USER MOD reduce.3.24.130724 H: found=0, std=0, add=925, rem=0, adj=29 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 814 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 902 GLN : amide:sc= -1.74 X(o=-1.7,f=-1.8!) USER MOD Set 2.1: A 858 LYS NZ :NH3+ -175:sc= -0.0286 (180deg=0) USER MOD Set 2.2: A 861 LYS NZ :NH3+ -160:sc= -0.361 (180deg=-1.45!) USER MOD Set 3.1: A 829 CYS SG : rot 180:sc= -2.67! USER MOD Set 3.2: A 830 HIS : no HD1:sc= -5.73! C(o=-8.4!,f=-9.4!) USER MOD Set 3.3: A 879 TYR OH : rot 165:sc= 0 USER MOD Set 4.1: A 812 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 868 ASN : amide:sc= -0.0173 X(o=-0.15,f=-0.35) USER MOD Set 4.3: A 871 HIS : no HD1:sc= -0.134 X(o=-0.15,f=-0.65) USER MOD Set 5.1: A 810 CYS SG : rot 168:sc= 0.0599 USER MOD Set 5.2: A 864 CYS SG : rot 42:sc= 1.91 USER MOD Single : A 805 ASN : amide:sc= -8.62! C(o=-8.6!,f=-16!) USER MOD Single : A 806 LYS NZ :NH3+ -106:sc=-0.00162 (180deg=-1.5) USER MOD Single : A 807 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 813 CYS SG : rot 180:sc= -0.0749 USER MOD Single : A 818 CYS SG : rot 53:sc= -10.4! USER MOD Single : A 819 TYR OH : rot 180:sc= 0 USER MOD Single : A 820 THR OG1 : rot -151:sc= 0.253! USER MOD Single : A 831 TYR OH : rot -36:sc= -1.15 USER MOD Single : A 832 THR OG1 : rot 150:sc= -0.394 USER MOD Single : A 839 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 841 CYS SG : rot -154:sc= -0.0746 USER MOD Single : A 844 SER OG : rot -10:sc= 0.591 USER MOD Single : A 867 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 869 CYS SG : rot -1:sc= 1.05 USER MOD Single : A 870 SER OG : rot 180:sc= 0 USER MOD Single : A 876 HIS : no HD1:sc= -2.37 X(o=-2.4,f=-2.1) USER MOD Single : A 878 LYS NZ :NH3+ -139:sc= -0.636 (180deg=-2.63!) 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 -150:sc= -1.66! USER MOD Single : A 899 THR OG1 : rot 177:sc= -2.23 USER MOD Single : A 903 THR OG1 : rot 180:sc= -1.63! USER MOD Single : A 905 TYR OH : rot 180:sc= 0 USER MOD Single : A 906 SER OG : rot 180:sc= 0 USER MOD Single : A 907 LYS NZ :NH3+ -149:sc= -3.12! (180deg=-4.14!) USER MOD Single : A 909 LYS NZ :NH3+ -122:sc= -0.743 (180deg=-2.06!) USER MOD Single : A 912 HIS : no HD1:sc= -0.0671 X(o=-0.067,f=-0.11) USER MOD Single : A 915 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 923 MET CE :methyl -143:sc= -5.53! (180deg=-13.9!) USER MOD Single : A 924 SER OG : rot 180:sc= 0.023 USER MOD Single : A 925 LYS NZ :NH3+ -130:sc= -1.45 (180deg=-3.69!) USER MOD ----------------------------------------------------------------- ATOM 208 N ASN A 805 -2.952 -28.539 -1.922 1.00 4.24 N ATOM 209 CA ASN A 805 -2.278 -28.206 -0.678 1.00 34.34 C ATOM 210 C ASN A 805 -3.157 -27.252 0.134 1.00 75.42 C ATOM 211 O ASN A 805 -4.082 -26.645 -0.404 1.00 61.25 O ATOM 212 CB ASN A 805 -0.943 -27.508 -0.943 1.00 73.14 C ATOM 213 CG ASN A 805 -0.401 -26.859 0.331 1.00 25.14 C ATOM 214 OD1 ASN A 805 0.109 -27.516 1.225 1.00 51.43 O ATOM 215 ND2 ASN A 805 -0.538 -25.537 0.366 1.00 44.32 N ATOM 0 HA ASN A 805 -2.098 -29.133 -0.134 1.00 34.34 H new ATOM 0 HB2 ASN A 805 -0.220 -28.230 -1.323 1.00 73.14 H new ATOM 0 HB3 ASN A 805 -1.072 -26.749 -1.715 1.00 73.14 H new ATOM 0 HD21 ASN A 805 -0.207 -25.011 1.175 1.00 44.32 H new ATOM 0 HD22 ASN A 805 -0.974 -25.049 -0.416 1.00 44.32 H new ATOM 222 N LYS A 806 -2.838 -27.150 1.416 1.00 72.34 N ATOM 223 CA LYS A 806 -3.587 -26.281 2.306 1.00 14.45 C ATOM 224 C LYS A 806 -2.614 -25.386 3.077 1.00 61.32 C ATOM 225 O LYS A 806 -1.481 -25.783 3.345 1.00 2.30 O ATOM 226 CB LYS A 806 -4.511 -27.103 3.207 1.00 23.52 C ATOM 227 CG LYS A 806 -4.865 -26.332 4.480 1.00 53.00 C ATOM 228 CD LYS A 806 -6.190 -26.822 5.067 1.00 34.10 C ATOM 229 CE LYS A 806 -6.208 -28.348 5.183 1.00 2.40 C ATOM 230 NZ LYS A 806 -7.259 -28.783 6.129 1.00 33.40 N ATOM 0 H LYS A 806 -2.071 -27.655 1.859 1.00 72.34 H new ATOM 0 HA LYS A 806 -4.241 -25.623 1.733 1.00 14.45 H new ATOM 0 HB2 LYS A 806 -5.423 -27.355 2.665 1.00 23.52 H new ATOM 0 HB3 LYS A 806 -4.026 -28.043 3.470 1.00 23.52 H new ATOM 0 HG2 LYS A 806 -4.070 -26.453 5.216 1.00 53.00 H new ATOM 0 HG3 LYS A 806 -4.933 -25.267 4.257 1.00 53.00 H new ATOM 0 HD2 LYS A 806 -6.343 -26.377 6.050 1.00 34.10 H new ATOM 0 HD3 LYS A 806 -7.015 -26.492 4.436 1.00 34.10 H new ATOM 0 HE2 LYS A 806 -6.386 -28.791 4.203 1.00 2.40 H new ATOM 0 HE3 LYS A 806 -5.235 -28.704 5.522 1.00 2.40 H new ATOM 0 HZ1 LYS A 806 -6.818 -29.096 7.017 1.00 33.40 H new ATOM 0 HZ2 LYS A 806 -7.902 -27.989 6.323 1.00 33.40 H new ATOM 0 HZ3 LYS A 806 -7.797 -29.570 5.713 1.00 33.40 H new ATOM 243 N LYS A 807 -3.091 -24.196 3.411 1.00 34.50 N ATOM 244 CA LYS A 807 -2.277 -23.243 4.145 1.00 14.33 C ATOM 245 C LYS A 807 -2.611 -23.335 5.636 1.00 65.43 C ATOM 246 O LYS A 807 -3.693 -23.786 6.007 1.00 53.14 O ATOM 247 CB LYS A 807 -2.444 -21.837 3.564 1.00 22.11 C ATOM 248 CG LYS A 807 -1.843 -20.784 4.497 1.00 13.50 C ATOM 249 CD LYS A 807 -2.119 -19.371 3.978 1.00 11.23 C ATOM 250 CE LYS A 807 -1.743 -19.246 2.500 1.00 33.44 C ATOM 251 NZ LYS A 807 -1.948 -17.859 2.029 1.00 54.44 N ATOM 0 H LYS A 807 -4.031 -23.870 3.187 1.00 34.50 H new ATOM 0 HA LYS A 807 -1.219 -23.484 4.039 1.00 14.33 H new ATOM 0 HB2 LYS A 807 -1.960 -21.783 2.589 1.00 22.11 H new ATOM 0 HB3 LYS A 807 -3.502 -21.628 3.407 1.00 22.11 H new ATOM 0 HG2 LYS A 807 -2.263 -20.897 5.497 1.00 13.50 H new ATOM 0 HG3 LYS A 807 -0.768 -20.940 4.583 1.00 13.50 H new ATOM 0 HD2 LYS A 807 -3.174 -19.131 4.110 1.00 11.23 H new ATOM 0 HD3 LYS A 807 -1.552 -18.647 4.564 1.00 11.23 H new ATOM 0 HE2 LYS A 807 -0.701 -19.534 2.358 1.00 33.44 H new ATOM 0 HE3 LYS A 807 -2.347 -19.931 1.906 1.00 33.44 H new ATOM 0 HZ1 LYS A 807 -1.688 -17.792 1.024 1.00 54.44 H new ATOM 0 HZ2 LYS A 807 -2.947 -17.597 2.147 1.00 54.44 H new ATOM 0 HZ3 LYS A 807 -1.353 -17.212 2.585 1.00 54.44 H new ATOM 264 N LEU A 808 -1.660 -22.902 6.450 1.00 44.41 N ATOM 265 CA LEU A 808 -1.838 -22.930 7.892 1.00 55.03 C ATOM 266 C LEU A 808 -1.537 -21.544 8.466 1.00 74.21 C ATOM 267 O LEU A 808 -0.599 -20.879 8.031 1.00 2.31 O ATOM 268 CB LEU A 808 -1.000 -24.049 8.514 1.00 54.24 C ATOM 269 CG LEU A 808 -1.493 -25.475 8.262 1.00 73.20 C ATOM 270 CD1 LEU A 808 -0.858 -26.060 6.999 1.00 51.00 C ATOM 271 CD2 LEU A 808 -1.256 -26.362 9.486 1.00 4.52 C ATOM 0 H LEU A 808 -0.763 -22.530 6.138 1.00 44.41 H new ATOM 0 HA LEU A 808 -2.873 -23.161 8.143 1.00 55.03 H new ATOM 0 HB2 LEU A 808 0.019 -23.966 8.136 1.00 54.24 H new ATOM 0 HB3 LEU A 808 -0.955 -23.886 9.591 1.00 54.24 H new ATOM 0 HG LEU A 808 -2.569 -25.439 8.094 1.00 73.20 H new ATOM 0 HD11 LEU A 808 -1.226 -27.074 6.843 1.00 51.00 H new ATOM 0 HD12 LEU A 808 -1.121 -25.443 6.140 1.00 51.00 H new ATOM 0 HD13 LEU A 808 0.226 -26.080 7.113 1.00 51.00 H new ATOM 0 HD21 LEU A 808 -1.616 -27.370 9.280 1.00 4.52 H new ATOM 0 HD22 LEU A 808 -0.190 -26.396 9.710 1.00 4.52 H new ATOM 0 HD23 LEU A 808 -1.794 -25.953 10.341 1.00 4.52 H new ATOM 283 N LEU A 809 -2.352 -21.150 9.434 1.00 25.42 N ATOM 284 CA LEU A 809 -2.184 -19.856 10.072 1.00 11.25 C ATOM 285 C LEU A 809 -1.903 -20.059 11.563 1.00 65.35 C ATOM 286 O LEU A 809 -2.071 -21.160 12.085 1.00 12.01 O ATOM 287 CB LEU A 809 -3.392 -18.960 9.792 1.00 50.24 C ATOM 288 CG LEU A 809 -3.301 -18.083 8.541 1.00 64.32 C ATOM 289 CD1 LEU A 809 -3.466 -18.921 7.271 1.00 14.33 C ATOM 290 CD2 LEU A 809 -4.306 -16.932 8.603 1.00 13.14 C ATOM 0 H LEU A 809 -3.130 -21.704 9.791 1.00 25.42 H new ATOM 0 HA LEU A 809 -1.324 -19.334 9.653 1.00 11.25 H new ATOM 0 HB2 LEU A 809 -4.276 -19.592 9.705 1.00 50.24 H new ATOM 0 HB3 LEU A 809 -3.547 -18.312 10.655 1.00 50.24 H new ATOM 0 HG LEU A 809 -2.306 -17.639 8.507 1.00 64.32 H new ATOM 0 HD11 LEU A 809 -3.397 -18.274 6.397 1.00 14.33 H new ATOM 0 HD12 LEU A 809 -2.680 -19.674 7.227 1.00 14.33 H new ATOM 0 HD13 LEU A 809 -4.439 -19.412 7.283 1.00 14.33 H new ATOM 0 HD21 LEU A 809 -4.220 -16.325 7.702 1.00 13.14 H new ATOM 0 HD22 LEU A 809 -5.316 -17.335 8.674 1.00 13.14 H new ATOM 0 HD23 LEU A 809 -4.099 -16.315 9.477 1.00 13.14 H new ATOM 302 N CYS A 810 -1.478 -18.981 12.205 1.00 53.14 N ATOM 303 CA CYS A 810 -1.172 -19.027 13.624 1.00 23.22 C ATOM 304 C CYS A 810 -2.314 -18.352 14.385 1.00 55.33 C ATOM 305 O CYS A 810 -2.525 -17.147 14.254 1.00 51.10 O ATOM 306 CB CYS A 810 0.180 -18.380 13.932 1.00 20.03 C ATOM 307 SG CYS A 810 0.965 -19.219 15.357 1.00 43.15 S ATOM 0 H CYS A 810 -1.338 -18.070 11.768 1.00 53.14 H new ATOM 0 HA CYS A 810 -1.086 -20.065 13.946 1.00 23.22 H new ATOM 0 HB2 CYS A 810 0.830 -18.443 13.059 1.00 20.03 H new ATOM 0 HB3 CYS A 810 0.044 -17.321 14.152 1.00 20.03 H new ATOM 0 HG CYS A 810 2.204 -18.837 15.457 1.00 43.15 H new ATOM 313 N ARG A 811 -3.022 -19.157 15.163 1.00 74.22 N ATOM 314 CA ARG A 811 -4.138 -18.652 15.944 1.00 35.33 C ATOM 315 C ARG A 811 -3.756 -17.338 16.629 1.00 61.53 C ATOM 316 O ARG A 811 -4.620 -16.515 16.927 1.00 61.13 O ATOM 317 CB ARG A 811 -4.570 -19.666 17.006 1.00 13.42 C ATOM 318 CG ARG A 811 -5.709 -19.110 17.863 1.00 12.25 C ATOM 319 CD ARG A 811 -6.155 -20.131 18.912 1.00 74.24 C ATOM 320 NE ARG A 811 -7.337 -19.622 19.643 1.00 21.43 N ATOM 321 CZ ARG A 811 -7.284 -18.666 20.594 1.00 1.34 C ATOM 322 NH1 ARG A 811 -6.105 -18.105 20.937 1.00 23.13 N ATOM 323 NH2 ARG A 811 -8.402 -18.287 21.184 1.00 15.20 N ATOM 0 H ARG A 811 -2.844 -20.156 15.269 1.00 74.22 H new ATOM 0 HA ARG A 811 -4.970 -18.481 15.261 1.00 35.33 H new ATOM 0 HB2 ARG A 811 -4.890 -20.589 16.523 1.00 13.42 H new ATOM 0 HB3 ARG A 811 -3.721 -19.917 17.642 1.00 13.42 H new ATOM 0 HG2 ARG A 811 -5.384 -18.194 18.357 1.00 12.25 H new ATOM 0 HG3 ARG A 811 -6.553 -18.846 17.226 1.00 12.25 H new ATOM 0 HD2 ARG A 811 -6.395 -21.079 18.430 1.00 74.24 H new ATOM 0 HD3 ARG A 811 -5.341 -20.326 19.611 1.00 74.24 H new ATOM 0 HE ARG A 811 -8.248 -20.018 19.414 1.00 21.43 H new ATOM 0 HH11 ARG A 811 -5.245 -18.403 20.476 1.00 23.13 H new ATOM 0 HH12 ARG A 811 -6.074 -17.383 21.657 1.00 23.13 H new ATOM 0 HH21 ARG A 811 -9.289 -18.715 20.919 1.00 15.20 H new ATOM 0 HH22 ARG A 811 -8.379 -17.566 21.905 1.00 15.20 H new ATOM 336 N LYS A 812 -2.460 -17.183 16.858 1.00 33.11 N ATOM 337 CA LYS A 812 -1.953 -15.983 17.502 1.00 61.32 C ATOM 338 C LYS A 812 -2.675 -14.760 16.933 1.00 61.20 C ATOM 339 O LYS A 812 -3.540 -14.184 17.591 1.00 72.23 O ATOM 340 CB LYS A 812 -0.430 -15.912 17.377 1.00 43.43 C ATOM 341 CG LYS A 812 0.251 -16.642 18.536 1.00 13.24 C ATOM 342 CD LYS A 812 0.451 -15.707 19.731 1.00 44.22 C ATOM 343 CE LYS A 812 -0.761 -15.740 20.663 1.00 54.01 C ATOM 344 NZ LYS A 812 -0.361 -15.400 22.047 1.00 71.14 N ATOM 0 H LYS A 812 -1.746 -17.868 16.609 1.00 33.11 H new ATOM 0 HA LYS A 812 -2.161 -16.007 18.572 1.00 61.32 H new ATOM 0 HB2 LYS A 812 -0.118 -16.355 16.431 1.00 43.43 H new ATOM 0 HB3 LYS A 812 -0.111 -14.870 17.362 1.00 43.43 H new ATOM 0 HG2 LYS A 812 -0.353 -17.498 18.837 1.00 13.24 H new ATOM 0 HG3 LYS A 812 1.215 -17.031 18.209 1.00 13.24 H new ATOM 0 HD2 LYS A 812 1.345 -16.001 20.281 1.00 44.22 H new ATOM 0 HD3 LYS A 812 0.614 -14.689 19.377 1.00 44.22 H new ATOM 0 HE2 LYS A 812 -1.515 -15.036 20.313 1.00 54.01 H new ATOM 0 HE3 LYS A 812 -1.216 -16.730 20.643 1.00 54.01 H new ATOM 0 HZ1 LYS A 812 -1.196 -15.427 22.666 1.00 71.14 H new ATOM 0 HZ2 LYS A 812 0.342 -16.088 22.384 1.00 71.14 H new ATOM 0 HZ3 LYS A 812 0.052 -14.446 22.064 1.00 71.14 H new ATOM 357 N CYS A 813 -2.293 -14.400 15.717 1.00 43.23 N ATOM 358 CA CYS A 813 -2.893 -13.256 15.052 1.00 41.31 C ATOM 359 C CYS A 813 -3.447 -13.720 13.704 1.00 55.13 C ATOM 360 O CYS A 813 -3.632 -12.913 12.794 1.00 73.44 O ATOM 361 CB CYS A 813 -1.896 -12.106 14.894 1.00 64.25 C ATOM 362 SG CYS A 813 -0.882 -11.944 16.408 1.00 23.23 S ATOM 0 H CYS A 813 -1.575 -14.880 15.175 1.00 43.23 H new ATOM 0 HA CYS A 813 -3.706 -12.863 15.662 1.00 41.31 H new ATOM 0 HB2 CYS A 813 -1.252 -12.287 14.033 1.00 64.25 H new ATOM 0 HB3 CYS A 813 -2.430 -11.175 14.702 1.00 64.25 H new ATOM 0 HG CYS A 813 -0.038 -10.966 16.262 1.00 23.23 H new ATOM 368 N LYS A 814 -3.697 -15.018 13.618 1.00 34.21 N ATOM 369 CA LYS A 814 -4.227 -15.599 12.396 1.00 31.43 C ATOM 370 C LYS A 814 -3.371 -15.150 11.210 1.00 33.32 C ATOM 371 O LYS A 814 -3.836 -14.398 10.355 1.00 64.55 O ATOM 372 CB LYS A 814 -5.713 -15.266 12.244 1.00 5.53 C ATOM 373 CG LYS A 814 -6.375 -15.079 13.611 1.00 51.33 C ATOM 374 CD LYS A 814 -6.186 -16.319 14.486 1.00 71.41 C ATOM 375 CE LYS A 814 -7.236 -17.384 14.162 1.00 14.22 C ATOM 376 NZ LYS A 814 -8.430 -17.212 15.021 1.00 62.24 N ATOM 0 H LYS A 814 -3.542 -15.684 14.375 1.00 34.21 H new ATOM 0 HA LYS A 814 -4.171 -16.687 12.436 1.00 31.43 H new ATOM 0 HB2 LYS A 814 -5.827 -14.357 11.653 1.00 5.53 H new ATOM 0 HB3 LYS A 814 -6.215 -16.066 11.699 1.00 5.53 H new ATOM 0 HG2 LYS A 814 -5.948 -14.209 14.110 1.00 51.33 H new ATOM 0 HG3 LYS A 814 -7.439 -14.881 13.480 1.00 51.33 H new ATOM 0 HD2 LYS A 814 -5.188 -16.729 14.332 1.00 71.41 H new ATOM 0 HD3 LYS A 814 -6.257 -16.041 15.537 1.00 71.41 H new ATOM 0 HE2 LYS A 814 -7.522 -17.314 13.113 1.00 14.22 H new ATOM 0 HE3 LYS A 814 -6.813 -18.378 14.311 1.00 14.22 H new ATOM 0 HZ1 LYS A 814 -9.133 -17.942 14.789 1.00 62.24 H new ATOM 0 HZ2 LYS A 814 -8.155 -17.302 16.020 1.00 62.24 H new ATOM 0 HZ3 LYS A 814 -8.842 -16.271 14.859 1.00 62.24 H new ATOM 389 N ALA A 815 -2.136 -15.630 11.197 1.00 34.22 N ATOM 390 CA ALA A 815 -1.212 -15.287 10.130 1.00 25.43 C ATOM 391 C ALA A 815 -0.495 -16.553 9.656 1.00 73.52 C ATOM 392 O ALA A 815 -0.310 -17.492 10.428 1.00 25.45 O ATOM 393 CB ALA A 815 -0.237 -14.216 10.624 1.00 62.42 C ATOM 0 H ALA A 815 -1.754 -16.253 11.908 1.00 34.22 H new ATOM 0 HA ALA A 815 -1.748 -14.872 9.277 1.00 25.43 H new ATOM 0 HB1 ALA A 815 0.457 -13.958 9.824 1.00 62.42 H new ATOM 0 HB2 ALA A 815 -0.793 -13.327 10.922 1.00 62.42 H new ATOM 0 HB3 ALA A 815 0.321 -14.598 11.479 1.00 62.42 H new ATOM 399 N LEU A 816 -0.113 -16.538 8.388 1.00 65.35 N ATOM 400 CA LEU A 816 0.579 -17.674 7.801 1.00 42.41 C ATOM 401 C LEU A 816 1.601 -18.216 8.802 1.00 11.34 C ATOM 402 O LEU A 816 2.339 -17.448 9.418 1.00 21.54 O ATOM 403 CB LEU A 816 1.186 -17.291 6.449 1.00 31.34 C ATOM 404 CG LEU A 816 2.113 -18.329 5.813 1.00 51.23 C ATOM 405 CD1 LEU A 816 3.500 -18.293 6.456 1.00 3.43 C ATOM 406 CD2 LEU A 816 1.492 -19.726 5.868 1.00 53.03 C ATOM 0 H LEU A 816 -0.269 -15.758 7.750 1.00 65.35 H new ATOM 0 HA LEU A 816 -0.123 -18.481 7.593 1.00 42.41 H new ATOM 0 HB2 LEU A 816 0.373 -17.084 5.753 1.00 31.34 H new ATOM 0 HB3 LEU A 816 1.743 -16.362 6.573 1.00 31.34 H new ATOM 0 HG LEU A 816 2.239 -18.074 4.761 1.00 51.23 H new ATOM 0 HD11 LEU A 816 4.139 -19.040 5.985 1.00 3.43 H new ATOM 0 HD12 LEU A 816 3.938 -17.304 6.321 1.00 3.43 H new ATOM 0 HD13 LEU A 816 3.413 -18.509 7.521 1.00 3.43 H new ATOM 0 HD21 LEU A 816 2.171 -20.444 5.409 1.00 53.03 H new ATOM 0 HD22 LEU A 816 1.316 -20.005 6.907 1.00 53.03 H new ATOM 0 HD23 LEU A 816 0.546 -19.725 5.327 1.00 53.03 H new ATOM 418 N ALA A 817 1.611 -19.534 8.934 1.00 71.00 N ATOM 419 CA ALA A 817 2.530 -20.188 9.850 1.00 11.22 C ATOM 420 C ALA A 817 3.337 -21.242 9.090 1.00 3.01 C ATOM 421 O ALA A 817 4.551 -21.345 9.265 1.00 55.34 O ATOM 422 CB ALA A 817 1.746 -20.786 11.020 1.00 13.30 C ATOM 0 H ALA A 817 0.997 -20.167 8.422 1.00 71.00 H new ATOM 0 HA ALA A 817 3.236 -19.468 10.265 1.00 11.22 H new ATOM 0 HB1 ALA A 817 2.435 -21.277 11.707 1.00 13.30 H new ATOM 0 HB2 ALA A 817 1.214 -19.993 11.545 1.00 13.30 H new ATOM 0 HB3 ALA A 817 1.029 -21.515 10.643 1.00 13.30 H new ATOM 428 N CYS A 818 2.631 -21.999 8.263 1.00 44.32 N ATOM 429 CA CYS A 818 3.267 -23.041 7.475 1.00 23.34 C ATOM 430 C CYS A 818 2.257 -23.548 6.444 1.00 21.12 C ATOM 431 O CYS A 818 1.197 -22.951 6.263 1.00 42.12 O ATOM 432 CB CYS A 818 3.798 -24.173 8.358 1.00 1.42 C ATOM 433 SG CYS A 818 5.600 -23.978 8.608 1.00 25.12 S ATOM 0 H CYS A 818 1.625 -21.911 8.122 1.00 44.32 H new ATOM 0 HA CYS A 818 4.136 -22.632 6.960 1.00 23.34 H new ATOM 0 HB2 CYS A 818 3.286 -24.166 9.320 1.00 1.42 H new ATOM 0 HB3 CYS A 818 3.589 -25.137 7.893 1.00 1.42 H new ATOM 0 HG CYS A 818 5.850 -22.781 9.050 1.00 25.12 H new ATOM 439 N TYR A 819 2.621 -24.645 5.796 1.00 42.44 N ATOM 440 CA TYR A 819 1.760 -25.238 4.787 1.00 31.53 C ATOM 441 C TYR A 819 1.665 -26.755 4.971 1.00 43.51 C ATOM 442 O TYR A 819 2.572 -27.374 5.525 1.00 60.10 O ATOM 443 CB TYR A 819 2.420 -24.940 3.440 1.00 62.22 C ATOM 444 CG TYR A 819 2.384 -23.463 3.043 1.00 63.13 C ATOM 445 CD1 TYR A 819 1.248 -22.930 2.468 1.00 61.51 C ATOM 446 CD2 TYR A 819 3.488 -22.663 3.259 1.00 31.32 C ATOM 447 CE1 TYR A 819 1.214 -21.540 2.094 1.00 23.21 C ATOM 448 CE2 TYR A 819 3.454 -21.273 2.885 1.00 21.14 C ATOM 449 CZ TYR A 819 2.319 -20.780 2.321 1.00 30.14 C ATOM 450 OH TYR A 819 2.287 -19.467 1.968 1.00 30.24 O ATOM 0 H TYR A 819 3.500 -25.138 5.950 1.00 42.44 H new ATOM 0 HA TYR A 819 0.751 -24.831 4.856 1.00 31.53 H new ATOM 0 HB2 TYR A 819 3.458 -25.271 3.474 1.00 62.22 H new ATOM 0 HB3 TYR A 819 1.924 -25.526 2.666 1.00 62.22 H new ATOM 0 HD1 TYR A 819 0.384 -23.556 2.299 1.00 61.51 H new ATOM 0 HD2 TYR A 819 4.377 -23.080 3.709 1.00 31.32 H new ATOM 0 HE1 TYR A 819 0.331 -21.111 1.644 1.00 23.21 H new ATOM 0 HE2 TYR A 819 4.311 -20.636 3.049 1.00 21.14 H new ATOM 0 HH TYR A 819 3.145 -19.048 2.190 1.00 30.24 H new ATOM 460 N THR A 820 0.560 -27.308 4.495 1.00 34.22 N ATOM 461 CA THR A 820 0.335 -28.740 4.600 1.00 52.00 C ATOM 462 C THR A 820 1.204 -29.492 3.590 1.00 5.44 C ATOM 463 O THR A 820 1.380 -30.704 3.699 1.00 65.24 O ATOM 464 CB THR A 820 -1.163 -28.998 4.422 1.00 1.45 C ATOM 465 OG1 THR A 820 -1.444 -30.055 5.336 1.00 41.25 O ATOM 466 CG2 THR A 820 -1.497 -29.590 3.052 1.00 63.21 C ATOM 0 H THR A 820 -0.190 -26.791 4.036 1.00 34.22 H new ATOM 0 HA THR A 820 0.631 -29.115 5.580 1.00 52.00 H new ATOM 0 HB THR A 820 -1.710 -28.065 4.556 1.00 1.45 H new ATOM 0 HG1 THR A 820 -2.199 -30.584 5.002 1.00 41.25 H new ATOM 0 HG21 THR A 820 -2.572 -29.753 2.979 1.00 63.21 H new ATOM 0 HG22 THR A 820 -1.181 -28.899 2.270 1.00 63.21 H new ATOM 0 HG23 THR A 820 -0.976 -30.540 2.929 1.00 63.21 H new ATOM 474 N ALA A 821 1.725 -28.740 2.631 1.00 24.35 N ATOM 475 CA ALA A 821 2.573 -29.320 1.603 1.00 34.32 C ATOM 476 C ALA A 821 3.983 -29.519 2.163 1.00 73.24 C ATOM 477 O ALA A 821 4.834 -30.120 1.510 1.00 63.44 O ATOM 478 CB ALA A 821 2.558 -28.423 0.364 1.00 61.52 C ATOM 0 H ALA A 821 1.576 -27.735 2.544 1.00 24.35 H new ATOM 0 HA ALA A 821 2.198 -30.298 1.302 1.00 34.32 H new ATOM 0 HB1 ALA A 821 3.194 -28.857 -0.407 1.00 61.52 H new ATOM 0 HB2 ALA A 821 1.538 -28.338 -0.012 1.00 61.52 H new ATOM 0 HB3 ALA A 821 2.931 -27.433 0.627 1.00 61.52 H new ATOM 484 N ASP A 822 4.186 -29.003 3.366 1.00 52.13 N ATOM 485 CA ASP A 822 5.478 -29.116 4.020 1.00 21.23 C ATOM 486 C ASP A 822 5.286 -29.704 5.420 1.00 41.31 C ATOM 487 O ASP A 822 6.240 -29.808 6.190 1.00 40.15 O ATOM 488 CB ASP A 822 6.142 -27.746 4.170 1.00 52.12 C ATOM 489 CG ASP A 822 5.931 -26.793 2.991 1.00 24.40 C ATOM 490 OD1 ASP A 822 5.699 -25.590 3.176 1.00 3.52 O ATOM 491 OD2 ASP A 822 6.015 -27.341 1.826 1.00 21.10 O ATOM 0 H ASP A 822 3.477 -28.505 3.905 1.00 52.13 H new ATOM 0 HA ASP A 822 6.111 -29.758 3.407 1.00 21.23 H new ATOM 0 HB2 ASP A 822 5.761 -27.271 5.074 1.00 52.12 H new ATOM 0 HB3 ASP A 822 7.213 -27.891 4.313 1.00 52.12 H new ATOM 497 N VAL A 823 4.046 -30.072 5.707 1.00 24.33 N ATOM 498 CA VAL A 823 3.717 -30.647 7.001 1.00 41.42 C ATOM 499 C VAL A 823 3.794 -32.172 6.911 1.00 30.01 C ATOM 500 O VAL A 823 2.979 -32.800 6.236 1.00 45.51 O ATOM 501 CB VAL A 823 2.348 -30.143 7.464 1.00 65.12 C ATOM 502 CG1 VAL A 823 1.223 -31.002 6.883 1.00 23.03 C ATOM 503 CG2 VAL A 823 2.270 -30.095 8.991 1.00 72.30 C ATOM 0 H VAL A 823 3.257 -29.983 5.066 1.00 24.33 H new ATOM 0 HA VAL A 823 4.437 -30.330 7.755 1.00 41.42 H new ATOM 0 HB VAL A 823 2.220 -29.127 7.090 1.00 65.12 H new ATOM 0 HG11 VAL A 823 0.261 -30.623 7.227 1.00 23.03 H new ATOM 0 HG12 VAL A 823 1.260 -30.962 5.794 1.00 23.03 H new ATOM 0 HG13 VAL A 823 1.345 -32.034 7.213 1.00 23.03 H new ATOM 0 HG21 VAL A 823 1.287 -29.734 9.294 1.00 72.30 H new ATOM 0 HG22 VAL A 823 2.429 -31.095 9.395 1.00 72.30 H new ATOM 0 HG23 VAL A 823 3.038 -29.422 9.374 1.00 72.30 H new ATOM 513 N ARG A 824 4.780 -32.725 7.602 1.00 44.52 N ATOM 514 CA ARG A 824 4.974 -34.165 7.609 1.00 42.44 C ATOM 515 C ARG A 824 4.777 -34.720 9.020 1.00 33.14 C ATOM 516 O ARG A 824 5.508 -34.359 9.941 1.00 14.24 O ATOM 517 CB ARG A 824 6.374 -34.534 7.114 1.00 70.22 C ATOM 518 CG ARG A 824 6.716 -33.784 5.825 1.00 75.34 C ATOM 519 CD ARG A 824 5.636 -34.000 4.762 1.00 32.22 C ATOM 520 NE ARG A 824 6.060 -33.396 3.479 1.00 21.44 N ATOM 521 CZ ARG A 824 5.210 -33.037 2.494 1.00 10.33 C ATOM 522 NH1 ARG A 824 3.880 -33.217 2.637 1.00 32.34 N ATOM 523 NH2 ARG A 824 5.699 -32.506 1.389 1.00 11.31 N ATOM 0 H ARG A 824 5.453 -32.201 8.161 1.00 44.52 H new ATOM 0 HA ARG A 824 4.236 -34.603 6.937 1.00 42.44 H new ATOM 0 HB2 ARG A 824 7.109 -34.297 7.883 1.00 70.22 H new ATOM 0 HB3 ARG A 824 6.430 -35.608 6.939 1.00 70.22 H new ATOM 0 HG2 ARG A 824 6.817 -32.719 6.035 1.00 75.34 H new ATOM 0 HG3 ARG A 824 7.679 -34.126 5.445 1.00 75.34 H new ATOM 0 HD2 ARG A 824 5.454 -35.066 4.629 1.00 32.22 H new ATOM 0 HD3 ARG A 824 4.697 -33.555 5.090 1.00 32.22 H new ATOM 0 HE ARG A 824 7.057 -33.241 3.330 1.00 21.44 H new ATOM 0 HH11 ARG A 824 3.510 -33.627 3.495 1.00 32.34 H new ATOM 0 HH12 ARG A 824 3.245 -32.943 1.888 1.00 32.34 H new ATOM 0 HH21 ARG A 824 6.705 -32.373 1.289 1.00 11.31 H new ATOM 0 HH22 ARG A 824 5.071 -32.229 0.635 1.00 11.31 H new ATOM 536 N VAL A 825 3.785 -35.590 9.146 1.00 11.54 N ATOM 537 CA VAL A 825 3.482 -36.198 10.430 1.00 21.55 C ATOM 538 C VAL A 825 4.329 -37.461 10.604 1.00 4.51 C ATOM 539 O VAL A 825 4.456 -38.260 9.678 1.00 53.01 O ATOM 540 CB VAL A 825 1.980 -36.467 10.541 1.00 72.10 C ATOM 541 CG1 VAL A 825 1.209 -35.172 10.802 1.00 51.54 C ATOM 542 CG2 VAL A 825 1.456 -37.175 9.290 1.00 40.23 C ATOM 0 H VAL A 825 3.181 -35.888 8.380 1.00 11.54 H new ATOM 0 HA VAL A 825 3.738 -35.519 11.243 1.00 21.55 H new ATOM 0 HB VAL A 825 1.820 -37.129 11.392 1.00 72.10 H new ATOM 0 HG11 VAL A 825 0.144 -35.391 10.877 1.00 51.54 H new ATOM 0 HG12 VAL A 825 1.554 -34.725 11.734 1.00 51.54 H new ATOM 0 HG13 VAL A 825 1.379 -34.475 9.981 1.00 51.54 H new ATOM 0 HG21 VAL A 825 0.386 -37.354 9.395 1.00 40.23 H new ATOM 0 HG22 VAL A 825 1.635 -36.549 8.416 1.00 40.23 H new ATOM 0 HG23 VAL A 825 1.973 -38.127 9.167 1.00 40.23 H new ATOM 552 N ILE A 826 4.888 -37.600 11.797 1.00 21.03 N ATOM 553 CA ILE A 826 5.720 -38.751 12.104 1.00 31.22 C ATOM 554 C ILE A 826 4.825 -39.947 12.439 1.00 44.43 C ATOM 555 O ILE A 826 4.566 -40.224 13.609 1.00 71.14 O ATOM 556 CB ILE A 826 6.725 -38.408 13.206 1.00 52.24 C ATOM 557 CG1 ILE A 826 7.920 -37.640 12.637 1.00 22.24 C ATOM 558 CG2 ILE A 826 7.158 -39.664 13.964 1.00 63.35 C ATOM 559 CD1 ILE A 826 8.261 -36.432 13.511 1.00 2.53 C ATOM 0 H ILE A 826 4.781 -36.935 12.563 1.00 21.03 H new ATOM 0 HA ILE A 826 6.317 -39.031 11.236 1.00 31.22 H new ATOM 0 HB ILE A 826 6.234 -37.753 13.925 1.00 52.24 H new ATOM 0 HG12 ILE A 826 8.784 -38.301 12.571 1.00 22.24 H new ATOM 0 HG13 ILE A 826 7.695 -37.308 11.624 1.00 22.24 H new ATOM 0 HG21 ILE A 826 7.872 -39.392 14.741 1.00 63.35 H new ATOM 0 HG22 ILE A 826 6.286 -40.132 14.420 1.00 63.35 H new ATOM 0 HG23 ILE A 826 7.625 -40.364 13.271 1.00 63.35 H new ATOM 0 HD11 ILE A 826 9.114 -35.904 13.085 1.00 2.53 H new ATOM 0 HD12 ILE A 826 7.403 -35.761 13.555 1.00 2.53 H new ATOM 0 HD13 ILE A 826 8.510 -36.769 14.517 1.00 2.53 H new ATOM 571 N GLU A 827 4.379 -40.622 11.390 1.00 34.33 N ATOM 572 CA GLU A 827 3.519 -41.781 11.558 1.00 34.51 C ATOM 573 C GLU A 827 2.174 -41.363 12.155 1.00 12.44 C ATOM 574 O GLU A 827 1.521 -42.151 12.837 1.00 73.31 O ATOM 575 CB GLU A 827 4.196 -42.846 12.424 1.00 14.41 C ATOM 576 CG GLU A 827 5.430 -43.418 11.725 1.00 44.42 C ATOM 577 CD GLU A 827 5.856 -44.743 12.360 1.00 11.34 C ATOM 578 OE1 GLU A 827 5.640 -45.811 11.770 1.00 72.35 O ATOM 579 OE2 GLU A 827 6.431 -44.636 13.510 1.00 64.11 O ATOM 0 H GLU A 827 4.597 -40.389 10.421 1.00 34.33 H new ATOM 0 HA GLU A 827 3.338 -42.219 10.576 1.00 34.51 H new ATOM 0 HB2 GLU A 827 4.485 -42.412 13.381 1.00 14.41 H new ATOM 0 HB3 GLU A 827 3.490 -43.649 12.638 1.00 14.41 H new ATOM 0 HG2 GLU A 827 5.215 -43.570 10.667 1.00 44.42 H new ATOM 0 HG3 GLU A 827 6.250 -42.702 11.784 1.00 44.42 H new ATOM 587 N GLU A 828 1.800 -40.122 11.878 1.00 32.21 N ATOM 588 CA GLU A 828 0.545 -39.589 12.380 1.00 75.25 C ATOM 589 C GLU A 828 0.559 -39.548 13.909 1.00 55.11 C ATOM 590 O GLU A 828 -0.431 -39.896 14.552 1.00 64.11 O ATOM 591 CB GLU A 828 -0.643 -40.405 11.864 1.00 64.01 C ATOM 592 CG GLU A 828 -0.467 -40.754 10.385 1.00 51.34 C ATOM 593 CD GLU A 828 -1.451 -41.845 9.958 1.00 55.41 C ATOM 594 OE1 GLU A 828 -2.313 -41.601 9.100 1.00 14.14 O ATOM 595 OE2 GLU A 828 -1.297 -42.980 10.550 1.00 34.13 O ATOM 0 H GLU A 828 2.344 -39.471 11.312 1.00 32.21 H new ATOM 0 HA GLU A 828 0.432 -38.570 12.010 1.00 75.25 H new ATOM 0 HB2 GLU A 828 -0.741 -41.320 12.448 1.00 64.01 H new ATOM 0 HB3 GLU A 828 -1.564 -39.839 12.001 1.00 64.01 H new ATOM 0 HG2 GLU A 828 -0.620 -39.863 9.777 1.00 51.34 H new ATOM 0 HG3 GLU A 828 0.554 -41.090 10.206 1.00 51.34 H new ATOM 603 N CYS A 829 1.691 -39.119 14.447 1.00 32.42 N ATOM 604 CA CYS A 829 1.847 -39.028 15.889 1.00 74.10 C ATOM 605 C CYS A 829 1.975 -37.551 16.266 1.00 41.13 C ATOM 606 O CYS A 829 1.451 -37.120 17.292 1.00 74.43 O ATOM 607 CB CYS A 829 3.040 -39.849 16.382 1.00 40.20 C ATOM 608 SG CYS A 829 2.904 -40.130 18.185 1.00 2.32 S ATOM 0 H CYS A 829 2.509 -38.831 13.910 1.00 32.42 H new ATOM 0 HA CYS A 829 0.971 -39.452 16.380 1.00 74.10 H new ATOM 0 HB2 CYS A 829 3.076 -40.804 15.858 1.00 40.20 H new ATOM 0 HB3 CYS A 829 3.970 -39.327 16.156 1.00 40.20 H new ATOM 0 HG CYS A 829 3.921 -40.829 18.593 1.00 2.32 H new ATOM 614 N HIS A 830 2.676 -36.815 15.415 1.00 14.04 N ATOM 615 CA HIS A 830 2.880 -35.395 15.646 1.00 14.03 C ATOM 616 C HIS A 830 2.860 -34.650 14.310 1.00 2.21 C ATOM 617 O HIS A 830 2.979 -35.264 13.251 1.00 41.21 O ATOM 618 CB HIS A 830 4.164 -35.153 16.442 1.00 41.05 C ATOM 619 CG HIS A 830 4.517 -36.271 17.393 1.00 30.13 C ATOM 620 ND1 HIS A 830 5.078 -37.464 16.973 1.00 63.21 N ATOM 621 CD2 HIS A 830 4.383 -36.364 18.747 1.00 25.25 C ATOM 622 CE1 HIS A 830 5.269 -38.234 18.035 1.00 52.35 C ATOM 623 NE2 HIS A 830 4.837 -37.550 19.133 1.00 21.43 N ATOM 0 H HIS A 830 3.109 -37.176 14.565 1.00 14.04 H new ATOM 0 HA HIS A 830 2.066 -35.001 16.254 1.00 14.03 H new ATOM 0 HB2 HIS A 830 4.990 -35.008 15.745 1.00 41.05 H new ATOM 0 HB3 HIS A 830 4.059 -34.228 17.008 1.00 41.05 H new ATOM 0 HD2 HIS A 830 3.976 -35.602 19.395 1.00 25.25 H new ATOM 0 HE1 HIS A 830 5.692 -39.228 18.031 1.00 52.35 H new ATOM 0 HE2 HIS A 830 4.859 -37.893 20.093 1.00 21.43 H new ATOM 631 N TYR A 831 2.709 -33.337 14.404 1.00 43.14 N ATOM 632 CA TYR A 831 2.673 -32.501 13.215 1.00 34.35 C ATOM 633 C TYR A 831 3.891 -31.578 13.157 1.00 41.31 C ATOM 634 O TYR A 831 4.046 -30.695 13.999 1.00 2.30 O ATOM 635 CB TYR A 831 1.408 -31.650 13.338 1.00 55.33 C ATOM 636 CG TYR A 831 0.168 -32.282 12.701 1.00 42.51 C ATOM 637 CD1 TYR A 831 0.120 -32.483 11.336 1.00 10.23 C ATOM 638 CD2 TYR A 831 -0.902 -32.650 13.491 1.00 64.30 C ATOM 639 CE1 TYR A 831 -1.046 -33.078 10.737 1.00 55.40 C ATOM 640 CE2 TYR A 831 -2.068 -33.245 12.892 1.00 71.14 C ATOM 641 CZ TYR A 831 -2.083 -33.429 11.544 1.00 21.42 C ATOM 642 OH TYR A 831 -3.185 -33.991 10.978 1.00 24.12 O ATOM 0 H TYR A 831 2.610 -32.831 15.284 1.00 43.14 H new ATOM 0 HA TYR A 831 2.679 -33.114 12.314 1.00 34.35 H new ATOM 0 HB2 TYR A 831 1.208 -31.466 14.393 1.00 55.33 H new ATOM 0 HB3 TYR A 831 1.588 -30.680 12.874 1.00 55.33 H new ATOM 0 HD1 TYR A 831 0.957 -32.194 10.718 1.00 10.23 H new ATOM 0 HD2 TYR A 831 -0.865 -32.492 14.559 1.00 64.30 H new ATOM 0 HE1 TYR A 831 -1.096 -33.242 9.671 1.00 55.40 H new ATOM 0 HE2 TYR A 831 -2.912 -33.539 13.499 1.00 71.14 H new ATOM 0 HH TYR A 831 -3.349 -33.581 10.103 1.00 24.12 H new ATOM 652 N THR A 832 4.724 -31.813 12.154 1.00 25.12 N ATOM 653 CA THR A 832 5.924 -31.013 11.975 1.00 63.43 C ATOM 654 C THR A 832 6.000 -30.479 10.543 1.00 14.22 C ATOM 655 O THR A 832 5.325 -30.989 9.650 1.00 12.51 O ATOM 656 CB THR A 832 7.128 -31.872 12.367 1.00 61.43 C ATOM 657 OG1 THR A 832 8.223 -31.266 11.686 1.00 65.41 O ATOM 658 CG2 THR A 832 7.058 -33.283 11.778 1.00 53.23 C ATOM 0 H THR A 832 4.592 -32.546 11.457 1.00 25.12 H new ATOM 0 HA THR A 832 5.911 -30.132 12.617 1.00 63.43 H new ATOM 0 HB THR A 832 7.190 -31.935 13.453 1.00 61.43 H new ATOM 0 HG1 THR A 832 9.045 -31.401 12.203 1.00 65.41 H new ATOM 0 HG21 THR A 832 7.936 -33.850 12.087 1.00 53.23 H new ATOM 0 HG22 THR A 832 6.158 -33.783 12.137 1.00 53.23 H new ATOM 0 HG23 THR A 832 7.030 -33.222 10.690 1.00 53.23 H new ATOM 666 N VAL A 833 6.827 -29.458 10.370 1.00 74.45 N ATOM 667 CA VAL A 833 6.999 -28.849 9.062 1.00 50.03 C ATOM 668 C VAL A 833 8.474 -28.919 8.662 1.00 41.23 C ATOM 669 O VAL A 833 9.354 -28.927 9.521 1.00 62.10 O ATOM 670 CB VAL A 833 6.450 -27.421 9.073 1.00 13.03 C ATOM 671 CG1 VAL A 833 6.272 -26.890 7.649 1.00 25.23 C ATOM 672 CG2 VAL A 833 5.136 -27.345 9.854 1.00 22.23 C ATOM 0 H VAL A 833 7.385 -29.038 11.113 1.00 74.45 H new ATOM 0 HA VAL A 833 6.431 -29.395 8.309 1.00 50.03 H new ATOM 0 HB VAL A 833 7.178 -26.787 9.578 1.00 13.03 H new ATOM 0 HG11 VAL A 833 5.881 -25.873 7.686 1.00 25.23 H new ATOM 0 HG12 VAL A 833 7.235 -26.890 7.138 1.00 25.23 H new ATOM 0 HG13 VAL A 833 5.574 -27.528 7.107 1.00 25.23 H new ATOM 0 HG21 VAL A 833 4.767 -26.319 9.847 1.00 22.23 H new ATOM 0 HG22 VAL A 833 4.398 -27.999 9.390 1.00 22.23 H new ATOM 0 HG23 VAL A 833 5.305 -27.662 10.883 1.00 22.23 H new ATOM 682 N LEU A 834 8.699 -28.967 7.357 1.00 73.31 N ATOM 683 CA LEU A 834 10.052 -29.036 6.833 1.00 61.25 C ATOM 684 C LEU A 834 10.337 -27.784 6.001 1.00 13.32 C ATOM 685 O LEU A 834 9.502 -26.883 5.923 1.00 23.32 O ATOM 686 CB LEU A 834 10.264 -30.344 6.067 1.00 42.21 C ATOM 687 CG LEU A 834 9.791 -31.617 6.770 1.00 34.34 C ATOM 688 CD1 LEU A 834 9.666 -32.777 5.780 1.00 4.11 C ATOM 689 CD2 LEU A 834 10.703 -31.965 7.948 1.00 1.23 C ATOM 0 H LEU A 834 7.967 -28.959 6.647 1.00 73.31 H new ATOM 0 HA LEU A 834 10.776 -29.049 7.648 1.00 61.25 H new ATOM 0 HB2 LEU A 834 9.749 -30.269 5.109 1.00 42.21 H new ATOM 0 HB3 LEU A 834 11.327 -30.446 5.850 1.00 42.21 H new ATOM 0 HG LEU A 834 8.797 -31.432 7.176 1.00 34.34 H new ATOM 0 HD11 LEU A 834 9.328 -33.670 6.306 1.00 4.11 H new ATOM 0 HD12 LEU A 834 8.945 -32.518 5.005 1.00 4.11 H new ATOM 0 HD13 LEU A 834 10.636 -32.971 5.322 1.00 4.11 H new ATOM 0 HD21 LEU A 834 10.344 -32.874 8.430 1.00 1.23 H new ATOM 0 HD22 LEU A 834 11.719 -32.123 7.587 1.00 1.23 H new ATOM 0 HD23 LEU A 834 10.697 -31.146 8.667 1.00 1.23 H new ATOM 701 N GLY A 835 11.518 -27.766 5.401 1.00 73.50 N ATOM 702 CA GLY A 835 11.923 -26.639 4.578 1.00 33.33 C ATOM 703 C GLY A 835 12.401 -25.472 5.444 1.00 34.04 C ATOM 704 O GLY A 835 11.802 -25.175 6.477 1.00 24.35 O ATOM 0 H GLY A 835 12.208 -28.514 5.468 1.00 73.50 H new ATOM 0 HA2 GLY A 835 12.721 -26.946 3.902 1.00 33.33 H new ATOM 0 HA3 GLY A 835 11.086 -26.318 3.958 1.00 33.33 H new ATOM 708 N ASP A 836 13.474 -24.841 4.991 1.00 21.44 N ATOM 709 CA ASP A 836 14.039 -23.713 5.712 1.00 61.20 C ATOM 710 C ASP A 836 13.079 -22.525 5.625 1.00 71.24 C ATOM 711 O ASP A 836 13.032 -21.693 6.529 1.00 53.20 O ATOM 712 CB ASP A 836 15.377 -23.286 5.104 1.00 14.35 C ATOM 713 CG ASP A 836 16.147 -22.238 5.910 1.00 25.23 C ATOM 714 OD1 ASP A 836 15.852 -21.036 5.843 1.00 51.22 O ATOM 715 OD2 ASP A 836 17.101 -22.707 6.642 1.00 43.42 O ATOM 0 H ASP A 836 13.967 -25.089 4.133 1.00 21.44 H new ATOM 0 HA ASP A 836 14.194 -24.017 6.747 1.00 61.20 H new ATOM 0 HB2 ASP A 836 16.006 -24.169 4.990 1.00 14.35 H new ATOM 0 HB3 ASP A 836 15.196 -22.892 4.104 1.00 14.35 H new ATOM 721 N ALA A 837 12.337 -22.484 4.528 1.00 61.44 N ATOM 722 CA ALA A 837 11.381 -21.412 4.310 1.00 32.24 C ATOM 723 C ALA A 837 10.510 -21.251 5.558 1.00 50.20 C ATOM 724 O ALA A 837 9.987 -20.168 5.819 1.00 62.34 O ATOM 725 CB ALA A 837 10.555 -21.711 3.057 1.00 11.45 C ATOM 0 H ALA A 837 12.379 -23.176 3.780 1.00 61.44 H new ATOM 0 HA ALA A 837 11.896 -20.466 4.142 1.00 32.24 H new ATOM 0 HB1 ALA A 837 9.838 -20.907 2.894 1.00 11.45 H new ATOM 0 HB2 ALA A 837 11.217 -21.788 2.195 1.00 11.45 H new ATOM 0 HB3 ALA A 837 10.021 -22.652 3.189 1.00 11.45 H new ATOM 731 N PHE A 838 10.381 -22.343 6.296 1.00 60.50 N ATOM 732 CA PHE A 838 9.583 -22.337 7.510 1.00 55.21 C ATOM 733 C PHE A 838 10.411 -21.871 8.709 1.00 42.22 C ATOM 734 O PHE A 838 9.870 -21.319 9.665 1.00 13.04 O ATOM 735 CB PHE A 838 9.123 -23.776 7.751 1.00 22.11 C ATOM 736 CG PHE A 838 8.755 -24.076 9.205 1.00 31.35 C ATOM 737 CD1 PHE A 838 8.107 -23.141 9.950 1.00 54.42 C ATOM 738 CD2 PHE A 838 9.076 -25.279 9.754 1.00 53.31 C ATOM 739 CE1 PHE A 838 7.765 -23.419 11.300 1.00 72.24 C ATOM 740 CE2 PHE A 838 8.734 -25.557 11.104 1.00 71.32 C ATOM 741 CZ PHE A 838 8.086 -24.622 11.848 1.00 13.41 C ATOM 0 H PHE A 838 10.816 -23.239 6.077 1.00 60.50 H new ATOM 0 HA PHE A 838 8.741 -21.654 7.397 1.00 55.21 H new ATOM 0 HB2 PHE A 838 8.259 -23.981 7.119 1.00 22.11 H new ATOM 0 HB3 PHE A 838 9.915 -24.457 7.440 1.00 22.11 H new ATOM 0 HD1 PHE A 838 7.852 -22.186 9.515 1.00 54.42 H new ATOM 0 HD2 PHE A 838 9.591 -26.022 9.163 1.00 53.31 H new ATOM 0 HE1 PHE A 838 7.250 -22.676 11.891 1.00 72.24 H new ATOM 0 HE2 PHE A 838 8.989 -26.512 11.540 1.00 71.32 H new ATOM 0 HZ PHE A 838 7.826 -24.834 12.875 1.00 13.41 H new ATOM 751 N LYS A 839 11.711 -22.110 8.618 1.00 62.22 N ATOM 752 CA LYS A 839 12.620 -21.722 9.683 1.00 10.10 C ATOM 753 C LYS A 839 12.541 -20.208 9.889 1.00 55.12 C ATOM 754 O LYS A 839 12.754 -19.716 10.996 1.00 60.31 O ATOM 755 CB LYS A 839 14.034 -22.230 9.393 1.00 53.22 C ATOM 756 CG LYS A 839 14.079 -23.759 9.398 1.00 73.23 C ATOM 757 CD LYS A 839 15.471 -24.268 9.017 1.00 55.00 C ATOM 758 CE LYS A 839 15.430 -25.753 8.651 1.00 42.13 C ATOM 759 NZ LYS A 839 16.802 -26.293 8.524 1.00 44.11 N ATOM 0 H LYS A 839 12.157 -22.568 7.823 1.00 62.22 H new ATOM 0 HA LYS A 839 12.325 -22.188 10.623 1.00 10.10 H new ATOM 0 HB2 LYS A 839 14.367 -21.856 8.425 1.00 53.22 H new ATOM 0 HB3 LYS A 839 14.725 -21.840 10.140 1.00 53.22 H new ATOM 0 HG2 LYS A 839 13.810 -24.131 10.387 1.00 73.23 H new ATOM 0 HG3 LYS A 839 13.341 -24.150 8.698 1.00 73.23 H new ATOM 0 HD2 LYS A 839 15.855 -23.693 8.175 1.00 55.00 H new ATOM 0 HD3 LYS A 839 16.159 -24.113 9.848 1.00 55.00 H new ATOM 0 HE2 LYS A 839 14.884 -26.307 9.415 1.00 42.13 H new ATOM 0 HE3 LYS A 839 14.891 -25.888 7.713 1.00 42.13 H new ATOM 0 HZ1 LYS A 839 16.756 -27.302 8.275 1.00 44.11 H new ATOM 0 HZ2 LYS A 839 17.311 -25.775 7.779 1.00 44.11 H new ATOM 0 HZ3 LYS A 839 17.304 -26.182 9.428 1.00 44.11 H new ATOM 772 N GLU A 840 12.233 -19.511 8.805 1.00 52.11 N ATOM 773 CA GLU A 840 12.123 -18.063 8.853 1.00 54.15 C ATOM 774 C GLU A 840 10.727 -17.652 9.326 1.00 31.13 C ATOM 775 O GLU A 840 10.481 -16.479 9.601 1.00 3.41 O ATOM 776 CB GLU A 840 12.444 -17.443 7.491 1.00 73.40 C ATOM 777 CG GLU A 840 11.469 -17.938 6.420 1.00 1.31 C ATOM 778 CD GLU A 840 11.273 -16.883 5.329 1.00 73.31 C ATOM 779 OE1 GLU A 840 11.014 -15.711 5.639 1.00 35.00 O ATOM 780 OE2 GLU A 840 11.399 -17.318 4.121 1.00 22.51 O ATOM 0 H GLU A 840 12.056 -19.922 7.888 1.00 52.11 H new ATOM 0 HA GLU A 840 12.854 -17.687 9.569 1.00 54.15 H new ATOM 0 HB2 GLU A 840 12.392 -16.356 7.561 1.00 73.40 H new ATOM 0 HB3 GLU A 840 13.465 -17.696 7.204 1.00 73.40 H new ATOM 0 HG2 GLU A 840 11.847 -18.859 5.977 1.00 1.31 H new ATOM 0 HG3 GLU A 840 10.509 -18.175 6.878 1.00 1.31 H new ATOM 788 N CYS A 841 9.849 -18.641 9.407 1.00 24.43 N ATOM 789 CA CYS A 841 8.485 -18.398 9.843 1.00 12.41 C ATOM 790 C CYS A 841 8.457 -18.426 11.373 1.00 53.05 C ATOM 791 O CYS A 841 7.673 -17.711 11.996 1.00 61.52 O ATOM 792 CB CYS A 841 7.508 -19.406 9.235 1.00 22.44 C ATOM 793 SG CYS A 841 5.883 -18.614 8.956 1.00 14.33 S ATOM 0 H CYS A 841 10.056 -19.613 9.178 1.00 24.43 H new ATOM 0 HA CYS A 841 8.158 -17.419 9.493 1.00 12.41 H new ATOM 0 HB2 CYS A 841 7.903 -19.785 8.293 1.00 22.44 H new ATOM 0 HB3 CYS A 841 7.395 -20.262 9.900 1.00 22.44 H new ATOM 0 HG CYS A 841 4.951 -19.520 8.967 1.00 14.33 H new ATOM 799 N PHE A 842 9.321 -19.259 11.933 1.00 20.01 N ATOM 800 CA PHE A 842 9.405 -19.390 13.378 1.00 41.12 C ATOM 801 C PHE A 842 10.854 -19.272 13.856 1.00 53.42 C ATOM 802 O PHE A 842 11.739 -18.910 13.082 1.00 71.51 O ATOM 803 CB PHE A 842 8.875 -20.781 13.732 1.00 5.24 C ATOM 804 CG PHE A 842 9.963 -21.852 13.839 1.00 73.13 C ATOM 805 CD1 PHE A 842 10.563 -22.326 12.714 1.00 73.01 C ATOM 806 CD2 PHE A 842 10.329 -22.330 15.058 1.00 62.40 C ATOM 807 CE1 PHE A 842 11.572 -23.320 12.813 1.00 72.24 C ATOM 808 CE2 PHE A 842 11.338 -23.325 15.157 1.00 42.44 C ATOM 809 CZ PHE A 842 11.938 -23.799 14.032 1.00 43.51 C ATOM 0 H PHE A 842 9.969 -19.850 11.413 1.00 20.01 H new ATOM 0 HA PHE A 842 8.827 -18.600 13.858 1.00 41.12 H new ATOM 0 HB2 PHE A 842 8.340 -20.725 14.680 1.00 5.24 H new ATOM 0 HB3 PHE A 842 8.152 -21.086 12.976 1.00 5.24 H new ATOM 0 HD1 PHE A 842 10.272 -21.946 11.746 1.00 73.01 H new ATOM 0 HD2 PHE A 842 9.853 -21.953 15.951 1.00 62.40 H new ATOM 0 HE1 PHE A 842 12.049 -23.696 11.920 1.00 72.24 H new ATOM 0 HE2 PHE A 842 11.629 -23.705 16.125 1.00 42.44 H new ATOM 0 HZ PHE A 842 12.705 -24.556 14.107 1.00 43.51 H new ATOM 819 N VAL A 843 11.051 -19.583 15.128 1.00 14.15 N ATOM 820 CA VAL A 843 12.377 -19.516 15.719 1.00 54.02 C ATOM 821 C VAL A 843 12.535 -20.647 16.737 1.00 73.33 C ATOM 822 O VAL A 843 11.548 -21.247 17.162 1.00 4.41 O ATOM 823 CB VAL A 843 12.611 -18.130 16.324 1.00 72.31 C ATOM 824 CG1 VAL A 843 12.093 -17.031 15.394 1.00 62.42 C ATOM 825 CG2 VAL A 843 11.972 -18.022 17.710 1.00 75.13 C ATOM 0 H VAL A 843 10.314 -19.882 15.767 1.00 14.15 H new ATOM 0 HA VAL A 843 13.143 -19.656 14.956 1.00 54.02 H new ATOM 0 HB VAL A 843 13.686 -17.992 16.439 1.00 72.31 H new ATOM 0 HG11 VAL A 843 12.272 -16.056 15.848 1.00 62.42 H new ATOM 0 HG12 VAL A 843 12.614 -17.087 14.438 1.00 62.42 H new ATOM 0 HG13 VAL A 843 11.023 -17.165 15.232 1.00 62.42 H new ATOM 0 HG21 VAL A 843 12.153 -17.027 18.118 1.00 75.13 H new ATOM 0 HG22 VAL A 843 10.898 -18.191 17.630 1.00 75.13 H new ATOM 0 HG23 VAL A 843 12.409 -18.770 18.371 1.00 75.13 H new ATOM 835 N SER A 844 13.783 -20.905 17.098 1.00 60.22 N ATOM 836 CA SER A 844 14.083 -21.954 18.058 1.00 51.03 C ATOM 837 C SER A 844 15.039 -21.425 19.129 1.00 64.34 C ATOM 838 O SER A 844 16.133 -20.960 18.814 1.00 45.24 O ATOM 839 CB SER A 844 14.685 -23.178 17.366 1.00 64.24 C ATOM 840 OG SER A 844 16.089 -23.040 17.163 1.00 42.12 O ATOM 0 H SER A 844 14.599 -20.406 16.743 1.00 60.22 H new ATOM 0 HA SER A 844 13.151 -22.261 18.532 1.00 51.03 H new ATOM 0 HB2 SER A 844 14.491 -24.066 17.967 1.00 64.24 H new ATOM 0 HB3 SER A 844 14.193 -23.330 16.405 1.00 64.24 H new ATOM 0 HG SER A 844 16.360 -22.120 17.366 1.00 42.12 H new ATOM 846 N ARG A 845 14.592 -21.515 20.372 1.00 11.14 N ATOM 847 CA ARG A 845 15.394 -21.051 21.492 1.00 63.44 C ATOM 848 C ARG A 845 16.199 -22.210 22.084 1.00 70.23 C ATOM 849 O ARG A 845 15.626 -23.195 22.547 1.00 25.15 O ATOM 850 CB ARG A 845 14.515 -20.440 22.584 1.00 53.21 C ATOM 851 CG ARG A 845 13.445 -19.528 21.980 1.00 72.02 C ATOM 852 CD ARG A 845 14.036 -18.641 20.882 1.00 22.12 C ATOM 853 NE ARG A 845 15.195 -17.887 21.411 1.00 54.45 N ATOM 854 CZ ARG A 845 15.096 -16.864 22.286 1.00 40.31 C ATOM 855 NH1 ARG A 845 13.889 -16.464 22.739 1.00 11.14 N ATOM 856 NH2 ARG A 845 16.198 -16.260 22.692 1.00 74.13 N ATOM 0 H ARG A 845 13.684 -21.902 20.629 1.00 11.14 H new ATOM 0 HA ARG A 845 16.073 -20.285 21.118 1.00 63.44 H new ATOM 0 HB2 ARG A 845 14.039 -21.234 23.159 1.00 53.21 H new ATOM 0 HB3 ARG A 845 15.134 -19.871 23.278 1.00 53.21 H new ATOM 0 HG2 ARG A 845 12.637 -20.133 21.568 1.00 72.02 H new ATOM 0 HG3 ARG A 845 13.010 -18.905 22.761 1.00 72.02 H new ATOM 0 HD2 ARG A 845 14.346 -19.254 20.035 1.00 22.12 H new ATOM 0 HD3 ARG A 845 13.278 -17.949 20.515 1.00 22.12 H new ATOM 0 HE ARG A 845 16.126 -18.157 21.095 1.00 54.45 H new ATOM 0 HH11 ARG A 845 13.043 -16.936 22.420 1.00 11.14 H new ATOM 0 HH12 ARG A 845 13.823 -15.690 23.400 1.00 11.14 H new ATOM 0 HH21 ARG A 845 17.106 -16.568 22.345 1.00 74.13 H new ATOM 0 HH22 ARG A 845 16.141 -15.485 23.353 1.00 74.13 H new ATOM 869 N PRO A 846 17.549 -22.050 22.048 1.00 41.02 N ATOM 870 CA PRO A 846 18.438 -23.071 22.575 1.00 2.02 C ATOM 871 C PRO A 846 18.443 -23.057 24.105 1.00 35.31 C ATOM 872 O PRO A 846 17.537 -22.505 24.727 1.00 14.31 O ATOM 873 CB PRO A 846 19.799 -22.757 21.974 1.00 15.55 C ATOM 874 CG PRO A 846 19.725 -21.311 21.509 1.00 75.52 C ATOM 875 CD PRO A 846 18.262 -20.897 21.506 1.00 2.12 C ATOM 0 HA PRO A 846 18.123 -24.080 22.309 1.00 2.02 H new ATOM 0 HB2 PRO A 846 20.591 -22.891 22.710 1.00 15.55 H new ATOM 0 HB3 PRO A 846 20.022 -23.424 21.141 1.00 15.55 H new ATOM 0 HG2 PRO A 846 20.303 -20.667 22.172 1.00 75.52 H new ATOM 0 HG3 PRO A 846 20.153 -21.208 20.512 1.00 75.52 H new ATOM 0 HD2 PRO A 846 18.101 -20.009 22.117 1.00 2.12 H new ATOM 0 HD3 PRO A 846 17.920 -20.658 20.499 1.00 2.12 H new ATOM 1029 N PHE A 856 7.688 -36.028 25.535 1.00 62.54 N ATOM 1030 CA PHE A 856 8.939 -35.951 24.800 1.00 62.05 C ATOM 1031 C PHE A 856 9.948 -35.059 25.526 1.00 13.21 C ATOM 1032 O PHE A 856 9.591 -34.351 26.467 1.00 61.03 O ATOM 1033 CB PHE A 856 8.620 -35.334 23.436 1.00 34.15 C ATOM 1034 CG PHE A 856 8.283 -36.360 22.353 1.00 73.14 C ATOM 1035 CD1 PHE A 856 7.136 -37.087 22.437 1.00 3.10 C ATOM 1036 CD2 PHE A 856 9.130 -36.545 21.305 1.00 73.33 C ATOM 1037 CE1 PHE A 856 6.824 -38.039 21.431 1.00 33.20 C ATOM 1038 CE2 PHE A 856 8.817 -37.497 20.299 1.00 60.52 C ATOM 1039 CZ PHE A 856 7.671 -38.224 20.383 1.00 33.32 C ATOM 0 HA PHE A 856 9.376 -36.945 24.705 1.00 62.05 H new ATOM 0 HB2 PHE A 856 7.780 -34.648 23.546 1.00 34.15 H new ATOM 0 HB3 PHE A 856 9.474 -34.742 23.108 1.00 34.15 H new ATOM 0 HD1 PHE A 856 6.463 -36.940 23.269 1.00 3.10 H new ATOM 0 HD2 PHE A 856 10.040 -35.968 21.238 1.00 73.33 H new ATOM 0 HE1 PHE A 856 5.914 -38.616 21.498 1.00 33.20 H new ATOM 0 HE2 PHE A 856 9.489 -37.644 19.467 1.00 60.52 H new ATOM 0 HZ PHE A 856 7.433 -38.948 19.618 1.00 33.32 H new ATOM 1049 N GLU A 857 11.187 -35.122 25.062 1.00 1.31 N ATOM 1050 CA GLU A 857 12.250 -34.328 25.656 1.00 72.31 C ATOM 1051 C GLU A 857 12.352 -32.971 24.958 1.00 11.40 C ATOM 1052 O GLU A 857 12.874 -32.877 23.848 1.00 5.35 O ATOM 1053 CB GLU A 857 13.585 -35.073 25.604 1.00 70.44 C ATOM 1054 CG GLU A 857 13.398 -36.557 25.930 1.00 44.43 C ATOM 1055 CD GLU A 857 14.733 -37.210 26.295 1.00 50.23 C ATOM 1056 OE1 GLU A 857 15.395 -36.775 27.249 1.00 64.44 O ATOM 1057 OE2 GLU A 857 15.075 -38.204 25.548 1.00 65.41 O ATOM 0 H GLU A 857 11.479 -35.710 24.282 1.00 1.31 H new ATOM 0 HA GLU A 857 12.007 -34.158 26.705 1.00 72.31 H new ATOM 0 HB2 GLU A 857 14.026 -34.967 24.613 1.00 70.44 H new ATOM 0 HB3 GLU A 857 14.283 -34.626 26.313 1.00 70.44 H new ATOM 0 HG2 GLU A 857 12.697 -36.666 26.758 1.00 44.43 H new ATOM 0 HG3 GLU A 857 12.961 -37.069 25.073 1.00 44.43 H new ATOM 1065 N LYS A 858 11.844 -31.952 25.637 1.00 24.40 N ATOM 1066 CA LYS A 858 11.872 -30.604 25.096 1.00 31.10 C ATOM 1067 C LYS A 858 12.945 -29.790 25.821 1.00 25.11 C ATOM 1068 O LYS A 858 12.733 -29.337 26.944 1.00 14.55 O ATOM 1069 CB LYS A 858 10.479 -29.975 25.155 1.00 54.42 C ATOM 1070 CG LYS A 858 9.848 -30.167 26.535 1.00 34.43 C ATOM 1071 CD LYS A 858 8.542 -29.378 26.657 1.00 64.44 C ATOM 1072 CE LYS A 858 7.878 -29.623 28.013 1.00 2.51 C ATOM 1073 NZ LYS A 858 8.491 -28.765 29.052 1.00 23.11 N ATOM 0 H LYS A 858 11.411 -32.033 26.557 1.00 24.40 H new ATOM 0 HA LYS A 858 12.144 -30.623 24.041 1.00 31.10 H new ATOM 0 HB2 LYS A 858 10.547 -28.911 24.927 1.00 54.42 H new ATOM 0 HB3 LYS A 858 9.841 -30.424 24.394 1.00 54.42 H new ATOM 0 HG2 LYS A 858 9.654 -31.226 26.706 1.00 34.43 H new ATOM 0 HG3 LYS A 858 10.546 -29.842 27.306 1.00 34.43 H new ATOM 0 HD2 LYS A 858 8.743 -28.314 26.534 1.00 64.44 H new ATOM 0 HD3 LYS A 858 7.861 -29.669 25.857 1.00 64.44 H new ATOM 0 HE2 LYS A 858 6.810 -29.415 27.945 1.00 2.51 H new ATOM 0 HE3 LYS A 858 7.981 -30.672 28.291 1.00 2.51 H new ATOM 0 HZ1 LYS A 858 8.089 -29.003 29.981 1.00 23.11 H new ATOM 0 HZ2 LYS A 858 9.519 -28.922 29.070 1.00 23.11 H new ATOM 0 HZ3 LYS A 858 8.297 -27.766 28.836 1.00 23.11 H new ATOM 1086 N ARG A 859 14.076 -29.630 25.149 1.00 51.21 N ATOM 1087 CA ARG A 859 15.183 -28.878 25.715 1.00 22.51 C ATOM 1088 C ARG A 859 15.294 -27.509 25.043 1.00 42.34 C ATOM 1089 O ARG A 859 16.382 -26.941 24.957 1.00 23.34 O ATOM 1090 CB ARG A 859 16.504 -29.631 25.544 1.00 21.32 C ATOM 1091 CG ARG A 859 16.499 -30.936 26.344 1.00 41.21 C ATOM 1092 CD ARG A 859 17.873 -31.608 26.305 1.00 1.11 C ATOM 1093 NE ARG A 859 18.916 -30.653 26.741 1.00 43.34 N ATOM 1094 CZ ARG A 859 20.216 -30.738 26.386 1.00 1.02 C ATOM 1095 NH1 ARG A 859 20.644 -31.738 25.586 1.00 0.33 N ATOM 1096 NH2 ARG A 859 21.062 -29.829 26.834 1.00 65.23 N ATOM 0 H ARG A 859 14.249 -30.008 24.218 1.00 51.21 H new ATOM 0 HA ARG A 859 14.986 -28.749 26.779 1.00 22.51 H new ATOM 0 HB2 ARG A 859 16.669 -29.848 24.489 1.00 21.32 H new ATOM 0 HB3 ARG A 859 17.331 -29.002 25.873 1.00 21.32 H new ATOM 0 HG2 ARG A 859 16.219 -30.732 27.378 1.00 41.21 H new ATOM 0 HG3 ARG A 859 15.747 -31.613 25.938 1.00 41.21 H new ATOM 0 HD2 ARG A 859 17.877 -32.484 26.953 1.00 1.11 H new ATOM 0 HD3 ARG A 859 18.088 -31.957 25.295 1.00 1.11 H new ATOM 0 HE ARG A 859 18.635 -29.882 27.348 1.00 43.34 H new ATOM 0 HH11 ARG A 859 19.984 -32.437 25.245 1.00 0.33 H new ATOM 0 HH12 ARG A 859 21.628 -31.795 25.323 1.00 0.33 H new ATOM 0 HH21 ARG A 859 20.730 -29.077 27.439 1.00 65.23 H new ATOM 0 HH22 ARG A 859 22.048 -29.878 26.576 1.00 65.23 H new ATOM 1109 N ALA A 860 14.153 -27.017 24.582 1.00 4.11 N ATOM 1110 CA ALA A 860 14.109 -25.724 23.920 1.00 72.32 C ATOM 1111 C ALA A 860 12.662 -25.397 23.546 1.00 74.41 C ATOM 1112 O ALA A 860 11.842 -26.299 23.375 1.00 0.43 O ATOM 1113 CB ALA A 860 15.036 -25.742 22.703 1.00 54.14 C ATOM 0 H ALA A 860 13.252 -27.490 24.654 1.00 4.11 H new ATOM 0 HA ALA A 860 14.463 -24.938 24.588 1.00 72.32 H new ATOM 0 HB1 ALA A 860 15.003 -24.772 22.206 1.00 54.14 H new ATOM 0 HB2 ALA A 860 16.056 -25.950 23.026 1.00 54.14 H new ATOM 0 HB3 ALA A 860 14.710 -26.516 22.009 1.00 54.14 H new ATOM 1119 N LYS A 861 12.392 -24.106 23.430 1.00 54.54 N ATOM 1120 CA LYS A 861 11.058 -23.648 23.079 1.00 34.40 C ATOM 1121 C LYS A 861 11.110 -22.920 21.734 1.00 34.44 C ATOM 1122 O LYS A 861 12.099 -22.261 21.419 1.00 11.13 O ATOM 1123 CB LYS A 861 10.465 -22.807 24.211 1.00 33.33 C ATOM 1124 CG LYS A 861 9.752 -23.692 25.236 1.00 5.05 C ATOM 1125 CD LYS A 861 10.694 -24.770 25.779 1.00 54.53 C ATOM 1126 CE LYS A 861 10.289 -25.189 27.193 1.00 23.24 C ATOM 1127 NZ LYS A 861 10.580 -26.624 27.411 1.00 10.03 N ATOM 0 H LYS A 861 13.074 -23.361 23.573 1.00 54.54 H new ATOM 0 HA LYS A 861 10.384 -24.496 22.957 1.00 34.40 H new ATOM 0 HB2 LYS A 861 11.257 -22.241 24.702 1.00 33.33 H new ATOM 0 HB3 LYS A 861 9.763 -22.082 23.800 1.00 33.33 H new ATOM 0 HG2 LYS A 861 9.384 -23.078 26.058 1.00 5.05 H new ATOM 0 HG3 LYS A 861 8.883 -24.162 24.775 1.00 5.05 H new ATOM 0 HD2 LYS A 861 10.678 -25.638 25.120 1.00 54.53 H new ATOM 0 HD3 LYS A 861 11.717 -24.394 25.786 1.00 54.53 H new ATOM 0 HE2 LYS A 861 10.827 -24.587 27.925 1.00 23.24 H new ATOM 0 HE3 LYS A 861 9.226 -25.000 27.344 1.00 23.24 H new ATOM 0 HZ1 LYS A 861 10.014 -26.976 28.209 1.00 10.03 H new ATOM 0 HZ2 LYS A 861 10.340 -27.161 26.553 1.00 10.03 H new ATOM 0 HZ3 LYS A 861 11.591 -26.745 27.624 1.00 10.03 H new ATOM 1140 N ILE A 862 10.032 -23.065 20.978 1.00 53.54 N ATOM 1141 CA ILE A 862 9.942 -22.429 19.674 1.00 10.10 C ATOM 1142 C ILE A 862 9.011 -21.218 19.765 1.00 45.30 C ATOM 1143 O ILE A 862 8.101 -21.190 20.592 1.00 63.51 O ATOM 1144 CB ILE A 862 9.525 -23.446 18.610 1.00 44.25 C ATOM 1145 CG1 ILE A 862 8.016 -23.694 18.649 1.00 41.53 C ATOM 1146 CG2 ILE A 862 10.323 -24.744 18.750 1.00 42.15 C ATOM 1147 CD1 ILE A 862 7.302 -22.900 17.553 1.00 74.22 C ATOM 0 H ILE A 862 9.214 -23.613 21.243 1.00 53.54 H new ATOM 0 HA ILE A 862 10.919 -22.058 19.363 1.00 10.10 H new ATOM 0 HB ILE A 862 9.757 -23.029 17.630 1.00 44.25 H new ATOM 0 HG12 ILE A 862 7.815 -24.758 18.522 1.00 41.53 H new ATOM 0 HG13 ILE A 862 7.622 -23.409 19.625 1.00 41.53 H new ATOM 0 HG21 ILE A 862 10.007 -25.450 17.982 1.00 42.15 H new ATOM 0 HG22 ILE A 862 11.386 -24.532 18.633 1.00 42.15 H new ATOM 0 HG23 ILE A 862 10.145 -25.176 19.735 1.00 42.15 H new ATOM 0 HD11 ILE A 862 6.231 -23.094 17.603 1.00 74.22 H new ATOM 0 HD12 ILE A 862 7.485 -21.835 17.697 1.00 74.22 H new ATOM 0 HD13 ILE A 862 7.681 -23.204 16.577 1.00 74.22 H new ATOM 1159 N PHE A 863 9.272 -20.246 18.903 1.00 1.55 N ATOM 1160 CA PHE A 863 8.469 -19.035 18.876 1.00 3.32 C ATOM 1161 C PHE A 863 8.428 -18.436 17.469 1.00 53.13 C ATOM 1162 O PHE A 863 9.355 -18.624 16.683 1.00 72.25 O ATOM 1163 CB PHE A 863 9.136 -18.035 19.823 1.00 14.13 C ATOM 1164 CG PHE A 863 9.291 -18.545 21.258 1.00 55.34 C ATOM 1165 CD1 PHE A 863 10.205 -19.510 21.541 1.00 63.51 C ATOM 1166 CD2 PHE A 863 8.513 -18.032 22.249 1.00 25.31 C ATOM 1167 CE1 PHE A 863 10.349 -19.984 22.872 1.00 40.31 C ATOM 1168 CE2 PHE A 863 8.657 -18.506 23.580 1.00 2.52 C ATOM 1169 CZ PHE A 863 9.572 -19.471 23.864 1.00 70.35 C ATOM 0 H PHE A 863 10.028 -20.272 18.218 1.00 1.55 H new ATOM 0 HA PHE A 863 7.446 -19.260 19.176 1.00 3.32 H new ATOM 0 HB2 PHE A 863 10.120 -17.780 19.431 1.00 14.13 H new ATOM 0 HB3 PHE A 863 8.550 -17.116 19.836 1.00 14.13 H new ATOM 0 HD1 PHE A 863 10.822 -19.917 20.753 1.00 63.51 H new ATOM 0 HD2 PHE A 863 7.787 -17.265 22.024 1.00 25.31 H new ATOM 0 HE1 PHE A 863 11.075 -20.751 23.097 1.00 40.31 H new ATOM 0 HE2 PHE A 863 8.039 -18.100 24.367 1.00 2.52 H new ATOM 0 HZ PHE A 863 9.682 -19.830 24.877 1.00 70.35 H new ATOM 1179 N CYS A 864 7.343 -17.727 17.194 1.00 51.32 N ATOM 1180 CA CYS A 864 7.168 -17.099 15.895 1.00 63.31 C ATOM 1181 C CYS A 864 8.296 -16.085 15.696 1.00 10.51 C ATOM 1182 O CYS A 864 8.655 -15.360 16.623 1.00 32.54 O ATOM 1183 CB CYS A 864 5.788 -16.453 15.760 1.00 43.40 C ATOM 1184 SG CYS A 864 4.585 -17.674 15.121 1.00 53.14 S ATOM 0 H CYS A 864 6.576 -17.573 17.849 1.00 51.32 H new ATOM 0 HA CYS A 864 7.219 -17.856 15.112 1.00 63.31 H new ATOM 0 HB2 CYS A 864 5.457 -16.077 16.728 1.00 43.40 H new ATOM 0 HB3 CYS A 864 5.842 -15.597 15.087 1.00 43.40 H new ATOM 0 HG CYS A 864 4.778 -18.820 15.705 1.00 53.14 H new ATOM 1190 N ALA A 865 8.823 -16.064 14.481 1.00 64.41 N ATOM 1191 CA ALA A 865 9.903 -15.150 14.149 1.00 60.44 C ATOM 1192 C ALA A 865 9.331 -13.747 13.937 1.00 74.54 C ATOM 1193 O ALA A 865 10.078 -12.773 13.862 1.00 34.12 O ATOM 1194 CB ALA A 865 10.649 -15.668 12.917 1.00 4.24 C ATOM 0 H ALA A 865 8.522 -16.665 13.714 1.00 64.41 H new ATOM 0 HA ALA A 865 10.622 -15.093 14.966 1.00 60.44 H new ATOM 0 HB1 ALA A 865 11.459 -14.983 12.667 1.00 4.24 H new ATOM 0 HB2 ALA A 865 11.061 -16.655 13.129 1.00 4.24 H new ATOM 0 HB3 ALA A 865 9.959 -15.736 12.076 1.00 4.24 H new ATOM 1200 N ARG A 866 8.010 -13.689 13.845 1.00 22.43 N ATOM 1201 CA ARG A 866 7.329 -12.422 13.643 1.00 11.13 C ATOM 1202 C ARG A 866 7.608 -11.477 14.814 1.00 74.10 C ATOM 1203 O ARG A 866 8.450 -11.766 15.662 1.00 2.23 O ATOM 1204 CB ARG A 866 5.818 -12.624 13.508 1.00 4.14 C ATOM 1205 CG ARG A 866 5.497 -13.634 12.405 1.00 53.22 C ATOM 1206 CD ARG A 866 5.238 -12.927 11.073 1.00 53.50 C ATOM 1207 NE ARG A 866 4.254 -11.837 11.262 1.00 43.35 N ATOM 1208 CZ ARG A 866 4.176 -10.743 10.474 1.00 72.45 C ATOM 1209 NH1 ARG A 866 5.024 -10.585 9.435 1.00 74.00 N ATOM 1210 NH2 ARG A 866 3.258 -9.831 10.734 1.00 73.41 N ATOM 0 H ARG A 866 7.394 -14.499 13.907 1.00 22.43 H new ATOM 0 HA ARG A 866 7.709 -11.984 12.720 1.00 11.13 H new ATOM 0 HB2 ARG A 866 5.408 -12.972 14.456 1.00 4.14 H new ATOM 0 HB3 ARG A 866 5.339 -11.671 13.284 1.00 4.14 H new ATOM 0 HG2 ARG A 866 6.326 -14.333 12.295 1.00 53.22 H new ATOM 0 HG3 ARG A 866 4.622 -14.219 12.686 1.00 53.22 H new ATOM 0 HD2 ARG A 866 6.170 -12.522 10.679 1.00 53.50 H new ATOM 0 HD3 ARG A 866 4.865 -13.641 10.339 1.00 53.50 H new ATOM 0 HE ARG A 866 3.594 -11.917 12.035 1.00 43.35 H new ATOM 0 HH11 ARG A 866 5.730 -11.295 9.241 1.00 74.00 H new ATOM 0 HH12 ARG A 866 4.958 -9.756 8.845 1.00 74.00 H new ATOM 0 HH21 ARG A 866 2.621 -9.958 11.520 1.00 73.41 H new ATOM 0 HH22 ARG A 866 3.186 -8.999 10.149 1.00 73.41 H new ATOM 1223 N GLN A 867 6.884 -10.367 14.823 1.00 72.45 N ATOM 1224 CA GLN A 867 7.043 -9.378 15.875 1.00 34.41 C ATOM 1225 C GLN A 867 6.883 -10.034 17.248 1.00 22.22 C ATOM 1226 O GLN A 867 7.443 -9.560 18.235 1.00 13.34 O ATOM 1227 CB GLN A 867 6.051 -8.227 15.699 1.00 1.53 C ATOM 1228 CG GLN A 867 6.453 -7.022 16.553 1.00 32.11 C ATOM 1229 CD GLN A 867 5.735 -5.754 16.085 1.00 62.51 C ATOM 1230 OE1 GLN A 867 4.809 -5.791 15.291 1.00 23.42 O ATOM 1231 NE2 GLN A 867 6.212 -4.634 16.619 1.00 5.12 N ATOM 0 H GLN A 867 6.186 -10.131 14.118 1.00 72.45 H new ATOM 0 HA GLN A 867 8.048 -8.962 15.807 1.00 34.41 H new ATOM 0 HB2 GLN A 867 6.009 -7.936 14.649 1.00 1.53 H new ATOM 0 HB3 GLN A 867 5.051 -8.558 15.978 1.00 1.53 H new ATOM 0 HG2 GLN A 867 6.212 -7.216 17.598 1.00 32.11 H new ATOM 0 HG3 GLN A 867 7.532 -6.875 16.496 1.00 32.11 H new ATOM 0 HE21 GLN A 867 6.990 -4.674 17.278 1.00 5.12 H new ATOM 0 HE22 GLN A 867 5.800 -3.735 16.370 1.00 5.12 H new ATOM 1240 N ASN A 868 6.117 -11.115 17.267 1.00 62.11 N ATOM 1241 CA ASN A 868 5.877 -11.841 18.503 1.00 41.14 C ATOM 1242 C ASN A 868 6.835 -13.031 18.584 1.00 73.40 C ATOM 1243 O ASN A 868 6.603 -14.063 17.955 1.00 2.11 O ATOM 1244 CB ASN A 868 4.446 -12.380 18.555 1.00 25.44 C ATOM 1245 CG ASN A 868 3.430 -11.266 18.296 1.00 24.31 C ATOM 1246 OD1 ASN A 868 3.213 -10.838 17.175 1.00 74.04 O ATOM 1247 ND2 ASN A 868 2.823 -10.822 19.393 1.00 73.54 N ATOM 0 H ASN A 868 5.654 -11.506 16.446 1.00 62.11 H new ATOM 0 HA ASN A 868 6.034 -11.154 19.335 1.00 41.14 H new ATOM 0 HB2 ASN A 868 4.324 -13.168 17.812 1.00 25.44 H new ATOM 0 HB3 ASN A 868 4.258 -12.829 19.530 1.00 25.44 H new ATOM 0 HD21 ASN A 868 2.128 -10.078 19.326 1.00 73.54 H new ATOM 0 HD22 ASN A 868 3.052 -11.225 20.301 1.00 73.54 H new ATOM 1254 N CYS A 869 7.890 -12.849 19.364 1.00 50.11 N ATOM 1255 CA CYS A 869 8.884 -13.895 19.536 1.00 74.13 C ATOM 1256 C CYS A 869 8.761 -14.445 20.958 1.00 4.33 C ATOM 1257 O CYS A 869 9.261 -15.529 21.254 1.00 70.24 O ATOM 1258 CB CYS A 869 10.296 -13.388 19.239 1.00 2.22 C ATOM 1259 SG CYS A 869 10.652 -13.538 17.450 1.00 4.45 S ATOM 0 H CYS A 869 8.078 -11.992 19.884 1.00 50.11 H new ATOM 0 HA CYS A 869 8.700 -14.697 18.821 1.00 74.13 H new ATOM 0 HB2 CYS A 869 10.391 -12.348 19.551 1.00 2.22 H new ATOM 0 HB3 CYS A 869 11.025 -13.961 19.812 1.00 2.22 H new ATOM 0 HG CYS A 869 9.631 -14.073 16.848 1.00 4.45 H new ATOM 1265 N SER A 870 8.094 -13.671 21.802 1.00 23.21 N ATOM 1266 CA SER A 870 7.900 -14.067 23.187 1.00 62.04 C ATOM 1267 C SER A 870 6.718 -15.032 23.294 1.00 15.21 C ATOM 1268 O SER A 870 6.317 -15.409 24.394 1.00 3.25 O ATOM 1269 CB SER A 870 7.673 -12.847 24.082 1.00 70.15 C ATOM 1270 OG SER A 870 8.865 -12.087 24.261 1.00 22.30 O ATOM 0 H SER A 870 7.681 -12.772 21.554 1.00 23.21 H new ATOM 0 HA SER A 870 8.804 -14.571 23.529 1.00 62.04 H new ATOM 0 HB2 SER A 870 6.902 -12.214 23.643 1.00 70.15 H new ATOM 0 HB3 SER A 870 7.302 -13.174 25.053 1.00 70.15 H new ATOM 0 HG SER A 870 8.678 -11.316 24.837 1.00 22.30 H new ATOM 1276 N HIS A 871 6.191 -15.404 22.136 1.00 4.25 N ATOM 1277 CA HIS A 871 5.063 -16.317 22.086 1.00 33.45 C ATOM 1278 C HIS A 871 5.489 -17.624 21.415 1.00 64.12 C ATOM 1279 O HIS A 871 5.850 -17.633 20.239 1.00 60.12 O ATOM 1280 CB HIS A 871 3.863 -15.662 21.399 1.00 2.34 C ATOM 1281 CG HIS A 871 3.050 -14.768 22.305 1.00 52.10 C ATOM 1282 ND1 HIS A 871 2.638 -15.156 23.568 1.00 12.30 N ATOM 1283 CD2 HIS A 871 2.578 -13.502 22.118 1.00 51.13 C ATOM 1284 CE1 HIS A 871 1.949 -14.161 24.107 1.00 10.31 C ATOM 1285 NE2 HIS A 871 1.912 -13.137 23.207 1.00 44.14 N ATOM 0 H HIS A 871 6.525 -15.089 21.225 1.00 4.25 H new ATOM 0 HA HIS A 871 4.741 -16.557 23.099 1.00 33.45 H new ATOM 0 HB2 HIS A 871 4.218 -15.077 20.551 1.00 2.34 H new ATOM 0 HB3 HIS A 871 3.216 -16.442 20.999 1.00 2.34 H new ATOM 0 HD2 HIS A 871 2.722 -12.899 21.234 1.00 51.13 H new ATOM 0 HE1 HIS A 871 1.496 -14.161 25.087 1.00 10.31 H new ATOM 0 HE2 HIS A 871 1.449 -12.239 23.347 1.00 44.14 H new ATOM 1293 N ASP A 872 5.434 -18.696 22.191 1.00 64.50 N ATOM 1294 CA ASP A 872 5.811 -20.006 21.686 1.00 13.00 C ATOM 1295 C ASP A 872 4.547 -20.812 21.379 1.00 11.11 C ATOM 1296 O ASP A 872 3.577 -20.764 22.135 1.00 64.55 O ATOM 1297 CB ASP A 872 6.626 -20.782 22.722 1.00 64.12 C ATOM 1298 CG ASP A 872 6.118 -20.671 24.161 1.00 40.14 C ATOM 1299 OD1 ASP A 872 4.992 -21.085 24.474 1.00 51.31 O ATOM 1300 OD2 ASP A 872 6.942 -20.125 24.989 1.00 2.14 O ATOM 0 H ASP A 872 5.134 -18.685 23.166 1.00 64.50 H new ATOM 0 HA ASP A 872 6.413 -19.861 20.789 1.00 13.00 H new ATOM 0 HB2 ASP A 872 6.639 -21.834 22.438 1.00 64.12 H new ATOM 0 HB3 ASP A 872 7.657 -20.430 22.689 1.00 64.12 H new ATOM 1306 N TRP A 873 4.599 -21.533 20.269 1.00 73.21 N ATOM 1307 CA TRP A 873 3.470 -22.348 19.853 1.00 61.33 C ATOM 1308 C TRP A 873 3.936 -23.804 19.791 1.00 32.42 C ATOM 1309 O TRP A 873 3.155 -24.696 19.464 1.00 74.41 O ATOM 1310 CB TRP A 873 2.892 -21.849 18.527 1.00 44.10 C ATOM 1311 CG TRP A 873 3.937 -21.266 17.573 1.00 22.30 C ATOM 1312 CD1 TRP A 873 4.837 -20.305 17.822 1.00 12.02 C ATOM 1313 CD2 TRP A 873 4.155 -21.650 16.199 1.00 42.52 C ATOM 1314 NE1 TRP A 873 5.616 -20.041 16.714 1.00 74.43 N ATOM 1315 CE2 TRP A 873 5.188 -20.885 15.695 1.00 31.22 C ATOM 1316 CE3 TRP A 873 3.502 -22.610 15.408 1.00 75.55 C ATOM 1317 CZ2 TRP A 873 5.659 -21.002 14.382 1.00 75.31 C ATOM 1318 CZ3 TRP A 873 3.984 -22.715 14.097 1.00 33.23 C ATOM 1319 CH2 TRP A 873 5.022 -21.953 13.575 1.00 22.11 C ATOM 0 H TRP A 873 5.405 -21.570 19.645 1.00 73.21 H new ATOM 0 HA TRP A 873 2.655 -22.273 20.572 1.00 61.33 H new ATOM 0 HB2 TRP A 873 2.383 -22.675 18.031 1.00 44.10 H new ATOM 0 HB3 TRP A 873 2.139 -21.088 18.734 1.00 44.10 H new ATOM 0 HD1 TRP A 873 4.940 -19.800 18.771 1.00 12.02 H new ATOM 0 HE1 TRP A 873 6.367 -19.354 16.654 1.00 74.43 H new ATOM 0 HE3 TRP A 873 2.692 -23.219 15.781 1.00 75.55 H new ATOM 0 HZ2 TRP A 873 6.470 -20.392 14.011 1.00 75.31 H new ATOM 0 HZ3 TRP A 873 3.516 -23.439 13.446 1.00 33.23 H new ATOM 0 HH2 TRP A 873 5.336 -22.093 12.551 1.00 22.11 H new ATOM 1330 N GLY A 874 5.207 -24.000 20.111 1.00 15.21 N ATOM 1331 CA GLY A 874 5.786 -25.332 20.096 1.00 34.43 C ATOM 1332 C GLY A 874 7.093 -25.371 20.889 1.00 5.25 C ATOM 1333 O GLY A 874 7.376 -24.465 21.672 1.00 40.43 O ATOM 0 H GLY A 874 5.852 -23.258 20.382 1.00 15.21 H new ATOM 0 HA2 GLY A 874 5.078 -26.045 20.519 1.00 34.43 H new ATOM 0 HA3 GLY A 874 5.972 -25.640 19.067 1.00 34.43 H new ATOM 1337 N ILE A 875 7.857 -26.429 20.660 1.00 34.31 N ATOM 1338 CA ILE A 875 9.128 -26.598 21.343 1.00 12.35 C ATOM 1339 C ILE A 875 10.105 -27.329 20.421 1.00 71.02 C ATOM 1340 O ILE A 875 9.735 -27.747 19.325 1.00 74.30 O ATOM 1341 CB ILE A 875 8.923 -27.288 22.694 1.00 41.24 C ATOM 1342 CG1 ILE A 875 8.855 -28.807 22.528 1.00 73.32 C ATOM 1343 CG2 ILE A 875 7.691 -26.733 23.411 1.00 32.54 C ATOM 1344 CD1 ILE A 875 7.915 -29.192 21.383 1.00 21.33 C ATOM 0 H ILE A 875 7.620 -27.179 20.010 1.00 34.31 H new ATOM 0 HA ILE A 875 9.570 -25.628 21.570 1.00 12.35 H new ATOM 0 HB ILE A 875 9.786 -27.072 23.324 1.00 41.24 H new ATOM 0 HG12 ILE A 875 9.853 -29.200 22.332 1.00 73.32 H new ATOM 0 HG13 ILE A 875 8.509 -29.263 23.456 1.00 73.32 H new ATOM 0 HG21 ILE A 875 7.568 -27.240 24.368 1.00 32.54 H new ATOM 0 HG22 ILE A 875 7.819 -25.664 23.581 1.00 32.54 H new ATOM 0 HG23 ILE A 875 6.807 -26.899 22.796 1.00 32.54 H new ATOM 0 HD11 ILE A 875 7.885 -30.277 21.286 1.00 21.33 H new ATOM 0 HD12 ILE A 875 6.913 -28.818 21.594 1.00 21.33 H new ATOM 0 HD13 ILE A 875 8.277 -28.755 20.452 1.00 21.33 H new ATOM 1356 N HIS A 876 11.334 -27.461 20.898 1.00 12.13 N ATOM 1357 CA HIS A 876 12.367 -28.134 20.130 1.00 71.51 C ATOM 1358 C HIS A 876 12.787 -29.418 20.849 1.00 11.23 C ATOM 1359 O HIS A 876 13.515 -29.369 21.840 1.00 51.14 O ATOM 1360 CB HIS A 876 13.543 -27.194 19.860 1.00 61.13 C ATOM 1361 CG HIS A 876 14.220 -27.424 18.529 1.00 11.34 C ATOM 1362 ND1 HIS A 876 14.086 -26.555 17.460 1.00 3.15 N ATOM 1363 CD2 HIS A 876 15.037 -28.431 18.107 1.00 31.12 C ATOM 1364 CE1 HIS A 876 14.794 -27.028 16.446 1.00 64.43 C ATOM 1365 NE2 HIS A 876 15.382 -28.191 16.848 1.00 23.53 N ATOM 0 H HIS A 876 11.638 -27.113 21.807 1.00 12.13 H new ATOM 0 HA HIS A 876 11.973 -28.418 19.154 1.00 71.51 H new ATOM 0 HB2 HIS A 876 13.189 -26.164 19.903 1.00 61.13 H new ATOM 0 HB3 HIS A 876 14.279 -27.311 20.656 1.00 61.13 H new ATOM 0 HD2 HIS A 876 15.350 -29.280 18.697 1.00 31.12 H new ATOM 0 HE1 HIS A 876 14.889 -26.573 15.471 1.00 64.43 H new ATOM 0 HE2 HIS A 876 15.987 -28.779 16.275 1.00 23.53 H new ATOM 1373 N VAL A 877 12.310 -30.536 20.323 1.00 31.21 N ATOM 1374 CA VAL A 877 12.627 -31.831 20.903 1.00 53.45 C ATOM 1375 C VAL A 877 13.484 -32.629 19.918 1.00 34.22 C ATOM 1376 O VAL A 877 13.766 -32.163 18.816 1.00 61.04 O ATOM 1377 CB VAL A 877 11.339 -32.556 21.299 1.00 1.42 C ATOM 1378 CG1 VAL A 877 10.293 -31.569 21.822 1.00 61.01 C ATOM 1379 CG2 VAL A 877 10.787 -33.372 20.129 1.00 53.22 C ATOM 0 H VAL A 877 11.706 -30.573 19.502 1.00 31.21 H new ATOM 0 HA VAL A 877 13.209 -31.709 21.816 1.00 53.45 H new ATOM 0 HB VAL A 877 11.579 -33.248 22.106 1.00 1.42 H new ATOM 0 HG11 VAL A 877 9.387 -32.110 22.096 1.00 61.01 H new ATOM 0 HG12 VAL A 877 10.686 -31.052 22.697 1.00 61.01 H new ATOM 0 HG13 VAL A 877 10.059 -30.841 21.045 1.00 61.01 H new ATOM 0 HG21 VAL A 877 9.872 -33.877 20.437 1.00 53.22 H new ATOM 0 HG22 VAL A 877 10.571 -32.708 19.292 1.00 53.22 H new ATOM 0 HG23 VAL A 877 11.525 -34.113 19.822 1.00 53.22 H new ATOM 1389 N LYS A 878 13.873 -33.819 20.352 1.00 1.22 N ATOM 1390 CA LYS A 878 14.692 -34.687 19.523 1.00 40.30 C ATOM 1391 C LYS A 878 13.998 -36.041 19.369 1.00 73.31 C ATOM 1392 O LYS A 878 13.434 -36.567 20.328 1.00 50.43 O ATOM 1393 CB LYS A 878 16.111 -34.784 20.087 1.00 40.51 C ATOM 1394 CG LYS A 878 16.857 -35.979 19.491 1.00 23.12 C ATOM 1395 CD LYS A 878 18.345 -35.927 19.843 1.00 23.44 C ATOM 1396 CE LYS A 878 18.604 -36.540 21.221 1.00 22.02 C ATOM 1397 NZ LYS A 878 18.157 -35.619 22.290 1.00 33.42 N ATOM 0 H LYS A 878 13.636 -34.202 21.267 1.00 1.22 H new ATOM 0 HA LYS A 878 14.799 -34.268 18.523 1.00 40.30 H new ATOM 0 HB2 LYS A 878 16.656 -33.865 19.870 1.00 40.51 H new ATOM 0 HB3 LYS A 878 16.069 -34.881 21.172 1.00 40.51 H new ATOM 0 HG2 LYS A 878 16.423 -36.906 19.865 1.00 23.12 H new ATOM 0 HG3 LYS A 878 16.736 -35.985 18.408 1.00 23.12 H new ATOM 0 HD2 LYS A 878 18.920 -36.464 19.088 1.00 23.44 H new ATOM 0 HD3 LYS A 878 18.689 -34.893 19.830 1.00 23.44 H new ATOM 0 HE2 LYS A 878 18.077 -37.490 21.308 1.00 22.02 H new ATOM 0 HE3 LYS A 878 19.667 -36.753 21.337 1.00 22.02 H new ATOM 0 HZ1 LYS A 878 18.853 -35.621 23.063 1.00 33.42 H new ATOM 0 HZ2 LYS A 878 18.069 -34.657 21.905 1.00 33.42 H new ATOM 0 HZ3 LYS A 878 17.234 -35.931 22.654 1.00 33.42 H new ATOM 1410 N TYR A 879 14.061 -36.568 18.155 1.00 63.20 N ATOM 1411 CA TYR A 879 13.446 -37.852 17.863 1.00 54.40 C ATOM 1412 C TYR A 879 14.491 -38.869 17.402 1.00 23.11 C ATOM 1413 O TYR A 879 15.595 -38.495 17.009 1.00 61.43 O ATOM 1414 CB TYR A 879 12.461 -37.597 16.720 1.00 0.30 C ATOM 1415 CG TYR A 879 11.216 -38.485 16.762 1.00 52.32 C ATOM 1416 CD1 TYR A 879 11.304 -39.815 16.403 1.00 42.51 C ATOM 1417 CD2 TYR A 879 10.004 -37.956 17.158 1.00 22.12 C ATOM 1418 CE1 TYR A 879 10.132 -40.650 16.442 1.00 22.32 C ATOM 1419 CE2 TYR A 879 8.832 -38.792 17.198 1.00 43.15 C ATOM 1420 CZ TYR A 879 8.954 -40.098 16.838 1.00 41.34 C ATOM 1421 OH TYR A 879 7.847 -40.887 16.875 1.00 63.13 O ATOM 0 H TYR A 879 14.529 -36.129 17.362 1.00 63.20 H new ATOM 0 HA TYR A 879 12.961 -38.256 18.752 1.00 54.40 H new ATOM 0 HB2 TYR A 879 12.151 -36.552 16.748 1.00 0.30 H new ATOM 0 HB3 TYR A 879 12.974 -37.752 15.771 1.00 0.30 H new ATOM 0 HD1 TYR A 879 12.252 -40.229 16.093 1.00 42.51 H new ATOM 0 HD2 TYR A 879 9.935 -36.915 17.438 1.00 22.12 H new ATOM 0 HE1 TYR A 879 10.187 -41.692 16.163 1.00 22.32 H new ATOM 0 HE2 TYR A 879 7.878 -38.391 17.507 1.00 43.15 H new ATOM 0 HH TYR A 879 7.145 -40.441 17.393 1.00 63.13 H new ATOM 1431 N LYS A 880 14.107 -40.135 17.466 1.00 34.41 N ATOM 1432 CA LYS A 880 14.997 -41.209 17.060 1.00 21.52 C ATOM 1433 C LYS A 880 15.537 -40.916 15.659 1.00 25.12 C ATOM 1434 O LYS A 880 16.586 -41.431 15.274 1.00 71.31 O ATOM 1435 CB LYS A 880 14.292 -42.563 17.177 1.00 44.53 C ATOM 1436 CG LYS A 880 13.716 -42.762 18.580 1.00 1.50 C ATOM 1437 CD LYS A 880 14.754 -42.422 19.652 1.00 32.51 C ATOM 1438 CE LYS A 880 14.605 -40.974 20.121 1.00 54.34 C ATOM 1439 NZ LYS A 880 14.948 -40.855 21.555 1.00 34.15 N ATOM 0 H LYS A 880 13.191 -40.441 17.793 1.00 34.41 H new ATOM 0 HA LYS A 880 15.856 -41.264 17.728 1.00 21.52 H new ATOM 0 HB2 LYS A 880 13.492 -42.625 16.439 1.00 44.53 H new ATOM 0 HB3 LYS A 880 14.996 -43.364 16.952 1.00 44.53 H new ATOM 0 HG2 LYS A 880 12.836 -42.132 18.708 1.00 1.50 H new ATOM 0 HG3 LYS A 880 13.389 -43.795 18.700 1.00 1.50 H new ATOM 0 HD2 LYS A 880 14.639 -43.096 20.501 1.00 32.51 H new ATOM 0 HD3 LYS A 880 15.757 -42.578 19.254 1.00 32.51 H new ATOM 0 HE2 LYS A 880 15.253 -40.326 19.531 1.00 54.34 H new ATOM 0 HE3 LYS A 880 13.582 -40.636 19.957 1.00 54.34 H new ATOM 0 HZ1 LYS A 880 14.841 -39.865 21.857 1.00 34.15 H new ATOM 0 HZ2 LYS A 880 14.312 -41.458 22.115 1.00 34.15 H new ATOM 0 HZ3 LYS A 880 15.932 -41.158 21.703 1.00 34.15 H new ATOM 1452 N THR A 881 14.797 -40.089 14.935 1.00 22.53 N ATOM 1453 CA THR A 881 15.189 -39.721 13.585 1.00 31.43 C ATOM 1454 C THR A 881 16.116 -38.505 13.612 1.00 12.51 C ATOM 1455 O THR A 881 17.321 -38.633 13.401 1.00 12.31 O ATOM 1456 CB THR A 881 13.915 -39.497 12.768 1.00 62.20 C ATOM 1457 OG1 THR A 881 13.167 -40.695 12.956 1.00 15.03 O ATOM 1458 CG2 THR A 881 14.185 -39.459 11.262 1.00 33.23 C ATOM 0 H THR A 881 13.928 -39.663 15.258 1.00 22.53 H new ATOM 0 HA THR A 881 15.762 -40.516 13.108 1.00 31.43 H new ATOM 0 HB THR A 881 13.445 -38.563 13.077 1.00 62.20 H new ATOM 0 HG1 THR A 881 12.323 -40.635 12.461 1.00 15.03 H new ATOM 0 HG21 THR A 881 13.248 -39.298 10.728 1.00 33.23 H new ATOM 0 HG22 THR A 881 14.876 -38.646 11.037 1.00 33.23 H new ATOM 0 HG23 THR A 881 14.624 -40.406 10.947 1.00 33.23 H new ATOM 1466 N PHE A 882 15.518 -37.351 13.873 1.00 22.33 N ATOM 1467 CA PHE A 882 16.275 -36.112 13.930 1.00 21.24 C ATOM 1468 C PHE A 882 15.630 -35.120 14.900 1.00 53.44 C ATOM 1469 O PHE A 882 14.544 -35.372 15.420 1.00 2.54 O ATOM 1470 CB PHE A 882 16.261 -35.514 12.522 1.00 20.33 C ATOM 1471 CG PHE A 882 17.466 -35.909 11.666 1.00 22.54 C ATOM 1472 CD1 PHE A 882 17.449 -37.074 10.964 1.00 32.00 C ATOM 1473 CD2 PHE A 882 18.555 -35.096 11.608 1.00 73.40 C ATOM 1474 CE1 PHE A 882 18.567 -37.441 10.170 1.00 42.22 C ATOM 1475 CE2 PHE A 882 19.673 -35.463 10.814 1.00 62.23 C ATOM 1476 CZ PHE A 882 19.656 -36.628 10.111 1.00 12.24 C ATOM 0 H PHE A 882 14.518 -37.248 14.047 1.00 22.33 H new ATOM 0 HA PHE A 882 17.289 -36.311 14.277 1.00 21.24 H new ATOM 0 HB2 PHE A 882 15.349 -35.828 12.014 1.00 20.33 H new ATOM 0 HB3 PHE A 882 16.224 -34.427 12.600 1.00 20.33 H new ATOM 0 HD1 PHE A 882 16.585 -37.720 11.011 1.00 32.00 H new ATOM 0 HD2 PHE A 882 18.569 -34.171 12.166 1.00 73.40 H new ATOM 0 HE1 PHE A 882 18.553 -38.366 9.613 1.00 42.22 H new ATOM 0 HE2 PHE A 882 20.537 -34.817 10.768 1.00 62.23 H new ATOM 0 HZ PHE A 882 20.507 -36.907 9.507 1.00 12.24 H new ATOM 1486 N GLU A 883 16.325 -34.012 15.112 1.00 21.14 N ATOM 1487 CA GLU A 883 15.833 -32.981 16.010 1.00 45.52 C ATOM 1488 C GLU A 883 15.059 -31.920 15.225 1.00 10.53 C ATOM 1489 O GLU A 883 15.644 -31.167 14.448 1.00 60.22 O ATOM 1490 CB GLU A 883 16.981 -32.349 16.800 1.00 1.12 C ATOM 1491 CG GLU A 883 16.455 -31.325 17.808 1.00 54.12 C ATOM 1492 CD GLU A 883 17.582 -30.423 18.313 1.00 44.21 C ATOM 1493 OE1 GLU A 883 17.902 -30.441 19.511 1.00 73.40 O ATOM 1494 OE2 GLU A 883 18.135 -29.684 17.411 1.00 21.12 O ATOM 0 H GLU A 883 17.225 -33.806 14.678 1.00 21.14 H new ATOM 0 HA GLU A 883 15.154 -33.443 16.726 1.00 45.52 H new ATOM 0 HB2 GLU A 883 17.538 -33.126 17.323 1.00 1.12 H new ATOM 0 HB3 GLU A 883 17.676 -31.865 16.114 1.00 1.12 H new ATOM 0 HG2 GLU A 883 15.679 -30.717 17.343 1.00 54.12 H new ATOM 0 HG3 GLU A 883 15.994 -31.842 18.649 1.00 54.12 H new ATOM 1502 N ILE A 884 13.755 -31.893 15.457 1.00 74.25 N ATOM 1503 CA ILE A 884 12.894 -30.937 14.781 1.00 0.11 C ATOM 1504 C ILE A 884 11.823 -30.444 15.756 1.00 73.20 C ATOM 1505 O ILE A 884 11.486 -31.136 16.715 1.00 34.32 O ATOM 1506 CB ILE A 884 12.325 -31.542 13.496 1.00 31.34 C ATOM 1507 CG1 ILE A 884 12.154 -33.057 13.633 1.00 53.31 C ATOM 1508 CG2 ILE A 884 13.184 -31.169 12.287 1.00 65.31 C ATOM 1509 CD1 ILE A 884 11.265 -33.402 14.829 1.00 31.33 C ATOM 0 H ILE A 884 13.273 -32.518 16.104 1.00 74.25 H new ATOM 0 HA ILE A 884 13.467 -30.064 14.467 1.00 0.11 H new ATOM 0 HB ILE A 884 11.334 -31.120 13.329 1.00 31.34 H new ATOM 0 HG12 ILE A 884 11.715 -33.461 12.721 1.00 53.31 H new ATOM 0 HG13 ILE A 884 13.130 -33.527 13.753 1.00 53.31 H new ATOM 0 HG21 ILE A 884 12.757 -31.612 11.387 1.00 65.31 H new ATOM 0 HG22 ILE A 884 13.211 -30.085 12.180 1.00 65.31 H new ATOM 0 HG23 ILE A 884 14.197 -31.544 12.431 1.00 65.31 H new ATOM 0 HD11 ILE A 884 11.160 -34.484 14.904 1.00 31.33 H new ATOM 0 HD12 ILE A 884 11.719 -33.018 15.742 1.00 31.33 H new ATOM 0 HD13 ILE A 884 10.282 -32.950 14.694 1.00 31.33 H new ATOM 1521 N PRO A 885 11.304 -29.220 15.469 1.00 33.31 N ATOM 1522 CA PRO A 885 10.278 -28.627 16.309 1.00 15.13 C ATOM 1523 C PRO A 885 8.922 -29.295 16.074 1.00 74.34 C ATOM 1524 O PRO A 885 8.300 -29.096 15.031 1.00 62.21 O ATOM 1525 CB PRO A 885 10.282 -27.150 15.951 1.00 12.45 C ATOM 1526 CG PRO A 885 10.978 -27.049 14.604 1.00 73.22 C ATOM 1527 CD PRO A 885 11.679 -28.372 14.342 1.00 72.05 C ATOM 0 HA PRO A 885 10.473 -28.767 17.372 1.00 15.13 H new ATOM 0 HB2 PRO A 885 9.266 -26.759 15.896 1.00 12.45 H new ATOM 0 HB3 PRO A 885 10.808 -26.566 16.707 1.00 12.45 H new ATOM 0 HG2 PRO A 885 10.256 -26.837 13.816 1.00 73.22 H new ATOM 0 HG3 PRO A 885 11.697 -26.230 14.606 1.00 73.22 H new ATOM 0 HD2 PRO A 885 11.360 -28.808 13.395 1.00 72.05 H new ATOM 0 HD3 PRO A 885 12.760 -28.243 14.286 1.00 72.05 H new ATOM 1535 N VAL A 886 8.502 -30.074 17.060 1.00 65.52 N ATOM 1536 CA VAL A 886 7.232 -30.773 16.973 1.00 35.40 C ATOM 1537 C VAL A 886 6.134 -29.907 17.595 1.00 45.11 C ATOM 1538 O VAL A 886 6.185 -29.593 18.783 1.00 22.21 O ATOM 1539 CB VAL A 886 7.347 -32.152 17.626 1.00 33.13 C ATOM 1540 CG1 VAL A 886 6.082 -32.979 17.388 1.00 32.12 C ATOM 1541 CG2 VAL A 886 8.589 -32.893 17.127 1.00 34.31 C ATOM 0 H VAL A 886 9.020 -30.236 17.924 1.00 65.52 H new ATOM 0 HA VAL A 886 6.961 -30.943 15.931 1.00 35.40 H new ATOM 0 HB VAL A 886 7.454 -32.006 18.701 1.00 33.13 H new ATOM 0 HG11 VAL A 886 6.190 -33.954 17.863 1.00 32.12 H new ATOM 0 HG12 VAL A 886 5.223 -32.461 17.815 1.00 32.12 H new ATOM 0 HG13 VAL A 886 5.930 -33.112 16.317 1.00 32.12 H new ATOM 0 HG21 VAL A 886 8.647 -33.870 17.607 1.00 34.31 H new ATOM 0 HG22 VAL A 886 8.526 -33.022 16.047 1.00 34.31 H new ATOM 0 HG23 VAL A 886 9.480 -32.315 17.372 1.00 34.31 H new ATOM 1551 N ILE A 887 5.168 -29.545 16.764 1.00 44.24 N ATOM 1552 CA ILE A 887 4.061 -28.721 17.217 1.00 11.30 C ATOM 1553 C ILE A 887 2.810 -29.590 17.363 1.00 63.03 C ATOM 1554 O ILE A 887 2.837 -30.779 17.049 1.00 34.22 O ATOM 1555 CB ILE A 887 3.871 -27.520 16.288 1.00 74.34 C ATOM 1556 CG1 ILE A 887 5.208 -27.065 15.699 1.00 13.04 C ATOM 1557 CG2 ILE A 887 3.142 -26.382 17.005 1.00 43.33 C ATOM 1558 CD1 ILE A 887 6.152 -26.574 16.799 1.00 73.30 C ATOM 0 H ILE A 887 5.129 -29.807 15.779 1.00 44.24 H new ATOM 0 HA ILE A 887 4.275 -28.303 18.200 1.00 11.30 H new ATOM 0 HB ILE A 887 3.241 -27.830 15.454 1.00 74.34 H new ATOM 0 HG12 ILE A 887 5.671 -27.890 15.159 1.00 13.04 H new ATOM 0 HG13 ILE A 887 5.039 -26.266 14.977 1.00 13.04 H new ATOM 0 HG21 ILE A 887 3.020 -25.541 16.322 1.00 43.33 H new ATOM 0 HG22 ILE A 887 2.162 -26.728 17.334 1.00 43.33 H new ATOM 0 HG23 ILE A 887 3.724 -26.065 17.870 1.00 43.33 H new ATOM 0 HD11 ILE A 887 7.095 -26.256 16.354 1.00 73.30 H new ATOM 0 HD12 ILE A 887 5.696 -25.733 17.321 1.00 73.30 H new ATOM 0 HD13 ILE A 887 6.338 -27.382 17.506 1.00 73.30 H new ATOM 1570 N LYS A 888 1.745 -28.963 17.838 1.00 14.24 N ATOM 1571 CA LYS A 888 0.487 -29.664 18.029 1.00 35.24 C ATOM 1572 C LYS A 888 -0.524 -29.184 16.986 1.00 42.22 C ATOM 1573 O LYS A 888 -0.294 -28.183 16.308 1.00 23.24 O ATOM 1574 CB LYS A 888 0.001 -29.510 19.472 1.00 31.21 C ATOM 1575 CG LYS A 888 0.075 -28.050 19.922 1.00 13.35 C ATOM 1576 CD LYS A 888 -0.539 -27.873 21.313 1.00 60.12 C ATOM 1577 CE LYS A 888 0.504 -28.112 22.407 1.00 52.43 C ATOM 1578 NZ LYS A 888 -0.054 -27.777 23.736 1.00 1.12 N ATOM 0 H LYS A 888 1.727 -27.976 18.097 1.00 14.24 H new ATOM 0 HA LYS A 888 0.621 -30.735 17.874 1.00 35.24 H new ATOM 0 HB2 LYS A 888 -1.025 -29.868 19.554 1.00 31.21 H new ATOM 0 HB3 LYS A 888 0.608 -30.129 20.132 1.00 31.21 H new ATOM 0 HG2 LYS A 888 1.114 -27.722 19.935 1.00 13.35 H new ATOM 0 HG3 LYS A 888 -0.450 -27.418 19.206 1.00 13.35 H new ATOM 0 HD2 LYS A 888 -0.948 -26.867 21.409 1.00 60.12 H new ATOM 0 HD3 LYS A 888 -1.369 -28.568 21.439 1.00 60.12 H new ATOM 0 HE2 LYS A 888 0.823 -29.154 22.392 1.00 52.43 H new ATOM 0 HE3 LYS A 888 1.388 -27.505 22.214 1.00 52.43 H new ATOM 0 HZ1 LYS A 888 0.666 -27.945 24.467 1.00 1.12 H new ATOM 0 HZ2 LYS A 888 -0.337 -26.776 23.752 1.00 1.12 H new ATOM 0 HZ3 LYS A 888 -0.884 -28.374 23.925 1.00 1.12 H new ATOM 1591 N ILE A 889 -1.621 -29.919 16.889 1.00 74.52 N ATOM 1592 CA ILE A 889 -2.668 -29.581 15.939 1.00 22.01 C ATOM 1593 C ILE A 889 -3.493 -28.416 16.490 1.00 63.04 C ATOM 1594 O ILE A 889 -4.163 -27.714 15.734 1.00 1.31 O ATOM 1595 CB ILE A 889 -3.502 -30.818 15.597 1.00 5.43 C ATOM 1596 CG1 ILE A 889 -4.047 -30.734 14.170 1.00 12.43 C ATOM 1597 CG2 ILE A 889 -4.615 -31.029 16.625 1.00 22.42 C ATOM 1598 CD1 ILE A 889 -4.947 -31.931 13.856 1.00 1.41 C ATOM 0 H ILE A 889 -1.808 -30.748 17.453 1.00 74.52 H new ATOM 0 HA ILE A 889 -2.234 -29.248 14.996 1.00 22.01 H new ATOM 0 HB ILE A 889 -2.852 -31.692 15.642 1.00 5.43 H new ATOM 0 HG12 ILE A 889 -4.610 -29.809 14.046 1.00 12.43 H new ATOM 0 HG13 ILE A 889 -3.219 -30.701 13.462 1.00 12.43 H new ATOM 0 HG21 ILE A 889 -5.193 -31.914 16.359 1.00 22.42 H new ATOM 0 HG22 ILE A 889 -4.176 -31.166 17.613 1.00 22.42 H new ATOM 0 HG23 ILE A 889 -5.270 -30.158 16.636 1.00 22.42 H new ATOM 0 HD11 ILE A 889 -5.321 -31.847 12.836 1.00 1.41 H new ATOM 0 HD12 ILE A 889 -4.375 -32.853 13.958 1.00 1.41 H new ATOM 0 HD13 ILE A 889 -5.787 -31.947 14.550 1.00 1.41 H new ATOM 1610 N GLU A 890 -3.417 -28.247 17.801 1.00 2.34 N ATOM 1611 CA GLU A 890 -4.148 -27.179 18.462 1.00 52.12 C ATOM 1612 C GLU A 890 -3.244 -25.960 18.661 1.00 73.54 C ATOM 1613 O GLU A 890 -3.577 -25.055 19.424 1.00 45.45 O ATOM 1614 CB GLU A 890 -4.728 -27.655 19.795 1.00 11.32 C ATOM 1615 CG GLU A 890 -3.616 -27.931 20.809 1.00 13.14 C ATOM 1616 CD GLU A 890 -4.133 -27.785 22.242 1.00 23.23 C ATOM 1617 OE1 GLU A 890 -4.895 -28.641 22.716 1.00 11.54 O ATOM 1618 OE2 GLU A 890 -3.714 -26.739 22.869 1.00 4.51 O ATOM 0 H GLU A 890 -2.860 -28.832 18.424 1.00 2.34 H new ATOM 0 HA GLU A 890 -4.982 -26.887 17.824 1.00 52.12 H new ATOM 0 HB2 GLU A 890 -5.407 -26.900 20.191 1.00 11.32 H new ATOM 0 HB3 GLU A 890 -5.315 -28.560 19.638 1.00 11.32 H new ATOM 0 HG2 GLU A 890 -3.225 -28.937 20.660 1.00 13.14 H new ATOM 0 HG3 GLU A 890 -2.789 -27.240 20.645 1.00 13.14 H new ATOM 1626 N SER A 891 -2.119 -25.978 17.961 1.00 53.30 N ATOM 1627 CA SER A 891 -1.165 -24.886 18.051 1.00 12.51 C ATOM 1628 C SER A 891 -1.459 -23.844 16.970 1.00 43.24 C ATOM 1629 O SER A 891 -1.516 -22.648 17.253 1.00 32.35 O ATOM 1630 CB SER A 891 0.271 -25.397 17.920 1.00 51.40 C ATOM 1631 OG SER A 891 0.876 -25.621 19.191 1.00 73.14 O ATOM 0 H SER A 891 -1.847 -26.731 17.329 1.00 53.30 H new ATOM 0 HA SER A 891 -1.268 -24.421 19.032 1.00 12.51 H new ATOM 0 HB2 SER A 891 0.275 -26.325 17.348 1.00 51.40 H new ATOM 0 HB3 SER A 891 0.863 -24.674 17.359 1.00 51.40 H new ATOM 0 HG SER A 891 1.842 -25.473 19.124 1.00 73.14 H new ATOM 1637 N PHE A 892 -1.637 -24.335 15.752 1.00 23.43 N ATOM 1638 CA PHE A 892 -1.923 -23.462 14.627 1.00 42.02 C ATOM 1639 C PHE A 892 -3.208 -23.889 13.914 1.00 24.01 C ATOM 1640 O PHE A 892 -3.679 -25.011 14.095 1.00 3.32 O ATOM 1641 CB PHE A 892 -0.749 -23.587 13.654 1.00 5.31 C ATOM 1642 CG PHE A 892 -0.276 -25.025 13.430 1.00 0.41 C ATOM 1643 CD1 PHE A 892 -1.127 -25.946 12.905 1.00 32.11 C ATOM 1644 CD2 PHE A 892 0.995 -25.381 13.756 1.00 24.11 C ATOM 1645 CE1 PHE A 892 -0.689 -27.281 12.697 1.00 4.41 C ATOM 1646 CE2 PHE A 892 1.434 -26.716 13.548 1.00 11.43 C ATOM 1647 CZ PHE A 892 0.583 -27.637 13.023 1.00 33.11 C ATOM 0 H PHE A 892 -1.589 -25.327 15.520 1.00 23.43 H new ATOM 0 HA PHE A 892 -2.056 -22.438 14.976 1.00 42.02 H new ATOM 0 HB2 PHE A 892 -1.038 -23.157 12.695 1.00 5.31 H new ATOM 0 HB3 PHE A 892 0.086 -22.995 14.030 1.00 5.31 H new ATOM 0 HD1 PHE A 892 -2.136 -25.662 12.646 1.00 32.11 H new ATOM 0 HD2 PHE A 892 1.671 -24.649 14.173 1.00 24.11 H new ATOM 0 HE1 PHE A 892 -1.365 -28.013 12.280 1.00 4.41 H new ATOM 0 HE2 PHE A 892 2.444 -26.999 13.807 1.00 11.43 H new ATOM 0 HZ PHE A 892 0.917 -28.652 12.865 1.00 33.11 H new ATOM 1657 N VAL A 893 -3.738 -22.972 13.119 1.00 40.24 N ATOM 1658 CA VAL A 893 -4.959 -23.239 12.378 1.00 71.32 C ATOM 1659 C VAL A 893 -4.602 -23.702 10.964 1.00 43.22 C ATOM 1660 O VAL A 893 -3.475 -23.508 10.510 1.00 71.13 O ATOM 1661 CB VAL A 893 -5.861 -22.004 12.393 1.00 54.24 C ATOM 1662 CG1 VAL A 893 -5.775 -21.278 13.736 1.00 5.53 C ATOM 1663 CG2 VAL A 893 -5.520 -21.061 11.237 1.00 64.53 C ATOM 0 H VAL A 893 -3.344 -22.043 12.972 1.00 40.24 H new ATOM 0 HA VAL A 893 -5.524 -24.043 12.850 1.00 71.32 H new ATOM 0 HB VAL A 893 -6.889 -22.340 12.259 1.00 54.24 H new ATOM 0 HG11 VAL A 893 -6.426 -20.404 13.719 1.00 5.53 H new ATOM 0 HG12 VAL A 893 -6.090 -21.950 14.534 1.00 5.53 H new ATOM 0 HG13 VAL A 893 -4.747 -20.962 13.913 1.00 5.53 H new ATOM 0 HG21 VAL A 893 -6.176 -20.191 11.271 1.00 64.53 H new ATOM 0 HG22 VAL A 893 -4.483 -20.737 11.326 1.00 64.53 H new ATOM 0 HG23 VAL A 893 -5.658 -21.582 10.290 1.00 64.53 H new ATOM 1673 N VAL A 894 -5.582 -24.304 10.307 1.00 31.22 N ATOM 1674 CA VAL A 894 -5.385 -24.796 8.954 1.00 12.21 C ATOM 1675 C VAL A 894 -6.419 -24.154 8.027 1.00 15.23 C ATOM 1676 O VAL A 894 -7.611 -24.440 8.129 1.00 74.14 O ATOM 1677 CB VAL A 894 -5.437 -26.325 8.940 1.00 13.20 C ATOM 1678 CG1 VAL A 894 -6.880 -26.823 8.839 1.00 33.31 C ATOM 1679 CG2 VAL A 894 -4.581 -26.892 7.806 1.00 25.25 C ATOM 0 H VAL A 894 -6.515 -24.462 10.687 1.00 31.22 H new ATOM 0 HA VAL A 894 -4.399 -24.515 8.585 1.00 12.21 H new ATOM 0 HB VAL A 894 -5.024 -26.683 9.883 1.00 13.20 H new ATOM 0 HG11 VAL A 894 -6.889 -27.913 8.831 1.00 33.31 H new ATOM 0 HG12 VAL A 894 -7.450 -26.462 9.695 1.00 33.31 H new ATOM 0 HG13 VAL A 894 -7.330 -26.450 7.919 1.00 33.31 H new ATOM 0 HG21 VAL A 894 -4.635 -27.981 7.818 1.00 25.25 H new ATOM 0 HG22 VAL A 894 -4.951 -26.521 6.850 1.00 25.25 H new ATOM 0 HG23 VAL A 894 -3.546 -26.579 7.940 1.00 25.25 H new ATOM 1689 N GLU A 895 -5.926 -23.298 7.145 1.00 43.31 N ATOM 1690 CA GLU A 895 -6.792 -22.613 6.201 1.00 52.32 C ATOM 1691 C GLU A 895 -6.449 -23.027 4.768 1.00 1.44 C ATOM 1692 O GLU A 895 -5.311 -22.870 4.329 1.00 24.13 O ATOM 1693 CB GLU A 895 -6.697 -21.095 6.371 1.00 72.23 C ATOM 1694 CG GLU A 895 -7.879 -20.393 5.699 1.00 34.24 C ATOM 1695 CD GLU A 895 -7.917 -18.909 6.069 1.00 15.11 C ATOM 1696 OE1 GLU A 895 -8.999 -18.364 6.335 1.00 51.22 O ATOM 1697 OE2 GLU A 895 -6.770 -18.319 6.076 1.00 72.13 O ATOM 0 H GLU A 895 -4.937 -23.063 7.064 1.00 43.31 H new ATOM 0 HA GLU A 895 -7.822 -22.905 6.406 1.00 52.32 H new ATOM 0 HB2 GLU A 895 -6.676 -20.845 7.432 1.00 72.23 H new ATOM 0 HB3 GLU A 895 -5.763 -20.735 5.940 1.00 72.23 H new ATOM 0 HG2 GLU A 895 -7.803 -20.500 4.617 1.00 34.24 H new ATOM 0 HG3 GLU A 895 -8.811 -20.871 6.002 1.00 34.24 H new ATOM 1705 N ASP A 896 -7.454 -23.547 4.080 1.00 51.44 N ATOM 1706 CA ASP A 896 -7.273 -23.984 2.706 1.00 62.11 C ATOM 1707 C ASP A 896 -7.107 -22.760 1.803 1.00 30.10 C ATOM 1708 O ASP A 896 -7.749 -21.734 2.019 1.00 54.42 O ATOM 1709 CB ASP A 896 -8.488 -24.773 2.214 1.00 20.13 C ATOM 1710 CG ASP A 896 -8.250 -26.272 2.018 1.00 1.34 C ATOM 1711 OD1 ASP A 896 -7.449 -26.685 1.166 1.00 33.25 O ATOM 1712 OD2 ASP A 896 -8.936 -27.039 2.796 1.00 54.13 O ATOM 0 H ASP A 896 -8.397 -23.676 4.448 1.00 51.44 H new ATOM 0 HA ASP A 896 -6.390 -24.622 2.669 1.00 62.11 H new ATOM 0 HB2 ASP A 896 -9.302 -24.640 2.927 1.00 20.13 H new ATOM 0 HB3 ASP A 896 -8.820 -24.346 1.268 1.00 20.13 H new ATOM 1718 N ILE A 897 -6.242 -22.909 0.811 1.00 61.32 N ATOM 1719 CA ILE A 897 -5.983 -21.829 -0.126 1.00 15.23 C ATOM 1720 C ILE A 897 -6.988 -21.906 -1.277 1.00 34.12 C ATOM 1721 O ILE A 897 -7.068 -20.994 -2.098 1.00 72.02 O ATOM 1722 CB ILE A 897 -4.523 -21.853 -0.582 1.00 11.45 C ATOM 1723 CG1 ILE A 897 -3.612 -22.388 0.525 1.00 0.20 C ATOM 1724 CG2 ILE A 897 -4.079 -20.473 -1.072 1.00 54.02 C ATOM 1725 CD1 ILE A 897 -3.136 -23.806 0.205 1.00 65.12 C ATOM 0 H ILE A 897 -5.711 -23.762 0.635 1.00 61.32 H new ATOM 0 HA ILE A 897 -6.125 -20.863 0.358 1.00 15.23 H new ATOM 0 HB ILE A 897 -4.440 -22.537 -1.427 1.00 11.45 H new ATOM 0 HG12 ILE A 897 -2.751 -21.729 0.643 1.00 0.20 H new ATOM 0 HG13 ILE A 897 -4.147 -22.386 1.474 1.00 0.20 H new ATOM 0 HG21 ILE A 897 -3.037 -20.518 -1.390 1.00 54.02 H new ATOM 0 HG22 ILE A 897 -4.702 -20.167 -1.912 1.00 54.02 H new ATOM 0 HG23 ILE A 897 -4.180 -19.750 -0.263 1.00 54.02 H new ATOM 0 HD11 ILE A 897 -2.490 -24.163 1.007 1.00 65.12 H new ATOM 0 HD12 ILE A 897 -3.998 -24.467 0.112 1.00 65.12 H new ATOM 0 HD13 ILE A 897 -2.580 -23.800 -0.733 1.00 65.12 H new ATOM 1737 N ALA A 898 -7.730 -23.004 -1.300 1.00 12.44 N ATOM 1738 CA ALA A 898 -8.727 -23.212 -2.336 1.00 43.15 C ATOM 1739 C ALA A 898 -10.109 -22.853 -1.788 1.00 74.04 C ATOM 1740 O ALA A 898 -11.062 -22.695 -2.551 1.00 25.40 O ATOM 1741 CB ALA A 898 -8.653 -24.658 -2.832 1.00 53.52 C ATOM 0 H ALA A 898 -7.660 -23.759 -0.617 1.00 12.44 H new ATOM 0 HA ALA A 898 -8.534 -22.564 -3.191 1.00 43.15 H new ATOM 0 HB1 ALA A 898 -9.401 -24.815 -3.609 1.00 53.52 H new ATOM 0 HB2 ALA A 898 -7.661 -24.853 -3.239 1.00 53.52 H new ATOM 0 HB3 ALA A 898 -8.845 -25.338 -2.002 1.00 53.52 H new ATOM 1747 N THR A 899 -10.176 -22.734 -0.471 1.00 23.35 N ATOM 1748 CA THR A 899 -11.426 -22.397 0.188 1.00 10.15 C ATOM 1749 C THR A 899 -11.241 -21.173 1.088 1.00 34.31 C ATOM 1750 O THR A 899 -12.041 -20.240 1.044 1.00 0.41 O ATOM 1751 CB THR A 899 -11.913 -23.637 0.941 1.00 13.52 C ATOM 1752 OG1 THR A 899 -11.102 -23.673 2.112 1.00 64.21 O ATOM 1753 CG2 THR A 899 -11.572 -24.937 0.211 1.00 53.14 C ATOM 0 H THR A 899 -9.384 -22.865 0.158 1.00 23.35 H new ATOM 0 HA THR A 899 -12.192 -22.117 -0.535 1.00 10.15 H new ATOM 0 HB THR A 899 -12.992 -23.574 1.084 1.00 13.52 H new ATOM 0 HG1 THR A 899 -11.384 -24.418 2.683 1.00 64.21 H new ATOM 0 HG21 THR A 899 -11.940 -25.786 0.788 1.00 53.14 H new ATOM 0 HG22 THR A 899 -12.042 -24.936 -0.773 1.00 53.14 H new ATOM 0 HG23 THR A 899 -10.491 -25.017 0.097 1.00 53.14 H new ATOM 1761 N GLY A 900 -10.182 -21.218 1.883 1.00 14.41 N ATOM 1762 CA GLY A 900 -9.882 -20.124 2.792 1.00 75.12 C ATOM 1763 C GLY A 900 -10.550 -20.342 4.151 1.00 55.30 C ATOM 1764 O GLY A 900 -10.676 -19.408 4.942 1.00 40.24 O ATOM 0 H GLY A 900 -9.521 -21.994 1.917 1.00 14.41 H new ATOM 0 HA2 GLY A 900 -8.803 -20.040 2.922 1.00 75.12 H new ATOM 0 HA3 GLY A 900 -10.225 -19.184 2.361 1.00 75.12 H new ATOM 1768 N VAL A 901 -10.962 -21.580 4.381 1.00 64.11 N ATOM 1769 CA VAL A 901 -11.614 -21.932 5.631 1.00 64.22 C ATOM 1770 C VAL A 901 -10.558 -22.384 6.642 1.00 71.31 C ATOM 1771 O VAL A 901 -9.944 -23.437 6.475 1.00 45.45 O ATOM 1772 CB VAL A 901 -12.692 -22.988 5.379 1.00 24.43 C ATOM 1773 CG1 VAL A 901 -13.602 -23.144 6.599 1.00 22.21 C ATOM 1774 CG2 VAL A 901 -13.505 -22.654 4.127 1.00 20.32 C ATOM 0 H VAL A 901 -10.857 -22.352 3.723 1.00 64.11 H new ATOM 0 HA VAL A 901 -12.120 -21.065 6.056 1.00 64.22 H new ATOM 0 HB VAL A 901 -12.193 -23.942 5.209 1.00 24.43 H new ATOM 0 HG11 VAL A 901 -14.359 -23.900 6.394 1.00 22.21 H new ATOM 0 HG12 VAL A 901 -13.007 -23.450 7.460 1.00 22.21 H new ATOM 0 HG13 VAL A 901 -14.088 -22.193 6.814 1.00 22.21 H new ATOM 0 HG21 VAL A 901 -14.264 -23.420 3.971 1.00 20.32 H new ATOM 0 HG22 VAL A 901 -13.988 -21.685 4.255 1.00 20.32 H new ATOM 0 HG23 VAL A 901 -12.843 -22.618 3.262 1.00 20.32 H new ATOM 1784 N GLN A 902 -10.380 -21.567 7.669 1.00 11.40 N ATOM 1785 CA GLN A 902 -9.409 -21.869 8.707 1.00 35.22 C ATOM 1786 C GLN A 902 -10.081 -22.621 9.858 1.00 25.33 C ATOM 1787 O GLN A 902 -11.232 -22.350 10.194 1.00 12.42 O ATOM 1788 CB GLN A 902 -8.728 -20.595 9.209 1.00 44.24 C ATOM 1789 CG GLN A 902 -9.729 -19.678 9.914 1.00 32.21 C ATOM 1790 CD GLN A 902 -9.034 -18.817 10.971 1.00 74.12 C ATOM 1791 OE1 GLN A 902 -9.583 -18.509 12.016 1.00 3.32 O ATOM 1792 NE2 GLN A 902 -7.800 -18.447 10.641 1.00 20.43 N ATOM 0 H GLN A 902 -10.892 -20.695 7.805 1.00 11.40 H new ATOM 0 HA GLN A 902 -8.637 -22.510 8.280 1.00 35.22 H new ATOM 0 HB2 GLN A 902 -7.922 -20.856 9.896 1.00 44.24 H new ATOM 0 HB3 GLN A 902 -8.274 -20.067 8.371 1.00 44.24 H new ATOM 0 HG2 GLN A 902 -10.218 -19.036 9.181 1.00 32.21 H new ATOM 0 HG3 GLN A 902 -10.509 -20.278 10.384 1.00 32.21 H new ATOM 0 HE21 GLN A 902 -7.401 -18.740 9.749 1.00 20.43 H new ATOM 0 HE22 GLN A 902 -7.253 -17.870 11.280 1.00 20.43 H new ATOM 1801 N THR A 903 -9.331 -23.552 10.431 1.00 15.02 N ATOM 1802 CA THR A 903 -9.839 -24.345 11.538 1.00 75.24 C ATOM 1803 C THR A 903 -8.686 -24.838 12.414 1.00 74.32 C ATOM 1804 O THR A 903 -7.611 -25.156 11.909 1.00 24.43 O ATOM 1805 CB THR A 903 -10.689 -25.478 10.957 1.00 44.43 C ATOM 1806 OG1 THR A 903 -11.394 -24.866 9.881 1.00 53.43 O ATOM 1807 CG2 THR A 903 -11.792 -25.933 11.914 1.00 25.05 C ATOM 0 H THR A 903 -8.376 -23.775 10.149 1.00 15.02 H new ATOM 0 HA THR A 903 -10.472 -23.748 12.195 1.00 75.24 H new ATOM 0 HB THR A 903 -10.047 -26.325 10.714 1.00 44.43 H new ATOM 0 HG1 THR A 903 -11.969 -25.530 9.447 1.00 53.43 H new ATOM 0 HG21 THR A 903 -12.365 -26.738 11.453 1.00 25.05 H new ATOM 0 HG22 THR A 903 -11.344 -26.291 12.841 1.00 25.05 H new ATOM 0 HG23 THR A 903 -12.454 -25.095 12.131 1.00 25.05 H new ATOM 1815 N LEU A 904 -8.950 -24.886 13.711 1.00 31.23 N ATOM 1816 CA LEU A 904 -7.948 -25.335 14.663 1.00 63.23 C ATOM 1817 C LEU A 904 -8.471 -26.566 15.406 1.00 53.30 C ATOM 1818 O LEU A 904 -9.425 -26.470 16.177 1.00 24.35 O ATOM 1819 CB LEU A 904 -7.534 -24.188 15.587 1.00 74.11 C ATOM 1820 CG LEU A 904 -8.585 -23.099 15.816 1.00 63.35 C ATOM 1821 CD1 LEU A 904 -9.648 -23.564 16.813 1.00 5.52 C ATOM 1822 CD2 LEU A 904 -7.928 -21.786 16.247 1.00 73.22 C ATOM 0 H LEU A 904 -9.844 -24.621 14.125 1.00 31.23 H new ATOM 0 HA LEU A 904 -7.039 -25.639 14.144 1.00 63.23 H new ATOM 0 HB2 LEU A 904 -7.258 -24.608 16.554 1.00 74.11 H new ATOM 0 HB3 LEU A 904 -6.639 -23.721 15.175 1.00 74.11 H new ATOM 0 HG LEU A 904 -9.093 -22.909 14.870 1.00 63.35 H new ATOM 0 HD11 LEU A 904 -10.382 -22.772 16.958 1.00 5.52 H new ATOM 0 HD12 LEU A 904 -10.145 -24.454 16.426 1.00 5.52 H new ATOM 0 HD13 LEU A 904 -9.175 -23.799 17.766 1.00 5.52 H new ATOM 0 HD21 LEU A 904 -8.696 -21.029 16.403 1.00 73.22 H new ATOM 0 HD22 LEU A 904 -7.378 -21.942 17.175 1.00 73.22 H new ATOM 0 HD23 LEU A 904 -7.241 -21.451 15.470 1.00 73.22 H new ATOM 1834 N TYR A 905 -7.825 -27.693 15.148 1.00 61.04 N ATOM 1835 CA TYR A 905 -8.213 -28.941 15.783 1.00 55.15 C ATOM 1836 C TYR A 905 -7.793 -28.962 17.254 1.00 40.15 C ATOM 1837 O TYR A 905 -7.327 -27.955 17.784 1.00 45.21 O ATOM 1838 CB TYR A 905 -7.464 -30.046 15.035 1.00 55.34 C ATOM 1839 CG TYR A 905 -7.994 -30.312 13.624 1.00 14.23 C ATOM 1840 CD1 TYR A 905 -9.340 -30.543 13.425 1.00 53.00 C ATOM 1841 CD2 TYR A 905 -7.126 -30.321 12.551 1.00 14.22 C ATOM 1842 CE1 TYR A 905 -9.839 -30.793 12.098 1.00 70.55 C ATOM 1843 CE2 TYR A 905 -7.625 -30.571 11.224 1.00 71.42 C ATOM 1844 CZ TYR A 905 -8.957 -30.795 11.062 1.00 22.44 C ATOM 1845 OH TYR A 905 -9.428 -31.032 9.809 1.00 42.03 O ATOM 0 H TYR A 905 -7.035 -27.768 14.507 1.00 61.04 H new ATOM 0 HA TYR A 905 -9.295 -29.070 15.746 1.00 55.15 H new ATOM 0 HB2 TYR A 905 -6.410 -29.777 14.971 1.00 55.34 H new ATOM 0 HB3 TYR A 905 -7.524 -30.967 15.614 1.00 55.34 H new ATOM 0 HD1 TYR A 905 -10.019 -30.536 14.265 1.00 53.00 H new ATOM 0 HD2 TYR A 905 -6.073 -30.141 12.707 1.00 14.22 H new ATOM 0 HE1 TYR A 905 -10.890 -30.975 11.929 1.00 70.55 H new ATOM 0 HE2 TYR A 905 -6.957 -30.581 10.376 1.00 71.42 H new ATOM 0 HH TYR A 905 -8.686 -31.002 9.170 1.00 42.03 H new ATOM 1855 N SER A 906 -7.973 -30.120 17.871 1.00 73.20 N ATOM 1856 CA SER A 906 -7.618 -30.286 19.270 1.00 14.53 C ATOM 1857 C SER A 906 -6.623 -31.437 19.425 1.00 21.01 C ATOM 1858 O SER A 906 -5.549 -31.261 19.998 1.00 2.11 O ATOM 1859 CB SER A 906 -8.860 -30.539 20.127 1.00 13.32 C ATOM 1860 OG SER A 906 -9.774 -29.446 20.079 1.00 72.44 O ATOM 0 H SER A 906 -8.360 -30.953 17.428 1.00 73.20 H new ATOM 0 HA SER A 906 -7.152 -29.363 19.616 1.00 14.53 H new ATOM 0 HB2 SER A 906 -9.360 -31.445 19.783 1.00 13.32 H new ATOM 0 HB3 SER A 906 -8.558 -30.714 21.160 1.00 13.32 H new ATOM 0 HG SER A 906 -10.554 -29.647 20.637 1.00 72.44 H new ATOM 1866 N LYS A 907 -7.015 -32.590 18.904 1.00 34.22 N ATOM 1867 CA LYS A 907 -6.171 -33.770 18.977 1.00 21.54 C ATOM 1868 C LYS A 907 -5.623 -34.088 17.584 1.00 13.44 C ATOM 1869 O LYS A 907 -6.258 -33.775 16.578 1.00 31.31 O ATOM 1870 CB LYS A 907 -6.930 -34.934 19.619 1.00 11.51 C ATOM 1871 CG LYS A 907 -5.972 -35.877 20.350 1.00 73.05 C ATOM 1872 CD LYS A 907 -5.793 -35.454 21.809 1.00 20.30 C ATOM 1873 CE LYS A 907 -4.882 -34.230 21.917 1.00 10.12 C ATOM 1874 NZ LYS A 907 -3.702 -34.383 21.038 1.00 44.25 N ATOM 0 H LYS A 907 -7.907 -32.732 18.429 1.00 34.22 H new ATOM 0 HA LYS A 907 -5.313 -33.584 19.623 1.00 21.54 H new ATOM 0 HB2 LYS A 907 -7.671 -34.548 20.319 1.00 11.51 H new ATOM 0 HB3 LYS A 907 -7.474 -35.485 18.852 1.00 11.51 H new ATOM 0 HG2 LYS A 907 -6.356 -36.896 20.308 1.00 73.05 H new ATOM 0 HG3 LYS A 907 -5.005 -35.880 19.847 1.00 73.05 H new ATOM 0 HD2 LYS A 907 -6.765 -35.228 22.248 1.00 20.30 H new ATOM 0 HD3 LYS A 907 -5.369 -36.279 22.381 1.00 20.30 H new ATOM 0 HE2 LYS A 907 -5.435 -33.332 21.640 1.00 10.12 H new ATOM 0 HE3 LYS A 907 -4.559 -34.100 22.950 1.00 10.12 H new ATOM 0 HZ1 LYS A 907 -2.889 -33.890 21.459 1.00 44.25 H new ATOM 0 HZ2 LYS A 907 -3.477 -35.393 20.932 1.00 44.25 H new ATOM 0 HZ3 LYS A 907 -3.909 -33.974 20.104 1.00 44.25 H new ATOM 1887 N TRP A 908 -4.451 -34.704 17.571 1.00 44.03 N ATOM 1888 CA TRP A 908 -3.810 -35.067 16.318 1.00 54.22 C ATOM 1889 C TRP A 908 -4.530 -36.295 15.757 1.00 20.35 C ATOM 1890 O TRP A 908 -4.314 -36.675 14.608 1.00 64.22 O ATOM 1891 CB TRP A 908 -2.310 -35.291 16.514 1.00 43.43 C ATOM 1892 CG TRP A 908 -1.701 -34.467 17.650 1.00 22.13 C ATOM 1893 CD1 TRP A 908 -1.329 -33.180 17.629 1.00 10.20 C ATOM 1894 CD2 TRP A 908 -1.406 -34.930 18.985 1.00 14.22 C ATOM 1895 NE1 TRP A 908 -0.819 -32.781 18.847 1.00 5.45 N ATOM 1896 CE2 TRP A 908 -0.867 -33.879 19.698 1.00 13.44 C ATOM 1897 CE3 TRP A 908 -1.590 -36.195 19.571 1.00 41.22 C ATOM 1898 CZ2 TRP A 908 -0.467 -33.985 21.036 1.00 52.22 C ATOM 1899 CZ3 TRP A 908 -1.185 -36.285 20.908 1.00 1.51 C ATOM 1900 CH2 TRP A 908 -0.640 -35.236 21.640 1.00 53.21 C ATOM 0 H TRP A 908 -3.928 -34.961 18.408 1.00 44.03 H new ATOM 0 HA TRP A 908 -3.890 -34.256 15.595 1.00 54.22 H new ATOM 0 HB2 TRP A 908 -2.134 -36.348 16.711 1.00 43.43 H new ATOM 0 HB3 TRP A 908 -1.793 -35.049 15.586 1.00 43.43 H new ATOM 0 HD1 TRP A 908 -1.417 -32.536 16.767 1.00 10.20 H new ATOM 0 HE1 TRP A 908 -0.471 -31.851 19.080 1.00 5.45 H new ATOM 0 HE3 TRP A 908 -2.011 -37.031 19.032 1.00 41.22 H new ATOM 0 HZ2 TRP A 908 -0.048 -33.147 21.573 1.00 52.22 H new ATOM 0 HZ3 TRP A 908 -1.304 -37.236 21.406 1.00 1.51 H new ATOM 0 HH2 TRP A 908 -0.351 -35.386 22.670 1.00 53.21 H new ATOM 1911 N LYS A 909 -5.371 -36.882 16.596 1.00 31.30 N ATOM 1912 CA LYS A 909 -6.124 -38.060 16.199 1.00 61.01 C ATOM 1913 C LYS A 909 -7.023 -37.709 15.012 1.00 41.03 C ATOM 1914 O LYS A 909 -7.542 -38.597 14.338 1.00 73.32 O ATOM 1915 CB LYS A 909 -6.883 -38.639 17.395 1.00 65.44 C ATOM 1916 CG LYS A 909 -8.275 -38.017 17.514 1.00 32.11 C ATOM 1917 CD LYS A 909 -9.050 -38.627 18.684 1.00 23.12 C ATOM 1918 CE LYS A 909 -8.922 -40.152 18.691 1.00 53.34 C ATOM 1919 NZ LYS A 909 -7.747 -40.570 19.487 1.00 70.21 N ATOM 0 H LYS A 909 -5.548 -36.564 17.549 1.00 31.30 H new ATOM 0 HA LYS A 909 -5.450 -38.849 15.866 1.00 61.01 H new ATOM 0 HB2 LYS A 909 -6.972 -39.720 17.285 1.00 65.44 H new ATOM 0 HB3 LYS A 909 -6.320 -38.457 18.310 1.00 65.44 H new ATOM 0 HG2 LYS A 909 -8.185 -36.940 17.655 1.00 32.11 H new ATOM 0 HG3 LYS A 909 -8.827 -38.172 16.587 1.00 32.11 H new ATOM 0 HD2 LYS A 909 -8.674 -38.223 19.624 1.00 23.12 H new ATOM 0 HD3 LYS A 909 -10.101 -38.347 18.614 1.00 23.12 H new ATOM 0 HE2 LYS A 909 -9.827 -40.597 19.106 1.00 53.34 H new ATOM 0 HE3 LYS A 909 -8.826 -40.519 17.669 1.00 53.34 H new ATOM 0 HZ1 LYS A 909 -7.104 -41.129 18.890 1.00 70.21 H new ATOM 0 HZ2 LYS A 909 -7.248 -39.728 19.838 1.00 70.21 H new ATOM 0 HZ3 LYS A 909 -8.061 -41.147 20.293 1.00 70.21 H new ATOM 1932 N ASP A 910 -7.179 -36.412 14.792 1.00 51.21 N ATOM 1933 CA ASP A 910 -8.006 -35.932 13.698 1.00 73.42 C ATOM 1934 C ASP A 910 -7.164 -35.856 12.423 1.00 42.51 C ATOM 1935 O ASP A 910 -7.599 -35.292 11.420 1.00 1.41 O ATOM 1936 CB ASP A 910 -8.550 -34.532 13.991 1.00 65.45 C ATOM 1937 CG ASP A 910 -9.584 -34.462 15.116 1.00 61.42 C ATOM 1938 OD1 ASP A 910 -10.513 -33.642 15.079 1.00 20.11 O ATOM 1939 OD2 ASP A 910 -9.405 -35.308 16.074 1.00 52.41 O ATOM 0 H ASP A 910 -6.746 -35.678 15.353 1.00 51.21 H new ATOM 0 HA ASP A 910 -8.840 -36.624 13.577 1.00 73.42 H new ATOM 0 HB2 ASP A 910 -7.714 -33.880 14.245 1.00 65.45 H new ATOM 0 HB3 ASP A 910 -8.999 -34.135 13.080 1.00 65.45 H new ATOM 1945 N PHE A 911 -5.973 -36.431 12.503 1.00 11.22 N ATOM 1946 CA PHE A 911 -5.066 -36.435 11.368 1.00 3.43 C ATOM 1947 C PHE A 911 -5.689 -37.154 10.170 1.00 22.24 C ATOM 1948 O PHE A 911 -5.514 -38.361 10.007 1.00 14.21 O ATOM 1949 CB PHE A 911 -3.808 -37.189 11.804 1.00 71.33 C ATOM 1950 CG PHE A 911 -4.088 -38.407 12.687 1.00 64.01 C ATOM 1951 CD1 PHE A 911 -5.311 -39.000 12.660 1.00 14.12 C ATOM 1952 CD2 PHE A 911 -3.112 -38.896 13.499 1.00 75.53 C ATOM 1953 CE1 PHE A 911 -5.571 -40.130 13.480 1.00 42.11 C ATOM 1954 CE2 PHE A 911 -3.372 -40.027 14.319 1.00 40.45 C ATOM 1955 CZ PHE A 911 -4.596 -40.619 14.292 1.00 63.53 C ATOM 0 H PHE A 911 -5.615 -36.897 13.337 1.00 11.22 H new ATOM 0 HA PHE A 911 -4.843 -35.412 11.066 1.00 3.43 H new ATOM 0 HB2 PHE A 911 -3.265 -37.514 10.916 1.00 71.33 H new ATOM 0 HB3 PHE A 911 -3.155 -36.504 12.344 1.00 71.33 H new ATOM 0 HD1 PHE A 911 -6.085 -38.612 12.015 1.00 14.12 H new ATOM 0 HD2 PHE A 911 -2.140 -38.425 13.520 1.00 75.53 H new ATOM 0 HE1 PHE A 911 -6.543 -40.601 13.459 1.00 42.11 H new ATOM 0 HE2 PHE A 911 -2.598 -40.416 14.963 1.00 40.45 H new ATOM 0 HZ PHE A 911 -4.794 -41.478 14.916 1.00 63.53 H new ATOM 1965 N HIS A 912 -6.403 -36.383 9.363 1.00 24.14 N ATOM 1966 CA HIS A 912 -7.053 -36.932 8.185 1.00 3.24 C ATOM 1967 C HIS A 912 -6.348 -36.423 6.926 1.00 1.24 C ATOM 1968 O HIS A 912 -6.994 -36.152 5.915 1.00 0.24 O ATOM 1969 CB HIS A 912 -8.550 -36.617 8.195 1.00 61.30 C ATOM 1970 CG HIS A 912 -9.358 -37.449 7.228 1.00 34.10 C ATOM 1971 ND1 HIS A 912 -9.531 -38.814 7.376 1.00 33.20 N ATOM 1972 CD2 HIS A 912 -10.039 -37.095 6.100 1.00 11.34 C ATOM 1973 CE1 HIS A 912 -10.283 -39.251 6.376 1.00 20.45 C ATOM 1974 NE2 HIS A 912 -10.596 -38.184 5.587 1.00 72.33 N ATOM 0 H HIS A 912 -6.546 -35.383 9.502 1.00 24.14 H new ATOM 0 HA HIS A 912 -6.969 -38.019 8.192 1.00 3.24 H new ATOM 0 HB2 HIS A 912 -8.937 -36.771 9.202 1.00 61.30 H new ATOM 0 HB3 HIS A 912 -8.691 -35.563 7.957 1.00 61.30 H new ATOM 0 HD2 HIS A 912 -10.112 -36.097 5.694 1.00 11.34 H new ATOM 0 HE1 HIS A 912 -10.593 -40.273 6.214 1.00 20.45 H new ATOM 0 HE2 HIS A 912 -11.165 -38.218 4.741 1.00 72.33 H new ATOM 1982 N PHE A 913 -5.032 -36.308 7.029 1.00 20.21 N ATOM 1983 CA PHE A 913 -4.232 -35.836 5.911 1.00 33.54 C ATOM 1984 C PHE A 913 -3.516 -36.999 5.221 1.00 43.32 C ATOM 1985 O PHE A 913 -4.051 -37.597 4.289 1.00 50.11 O ATOM 1986 CB PHE A 913 -3.187 -34.876 6.483 1.00 75.01 C ATOM 1987 CG PHE A 913 -3.724 -33.472 6.770 1.00 20.23 C ATOM 1988 CD1 PHE A 913 -4.516 -33.256 7.854 1.00 12.22 C ATOM 1989 CD2 PHE A 913 -3.409 -32.441 5.942 1.00 45.13 C ATOM 1990 CE1 PHE A 913 -5.014 -31.953 8.121 1.00 11.10 C ATOM 1991 CE2 PHE A 913 -3.906 -31.138 6.208 1.00 34.14 C ATOM 1992 CZ PHE A 913 -4.699 -30.922 7.292 1.00 4.54 C ATOM 0 H PHE A 913 -4.500 -36.533 7.869 1.00 20.21 H new ATOM 0 HA PHE A 913 -4.871 -35.349 5.174 1.00 33.54 H new ATOM 0 HB2 PHE A 913 -2.788 -35.297 7.406 1.00 75.01 H new ATOM 0 HB3 PHE A 913 -2.356 -34.800 5.782 1.00 75.01 H new ATOM 0 HD1 PHE A 913 -4.766 -34.075 8.512 1.00 12.22 H new ATOM 0 HD2 PHE A 913 -2.780 -32.613 5.081 1.00 45.13 H new ATOM 0 HE1 PHE A 913 -5.643 -31.781 8.982 1.00 11.10 H new ATOM 0 HE2 PHE A 913 -3.655 -30.319 5.550 1.00 34.14 H new ATOM 0 HZ PHE A 913 -5.079 -29.931 7.494 1.00 4.54 H new ATOM 2002 N GLU A 914 -2.316 -37.283 5.705 1.00 64.43 N ATOM 2003 CA GLU A 914 -1.520 -38.363 5.146 1.00 72.34 C ATOM 2004 C GLU A 914 -0.291 -38.624 6.018 1.00 3.33 C ATOM 2005 O GLU A 914 0.251 -37.701 6.626 1.00 75.14 O ATOM 2006 CB GLU A 914 -1.113 -38.055 3.703 1.00 13.34 C ATOM 2007 CG GLU A 914 0.066 -37.081 3.663 1.00 40.22 C ATOM 2008 CD GLU A 914 0.414 -36.701 2.222 1.00 11.11 C ATOM 2009 OE1 GLU A 914 0.787 -37.573 1.424 1.00 72.33 O ATOM 2010 OE2 GLU A 914 0.284 -35.448 1.942 1.00 23.30 O ATOM 0 H GLU A 914 -1.875 -36.784 6.478 1.00 64.43 H new ATOM 0 HA GLU A 914 -2.129 -39.267 5.132 1.00 72.34 H new ATOM 0 HB2 GLU A 914 -0.843 -38.979 3.192 1.00 13.34 H new ATOM 0 HB3 GLU A 914 -1.960 -37.629 3.165 1.00 13.34 H new ATOM 0 HG2 GLU A 914 -0.180 -36.183 4.230 1.00 40.22 H new ATOM 0 HG3 GLU A 914 0.933 -37.534 4.143 1.00 40.22 H new ATOM 2018 N LYS A 915 0.114 -39.885 6.053 1.00 3.31 N ATOM 2019 CA LYS A 915 1.270 -40.278 6.841 1.00 32.14 C ATOM 2020 C LYS A 915 2.540 -40.076 6.013 1.00 50.33 C ATOM 2021 O LYS A 915 2.671 -40.633 4.924 1.00 34.31 O ATOM 2022 CB LYS A 915 1.099 -41.705 7.367 1.00 43.20 C ATOM 2023 CG LYS A 915 0.846 -42.685 6.220 1.00 71.12 C ATOM 2024 CD LYS A 915 1.443 -44.059 6.530 1.00 4.15 C ATOM 2025 CE LYS A 915 0.476 -44.902 7.363 1.00 34.03 C ATOM 2026 NZ LYS A 915 0.819 -46.338 7.260 1.00 34.12 N ATOM 0 H LYS A 915 -0.338 -40.648 5.548 1.00 3.31 H new ATOM 0 HA LYS A 915 1.362 -39.646 7.724 1.00 32.14 H new ATOM 0 HB2 LYS A 915 1.992 -42.004 7.915 1.00 43.20 H new ATOM 0 HB3 LYS A 915 0.267 -41.740 8.070 1.00 43.20 H new ATOM 0 HG2 LYS A 915 -0.226 -42.781 6.049 1.00 71.12 H new ATOM 0 HG3 LYS A 915 1.282 -42.294 5.301 1.00 71.12 H new ATOM 0 HD2 LYS A 915 1.674 -44.577 5.599 1.00 4.15 H new ATOM 0 HD3 LYS A 915 2.383 -43.938 7.069 1.00 4.15 H new ATOM 0 HE2 LYS A 915 0.515 -44.587 8.406 1.00 34.03 H new ATOM 0 HE3 LYS A 915 -0.546 -44.741 7.019 1.00 34.03 H new ATOM 0 HZ1 LYS A 915 0.153 -46.896 7.831 1.00 34.12 H new ATOM 0 HZ2 LYS A 915 0.759 -46.639 6.266 1.00 34.12 H new ATOM 0 HZ3 LYS A 915 1.787 -46.490 7.610 1.00 34.12 H new ATOM 2039 N ILE A 916 3.444 -39.276 6.560 1.00 71.33 N ATOM 2040 CA ILE A 916 4.699 -38.993 5.885 1.00 61.35 C ATOM 2041 C ILE A 916 5.857 -39.197 6.864 1.00 50.43 C ATOM 2042 O ILE A 916 5.985 -38.460 7.841 1.00 62.15 O ATOM 2043 CB ILE A 916 4.665 -37.600 5.253 1.00 64.34 C ATOM 2044 CG1 ILE A 916 3.246 -37.229 4.820 1.00 14.53 C ATOM 2045 CG2 ILE A 916 5.662 -37.499 4.096 1.00 51.20 C ATOM 2046 CD1 ILE A 916 3.179 -35.775 4.349 1.00 41.44 C ATOM 0 H ILE A 916 3.332 -38.815 7.463 1.00 71.33 H new ATOM 0 HA ILE A 916 4.853 -39.688 5.060 1.00 61.35 H new ATOM 0 HB ILE A 916 4.971 -36.875 6.007 1.00 64.34 H new ATOM 0 HG12 ILE A 916 2.923 -37.891 4.016 1.00 14.53 H new ATOM 0 HG13 ILE A 916 2.558 -37.378 5.652 1.00 14.53 H new ATOM 0 HG21 ILE A 916 5.618 -36.499 3.664 1.00 51.20 H new ATOM 0 HG22 ILE A 916 6.669 -37.691 4.466 1.00 51.20 H new ATOM 0 HG23 ILE A 916 5.410 -38.235 3.333 1.00 51.20 H new ATOM 0 HD11 ILE A 916 2.159 -35.537 4.047 1.00 41.44 H new ATOM 0 HD12 ILE A 916 3.480 -35.115 5.162 1.00 41.44 H new ATOM 0 HD13 ILE A 916 3.850 -35.636 3.502 1.00 41.44 H new ATOM 2058 N PRO A 917 6.692 -40.226 6.560 1.00 4.13 N ATOM 2059 CA PRO A 917 7.835 -40.535 7.402 1.00 23.43 C ATOM 2060 C PRO A 917 8.959 -39.517 7.197 1.00 21.44 C ATOM 2061 O PRO A 917 9.590 -39.488 6.142 1.00 24.31 O ATOM 2062 CB PRO A 917 8.237 -41.949 7.016 1.00 21.51 C ATOM 2063 CG PRO A 917 7.605 -42.206 5.658 1.00 61.13 C ATOM 2064 CD PRO A 917 6.572 -41.119 5.412 1.00 75.13 C ATOM 0 HA PRO A 917 7.602 -40.477 8.465 1.00 23.43 H new ATOM 0 HB2 PRO A 917 9.321 -42.047 6.967 1.00 21.51 H new ATOM 0 HB3 PRO A 917 7.885 -42.670 7.753 1.00 21.51 H new ATOM 0 HG2 PRO A 917 8.364 -42.196 4.876 1.00 61.13 H new ATOM 0 HG3 PRO A 917 7.137 -43.190 5.635 1.00 61.13 H new ATOM 0 HD2 PRO A 917 6.767 -40.592 4.478 1.00 75.13 H new ATOM 0 HD3 PRO A 917 5.568 -41.537 5.339 1.00 75.13 H new ATOM 2072 N PHE A 918 9.175 -38.707 8.223 1.00 34.34 N ATOM 2073 CA PHE A 918 10.211 -37.691 8.169 1.00 3.42 C ATOM 2074 C PHE A 918 11.455 -38.213 7.447 1.00 31.43 C ATOM 2075 O PHE A 918 12.017 -39.236 7.834 1.00 25.52 O ATOM 2076 CB PHE A 918 10.580 -37.351 9.615 1.00 43.34 C ATOM 2077 CG PHE A 918 10.938 -35.880 9.836 1.00 44.31 C ATOM 2078 CD1 PHE A 918 12.104 -35.382 9.342 1.00 10.14 C ATOM 2079 CD2 PHE A 918 10.091 -35.070 10.526 1.00 4.10 C ATOM 2080 CE1 PHE A 918 12.436 -34.017 9.548 1.00 44.22 C ATOM 2081 CE2 PHE A 918 10.424 -33.705 10.731 1.00 12.25 C ATOM 2082 CZ PHE A 918 11.589 -33.207 10.238 1.00 23.00 C ATOM 0 H PHE A 918 8.650 -38.734 9.097 1.00 34.34 H new ATOM 0 HA PHE A 918 9.848 -36.819 7.626 1.00 3.42 H new ATOM 0 HB2 PHE A 918 9.744 -37.612 10.264 1.00 43.34 H new ATOM 0 HB3 PHE A 918 11.425 -37.970 9.919 1.00 43.34 H new ATOM 0 HD1 PHE A 918 12.777 -36.025 8.793 1.00 10.14 H new ATOM 0 HD2 PHE A 918 9.165 -35.465 10.918 1.00 4.10 H new ATOM 0 HE1 PHE A 918 13.362 -33.622 9.157 1.00 44.22 H new ATOM 0 HE2 PHE A 918 9.751 -33.062 11.279 1.00 12.25 H new ATOM 0 HZ PHE A 918 11.842 -32.169 10.394 1.00 23.00 H new ATOM 2092 N ASP A 919 11.848 -37.487 6.411 1.00 35.20 N ATOM 2093 CA ASP A 919 13.014 -37.865 5.632 1.00 42.15 C ATOM 2094 C ASP A 919 14.168 -36.913 5.955 1.00 71.44 C ATOM 2095 O ASP A 919 13.961 -35.711 6.107 1.00 1.45 O ATOM 2096 CB ASP A 919 12.729 -37.770 4.131 1.00 13.45 C ATOM 2097 CG ASP A 919 12.374 -39.095 3.455 1.00 23.42 C ATOM 2098 OD1 ASP A 919 12.579 -40.178 4.025 1.00 54.31 O ATOM 2099 OD2 ASP A 919 11.860 -38.986 2.277 1.00 64.20 O ATOM 0 H ASP A 919 11.379 -36.639 6.093 1.00 35.20 H new ATOM 0 HA ASP A 919 13.270 -38.894 5.886 1.00 42.15 H new ATOM 0 HB2 ASP A 919 11.909 -37.069 3.976 1.00 13.45 H new ATOM 0 HB3 ASP A 919 13.605 -37.350 3.636 1.00 13.45 H new ATOM 2105 N PRO A 920 15.389 -37.503 6.052 1.00 65.34 N ATOM 2106 CA PRO A 920 16.576 -36.721 6.354 1.00 63.53 C ATOM 2107 C PRO A 920 17.025 -35.913 5.135 1.00 41.31 C ATOM 2108 O PRO A 920 17.881 -35.036 5.248 1.00 72.32 O ATOM 2109 CB PRO A 920 17.612 -37.738 6.807 1.00 50.54 C ATOM 2110 CG PRO A 920 17.123 -39.085 6.301 1.00 32.01 C ATOM 2111 CD PRO A 920 15.672 -38.925 5.877 1.00 41.02 C ATOM 0 HA PRO A 920 16.403 -35.976 7.130 1.00 63.53 H new ATOM 0 HB2 PRO A 920 18.595 -37.502 6.400 1.00 50.54 H new ATOM 0 HB3 PRO A 920 17.708 -37.740 7.893 1.00 50.54 H new ATOM 0 HG2 PRO A 920 17.731 -39.421 5.461 1.00 32.01 H new ATOM 0 HG3 PRO A 920 17.212 -39.841 7.081 1.00 32.01 H new ATOM 0 HD2 PRO A 920 15.526 -39.233 4.842 1.00 41.02 H new ATOM 0 HD3 PRO A 920 15.011 -39.539 6.489 1.00 41.02 H new ATOM 2119 N ALA A 921 16.427 -36.236 3.997 1.00 4.15 N ATOM 2120 CA ALA A 921 16.755 -35.550 2.759 1.00 72.31 C ATOM 2121 C ALA A 921 16.075 -34.180 2.744 1.00 14.14 C ATOM 2122 O ALA A 921 16.543 -33.257 2.079 1.00 72.51 O ATOM 2123 CB ALA A 921 16.341 -36.419 1.569 1.00 20.25 C ATOM 0 H ALA A 921 15.718 -36.963 3.907 1.00 4.15 H new ATOM 0 HA ALA A 921 17.830 -35.385 2.685 1.00 72.31 H new ATOM 0 HB1 ALA A 921 16.587 -35.905 0.640 1.00 20.25 H new ATOM 0 HB2 ALA A 921 16.873 -37.369 1.610 1.00 20.25 H new ATOM 0 HB3 ALA A 921 15.267 -36.603 1.609 1.00 20.25 H new ATOM 2129 N GLU A 922 14.981 -34.090 3.486 1.00 14.13 N ATOM 2130 CA GLU A 922 14.231 -32.848 3.567 1.00 2.32 C ATOM 2131 C GLU A 922 14.888 -31.895 4.568 1.00 24.53 C ATOM 2132 O GLU A 922 15.170 -30.743 4.242 1.00 74.31 O ATOM 2133 CB GLU A 922 12.771 -33.112 3.939 1.00 12.51 C ATOM 2134 CG GLU A 922 12.207 -34.290 3.143 1.00 55.01 C ATOM 2135 CD GLU A 922 11.041 -33.845 2.257 1.00 33.34 C ATOM 2136 OE1 GLU A 922 11.234 -33.591 1.059 1.00 1.03 O ATOM 2137 OE2 GLU A 922 9.900 -33.769 2.855 1.00 2.24 O ATOM 0 H GLU A 922 14.596 -34.857 4.037 1.00 14.13 H new ATOM 0 HA GLU A 922 14.242 -32.376 2.585 1.00 2.32 H new ATOM 0 HB2 GLU A 922 12.696 -33.320 5.006 1.00 12.51 H new ATOM 0 HB3 GLU A 922 12.176 -32.220 3.746 1.00 12.51 H new ATOM 0 HG2 GLU A 922 12.992 -34.725 2.525 1.00 55.01 H new ATOM 0 HG3 GLU A 922 11.872 -35.069 3.828 1.00 55.01 H new ATOM 2145 N MET A 923 15.114 -32.412 5.767 1.00 23.12 N ATOM 2146 CA MET A 923 15.733 -31.622 6.818 1.00 22.21 C ATOM 2147 C MET A 923 16.880 -30.775 6.264 1.00 44.02 C ATOM 2148 O MET A 923 16.862 -29.550 6.374 1.00 73.01 O ATOM 2149 CB MET A 923 16.266 -32.552 7.909 1.00 24.44 C ATOM 2150 CG MET A 923 17.056 -31.769 8.960 1.00 64.02 C ATOM 2151 SD MET A 923 17.205 -32.732 10.455 1.00 23.13 S ATOM 2152 CE MET A 923 15.479 -32.978 10.839 1.00 64.23 C ATOM 0 H MET A 923 14.880 -33.368 6.034 1.00 23.12 H new ATOM 0 HA MET A 923 14.980 -30.953 7.235 1.00 22.21 H new ATOM 0 HB2 MET A 923 15.435 -33.072 8.386 1.00 24.44 H new ATOM 0 HB3 MET A 923 16.905 -33.314 7.462 1.00 24.44 H new ATOM 0 HG2 MET A 923 18.046 -31.525 8.575 1.00 64.02 H new ATOM 0 HG3 MET A 923 16.555 -30.825 9.174 1.00 64.02 H new ATOM 0 HE1 MET A 923 15.337 -32.938 11.919 1.00 64.23 H new ATOM 0 HE2 MET A 923 14.886 -32.195 10.366 1.00 64.23 H new ATOM 0 HE3 MET A 923 15.159 -33.951 10.467 1.00 64.23 H new ATOM 2162 N SER A 924 17.852 -31.461 5.680 1.00 72.21 N ATOM 2163 CA SER A 924 19.005 -30.787 5.108 1.00 21.12 C ATOM 2164 C SER A 924 18.647 -30.209 3.738 1.00 51.23 C ATOM 2165 O SER A 924 17.912 -30.829 2.971 1.00 63.42 O ATOM 2166 CB SER A 924 20.196 -31.740 4.987 1.00 10.15 C ATOM 2167 OG SER A 924 19.792 -33.055 4.616 1.00 31.14 O ATOM 0 H SER A 924 17.864 -32.477 5.591 1.00 72.21 H new ATOM 0 HA SER A 924 19.291 -29.974 5.775 1.00 21.12 H new ATOM 0 HB2 SER A 924 20.896 -31.353 4.246 1.00 10.15 H new ATOM 0 HB3 SER A 924 20.727 -31.779 5.938 1.00 10.15 H new ATOM 0 HG SER A 924 20.581 -33.633 4.548 1.00 31.14 H new ATOM 2173 N LYS A 925 19.183 -29.027 3.472 1.00 54.44 N ATOM 2174 CA LYS A 925 18.929 -28.358 2.207 1.00 52.51 C ATOM 2175 C LYS A 925 19.256 -29.311 1.056 1.00 43.32 C ATOM 2176 O LYS A 925 20.267 -30.011 1.094 1.00 74.43 O ATOM 2177 CB LYS A 925 19.687 -27.030 2.141 1.00 22.42 C ATOM 2178 CG LYS A 925 19.045 -26.081 1.127 1.00 21.52 C ATOM 2179 CD LYS A 925 20.048 -25.030 0.649 1.00 62.04 C ATOM 2180 CE LYS A 925 21.070 -25.644 -0.311 1.00 11.33 C ATOM 2181 NZ LYS A 925 22.229 -26.178 0.439 1.00 74.41 N ATOM 0 H LYS A 925 19.792 -28.515 4.111 1.00 54.44 H new ATOM 0 HA LYS A 925 17.874 -28.101 2.118 1.00 52.51 H new ATOM 0 HB2 LYS A 925 19.696 -26.563 3.126 1.00 22.42 H new ATOM 0 HB3 LYS A 925 20.726 -27.213 1.866 1.00 22.42 H new ATOM 0 HG2 LYS A 925 18.675 -26.650 0.274 1.00 21.52 H new ATOM 0 HG3 LYS A 925 18.184 -25.588 1.579 1.00 21.52 H new ATOM 0 HD2 LYS A 925 19.519 -24.217 0.152 1.00 62.04 H new ATOM 0 HD3 LYS A 925 20.563 -24.597 1.507 1.00 62.04 H new ATOM 0 HE2 LYS A 925 20.603 -26.443 -0.887 1.00 11.33 H new ATOM 0 HE3 LYS A 925 21.406 -24.891 -1.024 1.00 11.33 H new ATOM 0 HZ1 LYS A 925 23.110 -25.823 0.015 1.00 74.41 H new ATOM 0 HZ2 LYS A 925 22.173 -25.869 1.431 1.00 74.41 H new ATOM 0 HZ3 LYS A 925 22.220 -27.217 0.399 1.00 74.41 H new