USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 919 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 905 TYR OH : rot 90:sc= -3.12! USER MOD Set 1.2: A 912 HIS : no HE2:sc= -1 K(o=-4.1,f=-6.4!) USER MOD Set 2.1: A 868 ASN : amide:sc= -2.59! K(o=-13!,f=-9.1) USER MOD Set 2.2: A 871 HIS : no HE2:sc= -10.6! K(o=-13!,f=-9.1) USER MOD Set 3.1: A 830 HIS : no HD1:sc= -2.82! X(o=-3.8!,f=-4.1) USER MOD Set 3.2: A 879 TYR OH : rot -91:sc= -0.935! USER MOD Single : A 805 ASN : amide:sc= -2.68! K(o=-2.7!,f=-0.89) USER MOD Single : A 806 LYS NZ :NH3+ -156:sc= -0.0344 (180deg=-0.543) USER MOD Single : A 807 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 810 CYS SG : rot 142:sc= 0.656 USER MOD Single : A 812 LYS NZ :NH3+ -114:sc= -1.25 (180deg=-4.71!) USER MOD Single : A 813 CYS SG : rot -46:sc= -0.162 USER MOD Single : A 814 LYS NZ :NH3+ -162:sc= -0.0363 (180deg=-0.315) USER MOD Single : A 818 CYS SG : rot -150:sc= -0.148 USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot 134:sc= -0.83! USER MOD Single : A 829 CYS SG : rot 82:sc= -0.636 USER MOD Single : A 831 TYR OH : rot 165:sc= 0 USER MOD Single : A 832 THR OG1 : rot 150:sc= -0.726 USER MOD Single : A 839 LYS NZ :NH3+ 180:sc= -0.12 (180deg=-0.12) USER MOD Single : A 841 CYS SG : rot -47:sc= -1.08 USER MOD Single : A 844 SER OG : rot -4:sc= 0.754! USER MOD Single : A 858 LYS NZ :NH3+ -163:sc= -0.0421 (180deg=-0.389) USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 864 CYS SG : rot 12:sc= -0.911 USER MOD Single : A 867 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 869 CYS SG : rot 52:sc= 0.0695 USER MOD Single : A 870 SER OG : rot -43:sc= 0.654 USER MOD Single : A 876 HIS : no HD1:sc= -0.0497 K(o=-0.05,f=-0.85) USER MOD Single : A 878 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 880 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 881 THR OG1 : rot 180:sc= 0 USER MOD Single : A 888 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 891 SER OG : rot 85:sc= -2.86! USER MOD Single : A 899 THR OG1 : rot -169:sc= -8.02! USER MOD Single : A 902 GLN : amide:sc= -2.91! K(o=-2.9!,f=-0.024) USER MOD Single : A 903 THR OG1 : rot 180:sc= -1.64! USER MOD Single : A 906 SER OG : rot 180:sc= 0 USER MOD Single : A 907 LYS NZ :NH3+ -144:sc= -3.03! (180deg=-4.04!) USER MOD Single : A 909 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 LYS NZ :NH3+ -164:sc=-0.00588 (180deg=-0.122) USER MOD Single : A 923 MET CE :methyl 172:sc= -4.59 (180deg=-4.64!) USER MOD Single : A 924 SER OG : rot 180:sc= -0.029 USER MOD Single : A 925 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 0.043 -27.830 -3.070 1.00 12.21 N ATOM 209 CA ASN A 805 0.803 -27.033 -2.122 1.00 64.22 C ATOM 210 C ASN A 805 -0.070 -25.886 -1.610 1.00 33.54 C ATOM 211 O ASN A 805 -0.869 -25.327 -2.359 1.00 72.12 O ATOM 212 CB ASN A 805 2.042 -26.425 -2.783 1.00 51.10 C ATOM 213 CG ASN A 805 2.515 -25.184 -2.023 1.00 41.04 C ATOM 214 OD1 ASN A 805 2.696 -24.114 -2.581 1.00 61.24 O ATOM 215 ND2 ASN A 805 2.705 -25.386 -0.723 1.00 12.34 N ATOM 0 HA ASN A 805 1.112 -27.685 -1.305 1.00 64.22 H new ATOM 0 HB2 ASN A 805 2.842 -27.164 -2.813 1.00 51.10 H new ATOM 0 HB3 ASN A 805 1.814 -26.159 -3.815 1.00 51.10 H new ATOM 0 HD21 ASN A 805 3.021 -24.620 -0.129 1.00 12.34 H new ATOM 0 HD22 ASN A 805 2.535 -26.307 -0.320 1.00 12.34 H new ATOM 222 N LYS A 806 0.111 -25.570 -0.336 1.00 22.52 N ATOM 223 CA LYS A 806 -0.651 -24.501 0.286 1.00 44.53 C ATOM 224 C LYS A 806 0.285 -23.646 1.143 1.00 32.04 C ATOM 225 O LYS A 806 1.281 -24.143 1.666 1.00 30.42 O ATOM 226 CB LYS A 806 -1.843 -25.070 1.057 1.00 52.14 C ATOM 227 CG LYS A 806 -2.327 -24.085 2.123 1.00 33.31 C ATOM 228 CD LYS A 806 -3.797 -24.333 2.471 1.00 5.51 C ATOM 229 CE LYS A 806 -4.004 -25.755 2.996 1.00 42.31 C ATOM 230 NZ LYS A 806 -4.499 -26.638 1.917 1.00 75.20 N ATOM 0 H LYS A 806 0.775 -26.036 0.283 1.00 22.52 H new ATOM 0 HA LYS A 806 -1.077 -23.845 -0.473 1.00 44.53 H new ATOM 0 HB2 LYS A 806 -2.656 -25.291 0.365 1.00 52.14 H new ATOM 0 HB3 LYS A 806 -1.560 -26.011 1.528 1.00 52.14 H new ATOM 0 HG2 LYS A 806 -1.715 -24.184 3.020 1.00 33.31 H new ATOM 0 HG3 LYS A 806 -2.202 -23.064 1.763 1.00 33.31 H new ATOM 0 HD2 LYS A 806 -4.123 -23.613 3.222 1.00 5.51 H new ATOM 0 HD3 LYS A 806 -4.415 -24.174 1.588 1.00 5.51 H new ATOM 0 HE2 LYS A 806 -3.065 -26.144 3.390 1.00 42.31 H new ATOM 0 HE3 LYS A 806 -4.716 -25.744 3.821 1.00 42.31 H new ATOM 0 HZ1 LYS A 806 -5.008 -27.443 2.334 1.00 75.20 H new ATOM 0 HZ2 LYS A 806 -5.142 -26.104 1.299 1.00 75.20 H new ATOM 0 HZ3 LYS A 806 -3.695 -26.989 1.359 1.00 75.20 H new ATOM 243 N LYS A 807 -0.069 -22.375 1.262 1.00 40.35 N ATOM 244 CA LYS A 807 0.726 -21.446 2.047 1.00 64.31 C ATOM 245 C LYS A 807 0.121 -21.320 3.446 1.00 12.32 C ATOM 246 O LYS A 807 -1.089 -21.459 3.618 1.00 52.43 O ATOM 247 CB LYS A 807 0.868 -20.110 1.315 1.00 64.20 C ATOM 248 CG LYS A 807 1.670 -19.110 2.150 1.00 10.13 C ATOM 249 CD LYS A 807 1.639 -17.718 1.517 1.00 44.43 C ATOM 250 CE LYS A 807 1.863 -17.798 0.005 1.00 31.13 C ATOM 251 NZ LYS A 807 1.949 -16.441 -0.579 1.00 4.12 N ATOM 0 H LYS A 807 -0.896 -21.966 0.828 1.00 40.35 H new ATOM 0 HA LYS A 807 1.741 -21.824 2.171 1.00 64.31 H new ATOM 0 HB2 LYS A 807 1.362 -20.267 0.356 1.00 64.20 H new ATOM 0 HB3 LYS A 807 -0.120 -19.701 1.102 1.00 64.20 H new ATOM 0 HG2 LYS A 807 1.261 -19.064 3.159 1.00 10.13 H new ATOM 0 HG3 LYS A 807 2.702 -19.450 2.239 1.00 10.13 H new ATOM 0 HD2 LYS A 807 0.680 -17.243 1.721 1.00 44.43 H new ATOM 0 HD3 LYS A 807 2.408 -17.092 1.970 1.00 44.43 H new ATOM 0 HE2 LYS A 807 2.780 -18.349 -0.204 1.00 31.13 H new ATOM 0 HE3 LYS A 807 1.046 -18.350 -0.461 1.00 31.13 H new ATOM 0 HZ1 LYS A 807 2.101 -16.514 -1.605 1.00 4.12 H new ATOM 0 HZ2 LYS A 807 1.063 -15.927 -0.396 1.00 4.12 H new ATOM 0 HZ3 LYS A 807 2.743 -15.927 -0.147 1.00 4.12 H new ATOM 264 N LEU A 808 0.990 -21.057 4.411 1.00 63.51 N ATOM 265 CA LEU A 808 0.556 -20.911 5.790 1.00 43.41 C ATOM 266 C LEU A 808 0.999 -19.544 6.316 1.00 13.23 C ATOM 267 O LEU A 808 1.871 -18.902 5.732 1.00 32.35 O ATOM 268 CB LEU A 808 1.052 -22.085 6.636 1.00 61.34 C ATOM 269 CG LEU A 808 0.501 -23.462 6.260 1.00 74.10 C ATOM 270 CD1 LEU A 808 1.342 -24.107 5.157 1.00 31.51 C ATOM 271 CD2 LEU A 808 0.384 -24.361 7.493 1.00 64.14 C ATOM 0 H LEU A 808 1.993 -20.941 4.265 1.00 63.51 H new ATOM 0 HA LEU A 808 -0.532 -20.941 5.852 1.00 43.41 H new ATOM 0 HB2 LEU A 808 2.139 -22.120 6.571 1.00 61.34 H new ATOM 0 HB3 LEU A 808 0.802 -21.888 7.678 1.00 61.34 H new ATOM 0 HG LEU A 808 -0.505 -23.330 5.861 1.00 74.10 H new ATOM 0 HD11 LEU A 808 0.929 -25.085 4.909 1.00 31.51 H new ATOM 0 HD12 LEU A 808 1.329 -23.472 4.271 1.00 31.51 H new ATOM 0 HD13 LEU A 808 2.369 -24.225 5.504 1.00 31.51 H new ATOM 0 HD21 LEU A 808 -0.010 -25.334 7.198 1.00 64.14 H new ATOM 0 HD22 LEU A 808 1.368 -24.490 7.944 1.00 64.14 H new ATOM 0 HD23 LEU A 808 -0.289 -23.901 8.216 1.00 64.14 H new ATOM 283 N LEU A 809 0.377 -19.139 7.414 1.00 51.42 N ATOM 284 CA LEU A 809 0.696 -17.860 8.026 1.00 55.45 C ATOM 285 C LEU A 809 0.755 -18.027 9.545 1.00 3.12 C ATOM 286 O LEU A 809 0.338 -19.055 10.077 1.00 5.30 O ATOM 287 CB LEU A 809 -0.290 -16.784 7.563 1.00 21.34 C ATOM 288 CG LEU A 809 0.125 -15.980 6.330 1.00 3.51 C ATOM 289 CD1 LEU A 809 -0.049 -16.804 5.053 1.00 12.12 C ATOM 290 CD2 LEU A 809 -0.631 -14.651 6.262 1.00 4.04 C ATOM 0 H LEU A 809 -0.346 -19.674 7.895 1.00 51.42 H new ATOM 0 HA LEU A 809 1.680 -17.518 7.704 1.00 55.45 H new ATOM 0 HB2 LEU A 809 -1.247 -17.262 7.355 1.00 21.34 H new ATOM 0 HB3 LEU A 809 -0.453 -16.090 8.387 1.00 21.34 H new ATOM 0 HG LEU A 809 1.185 -15.744 6.418 1.00 3.51 H new ATOM 0 HD11 LEU A 809 0.253 -16.208 4.192 1.00 12.12 H new ATOM 0 HD12 LEU A 809 0.570 -17.699 5.110 1.00 12.12 H new ATOM 0 HD13 LEU A 809 -1.095 -17.092 4.946 1.00 12.12 H new ATOM 0 HD21 LEU A 809 -0.317 -14.099 5.376 1.00 4.04 H new ATOM 0 HD22 LEU A 809 -1.702 -14.844 6.209 1.00 4.04 H new ATOM 0 HD23 LEU A 809 -0.412 -14.062 7.153 1.00 4.04 H new ATOM 302 N CYS A 810 1.277 -17.001 10.201 1.00 10.23 N ATOM 303 CA CYS A 810 1.397 -17.021 11.649 1.00 34.23 C ATOM 304 C CYS A 810 0.308 -16.119 12.234 1.00 44.40 C ATOM 305 O CYS A 810 0.391 -14.896 12.133 1.00 1.52 O ATOM 306 CB CYS A 810 2.794 -16.600 12.107 1.00 24.13 C ATOM 307 SG CYS A 810 3.078 -17.142 13.832 1.00 74.40 S ATOM 0 H CYS A 810 1.622 -16.150 9.756 1.00 10.23 H new ATOM 0 HA CYS A 810 1.259 -18.039 12.014 1.00 34.23 H new ATOM 0 HB2 CYS A 810 3.547 -17.037 11.451 1.00 24.13 H new ATOM 0 HB3 CYS A 810 2.898 -15.517 12.036 1.00 24.13 H new ATOM 0 HG CYS A 810 4.307 -17.545 13.963 1.00 74.40 H new ATOM 313 N ARG A 811 -0.687 -16.757 12.832 1.00 4.24 N ATOM 314 CA ARG A 811 -1.790 -16.027 13.433 1.00 0.33 C ATOM 315 C ARG A 811 -1.266 -14.813 14.204 1.00 33.43 C ATOM 316 O ARG A 811 -1.975 -13.821 14.363 1.00 35.00 O ATOM 317 CB ARG A 811 -2.589 -16.921 14.384 1.00 41.51 C ATOM 318 CG ARG A 811 -3.748 -16.149 15.018 1.00 40.32 C ATOM 319 CD ARG A 811 -4.558 -17.047 15.954 1.00 20.54 C ATOM 320 NE ARG A 811 -5.319 -16.220 16.917 1.00 22.12 N ATOM 321 CZ ARG A 811 -6.027 -16.721 17.952 1.00 64.12 C ATOM 322 NH1 ARG A 811 -6.077 -18.053 18.167 1.00 43.13 N ATOM 323 NH2 ARG A 811 -6.669 -15.889 18.750 1.00 32.12 N ATOM 0 H ARG A 811 -0.752 -17.772 12.913 1.00 4.24 H new ATOM 0 HA ARG A 811 -2.446 -15.695 12.628 1.00 0.33 H new ATOM 0 HB2 ARG A 811 -2.976 -17.783 13.840 1.00 41.51 H new ATOM 0 HB3 ARG A 811 -1.933 -17.305 15.165 1.00 41.51 H new ATOM 0 HG2 ARG A 811 -3.360 -15.295 15.573 1.00 40.32 H new ATOM 0 HG3 ARG A 811 -4.397 -15.753 14.236 1.00 40.32 H new ATOM 0 HD2 ARG A 811 -5.242 -17.667 15.375 1.00 20.54 H new ATOM 0 HD3 ARG A 811 -3.891 -17.723 16.490 1.00 20.54 H new ATOM 0 HE ARG A 811 -5.308 -15.208 16.791 1.00 22.12 H new ATOM 0 HH11 ARG A 811 -5.578 -18.689 17.545 1.00 43.13 H new ATOM 0 HH12 ARG A 811 -6.614 -18.423 18.951 1.00 43.13 H new ATOM 0 HH21 ARG A 811 -6.626 -14.884 18.580 1.00 32.12 H new ATOM 0 HH22 ARG A 811 -7.208 -16.251 19.536 1.00 32.12 H new ATOM 336 N LYS A 812 -0.029 -14.933 14.663 1.00 11.21 N ATOM 337 CA LYS A 812 0.598 -13.858 15.414 1.00 73.04 C ATOM 338 C LYS A 812 0.303 -12.523 14.727 1.00 14.13 C ATOM 339 O LYS A 812 -0.562 -11.770 15.172 1.00 14.01 O ATOM 340 CB LYS A 812 2.090 -14.136 15.602 1.00 4.11 C ATOM 341 CG LYS A 812 2.340 -14.954 16.871 1.00 71.13 C ATOM 342 CD LYS A 812 2.628 -14.041 18.064 1.00 35.13 C ATOM 343 CE LYS A 812 1.355 -13.329 18.529 1.00 24.52 C ATOM 344 NZ LYS A 812 1.175 -12.058 17.794 1.00 54.12 N ATOM 0 H LYS A 812 0.556 -15.758 14.530 1.00 11.21 H new ATOM 0 HA LYS A 812 0.179 -13.800 16.419 1.00 73.04 H new ATOM 0 HB2 LYS A 812 2.475 -14.675 14.736 1.00 4.11 H new ATOM 0 HB3 LYS A 812 2.635 -13.194 15.659 1.00 4.11 H new ATOM 0 HG2 LYS A 812 1.470 -15.575 17.085 1.00 71.13 H new ATOM 0 HG3 LYS A 812 3.182 -15.629 16.713 1.00 71.13 H new ATOM 0 HD2 LYS A 812 3.041 -14.628 18.884 1.00 35.13 H new ATOM 0 HD3 LYS A 812 3.382 -13.303 17.789 1.00 35.13 H new ATOM 0 HE2 LYS A 812 0.491 -13.974 18.369 1.00 24.52 H new ATOM 0 HE3 LYS A 812 1.412 -13.132 19.600 1.00 24.52 H new ATOM 0 HZ1 LYS A 812 1.267 -11.259 18.454 1.00 54.12 H new ATOM 0 HZ2 LYS A 812 1.900 -11.980 17.052 1.00 54.12 H new ATOM 0 HZ3 LYS A 812 0.231 -12.040 17.358 1.00 54.12 H new ATOM 357 N CYS A 813 1.038 -12.270 13.655 1.00 62.03 N ATOM 358 CA CYS A 813 0.866 -11.039 12.902 1.00 1.25 C ATOM 359 C CYS A 813 0.371 -11.398 11.500 1.00 15.23 C ATOM 360 O CYS A 813 0.515 -10.610 10.566 1.00 30.45 O ATOM 361 CB CYS A 813 2.156 -10.218 12.859 1.00 44.41 C ATOM 362 SG CYS A 813 1.808 -8.538 12.222 1.00 13.34 S ATOM 0 H CYS A 813 1.755 -12.897 13.289 1.00 62.03 H new ATOM 0 HA CYS A 813 0.127 -10.408 13.396 1.00 1.25 H new ATOM 0 HB2 CYS A 813 2.590 -10.155 13.857 1.00 44.41 H new ATOM 0 HB3 CYS A 813 2.890 -10.712 12.223 1.00 44.41 H new ATOM 0 HG CYS A 813 1.058 -8.622 11.163 1.00 13.34 H new ATOM 368 N LYS A 814 -0.204 -12.587 11.397 1.00 63.32 N ATOM 369 CA LYS A 814 -0.722 -13.060 10.124 1.00 25.32 C ATOM 370 C LYS A 814 0.324 -12.821 9.033 1.00 73.42 C ATOM 371 O LYS A 814 0.134 -11.974 8.161 1.00 20.33 O ATOM 372 CB LYS A 814 -2.079 -12.420 9.827 1.00 42.33 C ATOM 373 CG LYS A 814 -2.775 -11.986 11.118 1.00 11.31 C ATOM 374 CD LYS A 814 -3.083 -13.192 12.007 1.00 25.14 C ATOM 375 CE LYS A 814 -4.182 -14.060 11.393 1.00 72.33 C ATOM 376 NZ LYS A 814 -5.477 -13.343 11.405 1.00 44.33 N ATOM 0 H LYS A 814 -0.323 -13.237 12.174 1.00 63.32 H new ATOM 0 HA LYS A 814 -0.904 -14.134 10.161 1.00 25.32 H new ATOM 0 HB2 LYS A 814 -1.943 -11.557 9.175 1.00 42.33 H new ATOM 0 HB3 LYS A 814 -2.710 -13.129 9.290 1.00 42.33 H new ATOM 0 HG2 LYS A 814 -2.141 -11.284 11.659 1.00 11.31 H new ATOM 0 HG3 LYS A 814 -3.700 -11.461 10.878 1.00 11.31 H new ATOM 0 HD2 LYS A 814 -2.180 -13.786 12.145 1.00 25.14 H new ATOM 0 HD3 LYS A 814 -3.394 -12.850 12.994 1.00 25.14 H new ATOM 0 HE2 LYS A 814 -3.916 -14.324 10.370 1.00 72.33 H new ATOM 0 HE3 LYS A 814 -4.271 -14.993 11.950 1.00 72.33 H new ATOM 0 HZ1 LYS A 814 -6.252 -14.025 11.279 1.00 44.33 H new ATOM 0 HZ2 LYS A 814 -5.593 -12.851 12.314 1.00 44.33 H new ATOM 0 HZ3 LYS A 814 -5.497 -12.649 10.631 1.00 44.33 H new ATOM 389 N ALA A 815 1.404 -13.583 9.116 1.00 24.41 N ATOM 390 CA ALA A 815 2.480 -13.465 8.146 1.00 20.23 C ATOM 391 C ALA A 815 2.966 -14.863 7.758 1.00 41.15 C ATOM 392 O ALA A 815 2.885 -15.796 8.554 1.00 33.34 O ATOM 393 CB ALA A 815 3.599 -12.600 8.728 1.00 4.41 C ATOM 0 H ALA A 815 1.558 -14.285 9.840 1.00 24.41 H new ATOM 0 HA ALA A 815 2.127 -12.975 7.239 1.00 20.23 H new ATOM 0 HB1 ALA A 815 4.406 -12.511 8.001 1.00 4.41 H new ATOM 0 HB2 ALA A 815 3.209 -11.609 8.960 1.00 4.41 H new ATOM 0 HB3 ALA A 815 3.980 -13.062 9.638 1.00 4.41 H new ATOM 399 N LEU A 816 3.461 -14.963 6.533 1.00 71.05 N ATOM 400 CA LEU A 816 3.960 -16.231 6.028 1.00 20.13 C ATOM 401 C LEU A 816 4.726 -16.951 7.140 1.00 32.11 C ATOM 402 O LEU A 816 5.570 -16.353 7.805 1.00 11.24 O ATOM 403 CB LEU A 816 4.781 -16.016 4.756 1.00 45.43 C ATOM 404 CG LEU A 816 5.512 -17.245 4.213 1.00 71.55 C ATOM 405 CD1 LEU A 816 6.732 -17.583 5.072 1.00 15.13 C ATOM 406 CD2 LEU A 816 4.558 -18.435 4.078 1.00 5.54 C ATOM 0 H LEU A 816 3.527 -14.186 5.875 1.00 71.05 H new ATOM 0 HA LEU A 816 3.132 -16.878 5.739 1.00 20.13 H new ATOM 0 HB2 LEU A 816 4.117 -15.640 3.978 1.00 45.43 H new ATOM 0 HB3 LEU A 816 5.518 -15.236 4.950 1.00 45.43 H new ATOM 0 HG LEU A 816 5.878 -17.010 3.214 1.00 71.55 H new ATOM 0 HD11 LEU A 816 7.233 -18.461 4.663 1.00 15.13 H new ATOM 0 HD12 LEU A 816 7.422 -16.739 5.073 1.00 15.13 H new ATOM 0 HD13 LEU A 816 6.412 -17.791 6.093 1.00 15.13 H new ATOM 0 HD21 LEU A 816 5.103 -19.296 3.690 1.00 5.54 H new ATOM 0 HD22 LEU A 816 4.141 -18.680 5.055 1.00 5.54 H new ATOM 0 HD23 LEU A 816 3.750 -18.178 3.393 1.00 5.54 H new ATOM 418 N ALA A 817 4.404 -18.225 7.307 1.00 31.41 N ATOM 419 CA ALA A 817 5.051 -19.033 8.327 1.00 70.42 C ATOM 420 C ALA A 817 5.805 -20.184 7.657 1.00 2.21 C ATOM 421 O ALA A 817 6.969 -20.432 7.968 1.00 44.55 O ATOM 422 CB ALA A 817 4.004 -19.527 9.328 1.00 43.23 C ATOM 0 H ALA A 817 3.704 -18.718 6.753 1.00 31.41 H new ATOM 0 HA ALA A 817 5.778 -18.440 8.882 1.00 70.42 H new ATOM 0 HB1 ALA A 817 4.489 -20.133 10.093 1.00 43.23 H new ATOM 0 HB2 ALA A 817 3.517 -18.672 9.797 1.00 43.23 H new ATOM 0 HB3 ALA A 817 3.258 -20.128 8.808 1.00 43.23 H new ATOM 428 N CYS A 818 5.111 -20.856 6.751 1.00 70.02 N ATOM 429 CA CYS A 818 5.701 -21.974 6.035 1.00 74.44 C ATOM 430 C CYS A 818 4.704 -22.445 4.973 1.00 13.45 C ATOM 431 O CYS A 818 3.669 -21.813 4.765 1.00 1.34 O ATOM 432 CB CYS A 818 6.100 -23.106 6.983 1.00 24.14 C ATOM 433 SG CYS A 818 4.837 -23.300 8.293 1.00 4.15 S ATOM 0 H CYS A 818 4.146 -20.648 6.496 1.00 70.02 H new ATOM 0 HA CYS A 818 6.623 -21.652 5.550 1.00 74.44 H new ATOM 0 HB2 CYS A 818 6.205 -24.037 6.427 1.00 24.14 H new ATOM 0 HB3 CYS A 818 7.070 -22.891 7.431 1.00 24.14 H new ATOM 0 HG CYS A 818 5.401 -23.742 9.378 1.00 4.15 H new ATOM 439 N TYR A 819 5.050 -23.550 4.330 1.00 2.14 N ATOM 440 CA TYR A 819 4.199 -24.112 3.296 1.00 74.01 C ATOM 441 C TYR A 819 3.860 -25.573 3.598 1.00 24.32 C ATOM 442 O TYR A 819 4.684 -26.304 4.146 1.00 20.31 O ATOM 443 CB TYR A 819 5.010 -24.046 2.000 1.00 34.22 C ATOM 444 CG TYR A 819 5.221 -22.627 1.470 1.00 52.22 C ATOM 445 CD1 TYR A 819 6.275 -21.866 1.934 1.00 35.21 C ATOM 446 CD2 TYR A 819 4.357 -22.107 0.527 1.00 43.12 C ATOM 447 CE1 TYR A 819 6.473 -20.530 1.435 1.00 63.31 C ATOM 448 CE2 TYR A 819 4.556 -20.771 0.028 1.00 41.15 C ATOM 449 CZ TYR A 819 5.604 -20.049 0.506 1.00 2.52 C ATOM 450 OH TYR A 819 5.792 -18.787 0.035 1.00 51.23 O ATOM 0 H TYR A 819 5.909 -24.072 4.505 1.00 2.14 H new ATOM 0 HA TYR A 819 3.261 -23.561 3.230 1.00 74.01 H new ATOM 0 HB2 TYR A 819 5.983 -24.508 2.168 1.00 34.22 H new ATOM 0 HB3 TYR A 819 4.504 -24.637 1.236 1.00 34.22 H new ATOM 0 HD1 TYR A 819 6.951 -22.273 2.671 1.00 35.21 H new ATOM 0 HD2 TYR A 819 3.532 -22.702 0.164 1.00 43.12 H new ATOM 0 HE1 TYR A 819 7.293 -19.924 1.790 1.00 63.31 H new ATOM 0 HE2 TYR A 819 3.888 -20.352 -0.710 1.00 41.15 H new ATOM 0 HH TYR A 819 5.097 -18.577 -0.623 1.00 51.23 H new ATOM 460 N THR A 820 2.647 -25.955 3.228 1.00 60.32 N ATOM 461 CA THR A 820 2.190 -27.316 3.452 1.00 33.24 C ATOM 462 C THR A 820 3.082 -28.309 2.704 1.00 13.23 C ATOM 463 O THR A 820 3.193 -29.468 3.099 1.00 24.42 O ATOM 464 CB THR A 820 0.718 -27.394 3.043 1.00 14.20 C ATOM 465 OG1 THR A 820 0.167 -28.378 3.914 1.00 74.23 O ATOM 466 CG2 THR A 820 0.529 -27.986 1.645 1.00 41.32 C ATOM 0 H THR A 820 1.966 -25.346 2.774 1.00 60.32 H new ATOM 0 HA THR A 820 2.265 -27.590 4.504 1.00 33.24 H new ATOM 0 HB THR A 820 0.279 -26.397 3.077 1.00 14.20 H new ATOM 0 HG1 THR A 820 -0.679 -28.050 4.285 1.00 74.23 H new ATOM 0 HG21 THR A 820 -0.534 -28.019 1.404 1.00 41.32 H new ATOM 0 HG22 THR A 820 1.048 -27.366 0.914 1.00 41.32 H new ATOM 0 HG23 THR A 820 0.938 -28.996 1.619 1.00 41.32 H new ATOM 474 N ALA A 821 3.694 -27.817 1.637 1.00 30.22 N ATOM 475 CA ALA A 821 4.573 -28.647 0.830 1.00 13.41 C ATOM 476 C ALA A 821 5.828 -28.986 1.636 1.00 44.04 C ATOM 477 O ALA A 821 6.621 -29.834 1.229 1.00 74.41 O ATOM 478 CB ALA A 821 4.897 -27.924 -0.479 1.00 2.32 C ATOM 0 H ALA A 821 3.599 -26.855 1.312 1.00 30.22 H new ATOM 0 HA ALA A 821 4.084 -29.586 0.571 1.00 13.41 H new ATOM 0 HB1 ALA A 821 5.556 -28.546 -1.085 1.00 2.32 H new ATOM 0 HB2 ALA A 821 3.974 -27.732 -1.027 1.00 2.32 H new ATOM 0 HB3 ALA A 821 5.392 -26.978 -0.259 1.00 2.32 H new ATOM 484 N ASP A 822 5.971 -28.306 2.764 1.00 51.24 N ATOM 485 CA ASP A 822 7.117 -28.525 3.630 1.00 52.42 C ATOM 486 C ASP A 822 6.641 -29.121 4.956 1.00 5.02 C ATOM 487 O ASP A 822 7.405 -29.792 5.648 1.00 23.42 O ATOM 488 CB ASP A 822 7.836 -27.209 3.934 1.00 65.21 C ATOM 489 CG ASP A 822 8.220 -26.383 2.705 1.00 52.33 C ATOM 490 OD1 ASP A 822 7.453 -26.287 1.735 1.00 63.43 O ATOM 491 OD2 ASP A 822 9.376 -25.814 2.769 1.00 13.53 O ATOM 0 H ASP A 822 5.312 -27.603 3.098 1.00 51.24 H new ATOM 0 HA ASP A 822 7.803 -29.201 3.119 1.00 52.42 H new ATOM 0 HB2 ASP A 822 7.196 -26.603 4.575 1.00 65.21 H new ATOM 0 HB3 ASP A 822 8.740 -27.429 4.502 1.00 65.21 H new ATOM 497 N VAL A 823 5.382 -28.854 5.271 1.00 64.32 N ATOM 498 CA VAL A 823 4.796 -29.356 6.502 1.00 62.20 C ATOM 499 C VAL A 823 4.552 -30.861 6.369 1.00 0.31 C ATOM 500 O VAL A 823 3.763 -31.294 5.530 1.00 2.44 O ATOM 501 CB VAL A 823 3.526 -28.571 6.835 1.00 75.45 C ATOM 502 CG1 VAL A 823 2.295 -29.231 6.209 1.00 14.50 C ATOM 503 CG2 VAL A 823 3.356 -28.418 8.347 1.00 2.33 C ATOM 0 H VAL A 823 4.751 -28.296 4.695 1.00 64.32 H new ATOM 0 HA VAL A 823 5.480 -29.211 7.338 1.00 62.20 H new ATOM 0 HB VAL A 823 3.627 -27.574 6.407 1.00 75.45 H new ATOM 0 HG11 VAL A 823 1.405 -28.654 6.461 1.00 14.50 H new ATOM 0 HG12 VAL A 823 2.412 -29.265 5.126 1.00 14.50 H new ATOM 0 HG13 VAL A 823 2.190 -30.245 6.594 1.00 14.50 H new ATOM 0 HG21 VAL A 823 2.446 -27.856 8.556 1.00 2.33 H new ATOM 0 HG22 VAL A 823 3.288 -29.404 8.807 1.00 2.33 H new ATOM 0 HG23 VAL A 823 4.214 -27.885 8.757 1.00 2.33 H new ATOM 513 N ARG A 824 5.244 -31.617 7.209 1.00 15.53 N ATOM 514 CA ARG A 824 5.112 -33.064 7.196 1.00 13.53 C ATOM 515 C ARG A 824 4.951 -33.595 8.622 1.00 3.21 C ATOM 516 O ARG A 824 5.576 -33.086 9.552 1.00 74.02 O ATOM 517 CB ARG A 824 6.331 -33.722 6.548 1.00 4.24 C ATOM 518 CG ARG A 824 6.187 -33.765 5.026 1.00 43.43 C ATOM 519 CD ARG A 824 6.813 -32.526 4.381 1.00 62.42 C ATOM 520 NE ARG A 824 6.500 -32.496 2.935 1.00 54.33 N ATOM 521 CZ ARG A 824 7.256 -33.084 1.984 1.00 50.55 C ATOM 522 NH1 ARG A 824 8.379 -33.754 2.318 1.00 11.04 N ATOM 523 NH2 ARG A 824 6.881 -32.993 0.721 1.00 2.21 N ATOM 0 H ARG A 824 5.898 -31.255 7.903 1.00 15.53 H new ATOM 0 HA ARG A 824 4.226 -33.311 6.611 1.00 13.53 H new ATOM 0 HB2 ARG A 824 7.232 -33.170 6.816 1.00 4.24 H new ATOM 0 HB3 ARG A 824 6.450 -34.734 6.934 1.00 4.24 H new ATOM 0 HG2 ARG A 824 6.666 -34.663 4.637 1.00 43.43 H new ATOM 0 HG3 ARG A 824 5.132 -33.825 4.758 1.00 43.43 H new ATOM 0 HD2 ARG A 824 6.434 -31.624 4.862 1.00 62.42 H new ATOM 0 HD3 ARG A 824 7.893 -32.536 4.528 1.00 62.42 H new ATOM 0 HE ARG A 824 5.660 -32.000 2.638 1.00 54.33 H new ATOM 0 HH11 ARG A 824 8.662 -33.819 3.296 1.00 11.04 H new ATOM 0 HH12 ARG A 824 8.944 -34.195 1.593 1.00 11.04 H new ATOM 0 HH21 ARG A 824 6.031 -32.484 0.477 1.00 2.21 H new ATOM 0 HH22 ARG A 824 7.441 -33.432 -0.010 1.00 2.21 H new ATOM 536 N VAL A 825 4.111 -34.611 8.750 1.00 60.23 N ATOM 537 CA VAL A 825 3.861 -35.217 10.047 1.00 54.14 C ATOM 538 C VAL A 825 4.583 -36.564 10.124 1.00 54.44 C ATOM 539 O VAL A 825 4.632 -37.303 9.141 1.00 0.54 O ATOM 540 CB VAL A 825 2.354 -35.332 10.289 1.00 42.55 C ATOM 541 CG1 VAL A 825 1.786 -34.021 10.838 1.00 71.44 C ATOM 542 CG2 VAL A 825 1.624 -35.753 9.012 1.00 64.43 C ATOM 0 H VAL A 825 3.595 -35.030 7.977 1.00 60.23 H new ATOM 0 HA VAL A 825 4.258 -34.589 10.845 1.00 54.14 H new ATOM 0 HB VAL A 825 2.193 -36.107 11.038 1.00 42.55 H new ATOM 0 HG11 VAL A 825 0.714 -34.129 11.001 1.00 71.44 H new ATOM 0 HG12 VAL A 825 2.274 -33.780 11.782 1.00 71.44 H new ATOM 0 HG13 VAL A 825 1.965 -33.219 10.122 1.00 71.44 H new ATOM 0 HG21 VAL A 825 0.555 -35.827 9.212 1.00 64.43 H new ATOM 0 HG22 VAL A 825 1.797 -35.011 8.233 1.00 64.43 H new ATOM 0 HG23 VAL A 825 1.999 -36.721 8.681 1.00 64.43 H new ATOM 552 N ILE A 826 5.125 -36.842 11.300 1.00 13.11 N ATOM 553 CA ILE A 826 5.842 -38.087 11.518 1.00 12.31 C ATOM 554 C ILE A 826 4.836 -39.212 11.772 1.00 3.31 C ATOM 555 O ILE A 826 4.490 -39.493 12.919 1.00 44.35 O ATOM 556 CB ILE A 826 6.875 -37.922 12.634 1.00 12.55 C ATOM 557 CG1 ILE A 826 8.121 -37.195 12.125 1.00 64.21 C ATOM 558 CG2 ILE A 826 7.217 -39.271 13.269 1.00 31.10 C ATOM 559 CD1 ILE A 826 8.542 -36.085 13.090 1.00 22.22 C ATOM 0 H ILE A 826 5.082 -36.227 12.112 1.00 13.11 H new ATOM 0 HA ILE A 826 6.409 -38.361 10.628 1.00 12.31 H new ATOM 0 HB ILE A 826 6.437 -37.301 13.415 1.00 12.55 H new ATOM 0 HG12 ILE A 826 8.938 -37.907 12.005 1.00 64.21 H new ATOM 0 HG13 ILE A 826 7.922 -36.770 11.141 1.00 64.21 H new ATOM 0 HG21 ILE A 826 7.953 -39.125 14.059 1.00 31.10 H new ATOM 0 HG22 ILE A 826 6.315 -39.714 13.691 1.00 31.10 H new ATOM 0 HG23 ILE A 826 7.627 -39.937 12.510 1.00 31.10 H new ATOM 0 HD11 ILE A 826 9.430 -35.585 12.704 1.00 22.22 H new ATOM 0 HD12 ILE A 826 7.732 -35.362 13.189 1.00 22.22 H new ATOM 0 HD13 ILE A 826 8.764 -36.516 14.066 1.00 22.22 H new ATOM 571 N GLU A 827 4.396 -39.825 10.684 1.00 74.04 N ATOM 572 CA GLU A 827 3.437 -40.913 10.774 1.00 73.10 C ATOM 573 C GLU A 827 2.188 -40.459 11.533 1.00 43.30 C ATOM 574 O GLU A 827 1.483 -41.277 12.121 1.00 30.00 O ATOM 575 CB GLU A 827 4.063 -42.142 11.435 1.00 22.40 C ATOM 576 CG GLU A 827 5.529 -42.298 11.025 1.00 21.05 C ATOM 577 CD GLU A 827 6.044 -43.701 11.352 1.00 33.44 C ATOM 578 OE1 GLU A 827 5.294 -44.681 11.227 1.00 22.31 O ATOM 579 OE2 GLU A 827 7.270 -43.754 11.748 1.00 3.12 O ATOM 0 H GLU A 827 4.686 -39.589 9.735 1.00 74.04 H new ATOM 0 HA GLU A 827 3.142 -41.195 9.763 1.00 73.10 H new ATOM 0 HB2 GLU A 827 3.992 -42.052 12.519 1.00 22.40 H new ATOM 0 HB3 GLU A 827 3.506 -43.035 11.152 1.00 22.40 H new ATOM 0 HG2 GLU A 827 5.634 -42.108 9.957 1.00 21.05 H new ATOM 0 HG3 GLU A 827 6.136 -41.554 11.542 1.00 21.05 H new ATOM 587 N GLU A 828 1.954 -39.155 11.495 1.00 34.34 N ATOM 588 CA GLU A 828 0.803 -38.582 12.172 1.00 34.44 C ATOM 589 C GLU A 828 1.000 -38.632 13.689 1.00 51.31 C ATOM 590 O GLU A 828 0.085 -38.997 14.426 1.00 64.32 O ATOM 591 CB GLU A 828 -0.486 -39.298 11.764 1.00 73.23 C ATOM 592 CG GLU A 828 -0.509 -39.570 10.258 1.00 11.51 C ATOM 593 CD GLU A 828 -1.698 -40.455 9.878 1.00 23.05 C ATOM 594 OE1 GLU A 828 -2.812 -39.947 9.682 1.00 3.15 O ATOM 595 OE2 GLU A 828 -1.433 -41.714 9.788 1.00 24.30 O ATOM 0 H GLU A 828 2.542 -38.480 11.006 1.00 34.34 H new ATOM 0 HA GLU A 828 0.712 -37.539 11.871 1.00 34.44 H new ATOM 0 HB2 GLU A 828 -0.572 -40.238 12.308 1.00 73.23 H new ATOM 0 HB3 GLU A 828 -1.347 -38.690 12.041 1.00 73.23 H new ATOM 0 HG2 GLU A 828 -0.566 -38.626 9.715 1.00 11.51 H new ATOM 0 HG3 GLU A 828 0.420 -40.055 9.958 1.00 11.51 H new ATOM 603 N CYS A 829 2.199 -38.258 14.110 1.00 63.31 N ATOM 604 CA CYS A 829 2.528 -38.255 15.525 1.00 22.33 C ATOM 605 C CYS A 829 2.739 -36.806 15.967 1.00 54.45 C ATOM 606 O CYS A 829 2.344 -36.425 17.068 1.00 44.33 O ATOM 607 CB CYS A 829 3.751 -39.126 15.824 1.00 55.23 C ATOM 608 SG CYS A 829 3.483 -40.820 15.186 1.00 32.12 S ATOM 0 H CYS A 829 2.955 -37.955 13.496 1.00 63.31 H new ATOM 0 HA CYS A 829 1.705 -38.691 16.092 1.00 22.33 H new ATOM 0 HB2 CYS A 829 4.639 -38.691 15.364 1.00 55.23 H new ATOM 0 HB3 CYS A 829 3.932 -39.157 16.898 1.00 55.23 H new ATOM 0 HG CYS A 829 3.747 -40.851 13.913 1.00 32.12 H new ATOM 614 N HIS A 830 3.359 -36.036 15.084 1.00 23.24 N ATOM 615 CA HIS A 830 3.627 -34.637 15.369 1.00 12.32 C ATOM 616 C HIS A 830 3.655 -33.843 14.061 1.00 24.23 C ATOM 617 O HIS A 830 3.759 -34.423 12.981 1.00 5.24 O ATOM 618 CB HIS A 830 4.913 -34.484 16.184 1.00 60.25 C ATOM 619 CG HIS A 830 4.747 -34.779 17.655 1.00 14.33 C ATOM 620 ND1 HIS A 830 5.450 -35.779 18.304 1.00 52.12 N ATOM 621 CD2 HIS A 830 3.952 -34.194 18.597 1.00 52.11 C ATOM 622 CE1 HIS A 830 5.086 -35.787 19.578 1.00 71.33 C ATOM 623 NE2 HIS A 830 4.157 -34.805 19.757 1.00 1.33 N ATOM 0 H HIS A 830 3.683 -36.355 14.171 1.00 23.24 H new ATOM 0 HA HIS A 830 2.826 -34.228 15.985 1.00 12.32 H new ATOM 0 HB2 HIS A 830 5.672 -35.150 15.774 1.00 60.25 H new ATOM 0 HB3 HIS A 830 5.286 -33.466 16.068 1.00 60.25 H new ATOM 0 HD2 HIS A 830 3.271 -33.373 18.427 1.00 52.11 H new ATOM 0 HE1 HIS A 830 5.460 -36.454 20.341 1.00 71.33 H new ATOM 0 HE2 HIS A 830 3.696 -34.577 20.638 1.00 1.33 H new ATOM 631 N TYR A 831 3.561 -32.529 14.202 1.00 62.13 N ATOM 632 CA TYR A 831 3.575 -31.650 13.045 1.00 50.01 C ATOM 633 C TYR A 831 4.895 -30.882 12.955 1.00 25.32 C ATOM 634 O TYR A 831 5.286 -30.200 13.901 1.00 42.41 O ATOM 635 CB TYR A 831 2.433 -30.654 13.259 1.00 64.15 C ATOM 636 CG TYR A 831 1.072 -31.154 12.772 1.00 70.34 C ATOM 637 CD1 TYR A 831 0.770 -31.133 11.425 1.00 22.11 C ATOM 638 CD2 TYR A 831 0.146 -31.627 13.679 1.00 15.11 C ATOM 639 CE1 TYR A 831 -0.511 -31.604 10.967 1.00 52.11 C ATOM 640 CE2 TYR A 831 -1.136 -32.098 13.221 1.00 42.22 C ATOM 641 CZ TYR A 831 -1.401 -32.063 11.887 1.00 0.04 C ATOM 642 OH TYR A 831 -2.611 -32.508 11.455 1.00 52.44 O ATOM 0 H TYR A 831 3.475 -32.052 15.099 1.00 62.13 H new ATOM 0 HA TYR A 831 3.463 -32.224 12.125 1.00 50.01 H new ATOM 0 HB2 TYR A 831 2.364 -30.419 14.321 1.00 64.15 H new ATOM 0 HB3 TYR A 831 2.673 -29.725 12.742 1.00 64.15 H new ATOM 0 HD1 TYR A 831 1.495 -30.763 10.715 1.00 22.11 H new ATOM 0 HD2 TYR A 831 0.382 -31.644 14.733 1.00 15.11 H new ATOM 0 HE1 TYR A 831 -0.760 -31.593 9.916 1.00 52.11 H new ATOM 0 HE2 TYR A 831 -1.870 -32.470 13.920 1.00 42.22 H new ATOM 0 HH TYR A 831 -3.045 -33.021 12.169 1.00 52.44 H new ATOM 652 N THR A 832 5.547 -31.020 11.810 1.00 55.04 N ATOM 653 CA THR A 832 6.815 -30.348 11.584 1.00 11.11 C ATOM 654 C THR A 832 6.904 -29.847 10.141 1.00 12.34 C ATOM 655 O THR A 832 6.056 -30.175 9.313 1.00 60.31 O ATOM 656 CB THR A 832 7.937 -31.317 11.961 1.00 61.32 C ATOM 657 OG1 THR A 832 9.065 -30.843 11.231 1.00 61.25 O ATOM 658 CG2 THR A 832 7.703 -32.726 11.412 1.00 70.04 C ATOM 0 H THR A 832 5.220 -31.588 11.028 1.00 55.04 H new ATOM 0 HA THR A 832 6.909 -29.460 12.209 1.00 11.11 H new ATOM 0 HB THR A 832 8.029 -31.361 13.046 1.00 61.32 H new ATOM 0 HG1 THR A 832 9.885 -31.050 11.725 1.00 61.25 H new ATOM 0 HG21 THR A 832 8.528 -33.374 11.708 1.00 70.04 H new ATOM 0 HG22 THR A 832 6.769 -33.122 11.812 1.00 70.04 H new ATOM 0 HG23 THR A 832 7.644 -32.688 10.324 1.00 70.04 H new ATOM 666 N VAL A 833 7.938 -29.059 9.885 1.00 71.20 N ATOM 667 CA VAL A 833 8.149 -28.509 8.557 1.00 74.34 C ATOM 668 C VAL A 833 9.642 -28.548 8.224 1.00 34.12 C ATOM 669 O VAL A 833 10.483 -28.435 9.115 1.00 54.24 O ATOM 670 CB VAL A 833 7.554 -27.102 8.472 1.00 32.14 C ATOM 671 CG1 VAL A 833 7.278 -26.710 7.020 1.00 53.34 C ATOM 672 CG2 VAL A 833 6.286 -26.991 9.321 1.00 74.30 C ATOM 0 H VAL A 833 8.639 -28.788 10.575 1.00 71.20 H new ATOM 0 HA VAL A 833 7.633 -29.111 7.809 1.00 74.34 H new ATOM 0 HB VAL A 833 8.288 -26.403 8.873 1.00 32.14 H new ATOM 0 HG11 VAL A 833 6.856 -25.706 6.988 1.00 53.34 H new ATOM 0 HG12 VAL A 833 8.210 -26.730 6.454 1.00 53.34 H new ATOM 0 HG13 VAL A 833 6.572 -27.415 6.581 1.00 53.34 H new ATOM 0 HG21 VAL A 833 5.883 -25.981 9.243 1.00 74.30 H new ATOM 0 HG22 VAL A 833 5.545 -27.706 8.963 1.00 74.30 H new ATOM 0 HG23 VAL A 833 6.525 -27.207 10.362 1.00 74.30 H new ATOM 682 N LEU A 834 9.925 -28.709 6.940 1.00 3.20 N ATOM 683 CA LEU A 834 11.302 -28.764 6.479 1.00 61.00 C ATOM 684 C LEU A 834 11.640 -27.469 5.738 1.00 55.22 C ATOM 685 O LEU A 834 10.815 -26.559 5.663 1.00 31.21 O ATOM 686 CB LEU A 834 11.539 -30.027 5.649 1.00 71.22 C ATOM 687 CG LEU A 834 10.668 -31.235 6.002 1.00 52.35 C ATOM 688 CD1 LEU A 834 10.959 -32.412 5.068 1.00 14.34 C ATOM 689 CD2 LEU A 834 10.831 -31.617 7.474 1.00 13.20 C ATOM 0 H LEU A 834 9.225 -28.803 6.204 1.00 3.20 H new ATOM 0 HA LEU A 834 11.984 -28.834 7.326 1.00 61.00 H new ATOM 0 HB2 LEU A 834 11.379 -29.783 4.599 1.00 71.22 H new ATOM 0 HB3 LEU A 834 12.585 -30.315 5.753 1.00 71.22 H new ATOM 0 HG LEU A 834 9.624 -30.958 5.855 1.00 52.35 H new ATOM 0 HD11 LEU A 834 10.327 -33.257 5.340 1.00 14.34 H new ATOM 0 HD12 LEU A 834 10.751 -32.120 4.039 1.00 14.34 H new ATOM 0 HD13 LEU A 834 12.007 -32.698 5.159 1.00 14.34 H new ATOM 0 HD21 LEU A 834 10.201 -32.478 7.698 1.00 13.20 H new ATOM 0 HD22 LEU A 834 11.873 -31.868 7.671 1.00 13.20 H new ATOM 0 HD23 LEU A 834 10.535 -30.777 8.103 1.00 13.20 H new ATOM 701 N GLY A 835 12.853 -27.427 5.208 1.00 4.54 N ATOM 702 CA GLY A 835 13.310 -26.258 4.476 1.00 40.23 C ATOM 703 C GLY A 835 13.922 -25.222 5.421 1.00 33.24 C ATOM 704 O GLY A 835 13.238 -24.699 6.300 1.00 5.31 O ATOM 0 H GLY A 835 13.534 -28.184 5.271 1.00 4.54 H new ATOM 0 HA2 GLY A 835 14.048 -26.557 3.731 1.00 40.23 H new ATOM 0 HA3 GLY A 835 12.474 -25.813 3.936 1.00 40.23 H new ATOM 708 N ASP A 836 15.202 -24.958 5.209 1.00 5.51 N ATOM 709 CA ASP A 836 15.914 -23.994 6.032 1.00 51.13 C ATOM 710 C ASP A 836 15.152 -22.667 6.030 1.00 33.30 C ATOM 711 O ASP A 836 15.314 -21.853 6.938 1.00 51.15 O ATOM 712 CB ASP A 836 17.318 -23.733 5.484 1.00 44.20 C ATOM 713 CG ASP A 836 17.363 -23.018 4.132 1.00 13.52 C ATOM 714 OD1 ASP A 836 16.923 -23.560 3.108 1.00 72.33 O ATOM 715 OD2 ASP A 836 17.883 -21.837 4.157 1.00 73.22 O ATOM 0 H ASP A 836 15.765 -25.394 4.479 1.00 5.51 H new ATOM 0 HA ASP A 836 15.990 -24.402 7.040 1.00 51.13 H new ATOM 0 HB2 ASP A 836 17.870 -23.138 6.211 1.00 44.20 H new ATOM 0 HB3 ASP A 836 17.838 -24.686 5.391 1.00 44.20 H new ATOM 721 N ALA A 837 14.337 -22.491 5.001 1.00 75.15 N ATOM 722 CA ALA A 837 13.549 -21.277 4.869 1.00 73.32 C ATOM 723 C ALA A 837 12.678 -21.102 6.115 1.00 72.05 C ATOM 724 O ALA A 837 12.551 -19.996 6.637 1.00 2.31 O ATOM 725 CB ALA A 837 12.721 -21.342 3.583 1.00 24.45 C ATOM 0 H ALA A 837 14.205 -23.169 4.250 1.00 75.15 H new ATOM 0 HA ALA A 837 14.198 -20.404 4.795 1.00 73.32 H new ATOM 0 HB1 ALA A 837 12.130 -20.431 3.484 1.00 24.45 H new ATOM 0 HB2 ALA A 837 13.387 -21.437 2.726 1.00 24.45 H new ATOM 0 HB3 ALA A 837 12.055 -22.204 3.622 1.00 24.45 H new ATOM 731 N PHE A 838 12.100 -22.210 6.554 1.00 30.22 N ATOM 732 CA PHE A 838 11.245 -22.193 7.729 1.00 54.03 C ATOM 733 C PHE A 838 12.067 -22.359 9.008 1.00 32.23 C ATOM 734 O PHE A 838 11.546 -22.196 10.111 1.00 40.14 O ATOM 735 CB PHE A 838 10.282 -23.375 7.598 1.00 11.21 C ATOM 736 CG PHE A 838 9.661 -23.821 8.924 1.00 64.34 C ATOM 737 CD1 PHE A 838 8.713 -23.053 9.523 1.00 30.14 C ATOM 738 CD2 PHE A 838 10.058 -24.987 9.502 1.00 44.51 C ATOM 739 CE1 PHE A 838 8.137 -23.467 10.753 1.00 21.55 C ATOM 740 CE2 PHE A 838 9.483 -25.401 10.732 1.00 54.11 C ATOM 741 CZ PHE A 838 8.534 -24.633 11.332 1.00 41.32 C ATOM 0 H PHE A 838 12.207 -23.126 6.117 1.00 30.22 H new ATOM 0 HA PHE A 838 10.716 -21.242 7.791 1.00 54.03 H new ATOM 0 HB2 PHE A 838 9.483 -23.105 6.907 1.00 11.21 H new ATOM 0 HB3 PHE A 838 10.815 -24.217 7.156 1.00 11.21 H new ATOM 0 HD1 PHE A 838 8.398 -22.128 9.063 1.00 30.14 H new ATOM 0 HD2 PHE A 838 10.810 -25.597 9.025 1.00 44.51 H new ATOM 0 HE1 PHE A 838 7.384 -22.857 11.229 1.00 21.55 H new ATOM 0 HE2 PHE A 838 9.799 -26.326 11.192 1.00 54.11 H new ATOM 0 HZ PHE A 838 8.096 -24.948 12.267 1.00 41.32 H new ATOM 751 N LYS A 839 13.338 -22.682 8.819 1.00 11.32 N ATOM 752 CA LYS A 839 14.237 -22.872 9.945 1.00 42.24 C ATOM 753 C LYS A 839 14.778 -21.513 10.395 1.00 35.11 C ATOM 754 O LYS A 839 15.312 -21.388 11.496 1.00 51.31 O ATOM 755 CB LYS A 839 15.331 -23.882 9.592 1.00 74.21 C ATOM 756 CG LYS A 839 14.724 -25.225 9.179 1.00 51.21 C ATOM 757 CD LYS A 839 15.818 -26.248 8.867 1.00 52.13 C ATOM 758 CE LYS A 839 15.294 -27.345 7.938 1.00 54.22 C ATOM 759 NZ LYS A 839 14.621 -28.407 8.718 1.00 23.45 N ATOM 0 H LYS A 839 13.767 -22.817 7.903 1.00 11.32 H new ATOM 0 HA LYS A 839 13.701 -23.299 10.793 1.00 42.24 H new ATOM 0 HB2 LYS A 839 15.944 -23.491 8.780 1.00 74.21 H new ATOM 0 HB3 LYS A 839 15.990 -24.024 10.449 1.00 74.21 H new ATOM 0 HG2 LYS A 839 14.087 -25.601 9.979 1.00 51.21 H new ATOM 0 HG3 LYS A 839 14.089 -25.088 8.304 1.00 51.21 H new ATOM 0 HD2 LYS A 839 16.667 -25.747 8.402 1.00 52.13 H new ATOM 0 HD3 LYS A 839 16.179 -26.693 9.794 1.00 52.13 H new ATOM 0 HE2 LYS A 839 14.597 -26.917 7.218 1.00 54.22 H new ATOM 0 HE3 LYS A 839 16.119 -27.772 7.368 1.00 54.22 H new ATOM 0 HZ1 LYS A 839 14.271 -29.143 8.072 1.00 23.45 H new ATOM 0 HZ2 LYS A 839 15.297 -28.826 9.388 1.00 23.45 H new ATOM 0 HZ3 LYS A 839 13.821 -27.999 9.243 1.00 23.45 H new ATOM 772 N GLU A 840 14.620 -20.530 9.521 1.00 14.02 N ATOM 773 CA GLU A 840 15.085 -19.185 9.815 1.00 31.23 C ATOM 774 C GLU A 840 13.916 -18.304 10.259 1.00 75.01 C ATOM 775 O GLU A 840 14.117 -17.279 10.908 1.00 24.13 O ATOM 776 CB GLU A 840 15.803 -18.577 8.609 1.00 73.23 C ATOM 777 CG GLU A 840 14.882 -18.534 7.387 1.00 31.05 C ATOM 778 CD GLU A 840 15.303 -17.423 6.423 1.00 75.42 C ATOM 779 OE1 GLU A 840 16.438 -17.433 5.924 1.00 54.23 O ATOM 780 OE2 GLU A 840 14.402 -16.528 6.196 1.00 72.31 O ATOM 0 H GLU A 840 14.176 -20.638 8.609 1.00 14.02 H new ATOM 0 HA GLU A 840 15.803 -19.241 10.633 1.00 31.23 H new ATOM 0 HB2 GLU A 840 16.139 -17.569 8.851 1.00 73.23 H new ATOM 0 HB3 GLU A 840 16.693 -19.162 8.378 1.00 73.23 H new ATOM 0 HG2 GLU A 840 14.908 -19.495 6.874 1.00 31.05 H new ATOM 0 HG3 GLU A 840 13.853 -18.372 7.708 1.00 31.05 H new ATOM 788 N CYS A 841 12.718 -18.735 9.891 1.00 61.35 N ATOM 789 CA CYS A 841 11.516 -17.998 10.242 1.00 23.34 C ATOM 790 C CYS A 841 11.318 -18.098 11.756 1.00 13.21 C ATOM 791 O CYS A 841 10.770 -17.187 12.375 1.00 12.10 O ATOM 792 CB CYS A 841 10.296 -18.506 9.472 1.00 13.20 C ATOM 793 SG CYS A 841 9.714 -20.085 10.192 1.00 54.54 S ATOM 0 H CYS A 841 12.554 -19.586 9.353 1.00 61.35 H new ATOM 0 HA CYS A 841 11.631 -16.952 9.959 1.00 23.34 H new ATOM 0 HB2 CYS A 841 9.498 -17.764 9.508 1.00 13.20 H new ATOM 0 HB3 CYS A 841 10.552 -18.648 8.422 1.00 13.20 H new ATOM 0 HG CYS A 841 10.726 -20.882 10.365 1.00 54.54 H new ATOM 799 N PHE A 842 11.774 -19.212 12.309 1.00 70.13 N ATOM 800 CA PHE A 842 11.653 -19.442 13.738 1.00 23.43 C ATOM 801 C PHE A 842 13.012 -19.315 14.431 1.00 54.21 C ATOM 802 O PHE A 842 13.984 -18.873 13.821 1.00 2.21 O ATOM 803 CB PHE A 842 11.134 -20.870 13.919 1.00 22.21 C ATOM 804 CG PHE A 842 12.237 -21.914 14.110 1.00 52.32 C ATOM 805 CD1 PHE A 842 13.064 -22.225 13.076 1.00 22.44 C ATOM 806 CD2 PHE A 842 12.390 -22.529 15.313 1.00 74.52 C ATOM 807 CE1 PHE A 842 14.088 -23.194 13.253 1.00 14.25 C ATOM 808 CE2 PHE A 842 13.413 -23.498 15.490 1.00 51.22 C ATOM 809 CZ PHE A 842 14.240 -23.810 14.457 1.00 43.45 C ATOM 0 H PHE A 842 12.228 -19.965 11.793 1.00 70.13 H new ATOM 0 HA PHE A 842 10.980 -18.705 14.177 1.00 23.43 H new ATOM 0 HB2 PHE A 842 10.469 -20.897 14.782 1.00 22.21 H new ATOM 0 HB3 PHE A 842 10.537 -21.142 13.048 1.00 22.21 H new ATOM 0 HD1 PHE A 842 12.942 -21.736 12.121 1.00 22.44 H new ATOM 0 HD2 PHE A 842 11.734 -22.281 16.134 1.00 74.52 H new ATOM 0 HE1 PHE A 842 14.745 -23.442 12.433 1.00 14.25 H new ATOM 0 HE2 PHE A 842 13.534 -23.987 16.445 1.00 51.22 H new ATOM 0 HZ PHE A 842 15.018 -24.547 14.592 1.00 43.45 H new ATOM 819 N VAL A 843 13.035 -19.710 15.695 1.00 12.33 N ATOM 820 CA VAL A 843 14.258 -19.645 16.477 1.00 33.04 C ATOM 821 C VAL A 843 14.243 -20.754 17.531 1.00 25.30 C ATOM 822 O VAL A 843 13.186 -21.293 17.857 1.00 45.54 O ATOM 823 CB VAL A 843 14.419 -18.249 17.082 1.00 43.45 C ATOM 824 CG1 VAL A 843 14.270 -17.167 16.010 1.00 41.01 C ATOM 825 CG2 VAL A 843 13.427 -18.028 18.225 1.00 23.03 C ATOM 0 H VAL A 843 12.226 -20.076 16.197 1.00 12.33 H new ATOM 0 HA VAL A 843 15.127 -19.811 15.841 1.00 33.04 H new ATOM 0 HB VAL A 843 15.425 -18.177 17.494 1.00 43.45 H new ATOM 0 HG11 VAL A 843 14.389 -16.184 16.466 1.00 41.01 H new ATOM 0 HG12 VAL A 843 15.033 -17.306 15.244 1.00 41.01 H new ATOM 0 HG13 VAL A 843 13.282 -17.239 15.555 1.00 41.01 H new ATOM 0 HG21 VAL A 843 13.563 -17.028 18.637 1.00 23.03 H new ATOM 0 HG22 VAL A 843 12.409 -18.130 17.848 1.00 23.03 H new ATOM 0 HG23 VAL A 843 13.601 -18.769 19.006 1.00 23.03 H new ATOM 835 N SER A 844 15.429 -21.063 18.035 1.00 63.32 N ATOM 836 CA SER A 844 15.566 -22.099 19.045 1.00 45.31 C ATOM 837 C SER A 844 16.610 -21.682 20.083 1.00 1.22 C ATOM 838 O SER A 844 17.758 -21.404 19.738 1.00 14.23 O ATOM 839 CB SER A 844 15.952 -23.437 18.413 1.00 63.35 C ATOM 840 OG SER A 844 17.364 -23.578 18.279 1.00 2.51 O ATOM 0 H SER A 844 16.304 -20.614 17.763 1.00 63.32 H new ATOM 0 HA SER A 844 14.602 -22.226 19.538 1.00 45.31 H new ATOM 0 HB2 SER A 844 15.563 -24.252 19.024 1.00 63.35 H new ATOM 0 HB3 SER A 844 15.485 -23.523 17.432 1.00 63.35 H new ATOM 0 HG SER A 844 17.804 -22.747 18.557 1.00 2.51 H new ATOM 846 N ARG A 845 16.174 -21.651 21.334 1.00 23.40 N ATOM 847 CA ARG A 845 17.056 -21.273 22.425 1.00 64.10 C ATOM 848 C ARG A 845 17.286 -22.463 23.359 1.00 14.13 C ATOM 849 O ARG A 845 16.456 -23.368 23.433 1.00 52.13 O ATOM 850 CB ARG A 845 16.472 -20.109 23.227 1.00 2.31 C ATOM 851 CG ARG A 845 15.618 -19.204 22.337 1.00 14.11 C ATOM 852 CD ARG A 845 16.441 -18.639 21.178 1.00 62.11 C ATOM 853 NE ARG A 845 17.213 -17.461 21.632 1.00 24.24 N ATOM 854 CZ ARG A 845 18.058 -16.761 20.846 1.00 10.52 C ATOM 855 NH1 ARG A 845 18.246 -17.114 19.557 1.00 24.20 N ATOM 856 NH2 ARG A 845 18.697 -15.725 21.357 1.00 51.51 N ATOM 0 H ARG A 845 15.221 -21.882 21.616 1.00 23.40 H new ATOM 0 HA ARG A 845 18.005 -20.960 21.990 1.00 64.10 H new ATOM 0 HB2 ARG A 845 15.866 -20.495 24.047 1.00 2.31 H new ATOM 0 HB3 ARG A 845 17.280 -19.529 23.673 1.00 2.31 H new ATOM 0 HG2 ARG A 845 14.771 -19.768 21.945 1.00 14.11 H new ATOM 0 HG3 ARG A 845 15.209 -18.386 22.930 1.00 14.11 H new ATOM 0 HD2 ARG A 845 17.118 -19.403 20.796 1.00 62.11 H new ATOM 0 HD3 ARG A 845 15.782 -18.358 20.357 1.00 62.11 H new ATOM 0 HE ARG A 845 17.099 -17.159 22.600 1.00 24.24 H new ATOM 0 HH11 ARG A 845 17.748 -17.915 19.170 1.00 24.20 H new ATOM 0 HH12 ARG A 845 18.886 -16.579 18.970 1.00 24.20 H new ATOM 0 HH21 ARG A 845 18.549 -15.464 22.332 1.00 51.51 H new ATOM 0 HH22 ARG A 845 19.339 -15.185 20.777 1.00 51.51 H new ATOM 869 N PRO A 846 18.445 -22.422 24.068 1.00 4.12 N ATOM 870 CA PRO A 846 18.794 -23.485 24.995 1.00 62.53 C ATOM 871 C PRO A 846 17.966 -23.389 26.278 1.00 41.53 C ATOM 872 O PRO A 846 17.331 -22.367 26.535 1.00 73.20 O ATOM 873 CB PRO A 846 20.286 -23.323 25.237 1.00 51.12 C ATOM 874 CG PRO A 846 20.626 -21.904 24.809 1.00 75.54 C ATOM 875 CD PRO A 846 19.452 -21.366 24.007 1.00 71.02 C ATOM 0 HA PRO A 846 18.574 -24.476 24.599 1.00 62.53 H new ATOM 0 HB2 PRO A 846 20.531 -23.484 26.287 1.00 51.12 H new ATOM 0 HB3 PRO A 846 20.856 -24.052 24.661 1.00 51.12 H new ATOM 0 HG2 PRO A 846 20.813 -21.277 25.681 1.00 75.54 H new ATOM 0 HG3 PRO A 846 21.536 -21.894 24.208 1.00 75.54 H new ATOM 0 HD2 PRO A 846 19.076 -20.435 24.432 1.00 71.02 H new ATOM 0 HD3 PRO A 846 19.740 -21.153 22.978 1.00 71.02 H new ATOM 1029 N PHE A 856 8.091 -37.346 24.849 1.00 64.13 N ATOM 1030 CA PHE A 856 9.398 -37.032 24.297 1.00 25.31 C ATOM 1031 C PHE A 856 10.197 -36.142 25.251 1.00 11.42 C ATOM 1032 O PHE A 856 9.671 -35.682 26.264 1.00 72.24 O ATOM 1033 CB PHE A 856 9.162 -36.275 22.989 1.00 12.21 C ATOM 1034 CG PHE A 856 9.065 -37.176 21.757 1.00 75.43 C ATOM 1035 CD1 PHE A 856 9.930 -38.214 21.603 1.00 21.13 C ATOM 1036 CD2 PHE A 856 8.112 -36.940 20.815 1.00 64.13 C ATOM 1037 CE1 PHE A 856 9.840 -39.051 20.460 1.00 52.14 C ATOM 1038 CE2 PHE A 856 8.022 -37.777 19.671 1.00 1.21 C ATOM 1039 CZ PHE A 856 8.888 -38.815 19.518 1.00 54.44 C ATOM 0 HA PHE A 856 9.965 -37.950 24.139 1.00 25.31 H new ATOM 0 HB2 PHE A 856 8.242 -35.697 23.077 1.00 12.21 H new ATOM 0 HB3 PHE A 856 9.974 -35.562 22.842 1.00 12.21 H new ATOM 0 HD1 PHE A 856 10.686 -38.402 22.351 1.00 21.13 H new ATOM 0 HD2 PHE A 856 7.424 -36.116 20.937 1.00 64.13 H new ATOM 0 HE1 PHE A 856 10.527 -39.875 20.339 1.00 52.14 H new ATOM 0 HE2 PHE A 856 7.266 -37.589 18.923 1.00 1.21 H new ATOM 0 HZ PHE A 856 8.819 -39.452 18.648 1.00 54.44 H new ATOM 1049 N GLU A 857 11.454 -35.925 24.894 1.00 2.53 N ATOM 1050 CA GLU A 857 12.330 -35.097 25.706 1.00 24.11 C ATOM 1051 C GLU A 857 12.528 -33.730 25.049 1.00 10.50 C ATOM 1052 O GLU A 857 12.854 -33.647 23.866 1.00 52.32 O ATOM 1053 CB GLU A 857 13.673 -35.790 25.944 1.00 24.12 C ATOM 1054 CG GLU A 857 13.471 -37.221 26.447 1.00 53.13 C ATOM 1055 CD GLU A 857 14.753 -37.767 27.077 1.00 21.44 C ATOM 1056 OE1 GLU A 857 15.180 -38.883 26.746 1.00 20.53 O ATOM 1057 OE2 GLU A 857 15.312 -36.988 27.940 1.00 14.41 O ATOM 0 H GLU A 857 11.887 -36.308 24.054 1.00 2.53 H new ATOM 0 HA GLU A 857 11.858 -34.947 26.677 1.00 24.11 H new ATOM 0 HB2 GLU A 857 14.248 -35.804 25.018 1.00 24.12 H new ATOM 0 HB3 GLU A 857 14.254 -35.224 26.672 1.00 24.12 H new ATOM 0 HG2 GLU A 857 12.664 -37.242 27.179 1.00 53.13 H new ATOM 0 HG3 GLU A 857 13.167 -37.862 25.619 1.00 53.13 H new ATOM 1065 N LYS A 858 12.322 -32.691 25.845 1.00 4.23 N ATOM 1066 CA LYS A 858 12.474 -31.331 25.356 1.00 71.02 C ATOM 1067 C LYS A 858 13.319 -30.528 26.347 1.00 61.13 C ATOM 1068 O LYS A 858 13.009 -30.480 27.536 1.00 22.11 O ATOM 1069 CB LYS A 858 11.106 -30.709 25.069 1.00 34.25 C ATOM 1070 CG LYS A 858 10.427 -30.256 26.364 1.00 24.11 C ATOM 1071 CD LYS A 858 8.916 -30.117 26.172 1.00 50.14 C ATOM 1072 CE LYS A 858 8.233 -29.704 27.477 1.00 51.22 C ATOM 1073 NZ LYS A 858 8.435 -30.737 28.517 1.00 3.12 N ATOM 0 H LYS A 858 12.051 -32.764 26.826 1.00 4.23 H new ATOM 0 HA LYS A 858 13.007 -31.326 24.405 1.00 71.02 H new ATOM 0 HB2 LYS A 858 11.223 -29.858 24.398 1.00 34.25 H new ATOM 0 HB3 LYS A 858 10.473 -31.434 24.557 1.00 34.25 H new ATOM 0 HG2 LYS A 858 10.632 -30.975 27.157 1.00 24.11 H new ATOM 0 HG3 LYS A 858 10.846 -29.302 26.684 1.00 24.11 H new ATOM 0 HD2 LYS A 858 8.711 -29.376 25.400 1.00 50.14 H new ATOM 0 HD3 LYS A 858 8.501 -31.063 25.824 1.00 50.14 H new ATOM 0 HE2 LYS A 858 8.636 -28.751 27.820 1.00 51.22 H new ATOM 0 HE3 LYS A 858 7.167 -29.556 27.305 1.00 51.22 H new ATOM 0 HZ1 LYS A 858 7.747 -30.596 29.284 1.00 3.12 H new ATOM 0 HZ2 LYS A 858 8.300 -31.680 28.100 1.00 3.12 H new ATOM 0 HZ3 LYS A 858 9.400 -30.662 28.898 1.00 3.12 H new ATOM 1086 N ARG A 859 14.370 -29.917 25.820 1.00 62.52 N ATOM 1087 CA ARG A 859 15.262 -29.119 26.643 1.00 24.01 C ATOM 1088 C ARG A 859 15.528 -27.766 25.980 1.00 64.23 C ATOM 1089 O ARG A 859 16.568 -27.151 26.211 1.00 22.21 O ATOM 1090 CB ARG A 859 16.593 -29.838 26.870 1.00 24.44 C ATOM 1091 CG ARG A 859 16.432 -30.989 27.866 1.00 73.12 C ATOM 1092 CD ARG A 859 17.449 -32.098 27.591 1.00 22.45 C ATOM 1093 NE ARG A 859 18.711 -31.514 27.086 1.00 42.24 N ATOM 1094 CZ ARG A 859 19.657 -30.958 27.873 1.00 53.23 C ATOM 1095 NH1 ARG A 859 19.490 -30.906 29.211 1.00 23.14 N ATOM 1096 NH2 ARG A 859 20.746 -30.465 27.314 1.00 63.34 N ATOM 0 H ARG A 859 14.624 -29.959 24.833 1.00 62.52 H new ATOM 0 HA ARG A 859 14.776 -28.966 27.606 1.00 24.01 H new ATOM 0 HB2 ARG A 859 16.969 -30.223 25.922 1.00 24.44 H new ATOM 0 HB3 ARG A 859 17.334 -29.131 27.243 1.00 24.44 H new ATOM 0 HG2 ARG A 859 16.561 -30.616 28.882 1.00 73.12 H new ATOM 0 HG3 ARG A 859 15.422 -31.393 27.800 1.00 73.12 H new ATOM 0 HD2 ARG A 859 17.640 -32.662 28.504 1.00 22.45 H new ATOM 0 HD3 ARG A 859 17.046 -32.800 26.861 1.00 22.45 H new ATOM 0 HE ARG A 859 18.877 -31.533 26.080 1.00 42.24 H new ATOM 0 HH11 ARG A 859 18.645 -31.288 29.635 1.00 23.14 H new ATOM 0 HH12 ARG A 859 20.209 -30.484 29.799 1.00 23.14 H new ATOM 0 HH21 ARG A 859 20.864 -30.507 26.302 1.00 63.34 H new ATOM 0 HH22 ARG A 859 21.470 -30.042 27.894 1.00 63.34 H new ATOM 1109 N ALA A 860 14.571 -27.343 25.168 1.00 12.40 N ATOM 1110 CA ALA A 860 14.689 -26.074 24.469 1.00 13.15 C ATOM 1111 C ALA A 860 13.296 -25.594 24.055 1.00 44.23 C ATOM 1112 O ALA A 860 12.394 -26.403 23.845 1.00 51.21 O ATOM 1113 CB ALA A 860 15.630 -26.235 23.274 1.00 1.32 C ATOM 0 H ALA A 860 13.710 -27.856 24.978 1.00 12.40 H new ATOM 0 HA ALA A 860 15.119 -25.314 25.122 1.00 13.15 H new ATOM 0 HB1 ALA A 860 15.718 -25.283 22.750 1.00 1.32 H new ATOM 0 HB2 ALA A 860 16.613 -26.549 23.625 1.00 1.32 H new ATOM 0 HB3 ALA A 860 15.230 -26.988 22.595 1.00 1.32 H new ATOM 1119 N LYS A 861 13.166 -24.280 23.949 1.00 51.43 N ATOM 1120 CA LYS A 861 11.899 -23.682 23.563 1.00 71.13 C ATOM 1121 C LYS A 861 12.085 -22.896 22.263 1.00 24.23 C ATOM 1122 O LYS A 861 12.879 -21.958 22.210 1.00 55.52 O ATOM 1123 CB LYS A 861 11.329 -22.846 24.711 1.00 71.35 C ATOM 1124 CG LYS A 861 10.516 -23.716 25.671 1.00 34.31 C ATOM 1125 CD LYS A 861 11.403 -24.288 26.778 1.00 25.31 C ATOM 1126 CE LYS A 861 11.697 -23.233 27.846 1.00 44.54 C ATOM 1127 NZ LYS A 861 12.598 -23.782 28.884 1.00 40.13 N ATOM 0 H LYS A 861 13.917 -23.612 24.124 1.00 51.43 H new ATOM 0 HA LYS A 861 11.158 -24.456 23.364 1.00 71.13 H new ATOM 0 HB2 LYS A 861 12.142 -22.363 25.252 1.00 71.35 H new ATOM 0 HB3 LYS A 861 10.698 -22.053 24.310 1.00 71.35 H new ATOM 0 HG2 LYS A 861 9.714 -23.125 26.112 1.00 34.31 H new ATOM 0 HG3 LYS A 861 10.046 -24.530 25.120 1.00 34.31 H new ATOM 0 HD2 LYS A 861 10.911 -25.146 27.236 1.00 25.31 H new ATOM 0 HD3 LYS A 861 12.339 -24.647 26.350 1.00 25.31 H new ATOM 0 HE2 LYS A 861 12.155 -22.358 27.385 1.00 44.54 H new ATOM 0 HE3 LYS A 861 10.765 -22.901 28.304 1.00 44.54 H new ATOM 0 HZ1 LYS A 861 12.787 -23.053 29.601 1.00 40.13 H new ATOM 0 HZ2 LYS A 861 12.147 -24.603 29.336 1.00 40.13 H new ATOM 0 HZ3 LYS A 861 13.494 -24.077 28.446 1.00 40.13 H new ATOM 1140 N ILE A 862 11.341 -23.309 21.248 1.00 44.23 N ATOM 1141 CA ILE A 862 11.415 -22.655 19.952 1.00 32.10 C ATOM 1142 C ILE A 862 10.447 -21.470 19.928 1.00 64.10 C ATOM 1143 O ILE A 862 9.329 -21.567 20.431 1.00 2.31 O ATOM 1144 CB ILE A 862 11.178 -23.666 18.828 1.00 54.41 C ATOM 1145 CG1 ILE A 862 9.684 -23.949 18.652 1.00 64.50 C ATOM 1146 CG2 ILE A 862 11.981 -24.946 19.063 1.00 32.45 C ATOM 1147 CD1 ILE A 862 9.063 -23.000 17.626 1.00 40.03 C ATOM 0 H ILE A 862 10.684 -24.088 21.296 1.00 44.23 H new ATOM 0 HA ILE A 862 12.414 -22.254 19.783 1.00 32.10 H new ATOM 0 HB ILE A 862 11.535 -23.230 17.895 1.00 54.41 H new ATOM 0 HG12 ILE A 862 9.541 -24.981 18.331 1.00 64.50 H new ATOM 0 HG13 ILE A 862 9.174 -23.839 19.609 1.00 64.50 H new ATOM 0 HG21 ILE A 862 11.794 -25.647 18.250 1.00 32.45 H new ATOM 0 HG22 ILE A 862 13.044 -24.707 19.099 1.00 32.45 H new ATOM 0 HG23 ILE A 862 11.678 -25.397 20.008 1.00 32.45 H new ATOM 0 HD11 ILE A 862 8.001 -23.223 17.520 1.00 40.03 H new ATOM 0 HD12 ILE A 862 9.186 -21.970 17.962 1.00 40.03 H new ATOM 0 HD13 ILE A 862 9.559 -23.130 16.664 1.00 40.03 H new ATOM 1159 N PHE A 863 10.913 -20.379 19.338 1.00 1.00 N ATOM 1160 CA PHE A 863 10.103 -19.176 19.242 1.00 61.52 C ATOM 1161 C PHE A 863 10.148 -18.597 17.826 1.00 34.23 C ATOM 1162 O PHE A 863 10.875 -19.098 16.970 1.00 55.35 O ATOM 1163 CB PHE A 863 10.698 -18.158 20.216 1.00 14.40 C ATOM 1164 CG PHE A 863 10.977 -18.720 21.611 1.00 32.32 C ATOM 1165 CD1 PHE A 863 9.943 -19.049 22.431 1.00 31.12 C ATOM 1166 CD2 PHE A 863 12.259 -18.892 22.031 1.00 10.43 C ATOM 1167 CE1 PHE A 863 10.202 -19.571 23.726 1.00 20.31 C ATOM 1168 CE2 PHE A 863 12.518 -19.414 23.326 1.00 1.20 C ATOM 1169 CZ PHE A 863 11.484 -19.743 24.146 1.00 2.31 C ATOM 0 H PHE A 863 11.841 -20.303 18.922 1.00 1.00 H new ATOM 0 HA PHE A 863 9.064 -19.406 19.479 1.00 61.52 H new ATOM 0 HB2 PHE A 863 11.628 -17.772 19.799 1.00 14.40 H new ATOM 0 HB3 PHE A 863 10.014 -17.314 20.306 1.00 14.40 H new ATOM 0 HD1 PHE A 863 8.925 -18.913 22.097 1.00 31.12 H new ATOM 0 HD2 PHE A 863 13.080 -18.632 21.380 1.00 10.43 H new ATOM 0 HE1 PHE A 863 9.381 -19.831 24.377 1.00 20.31 H new ATOM 0 HE2 PHE A 863 13.536 -19.550 23.660 1.00 1.20 H new ATOM 0 HZ PHE A 863 11.681 -20.141 25.131 1.00 2.31 H new ATOM 1179 N CYS A 864 9.361 -17.550 17.625 1.00 70.32 N ATOM 1180 CA CYS A 864 9.301 -16.898 16.328 1.00 45.50 C ATOM 1181 C CYS A 864 10.540 -16.011 16.179 1.00 33.30 C ATOM 1182 O CYS A 864 10.986 -15.395 17.145 1.00 0.14 O ATOM 1183 CB CYS A 864 8.006 -16.102 16.154 1.00 60.20 C ATOM 1184 SG CYS A 864 8.087 -14.554 17.125 1.00 3.55 S ATOM 0 H CYS A 864 8.760 -17.137 18.338 1.00 70.32 H new ATOM 0 HA CYS A 864 9.296 -17.651 15.540 1.00 45.50 H new ATOM 0 HB2 CYS A 864 7.850 -15.872 15.100 1.00 60.20 H new ATOM 0 HB3 CYS A 864 7.155 -16.701 16.479 1.00 60.20 H new ATOM 0 HG CYS A 864 9.308 -14.357 17.527 1.00 3.55 H new ATOM 1190 N ALA A 865 11.059 -15.976 14.961 1.00 45.41 N ATOM 1191 CA ALA A 865 12.237 -15.175 14.673 1.00 4.00 C ATOM 1192 C ALA A 865 11.822 -13.714 14.484 1.00 24.53 C ATOM 1193 O ALA A 865 12.664 -12.818 14.515 1.00 55.50 O ATOM 1194 CB ALA A 865 12.952 -15.741 13.445 1.00 62.54 C ATOM 0 H ALA A 865 10.686 -16.489 14.162 1.00 45.41 H new ATOM 0 HA ALA A 865 12.939 -15.213 15.506 1.00 4.00 H new ATOM 0 HB1 ALA A 865 13.835 -15.140 13.229 1.00 62.54 H new ATOM 0 HB2 ALA A 865 13.252 -16.770 13.641 1.00 62.54 H new ATOM 0 HB3 ALA A 865 12.278 -15.717 12.588 1.00 62.54 H new ATOM 1200 N ARG A 866 10.526 -13.521 14.293 1.00 33.12 N ATOM 1201 CA ARG A 866 9.989 -12.185 14.099 1.00 11.25 C ATOM 1202 C ARG A 866 10.441 -11.262 15.233 1.00 14.20 C ATOM 1203 O ARG A 866 11.183 -11.680 16.120 1.00 44.21 O ATOM 1204 CB ARG A 866 8.460 -12.208 14.048 1.00 10.42 C ATOM 1205 CG ARG A 866 7.964 -12.747 12.705 1.00 44.33 C ATOM 1206 CD ARG A 866 8.054 -11.675 11.617 1.00 45.51 C ATOM 1207 NE ARG A 866 8.179 -12.312 10.287 1.00 31.11 N ATOM 1208 CZ ARG A 866 8.362 -11.632 9.136 1.00 42.44 C ATOM 1209 NH1 ARG A 866 8.444 -10.284 9.142 1.00 71.13 N ATOM 1210 NH2 ARG A 866 8.460 -12.304 8.004 1.00 40.53 N ATOM 0 H ARG A 866 9.831 -14.268 14.268 1.00 33.12 H new ATOM 0 HA ARG A 866 10.367 -11.810 13.148 1.00 11.25 H new ATOM 0 HB2 ARG A 866 8.075 -12.828 14.857 1.00 10.42 H new ATOM 0 HB3 ARG A 866 8.072 -11.202 14.206 1.00 10.42 H new ATOM 0 HG2 ARG A 866 8.557 -13.614 12.416 1.00 44.33 H new ATOM 0 HG3 ARG A 866 6.932 -13.085 12.803 1.00 44.33 H new ATOM 0 HD2 ARG A 866 7.167 -11.042 11.644 1.00 45.51 H new ATOM 0 HD3 ARG A 866 8.912 -11.029 11.802 1.00 45.51 H new ATOM 0 HE ARG A 866 8.123 -13.329 10.237 1.00 31.11 H new ATOM 0 HH11 ARG A 866 8.368 -9.772 10.021 1.00 71.13 H new ATOM 0 HH12 ARG A 866 8.582 -9.778 8.267 1.00 71.13 H new ATOM 0 HH21 ARG A 866 8.397 -13.322 8.008 1.00 40.53 H new ATOM 0 HH22 ARG A 866 8.598 -11.805 7.125 1.00 40.53 H new ATOM 1223 N GLN A 867 9.973 -10.024 15.167 1.00 3.20 N ATOM 1224 CA GLN A 867 10.320 -9.038 16.177 1.00 70.21 C ATOM 1225 C GLN A 867 10.005 -9.576 17.574 1.00 21.40 C ATOM 1226 O GLN A 867 10.885 -9.642 18.431 1.00 63.33 O ATOM 1227 CB GLN A 867 9.595 -7.715 15.923 1.00 44.11 C ATOM 1228 CG GLN A 867 10.087 -6.628 16.881 1.00 43.23 C ATOM 1229 CD GLN A 867 9.296 -5.332 16.692 1.00 11.02 C ATOM 1230 OE1 GLN A 867 8.224 -5.308 16.110 1.00 33.14 O ATOM 1231 NE2 GLN A 867 9.882 -4.259 17.215 1.00 2.14 N ATOM 0 H GLN A 867 9.357 -9.681 14.430 1.00 3.20 H new ATOM 0 HA GLN A 867 11.391 -8.845 16.116 1.00 70.21 H new ATOM 0 HB2 GLN A 867 9.759 -7.398 14.893 1.00 44.11 H new ATOM 0 HB3 GLN A 867 8.521 -7.855 16.047 1.00 44.11 H new ATOM 0 HG2 GLN A 867 9.987 -6.973 17.910 1.00 43.23 H new ATOM 0 HG3 GLN A 867 11.147 -6.440 16.710 1.00 43.23 H new ATOM 0 HE21 GLN A 867 10.780 -4.349 17.690 1.00 2.14 H new ATOM 0 HE22 GLN A 867 9.433 -3.346 17.142 1.00 2.14 H new ATOM 1240 N ASN A 868 8.747 -9.947 17.761 1.00 70.52 N ATOM 1241 CA ASN A 868 8.305 -10.478 19.039 1.00 0.23 C ATOM 1242 C ASN A 868 9.202 -11.651 19.437 1.00 25.35 C ATOM 1243 O ASN A 868 9.419 -12.568 18.647 1.00 60.14 O ATOM 1244 CB ASN A 868 6.866 -10.991 18.955 1.00 0.42 C ATOM 1245 CG ASN A 868 5.865 -9.849 19.146 1.00 62.14 C ATOM 1246 OD1 ASN A 868 5.826 -9.188 20.170 1.00 33.13 O ATOM 1247 ND2 ASN A 868 5.061 -9.655 18.104 1.00 20.43 N ATOM 0 H ASN A 868 8.019 -9.890 17.048 1.00 70.52 H new ATOM 0 HA ASN A 868 8.359 -9.675 19.774 1.00 0.23 H new ATOM 0 HB2 ASN A 868 6.701 -11.466 17.988 1.00 0.42 H new ATOM 0 HB3 ASN A 868 6.703 -11.754 19.717 1.00 0.42 H new ATOM 0 HD21 ASN A 868 4.358 -8.916 18.133 1.00 20.43 H new ATOM 0 HD22 ASN A 868 5.147 -10.245 17.277 1.00 20.43 H new ATOM 1254 N CYS A 869 9.701 -11.584 20.663 1.00 35.44 N ATOM 1255 CA CYS A 869 10.570 -12.630 21.176 1.00 14.12 C ATOM 1256 C CYS A 869 9.790 -13.435 22.217 1.00 32.24 C ATOM 1257 O CYS A 869 10.128 -14.584 22.499 1.00 14.24 O ATOM 1258 CB CYS A 869 11.866 -12.056 21.752 1.00 32.10 C ATOM 1259 SG CYS A 869 13.023 -11.641 20.396 1.00 12.35 S ATOM 0 H CYS A 869 9.520 -10.822 21.316 1.00 35.44 H new ATOM 0 HA CYS A 869 10.872 -13.288 20.361 1.00 14.12 H new ATOM 0 HB2 CYS A 869 11.649 -11.165 22.341 1.00 32.10 H new ATOM 0 HB3 CYS A 869 12.326 -12.779 22.425 1.00 32.10 H new ATOM 0 HG CYS A 869 12.414 -10.903 19.516 1.00 12.35 H new ATOM 1265 N SER A 870 8.761 -12.801 22.760 1.00 2.24 N ATOM 1266 CA SER A 870 7.931 -13.444 23.764 1.00 14.13 C ATOM 1267 C SER A 870 6.754 -14.154 23.093 1.00 75.31 C ATOM 1268 O SER A 870 5.657 -14.207 23.648 1.00 50.54 O ATOM 1269 CB SER A 870 7.423 -12.430 24.791 1.00 54.51 C ATOM 1270 OG SER A 870 6.696 -13.055 25.845 1.00 20.22 O ATOM 0 H SER A 870 8.483 -11.848 22.523 1.00 2.24 H new ATOM 0 HA SER A 870 8.539 -14.180 24.290 1.00 14.13 H new ATOM 0 HB2 SER A 870 8.268 -11.883 25.209 1.00 54.51 H new ATOM 0 HB3 SER A 870 6.785 -11.700 24.294 1.00 54.51 H new ATOM 0 HG SER A 870 6.102 -13.740 25.472 1.00 20.22 H new ATOM 1276 N HIS A 871 7.021 -14.684 21.908 1.00 1.51 N ATOM 1277 CA HIS A 871 5.998 -15.389 21.155 1.00 11.40 C ATOM 1278 C HIS A 871 6.532 -16.754 20.718 1.00 72.12 C ATOM 1279 O HIS A 871 7.300 -16.847 19.762 1.00 71.34 O ATOM 1280 CB HIS A 871 5.506 -14.540 19.980 1.00 25.34 C ATOM 1281 CG HIS A 871 4.615 -13.390 20.384 1.00 2.01 C ATOM 1282 ND1 HIS A 871 3.947 -13.348 21.596 1.00 64.44 N ATOM 1283 CD2 HIS A 871 4.290 -12.241 19.725 1.00 1.35 C ATOM 1284 CE1 HIS A 871 3.254 -12.221 21.652 1.00 11.03 C ATOM 1285 NE2 HIS A 871 3.467 -11.536 20.492 1.00 22.12 N ATOM 0 H HIS A 871 7.932 -14.639 21.451 1.00 1.51 H new ATOM 0 HA HIS A 871 5.129 -15.564 21.790 1.00 11.40 H new ATOM 0 HB2 HIS A 871 6.369 -14.146 19.443 1.00 25.34 H new ATOM 0 HB3 HIS A 871 4.963 -15.180 19.285 1.00 25.34 H new ATOM 0 HD1 HIS A 871 3.983 -14.063 22.322 1.00 64.44 H new ATOM 0 HD2 HIS A 871 4.642 -11.953 18.745 1.00 1.35 H new ATOM 0 HE1 HIS A 871 2.629 -11.900 22.473 1.00 11.03 H new ATOM 1293 N ASP A 872 6.104 -17.780 21.439 1.00 14.42 N ATOM 1294 CA ASP A 872 6.529 -19.136 21.138 1.00 71.01 C ATOM 1295 C ASP A 872 5.442 -19.837 20.321 1.00 33.22 C ATOM 1296 O ASP A 872 4.259 -19.533 20.465 1.00 34.15 O ATOM 1297 CB ASP A 872 6.751 -19.941 22.420 1.00 74.22 C ATOM 1298 CG ASP A 872 5.485 -20.546 23.030 1.00 32.14 C ATOM 1299 OD1 ASP A 872 5.234 -21.755 22.913 1.00 54.34 O ATOM 1300 OD2 ASP A 872 4.729 -19.710 23.658 1.00 60.00 O ATOM 0 H ASP A 872 5.467 -17.699 22.231 1.00 14.42 H new ATOM 0 HA ASP A 872 7.464 -19.081 20.581 1.00 71.01 H new ATOM 0 HB2 ASP A 872 7.455 -20.746 22.209 1.00 74.22 H new ATOM 0 HB3 ASP A 872 7.220 -19.294 23.161 1.00 74.22 H new ATOM 1306 N TRP A 873 5.882 -20.763 19.481 1.00 14.42 N ATOM 1307 CA TRP A 873 4.961 -21.509 18.641 1.00 33.53 C ATOM 1308 C TRP A 873 4.857 -22.930 19.200 1.00 22.10 C ATOM 1309 O TRP A 873 3.759 -23.420 19.461 1.00 65.03 O ATOM 1310 CB TRP A 873 5.402 -21.474 17.177 1.00 42.21 C ATOM 1311 CG TRP A 873 5.428 -20.070 16.569 1.00 62.12 C ATOM 1312 CD1 TRP A 873 4.956 -18.933 17.098 1.00 51.04 C ATOM 1313 CD2 TRP A 873 5.977 -19.699 15.287 1.00 51.54 C ATOM 1314 NE1 TRP A 873 5.159 -17.860 16.254 1.00 71.14 N ATOM 1315 CE2 TRP A 873 5.800 -18.341 15.117 1.00 13.54 C ATOM 1316 CE3 TRP A 873 6.602 -20.484 14.303 1.00 64.05 C ATOM 1317 CZ2 TRP A 873 6.220 -17.649 13.975 1.00 72.11 C ATOM 1318 CZ3 TRP A 873 7.016 -19.778 13.167 1.00 64.04 C ATOM 1319 CH2 TRP A 873 6.845 -18.411 12.981 1.00 63.20 C ATOM 0 H TRP A 873 6.864 -21.013 19.364 1.00 14.42 H new ATOM 0 HA TRP A 873 3.970 -21.054 18.657 1.00 33.53 H new ATOM 0 HB2 TRP A 873 6.397 -21.912 17.097 1.00 42.21 H new ATOM 0 HB3 TRP A 873 4.730 -22.101 16.591 1.00 42.21 H new ATOM 0 HD1 TRP A 873 4.477 -18.865 18.064 1.00 51.04 H new ATOM 0 HE1 TRP A 873 4.889 -16.893 16.431 1.00 71.14 H new ATOM 0 HE3 TRP A 873 6.751 -21.548 14.414 1.00 64.05 H new ATOM 0 HZ2 TRP A 873 6.070 -16.585 13.867 1.00 72.11 H new ATOM 0 HZ3 TRP A 873 7.503 -20.335 12.380 1.00 64.04 H new ATOM 0 HH2 TRP A 873 7.193 -17.939 12.074 1.00 63.20 H new ATOM 1330 N GLY A 874 6.015 -23.552 19.368 1.00 43.55 N ATOM 1331 CA GLY A 874 6.069 -24.906 19.891 1.00 71.14 C ATOM 1332 C GLY A 874 7.278 -25.092 20.809 1.00 2.45 C ATOM 1333 O GLY A 874 7.670 -24.167 21.520 1.00 31.21 O ATOM 0 H GLY A 874 6.924 -23.142 19.151 1.00 43.55 H new ATOM 0 HA2 GLY A 874 5.154 -25.124 20.441 1.00 71.14 H new ATOM 0 HA3 GLY A 874 6.122 -25.616 19.066 1.00 71.14 H new ATOM 1337 N ILE A 875 7.836 -26.293 20.765 1.00 11.44 N ATOM 1338 CA ILE A 875 8.993 -26.611 21.585 1.00 34.11 C ATOM 1339 C ILE A 875 9.959 -27.482 20.779 1.00 0.34 C ATOM 1340 O ILE A 875 9.561 -28.120 19.806 1.00 20.13 O ATOM 1341 CB ILE A 875 8.554 -27.242 22.908 1.00 2.44 C ATOM 1342 CG1 ILE A 875 7.431 -28.257 22.687 1.00 51.53 C ATOM 1343 CG2 ILE A 875 8.163 -26.167 23.925 1.00 44.11 C ATOM 1344 CD1 ILE A 875 7.969 -29.540 22.052 1.00 62.31 C ATOM 0 H ILE A 875 7.509 -27.057 20.174 1.00 11.44 H new ATOM 0 HA ILE A 875 9.531 -25.702 21.855 1.00 34.11 H new ATOM 0 HB ILE A 875 9.402 -27.786 23.324 1.00 2.44 H new ATOM 0 HG12 ILE A 875 6.954 -28.490 23.639 1.00 51.53 H new ATOM 0 HG13 ILE A 875 6.665 -27.823 22.045 1.00 51.53 H new ATOM 0 HG21 ILE A 875 7.855 -26.642 24.856 1.00 44.11 H new ATOM 0 HG22 ILE A 875 9.017 -25.517 24.114 1.00 44.11 H new ATOM 0 HG23 ILE A 875 7.338 -25.575 23.529 1.00 44.11 H new ATOM 0 HD11 ILE A 875 7.150 -30.245 21.906 1.00 62.31 H new ATOM 0 HD12 ILE A 875 8.423 -29.307 21.089 1.00 62.31 H new ATOM 0 HD13 ILE A 875 8.717 -29.985 22.708 1.00 62.31 H new ATOM 1356 N HIS A 876 11.210 -27.479 21.215 1.00 64.43 N ATOM 1357 CA HIS A 876 12.237 -28.261 20.546 1.00 33.01 C ATOM 1358 C HIS A 876 12.415 -29.598 21.268 1.00 25.03 C ATOM 1359 O HIS A 876 12.632 -29.630 22.479 1.00 50.13 O ATOM 1360 CB HIS A 876 13.540 -27.467 20.438 1.00 51.14 C ATOM 1361 CG HIS A 876 14.356 -27.791 19.209 1.00 23.23 C ATOM 1362 ND1 HIS A 876 14.775 -26.825 18.311 1.00 71.32 N ATOM 1363 CD2 HIS A 876 14.827 -28.983 18.741 1.00 1.41 C ATOM 1364 CE1 HIS A 876 15.465 -27.420 17.349 1.00 72.03 C ATOM 1365 NE2 HIS A 876 15.496 -28.757 17.617 1.00 74.01 N ATOM 0 H HIS A 876 11.536 -26.948 22.023 1.00 64.43 H new ATOM 0 HA HIS A 876 11.926 -28.478 19.524 1.00 33.01 H new ATOM 0 HB2 HIS A 876 13.306 -26.402 20.436 1.00 51.14 H new ATOM 0 HB3 HIS A 876 14.145 -27.659 21.324 1.00 51.14 H new ATOM 0 HD2 HIS A 876 14.680 -29.947 19.206 1.00 1.41 H new ATOM 0 HE1 HIS A 876 15.923 -26.932 16.501 1.00 72.03 H new ATOM 0 HE2 HIS A 876 15.957 -29.466 17.047 1.00 74.01 H new ATOM 1373 N VAL A 877 12.318 -30.669 20.495 1.00 62.32 N ATOM 1374 CA VAL A 877 12.466 -32.006 21.045 1.00 4.24 C ATOM 1375 C VAL A 877 13.395 -32.824 20.145 1.00 14.41 C ATOM 1376 O VAL A 877 13.906 -32.314 19.149 1.00 72.52 O ATOM 1377 CB VAL A 877 11.091 -32.651 21.230 1.00 25.20 C ATOM 1378 CG1 VAL A 877 10.156 -31.733 22.019 1.00 4.13 C ATOM 1379 CG2 VAL A 877 10.478 -33.030 19.881 1.00 50.25 C ATOM 0 H VAL A 877 12.139 -30.638 19.491 1.00 62.32 H new ATOM 0 HA VAL A 877 12.926 -31.964 22.032 1.00 4.24 H new ATOM 0 HB VAL A 877 11.225 -33.566 21.806 1.00 25.20 H new ATOM 0 HG11 VAL A 877 9.186 -32.216 22.136 1.00 4.13 H new ATOM 0 HG12 VAL A 877 10.584 -31.536 23.002 1.00 4.13 H new ATOM 0 HG13 VAL A 877 10.031 -30.793 21.482 1.00 4.13 H new ATOM 0 HG21 VAL A 877 9.501 -33.486 20.041 1.00 50.25 H new ATOM 0 HG22 VAL A 877 10.365 -32.135 19.269 1.00 50.25 H new ATOM 0 HG23 VAL A 877 11.131 -33.739 19.371 1.00 50.25 H new ATOM 1389 N LYS A 878 13.584 -34.078 20.528 1.00 3.41 N ATOM 1390 CA LYS A 878 14.442 -34.971 19.768 1.00 50.22 C ATOM 1391 C LYS A 878 13.843 -36.379 19.780 1.00 41.33 C ATOM 1392 O LYS A 878 13.446 -36.879 20.831 1.00 75.23 O ATOM 1393 CB LYS A 878 15.878 -34.909 20.292 1.00 42.04 C ATOM 1394 CG LYS A 878 16.879 -35.274 19.193 1.00 34.40 C ATOM 1395 CD LYS A 878 18.116 -35.955 19.782 1.00 11.44 C ATOM 1396 CE LYS A 878 18.642 -35.181 20.993 1.00 65.12 C ATOM 1397 NZ LYS A 878 19.962 -35.707 21.410 1.00 53.21 N ATOM 0 H LYS A 878 13.158 -34.497 21.355 1.00 3.41 H new ATOM 0 HA LYS A 878 14.494 -34.655 18.726 1.00 50.22 H new ATOM 0 HB2 LYS A 878 16.090 -33.907 20.664 1.00 42.04 H new ATOM 0 HB3 LYS A 878 15.992 -35.592 21.134 1.00 42.04 H new ATOM 0 HG2 LYS A 878 16.404 -35.937 18.469 1.00 34.40 H new ATOM 0 HG3 LYS A 878 17.177 -34.375 18.654 1.00 34.40 H new ATOM 0 HD2 LYS A 878 17.869 -36.975 20.077 1.00 11.44 H new ATOM 0 HD3 LYS A 878 18.895 -36.023 19.023 1.00 11.44 H new ATOM 0 HE2 LYS A 878 18.727 -34.123 20.747 1.00 65.12 H new ATOM 0 HE3 LYS A 878 17.935 -35.261 21.818 1.00 65.12 H new ATOM 0 HZ1 LYS A 878 20.305 -35.171 22.233 1.00 53.21 H new ATOM 0 HZ2 LYS A 878 19.871 -36.711 21.664 1.00 53.21 H new ATOM 0 HZ3 LYS A 878 20.638 -35.608 20.626 1.00 53.21 H new ATOM 1410 N TYR A 879 13.797 -36.978 18.599 1.00 45.31 N ATOM 1411 CA TYR A 879 13.254 -38.318 18.460 1.00 32.11 C ATOM 1412 C TYR A 879 14.357 -39.326 18.129 1.00 13.40 C ATOM 1413 O TYR A 879 15.449 -38.941 17.715 1.00 63.53 O ATOM 1414 CB TYR A 879 12.269 -38.255 17.291 1.00 44.23 C ATOM 1415 CG TYR A 879 11.153 -37.225 17.472 1.00 33.03 C ATOM 1416 CD1 TYR A 879 10.868 -36.730 18.729 1.00 71.22 C ATOM 1417 CD2 TYR A 879 10.430 -36.791 16.380 1.00 51.34 C ATOM 1418 CE1 TYR A 879 9.817 -35.761 18.900 1.00 52.02 C ATOM 1419 CE2 TYR A 879 9.379 -35.821 16.551 1.00 72.44 C ATOM 1420 CZ TYR A 879 9.124 -35.354 17.802 1.00 21.42 C ATOM 1421 OH TYR A 879 8.131 -34.439 17.964 1.00 64.03 O ATOM 0 H TYR A 879 14.127 -36.559 17.729 1.00 45.31 H new ATOM 0 HA TYR A 879 12.781 -38.638 19.388 1.00 32.11 H new ATOM 0 HB2 TYR A 879 12.818 -38.023 16.379 1.00 44.23 H new ATOM 0 HB3 TYR A 879 11.822 -39.239 17.153 1.00 44.23 H new ATOM 0 HD1 TYR A 879 11.434 -37.070 19.584 1.00 71.22 H new ATOM 0 HD2 TYR A 879 10.652 -37.179 15.397 1.00 51.34 H new ATOM 0 HE1 TYR A 879 9.584 -35.366 19.878 1.00 52.02 H new ATOM 0 HE2 TYR A 879 8.806 -35.472 15.704 1.00 72.44 H new ATOM 0 HH TYR A 879 7.281 -34.902 18.119 1.00 64.03 H new ATOM 1431 N LYS A 880 14.032 -40.595 18.324 1.00 22.22 N ATOM 1432 CA LYS A 880 14.982 -41.661 18.051 1.00 13.25 C ATOM 1433 C LYS A 880 15.329 -41.660 16.561 1.00 11.44 C ATOM 1434 O LYS A 880 16.295 -42.296 16.145 1.00 24.41 O ATOM 1435 CB LYS A 880 14.443 -43.001 18.556 1.00 12.23 C ATOM 1436 CG LYS A 880 14.754 -43.192 20.042 1.00 22.31 C ATOM 1437 CD LYS A 880 13.766 -42.415 20.914 1.00 73.31 C ATOM 1438 CE LYS A 880 12.350 -42.977 20.771 1.00 54.31 C ATOM 1439 NZ LYS A 880 11.530 -42.621 21.951 1.00 74.34 N ATOM 0 H LYS A 880 13.125 -40.910 18.668 1.00 22.22 H new ATOM 0 HA LYS A 880 15.911 -41.492 18.595 1.00 13.25 H new ATOM 0 HB2 LYS A 880 13.366 -43.047 18.397 1.00 12.23 H new ATOM 0 HB3 LYS A 880 14.885 -43.815 17.981 1.00 12.23 H new ATOM 0 HG2 LYS A 880 14.710 -44.252 20.293 1.00 22.31 H new ATOM 0 HG3 LYS A 880 15.770 -42.857 20.250 1.00 22.31 H new ATOM 0 HD2 LYS A 880 14.078 -42.466 21.957 1.00 73.31 H new ATOM 0 HD3 LYS A 880 13.774 -41.363 20.630 1.00 73.31 H new ATOM 0 HE2 LYS A 880 11.886 -42.584 19.866 1.00 54.31 H new ATOM 0 HE3 LYS A 880 12.392 -44.061 20.663 1.00 54.31 H new ATOM 0 HZ1 LYS A 880 10.572 -43.010 21.838 1.00 74.34 H new ATOM 0 HZ2 LYS A 880 11.966 -43.017 22.809 1.00 74.34 H new ATOM 0 HZ3 LYS A 880 11.476 -41.586 22.036 1.00 74.34 H new ATOM 1452 N THR A 881 14.521 -40.937 15.799 1.00 64.11 N ATOM 1453 CA THR A 881 14.731 -40.845 14.364 1.00 1.30 C ATOM 1454 C THR A 881 15.661 -39.675 14.035 1.00 15.32 C ATOM 1455 O THR A 881 16.779 -39.879 13.565 1.00 13.32 O ATOM 1456 CB THR A 881 13.361 -40.740 13.692 1.00 52.42 C ATOM 1457 OG1 THR A 881 12.653 -41.882 14.166 1.00 41.03 O ATOM 1458 CG2 THR A 881 13.434 -40.948 12.178 1.00 73.22 C ATOM 0 H THR A 881 13.721 -40.410 16.148 1.00 64.11 H new ATOM 0 HA THR A 881 15.231 -41.734 13.979 1.00 1.30 H new ATOM 0 HB THR A 881 12.927 -39.763 13.903 1.00 52.42 H new ATOM 0 HG1 THR A 881 11.752 -41.892 13.780 1.00 41.03 H new ATOM 0 HG21 THR A 881 12.435 -40.863 11.751 1.00 73.22 H new ATOM 0 HG22 THR A 881 14.083 -40.191 11.738 1.00 73.22 H new ATOM 0 HG23 THR A 881 13.837 -41.938 11.966 1.00 73.22 H new ATOM 1466 N PHE A 882 15.163 -38.475 14.296 1.00 44.55 N ATOM 1467 CA PHE A 882 15.935 -37.272 14.033 1.00 3.32 C ATOM 1468 C PHE A 882 15.551 -36.152 15.002 1.00 5.42 C ATOM 1469 O PHE A 882 14.613 -36.297 15.784 1.00 3.13 O ATOM 1470 CB PHE A 882 15.605 -36.831 12.606 1.00 52.31 C ATOM 1471 CG PHE A 882 16.087 -37.802 11.527 1.00 64.31 C ATOM 1472 CD1 PHE A 882 17.333 -38.343 11.607 1.00 73.15 C ATOM 1473 CD2 PHE A 882 15.271 -38.125 10.488 1.00 31.23 C ATOM 1474 CE1 PHE A 882 17.780 -39.245 10.605 1.00 5.12 C ATOM 1475 CE2 PHE A 882 15.719 -39.027 9.487 1.00 53.10 C ATOM 1476 CZ PHE A 882 16.964 -39.568 9.567 1.00 50.25 C ATOM 0 H PHE A 882 14.235 -38.310 14.687 1.00 44.55 H new ATOM 0 HA PHE A 882 16.998 -37.477 14.159 1.00 3.32 H new ATOM 0 HB2 PHE A 882 14.526 -36.709 12.515 1.00 52.31 H new ATOM 0 HB3 PHE A 882 16.052 -35.853 12.426 1.00 52.31 H new ATOM 0 HD1 PHE A 882 17.982 -38.087 12.432 1.00 73.15 H new ATOM 0 HD2 PHE A 882 14.282 -37.695 10.424 1.00 31.23 H new ATOM 0 HE1 PHE A 882 18.769 -39.675 10.668 1.00 5.12 H new ATOM 0 HE2 PHE A 882 15.071 -39.283 8.662 1.00 53.10 H new ATOM 0 HZ PHE A 882 17.304 -40.254 8.806 1.00 50.25 H new ATOM 1486 N GLU A 883 16.297 -35.059 14.919 1.00 75.33 N ATOM 1487 CA GLU A 883 16.046 -33.915 15.779 1.00 41.05 C ATOM 1488 C GLU A 883 15.296 -32.827 15.008 1.00 13.54 C ATOM 1489 O GLU A 883 15.851 -32.208 14.101 1.00 34.33 O ATOM 1490 CB GLU A 883 17.352 -33.372 16.363 1.00 74.11 C ATOM 1491 CG GLU A 883 17.075 -32.309 17.428 1.00 24.22 C ATOM 1492 CD GLU A 883 18.295 -32.107 18.330 1.00 34.02 C ATOM 1493 OE1 GLU A 883 19.437 -32.156 17.849 1.00 35.22 O ATOM 1494 OE2 GLU A 883 18.024 -31.891 19.573 1.00 72.22 O ATOM 0 H GLU A 883 17.075 -34.942 14.270 1.00 75.33 H new ATOM 0 HA GLU A 883 15.421 -34.240 16.611 1.00 41.05 H new ATOM 0 HB2 GLU A 883 17.927 -34.189 16.800 1.00 74.11 H new ATOM 0 HB3 GLU A 883 17.961 -32.944 15.566 1.00 74.11 H new ATOM 0 HG2 GLU A 883 16.814 -31.366 16.947 1.00 24.22 H new ATOM 0 HG3 GLU A 883 16.218 -32.608 18.031 1.00 24.22 H new ATOM 1502 N ILE A 884 14.045 -32.626 15.398 1.00 5.53 N ATOM 1503 CA ILE A 884 13.213 -31.622 14.756 1.00 63.41 C ATOM 1504 C ILE A 884 12.210 -31.072 15.771 1.00 10.13 C ATOM 1505 O ILE A 884 11.865 -31.749 16.738 1.00 22.15 O ATOM 1506 CB ILE A 884 12.562 -32.194 13.495 1.00 34.33 C ATOM 1507 CG1 ILE A 884 12.363 -33.706 13.619 1.00 75.33 C ATOM 1508 CG2 ILE A 884 13.363 -31.822 12.246 1.00 1.34 C ATOM 1509 CD1 ILE A 884 11.323 -34.037 14.691 1.00 15.31 C ATOM 0 H ILE A 884 13.588 -33.141 16.150 1.00 5.53 H new ATOM 0 HA ILE A 884 13.820 -30.781 14.420 1.00 63.41 H new ATOM 0 HB ILE A 884 11.574 -31.746 13.388 1.00 34.33 H new ATOM 0 HG12 ILE A 884 12.044 -34.114 12.660 1.00 75.33 H new ATOM 0 HG13 ILE A 884 13.311 -34.182 13.868 1.00 75.33 H new ATOM 0 HG21 ILE A 884 12.878 -32.241 11.364 1.00 1.34 H new ATOM 0 HG22 ILE A 884 13.409 -30.737 12.153 1.00 1.34 H new ATOM 0 HG23 ILE A 884 14.373 -32.222 12.329 1.00 1.34 H new ATOM 0 HD11 ILE A 884 11.201 -35.118 14.758 1.00 15.31 H new ATOM 0 HD12 ILE A 884 11.656 -33.649 15.653 1.00 15.31 H new ATOM 0 HD13 ILE A 884 10.369 -33.580 14.426 1.00 15.31 H new ATOM 1521 N PRO A 885 11.758 -29.816 15.510 1.00 72.22 N ATOM 1522 CA PRO A 885 10.801 -29.167 16.390 1.00 71.04 C ATOM 1523 C PRO A 885 9.399 -29.749 16.199 1.00 13.15 C ATOM 1524 O PRO A 885 9.131 -30.421 15.204 1.00 1.44 O ATOM 1525 CB PRO A 885 10.884 -27.690 16.040 1.00 73.25 C ATOM 1526 CG PRO A 885 11.536 -27.623 14.668 1.00 11.22 C ATOM 1527 CD PRO A 885 12.144 -28.984 14.374 1.00 61.31 C ATOM 0 HA PRO A 885 11.024 -29.326 17.445 1.00 71.04 H new ATOM 0 HB2 PRO A 885 9.893 -27.236 16.024 1.00 73.25 H new ATOM 0 HB3 PRO A 885 11.472 -27.146 16.779 1.00 73.25 H new ATOM 0 HG2 PRO A 885 10.800 -27.362 13.908 1.00 11.22 H new ATOM 0 HG3 PRO A 885 12.304 -26.849 14.648 1.00 11.22 H new ATOM 0 HD2 PRO A 885 11.765 -29.393 13.437 1.00 61.31 H new ATOM 0 HD3 PRO A 885 13.228 -28.921 14.279 1.00 61.31 H new ATOM 1535 N VAL A 886 8.540 -29.470 17.169 1.00 4.34 N ATOM 1536 CA VAL A 886 7.172 -29.957 17.121 1.00 3.23 C ATOM 1537 C VAL A 886 6.215 -28.767 17.035 1.00 15.21 C ATOM 1538 O VAL A 886 6.477 -27.711 17.610 1.00 70.35 O ATOM 1539 CB VAL A 886 6.896 -30.861 18.325 1.00 40.44 C ATOM 1540 CG1 VAL A 886 5.687 -31.762 18.067 1.00 14.42 C ATOM 1541 CG2 VAL A 886 8.131 -31.690 18.683 1.00 42.44 C ATOM 0 H VAL A 886 8.765 -28.913 17.993 1.00 4.34 H new ATOM 0 HA VAL A 886 7.014 -30.566 16.231 1.00 3.23 H new ATOM 0 HB VAL A 886 6.663 -30.223 19.177 1.00 40.44 H new ATOM 0 HG11 VAL A 886 5.512 -32.394 18.937 1.00 14.42 H new ATOM 0 HG12 VAL A 886 4.807 -31.146 17.883 1.00 14.42 H new ATOM 0 HG13 VAL A 886 5.879 -32.389 17.196 1.00 14.42 H new ATOM 0 HG21 VAL A 886 7.908 -32.323 19.542 1.00 42.44 H new ATOM 0 HG22 VAL A 886 8.409 -32.314 17.834 1.00 42.44 H new ATOM 0 HG23 VAL A 886 8.958 -31.024 18.929 1.00 42.44 H new ATOM 1551 N ILE A 887 5.124 -28.977 16.313 1.00 71.12 N ATOM 1552 CA ILE A 887 4.126 -27.935 16.144 1.00 54.20 C ATOM 1553 C ILE A 887 2.730 -28.540 16.305 1.00 31.54 C ATOM 1554 O ILE A 887 2.593 -29.744 16.521 1.00 54.33 O ATOM 1555 CB ILE A 887 4.330 -27.207 14.814 1.00 62.44 C ATOM 1556 CG1 ILE A 887 5.813 -27.158 14.438 1.00 13.43 C ATOM 1557 CG2 ILE A 887 3.701 -25.813 14.848 1.00 34.35 C ATOM 1558 CD1 ILE A 887 6.597 -26.280 15.416 1.00 55.52 C ATOM 0 H ILE A 887 4.909 -29.854 15.838 1.00 71.12 H new ATOM 0 HA ILE A 887 4.236 -27.175 16.917 1.00 54.20 H new ATOM 0 HB ILE A 887 3.818 -27.771 14.034 1.00 62.44 H new ATOM 0 HG12 ILE A 887 6.226 -28.167 14.438 1.00 13.43 H new ATOM 0 HG13 ILE A 887 5.923 -26.769 13.426 1.00 13.43 H new ATOM 0 HG21 ILE A 887 3.861 -25.318 13.890 1.00 34.35 H new ATOM 0 HG22 ILE A 887 2.631 -25.901 15.037 1.00 34.35 H new ATOM 0 HG23 ILE A 887 4.162 -25.225 15.642 1.00 34.35 H new ATOM 0 HD11 ILE A 887 7.648 -26.262 15.127 1.00 55.52 H new ATOM 0 HD12 ILE A 887 6.197 -25.266 15.395 1.00 55.52 H new ATOM 0 HD13 ILE A 887 6.505 -26.686 16.423 1.00 55.52 H new ATOM 1570 N LYS A 888 1.729 -27.679 16.195 1.00 5.12 N ATOM 1571 CA LYS A 888 0.349 -28.114 16.326 1.00 3.13 C ATOM 1572 C LYS A 888 -0.471 -27.549 15.165 1.00 34.11 C ATOM 1573 O LYS A 888 0.077 -26.921 14.261 1.00 53.41 O ATOM 1574 CB LYS A 888 -0.201 -27.744 17.705 1.00 4.43 C ATOM 1575 CG LYS A 888 0.094 -26.280 18.038 1.00 2.40 C ATOM 1576 CD LYS A 888 -0.361 -25.938 19.458 1.00 2.23 C ATOM 1577 CE LYS A 888 0.588 -26.538 20.497 1.00 21.44 C ATOM 1578 NZ LYS A 888 -0.025 -26.499 21.844 1.00 55.33 N ATOM 0 H LYS A 888 1.846 -26.682 16.017 1.00 5.12 H new ATOM 0 HA LYS A 888 0.284 -29.200 16.264 1.00 3.13 H new ATOM 0 HB2 LYS A 888 -1.277 -27.917 17.730 1.00 4.43 H new ATOM 0 HB3 LYS A 888 0.243 -28.390 18.463 1.00 4.43 H new ATOM 0 HG2 LYS A 888 1.163 -26.089 17.939 1.00 2.40 H new ATOM 0 HG3 LYS A 888 -0.413 -25.632 17.324 1.00 2.40 H new ATOM 0 HD2 LYS A 888 -0.402 -24.856 19.580 1.00 2.23 H new ATOM 0 HD3 LYS A 888 -1.370 -26.316 19.621 1.00 2.23 H new ATOM 0 HE2 LYS A 888 0.826 -27.567 20.229 1.00 21.44 H new ATOM 0 HE3 LYS A 888 1.527 -25.985 20.502 1.00 21.44 H new ATOM 0 HZ1 LYS A 888 0.633 -26.910 22.537 1.00 55.33 H new ATOM 0 HZ2 LYS A 888 -0.230 -25.513 22.104 1.00 55.33 H new ATOM 0 HZ3 LYS A 888 -0.909 -27.046 21.839 1.00 55.33 H new ATOM 1591 N ILE A 889 -1.772 -27.793 15.228 1.00 71.32 N ATOM 1592 CA ILE A 889 -2.674 -27.317 14.193 1.00 43.13 C ATOM 1593 C ILE A 889 -3.143 -25.903 14.542 1.00 24.10 C ATOM 1594 O ILE A 889 -3.334 -25.072 13.656 1.00 43.23 O ATOM 1595 CB ILE A 889 -3.818 -28.310 13.981 1.00 55.32 C ATOM 1596 CG1 ILE A 889 -4.606 -27.975 12.713 1.00 75.44 C ATOM 1597 CG2 ILE A 889 -4.720 -28.378 15.215 1.00 74.02 C ATOM 1598 CD1 ILE A 889 -5.816 -28.900 12.559 1.00 63.03 C ATOM 0 H ILE A 889 -2.223 -28.314 15.980 1.00 71.32 H new ATOM 0 HA ILE A 889 -2.156 -27.254 13.236 1.00 43.13 H new ATOM 0 HB ILE A 889 -3.388 -29.302 13.841 1.00 55.32 H new ATOM 0 HG12 ILE A 889 -4.939 -26.938 12.751 1.00 75.44 H new ATOM 0 HG13 ILE A 889 -3.958 -28.070 11.842 1.00 75.44 H new ATOM 0 HG21 ILE A 889 -5.525 -29.091 15.038 1.00 74.02 H new ATOM 0 HG22 ILE A 889 -4.134 -28.698 16.077 1.00 74.02 H new ATOM 0 HG23 ILE A 889 -5.144 -27.393 15.411 1.00 74.02 H new ATOM 0 HD11 ILE A 889 -6.359 -28.641 11.650 1.00 63.03 H new ATOM 0 HD12 ILE A 889 -5.478 -29.934 12.497 1.00 63.03 H new ATOM 0 HD13 ILE A 889 -6.474 -28.784 13.420 1.00 63.03 H new ATOM 1610 N GLU A 890 -3.315 -25.674 15.836 1.00 44.24 N ATOM 1611 CA GLU A 890 -3.757 -24.375 16.313 1.00 15.10 C ATOM 1612 C GLU A 890 -2.553 -23.482 16.618 1.00 23.42 C ATOM 1613 O GLU A 890 -2.596 -22.670 17.541 1.00 45.24 O ATOM 1614 CB GLU A 890 -4.657 -24.520 17.542 1.00 74.03 C ATOM 1615 CG GLU A 890 -3.878 -25.092 18.728 1.00 73.54 C ATOM 1616 CD GLU A 890 -4.633 -24.867 20.039 1.00 22.34 C ATOM 1617 OE1 GLU A 890 -5.029 -25.838 20.701 1.00 22.33 O ATOM 1618 OE2 GLU A 890 -4.802 -23.631 20.366 1.00 53.24 O ATOM 0 H GLU A 890 -3.156 -26.366 16.568 1.00 44.24 H new ATOM 0 HA GLU A 890 -4.344 -23.902 15.526 1.00 15.10 H new ATOM 0 HB2 GLU A 890 -5.072 -23.548 17.810 1.00 74.03 H new ATOM 0 HB3 GLU A 890 -5.498 -25.172 17.306 1.00 74.03 H new ATOM 0 HG2 GLU A 890 -3.712 -26.159 18.578 1.00 73.54 H new ATOM 0 HG3 GLU A 890 -2.896 -24.621 18.784 1.00 73.54 H new ATOM 1626 N SER A 891 -1.506 -23.664 15.826 1.00 55.11 N ATOM 1627 CA SER A 891 -0.292 -22.885 16.000 1.00 70.32 C ATOM 1628 C SER A 891 -0.173 -21.845 14.884 1.00 14.34 C ATOM 1629 O SER A 891 0.291 -20.730 15.117 1.00 5.03 O ATOM 1630 CB SER A 891 0.943 -23.788 16.017 1.00 1.11 C ATOM 1631 OG SER A 891 0.899 -24.773 14.988 1.00 2.30 O ATOM 0 H SER A 891 -1.474 -24.340 15.062 1.00 55.11 H new ATOM 0 HA SER A 891 -0.349 -22.373 16.961 1.00 70.32 H new ATOM 0 HB2 SER A 891 1.839 -23.179 15.898 1.00 1.11 H new ATOM 0 HB3 SER A 891 1.019 -24.280 16.987 1.00 1.11 H new ATOM 0 HG SER A 891 1.244 -24.391 14.154 1.00 2.30 H new ATOM 1637 N PHE A 892 -0.602 -22.246 13.697 1.00 41.14 N ATOM 1638 CA PHE A 892 -0.550 -21.362 12.544 1.00 24.14 C ATOM 1639 C PHE A 892 -1.830 -21.468 11.714 1.00 51.33 C ATOM 1640 O PHE A 892 -2.738 -22.223 12.059 1.00 65.13 O ATOM 1641 CB PHE A 892 0.637 -21.811 11.690 1.00 62.23 C ATOM 1642 CG PHE A 892 0.775 -23.330 11.565 1.00 75.03 C ATOM 1643 CD1 PHE A 892 -0.241 -24.063 11.034 1.00 22.24 C ATOM 1644 CD2 PHE A 892 1.912 -23.947 11.984 1.00 12.30 C ATOM 1645 CE1 PHE A 892 -0.113 -25.473 10.919 1.00 54.35 C ATOM 1646 CE2 PHE A 892 2.039 -25.356 11.868 1.00 22.31 C ATOM 1647 CZ PHE A 892 1.024 -26.089 11.338 1.00 71.52 C ATOM 0 H PHE A 892 -0.987 -23.171 13.508 1.00 41.14 H new ATOM 0 HA PHE A 892 -0.447 -20.328 12.872 1.00 24.14 H new ATOM 0 HB2 PHE A 892 0.537 -21.382 10.693 1.00 62.23 H new ATOM 0 HB3 PHE A 892 1.554 -21.407 12.120 1.00 62.23 H new ATOM 0 HD1 PHE A 892 -1.144 -23.573 10.700 1.00 22.24 H new ATOM 0 HD2 PHE A 892 2.718 -23.365 12.405 1.00 12.30 H new ATOM 0 HE1 PHE A 892 -0.919 -26.056 10.499 1.00 54.35 H new ATOM 0 HE2 PHE A 892 2.942 -25.846 12.201 1.00 22.31 H new ATOM 0 HZ PHE A 892 1.121 -27.161 11.250 1.00 71.52 H new ATOM 1657 N VAL A 893 -1.863 -20.699 10.635 1.00 64.52 N ATOM 1658 CA VAL A 893 -3.017 -20.697 9.752 1.00 21.21 C ATOM 1659 C VAL A 893 -2.601 -21.215 8.374 1.00 45.01 C ATOM 1660 O VAL A 893 -1.412 -21.276 8.063 1.00 71.51 O ATOM 1661 CB VAL A 893 -3.636 -19.299 9.703 1.00 3.35 C ATOM 1662 CG1 VAL A 893 -3.519 -18.600 11.060 1.00 75.33 C ATOM 1663 CG2 VAL A 893 -3.000 -18.456 8.596 1.00 5.13 C ATOM 0 H VAL A 893 -1.109 -20.073 10.352 1.00 64.52 H new ATOM 0 HA VAL A 893 -3.789 -21.367 10.131 1.00 21.21 H new ATOM 0 HB VAL A 893 -4.696 -19.410 9.473 1.00 3.35 H new ATOM 0 HG11 VAL A 893 -3.967 -17.608 10.998 1.00 75.33 H new ATOM 0 HG12 VAL A 893 -4.039 -19.186 11.817 1.00 75.33 H new ATOM 0 HG13 VAL A 893 -2.468 -18.507 11.332 1.00 75.33 H new ATOM 0 HG21 VAL A 893 -3.458 -17.467 8.583 1.00 5.13 H new ATOM 0 HG22 VAL A 893 -1.931 -18.358 8.782 1.00 5.13 H new ATOM 0 HG23 VAL A 893 -3.158 -18.942 7.633 1.00 5.13 H new ATOM 1673 N VAL A 894 -3.602 -21.574 7.585 1.00 73.23 N ATOM 1674 CA VAL A 894 -3.355 -22.085 6.247 1.00 51.31 C ATOM 1675 C VAL A 894 -3.986 -21.141 5.221 1.00 32.30 C ATOM 1676 O VAL A 894 -5.207 -21.110 5.070 1.00 45.52 O ATOM 1677 CB VAL A 894 -3.868 -23.522 6.132 1.00 4.22 C ATOM 1678 CG1 VAL A 894 -2.706 -24.516 6.086 1.00 62.11 C ATOM 1679 CG2 VAL A 894 -4.829 -23.854 7.276 1.00 44.05 C ATOM 0 H VAL A 894 -4.587 -21.521 7.846 1.00 73.23 H new ATOM 0 HA VAL A 894 -2.285 -22.119 6.043 1.00 51.31 H new ATOM 0 HB VAL A 894 -4.420 -23.608 5.196 1.00 4.22 H new ATOM 0 HG11 VAL A 894 -3.098 -25.530 6.004 1.00 62.11 H new ATOM 0 HG12 VAL A 894 -2.076 -24.300 5.223 1.00 62.11 H new ATOM 0 HG13 VAL A 894 -2.115 -24.428 6.998 1.00 62.11 H new ATOM 0 HG21 VAL A 894 -5.179 -24.881 7.171 1.00 44.05 H new ATOM 0 HG22 VAL A 894 -4.312 -23.743 8.229 1.00 44.05 H new ATOM 0 HG23 VAL A 894 -5.681 -23.175 7.244 1.00 44.05 H new ATOM 1689 N GLU A 895 -3.126 -20.396 4.543 1.00 54.24 N ATOM 1690 CA GLU A 895 -3.584 -19.454 3.535 1.00 35.03 C ATOM 1691 C GLU A 895 -3.344 -20.018 2.133 1.00 11.33 C ATOM 1692 O GLU A 895 -2.234 -19.935 1.609 1.00 35.11 O ATOM 1693 CB GLU A 895 -2.902 -18.095 3.704 1.00 21.23 C ATOM 1694 CG GLU A 895 -3.546 -17.042 2.800 1.00 3.04 C ATOM 1695 CD GLU A 895 -2.648 -15.810 2.668 1.00 64.43 C ATOM 1696 OE1 GLU A 895 -2.676 -14.926 3.537 1.00 63.15 O ATOM 1697 OE2 GLU A 895 -1.900 -15.792 1.617 1.00 41.44 O ATOM 0 H GLU A 895 -2.115 -20.425 4.671 1.00 54.24 H new ATOM 0 HA GLU A 895 -4.656 -19.304 3.666 1.00 35.03 H new ATOM 0 HB2 GLU A 895 -2.970 -17.777 4.744 1.00 21.23 H new ATOM 0 HB3 GLU A 895 -1.842 -18.184 3.467 1.00 21.23 H new ATOM 0 HG2 GLU A 895 -3.732 -17.468 1.814 1.00 3.04 H new ATOM 0 HG3 GLU A 895 -4.513 -16.749 3.208 1.00 3.04 H new ATOM 1705 N ASP A 896 -4.402 -20.578 1.566 1.00 33.01 N ATOM 1706 CA ASP A 896 -4.320 -21.155 0.235 1.00 32.22 C ATOM 1707 C ASP A 896 -3.803 -20.099 -0.743 1.00 41.31 C ATOM 1708 O ASP A 896 -4.165 -18.927 -0.646 1.00 23.14 O ATOM 1709 CB ASP A 896 -5.696 -21.616 -0.251 1.00 24.41 C ATOM 1710 CG ASP A 896 -5.946 -23.122 -0.148 1.00 73.22 C ATOM 1711 OD1 ASP A 896 -6.428 -23.621 0.880 1.00 41.21 O ATOM 1712 OD2 ASP A 896 -5.621 -23.802 -1.195 1.00 50.34 O ATOM 0 H ASP A 896 -5.321 -20.645 2.004 1.00 33.01 H new ATOM 0 HA ASP A 896 -3.647 -22.012 0.280 1.00 32.22 H new ATOM 0 HB2 ASP A 896 -6.461 -21.095 0.325 1.00 24.41 H new ATOM 0 HB3 ASP A 896 -5.818 -21.313 -1.291 1.00 24.41 H new ATOM 1718 N ILE A 897 -2.964 -20.551 -1.664 1.00 35.01 N ATOM 1719 CA ILE A 897 -2.394 -19.659 -2.659 1.00 63.31 C ATOM 1720 C ILE A 897 -3.315 -19.608 -3.880 1.00 24.31 C ATOM 1721 O ILE A 897 -3.172 -18.734 -4.734 1.00 23.44 O ATOM 1722 CB ILE A 897 -0.958 -20.073 -2.989 1.00 10.03 C ATOM 1723 CG1 ILE A 897 -0.261 -20.660 -1.760 1.00 3.13 C ATOM 1724 CG2 ILE A 897 -0.175 -18.904 -3.588 1.00 45.35 C ATOM 1725 CD1 ILE A 897 -0.072 -22.171 -1.906 1.00 35.23 C ATOM 0 H ILE A 897 -2.666 -21.523 -1.742 1.00 35.01 H new ATOM 0 HA ILE A 897 -2.327 -18.644 -2.267 1.00 63.31 H new ATOM 0 HB ILE A 897 -0.993 -20.858 -3.745 1.00 10.03 H new ATOM 0 HG12 ILE A 897 0.708 -20.180 -1.623 1.00 3.13 H new ATOM 0 HG13 ILE A 897 -0.850 -20.448 -0.868 1.00 3.13 H new ATOM 0 HG21 ILE A 897 0.842 -19.225 -3.813 1.00 45.35 H new ATOM 0 HG22 ILE A 897 -0.662 -18.571 -4.505 1.00 45.35 H new ATOM 0 HG23 ILE A 897 -0.146 -18.081 -2.873 1.00 45.35 H new ATOM 0 HD11 ILE A 897 0.426 -22.563 -1.019 1.00 35.23 H new ATOM 0 HD12 ILE A 897 -1.045 -22.650 -2.018 1.00 35.23 H new ATOM 0 HD13 ILE A 897 0.538 -22.378 -2.785 1.00 35.23 H new ATOM 1737 N ALA A 898 -4.239 -20.556 -3.924 1.00 33.23 N ATOM 1738 CA ALA A 898 -5.183 -20.630 -5.026 1.00 34.33 C ATOM 1739 C ALA A 898 -6.436 -19.825 -4.674 1.00 2.03 C ATOM 1740 O ALA A 898 -7.171 -19.395 -5.561 1.00 11.42 O ATOM 1741 CB ALA A 898 -5.499 -22.096 -5.330 1.00 32.11 C ATOM 0 H ALA A 898 -4.354 -21.279 -3.214 1.00 33.23 H new ATOM 0 HA ALA A 898 -4.754 -20.195 -5.928 1.00 34.33 H new ATOM 0 HB1 ALA A 898 -6.207 -22.152 -6.157 1.00 32.11 H new ATOM 0 HB2 ALA A 898 -4.581 -22.617 -5.603 1.00 32.11 H new ATOM 0 HB3 ALA A 898 -5.934 -22.565 -4.447 1.00 32.11 H new ATOM 1747 N THR A 899 -6.640 -19.646 -3.377 1.00 0.40 N ATOM 1748 CA THR A 899 -7.791 -18.900 -2.897 1.00 3.43 C ATOM 1749 C THR A 899 -7.339 -17.629 -2.175 1.00 42.50 C ATOM 1750 O THR A 899 -8.056 -16.630 -2.162 1.00 13.54 O ATOM 1751 CB THR A 899 -8.626 -19.833 -2.018 1.00 50.10 C ATOM 1752 OG1 THR A 899 -7.916 -19.875 -0.783 1.00 63.55 O ATOM 1753 CG2 THR A 899 -8.601 -21.281 -2.512 1.00 51.44 C ATOM 0 H THR A 899 -6.028 -20.005 -2.644 1.00 0.40 H new ATOM 0 HA THR A 899 -8.416 -18.562 -3.724 1.00 3.43 H new ATOM 0 HB THR A 899 -9.656 -19.478 -1.988 1.00 50.10 H new ATOM 0 HG1 THR A 899 -8.285 -20.585 -0.217 1.00 63.55 H new ATOM 0 HG21 THR A 899 -9.209 -21.901 -1.853 1.00 51.44 H new ATOM 0 HG22 THR A 899 -9.001 -21.327 -3.525 1.00 51.44 H new ATOM 0 HG23 THR A 899 -7.575 -21.648 -2.511 1.00 51.44 H new ATOM 1761 N GLY A 900 -6.151 -17.708 -1.593 1.00 14.55 N ATOM 1762 CA GLY A 900 -5.595 -16.576 -0.871 1.00 12.24 C ATOM 1763 C GLY A 900 -6.376 -16.310 0.418 1.00 55.32 C ATOM 1764 O GLY A 900 -6.317 -15.211 0.969 1.00 62.45 O ATOM 0 H GLY A 900 -5.558 -18.538 -1.607 1.00 14.55 H new ATOM 0 HA2 GLY A 900 -4.549 -16.770 -0.633 1.00 12.24 H new ATOM 0 HA3 GLY A 900 -5.619 -15.689 -1.504 1.00 12.24 H new ATOM 1768 N VAL A 901 -7.091 -17.334 0.861 1.00 52.52 N ATOM 1769 CA VAL A 901 -7.883 -17.224 2.074 1.00 33.01 C ATOM 1770 C VAL A 901 -7.192 -17.994 3.201 1.00 62.23 C ATOM 1771 O VAL A 901 -6.711 -19.107 2.993 1.00 75.42 O ATOM 1772 CB VAL A 901 -9.312 -17.704 1.811 1.00 12.12 C ATOM 1773 CG1 VAL A 901 -9.321 -19.146 1.300 1.00 41.34 C ATOM 1774 CG2 VAL A 901 -10.178 -17.562 3.065 1.00 44.52 C ATOM 0 H VAL A 901 -7.138 -18.243 0.402 1.00 52.52 H new ATOM 0 HA VAL A 901 -7.956 -16.183 2.389 1.00 33.01 H new ATOM 0 HB VAL A 901 -9.740 -17.070 1.034 1.00 12.12 H new ATOM 0 HG11 VAL A 901 -10.349 -19.462 1.121 1.00 41.34 H new ATOM 0 HG12 VAL A 901 -8.756 -19.206 0.370 1.00 41.34 H new ATOM 0 HG13 VAL A 901 -8.865 -19.799 2.044 1.00 41.34 H new ATOM 0 HG21 VAL A 901 -11.188 -17.910 2.851 1.00 44.52 H new ATOM 0 HG22 VAL A 901 -9.752 -18.159 3.871 1.00 44.52 H new ATOM 0 HG23 VAL A 901 -10.211 -16.515 3.368 1.00 44.52 H new ATOM 1784 N GLN A 902 -7.163 -17.371 4.370 1.00 51.05 N ATOM 1785 CA GLN A 902 -6.538 -17.984 5.529 1.00 13.14 C ATOM 1786 C GLN A 902 -7.600 -18.610 6.436 1.00 73.04 C ATOM 1787 O GLN A 902 -8.727 -18.121 6.507 1.00 3.04 O ATOM 1788 CB GLN A 902 -5.692 -16.967 6.298 1.00 52.10 C ATOM 1789 CG GLN A 902 -6.577 -15.917 6.973 1.00 5.24 C ATOM 1790 CD GLN A 902 -5.742 -14.734 7.470 1.00 62.42 C ATOM 1791 OE1 GLN A 902 -6.105 -13.579 7.321 1.00 62.11 O ATOM 1792 NE2 GLN A 902 -4.606 -15.086 8.066 1.00 35.34 N ATOM 0 H GLN A 902 -7.562 -16.448 4.539 1.00 51.05 H new ATOM 0 HA GLN A 902 -5.872 -18.774 5.182 1.00 13.14 H new ATOM 0 HB2 GLN A 902 -5.093 -17.481 7.050 1.00 52.10 H new ATOM 0 HB3 GLN A 902 -4.996 -16.478 5.616 1.00 52.10 H new ATOM 0 HG2 GLN A 902 -7.331 -15.565 6.269 1.00 5.24 H new ATOM 0 HG3 GLN A 902 -7.109 -16.368 7.810 1.00 5.24 H new ATOM 0 HE21 GLN A 902 -4.362 -16.072 8.158 1.00 35.34 H new ATOM 0 HE22 GLN A 902 -3.979 -14.370 8.431 1.00 35.34 H new ATOM 1801 N THR A 903 -7.204 -19.683 7.105 1.00 42.43 N ATOM 1802 CA THR A 903 -8.108 -20.381 8.003 1.00 5.42 C ATOM 1803 C THR A 903 -7.318 -21.112 9.091 1.00 75.22 C ATOM 1804 O THR A 903 -6.278 -21.706 8.814 1.00 25.33 O ATOM 1805 CB THR A 903 -8.987 -21.308 7.163 1.00 60.35 C ATOM 1806 OG1 THR A 903 -9.253 -20.558 5.981 1.00 42.13 O ATOM 1807 CG2 THR A 903 -10.368 -21.527 7.783 1.00 32.23 C ATOM 0 H THR A 903 -6.269 -20.086 7.043 1.00 42.43 H new ATOM 0 HA THR A 903 -8.759 -19.684 8.530 1.00 5.42 H new ATOM 0 HB THR A 903 -8.487 -22.269 7.041 1.00 60.35 H new ATOM 0 HG1 THR A 903 -9.817 -21.086 5.379 1.00 42.13 H new ATOM 0 HG21 THR A 903 -10.951 -22.193 7.147 1.00 32.23 H new ATOM 0 HG22 THR A 903 -10.257 -21.975 8.771 1.00 32.23 H new ATOM 0 HG23 THR A 903 -10.882 -20.570 7.874 1.00 32.23 H new ATOM 1815 N LEU A 904 -7.844 -21.045 10.305 1.00 14.00 N ATOM 1816 CA LEU A 904 -7.202 -21.694 11.436 1.00 52.43 C ATOM 1817 C LEU A 904 -8.165 -22.713 12.048 1.00 70.14 C ATOM 1818 O LEU A 904 -9.281 -22.366 12.431 1.00 2.25 O ATOM 1819 CB LEU A 904 -6.694 -20.651 12.434 1.00 75.11 C ATOM 1820 CG LEU A 904 -7.387 -19.288 12.390 1.00 13.44 C ATOM 1821 CD1 LEU A 904 -8.759 -19.348 13.066 1.00 42.23 C ATOM 1822 CD2 LEU A 904 -6.497 -18.201 12.997 1.00 53.35 C ATOM 0 H LEU A 904 -8.708 -20.551 10.530 1.00 14.00 H new ATOM 0 HA LEU A 904 -6.320 -22.245 11.109 1.00 52.43 H new ATOM 0 HB2 LEU A 904 -6.799 -21.058 13.440 1.00 75.11 H new ATOM 0 HB3 LEU A 904 -5.628 -20.500 12.261 1.00 75.11 H new ATOM 0 HG LEU A 904 -7.553 -19.023 11.346 1.00 13.44 H new ATOM 0 HD11 LEU A 904 -9.230 -18.366 13.021 1.00 42.23 H new ATOM 0 HD12 LEU A 904 -9.387 -20.076 12.551 1.00 42.23 H new ATOM 0 HD13 LEU A 904 -8.639 -19.645 14.108 1.00 42.23 H new ATOM 0 HD21 LEU A 904 -7.013 -17.242 12.953 1.00 53.35 H new ATOM 0 HD22 LEU A 904 -6.278 -18.448 14.036 1.00 53.35 H new ATOM 0 HD23 LEU A 904 -5.565 -18.138 12.435 1.00 53.35 H new ATOM 1834 N TYR A 905 -7.698 -23.951 12.119 1.00 33.03 N ATOM 1835 CA TYR A 905 -8.504 -25.023 12.678 1.00 31.40 C ATOM 1836 C TYR A 905 -8.507 -24.968 14.207 1.00 2.31 C ATOM 1837 O TYR A 905 -7.979 -24.027 14.798 1.00 22.35 O ATOM 1838 CB TYR A 905 -7.841 -26.327 12.228 1.00 14.02 C ATOM 1839 CG TYR A 905 -7.655 -26.440 10.714 1.00 72.11 C ATOM 1840 CD1 TYR A 905 -8.743 -26.317 9.874 1.00 50.53 C ATOM 1841 CD2 TYR A 905 -6.399 -26.666 10.188 1.00 52.31 C ATOM 1842 CE1 TYR A 905 -8.568 -26.423 8.448 1.00 2.04 C ATOM 1843 CE2 TYR A 905 -6.224 -26.772 8.763 1.00 61.14 C ATOM 1844 CZ TYR A 905 -7.317 -26.646 7.963 1.00 1.42 C ATOM 1845 OH TYR A 905 -7.151 -26.746 6.617 1.00 33.11 O ATOM 0 H TYR A 905 -6.772 -24.235 11.799 1.00 33.03 H new ATOM 0 HA TYR A 905 -9.538 -24.941 12.342 1.00 31.40 H new ATOM 0 HB2 TYR A 905 -6.868 -26.413 12.711 1.00 14.02 H new ATOM 0 HB3 TYR A 905 -8.444 -27.167 12.573 1.00 14.02 H new ATOM 0 HD1 TYR A 905 -9.726 -26.141 10.286 1.00 50.53 H new ATOM 0 HD2 TYR A 905 -5.548 -26.763 10.845 1.00 52.31 H new ATOM 0 HE1 TYR A 905 -9.411 -26.328 7.779 1.00 2.04 H new ATOM 0 HE2 TYR A 905 -5.247 -26.948 8.338 1.00 61.14 H new ATOM 0 HH TYR A 905 -6.969 -25.859 6.243 1.00 33.11 H new ATOM 1855 N SER A 906 -9.107 -25.987 14.803 1.00 33.14 N ATOM 1856 CA SER A 906 -9.186 -26.066 16.252 1.00 22.11 C ATOM 1857 C SER A 906 -8.416 -27.290 16.752 1.00 61.31 C ATOM 1858 O SER A 906 -7.548 -27.172 17.616 1.00 74.31 O ATOM 1859 CB SER A 906 -10.640 -26.126 16.722 1.00 14.55 C ATOM 1860 OG SER A 906 -11.224 -24.829 16.818 1.00 40.01 O ATOM 0 H SER A 906 -9.543 -26.765 14.309 1.00 33.14 H new ATOM 0 HA SER A 906 -8.735 -25.165 16.668 1.00 22.11 H new ATOM 0 HB2 SER A 906 -11.220 -26.735 16.028 1.00 14.55 H new ATOM 0 HB3 SER A 906 -10.687 -26.618 17.694 1.00 14.55 H new ATOM 0 HG SER A 906 -12.153 -24.910 17.119 1.00 40.01 H new ATOM 1866 N LYS A 907 -8.761 -28.438 16.187 1.00 52.21 N ATOM 1867 CA LYS A 907 -8.113 -29.683 16.564 1.00 15.42 C ATOM 1868 C LYS A 907 -7.597 -30.385 15.307 1.00 30.21 C ATOM 1869 O LYS A 907 -8.122 -30.176 14.215 1.00 74.33 O ATOM 1870 CB LYS A 907 -9.057 -30.544 17.406 1.00 1.34 C ATOM 1871 CG LYS A 907 -8.272 -31.439 18.367 1.00 5.32 C ATOM 1872 CD LYS A 907 -8.023 -30.728 19.699 1.00 21.11 C ATOM 1873 CE LYS A 907 -6.915 -29.682 19.564 1.00 41.22 C ATOM 1874 NZ LYS A 907 -5.787 -30.221 18.771 1.00 54.53 N ATOM 0 H LYS A 907 -9.481 -28.532 15.471 1.00 52.21 H new ATOM 0 HA LYS A 907 -7.248 -29.486 17.197 1.00 15.42 H new ATOM 0 HB2 LYS A 907 -9.733 -29.903 17.971 1.00 1.34 H new ATOM 0 HB3 LYS A 907 -9.674 -31.160 16.752 1.00 1.34 H new ATOM 0 HG2 LYS A 907 -8.823 -32.363 18.541 1.00 5.32 H new ATOM 0 HG3 LYS A 907 -7.320 -31.717 17.915 1.00 5.32 H new ATOM 0 HD2 LYS A 907 -8.942 -30.248 20.036 1.00 21.11 H new ATOM 0 HD3 LYS A 907 -7.747 -31.459 20.459 1.00 21.11 H new ATOM 0 HE2 LYS A 907 -7.309 -28.786 19.084 1.00 41.22 H new ATOM 0 HE3 LYS A 907 -6.564 -29.386 20.552 1.00 41.22 H new ATOM 0 HZ1 LYS A 907 -4.890 -29.858 19.152 1.00 54.53 H new ATOM 0 HZ2 LYS A 907 -5.790 -31.260 18.824 1.00 54.53 H new ATOM 0 HZ3 LYS A 907 -5.887 -29.925 17.779 1.00 54.53 H new ATOM 1887 N TRP A 908 -6.574 -31.204 15.503 1.00 10.15 N ATOM 1888 CA TRP A 908 -5.981 -31.939 14.399 1.00 3.41 C ATOM 1889 C TRP A 908 -7.087 -32.751 13.723 1.00 52.42 C ATOM 1890 O TRP A 908 -7.007 -33.043 12.531 1.00 72.22 O ATOM 1891 CB TRP A 908 -4.814 -32.803 14.880 1.00 64.11 C ATOM 1892 CG TRP A 908 -3.979 -32.160 15.990 1.00 61.45 C ATOM 1893 CD1 TRP A 908 -3.003 -31.251 15.866 1.00 43.21 C ATOM 1894 CD2 TRP A 908 -4.088 -32.417 17.406 1.00 65.24 C ATOM 1895 NE1 TRP A 908 -2.476 -30.904 17.094 1.00 52.04 N ATOM 1896 CE2 TRP A 908 -3.157 -31.636 18.060 1.00 50.25 C ATOM 1897 CE3 TRP A 908 -4.944 -33.281 18.110 1.00 20.25 C ATOM 1898 CZ2 TRP A 908 -2.994 -31.640 19.450 1.00 64.20 C ATOM 1899 CZ3 TRP A 908 -4.768 -33.274 19.499 1.00 30.14 C ATOM 1900 CH2 TRP A 908 -3.836 -32.493 20.173 1.00 62.41 C ATOM 0 H TRP A 908 -6.141 -31.375 16.410 1.00 10.15 H new ATOM 0 HA TRP A 908 -5.554 -31.255 13.666 1.00 3.41 H new ATOM 0 HB2 TRP A 908 -5.204 -33.755 15.239 1.00 64.11 H new ATOM 0 HB3 TRP A 908 -4.165 -33.023 14.032 1.00 64.11 H new ATOM 0 HD1 TRP A 908 -2.670 -30.841 14.924 1.00 43.21 H new ATOM 0 HE1 TRP A 908 -1.725 -30.234 17.262 1.00 52.04 H new ATOM 0 HE3 TRP A 908 -5.679 -33.901 17.619 1.00 20.25 H new ATOM 0 HZ2 TRP A 908 -2.258 -31.018 19.938 1.00 64.20 H new ATOM 0 HZ3 TRP A 908 -5.401 -33.921 20.088 1.00 30.14 H new ATOM 0 HH2 TRP A 908 -3.762 -32.544 21.249 1.00 62.41 H new ATOM 1911 N LYS A 909 -8.094 -33.092 14.513 1.00 13.42 N ATOM 1912 CA LYS A 909 -9.216 -33.864 14.006 1.00 64.12 C ATOM 1913 C LYS A 909 -9.608 -33.338 12.624 1.00 50.22 C ATOM 1914 O LYS A 909 -9.755 -34.112 11.679 1.00 22.24 O ATOM 1915 CB LYS A 909 -10.367 -33.863 15.014 1.00 64.32 C ATOM 1916 CG LYS A 909 -9.852 -34.106 16.434 1.00 2.11 C ATOM 1917 CD LYS A 909 -8.790 -35.207 16.452 1.00 61.32 C ATOM 1918 CE LYS A 909 -9.320 -36.490 15.808 1.00 61.02 C ATOM 1919 NZ LYS A 909 -8.199 -37.368 15.403 1.00 52.35 N ATOM 0 H LYS A 909 -8.157 -32.848 15.501 1.00 13.42 H new ATOM 0 HA LYS A 909 -8.934 -34.909 13.881 1.00 64.12 H new ATOM 0 HB2 LYS A 909 -10.891 -32.908 14.972 1.00 64.32 H new ATOM 0 HB3 LYS A 909 -11.089 -34.635 14.748 1.00 64.32 H new ATOM 0 HG2 LYS A 909 -9.431 -33.184 16.835 1.00 2.11 H new ATOM 0 HG3 LYS A 909 -10.682 -34.386 17.083 1.00 2.11 H new ATOM 0 HD2 LYS A 909 -7.901 -34.869 15.919 1.00 61.32 H new ATOM 0 HD3 LYS A 909 -8.488 -35.409 17.480 1.00 61.32 H new ATOM 0 HE2 LYS A 909 -9.966 -37.016 16.510 1.00 61.02 H new ATOM 0 HE3 LYS A 909 -9.929 -36.243 14.938 1.00 61.02 H new ATOM 0 HZ1 LYS A 909 -8.576 -38.234 14.968 1.00 52.35 H new ATOM 0 HZ2 LYS A 909 -7.598 -36.869 14.717 1.00 52.35 H new ATOM 0 HZ3 LYS A 909 -7.634 -37.619 16.240 1.00 52.35 H new ATOM 1932 N ASP A 910 -9.767 -32.025 12.549 1.00 3.41 N ATOM 1933 CA ASP A 910 -10.139 -31.386 11.298 1.00 13.34 C ATOM 1934 C ASP A 910 -8.874 -31.046 10.507 1.00 34.34 C ATOM 1935 O ASP A 910 -8.756 -29.952 9.959 1.00 50.13 O ATOM 1936 CB ASP A 910 -10.903 -30.084 11.551 1.00 65.02 C ATOM 1937 CG ASP A 910 -12.155 -30.226 12.418 1.00 22.43 C ATOM 1938 OD1 ASP A 910 -13.266 -29.870 11.999 1.00 10.01 O ATOM 1939 OD2 ASP A 910 -11.954 -30.735 13.587 1.00 44.42 O ATOM 0 H ASP A 910 -9.645 -31.386 13.334 1.00 3.41 H new ATOM 0 HA ASP A 910 -10.775 -32.076 10.743 1.00 13.34 H new ATOM 0 HB2 ASP A 910 -10.229 -29.372 12.027 1.00 65.02 H new ATOM 0 HB3 ASP A 910 -11.191 -29.657 10.590 1.00 65.02 H new ATOM 1945 N PHE A 911 -7.961 -32.005 10.474 1.00 23.21 N ATOM 1946 CA PHE A 911 -6.709 -31.822 9.759 1.00 1.34 C ATOM 1947 C PHE A 911 -6.957 -31.606 8.265 1.00 31.11 C ATOM 1948 O PHE A 911 -7.997 -32.004 7.741 1.00 4.42 O ATOM 1949 CB PHE A 911 -5.894 -33.102 9.949 1.00 23.34 C ATOM 1950 CG PHE A 911 -6.694 -34.388 9.728 1.00 4.25 C ATOM 1951 CD1 PHE A 911 -7.203 -34.669 8.499 1.00 15.33 C ATOM 1952 CD2 PHE A 911 -6.895 -35.249 10.761 1.00 21.43 C ATOM 1953 CE1 PHE A 911 -7.946 -35.862 8.294 1.00 1.44 C ATOM 1954 CE2 PHE A 911 -7.637 -36.442 10.556 1.00 35.33 C ATOM 1955 CZ PHE A 911 -8.147 -36.723 9.327 1.00 33.21 C ATOM 0 H PHE A 911 -8.063 -32.911 10.931 1.00 23.21 H new ATOM 0 HA PHE A 911 -6.186 -30.946 10.143 1.00 1.34 H new ATOM 0 HB2 PHE A 911 -5.050 -33.089 9.260 1.00 23.34 H new ATOM 0 HB3 PHE A 911 -5.482 -33.112 10.958 1.00 23.34 H new ATOM 0 HD1 PHE A 911 -7.042 -33.985 7.679 1.00 15.33 H new ATOM 0 HD2 PHE A 911 -6.490 -35.025 11.737 1.00 21.43 H new ATOM 0 HE1 PHE A 911 -8.351 -36.085 7.318 1.00 1.44 H new ATOM 0 HE2 PHE A 911 -7.796 -37.126 11.376 1.00 35.33 H new ATOM 0 HZ PHE A 911 -8.712 -37.630 9.171 1.00 33.21 H new ATOM 1965 N HIS A 912 -5.985 -30.977 7.621 1.00 20.31 N ATOM 1966 CA HIS A 912 -6.085 -30.704 6.197 1.00 21.14 C ATOM 1967 C HIS A 912 -4.784 -31.114 5.504 1.00 74.44 C ATOM 1968 O HIS A 912 -4.462 -30.606 4.431 1.00 63.31 O ATOM 1969 CB HIS A 912 -6.453 -29.240 5.950 1.00 44.22 C ATOM 1970 CG HIS A 912 -6.952 -28.960 4.552 1.00 11.14 C ATOM 1971 ND1 HIS A 912 -6.638 -29.762 3.469 1.00 34.44 N ATOM 1972 CD2 HIS A 912 -7.746 -27.960 4.074 1.00 53.25 C ATOM 1973 CE1 HIS A 912 -7.222 -29.258 2.392 1.00 1.12 C ATOM 1974 NE2 HIS A 912 -7.908 -28.141 2.769 1.00 43.54 N ATOM 0 H HIS A 912 -5.124 -30.649 8.059 1.00 20.31 H new ATOM 0 HA HIS A 912 -6.889 -31.298 5.764 1.00 21.14 H new ATOM 0 HB2 HIS A 912 -7.220 -28.943 6.665 1.00 44.22 H new ATOM 0 HB3 HIS A 912 -5.579 -28.618 6.144 1.00 44.22 H new ATOM 0 HD1 HIS A 912 -6.056 -30.599 3.495 1.00 34.44 H new ATOM 0 HD2 HIS A 912 -8.171 -27.157 4.658 1.00 53.25 H new ATOM 0 HE1 HIS A 912 -7.165 -29.661 1.392 1.00 1.12 H new ATOM 1982 N PHE A 913 -4.073 -32.030 6.145 1.00 61.05 N ATOM 1983 CA PHE A 913 -2.815 -32.515 5.603 1.00 43.44 C ATOM 1984 C PHE A 913 -2.820 -34.040 5.485 1.00 25.12 C ATOM 1985 O PHE A 913 -3.839 -34.682 5.732 1.00 74.04 O ATOM 1986 CB PHE A 913 -1.715 -32.094 6.580 1.00 53.44 C ATOM 1987 CG PHE A 913 -1.741 -30.607 6.942 1.00 21.33 C ATOM 1988 CD1 PHE A 913 -1.336 -29.679 6.035 1.00 41.21 C ATOM 1989 CD2 PHE A 913 -2.169 -30.215 8.172 1.00 3.23 C ATOM 1990 CE1 PHE A 913 -1.360 -28.299 6.372 1.00 62.54 C ATOM 1991 CE2 PHE A 913 -2.192 -28.836 8.509 1.00 55.41 C ATOM 1992 CZ PHE A 913 -1.788 -27.907 7.601 1.00 4.05 C ATOM 0 H PHE A 913 -4.344 -32.449 7.035 1.00 61.05 H new ATOM 0 HA PHE A 913 -2.655 -32.101 4.607 1.00 43.44 H new ATOM 0 HB2 PHE A 913 -1.810 -32.682 7.493 1.00 53.44 H new ATOM 0 HB3 PHE A 913 -0.745 -32.335 6.145 1.00 53.44 H new ATOM 0 HD1 PHE A 913 -0.996 -29.991 5.058 1.00 41.21 H new ATOM 0 HD2 PHE A 913 -2.491 -30.952 8.892 1.00 3.23 H new ATOM 0 HE1 PHE A 913 -1.038 -27.562 5.652 1.00 62.54 H new ATOM 0 HE2 PHE A 913 -2.530 -28.525 9.486 1.00 55.41 H new ATOM 0 HZ PHE A 913 -1.807 -26.858 7.857 1.00 4.05 H new ATOM 2002 N GLU A 914 -1.668 -34.576 5.109 1.00 61.32 N ATOM 2003 CA GLU A 914 -1.527 -36.014 4.956 1.00 65.42 C ATOM 2004 C GLU A 914 -0.214 -36.488 5.583 1.00 32.54 C ATOM 2005 O GLU A 914 0.690 -35.688 5.819 1.00 32.43 O ATOM 2006 CB GLU A 914 -1.608 -36.420 3.483 1.00 44.43 C ATOM 2007 CG GLU A 914 -0.254 -36.246 2.791 1.00 21.20 C ATOM 2008 CD GLU A 914 -0.421 -36.163 1.272 1.00 2.14 C ATOM 2009 OE1 GLU A 914 -0.719 -35.084 0.740 1.00 41.52 O ATOM 2010 OE2 GLU A 914 -0.228 -37.271 0.641 1.00 33.31 O ATOM 0 H GLU A 914 -0.824 -34.040 4.906 1.00 61.32 H new ATOM 0 HA GLU A 914 -2.353 -36.498 5.478 1.00 65.42 H new ATOM 0 HB2 GLU A 914 -1.929 -37.459 3.406 1.00 44.43 H new ATOM 0 HB3 GLU A 914 -2.360 -35.815 2.976 1.00 44.43 H new ATOM 0 HG2 GLU A 914 0.232 -35.342 3.157 1.00 21.20 H new ATOM 0 HG3 GLU A 914 0.398 -37.082 3.044 1.00 21.20 H new ATOM 2018 N LYS A 915 -0.151 -37.788 5.836 1.00 14.40 N ATOM 2019 CA LYS A 915 1.035 -38.378 6.432 1.00 43.33 C ATOM 2020 C LYS A 915 2.144 -38.455 5.380 1.00 73.40 C ATOM 2021 O LYS A 915 1.941 -39.007 4.299 1.00 4.42 O ATOM 2022 CB LYS A 915 0.699 -39.726 7.072 1.00 64.11 C ATOM 2023 CG LYS A 915 0.088 -40.683 6.046 1.00 23.02 C ATOM 2024 CD LYS A 915 0.485 -42.131 6.343 1.00 55.31 C ATOM 2025 CE LYS A 915 1.787 -42.500 5.629 1.00 14.04 C ATOM 2026 NZ LYS A 915 1.546 -42.701 4.183 1.00 41.51 N ATOM 0 H LYS A 915 -0.903 -38.449 5.639 1.00 14.40 H new ATOM 0 HA LYS A 915 1.407 -37.751 7.242 1.00 43.33 H new ATOM 0 HB2 LYS A 915 1.602 -40.167 7.494 1.00 64.11 H new ATOM 0 HB3 LYS A 915 0.002 -39.577 7.896 1.00 64.11 H new ATOM 0 HG2 LYS A 915 -0.998 -40.590 6.058 1.00 23.02 H new ATOM 0 HG3 LYS A 915 0.420 -40.409 5.045 1.00 23.02 H new ATOM 0 HD2 LYS A 915 0.605 -42.266 7.418 1.00 55.31 H new ATOM 0 HD3 LYS A 915 -0.312 -42.803 6.024 1.00 55.31 H new ATOM 0 HE2 LYS A 915 2.525 -41.711 5.774 1.00 14.04 H new ATOM 0 HE3 LYS A 915 2.202 -43.409 6.064 1.00 14.04 H new ATOM 0 HZ1 LYS A 915 2.353 -43.205 3.763 1.00 41.51 H new ATOM 0 HZ2 LYS A 915 0.681 -43.262 4.050 1.00 41.51 H new ATOM 0 HZ3 LYS A 915 1.435 -41.777 3.718 1.00 41.51 H new ATOM 2039 N ILE A 916 3.291 -37.895 5.733 1.00 22.15 N ATOM 2040 CA ILE A 916 4.432 -37.894 4.834 1.00 60.05 C ATOM 2041 C ILE A 916 5.692 -38.276 5.613 1.00 34.34 C ATOM 2042 O ILE A 916 5.866 -37.863 6.759 1.00 62.52 O ATOM 2043 CB ILE A 916 4.541 -36.551 4.109 1.00 63.03 C ATOM 2044 CG1 ILE A 916 3.251 -36.229 3.353 1.00 74.33 C ATOM 2045 CG2 ILE A 916 5.766 -36.521 3.191 1.00 35.15 C ATOM 2046 CD1 ILE A 916 3.143 -34.731 3.065 1.00 50.44 C ATOM 0 H ILE A 916 3.455 -37.438 6.630 1.00 22.15 H new ATOM 0 HA ILE A 916 4.301 -38.643 4.053 1.00 60.05 H new ATOM 0 HB ILE A 916 4.679 -35.770 4.857 1.00 63.03 H new ATOM 0 HG12 ILE A 916 3.226 -36.786 2.416 1.00 74.33 H new ATOM 0 HG13 ILE A 916 2.391 -36.553 3.939 1.00 74.33 H new ATOM 0 HG21 ILE A 916 5.820 -35.556 2.688 1.00 35.15 H new ATOM 0 HG22 ILE A 916 6.668 -36.672 3.783 1.00 35.15 H new ATOM 0 HG23 ILE A 916 5.683 -37.314 2.447 1.00 35.15 H new ATOM 0 HD11 ILE A 916 2.217 -34.530 2.527 1.00 50.44 H new ATOM 0 HD12 ILE A 916 3.144 -34.179 4.005 1.00 50.44 H new ATOM 0 HD13 ILE A 916 3.991 -34.415 2.458 1.00 50.44 H new ATOM 2058 N PRO A 917 6.560 -39.082 4.944 1.00 14.52 N ATOM 2059 CA PRO A 917 7.798 -39.524 5.562 1.00 31.21 C ATOM 2060 C PRO A 917 8.826 -38.392 5.603 1.00 51.42 C ATOM 2061 O PRO A 917 9.226 -37.874 4.561 1.00 13.32 O ATOM 2062 CB PRO A 917 8.253 -40.710 4.727 1.00 52.55 C ATOM 2063 CG PRO A 917 7.509 -40.599 3.406 1.00 55.42 C ATOM 2064 CD PRO A 917 6.386 -39.590 3.587 1.00 72.12 C ATOM 0 HA PRO A 917 7.667 -39.814 6.604 1.00 31.21 H new ATOM 0 HB2 PRO A 917 9.332 -40.687 4.571 1.00 52.55 H new ATOM 0 HB3 PRO A 917 8.023 -41.651 5.227 1.00 52.55 H new ATOM 0 HG2 PRO A 917 8.185 -40.280 2.613 1.00 55.42 H new ATOM 0 HG3 PRO A 917 7.107 -41.569 3.111 1.00 55.42 H new ATOM 0 HD2 PRO A 917 6.452 -38.788 2.852 1.00 72.12 H new ATOM 0 HD3 PRO A 917 5.409 -40.058 3.461 1.00 72.12 H new ATOM 2072 N PHE A 918 9.224 -38.041 6.817 1.00 44.44 N ATOM 2073 CA PHE A 918 10.198 -36.979 7.007 1.00 63.03 C ATOM 2074 C PHE A 918 11.534 -37.336 6.351 1.00 31.45 C ATOM 2075 O PHE A 918 12.043 -38.442 6.533 1.00 15.52 O ATOM 2076 CB PHE A 918 10.408 -36.829 8.515 1.00 74.02 C ATOM 2077 CG PHE A 918 10.885 -35.439 8.942 1.00 75.24 C ATOM 2078 CD1 PHE A 918 12.011 -34.909 8.394 1.00 54.34 C ATOM 2079 CD2 PHE A 918 10.183 -34.734 9.869 1.00 75.50 C ATOM 2080 CE1 PHE A 918 12.453 -33.619 8.790 1.00 42.03 C ATOM 2081 CE2 PHE A 918 10.625 -33.445 10.265 1.00 2.32 C ATOM 2082 CZ PHE A 918 11.751 -32.914 9.717 1.00 22.21 C ATOM 0 H PHE A 918 8.890 -38.473 7.679 1.00 44.44 H new ATOM 0 HA PHE A 918 9.836 -36.057 6.553 1.00 63.03 H new ATOM 0 HB2 PHE A 918 9.472 -37.053 9.026 1.00 74.02 H new ATOM 0 HB3 PHE A 918 11.137 -37.569 8.845 1.00 74.02 H new ATOM 0 HD1 PHE A 918 12.569 -35.469 7.658 1.00 54.34 H new ATOM 0 HD2 PHE A 918 9.289 -35.155 10.304 1.00 75.50 H new ATOM 0 HE1 PHE A 918 13.347 -33.198 8.355 1.00 42.03 H new ATOM 0 HE2 PHE A 918 10.067 -32.886 11.002 1.00 2.32 H new ATOM 0 HZ PHE A 918 12.087 -31.933 10.018 1.00 22.21 H new ATOM 2092 N ASP A 919 12.064 -36.380 5.603 1.00 71.32 N ATOM 2093 CA ASP A 919 13.331 -36.580 4.920 1.00 74.44 C ATOM 2094 C ASP A 919 14.440 -35.861 5.690 1.00 53.02 C ATOM 2095 O ASP A 919 14.337 -34.666 5.962 1.00 40.25 O ATOM 2096 CB ASP A 919 13.289 -36.005 3.503 1.00 50.33 C ATOM 2097 CG ASP A 919 12.910 -37.005 2.409 1.00 23.40 C ATOM 2098 OD1 ASP A 919 11.852 -36.887 1.773 1.00 3.24 O ATOM 2099 OD2 ASP A 919 13.765 -37.952 2.216 1.00 23.05 O ATOM 0 H ASP A 919 11.639 -35.465 5.455 1.00 71.32 H new ATOM 0 HA ASP A 919 13.521 -37.652 4.869 1.00 74.44 H new ATOM 0 HB2 ASP A 919 12.576 -35.180 3.483 1.00 50.33 H new ATOM 0 HB3 ASP A 919 14.268 -35.586 3.268 1.00 50.33 H new ATOM 2105 N PRO A 920 15.502 -36.639 6.029 1.00 62.44 N ATOM 2106 CA PRO A 920 16.629 -36.089 6.762 1.00 23.21 C ATOM 2107 C PRO A 920 17.507 -35.227 5.853 1.00 40.22 C ATOM 2108 O PRO A 920 18.386 -34.511 6.330 1.00 65.31 O ATOM 2109 CB PRO A 920 17.362 -37.298 7.322 1.00 14.45 C ATOM 2110 CG PRO A 920 16.891 -38.488 6.502 1.00 41.50 C ATOM 2111 CD PRO A 920 15.658 -38.059 5.724 1.00 40.44 C ATOM 0 HA PRO A 920 16.321 -35.419 7.565 1.00 23.21 H new ATOM 0 HB2 PRO A 920 18.442 -37.172 7.242 1.00 14.45 H new ATOM 0 HB3 PRO A 920 17.135 -37.437 8.379 1.00 14.45 H new ATOM 0 HG2 PRO A 920 17.676 -38.817 5.822 1.00 41.50 H new ATOM 0 HG3 PRO A 920 16.658 -39.331 7.152 1.00 41.50 H new ATOM 0 HD2 PRO A 920 15.788 -38.222 4.654 1.00 40.44 H new ATOM 0 HD3 PRO A 920 14.780 -38.628 6.029 1.00 40.44 H new ATOM 2119 N ALA A 921 17.237 -35.323 4.559 1.00 24.12 N ATOM 2120 CA ALA A 921 17.992 -34.561 3.579 1.00 54.52 C ATOM 2121 C ALA A 921 17.578 -33.089 3.655 1.00 20.54 C ATOM 2122 O ALA A 921 18.329 -32.207 3.242 1.00 22.52 O ATOM 2123 CB ALA A 921 17.770 -35.157 2.187 1.00 14.14 C ATOM 0 H ALA A 921 16.506 -35.917 4.167 1.00 24.12 H new ATOM 0 HA ALA A 921 19.060 -34.615 3.791 1.00 54.52 H new ATOM 0 HB1 ALA A 921 18.336 -34.585 1.452 1.00 14.14 H new ATOM 0 HB2 ALA A 921 18.106 -36.194 2.177 1.00 14.14 H new ATOM 0 HB3 ALA A 921 16.709 -35.117 1.939 1.00 14.14 H new ATOM 2129 N GLU A 922 16.384 -32.870 4.187 1.00 24.41 N ATOM 2130 CA GLU A 922 15.862 -31.521 4.323 1.00 31.42 C ATOM 2131 C GLU A 922 16.458 -30.844 5.559 1.00 53.53 C ATOM 2132 O GLU A 922 16.919 -29.706 5.485 1.00 50.40 O ATOM 2133 CB GLU A 922 14.333 -31.529 4.386 1.00 63.23 C ATOM 2134 CG GLU A 922 13.747 -32.501 3.360 1.00 65.25 C ATOM 2135 CD GLU A 922 12.826 -31.773 2.379 1.00 35.40 C ATOM 2136 OE1 GLU A 922 12.361 -30.662 2.673 1.00 4.21 O ATOM 2137 OE2 GLU A 922 12.597 -32.403 1.276 1.00 14.44 O ATOM 0 H GLU A 922 15.764 -33.604 4.529 1.00 24.41 H new ATOM 0 HA GLU A 922 16.154 -30.948 3.443 1.00 31.42 H new ATOM 0 HB2 GLU A 922 14.008 -31.812 5.387 1.00 63.23 H new ATOM 0 HB3 GLU A 922 13.953 -30.525 4.200 1.00 63.23 H new ATOM 0 HG2 GLU A 922 14.554 -32.988 2.813 1.00 65.25 H new ATOM 0 HG3 GLU A 922 13.191 -33.285 3.873 1.00 65.25 H new ATOM 2145 N MET A 923 16.429 -31.571 6.665 1.00 34.24 N ATOM 2146 CA MET A 923 16.960 -31.054 7.915 1.00 21.42 C ATOM 2147 C MET A 923 18.483 -30.919 7.849 1.00 33.43 C ATOM 2148 O MET A 923 19.048 -29.961 8.374 1.00 32.21 O ATOM 2149 CB MET A 923 16.580 -31.996 9.060 1.00 52.42 C ATOM 2150 CG MET A 923 17.496 -33.221 9.090 1.00 43.52 C ATOM 2151 SD MET A 923 17.087 -34.255 10.486 1.00 71.25 S ATOM 2152 CE MET A 923 15.307 -34.128 10.454 1.00 13.12 C ATOM 0 H MET A 923 16.046 -32.515 6.722 1.00 34.24 H new ATOM 0 HA MET A 923 16.533 -30.066 8.089 1.00 21.42 H new ATOM 0 HB2 MET A 923 16.646 -31.465 10.010 1.00 52.42 H new ATOM 0 HB3 MET A 923 15.544 -32.315 8.945 1.00 52.42 H new ATOM 0 HG2 MET A 923 17.390 -33.787 8.164 1.00 43.52 H new ATOM 0 HG3 MET A 923 18.537 -32.905 9.154 1.00 43.52 H new ATOM 0 HE1 MET A 923 14.879 -34.827 11.173 1.00 13.12 H new ATOM 0 HE2 MET A 923 15.010 -33.112 10.715 1.00 13.12 H new ATOM 0 HE3 MET A 923 14.943 -34.367 9.455 1.00 13.12 H new ATOM 2162 N SER A 924 19.104 -31.893 7.200 1.00 34.43 N ATOM 2163 CA SER A 924 20.550 -31.895 7.059 1.00 32.30 C ATOM 2164 C SER A 924 20.944 -31.301 5.705 1.00 22.14 C ATOM 2165 O SER A 924 20.086 -31.043 4.863 1.00 71.11 O ATOM 2166 CB SER A 924 21.115 -33.310 7.203 1.00 42.32 C ATOM 2167 OG SER A 924 22.536 -33.308 7.314 1.00 50.12 O ATOM 0 H SER A 924 18.632 -32.686 6.766 1.00 34.43 H new ATOM 0 HA SER A 924 20.973 -31.281 7.855 1.00 32.30 H new ATOM 0 HB2 SER A 924 20.683 -33.785 8.084 1.00 42.32 H new ATOM 0 HB3 SER A 924 20.819 -33.908 6.341 1.00 42.32 H new ATOM 0 HG SER A 924 22.858 -34.229 7.406 1.00 50.12 H new ATOM 2173 N LYS A 925 22.243 -31.101 5.539 1.00 63.22 N ATOM 2174 CA LYS A 925 22.762 -30.542 4.302 1.00 71.21 C ATOM 2175 C LYS A 925 22.009 -31.151 3.117 1.00 24.11 C ATOM 2176 O LYS A 925 21.552 -30.431 2.231 1.00 4.20 O ATOM 2177 CB LYS A 925 24.279 -30.725 4.226 1.00 1.32 C ATOM 2178 CG LYS A 925 24.829 -30.197 2.900 1.00 63.25 C ATOM 2179 CD LYS A 925 26.320 -29.873 3.014 1.00 22.33 C ATOM 2180 CE LYS A 925 27.109 -31.088 3.508 1.00 13.23 C ATOM 2181 NZ LYS A 925 28.514 -31.015 3.049 1.00 11.04 N ATOM 0 H LYS A 925 22.952 -31.316 6.240 1.00 63.22 H new ATOM 0 HA LYS A 925 22.592 -29.466 4.270 1.00 71.21 H new ATOM 0 HB2 LYS A 925 24.754 -30.201 5.055 1.00 1.32 H new ATOM 0 HB3 LYS A 925 24.527 -31.781 4.332 1.00 1.32 H new ATOM 0 HG2 LYS A 925 24.673 -30.939 2.117 1.00 63.25 H new ATOM 0 HG3 LYS A 925 24.280 -29.302 2.605 1.00 63.25 H new ATOM 0 HD2 LYS A 925 26.702 -29.557 2.043 1.00 22.33 H new ATOM 0 HD3 LYS A 925 26.463 -29.038 3.700 1.00 22.33 H new ATOM 0 HE2 LYS A 925 27.078 -31.131 4.597 1.00 13.23 H new ATOM 0 HE3 LYS A 925 26.647 -32.004 3.139 1.00 13.23 H new ATOM 0 HZ1 LYS A 925 29.035 -31.847 3.393 1.00 11.04 H new ATOM 0 HZ2 LYS A 925 28.539 -30.996 2.009 1.00 11.04 H new ATOM 0 HZ3 LYS A 925 28.957 -30.151 3.422 1.00 11.04 H new