 1.00 0.14 H new ATOM 0 HG13 ILE A 402 -4.405 9.147 -1.635 1.00 0.14 H new ATOM 0 HG21 ILE A 402 -3.279 5.780 -0.425 1.00 0.15 H new ATOM 0 HG22 ILE A 402 -1.567 6.260 -0.333 1.00 0.15 H new ATOM 0 HG23 ILE A 402 -2.747 6.949 0.807 1.00 0.15 H new ATOM 0 HD11 ILE A 402 -6.309 7.665 -1.385 1.00 0.13 H new ATOM 0 HD12 ILE A 402 -5.145 7.003 -2.557 1.00 0.13 H new ATOM 0 HD13 ILE A 402 -5.228 6.334 -0.910 1.00 0.13 H new ATOM 1253 N ILE A 403 -0.134 7.882 -2.151 1.00 0.07 N ATOM 1254 CA ILE A 403 1.223 7.440 -2.386 1.00 0.07 C ATOM 1255 C ILE A 403 1.717 8.056 -3.685 1.00 0.08 C ATOM 1256 O ILE A 403 0.920 8.554 -4.473 1.00 0.10 O ATOM 1257 CB ILE A 403 1.315 5.895 -2.461 1.00 0.09 C ATOM 1258 CG1 ILE A 403 0.656 5.249 -1.245 1.00 0.09 C ATOM 1259 CG2 ILE A 403 2.762 5.435 -2.560 1.00 0.14 C ATOM 1260 CD1 ILE A 403 0.774 3.743 -1.246 1.00 0.11 C ATOM 0 H ILE A 403 -0.780 7.678 -2.913 1.00 0.07 H new ATOM 0 HA ILE A 403 1.847 7.762 -1.552 1.00 0.07 H new ATOM 0 HB ILE A 403 0.785 5.582 -3.360 1.00 0.09 H new ATOM 0 HG12 ILE A 403 1.113 5.644 -0.337 1.00 0.09 H new ATOM 0 HG13 ILE A 403 -0.398 5.526 -1.218 1.00 0.09 H new ATOM 0 HG21 ILE A 403 2.795 4.347 -2.611 1.00 0.14 H new ATOM 0 HG22 ILE A 403 3.217 5.854 -3.458 1.00 0.14 H new ATOM 0 HG23 ILE A 403 3.312 5.774 -1.682 1.00 0.14 H new ATOM 0 HD11 ILE A 403 0.288 3.339 -0.358 1.00 0.11 H new ATOM 0 HD12 ILE A 403 0.293 3.341 -2.138 1.00 0.11 H new ATOM 0 HD13 ILE A 403 1.827 3.461 -1.243 1.00 0.11 H new ATOM 1272 N ARG A 404 3.017 8.070 -3.881 1.00 0.10 N ATOM 1273 CA ARG A 404 3.603 8.558 -5.111 1.00 0.13 C ATOM 1274 C ARG A 404 4.663 7.587 -5.582 1.00 0.14 C ATOM 1275 O ARG A 404 5.085 6.696 -4.843 1.00 0.16 O ATOM 1276 CB ARG A 404 4.225 9.936 -4.900 1.00 0.17 C ATOM 1277 CG ARG A 404 5.638 9.874 -4.381 1.00 0.25 C ATOM 1278 CD ARG A 404 6.221 11.258 -4.205 1.00 0.36 C ATOM 1279 NE ARG A 404 6.503 11.905 -5.482 1.00 1.14 N ATOM 1280 CZ ARG A 404 6.560 13.226 -5.653 1.00 1.56 C ATOM 1281 NH1 ARG A 404 6.359 14.045 -4.626 1.00 1.63 N ATOM 1282 NH2 ARG A 404 6.816 13.723 -6.855 1.00 2.39 N ATOM 0 H ARG A 404 3.697 7.744 -3.194 1.00 0.10 H new ATOM 0 HA ARG A 404 2.820 8.643 -5.864 1.00 0.13 H new ATOM 0 HB2 ARG A 404 4.215 10.481 -5.844 1.00 0.17 H new ATOM 0 HB3 ARG A 404 3.611 10.501 -4.199 1.00 0.17 H new ATOM 0 HG2 ARG A 404 5.654 9.346 -3.427 1.00 0.25 H new ATOM 0 HG3 ARG A 404 6.257 9.302 -5.072 1.00 0.25 H new ATOM 0 HD2 ARG A 404 5.526 11.873 -3.634 1.00 0.36 H new ATOM 0 HD3 ARG A 404 7.140 11.192 -3.623 1.00 0.36 H new ATOM 0 HE ARG A 404 6.667 11.310 -6.294 1.00 1.14 H new ATOM 0 HH11 ARG A 404 6.160 13.664 -3.701 1.00 1.63 H new ATOM 0 HH12 ARG A 404 6.404 15.055 -4.763 1.00 1.63 H new ATOM 0 HH21 ARG A 404 6.968 13.095 -7.644 1.00 2.39 H new ATOM 0 HH22 ARG A 404 6.861 14.733 -6.990 1.00 2.39 H new ATOM 1296 N LYS A 405 5.097 7.782 -6.801 1.00 0.17 N ATOM 1297 CA LYS A 405 6.109 6.943 -7.392 1.00 0.19 C ATOM 1298 C LYS A 405 7.391 7.749 -7.544 1.00 0.22 C ATOM 1299 O LYS A 405 7.358 8.897 -7.982 1.00 0.27 O ATOM 1300 CB LYS A 405 5.625 6.426 -8.738 1.00 0.22 C ATOM 1301 CG LYS A 405 6.444 5.259 -9.249 1.00 0.34 C ATOM 1302 CD LYS A 405 6.598 4.214 -8.189 1.00 0.29 C ATOM 1303 CE LYS A 405 7.174 2.951 -8.766 1.00 0.23 C ATOM 1304 NZ LYS A 405 8.422 3.187 -9.529 1.00 1.08 N ATOM 0 H LYS A 405 4.759 8.526 -7.412 1.00 0.17 H new ATOM 0 HA LYS A 405 6.307 6.083 -6.752 1.00 0.19 H new ATOM 0 HB2 LYS A 405 4.582 6.121 -8.651 1.00 0.22 H new ATOM 0 HB3 LYS A 405 5.661 7.236 -9.467 1.00 0.22 H new ATOM 0 HG2 LYS A 405 5.962 4.826 -10.125 1.00 0.34 H new ATOM 0 HG3 LYS A 405 7.426 5.609 -9.566 1.00 0.34 H new ATOM 0 HD2 LYS A 405 7.247 4.586 -7.396 1.00 0.29 H new ATOM 0 HD3 LYS A 405 5.629 4.004 -7.736 1.00 0.29 H new ATOM 0 HE2 LYS A 405 7.374 2.246 -7.959 1.00 0.23 H new ATOM 0 HE3 LYS A 405 6.436 2.486 -9.420 1.00 0.23 H new ATOM 0 HZ1 LYS A 405 8.909 2.282 -9.686 1.00 1.08 H new ATOM 0 HZ2 LYS A 405 8.192 3.620 -10.446 1.00 1.08 H new ATOM 0 HZ3 LYS A 405 9.042 3.825 -8.991 1.00 1.08 H new ATOM 1318 N GLU A 406 8.502 7.154 -7.155 1.00 0.23 N ATOM 1319 CA GLU A 406 9.784 7.835 -7.151 1.00 0.28 C ATOM 1320 C GLU A 406 10.377 7.938 -8.550 1.00 0.34 C ATOM 1321 O GLU A 406 9.878 7.341 -9.507 1.00 0.43 O ATOM 1322 CB GLU A 406 10.752 7.099 -6.226 1.00 0.29 C ATOM 1323 CG GLU A 406 10.522 5.611 -6.167 1.00 0.63 C ATOM 1324 CD GLU A 406 10.703 4.913 -7.499 1.00 1.77 C ATOM 1325 OE1 GLU A 406 11.460 5.423 -8.345 1.00 2.32 O ATOM 1326 OE2 GLU A 406 10.080 3.862 -7.713 1.00 2.42 O ATOM 0 H GLU A 406 8.542 6.187 -6.833 1.00 0.23 H new ATOM 0 HA GLU A 406 9.623 8.850 -6.788 1.00 0.28 H new ATOM 0 HB2 GLU A 406 11.773 7.287 -6.559 1.00 0.29 H new ATOM 0 HB3 GLU A 406 10.664 7.511 -5.221 1.00 0.29 H new ATOM 0 HG2 GLU A 406 11.209 5.175 -5.442 1.00 0.63 H new ATOM 0 HG3 GLU A 406 9.512 5.423 -5.803 1.00 0.63 H new ATOM 1333 N PRO A 407 11.398 8.778 -8.683 1.00 0.41 N ATOM 1334 CA PRO A 407 12.217 8.855 -9.878 1.00 0.51 C ATOM 1335 C PRO A 407 13.175 7.664 -10.031 1.00 0.52 C ATOM 1336 O PRO A 407 14.109 7.508 -9.241 1.00 0.54 O ATOM 1337 CB PRO A 407 12.993 10.165 -9.719 1.00 0.61 C ATOM 1338 CG PRO A 407 12.846 10.592 -8.297 1.00 0.58 C ATOM 1339 CD PRO A 407 11.840 9.692 -7.636 1.00 0.45 C ATOM 0 HA PRO A 407 11.602 8.825 -10.777 1.00 0.51 H new ATOM 0 HB2 PRO A 407 14.044 10.023 -9.972 1.00 0.61 H new ATOM 0 HB3 PRO A 407 12.603 10.928 -10.393 1.00 0.61 H new ATOM 0 HG2 PRO A 407 13.805 10.533 -7.782 1.00 0.58 H new ATOM 0 HG3 PRO A 407 12.519 11.630 -8.244 1.00 0.58 H new ATOM 0 HD2 PRO A 407 12.285 9.150 -6.802 1.00 0.45 H new ATOM 0 HD3 PRO A 407 11.004 10.264 -7.234 1.00 0.45 H new ATOM 1347 N GLY A 408 12.943 6.820 -11.033 1.00 0.54 N ATOM 1348 CA GLY A 408 13.968 5.872 -11.450 1.00 0.58 C ATOM 1349 C GLY A 408 13.861 4.465 -10.867 1.00 0.58 C ATOM 1350 O GLY A 408 14.227 3.499 -11.545 1.00 0.86 O ATOM 0 H GLY A 408 12.072 6.773 -11.561 1.00 0.54 H new ATOM 0 HA2 GLY A 408 13.942 5.795 -12.537 1.00 0.58 H new ATOM 0 HA3 GLY A 408 14.942 6.281 -11.182 1.00 0.58 H new ATOM 1354 N GLN A 409 13.388 4.321 -9.635 1.00 0.47 N ATOM 1355 CA GLN A 409 13.394 3.012 -8.976 1.00 0.51 C ATOM 1356 C GLN A 409 12.255 2.136 -9.505 1.00 0.48 C ATOM 1357 O GLN A 409 11.500 2.546 -10.387 1.00 0.61 O ATOM 1358 CB GLN A 409 13.296 3.140 -7.451 1.00 0.63 C ATOM 1359 CG GLN A 409 14.072 4.311 -6.860 1.00 0.45 C ATOM 1360 CD GLN A 409 14.436 4.093 -5.403 1.00 0.71 C ATOM 1361 OE1 GLN A 409 14.525 5.040 -4.621 1.00 1.64 O ATOM 1362 NE2 GLN A 409 14.666 2.842 -5.032 1.00 0.45 N ATOM 0 H GLN A 409 13.000 5.080 -9.075 1.00 0.47 H new ATOM 0 HA GLN A 409 14.347 2.537 -9.210 1.00 0.51 H new ATOM 0 HB2 GLN A 409 12.246 3.241 -7.175 1.00 0.63 H new ATOM 0 HB3 GLN A 409 13.657 2.217 -6.998 1.00 0.63 H new ATOM 0 HG2 GLN A 409 14.982 4.468 -7.439 1.00 0.45 H new ATOM 0 HG3 GLN A 409 13.476 5.219 -6.950 1.00 0.45 H new ATOM 0 HE21 GLN A 409 14.582 2.085 -5.711 1.00 0.45 H new ATOM 0 HE22 GLN A 409 14.927 2.636 -4.068 1.00 0.45 H new ATOM 1371 N ARG A 410 12.137 0.927 -8.976 1.00 0.41 N ATOM 1372 CA ARG A 410 11.135 -0.019 -9.449 1.00 0.39 C ATOM 1373 C ARG A 410 9.935 -0.080 -8.524 1.00 0.31 C ATOM 1374 O ARG A 410 8.875 0.460 -8.823 1.00 0.42 O ATOM 1375 CB ARG A 410 11.761 -1.411 -9.598 1.00 0.47 C ATOM 1376 CG ARG A 410 12.798 -1.737 -8.531 1.00 0.86 C ATOM 1377 CD ARG A 410 14.188 -1.305 -8.966 1.00 1.11 C ATOM 1378 NE ARG A 410 15.201 -1.565 -7.945 1.00 1.27 N ATOM 1379 CZ ARG A 410 16.116 -2.533 -8.054 1.00 2.04 C ATOM 1380 NH1 ARG A 410 16.055 -3.389 -9.065 1.00 2.65 N ATOM 1381 NH2 ARG A 410 17.075 -2.663 -7.147 1.00 2.43 N ATOM 0 H ARG A 410 12.723 0.577 -8.218 1.00 0.41 H new ATOM 0 HA ARG A 410 10.782 0.327 -10.420 1.00 0.39 H new ATOM 0 HB2 ARG A 410 10.970 -2.160 -9.563 1.00 0.47 H new ATOM 0 HB3 ARG A 410 12.228 -1.486 -10.580 1.00 0.47 H new ATOM 0 HG2 ARG A 410 12.534 -1.237 -7.599 1.00 0.86 H new ATOM 0 HG3 ARG A 410 12.793 -2.808 -8.331 1.00 0.86 H new ATOM 0 HD2 ARG A 410 14.458 -1.830 -9.882 1.00 1.11 H new ATOM 0 HD3 ARG A 410 14.177 -0.240 -9.200 1.00 1.11 H new ATOM 0 HE ARG A 410 15.210 -0.980 -7.110 1.00 1.27 H new ATOM 0 HH11 ARG A 410 15.311 -3.308 -9.758 1.00 2.65 H new ATOM 0 HH12 ARG A 410 16.752 -4.128 -9.150 1.00 2.65 H new ATOM 0 HH21 ARG A 410 17.119 -2.020 -6.356 1.00 2.43 H new ATOM 0 HH22 ARG A 410 17.768 -3.406 -7.240 1.00 2.43 H new ATOM 1395 N LEU A 411 10.117 -0.736 -7.402 1.00 0.21 N ATOM 1396 CA LEU A 411 9.043 -0.968 -6.460 1.00 0.14 C ATOM 1397 C LEU A 411 9.142 -0.018 -5.289 1.00 0.11 C ATOM 1398 O LEU A 411 8.780 -0.349 -4.169 1.00 0.12 O ATOM 1399 CB LEU A 411 9.081 -2.417 -6.005 1.00 0.11 C ATOM 1400 CG LEU A 411 8.742 -3.403 -7.113 1.00 0.11 C ATOM 1401 CD1 LEU A 411 9.013 -4.827 -6.682 1.00 0.15 C ATOM 1402 CD2 LEU A 411 7.291 -3.225 -7.505 1.00 0.16 C ATOM 0 H LEU A 411 11.015 -1.125 -7.114 1.00 0.21 H new ATOM 0 HA LEU A 411 8.086 -0.779 -6.947 1.00 0.14 H new ATOM 0 HB2 LEU A 411 10.074 -2.643 -5.618 1.00 0.11 H new ATOM 0 HB3 LEU A 411 8.380 -2.551 -5.181 1.00 0.11 H new ATOM 0 HG LEU A 411 9.378 -3.202 -7.975 1.00 0.11 H new ATOM 0 HD11 LEU A 411 8.761 -5.508 -7.495 1.00 0.15 H new ATOM 0 HD12 LEU A 411 10.068 -4.937 -6.431 1.00 0.15 H new ATOM 0 HD13 LEU A 411 8.406 -5.065 -5.809 1.00 0.15 H new ATOM 0 HD21 LEU A 411 7.040 -3.928 -8.299 1.00 0.16 H new ATOM 0 HD22 LEU A 411 6.655 -3.412 -6.640 1.00 0.16 H new ATOM 0 HD23 LEU A 411 7.132 -2.206 -7.859 1.00 0.16 H new ATOM 1414 N LEU A 412 9.662 1.155 -5.557 1.00 0.13 N ATOM 1415 CA LEU A 412 9.823 2.154 -4.529 1.00 0.11 C ATOM 1416 C LEU A 412 8.622 3.089 -4.566 1.00 0.10 C ATOM 1417 O LEU A 412 8.207 3.534 -5.633 1.00 0.11 O ATOM 1418 CB LEU A 412 11.113 2.924 -4.781 1.00 0.13 C ATOM 1419 CG LEU A 412 11.763 3.609 -3.579 1.00 0.13 C ATOM 1420 CD1 LEU A 412 10.775 4.435 -2.787 1.00 0.13 C ATOM 1421 CD2 LEU A 412 12.429 2.579 -2.702 1.00 0.16 C ATOM 0 H LEU A 412 9.982 1.442 -6.482 1.00 0.13 H new ATOM 0 HA LEU A 412 9.881 1.688 -3.545 1.00 0.11 H new ATOM 0 HB2 LEU A 412 11.840 2.235 -5.211 1.00 0.13 H new ATOM 0 HB3 LEU A 412 10.911 3.685 -5.535 1.00 0.13 H new ATOM 0 HG LEU A 412 12.516 4.301 -3.956 1.00 0.13 H new ATOM 0 HD11 LEU A 412 11.284 4.901 -1.944 1.00 0.13 H new ATOM 0 HD12 LEU A 412 10.351 5.208 -3.428 1.00 0.13 H new ATOM 0 HD13 LEU A 412 9.976 3.792 -2.418 1.00 0.13 H new ATOM 0 HD21 LEU A 412 12.891 3.073 -1.847 1.00 0.16 H new ATOM 0 HD22 LEU A 412 11.685 1.865 -2.350 1.00 0.16 H new ATOM 0 HD23 LEU A 412 13.194 2.054 -3.274 1.00 0.16 H new ATOM 1433 N PHE A 413 8.056 3.376 -3.412 1.00 0.10 N ATOM 1434 CA PHE A 413 6.914 4.259 -3.338 1.00 0.11 C ATOM 1435 C PHE A 413 7.037 5.146 -2.117 1.00 0.12 C ATOM 1436 O PHE A 413 7.524 4.711 -1.074 1.00 0.19 O ATOM 1437 CB PHE A 413 5.615 3.459 -3.270 1.00 0.12 C ATOM 1438 CG PHE A 413 5.438 2.490 -4.401 1.00 0.10 C ATOM 1439 CD1 PHE A 413 5.952 1.211 -4.304 1.00 0.11 C ATOM 1440 CD2 PHE A 413 4.767 2.854 -5.553 1.00 0.10 C ATOM 1441 CE1 PHE A 413 5.803 0.308 -5.335 1.00 0.11 C ATOM 1442 CE2 PHE A 413 4.613 1.955 -6.587 1.00 0.11 C ATOM 1443 CZ PHE A 413 5.132 0.679 -6.479 1.00 0.11 C ATOM 0 H PHE A 413 8.369 3.010 -2.513 1.00 0.10 H new ATOM 0 HA PHE A 413 6.891 4.876 -4.236 1.00 0.11 H new ATOM 0 HB2 PHE A 413 5.586 2.912 -2.328 1.00 0.12 H new ATOM 0 HB3 PHE A 413 4.773 4.151 -3.263 1.00 0.12 H new ATOM 0 HD1 PHE A 413 6.478 0.915 -3.408 1.00 0.11 H new ATOM 0 HD2 PHE A 413 4.360 3.850 -5.644 1.00 0.10 H new ATOM 0 HE1 PHE A 413 6.211 -0.688 -5.246 1.00 0.11 H new ATOM 0 HE2 PHE A 413 4.086 2.249 -7.483 1.00 0.11 H new ATOM 0 HZ PHE A 413 5.012 -0.025 -7.289 1.00 0.11 H new ATOM 1453 N ARG A 414 6.622 6.387 -2.247 1.00 0.10 N ATOM 1454 CA ARG A 414 6.633 7.296 -1.137 1.00 0.12 C ATOM 1455 C ARG A 414 5.232 7.797 -0.877 1.00 0.11 C ATOM 1456 O ARG A 414 4.553 8.259 -1.786 1.00 0.15 O ATOM 1457 CB ARG A 414 7.585 8.460 -1.399 1.00 0.20 C ATOM 1458 CG ARG A 414 7.144 9.749 -0.741 1.00 0.35 C ATOM 1459 CD ARG A 414 8.316 10.637 -0.384 1.00 0.37 C ATOM 1460 NE ARG A 414 9.175 10.909 -1.534 1.00 1.21 N ATOM 1461 CZ ARG A 414 9.824 12.055 -1.724 1.00 1.46 C ATOM 1462 NH1 ARG A 414 9.657 13.064 -0.880 1.00 1.06 N ATOM 1463 NH2 ARG A 414 10.630 12.185 -2.769 1.00 2.58 N ATOM 0 H ARG A 414 6.272 6.785 -3.118 1.00 0.10 H new ATOM 0 HA ARG A 414 6.990 6.769 -0.252 1.00 0.12 H new ATOM 0 HB2 ARG A 414 8.579 8.197 -1.038 1.00 0.20 H new ATOM 0 HB3 ARG A 414 7.668 8.618 -2.474 1.00 0.20 H new ATOM 0 HG2 ARG A 414 6.474 10.287 -1.412 1.00 0.35 H new ATOM 0 HG3 ARG A 414 6.576 9.519 0.161 1.00 0.35 H new ATOM 0 HD2 ARG A 414 7.946 11.579 0.021 1.00 0.37 H new ATOM 0 HD3 ARG A 414 8.904 10.161 0.401 1.00 0.37 H new ATOM 0 HE ARG A 414 9.284 10.175 -2.234 1.00 1.21 H new ATOM 0 HH11 ARG A 414 9.030 12.963 -0.082 1.00 1.06 H new ATOM 0 HH12 ARG A 414 10.156 13.941 -1.029 1.00 1.06 H new ATOM 0 HH21 ARG A 414 10.749 11.409 -3.421 1.00 2.58 H new ATOM 0 HH22 ARG A 414 11.131 13.061 -2.921 1.00 2.58 H new ATOM 1477 N PHE A 415 4.801 7.678 0.356 1.00 0.10 N ATOM 1478 CA PHE A 415 3.494 8.165 0.751 1.00 0.09 C ATOM 1479 C PHE A 415 3.440 9.684 0.612 1.00 0.11 C ATOM 1480 O PHE A 415 4.150 10.410 1.309 1.00 0.14 O ATOM 1481 CB PHE A 415 3.185 7.752 2.192 1.00 0.10 C ATOM 1482 CG PHE A 415 2.498 6.431 2.337 1.00 0.10 C ATOM 1483 CD1 PHE A 415 3.229 5.269 2.484 1.00 0.10 C ATOM 1484 CD2 PHE A 415 1.111 6.360 2.349 1.00 0.11 C ATOM 1485 CE1 PHE A 415 2.603 4.056 2.633 1.00 0.11 C ATOM 1486 CE2 PHE A 415 0.471 5.148 2.499 1.00 0.13 C ATOM 1487 CZ PHE A 415 1.221 3.992 2.639 1.00 0.12 C ATOM 0 H PHE A 415 5.337 7.246 1.109 1.00 0.10 H new ATOM 0 HA PHE A 415 2.742 7.724 0.097 1.00 0.09 H new ATOM 0 HB2 PHE A 415 4.119 7.723 2.754 1.00 0.10 H new ATOM 0 HB3 PHE A 415 2.562 8.521 2.649 1.00 0.10 H new ATOM 0 HD1 PHE A 415 4.308 5.315 2.482 1.00 0.10 H new ATOM 0 HD2 PHE A 415 0.528 7.263 2.240 1.00 0.11 H new ATOM 0 HE1 PHE A 415 3.188 3.155 2.745 1.00 0.11 H new ATOM 0 HE2 PHE A 415 -0.608 5.100 2.507 1.00 0.13 H new ATOM 0 HZ PHE A 415 0.726 3.039 2.753 1.00 0.12 H new ATOM 1497 N MET A 416 2.621 10.138 -0.333 1.00 0.11 N ATOM 1498 CA MET A 416 2.372 11.562 -0.553 1.00 0.15 C ATOM 1499 C MET A 416 1.956 12.240 0.737 1.00 0.17 C ATOM 1500 O MET A 416 2.311 13.393 0.997 1.00 0.23 O ATOM 1501 CB MET A 416 1.263 11.747 -1.591 1.00 0.15 C ATOM 1502 CG MET A 416 1.704 11.506 -3.019 1.00 0.24 C ATOM 1503 SD MET A 416 2.776 12.815 -3.638 1.00 1.41 S ATOM 1504 CE MET A 416 1.641 14.201 -3.620 1.00 1.47 C ATOM 0 H MET A 416 2.109 9.528 -0.970 1.00 0.11 H new ATOM 0 HA MET A 416 3.296 12.014 -0.913 1.00 0.15 H new ATOM 0 HB2 MET A 416 0.444 11.068 -1.356 1.00 0.15 H new ATOM 0 HB3 MET A 416 0.870 12.760 -1.510 1.00 0.15 H new ATOM 0 HG2 MET A 416 2.229 10.552 -3.078 1.00 0.24 H new ATOM 0 HG3 MET A 416 0.825 11.427 -3.659 1.00 0.24 H new ATOM 0 HE1 MET A 416 1.962 14.944 -4.350 1.00 1.47 H new ATOM 0 HE2 MET A 416 0.639 13.854 -3.872 1.00 1.47 H new ATOM 0 HE3 MET A 416 1.630 14.650 -2.627 1.00 1.47 H new ATOM 1514 N LYS A 417 1.194 11.514 1.533 1.00 0.16 N ATOM 1515 CA LYS A 417 0.719 11.999 2.804 1.00 0.21 C ATOM 1516 C LYS A 417 0.730 10.878 3.811 1.00 0.21 C ATOM 1517 O LYS A 417 1.036 9.732 3.484 1.00 0.22 O ATOM 1518 CB LYS A 417 -0.705 12.534 2.687 1.00 0.29 C ATOM 1519 CG LYS A 417 -0.821 13.840 1.936 1.00 0.57 C ATOM 1520 CD LYS A 417 -2.203 14.432 2.104 1.00 0.54 C ATOM 1521 CE LYS A 417 -2.311 15.783 1.420 1.00 0.84 C ATOM 1522 NZ LYS A 417 -3.618 16.445 1.675 1.00 1.36 N ATOM 0 H LYS A 417 0.888 10.567 1.310 1.00 0.16 H new ATOM 0 HA LYS A 417 1.378 12.806 3.125 1.00 0.21 H new ATOM 0 HB2 LYS A 417 -1.321 11.786 2.188 1.00 0.29 H new ATOM 0 HB3 LYS A 417 -1.114 12.667 3.689 1.00 0.29 H new ATOM 0 HG2 LYS A 417 -0.072 14.543 2.301 1.00 0.57 H new ATOM 0 HG3 LYS A 417 -0.616 13.676 0.878 1.00 0.57 H new ATOM 0 HD2 LYS A 417 -2.946 13.751 1.688 1.00 0.54 H new ATOM 0 HD3 LYS A 417 -2.428 14.540 3.165 1.00 0.54 H new ATOM 0 HE2 LYS A 417 -1.505 16.429 1.769 1.00 0.84 H new ATOM 0 HE3 LYS A 417 -2.175 15.655 0.346 1.00 0.84 H new ATOM 0 HZ1 LYS A 417 -3.536 17.463 1.476 1.00 1.36 H new ATOM 0 HZ2 LYS A 417 -4.344 16.029 1.058 1.00 1.36 H new ATOM 0 HZ3 LYS A 417 -3.889 16.307 2.670 1.00 1.36 H new ATOM 1536 N THR A 418 0.400 11.215 5.032 1.00 0.24 N ATOM 1537 CA THR A 418 0.225 10.234 6.064 1.00 0.24 C ATOM 1538 C THR A 418 -1.258 9.999 6.328 1.00 0.26 C ATOM 1539 O THR A 418 -2.090 10.866 6.046 1.00 0.28 O ATOM 1540 CB THR A 418 0.968 10.666 7.325 1.00 0.26 C ATOM 1541 OG1 THR A 418 0.722 12.053 7.589 1.00 0.35 O ATOM 1542 CG2 THR A 418 2.450 10.441 7.123 1.00 0.22 C ATOM 0 H THR A 418 0.246 12.177 5.335 1.00 0.24 H new ATOM 0 HA THR A 418 0.650 9.285 5.737 1.00 0.24 H new ATOM 0 HB THR A 418 0.616 10.080 8.174 1.00 0.26 H new ATOM 0 HG1 THR A 418 1.201 12.321 8.401 1.00 0.35 H new ATOM 0 HG21 THR A 418 2.990 10.747 8.019 1.00 0.22 H new ATOM 0 HG22 THR A 418 2.635 9.384 6.931 1.00 0.22 H new ATOM 0 HG23 THR A 418 2.795 11.030 6.273 1.00 0.22 H new ATOM 1550 N PRO A 419 -1.595 8.817 6.851 1.00 0.25 N ATOM 1551 CA PRO A 419 -2.974 8.319 6.946 1.00 0.28 C ATOM 1552 C PRO A 419 -4.008 9.335 7.432 1.00 0.31 C ATOM 1553 O PRO A 419 -5.088 9.425 6.861 1.00 0.33 O ATOM 1554 CB PRO A 419 -2.834 7.161 7.925 1.00 0.29 C ATOM 1555 CG PRO A 419 -1.489 6.623 7.618 1.00 0.27 C ATOM 1556 CD PRO A 419 -0.636 7.833 7.385 1.00 0.25 C ATOM 0 HA PRO A 419 -3.363 8.052 5.963 1.00 0.28 H new ATOM 0 HB2 PRO A 419 -2.908 7.496 8.959 1.00 0.29 H new ATOM 0 HB3 PRO A 419 -3.611 6.412 7.777 1.00 0.29 H new ATOM 0 HG2 PRO A 419 -1.106 6.022 8.443 1.00 0.27 H new ATOM 0 HG3 PRO A 419 -1.512 5.980 6.738 1.00 0.27 H new ATOM 0 HD2 PRO A 419 -0.171 8.182 8.307 1.00 0.25 H new ATOM 0 HD3 PRO A 419 0.169 7.629 6.679 1.00 0.25 H new ATOM 1564 N ASP A 420 -3.685 10.105 8.457 1.00 0.35 N ATOM 1565 CA ASP A 420 -4.657 11.043 9.029 1.00 0.42 C ATOM 1566 C ASP A 420 -5.060 12.105 8.001 1.00 0.43 C ATOM 1567 O ASP A 420 -6.217 12.522 7.944 1.00 0.48 O ATOM 1568 CB ASP A 420 -4.095 11.704 10.293 1.00 0.49 C ATOM 1569 CG ASP A 420 -5.158 12.419 11.111 1.00 0.62 C ATOM 1570 OD1 ASP A 420 -5.956 11.732 11.784 1.00 0.74 O ATOM 1571 OD2 ASP A 420 -5.186 13.668 11.109 1.00 0.72 O ATOM 0 H ASP A 420 -2.772 10.106 8.911 1.00 0.35 H new ATOM 0 HA ASP A 420 -5.548 10.479 9.304 1.00 0.42 H new ATOM 0 HB2 ASP A 420 -3.618 10.944 10.912 1.00 0.49 H new ATOM 0 HB3 ASP A 420 -3.321 12.417 10.010 1.00 0.49 H new ATOM 1576 N GLU A 421 -4.101 12.527 7.184 1.00 0.42 N ATOM 1577 CA GLU A 421 -4.371 13.456 6.086 1.00 0.45 C ATOM 1578 C GLU A 421 -5.106 12.760 4.946 1.00 0.42 C ATOM 1579 O GLU A 421 -5.903 13.369 4.234 1.00 0.49 O ATOM 1580 CB GLU A 421 -3.063 14.049 5.556 1.00 0.49 C ATOM 1581 CG GLU A 421 -2.745 15.431 6.102 1.00 0.81 C ATOM 1582 CD GLU A 421 -3.709 16.478 5.584 1.00 1.60 C ATOM 1583 OE1 GLU A 421 -3.731 16.725 4.362 1.00 2.21 O ATOM 1584 OE2 GLU A 421 -4.458 17.057 6.402 1.00 2.17 O ATOM 0 H GLU A 421 -3.125 12.241 7.260 1.00 0.42 H new ATOM 0 HA GLU A 421 -5.002 14.254 6.476 1.00 0.45 H new ATOM 0 HB2 GLU A 421 -2.244 13.374 5.804 1.00 0.49 H new ATOM 0 HB3 GLU A 421 -3.114 14.102 4.469 1.00 0.49 H new ATOM 0 HG2 GLU A 421 -2.784 15.409 7.191 1.00 0.81 H new ATOM 0 HG3 GLU A 421 -1.727 15.706 5.825 1.00 0.81 H new ATOM 1591 N ILE A 422 -4.831 11.481 4.781 1.00 0.34 N ATOM 1592 CA ILE A 422 -5.352 10.724 3.654 1.00 0.33 C ATOM 1593 C ILE A 422 -6.787 10.240 3.892 1.00 0.36 C ATOM 1594 O ILE A 422 -7.661 10.405 3.037 1.00 0.39 O ATOM 1595 CB ILE A 422 -4.463 9.505 3.362 1.00 0.29 C ATOM 1596 CG1 ILE A 422 -3.017 9.933 3.098 1.00 0.27 C ATOM 1597 CG2 ILE A 422 -5.017 8.736 2.185 1.00 0.32 C ATOM 1598 CD1 ILE A 422 -2.114 8.784 2.695 1.00 0.27 C ATOM 0 H ILE A 422 -4.246 10.939 5.417 1.00 0.34 H new ATOM 0 HA ILE A 422 -5.353 11.402 2.801 1.00 0.33 H new ATOM 0 HB ILE A 422 -4.462 8.856 4.238 1.00 0.29 H new ATOM 0 HG12 ILE A 422 -3.007 10.687 2.311 1.00 0.27 H new ATOM 0 HG13 ILE A 422 -2.615 10.404 3.995 1.00 0.27 H new ATOM 0 HG21 ILE A 422 -4.382 7.873 1.983 1.00 0.32 H new ATOM 0 HG22 ILE A 422 -6.027 8.398 2.415 1.00 0.32 H new ATOM 0 HG23 ILE A 422 -5.041 9.382 1.307 1.00 0.32 H new ATOM 0 HD11 ILE A 422 -1.105 9.158 2.523 1.00 0.27 H new ATOM 0 HD12 ILE A 422 -2.095 8.040 3.491 1.00 0.27 H new ATOM 0 HD13 ILE A 422 -2.492 8.327 1.780 1.00 0.27 H new ATOM 1610 N MET A 423 -7.016 9.657 5.064 1.00 0.42 N ATOM 1611 CA MET A 423 -8.288 9.017 5.400 1.00 0.51 C ATOM 1612 C MET A 423 -9.424 10.016 5.470 1.00 0.58 C ATOM 1613 O MET A 423 -10.597 9.651 5.459 1.00 0.71 O ATOM 1614 CB MET A 423 -8.170 8.304 6.741 1.00 0.58 C ATOM 1615 CG MET A 423 -7.118 7.223 6.740 1.00 0.58 C ATOM 1616 SD MET A 423 -7.173 6.179 8.214 1.00 0.90 S ATOM 1617 CE MET A 423 -6.925 7.400 9.503 1.00 2.01 C ATOM 0 H MET A 423 -6.324 9.614 5.812 1.00 0.42 H new ATOM 0 HA MET A 423 -8.512 8.302 4.608 1.00 0.51 H new ATOM 0 HB2 MET A 423 -7.933 9.034 7.515 1.00 0.58 H new ATOM 0 HB3 MET A 423 -9.134 7.866 7.000 1.00 0.58 H new ATOM 0 HG2 MET A 423 -7.247 6.599 5.855 1.00 0.58 H new ATOM 0 HG3 MET A 423 -6.133 7.683 6.665 1.00 0.58 H new ATOM 0 HE1 MET A 423 -6.704 6.896 10.444 1.00 2.01 H new ATOM 0 HE2 MET A 423 -6.091 8.049 9.234 1.00 2.01 H new ATOM 0 HE3 MET A 423 -7.829 7.999 9.616 1.00 2.01 H new ATOM 1627 N SER A 424 -9.054 11.271 5.518 1.00 0.59 N ATOM 1628 CA SER A 424 -10.005 12.355 5.731 1.00 0.72 C ATOM 1629 C SER A 424 -10.720 12.766 4.432 1.00 0.67 C ATOM 1630 O SER A 424 -11.128 13.919 4.277 1.00 1.09 O ATOM 1631 CB SER A 424 -9.277 13.553 6.351 1.00 0.92 C ATOM 1632 OG SER A 424 -10.176 14.599 6.676 1.00 1.57 O ATOM 0 H SER A 424 -8.088 11.579 5.412 1.00 0.59 H new ATOM 0 HA SER A 424 -10.777 12.000 6.414 1.00 0.72 H new ATOM 0 HB2 SER A 424 -8.750 13.233 7.250 1.00 0.92 H new ATOM 0 HB3 SER A 424 -8.525 13.923 5.654 1.00 0.92 H new ATOM 0 HG SER A 424 -10.744 14.794 5.902 1.00 1.57 H new ATOM 1638 N GLY A 425 -10.885 11.825 3.506 1.00 0.43 N ATOM 1639 CA GLY A 425 -11.605 12.118 2.277 1.00 0.42 C ATOM 1640 C GLY A 425 -11.039 11.401 1.067 1.00 0.37 C ATOM 1641 O GLY A 425 -11.751 10.659 0.391 1.00 0.50 O ATOM 0 H GLY A 425 -10.535 10.870 3.583 1.00 0.43 H new ATOM 0 HA2 GLY A 425 -12.651 11.838 2.401 1.00 0.42 H new ATOM 0 HA3 GLY A 425 -11.582 13.193 2.098 1.00 0.42 H new ATOM 1645 N ARG A 426 -9.756 11.626 0.803 1.00 0.38 N ATOM 1646 CA ARG A 426 -9.070 11.075 -0.352 1.00 0.36 C ATOM 1647 C ARG A 426 -9.352 9.585 -0.558 1.00 0.33 C ATOM 1648 O ARG A 426 -9.766 9.163 -1.637 1.00 0.34 O ATOM 1649 CB ARG A 426 -7.574 11.312 -0.201 1.00 0.39 C ATOM 1650 CG ARG A 426 -7.192 12.740 -0.178 1.00 0.56 C ATOM 1651 CD ARG A 426 -7.330 13.301 1.188 1.00 0.92 C ATOM 1652 NE ARG A 426 -8.489 14.186 1.316 1.00 1.37 N ATOM 1653 CZ ARG A 426 -8.708 14.995 2.354 1.00 2.06 C ATOM 1654 NH1 ARG A 426 -7.882 15.000 3.392 1.00 2.63 N ATOM 1655 NH2 ARG A 426 -9.764 15.798 2.347 1.00 2.67 N ATOM 0 H ARG A 426 -9.159 12.204 1.395 1.00 0.38 H new ATOM 0 HA ARG A 426 -9.450 11.586 -1.237 1.00 0.36 H new ATOM 0 HB2 ARG A 426 -7.233 10.840 0.720 1.00 0.39 H new ATOM 0 HB3 ARG A 426 -7.054 10.820 -1.023 1.00 0.39 H new ATOM 0 HG2 ARG A 426 -6.163 12.851 -0.519 1.00 0.56 H new ATOM 0 HG3 ARG A 426 -7.820 13.300 -0.871 1.00 0.56 H new ATOM 0 HD2 ARG A 426 -7.419 12.485 1.905 1.00 0.92 H new ATOM 0 HD3 ARG A 426 -6.425 13.853 1.444 1.00 0.92 H new ATOM 0 HE ARG A 426 -9.175 14.184 0.561 1.00 1.37 H new ATOM 0 HH11 ARG A 426 -7.071 14.382 3.401 1.00 2.63 H new ATOM 0 HH12 ARG A 426 -8.058 15.622 4.181 1.00 2.63 H new ATOM 0 HH21 ARG A 426 -10.402 15.794 1.551 1.00 2.67 H new ATOM 0 HH22 ARG A 426 -9.938 16.419 3.137 1.00 2.67 H new ATOM 1669 N THR A 427 -9.142 8.804 0.488 1.00 0.33 N ATOM 1670 CA THR A 427 -9.322 7.357 0.419 1.00 0.37 C ATOM 1671 C THR A 427 -10.618 6.923 1.104 1.00 0.43 C ATOM 1672 O THR A 427 -10.837 5.739 1.369 1.00 0.58 O ATOM 1673 CB THR A 427 -8.104 6.647 1.043 1.00 0.63 C ATOM 1674 OG1 THR A 427 -8.285 5.238 1.082 1.00 1.24 O ATOM 1675 CG2 THR A 427 -7.836 7.151 2.439 1.00 0.41 C ATOM 0 H THR A 427 -8.845 9.147 1.402 1.00 0.33 H new ATOM 0 HA THR A 427 -9.398 7.069 -0.630 1.00 0.37 H new ATOM 0 HB THR A 427 -7.248 6.875 0.408 1.00 0.63 H new ATOM 0 HG1 THR A 427 -9.230 5.034 1.243 1.00 1.24 H new ATOM 0 HG21 THR A 427 -6.972 6.632 2.853 1.00 0.41 H new ATOM 0 HG22 THR A 427 -7.635 8.222 2.407 1.00 0.41 H new ATOM 0 HG23 THR A 427 -8.707 6.964 3.067 1.00 0.41 H new ATOM 1683 N ASP A 428 -11.501 7.884 1.338 1.00 0.45 N ATOM 1684 CA ASP A 428 -12.781 7.610 1.983 1.00 0.62 C ATOM 1685 C ASP A 428 -13.656 6.743 1.081 1.00 0.61 C ATOM 1686 O ASP A 428 -14.348 5.834 1.541 1.00 0.78 O ATOM 1687 CB ASP A 428 -13.495 8.921 2.308 1.00 0.74 C ATOM 1688 CG ASP A 428 -14.823 8.714 3.003 1.00 1.27 C ATOM 1689 OD1 ASP A 428 -14.840 8.639 4.246 1.00 1.63 O ATOM 1690 OD2 ASP A 428 -15.860 8.648 2.312 1.00 1.75 O ATOM 0 H ASP A 428 -11.355 8.863 1.091 1.00 0.45 H new ATOM 0 HA ASP A 428 -12.596 7.069 2.911 1.00 0.62 H new ATOM 0 HB2 ASP A 428 -12.851 9.532 2.941 1.00 0.74 H new ATOM 0 HB3 ASP A 428 -13.657 9.479 1.386 1.00 0.74 H new ATOM 1695 N ARG A 429 -13.603 7.024 -0.218 1.00 0.54 N ATOM 1696 CA ARG A 429 -14.370 6.263 -1.200 1.00 0.65 C ATOM 1697 C ARG A 429 -13.645 4.968 -1.525 1.00 0.55 C ATOM 1698 O ARG A 429 -14.257 3.945 -1.839 1.00 0.66 O ATOM 1699 CB ARG A 429 -14.544 7.065 -2.481 1.00 0.81 C ATOM 1700 CG ARG A 429 -14.702 8.546 -2.239 1.00 0.98 C ATOM 1701 CD ARG A 429 -14.840 9.311 -3.546 1.00 1.12 C ATOM 1702 NE ARG A 429 -14.648 10.748 -3.365 1.00 1.64 N ATOM 1703 CZ ARG A 429 -14.539 11.617 -4.369 1.00 2.03 C ATOM 1704 NH1 ARG A 429 -14.684 11.215 -5.625 1.00 2.00 N ATOM 1705 NH2 ARG A 429 -14.296 12.894 -4.110 1.00 3.05 N ATOM 0 H ARG A 429 -13.037 7.773 -0.615 1.00 0.54 H new ATOM 0 HA ARG A 429 -15.351 6.047 -0.777 1.00 0.65 H new ATOM 0 HB2 ARG A 429 -13.681 6.899 -3.126 1.00 0.81 H new ATOM 0 HB3 ARG A 429 -15.418 6.696 -3.017 1.00 0.81 H new ATOM 0 HG2 ARG A 429 -15.580 8.723 -1.618 1.00 0.98 H new ATOM 0 HG3 ARG A 429 -13.840 8.920 -1.686 1.00 0.98 H new ATOM 0 HD2 ARG A 429 -14.111 8.936 -4.264 1.00 1.12 H new ATOM 0 HD3 ARG A 429 -15.827 9.128 -3.970 1.00 1.12 H new ATOM 0 HE ARG A 429 -14.594 11.108 -2.412 1.00 1.64 H new ATOM 0 HH11 ARG A 429 -14.880 10.235 -5.827 1.00 2.00 H new ATOM 0 HH12 ARG A 429 -14.599 11.886 -6.388 1.00 2.00 H new ATOM 0 HH21 ARG A 429 -14.193 13.208 -3.145 1.00 3.05 H new ATOM 0 HH22 ARG A 429 -14.212 13.563 -4.876 1.00 3.05 H new ATOM 1719 N LEU A 430 -12.328 5.045 -1.424 1.00 0.42 N ATOM 1720 CA LEU A 430 -11.431 3.953 -1.779 1.00 0.36 C ATOM 1721 C LEU A 430 -11.778 2.660 -1.070 1.00 0.39 C ATOM 1722 O LEU A 430 -11.772 1.588 -1.676 1.00 0.45 O ATOM 1723 CB LEU A 430 -10.010 4.346 -1.437 1.00 0.31 C ATOM 1724 CG LEU A 430 -9.208 4.942 -2.571 1.00 0.28 C ATOM 1725 CD1 LEU A 430 -7.887 5.386 -2.022 1.00 0.64 C ATOM 1726 CD2 LEU A 430 -9.006 3.930 -3.683 1.00 0.56 C ATOM 0 H LEU A 430 -11.844 5.878 -1.089 1.00 0.42 H new ATOM 0 HA LEU A 430 -11.539 3.775 -2.849 1.00 0.36 H new ATOM 0 HB2 LEU A 430 -10.038 5.065 -0.618 1.00 0.31 H new ATOM 0 HB3 LEU A 430 -9.486 3.464 -1.069 1.00 0.31 H new ATOM 0 HG LEU A 430 -9.745 5.790 -2.996 1.00 0.28 H new ATOM 0 HD11 LEU A 430 -7.288 5.821 -2.822 1.00 0.64 H new ATOM 0 HD12 LEU A 430 -8.049 6.132 -1.244 1.00 0.64 H new ATOM 0 HD13 LEU A 430 -7.362 4.529 -1.600 1.00 0.64 H new ATOM 0 HD21 LEU A 430 -8.426 4.384 -4.487 1.00 0.56 H new ATOM 0 HD22 LEU A 430 -8.471 3.064 -3.294 1.00 0.56 H new ATOM 0 HD23 LEU A 430 -9.976 3.615 -4.068 1.00 0.56 H new ATOM 1738 N GLU A 431 -12.102 2.788 0.203 1.00 0.42 N ATOM 1739 CA GLU A 431 -12.463 1.651 1.060 1.00 0.53 C ATOM 1740 C GLU A 431 -13.470 0.701 0.405 1.00 0.59 C ATOM 1741 O GLU A 431 -13.516 -0.486 0.728 1.00 0.72 O ATOM 1742 CB GLU A 431 -13.071 2.162 2.348 1.00 0.61 C ATOM 1743 CG GLU A 431 -12.115 2.913 3.237 1.00 0.73 C ATOM 1744 CD GLU A 431 -12.836 3.604 4.376 1.00 0.97 C ATOM 1745 OE1 GLU A 431 -13.650 2.947 5.058 1.00 1.31 O ATOM 1746 OE2 GLU A 431 -12.550 4.799 4.622 1.00 1.25 O ATOM 0 H GLU A 431 -12.125 3.687 0.685 1.00 0.42 H new ATOM 0 HA GLU A 431 -11.543 1.095 1.241 1.00 0.53 H new ATOM 0 HB2 GLU A 431 -13.910 2.815 2.105 1.00 0.61 H new ATOM 0 HB3 GLU A 431 -13.476 1.316 2.904 1.00 0.61 H new ATOM 0 HG2 GLU A 431 -11.374 2.223 3.640 1.00 0.73 H new ATOM 0 HG3 GLU A 431 -11.574 3.652 2.647 1.00 0.73 H new ATOM 1753 N HIS A 432 -14.271 1.226 -0.514 1.00 0.58 N ATOM 1754 CA HIS A 432 -15.360 0.459 -1.107 1.00 0.66 C ATOM 1755 C HIS A 432 -14.899 -0.273 -2.365 1.00 0.60 C ATOM 1756 O HIS A 432 -15.173 -1.458 -2.535 1.00 0.72 O ATOM 1757 CB HIS A 432 -16.540 1.384 -1.427 1.00 0.76 C ATOM 1758 CG HIS A 432 -17.000 2.187 -0.248 1.00 1.72 C ATOM 1759 ND1 HIS A 432 -18.096 1.865 0.518 1.00 2.60 N ATOM 1760 CD2 HIS A 432 -16.475 3.300 0.303 1.00 2.20 C ATOM 1761 CE1 HIS A 432 -18.224 2.747 1.491 1.00 3.59 C ATOM 1762 NE2 HIS A 432 -17.249 3.632 1.388 1.00 3.38 N ATOM 0 H HIS A 432 -14.187 2.180 -0.865 1.00 0.58 H new ATOM 0 HA HIS A 432 -15.682 -0.291 -0.385 1.00 0.66 H new ATOM 0 HB2 HIS A 432 -16.253 2.063 -2.230 1.00 0.76 H new ATOM 0 HB3 HIS A 432 -17.372 0.785 -1.797 1.00 0.76 H new ATOM 0 HD2 HIS A 432 -15.603 3.834 -0.046 1.00 2.20 H new ATOM 0 HE1 HIS A 432 -18.997 2.746 2.245 1.00 3.59 H new ATOM 0 HE2 HIS A 432 -17.097 4.427 2.009 1.00 3.38 H new ATOM 1771 N LEU A 433 -14.183 0.428 -3.237 1.00 0.50 N ATOM 1772 CA LEU A 433 -13.726 -0.165 -4.490 1.00 0.53 C ATOM 1773 C LEU A 433 -12.555 -1.102 -4.251 1.00 0.54 C ATOM 1774 O LEU A 433 -12.386 -2.092 -4.957 1.00 0.67 O ATOM 1775 CB LEU A 433 -13.319 0.913 -5.492 1.00 0.60 C ATOM 1776 CG LEU A 433 -12.203 1.843 -5.037 1.00 0.57 C ATOM 1777 CD1 LEU A 433 -11.162 2.009 -6.134 1.00 0.65 C ATOM 1778 CD2 LEU A 433 -12.777 3.192 -4.648 1.00 0.88 C ATOM 0 H LEU A 433 -13.908 1.401 -3.102 1.00 0.50 H new ATOM 0 HA LEU A 433 -14.559 -0.734 -4.903 1.00 0.53 H new ATOM 0 HB2 LEU A 433 -13.008 0.426 -6.417 1.00 0.60 H new ATOM 0 HB3 LEU A 433 -14.196 1.515 -5.728 1.00 0.60 H new ATOM 0 HG LEU A 433 -11.716 1.402 -4.167 1.00 0.57 H new ATOM 0 HD11 LEU A 433 -10.373 2.677 -5.789 1.00 0.65 H new ATOM 0 HD12 LEU A 433 -10.733 1.037 -6.379 1.00 0.65 H new ATOM 0 HD13 LEU A 433 -11.633 2.432 -7.022 1.00 0.65 H new ATOM 0 HD21 LEU A 433 -11.971 3.851 -4.324 1.00 0.88 H new ATOM 0 HD22 LEU A 433 -13.283 3.633 -5.507 1.00 0.88 H new ATOM 0 HD23 LEU A 433 -13.490 3.063 -3.834 1.00 0.88 H new ATOM 1790 N GLU A 434 -11.750 -0.781 -3.252 1.00 0.49 N ATOM 1791 CA GLU A 434 -10.585 -1.592 -2.911 1.00 0.60 C ATOM 1792 C GLU A 434 -10.968 -2.961 -2.391 1.00 0.76 C ATOM 1793 O GLU A 434 -10.133 -3.865 -2.331 1.00 1.02 O ATOM 1794 CB GLU A 434 -9.719 -0.894 -1.885 1.00 0.54 C ATOM 1795 CG GLU A 434 -8.924 0.236 -2.454 1.00 0.63 C ATOM 1796 CD GLU A 434 -7.768 0.603 -1.570 1.00 1.10 C ATOM 1797 OE1 GLU A 434 -7.118 -0.307 -1.037 1.00 1.36 O ATOM 1798 OE2 GLU A 434 -7.505 1.813 -1.407 1.00 1.90 O ATOM 0 H GLU A 434 -11.880 0.038 -2.659 1.00 0.49 H new ATOM 0 HA GLU A 434 -10.023 -1.724 -3.836 1.00 0.60 H new ATOM 0 HB2 GLU A 434 -10.352 -0.516 -1.082 1.00 0.54 H new ATOM 0 HB3 GLU A 434 -9.039 -1.620 -1.440 1.00 0.54 H new ATOM 0 HG2 GLU A 434 -8.554 -0.041 -3.441 1.00 0.63 H new ATOM 0 HG3 GLU A 434 -9.570 1.104 -2.588 1.00 0.63 H new ATOM 1805 N SER A 435 -12.224 -3.120 -2.024 1.00 0.72 N ATOM 1806 CA SER A 435 -12.718 -4.414 -1.599 1.00 0.89 C ATOM 1807 C SER A 435 -12.690 -5.367 -2.790 1.00 1.03 C ATOM 1808 O SER A 435 -12.662 -6.585 -2.634 1.00 1.20 O ATOM 1809 CB SER A 435 -14.130 -4.291 -1.026 1.00 0.97 C ATOM 1810 OG SER A 435 -14.505 -5.464 -0.320 1.00 1.47 O ATOM 0 H SER A 435 -12.918 -2.373 -2.011 1.00 0.72 H new ATOM 0 HA SER A 435 -12.080 -4.809 -0.808 1.00 0.89 H new ATOM 0 HB2 SER A 435 -14.180 -3.431 -0.358 1.00 0.97 H new ATOM 0 HB3 SER A 435 -14.838 -4.109 -1.834 1.00 0.97 H new ATOM 0 HG SER A 435 -15.412 -5.356 0.036 1.00 1.47 H new ATOM 1816 N GLN A 436 -12.665 -4.775 -3.981 1.00 1.04 N ATOM 1817 CA GLN A 436 -12.598 -5.505 -5.232 1.00 1.24 C ATOM 1818 C GLN A 436 -11.154 -5.562 -5.728 1.00 1.47 C ATOM 1819 O GLN A 436 -10.433 -6.517 -5.365 1.00 1.78 O ATOM 1820 CB GLN A 436 -13.477 -4.798 -6.263 1.00 1.17 C ATOM 1821 CG GLN A 436 -14.937 -4.723 -5.868 1.00 1.30 C ATOM 1822 CD GLN A 436 -15.653 -6.045 -6.033 1.00 2.00 C ATOM 1823 OE1 GLN A 436 -15.687 -6.875 -5.124 1.00 2.65 O ATOM 1824 NE2 GLN A 436 -16.236 -6.240 -7.198 1.00 2.60 N ATOM 1825 OXT GLN A 436 -10.737 -4.640 -6.467 1.00 2.10 O ATOM 0 H GLN A 436 -12.691 -3.762 -4.100 1.00 1.04 H new ATOM 0 HA GLN A 436 -12.953 -6.525 -5.082 1.00 1.24 H new ATOM 0 HB2 GLN A 436 -13.099 -3.787 -6.418 1.00 1.17 H new ATOM 0 HB3 GLN A 436 -13.394 -5.319 -7.217 1.00 1.17 H new ATOM 0 HG2 GLN A 436 -15.012 -4.400 -4.830 1.00 1.30 H new ATOM 0 HG3 GLN A 436 -15.435 -3.966 -6.474 1.00 1.30 H new ATOM 0 HE21 GLN A 436 -16.181 -5.524 -7.922 1.00 2.60 H new ATOM 0 HE22 GLN A 436 -16.742 -7.107 -7.376 1.00 2.60 H new TER 1834 GLN A 436