USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 808 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 898 ASN : amide:sc= -6.7! C(o=-6.7!,f=-9.5!) USER MOD Set 1.2: A1009 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 970 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 983 LYS NZ :NH3+ -118:sc= -7.46! (180deg=-9.6!) USER MOD Set 3.1: A 974 HIS : no HE2:sc= -3.45 K(o=-7,f=-8.5!) USER MOD Set 3.2: A 975 LYS NZ :NH3+ 171:sc= -3.55! (180deg=-3.65!) USER MOD Set 4.1: A 972 MET CE :methyl 168:sc= -0.265 (180deg=-0.263) USER MOD Set 4.2: A 981 CYS SG : rot 158:sc= -0.346 USER MOD Set 5.1: A 939 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 971 MET CE :methyl 164:sc= -1.74 (180deg=-3.01) USER MOD Set 6.1: A 948 GLN : amide:sc= -4.33! C(o=-9.2!,f=-8.1!) USER MOD Set 6.2: A 955 GLN : amide:sc= -4.23! C(o=-9.2!,f=-12!) USER MOD Set 6.3: A 957 ASN : amide:sc= -0.639 K(o=-9.2,f=-8.1) USER MOD Set 7.1: A 915 CYS SG : rot 56:sc= -1.28 USER MOD Set 7.2: A 930 ASN : amide:sc= -5.47! C(o=-6.9!,f=-16!) USER MOD Set 7.3: A 932 THR OG1 : rot 159:sc= -0.155 USER MOD Set 8.1: A 907 CYS SG : rot 118:sc= 0.364 USER MOD Set 8.2: A 962 CYS SG : rot -169:sc= 1.42! USER MOD Single : A 899 ASN : amide:sc= -0.642 K(o=-0.64,f=-2!) USER MOD Single : A 901 SER OG : rot 180:sc= 0 USER MOD Single : A 904 THR OG1 : rot 180:sc= -0.412 USER MOD Single : A 908 LYS NZ :NH3+ 149:sc= -0.128 (180deg=-0.784) USER MOD Single : A 909 ASN : amide:sc= -2.61! C(o=-2.6!,f=-3!) USER MOD Single : A 911 SER OG : rot -55:sc= 0.989 USER MOD Single : A 916 SER OG : rot 180:sc= -0.588 USER MOD Single : A 921 HIS : no HD1:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 931 MET CE :methyl 172:sc= -0.465 (180deg=-0.467) USER MOD Single : A 936 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 944 ASN : amide:sc= -14.6! C(o=-15!,f=-12!) USER MOD Single : A 945 LYS NZ :NH3+ 143:sc= -2.36! (180deg=-4.82!) USER MOD Single : A 963 LYS NZ :NH3+ -167:sc= -1.14 (180deg=-1.61) USER MOD Single : A 966 GLN : amide:sc= -0.882 K(o=-0.88,f=-4.2!) USER MOD Single : A 986 ASN : amide:sc= -4.51! C(o=-4.5!,f=-3.1!) USER MOD Single : A 992 LYS NZ :NH3+ -134:sc= -0.0371 (180deg=-0.312) USER MOD Single : A 997 LYS NZ :NH3+ -117:sc= -1.43 (180deg=-3.56!) USER MOD Single : A 998 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 999 GLN : amide:sc= -1.36 K(o=-1.4,f=-0.79) USER MOD Single : A1000 TYR OH : rot 180:sc= 0 USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 LYS NZ :NH3+ -160:sc= -0.252 (180deg=-0.808) USER MOD ----------------------------------------------------------------- ATOM 101 N ASN A 898 16.334 -9.372 -5.165 1.00 51.44 N ATOM 102 CA ASN A 898 17.275 -10.421 -5.519 1.00 32.02 C ATOM 103 C ASN A 898 17.784 -11.095 -4.243 1.00 13.42 C ATOM 104 O ASN A 898 18.833 -11.736 -4.251 1.00 45.34 O ATOM 105 CB ASN A 898 18.482 -9.850 -6.266 1.00 12.14 C ATOM 106 CG ASN A 898 19.465 -10.958 -6.648 1.00 32.33 C ATOM 107 OD1 ASN A 898 20.503 -11.142 -6.034 1.00 1.41 O ATOM 108 ND2 ASN A 898 19.081 -11.685 -7.693 1.00 51.04 N ATOM 0 HA ASN A 898 16.759 -11.134 -6.161 1.00 32.02 H new ATOM 0 HB2 ASN A 898 18.146 -9.331 -7.164 1.00 12.14 H new ATOM 0 HB3 ASN A 898 18.985 -9.112 -5.641 1.00 12.14 H new ATOM 0 HD21 ASN A 898 19.668 -12.450 -8.025 1.00 51.04 H new ATOM 0 HD22 ASN A 898 18.199 -11.478 -8.162 1.00 51.04 H new ATOM 115 N ASN A 899 17.016 -10.926 -3.176 1.00 71.23 N ATOM 116 CA ASN A 899 17.376 -11.510 -1.895 1.00 51.12 C ATOM 117 C ASN A 899 16.459 -12.700 -1.607 1.00 24.44 C ATOM 118 O ASN A 899 15.237 -12.573 -1.653 1.00 51.10 O ATOM 119 CB ASN A 899 17.206 -10.497 -0.761 1.00 44.13 C ATOM 120 CG ASN A 899 18.250 -10.721 0.335 1.00 60.02 C ATOM 121 OD1 ASN A 899 19.374 -11.123 0.085 1.00 63.44 O ATOM 122 ND2 ASN A 899 17.817 -10.439 1.560 1.00 34.11 N ATOM 0 H ASN A 899 16.146 -10.393 -3.173 1.00 71.23 H new ATOM 0 HA ASN A 899 18.419 -11.821 -1.947 1.00 51.12 H new ATOM 0 HB2 ASN A 899 17.299 -9.485 -1.155 1.00 44.13 H new ATOM 0 HB3 ASN A 899 16.205 -10.584 -0.338 1.00 44.13 H new ATOM 0 HD21 ASN A 899 18.439 -10.556 2.360 1.00 34.11 H new ATOM 0 HD22 ASN A 899 16.863 -10.106 1.700 1.00 34.11 H new ATOM 129 N PRO A 900 17.102 -13.861 -1.307 1.00 71.11 N ATOM 130 CA PRO A 900 16.358 -15.073 -1.011 1.00 31.50 C ATOM 131 C PRO A 900 15.744 -15.012 0.389 1.00 12.21 C ATOM 132 O PRO A 900 15.080 -15.953 0.822 1.00 51.44 O ATOM 133 CB PRO A 900 17.365 -16.201 -1.169 1.00 34.31 C ATOM 134 CG PRO A 900 18.736 -15.550 -1.091 1.00 52.02 C ATOM 135 CD PRO A 900 18.548 -14.049 -1.243 1.00 23.32 C ATOM 0 HA PRO A 900 15.508 -15.218 -1.678 1.00 31.50 H new ATOM 0 HB2 PRO A 900 17.242 -16.947 -0.384 1.00 34.31 H new ATOM 0 HB3 PRO A 900 17.230 -16.714 -2.121 1.00 34.31 H new ATOM 0 HG2 PRO A 900 19.215 -15.780 -0.139 1.00 52.02 H new ATOM 0 HG3 PRO A 900 19.387 -15.935 -1.876 1.00 52.02 H new ATOM 0 HD2 PRO A 900 18.981 -13.509 -0.401 1.00 23.32 H new ATOM 0 HD3 PRO A 900 19.036 -13.678 -2.144 1.00 23.32 H new ATOM 143 N SER A 901 15.987 -13.895 1.059 1.00 42.35 N ATOM 144 CA SER A 901 15.466 -13.698 2.401 1.00 43.14 C ATOM 145 C SER A 901 14.034 -13.164 2.333 1.00 70.30 C ATOM 146 O SER A 901 13.251 -13.357 3.262 1.00 62.40 O ATOM 147 CB SER A 901 16.352 -12.740 3.200 1.00 21.53 C ATOM 148 OG SER A 901 16.188 -12.909 4.606 1.00 71.33 O ATOM 0 H SER A 901 16.538 -13.117 0.697 1.00 42.35 H new ATOM 0 HA SER A 901 15.464 -14.661 2.912 1.00 43.14 H new ATOM 0 HB2 SER A 901 17.396 -12.905 2.934 1.00 21.53 H new ATOM 0 HB3 SER A 901 16.112 -11.712 2.928 1.00 21.53 H new ATOM 0 HG SER A 901 16.771 -12.281 5.081 1.00 71.33 H new ATOM 154 N LEU A 902 13.734 -12.504 1.224 1.00 4.43 N ATOM 155 CA LEU A 902 12.410 -11.941 1.023 1.00 0.21 C ATOM 156 C LEU A 902 11.509 -12.989 0.368 1.00 61.42 C ATOM 157 O LEU A 902 10.286 -12.918 0.477 1.00 0.12 O ATOM 158 CB LEU A 902 12.498 -10.630 0.239 1.00 4.35 C ATOM 159 CG LEU A 902 13.713 -9.749 0.540 1.00 31.13 C ATOM 160 CD1 LEU A 902 14.123 -8.941 -0.693 1.00 24.55 C ATOM 161 CD2 LEU A 902 13.453 -8.852 1.753 1.00 63.45 C ATOM 0 H LEU A 902 14.386 -12.347 0.455 1.00 4.43 H new ATOM 0 HA LEU A 902 11.957 -11.683 1.980 1.00 0.21 H new ATOM 0 HB2 LEU A 902 12.499 -10.865 -0.825 1.00 4.35 H new ATOM 0 HB3 LEU A 902 11.596 -10.051 0.436 1.00 4.35 H new ATOM 0 HG LEU A 902 14.551 -10.398 0.793 1.00 31.13 H new ATOM 0 HD11 LEU A 902 14.988 -8.324 -0.452 1.00 24.55 H new ATOM 0 HD12 LEU A 902 14.377 -9.621 -1.506 1.00 24.55 H new ATOM 0 HD13 LEU A 902 13.296 -8.302 -1.001 1.00 24.55 H new ATOM 0 HD21 LEU A 902 14.332 -8.236 1.945 1.00 63.45 H new ATOM 0 HD22 LEU A 902 12.596 -8.209 1.553 1.00 63.45 H new ATOM 0 HD23 LEU A 902 13.246 -9.471 2.626 1.00 63.45 H new ATOM 173 N ILE A 903 12.149 -13.939 -0.299 1.00 74.00 N ATOM 174 CA ILE A 903 11.420 -15.001 -0.972 1.00 63.11 C ATOM 175 C ILE A 903 11.491 -16.276 -0.129 1.00 12.33 C ATOM 176 O ILE A 903 12.460 -16.491 0.598 1.00 14.30 O ATOM 177 CB ILE A 903 11.934 -15.181 -2.402 1.00 4.51 C ATOM 178 CG1 ILE A 903 13.211 -16.023 -2.424 1.00 21.52 C ATOM 179 CG2 ILE A 903 12.129 -13.827 -3.088 1.00 63.14 C ATOM 180 CD1 ILE A 903 14.128 -15.599 -3.573 1.00 24.54 C ATOM 0 H ILE A 903 13.164 -13.995 -0.388 1.00 74.00 H new ATOM 0 HA ILE A 903 10.366 -14.739 -1.067 1.00 63.11 H new ATOM 0 HB ILE A 903 11.180 -15.725 -2.970 1.00 4.51 H new ATOM 0 HG12 ILE A 903 13.737 -15.916 -1.476 1.00 21.52 H new ATOM 0 HG13 ILE A 903 12.954 -17.077 -2.529 1.00 21.52 H new ATOM 0 HG21 ILE A 903 12.495 -13.983 -4.103 1.00 63.14 H new ATOM 0 HG22 ILE A 903 11.178 -13.296 -3.123 1.00 63.14 H new ATOM 0 HG23 ILE A 903 12.854 -13.236 -2.528 1.00 63.14 H new ATOM 0 HD11 ILE A 903 15.028 -16.213 -3.566 1.00 24.54 H new ATOM 0 HD12 ILE A 903 13.607 -15.730 -4.521 1.00 24.54 H new ATOM 0 HD13 ILE A 903 14.403 -14.551 -3.452 1.00 24.54 H new ATOM 192 N THR A 904 10.452 -17.088 -0.254 1.00 15.14 N ATOM 193 CA THR A 904 10.383 -18.336 0.488 1.00 4.41 C ATOM 194 C THR A 904 9.755 -19.434 -0.372 1.00 51.41 C ATOM 195 O THR A 904 9.106 -19.145 -1.377 1.00 24.42 O ATOM 196 CB THR A 904 9.622 -18.072 1.788 1.00 14.54 C ATOM 197 OG1 THR A 904 9.860 -16.692 2.056 1.00 35.42 O ATOM 198 CG2 THR A 904 10.239 -18.796 2.986 1.00 3.33 C ATOM 0 H THR A 904 9.651 -16.906 -0.858 1.00 15.14 H new ATOM 0 HA THR A 904 11.378 -18.698 0.745 1.00 4.41 H new ATOM 0 HB THR A 904 8.584 -18.385 1.670 1.00 14.54 H new ATOM 0 HG1 THR A 904 9.401 -16.435 2.883 1.00 35.42 H new ATOM 0 HG21 THR A 904 9.660 -18.574 3.883 1.00 3.33 H new ATOM 0 HG22 THR A 904 10.231 -19.871 2.805 1.00 3.33 H new ATOM 0 HG23 THR A 904 11.266 -18.459 3.125 1.00 3.33 H new ATOM 206 N PHE A 905 9.969 -20.670 0.054 1.00 41.23 N ATOM 207 CA PHE A 905 9.432 -21.813 -0.665 1.00 53.40 C ATOM 208 C PHE A 905 8.146 -22.318 -0.008 1.00 73.30 C ATOM 209 O PHE A 905 8.041 -22.348 1.217 1.00 34.31 O ATOM 210 CB PHE A 905 10.489 -22.917 -0.605 1.00 3.53 C ATOM 211 CG PHE A 905 11.843 -22.514 -1.192 1.00 44.41 C ATOM 212 CD1 PHE A 905 11.983 -21.314 -1.818 1.00 24.30 C ATOM 213 CD2 PHE A 905 12.907 -23.355 -1.089 1.00 10.15 C ATOM 214 CE1 PHE A 905 13.240 -20.940 -2.363 1.00 61.42 C ATOM 215 CE2 PHE A 905 14.164 -22.981 -1.634 1.00 33.02 C ATOM 216 CZ PHE A 905 14.304 -21.782 -2.260 1.00 13.44 C ATOM 0 H PHE A 905 10.507 -20.905 0.888 1.00 41.23 H new ATOM 0 HA PHE A 905 9.198 -21.530 -1.691 1.00 53.40 H new ATOM 0 HB2 PHE A 905 10.629 -23.216 0.434 1.00 3.53 H new ATOM 0 HB3 PHE A 905 10.118 -23.791 -1.141 1.00 3.53 H new ATOM 0 HD1 PHE A 905 11.138 -20.646 -1.900 1.00 24.30 H new ATOM 0 HD2 PHE A 905 12.796 -24.308 -0.593 1.00 10.15 H new ATOM 0 HE1 PHE A 905 13.351 -19.987 -2.859 1.00 61.42 H new ATOM 0 HE2 PHE A 905 15.009 -23.649 -1.551 1.00 33.02 H new ATOM 0 HZ PHE A 905 15.260 -21.498 -2.675 1.00 13.44 H new ATOM 226 N LEU A 906 7.200 -22.703 -0.852 1.00 74.00 N ATOM 227 CA LEU A 906 5.925 -23.206 -0.369 1.00 11.13 C ATOM 228 C LEU A 906 5.552 -24.470 -1.147 1.00 1.44 C ATOM 229 O LEU A 906 6.193 -24.846 -2.127 1.00 72.04 O ATOM 230 CB LEU A 906 4.859 -22.110 -0.429 1.00 1.13 C ATOM 231 CG LEU A 906 5.364 -20.674 -0.273 1.00 41.14 C ATOM 232 CD1 LEU A 906 4.365 -19.675 -0.860 1.00 13.14 C ATOM 233 CD2 LEU A 906 5.694 -20.364 1.188 1.00 1.11 C ATOM 0 H LEU A 906 7.291 -22.677 -1.868 1.00 74.00 H new ATOM 0 HA LEU A 906 6.000 -23.488 0.681 1.00 11.13 H new ATOM 0 HB2 LEU A 906 4.338 -22.189 -1.383 1.00 1.13 H new ATOM 0 HB3 LEU A 906 4.124 -22.303 0.352 1.00 1.13 H new ATOM 0 HG LEU A 906 6.290 -20.574 -0.840 1.00 41.14 H new ATOM 0 HD11 LEU A 906 4.748 -18.662 -0.736 1.00 13.14 H new ATOM 0 HD12 LEU A 906 4.224 -19.882 -1.921 1.00 13.14 H new ATOM 0 HD13 LEU A 906 3.411 -19.768 -0.342 1.00 13.14 H new ATOM 0 HD21 LEU A 906 6.051 -19.337 1.271 1.00 1.11 H new ATOM 0 HD22 LEU A 906 4.799 -20.487 1.797 1.00 1.11 H new ATOM 0 HD23 LEU A 906 6.468 -21.046 1.539 1.00 1.11 H new ATOM 245 N CYS A 907 4.491 -25.122 -0.683 1.00 32.23 N ATOM 246 CA CYS A 907 4.009 -26.345 -1.313 1.00 53.14 C ATOM 247 C CYS A 907 2.987 -26.030 -2.402 1.00 13.01 C ATOM 248 O CYS A 907 1.948 -25.443 -2.101 1.00 23.30 O ATOM 249 CB CYS A 907 3.387 -27.272 -0.268 1.00 35.12 C ATOM 250 SG CYS A 907 2.784 -28.854 -0.942 1.00 22.11 S ATOM 0 H CYS A 907 3.949 -24.823 0.128 1.00 32.23 H new ATOM 0 HA CYS A 907 4.861 -26.847 -1.772 1.00 53.14 H new ATOM 0 HB2 CYS A 907 4.126 -27.477 0.506 1.00 35.12 H new ATOM 0 HB3 CYS A 907 2.557 -26.754 0.213 1.00 35.12 H new ATOM 0 HG CYS A 907 3.433 -29.836 -0.391 1.00 22.11 H new ATOM 255 N LYS A 908 3.299 -26.421 -3.629 1.00 2.03 N ATOM 256 CA LYS A 908 2.402 -26.174 -4.744 1.00 52.34 C ATOM 257 C LYS A 908 0.998 -26.662 -4.382 1.00 12.11 C ATOM 258 O LYS A 908 0.039 -25.893 -4.427 1.00 74.30 O ATOM 259 CB LYS A 908 2.957 -26.796 -6.027 1.00 23.21 C ATOM 260 CG LYS A 908 1.868 -26.914 -7.095 1.00 45.04 C ATOM 261 CD LYS A 908 2.468 -26.829 -8.501 1.00 31.44 C ATOM 262 CE LYS A 908 2.690 -28.225 -9.087 1.00 30.13 C ATOM 263 NZ LYS A 908 1.397 -28.923 -9.267 1.00 64.14 N ATOM 0 H LYS A 908 4.161 -26.907 -3.875 1.00 2.03 H new ATOM 0 HA LYS A 908 2.327 -25.105 -4.942 1.00 52.34 H new ATOM 0 HB2 LYS A 908 3.778 -26.187 -6.405 1.00 23.21 H new ATOM 0 HB3 LYS A 908 3.366 -27.782 -5.810 1.00 23.21 H new ATOM 0 HG2 LYS A 908 1.339 -27.860 -6.978 1.00 45.04 H new ATOM 0 HG3 LYS A 908 1.134 -26.120 -6.960 1.00 45.04 H new ATOM 0 HD2 LYS A 908 1.803 -26.260 -9.150 1.00 31.44 H new ATOM 0 HD3 LYS A 908 3.415 -26.291 -8.464 1.00 31.44 H new ATOM 0 HE2 LYS A 908 3.204 -28.146 -10.045 1.00 30.13 H new ATOM 0 HE3 LYS A 908 3.334 -28.805 -8.426 1.00 30.13 H new ATOM 0 HZ1 LYS A 908 1.461 -29.567 -10.081 1.00 64.14 H new ATOM 0 HZ2 LYS A 908 1.175 -29.469 -8.410 1.00 64.14 H new ATOM 0 HZ3 LYS A 908 0.646 -28.224 -9.437 1.00 64.14 H new ATOM 276 N ASN A 909 0.922 -27.937 -4.030 1.00 72.14 N ATOM 277 CA ASN A 909 -0.349 -28.537 -3.660 1.00 41.14 C ATOM 278 C ASN A 909 -1.053 -27.640 -2.640 1.00 72.41 C ATOM 279 O ASN A 909 -2.169 -27.181 -2.878 1.00 33.32 O ATOM 280 CB ASN A 909 -0.143 -29.911 -3.020 1.00 34.11 C ATOM 281 CG ASN A 909 -0.202 -31.021 -4.072 1.00 14.42 C ATOM 282 OD1 ASN A 909 0.042 -30.810 -5.248 1.00 44.13 O ATOM 283 ND2 ASN A 909 -0.540 -32.211 -3.584 1.00 50.01 N ATOM 0 H ASN A 909 1.720 -28.571 -3.993 1.00 72.14 H new ATOM 0 HA ASN A 909 -0.947 -28.647 -4.565 1.00 41.14 H new ATOM 0 HB2 ASN A 909 0.821 -29.938 -2.511 1.00 34.11 H new ATOM 0 HB3 ASN A 909 -0.908 -30.082 -2.263 1.00 34.11 H new ATOM 0 HD21 ASN A 909 -0.608 -33.017 -4.206 1.00 50.01 H new ATOM 0 HD22 ASN A 909 -0.731 -32.318 -2.588 1.00 50.01 H new ATOM 290 N CYS A 910 -0.372 -27.418 -1.526 1.00 11.03 N ATOM 291 CA CYS A 910 -0.919 -26.585 -0.468 1.00 45.53 C ATOM 292 C CYS A 910 -0.295 -25.192 -0.584 1.00 33.04 C ATOM 293 O CYS A 910 -0.689 -24.401 -1.439 1.00 14.32 O ATOM 294 CB CYS A 910 -0.688 -27.200 0.913 1.00 32.23 C ATOM 295 SG CYS A 910 -1.469 -28.836 1.164 1.00 23.32 S ATOM 0 H CYS A 910 0.554 -27.800 -1.333 1.00 11.03 H new ATOM 0 HA CYS A 910 -2.000 -26.510 -0.583 1.00 45.53 H new ATOM 0 HB2 CYS A 910 0.385 -27.296 1.078 1.00 32.23 H new ATOM 0 HB3 CYS A 910 -1.066 -26.512 1.669 1.00 32.23 H new ATOM 300 N SER A 911 0.667 -24.935 0.290 1.00 63.33 N ATOM 301 CA SER A 911 1.349 -23.652 0.297 1.00 51.05 C ATOM 302 C SER A 911 1.976 -23.400 1.669 1.00 65.10 C ATOM 303 O SER A 911 1.922 -22.285 2.185 1.00 32.14 O ATOM 304 CB SER A 911 0.389 -22.517 -0.065 1.00 10.34 C ATOM 305 OG SER A 911 0.880 -21.247 0.358 1.00 65.45 O ATOM 0 H SER A 911 0.990 -25.594 0.998 1.00 63.33 H new ATOM 0 HA SER A 911 2.137 -23.679 -0.455 1.00 51.05 H new ATOM 0 HB2 SER A 911 0.233 -22.504 -1.144 1.00 10.34 H new ATOM 0 HB3 SER A 911 -0.581 -22.702 0.395 1.00 10.34 H new ATOM 0 HG SER A 911 1.075 -21.275 1.318 1.00 65.45 H new ATOM 311 N VAL A 912 2.558 -24.455 2.221 1.00 43.14 N ATOM 312 CA VAL A 912 3.196 -24.362 3.523 1.00 33.21 C ATOM 313 C VAL A 912 4.683 -24.055 3.338 1.00 60.24 C ATOM 314 O VAL A 912 5.347 -24.665 2.501 1.00 72.41 O ATOM 315 CB VAL A 912 2.945 -25.643 4.321 1.00 74.40 C ATOM 316 CG1 VAL A 912 1.545 -26.196 4.044 1.00 63.41 C ATOM 317 CG2 VAL A 912 4.018 -26.693 4.025 1.00 53.14 C ATOM 0 H VAL A 912 2.601 -25.378 1.790 1.00 43.14 H new ATOM 0 HA VAL A 912 2.765 -23.544 4.101 1.00 33.21 H new ATOM 0 HB VAL A 912 3.003 -25.394 5.381 1.00 74.40 H new ATOM 0 HG11 VAL A 912 1.392 -27.106 4.623 1.00 63.41 H new ATOM 0 HG12 VAL A 912 0.798 -25.455 4.329 1.00 63.41 H new ATOM 0 HG13 VAL A 912 1.446 -26.421 2.982 1.00 63.41 H new ATOM 0 HG21 VAL A 912 3.816 -27.593 4.605 1.00 53.14 H new ATOM 0 HG22 VAL A 912 4.006 -26.936 2.962 1.00 53.14 H new ATOM 0 HG23 VAL A 912 4.997 -26.299 4.296 1.00 53.14 H new ATOM 327 N LEU A 913 5.163 -23.110 4.132 1.00 51.40 N ATOM 328 CA LEU A 913 6.560 -22.714 4.066 1.00 74.32 C ATOM 329 C LEU A 913 7.438 -23.885 4.511 1.00 22.10 C ATOM 330 O LEU A 913 7.484 -24.216 5.695 1.00 61.33 O ATOM 331 CB LEU A 913 6.792 -21.432 4.867 1.00 51.30 C ATOM 332 CG LEU A 913 8.241 -20.948 4.954 1.00 30.40 C ATOM 333 CD1 LEU A 913 8.928 -21.498 6.206 1.00 52.41 C ATOM 334 CD2 LEU A 913 9.012 -21.295 3.679 1.00 50.43 C ATOM 0 H LEU A 913 4.609 -22.606 4.825 1.00 51.40 H new ATOM 0 HA LEU A 913 6.841 -22.476 3.040 1.00 74.32 H new ATOM 0 HB2 LEU A 913 6.190 -20.637 4.425 1.00 51.30 H new ATOM 0 HB3 LEU A 913 6.420 -21.588 5.880 1.00 51.30 H new ATOM 0 HG LEU A 913 8.234 -19.861 5.041 1.00 30.40 H new ATOM 0 HD11 LEU A 913 9.957 -21.139 6.244 1.00 52.41 H new ATOM 0 HD12 LEU A 913 8.393 -21.160 7.093 1.00 52.41 H new ATOM 0 HD13 LEU A 913 8.925 -22.588 6.174 1.00 52.41 H new ATOM 0 HD21 LEU A 913 10.039 -20.940 3.767 1.00 50.43 H new ATOM 0 HD22 LEU A 913 9.013 -22.376 3.537 1.00 50.43 H new ATOM 0 HD23 LEU A 913 8.535 -20.817 2.824 1.00 50.43 H new ATOM 346 N ALA A 914 8.114 -24.480 3.539 1.00 52.53 N ATOM 347 CA ALA A 914 8.988 -25.606 3.816 1.00 64.45 C ATOM 348 C ALA A 914 10.378 -25.088 4.191 1.00 40.42 C ATOM 349 O ALA A 914 11.054 -25.669 5.038 1.00 33.32 O ATOM 350 CB ALA A 914 9.022 -26.537 2.602 1.00 73.22 C ATOM 0 H ALA A 914 8.074 -24.203 2.558 1.00 52.53 H new ATOM 0 HA ALA A 914 8.612 -26.184 4.660 1.00 64.45 H new ATOM 0 HB1 ALA A 914 9.678 -27.382 2.810 1.00 73.22 H new ATOM 0 HB2 ALA A 914 8.016 -26.901 2.394 1.00 73.22 H new ATOM 0 HB3 ALA A 914 9.396 -25.992 1.736 1.00 73.22 H new ATOM 356 N CYS A 915 10.763 -23.999 3.541 1.00 5.05 N ATOM 357 CA CYS A 915 12.060 -23.395 3.796 1.00 24.34 C ATOM 358 C CYS A 915 12.172 -22.124 2.953 1.00 4.31 C ATOM 359 O CYS A 915 11.402 -21.927 2.015 1.00 51.03 O ATOM 360 CB CYS A 915 13.204 -24.371 3.512 1.00 21.14 C ATOM 361 SG CYS A 915 13.828 -25.078 5.081 1.00 51.30 S ATOM 0 H CYS A 915 10.200 -23.520 2.839 1.00 5.05 H new ATOM 0 HA CYS A 915 12.143 -23.138 4.852 1.00 24.34 H new ATOM 0 HB2 CYS A 915 12.857 -25.170 2.856 1.00 21.14 H new ATOM 0 HB3 CYS A 915 14.010 -23.857 2.989 1.00 21.14 H new ATOM 0 HG CYS A 915 12.848 -25.639 5.724 1.00 51.30 H new ATOM 367 N SER A 916 13.138 -21.293 3.318 1.00 63.33 N ATOM 368 CA SER A 916 13.361 -20.046 2.606 1.00 1.04 C ATOM 369 C SER A 916 14.645 -20.137 1.780 1.00 64.22 C ATOM 370 O SER A 916 15.521 -20.950 2.074 1.00 75.14 O ATOM 371 CB SER A 916 13.437 -18.865 3.576 1.00 54.11 C ATOM 372 OG SER A 916 12.641 -19.077 4.739 1.00 21.41 O ATOM 0 H SER A 916 13.775 -21.459 4.097 1.00 63.33 H new ATOM 0 HA SER A 916 12.517 -19.879 1.936 1.00 1.04 H new ATOM 0 HB2 SER A 916 14.474 -18.704 3.871 1.00 54.11 H new ATOM 0 HB3 SER A 916 13.105 -17.958 3.070 1.00 54.11 H new ATOM 0 HG SER A 916 12.718 -18.302 5.334 1.00 21.41 H new ATOM 378 N GLY A 917 14.718 -19.292 0.762 1.00 14.34 N ATOM 379 CA GLY A 917 15.880 -19.267 -0.109 1.00 3.42 C ATOM 380 C GLY A 917 17.167 -19.081 0.699 1.00 54.43 C ATOM 381 O GLY A 917 18.140 -19.805 0.497 1.00 4.52 O ATOM 0 H GLY A 917 13.990 -18.619 0.521 1.00 14.34 H new ATOM 0 HA2 GLY A 917 15.934 -20.196 -0.676 1.00 3.42 H new ATOM 0 HA3 GLY A 917 15.780 -18.457 -0.832 1.00 3.42 H new ATOM 385 N GLU A 918 17.129 -18.106 1.596 1.00 74.41 N ATOM 386 CA GLU A 918 18.279 -17.816 2.435 1.00 60.14 C ATOM 387 C GLU A 918 18.637 -19.036 3.286 1.00 73.12 C ATOM 388 O GLU A 918 19.772 -19.170 3.739 1.00 65.02 O ATOM 389 CB GLU A 918 18.021 -16.591 3.314 1.00 44.23 C ATOM 390 CG GLU A 918 16.980 -16.898 4.392 1.00 71.35 C ATOM 391 CD GLU A 918 17.621 -17.607 5.587 1.00 53.41 C ATOM 392 OE1 GLU A 918 16.953 -18.398 6.269 1.00 22.31 O ATOM 393 OE2 GLU A 918 18.859 -17.310 5.797 1.00 74.43 O ATOM 0 H GLU A 918 16.320 -17.507 1.760 1.00 74.41 H new ATOM 0 HA GLU A 918 19.127 -17.587 1.789 1.00 60.14 H new ATOM 0 HB2 GLU A 918 18.952 -16.273 3.783 1.00 44.23 H new ATOM 0 HB3 GLU A 918 17.676 -15.762 2.696 1.00 44.23 H new ATOM 0 HG2 GLU A 918 16.510 -15.972 4.723 1.00 71.35 H new ATOM 0 HG3 GLU A 918 16.191 -17.523 3.974 1.00 71.35 H new ATOM 401 N ASP A 919 17.646 -19.895 3.478 1.00 43.04 N ATOM 402 CA ASP A 919 17.842 -21.099 4.266 1.00 23.44 C ATOM 403 C ASP A 919 18.114 -22.278 3.330 1.00 25.40 C ATOM 404 O ASP A 919 17.762 -23.416 3.639 1.00 5.45 O ATOM 405 CB ASP A 919 16.595 -21.428 5.090 1.00 42.34 C ATOM 406 CG ASP A 919 16.868 -22.098 6.437 1.00 21.44 C ATOM 407 OD1 ASP A 919 18.027 -22.263 6.846 1.00 43.22 O ATOM 408 OD2 ASP A 919 15.816 -22.465 7.087 1.00 15.41 O ATOM 0 H ASP A 919 16.705 -19.780 3.101 1.00 43.04 H new ATOM 0 HA ASP A 919 18.683 -20.928 4.938 1.00 23.44 H new ATOM 0 HB2 ASP A 919 16.041 -20.506 5.266 1.00 42.34 H new ATOM 0 HB3 ASP A 919 15.950 -22.080 4.501 1.00 42.34 H new ATOM 414 N ILE A 920 18.739 -21.966 2.204 1.00 72.42 N ATOM 415 CA ILE A 920 19.062 -22.986 1.220 1.00 2.13 C ATOM 416 C ILE A 920 20.512 -22.808 0.765 1.00 1.43 C ATOM 417 O ILE A 920 21.064 -21.712 0.854 1.00 51.14 O ATOM 418 CB ILE A 920 18.050 -22.964 0.073 1.00 44.42 C ATOM 419 CG1 ILE A 920 16.637 -23.250 0.583 1.00 73.42 C ATOM 420 CG2 ILE A 920 18.464 -23.927 -1.042 1.00 2.42 C ATOM 421 CD1 ILE A 920 16.336 -24.750 0.551 1.00 70.24 C ATOM 0 H ILE A 920 19.030 -21.022 1.951 1.00 72.42 H new ATOM 0 HA ILE A 920 18.986 -23.980 1.662 1.00 2.13 H new ATOM 0 HB ILE A 920 18.040 -21.962 -0.355 1.00 44.42 H new ATOM 0 HG12 ILE A 920 16.531 -22.876 1.601 1.00 73.42 H new ATOM 0 HG13 ILE A 920 15.910 -22.716 -0.030 1.00 73.42 H new ATOM 0 HG21 ILE A 920 17.728 -23.892 -1.845 1.00 2.42 H new ATOM 0 HG22 ILE A 920 19.439 -23.635 -1.431 1.00 2.42 H new ATOM 0 HG23 ILE A 920 18.520 -24.941 -0.645 1.00 2.42 H new ATOM 0 HD11 ILE A 920 15.325 -24.926 0.919 1.00 70.24 H new ATOM 0 HD12 ILE A 920 16.419 -25.116 -0.472 1.00 70.24 H new ATOM 0 HD13 ILE A 920 17.049 -25.278 1.184 1.00 70.24 H new ATOM 433 N HIS A 921 21.088 -23.902 0.288 1.00 12.55 N ATOM 434 CA HIS A 921 22.463 -23.880 -0.181 1.00 11.25 C ATOM 435 C HIS A 921 22.503 -24.234 -1.668 1.00 43.25 C ATOM 436 O HIS A 921 21.533 -24.760 -2.212 1.00 23.13 O ATOM 437 CB HIS A 921 23.342 -24.798 0.671 1.00 10.44 C ATOM 438 CG HIS A 921 23.545 -24.313 2.087 1.00 2.50 C ATOM 439 ND1 HIS A 921 22.911 -24.887 3.175 1.00 62.33 N ATOM 440 CD2 HIS A 921 24.318 -23.303 2.581 1.00 62.11 C ATOM 441 CE1 HIS A 921 23.292 -24.244 4.269 1.00 70.24 C ATOM 442 NE2 HIS A 921 24.164 -23.262 3.899 1.00 74.45 N ATOM 0 H HIS A 921 20.627 -24.809 0.216 1.00 12.55 H new ATOM 0 HA HIS A 921 22.873 -22.876 -0.071 1.00 11.25 H new ATOM 0 HB2 HIS A 921 22.893 -25.791 0.699 1.00 10.44 H new ATOM 0 HB3 HIS A 921 24.315 -24.901 0.190 1.00 10.44 H new ATOM 0 HD2 HIS A 921 24.949 -22.648 1.998 1.00 62.11 H new ATOM 0 HE1 HIS A 921 22.969 -24.459 5.277 1.00 70.24 H new ATOM 0 HE2 HIS A 921 24.622 -22.605 4.531 1.00 74.45 H new ATOM 450 N VAL A 922 23.636 -23.931 -2.285 1.00 50.24 N ATOM 451 CA VAL A 922 23.816 -24.210 -3.700 1.00 32.41 C ATOM 452 C VAL A 922 24.999 -25.163 -3.881 1.00 22.14 C ATOM 453 O VAL A 922 25.946 -25.139 -3.095 1.00 74.13 O ATOM 454 CB VAL A 922 23.978 -22.902 -4.476 1.00 2.55 C ATOM 455 CG1 VAL A 922 24.704 -23.137 -5.802 1.00 12.43 C ATOM 456 CG2 VAL A 922 22.624 -22.228 -4.703 1.00 54.34 C ATOM 0 H VAL A 922 24.439 -23.495 -1.831 1.00 50.24 H new ATOM 0 HA VAL A 922 22.934 -24.705 -4.106 1.00 32.41 H new ATOM 0 HB VAL A 922 24.590 -22.229 -3.875 1.00 2.55 H new ATOM 0 HG11 VAL A 922 24.806 -22.191 -6.334 1.00 12.43 H new ATOM 0 HG12 VAL A 922 25.693 -23.552 -5.607 1.00 12.43 H new ATOM 0 HG13 VAL A 922 24.131 -23.836 -6.412 1.00 12.43 H new ATOM 0 HG21 VAL A 922 22.768 -21.300 -5.257 1.00 54.34 H new ATOM 0 HG22 VAL A 922 21.977 -22.894 -5.273 1.00 54.34 H new ATOM 0 HG23 VAL A 922 22.161 -22.008 -3.741 1.00 54.34 H new ATOM 573 N VAL A 929 20.463 -28.043 -3.055 1.00 52.11 N ATOM 574 CA VAL A 929 20.290 -28.942 -1.926 1.00 45.44 C ATOM 575 C VAL A 929 19.884 -28.132 -0.693 1.00 72.42 C ATOM 576 O VAL A 929 20.415 -27.049 -0.454 1.00 50.03 O ATOM 577 CB VAL A 929 21.565 -29.761 -1.710 1.00 54.34 C ATOM 578 CG1 VAL A 929 21.701 -30.853 -2.773 1.00 34.33 C ATOM 579 CG2 VAL A 929 22.800 -28.858 -1.691 1.00 32.14 C ATOM 0 HA VAL A 929 19.490 -29.656 -2.124 1.00 45.44 H new ATOM 0 HB VAL A 929 21.490 -30.247 -0.737 1.00 54.34 H new ATOM 0 HG11 VAL A 929 22.615 -31.420 -2.597 1.00 34.33 H new ATOM 0 HG12 VAL A 929 20.842 -31.522 -2.719 1.00 34.33 H new ATOM 0 HG13 VAL A 929 21.743 -30.395 -3.761 1.00 34.33 H new ATOM 0 HG21 VAL A 929 23.692 -29.465 -1.536 1.00 32.14 H new ATOM 0 HG22 VAL A 929 22.880 -28.331 -2.642 1.00 32.14 H new ATOM 0 HG23 VAL A 929 22.709 -28.134 -0.882 1.00 32.14 H new ATOM 589 N ASN A 930 18.945 -28.690 0.058 1.00 40.44 N ATOM 590 CA ASN A 930 18.461 -28.033 1.260 1.00 30.32 C ATOM 591 C ASN A 930 19.040 -28.738 2.489 1.00 41.33 C ATOM 592 O ASN A 930 18.499 -29.744 2.944 1.00 23.21 O ATOM 593 CB ASN A 930 16.935 -28.104 1.350 1.00 23.11 C ATOM 594 CG ASN A 930 16.415 -27.263 2.518 1.00 63.13 C ATOM 595 OD1 ASN A 930 16.821 -26.133 2.731 1.00 1.54 O ATOM 596 ND2 ASN A 930 15.497 -27.876 3.259 1.00 72.01 N ATOM 0 H ASN A 930 18.507 -29.589 -0.143 1.00 40.44 H new ATOM 0 HA ASN A 930 18.772 -26.989 1.223 1.00 30.32 H new ATOM 0 HB2 ASN A 930 16.495 -27.749 0.418 1.00 23.11 H new ATOM 0 HB3 ASN A 930 16.622 -29.141 1.476 1.00 23.11 H new ATOM 0 HD21 ASN A 930 15.088 -27.398 4.062 1.00 72.01 H new ATOM 0 HD22 ASN A 930 15.202 -28.824 3.024 1.00 72.01 H new ATOM 603 N MET A 931 20.133 -28.181 2.990 1.00 13.23 N ATOM 604 CA MET A 931 20.791 -28.743 4.157 1.00 21.02 C ATOM 605 C MET A 931 20.118 -28.271 5.447 1.00 34.04 C ATOM 606 O MET A 931 20.792 -27.850 6.386 1.00 62.11 O ATOM 607 CB MET A 931 22.262 -28.323 4.166 1.00 41.54 C ATOM 608 CG MET A 931 22.870 -28.427 2.765 1.00 23.25 C ATOM 609 SD MET A 931 24.636 -28.664 2.883 1.00 54.22 S ATOM 610 CE MET A 931 24.833 -30.067 1.797 1.00 20.25 C ATOM 0 H MET A 931 20.579 -27.347 2.609 1.00 13.23 H new ATOM 0 HA MET A 931 20.714 -29.829 4.106 1.00 21.02 H new ATOM 0 HB2 MET A 931 22.349 -27.299 4.529 1.00 41.54 H new ATOM 0 HB3 MET A 931 22.820 -28.955 4.857 1.00 41.54 H new ATOM 0 HG2 MET A 931 22.418 -29.259 2.224 1.00 23.25 H new ATOM 0 HG3 MET A 931 22.653 -27.522 2.197 1.00 23.25 H new ATOM 0 HE1 MET A 931 25.894 -30.261 1.642 1.00 20.25 H new ATOM 0 HE2 MET A 931 24.366 -30.943 2.246 1.00 20.25 H new ATOM 0 HE3 MET A 931 24.359 -29.855 0.839 1.00 20.25 H new ATOM 620 N THR A 932 18.796 -28.357 5.453 1.00 55.13 N ATOM 621 CA THR A 932 18.023 -27.944 6.612 1.00 4.22 C ATOM 622 C THR A 932 17.483 -29.167 7.356 1.00 12.41 C ATOM 623 O THR A 932 16.810 -30.010 6.765 1.00 2.02 O ATOM 624 CB THR A 932 16.927 -26.989 6.135 1.00 61.44 C ATOM 625 OG1 THR A 932 17.502 -26.337 5.006 1.00 61.54 O ATOM 626 CG2 THR A 932 16.666 -25.855 7.127 1.00 54.40 C ATOM 0 H THR A 932 18.240 -28.707 4.673 1.00 55.13 H new ATOM 0 HA THR A 932 18.645 -27.413 7.333 1.00 4.22 H new ATOM 0 HB THR A 932 16.005 -27.547 5.972 1.00 61.44 H new ATOM 0 HG1 THR A 932 16.790 -25.966 4.445 1.00 61.54 H new ATOM 0 HG21 THR A 932 15.880 -25.207 6.740 1.00 54.40 H new ATOM 0 HG22 THR A 932 16.353 -26.273 8.084 1.00 54.40 H new ATOM 0 HG23 THR A 932 17.579 -25.275 7.265 1.00 54.40 H new ATOM 634 N PRO A 933 17.805 -29.225 8.676 1.00 65.41 N ATOM 635 CA PRO A 933 17.360 -30.331 9.507 1.00 52.21 C ATOM 636 C PRO A 933 15.872 -30.201 9.841 1.00 43.12 C ATOM 637 O PRO A 933 15.136 -31.186 9.806 1.00 2.20 O ATOM 638 CB PRO A 933 18.251 -30.283 10.737 1.00 1.41 C ATOM 639 CG PRO A 933 18.846 -28.884 10.766 1.00 31.13 C ATOM 640 CD PRO A 933 18.600 -28.245 9.410 1.00 42.45 C ATOM 0 HA PRO A 933 17.447 -31.295 9.006 1.00 52.21 H new ATOM 0 HB2 PRO A 933 17.678 -30.483 11.642 1.00 1.41 H new ATOM 0 HB3 PRO A 933 19.034 -31.039 10.682 1.00 1.41 H new ATOM 0 HG2 PRO A 933 18.387 -28.290 11.557 1.00 31.13 H new ATOM 0 HG3 PRO A 933 19.914 -28.928 10.979 1.00 31.13 H new ATOM 0 HD2 PRO A 933 18.069 -27.299 9.509 1.00 42.45 H new ATOM 0 HD3 PRO A 933 19.538 -28.032 8.897 1.00 42.45 H new ATOM 648 N GLU A 934 15.474 -28.977 10.156 1.00 21.35 N ATOM 649 CA GLU A 934 14.088 -28.706 10.496 1.00 13.32 C ATOM 650 C GLU A 934 13.165 -29.155 9.361 1.00 23.23 C ATOM 651 O GLU A 934 12.005 -29.489 9.595 1.00 31.52 O ATOM 652 CB GLU A 934 13.882 -27.224 10.816 1.00 53.32 C ATOM 653 CG GLU A 934 14.324 -26.344 9.645 1.00 50.40 C ATOM 654 CD GLU A 934 14.800 -24.975 10.137 1.00 61.30 C ATOM 655 OE1 GLU A 934 13.980 -24.065 10.328 1.00 72.23 O ATOM 656 OE2 GLU A 934 16.073 -24.875 10.323 1.00 72.33 O ATOM 0 H GLU A 934 16.087 -28.162 10.183 1.00 21.35 H new ATOM 0 HA GLU A 934 13.836 -29.276 11.390 1.00 13.32 H new ATOM 0 HB2 GLU A 934 12.831 -27.039 11.038 1.00 53.32 H new ATOM 0 HB3 GLU A 934 14.448 -26.959 11.709 1.00 53.32 H new ATOM 0 HG2 GLU A 934 15.127 -26.837 9.098 1.00 50.40 H new ATOM 0 HG3 GLU A 934 13.495 -26.216 8.948 1.00 50.40 H new ATOM 664 N PHE A 935 13.716 -29.149 8.156 1.00 11.32 N ATOM 665 CA PHE A 935 12.957 -29.552 6.984 1.00 10.44 C ATOM 666 C PHE A 935 12.575 -31.031 7.060 1.00 23.35 C ATOM 667 O PHE A 935 11.597 -31.456 6.448 1.00 52.11 O ATOM 668 CB PHE A 935 13.860 -29.332 5.769 1.00 3.13 C ATOM 669 CG PHE A 935 13.210 -29.705 4.435 1.00 25.13 C ATOM 670 CD1 PHE A 935 12.010 -29.168 4.090 1.00 52.30 C ATOM 671 CD2 PHE A 935 13.833 -30.574 3.595 1.00 25.20 C ATOM 672 CE1 PHE A 935 11.407 -29.514 2.852 1.00 33.10 C ATOM 673 CE2 PHE A 935 13.230 -30.921 2.357 1.00 3.40 C ATOM 674 CZ PHE A 935 12.030 -30.383 2.012 1.00 74.23 C ATOM 0 H PHE A 935 14.679 -28.871 7.966 1.00 11.32 H new ATOM 0 HA PHE A 935 12.038 -28.970 6.918 1.00 10.44 H new ATOM 0 HB2 PHE A 935 14.158 -28.284 5.736 1.00 3.13 H new ATOM 0 HB3 PHE A 935 14.770 -29.919 5.895 1.00 3.13 H new ATOM 0 HD1 PHE A 935 11.515 -28.478 4.758 1.00 52.30 H new ATOM 0 HD2 PHE A 935 14.787 -31.000 3.869 1.00 25.20 H new ATOM 0 HE1 PHE A 935 10.454 -29.087 2.578 1.00 33.10 H new ATOM 0 HE2 PHE A 935 13.724 -31.612 1.690 1.00 3.40 H new ATOM 0 HZ PHE A 935 11.571 -30.646 1.070 1.00 74.23 H new ATOM 684 N LYS A 936 13.368 -31.776 7.818 1.00 52.25 N ATOM 685 CA LYS A 936 13.125 -33.199 7.982 1.00 62.04 C ATOM 686 C LYS A 936 11.782 -33.405 8.684 1.00 31.33 C ATOM 687 O LYS A 936 11.235 -34.507 8.674 1.00 55.21 O ATOM 688 CB LYS A 936 14.302 -33.864 8.698 1.00 64.12 C ATOM 689 CG LYS A 936 14.073 -33.903 10.210 1.00 31.20 C ATOM 690 CD LYS A 936 15.249 -34.570 10.926 1.00 4.40 C ATOM 691 CE LYS A 936 16.554 -33.818 10.654 1.00 71.02 C ATOM 692 NZ LYS A 936 17.661 -34.397 11.447 1.00 30.30 N ATOM 0 H LYS A 936 14.179 -31.420 8.325 1.00 52.25 H new ATOM 0 HA LYS A 936 13.055 -33.688 7.010 1.00 62.04 H new ATOM 0 HB2 LYS A 936 14.436 -34.878 8.321 1.00 64.12 H new ATOM 0 HB3 LYS A 936 15.220 -33.319 8.480 1.00 64.12 H new ATOM 0 HG2 LYS A 936 13.941 -32.889 10.588 1.00 31.20 H new ATOM 0 HG3 LYS A 936 13.154 -34.447 10.428 1.00 31.20 H new ATOM 0 HD2 LYS A 936 15.058 -34.598 11.999 1.00 4.40 H new ATOM 0 HD3 LYS A 936 15.344 -35.603 10.592 1.00 4.40 H new ATOM 0 HE2 LYS A 936 16.795 -33.868 9.592 1.00 71.02 H new ATOM 0 HE3 LYS A 936 16.432 -32.764 10.904 1.00 71.02 H new ATOM 0 HZ1 LYS A 936 18.539 -33.875 11.250 1.00 30.30 H new ATOM 0 HZ2 LYS A 936 17.436 -34.327 12.460 1.00 30.30 H new ATOM 0 HZ3 LYS A 936 17.787 -35.396 11.189 1.00 30.30 H new ATOM 705 N GLU A 937 11.289 -32.328 9.278 1.00 23.20 N ATOM 706 CA GLU A 937 10.020 -32.377 9.984 1.00 24.23 C ATOM 707 C GLU A 937 8.928 -31.692 9.161 1.00 73.53 C ATOM 708 O GLU A 937 7.785 -31.589 9.604 1.00 51.34 O ATOM 709 CB GLU A 937 10.140 -31.743 11.371 1.00 1.14 C ATOM 710 CG GLU A 937 11.357 -32.289 12.121 1.00 43.33 C ATOM 711 CD GLU A 937 10.941 -33.343 13.149 1.00 40.51 C ATOM 712 OE1 GLU A 937 10.027 -34.138 12.886 1.00 62.32 O ATOM 713 OE2 GLU A 937 11.605 -33.317 14.255 1.00 72.32 O ATOM 0 H GLU A 937 11.746 -31.416 9.285 1.00 23.20 H new ATOM 0 HA GLU A 937 9.743 -33.422 10.121 1.00 24.23 H new ATOM 0 HB2 GLU A 937 10.224 -30.661 11.274 1.00 1.14 H new ATOM 0 HB3 GLU A 937 9.235 -31.942 11.945 1.00 1.14 H new ATOM 0 HG2 GLU A 937 12.060 -32.726 11.411 1.00 43.33 H new ATOM 0 HG3 GLU A 937 11.876 -31.472 12.622 1.00 43.33 H new ATOM 721 N LEU A 938 9.318 -31.243 7.977 1.00 75.01 N ATOM 722 CA LEU A 938 8.385 -30.571 7.088 1.00 64.15 C ATOM 723 C LEU A 938 8.117 -31.460 5.871 1.00 2.23 C ATOM 724 O LEU A 938 7.111 -31.291 5.185 1.00 53.04 O ATOM 725 CB LEU A 938 8.899 -29.175 6.728 1.00 21.51 C ATOM 726 CG LEU A 938 9.483 -28.358 7.882 1.00 24.11 C ATOM 727 CD1 LEU A 938 10.100 -27.054 7.373 1.00 53.30 C ATOM 728 CD2 LEU A 938 8.432 -28.111 8.966 1.00 43.30 C ATOM 0 H LEU A 938 10.267 -31.331 7.613 1.00 75.01 H new ATOM 0 HA LEU A 938 7.428 -30.415 7.587 1.00 64.15 H new ATOM 0 HB2 LEU A 938 9.664 -29.278 5.958 1.00 21.51 H new ATOM 0 HB3 LEU A 938 8.078 -28.609 6.287 1.00 21.51 H new ATOM 0 HG LEU A 938 10.286 -28.937 8.339 1.00 24.11 H new ATOM 0 HD11 LEU A 938 10.508 -26.492 8.213 1.00 53.30 H new ATOM 0 HD12 LEU A 938 10.898 -27.281 6.666 1.00 53.30 H new ATOM 0 HD13 LEU A 938 9.334 -26.459 6.876 1.00 53.30 H new ATOM 0 HD21 LEU A 938 8.873 -27.528 9.775 1.00 43.30 H new ATOM 0 HD22 LEU A 938 7.592 -27.563 8.540 1.00 43.30 H new ATOM 0 HD23 LEU A 938 8.081 -29.066 9.357 1.00 43.30 H new ATOM 740 N TYR A 939 9.035 -32.387 5.642 1.00 43.01 N ATOM 741 CA TYR A 939 8.911 -33.302 4.520 1.00 35.54 C ATOM 742 C TYR A 939 8.938 -34.757 4.994 1.00 30.03 C ATOM 743 O TYR A 939 9.563 -35.072 6.005 1.00 23.54 O ATOM 744 CB TYR A 939 10.127 -33.046 3.629 1.00 4.12 C ATOM 745 CG TYR A 939 11.335 -33.926 3.956 1.00 20.34 C ATOM 746 CD1 TYR A 939 11.277 -35.287 3.735 1.00 61.32 C ATOM 747 CD2 TYR A 939 12.482 -33.360 4.473 1.00 5.43 C ATOM 748 CE1 TYR A 939 12.414 -36.116 4.043 1.00 52.11 C ATOM 749 CE2 TYR A 939 13.619 -34.188 4.781 1.00 22.23 C ATOM 750 CZ TYR A 939 13.529 -35.526 4.551 1.00 53.51 C ATOM 751 OH TYR A 939 14.602 -36.308 4.842 1.00 62.22 O ATOM 0 H TYR A 939 9.868 -32.524 6.214 1.00 43.01 H new ATOM 0 HA TYR A 939 7.969 -33.141 3.996 1.00 35.54 H new ATOM 0 HB2 TYR A 939 9.843 -33.208 2.589 1.00 4.12 H new ATOM 0 HB3 TYR A 939 10.418 -31.999 3.720 1.00 4.12 H new ATOM 0 HD1 TYR A 939 10.379 -35.731 3.331 1.00 61.32 H new ATOM 0 HD2 TYR A 939 12.527 -32.295 4.647 1.00 5.43 H new ATOM 0 HE1 TYR A 939 12.382 -37.182 3.874 1.00 52.11 H new ATOM 0 HE2 TYR A 939 14.523 -33.757 5.185 1.00 22.23 H new ATOM 0 HH TYR A 939 15.326 -35.751 5.196 1.00 62.22 H new ATOM 761 N ILE A 940 8.252 -35.604 4.241 1.00 23.31 N ATOM 762 CA ILE A 940 8.190 -37.018 4.571 1.00 2.05 C ATOM 763 C ILE A 940 8.628 -37.841 3.358 1.00 54.42 C ATOM 764 O ILE A 940 8.235 -37.546 2.230 1.00 64.02 O ATOM 765 CB ILE A 940 6.800 -37.385 5.095 1.00 62.32 C ATOM 766 CG1 ILE A 940 6.151 -36.197 5.807 1.00 32.01 C ATOM 767 CG2 ILE A 940 6.861 -38.626 5.988 1.00 10.24 C ATOM 768 CD1 ILE A 940 4.761 -36.564 6.330 1.00 34.31 C ATOM 0 H ILE A 940 7.734 -35.338 3.403 1.00 23.31 H new ATOM 0 HA ILE A 940 8.882 -37.251 5.380 1.00 2.05 H new ATOM 0 HB ILE A 940 6.168 -37.633 4.242 1.00 62.32 H new ATOM 0 HG12 ILE A 940 6.782 -35.876 6.636 1.00 32.01 H new ATOM 0 HG13 ILE A 940 6.074 -35.354 5.120 1.00 32.01 H new ATOM 0 HG21 ILE A 940 5.860 -38.865 6.347 1.00 10.24 H new ATOM 0 HG22 ILE A 940 7.252 -39.467 5.416 1.00 10.24 H new ATOM 0 HG23 ILE A 940 7.515 -38.431 6.838 1.00 10.24 H new ATOM 0 HD11 ILE A 940 4.322 -35.702 6.832 1.00 34.31 H new ATOM 0 HD12 ILE A 940 4.125 -36.861 5.496 1.00 34.31 H new ATOM 0 HD13 ILE A 940 4.844 -37.391 7.035 1.00 34.31 H new ATOM 780 N VAL A 941 9.434 -38.856 3.631 1.00 42.43 N ATOM 781 CA VAL A 941 9.929 -39.723 2.575 1.00 2.21 C ATOM 782 C VAL A 941 9.043 -40.967 2.485 1.00 12.34 C ATOM 783 O VAL A 941 8.705 -41.567 3.504 1.00 31.32 O ATOM 784 CB VAL A 941 11.403 -40.055 2.819 1.00 73.13 C ATOM 785 CG1 VAL A 941 11.761 -41.422 2.231 1.00 11.43 C ATOM 786 CG2 VAL A 941 12.312 -38.961 2.256 1.00 52.23 C ATOM 0 H VAL A 941 9.757 -39.098 4.568 1.00 42.43 H new ATOM 0 HA VAL A 941 9.878 -39.218 1.611 1.00 2.21 H new ATOM 0 HB VAL A 941 11.562 -40.101 3.896 1.00 73.13 H new ATOM 0 HG11 VAL A 941 12.814 -41.634 2.418 1.00 11.43 H new ATOM 0 HG12 VAL A 941 11.147 -42.192 2.699 1.00 11.43 H new ATOM 0 HG13 VAL A 941 11.577 -41.415 1.157 1.00 11.43 H new ATOM 0 HG21 VAL A 941 13.354 -39.222 2.443 1.00 52.23 H new ATOM 0 HG22 VAL A 941 12.148 -38.868 1.182 1.00 52.23 H new ATOM 0 HG23 VAL A 941 12.083 -38.012 2.741 1.00 52.23 H new ATOM 796 N ARG A 942 8.691 -41.316 1.257 1.00 64.43 N ATOM 797 CA ARG A 942 7.851 -42.478 1.021 1.00 52.24 C ATOM 798 C ARG A 942 8.657 -43.588 0.344 1.00 42.14 C ATOM 799 O ARG A 942 9.222 -43.383 -0.730 1.00 31.42 O ATOM 800 CB ARG A 942 6.651 -42.120 0.141 1.00 10.24 C ATOM 801 CG ARG A 942 5.439 -41.743 0.995 1.00 35.13 C ATOM 802 CD ARG A 942 5.821 -40.724 2.071 1.00 33.41 C ATOM 803 NE ARG A 942 4.654 -40.440 2.936 1.00 30.00 N ATOM 804 CZ ARG A 942 4.122 -41.326 3.804 1.00 34.22 C ATOM 805 NH1 ARG A 942 4.648 -42.563 3.930 1.00 1.23 N ATOM 806 NH2 ARG A 942 3.078 -40.965 4.528 1.00 63.31 N ATOM 0 H ARG A 942 8.972 -40.815 0.414 1.00 64.43 H new ATOM 0 HA ARG A 942 7.488 -42.826 1.988 1.00 52.24 H new ATOM 0 HB2 ARG A 942 6.911 -41.289 -0.515 1.00 10.24 H new ATOM 0 HB3 ARG A 942 6.400 -42.965 -0.500 1.00 10.24 H new ATOM 0 HG2 ARG A 942 4.656 -41.329 0.359 1.00 35.13 H new ATOM 0 HG3 ARG A 942 5.029 -42.637 1.465 1.00 35.13 H new ATOM 0 HD2 ARG A 942 6.645 -41.109 2.672 1.00 33.41 H new ATOM 0 HD3 ARG A 942 6.171 -39.803 1.604 1.00 33.41 H new ATOM 0 HE ARG A 942 4.225 -39.517 2.872 1.00 30.00 H new ATOM 0 HH11 ARG A 942 5.454 -42.834 3.367 1.00 1.23 H new ATOM 0 HH12 ARG A 942 4.240 -43.226 4.589 1.00 1.23 H new ATOM 0 HH21 ARG A 942 2.686 -40.029 4.426 1.00 63.31 H new ATOM 0 HH22 ARG A 942 2.664 -41.622 5.189 1.00 63.31 H new ATOM 819 N GLU A 943 8.685 -44.739 0.999 1.00 23.00 N ATOM 820 CA GLU A 943 9.413 -45.882 0.474 1.00 42.32 C ATOM 821 C GLU A 943 9.037 -46.123 -0.990 1.00 24.55 C ATOM 822 O GLU A 943 7.956 -46.632 -1.280 1.00 53.24 O ATOM 823 CB GLU A 943 9.157 -47.131 1.319 1.00 11.22 C ATOM 824 CG GLU A 943 10.043 -48.292 0.864 1.00 33.31 C ATOM 825 CD GLU A 943 9.477 -49.632 1.340 1.00 25.10 C ATOM 826 OE1 GLU A 943 9.541 -49.941 2.539 1.00 24.02 O ATOM 827 OE2 GLU A 943 8.956 -50.364 0.414 1.00 2.42 O ATOM 0 H GLU A 943 8.215 -44.905 1.889 1.00 23.00 H new ATOM 0 HA GLU A 943 10.480 -45.663 0.524 1.00 42.32 H new ATOM 0 HB2 GLU A 943 9.351 -46.910 2.369 1.00 11.22 H new ATOM 0 HB3 GLU A 943 8.108 -47.418 1.242 1.00 11.22 H new ATOM 0 HG2 GLU A 943 10.120 -48.291 -0.223 1.00 33.31 H new ATOM 0 HG3 GLU A 943 11.052 -48.160 1.255 1.00 33.31 H new ATOM 835 N ASN A 944 9.952 -45.748 -1.872 1.00 14.12 N ATOM 836 CA ASN A 944 9.730 -45.918 -3.298 1.00 14.52 C ATOM 837 C ASN A 944 11.079 -46.048 -4.008 1.00 12.15 C ATOM 838 O ASN A 944 11.977 -45.235 -3.795 1.00 23.44 O ATOM 839 CB ASN A 944 8.999 -44.710 -3.889 1.00 22.20 C ATOM 840 CG ASN A 944 9.074 -44.718 -5.417 1.00 65.11 C ATOM 841 OD1 ASN A 944 8.238 -45.283 -6.103 1.00 22.02 O ATOM 842 ND2 ASN A 944 10.120 -44.061 -5.911 1.00 25.55 N ATOM 0 H ASN A 944 10.848 -45.327 -1.627 1.00 14.12 H new ATOM 0 HA ASN A 944 9.123 -46.812 -3.441 1.00 14.52 H new ATOM 0 HB2 ASN A 944 7.956 -44.721 -3.572 1.00 22.20 H new ATOM 0 HB3 ASN A 944 9.439 -43.790 -3.504 1.00 22.20 H new ATOM 0 HD21 ASN A 944 10.259 -44.008 -6.920 1.00 25.55 H new ATOM 0 HD22 ASN A 944 10.783 -43.610 -5.281 1.00 25.55 H new ATOM 849 N LYS A 945 11.178 -47.077 -4.837 1.00 1.54 N ATOM 850 CA LYS A 945 12.403 -47.324 -5.579 1.00 55.21 C ATOM 851 C LYS A 945 12.273 -46.726 -6.981 1.00 41.33 C ATOM 852 O LYS A 945 13.244 -46.688 -7.736 1.00 73.20 O ATOM 853 CB LYS A 945 12.739 -48.816 -5.576 1.00 30.43 C ATOM 854 CG LYS A 945 11.757 -49.602 -6.448 1.00 3.31 C ATOM 855 CD LYS A 945 11.610 -51.041 -5.949 1.00 4.52 C ATOM 856 CE LYS A 945 12.843 -51.873 -6.306 1.00 62.21 C ATOM 857 NZ LYS A 945 14.047 -51.330 -5.637 1.00 72.44 N ATOM 0 H LYS A 945 10.431 -47.749 -5.011 1.00 1.54 H new ATOM 0 HA LYS A 945 13.247 -46.830 -5.098 1.00 55.21 H new ATOM 0 HB2 LYS A 945 13.755 -48.964 -5.942 1.00 30.43 H new ATOM 0 HB3 LYS A 945 12.709 -49.197 -4.555 1.00 30.43 H new ATOM 0 HG2 LYS A 945 10.784 -49.110 -6.441 1.00 3.31 H new ATOM 0 HG3 LYS A 945 12.105 -49.605 -7.481 1.00 3.31 H new ATOM 0 HD2 LYS A 945 11.466 -51.042 -4.869 1.00 4.52 H new ATOM 0 HD3 LYS A 945 10.721 -51.494 -6.389 1.00 4.52 H new ATOM 0 HE2 LYS A 945 12.689 -52.909 -6.005 1.00 62.21 H new ATOM 0 HE3 LYS A 945 12.989 -51.873 -7.386 1.00 62.21 H new ATOM 0 HZ1 LYS A 945 14.664 -52.114 -5.343 1.00 72.44 H new ATOM 0 HZ2 LYS A 945 14.562 -50.713 -6.297 1.00 72.44 H new ATOM 0 HZ3 LYS A 945 13.762 -50.781 -4.801 1.00 72.44 H new ATOM 870 N ALA A 946 11.066 -46.273 -7.288 1.00 3.23 N ATOM 871 CA ALA A 946 10.797 -45.678 -8.586 1.00 64.30 C ATOM 872 C ALA A 946 11.641 -44.412 -8.747 1.00 15.44 C ATOM 873 O ALA A 946 11.767 -43.882 -9.849 1.00 44.33 O ATOM 874 CB ALA A 946 9.299 -45.402 -8.721 1.00 34.04 C ATOM 0 H ALA A 946 10.263 -46.306 -6.660 1.00 3.23 H new ATOM 0 HA ALA A 946 11.075 -46.363 -9.387 1.00 64.30 H new ATOM 0 HB1 ALA A 946 9.098 -44.956 -9.695 1.00 34.04 H new ATOM 0 HB2 ALA A 946 8.747 -46.337 -8.629 1.00 34.04 H new ATOM 0 HB3 ALA A 946 8.983 -44.716 -7.935 1.00 34.04 H new ATOM 880 N LEU A 947 12.195 -43.963 -7.630 1.00 40.11 N ATOM 881 CA LEU A 947 13.022 -42.768 -7.633 1.00 65.50 C ATOM 882 C LEU A 947 14.496 -43.174 -7.552 1.00 14.41 C ATOM 883 O LEU A 947 15.207 -43.144 -8.555 1.00 23.33 O ATOM 884 CB LEU A 947 12.586 -41.811 -6.522 1.00 73.40 C ATOM 885 CG LEU A 947 11.529 -40.774 -6.907 1.00 72.32 C ATOM 886 CD1 LEU A 947 11.883 -40.097 -8.233 1.00 33.23 C ATOM 887 CD2 LEU A 947 10.133 -41.399 -6.938 1.00 33.43 C ATOM 0 H LEU A 947 12.087 -44.405 -6.717 1.00 40.11 H new ATOM 0 HA LEU A 947 12.892 -42.217 -8.565 1.00 65.50 H new ATOM 0 HB2 LEU A 947 12.201 -42.402 -5.691 1.00 73.40 H new ATOM 0 HB3 LEU A 947 13.467 -41.284 -6.157 1.00 73.40 H new ATOM 0 HG LEU A 947 11.517 -39.998 -6.142 1.00 72.32 H new ATOM 0 HD11 LEU A 947 11.116 -39.365 -8.484 1.00 33.23 H new ATOM 0 HD12 LEU A 947 12.846 -39.596 -8.140 1.00 33.23 H new ATOM 0 HD13 LEU A 947 11.939 -40.848 -9.021 1.00 33.23 H new ATOM 0 HD21 LEU A 947 9.401 -40.640 -7.214 1.00 33.43 H new ATOM 0 HD22 LEU A 947 10.112 -42.207 -7.669 1.00 33.43 H new ATOM 0 HD23 LEU A 947 9.890 -41.796 -5.952 1.00 33.43 H new ATOM 899 N GLN A 948 14.909 -43.542 -6.348 1.00 64.35 N ATOM 900 CA GLN A 948 16.285 -43.953 -6.123 1.00 50.23 C ATOM 901 C GLN A 948 16.649 -45.117 -7.047 1.00 5.11 C ATOM 902 O GLN A 948 15.769 -45.794 -7.575 1.00 32.10 O ATOM 903 CB GLN A 948 16.513 -44.324 -4.657 1.00 23.32 C ATOM 904 CG GLN A 948 16.292 -45.821 -4.429 1.00 54.13 C ATOM 905 CD GLN A 948 17.487 -46.635 -4.930 1.00 12.52 C ATOM 906 OE1 GLN A 948 17.352 -47.587 -5.680 1.00 52.03 O ATOM 907 NE2 GLN A 948 18.661 -46.207 -4.474 1.00 30.40 N ATOM 0 H GLN A 948 14.316 -43.564 -5.519 1.00 64.35 H new ATOM 0 HA GLN A 948 16.938 -43.112 -6.356 1.00 50.23 H new ATOM 0 HB2 GLN A 948 17.527 -44.054 -4.363 1.00 23.32 H new ATOM 0 HB3 GLN A 948 15.835 -43.752 -4.024 1.00 23.32 H new ATOM 0 HG2 GLN A 948 16.137 -46.012 -3.367 1.00 54.13 H new ATOM 0 HG3 GLN A 948 15.387 -46.141 -4.945 1.00 54.13 H new ATOM 0 HE21 GLN A 948 18.703 -45.403 -3.848 1.00 30.40 H new ATOM 0 HE22 GLN A 948 19.520 -46.683 -4.750 1.00 30.40 H new ATOM 1013 N GLN A 955 23.449 -41.600 -4.465 1.00 55.30 N ATOM 1014 CA GLN A 955 22.467 -42.509 -3.898 1.00 64.53 C ATOM 1015 C GLN A 955 21.254 -41.730 -3.388 1.00 75.31 C ATOM 1016 O GLN A 955 21.401 -40.663 -2.794 1.00 61.33 O ATOM 1017 CB GLN A 955 23.084 -43.355 -2.783 1.00 23.53 C ATOM 1018 CG GLN A 955 22.313 -44.663 -2.596 1.00 34.32 C ATOM 1019 CD GLN A 955 21.039 -44.437 -1.779 1.00 1.43 C ATOM 1020 OE1 GLN A 955 20.866 -43.425 -1.118 1.00 61.24 O ATOM 1021 NE2 GLN A 955 20.160 -45.431 -1.860 1.00 30.34 N ATOM 0 HA GLN A 955 22.133 -43.188 -4.683 1.00 64.53 H new ATOM 0 HB2 GLN A 955 24.125 -43.573 -3.021 1.00 23.53 H new ATOM 0 HB3 GLN A 955 23.082 -42.791 -1.850 1.00 23.53 H new ATOM 0 HG2 GLN A 955 22.056 -45.080 -3.570 1.00 34.32 H new ATOM 0 HG3 GLN A 955 22.947 -45.394 -2.094 1.00 34.32 H new ATOM 0 HE21 GLN A 955 20.367 -46.250 -2.432 1.00 30.34 H new ATOM 0 HE22 GLN A 955 19.278 -45.375 -1.351 1.00 30.34 H new ATOM 1030 N ILE A 956 20.081 -42.294 -3.638 1.00 51.13 N ATOM 1031 CA ILE A 956 18.842 -41.665 -3.212 1.00 22.43 C ATOM 1032 C ILE A 956 18.119 -42.589 -2.229 1.00 52.33 C ATOM 1033 O ILE A 956 18.322 -43.802 -2.247 1.00 51.35 O ATOM 1034 CB ILE A 956 17.995 -41.273 -4.424 1.00 44.30 C ATOM 1035 CG1 ILE A 956 18.879 -40.972 -5.636 1.00 64.01 C ATOM 1036 CG2 ILE A 956 17.066 -40.105 -4.088 1.00 40.54 C ATOM 1037 CD1 ILE A 956 19.581 -39.621 -5.481 1.00 65.41 C ATOM 0 H ILE A 956 19.963 -43.180 -4.130 1.00 51.13 H new ATOM 0 HA ILE A 956 19.049 -40.734 -2.683 1.00 22.43 H new ATOM 0 HB ILE A 956 17.364 -42.121 -4.689 1.00 44.30 H new ATOM 0 HG12 ILE A 956 19.622 -41.761 -5.753 1.00 64.01 H new ATOM 0 HG13 ILE A 956 18.272 -40.969 -6.541 1.00 64.01 H new ATOM 0 HG21 ILE A 956 16.475 -39.846 -4.966 1.00 40.54 H new ATOM 0 HG22 ILE A 956 16.400 -40.392 -3.274 1.00 40.54 H new ATOM 0 HG23 ILE A 956 17.660 -39.243 -3.784 1.00 40.54 H new ATOM 0 HD11 ILE A 956 20.203 -39.432 -6.356 1.00 65.41 H new ATOM 0 HD12 ILE A 956 18.835 -38.832 -5.388 1.00 65.41 H new ATOM 0 HD13 ILE A 956 20.206 -39.636 -4.588 1.00 65.41 H new ATOM 1049 N ASN A 957 17.289 -41.979 -1.395 1.00 65.11 N ATOM 1050 CA ASN A 957 16.535 -42.731 -0.407 1.00 72.31 C ATOM 1051 C ASN A 957 15.110 -42.951 -0.919 1.00 71.02 C ATOM 1052 O ASN A 957 14.452 -43.919 -0.539 1.00 42.43 O ATOM 1053 CB ASN A 957 16.449 -41.970 0.917 1.00 1.11 C ATOM 1054 CG ASN A 957 17.540 -42.431 1.886 1.00 12.22 C ATOM 1055 OD1 ASN A 957 17.305 -42.664 3.061 1.00 50.44 O ATOM 1056 ND2 ASN A 957 18.742 -42.549 1.331 1.00 63.04 N ATOM 0 H ASN A 957 17.122 -40.973 -1.384 1.00 65.11 H new ATOM 0 HA ASN A 957 17.045 -43.680 -0.245 1.00 72.31 H new ATOM 0 HB2 ASN A 957 16.549 -40.900 0.733 1.00 1.11 H new ATOM 0 HB3 ASN A 957 15.468 -42.125 1.367 1.00 1.11 H new ATOM 0 HD21 ASN A 957 19.537 -42.851 1.895 1.00 63.04 H new ATOM 0 HD22 ASN A 957 18.870 -42.338 0.341 1.00 63.04 H new ATOM 1063 N GLY A 958 14.675 -42.037 -1.774 1.00 12.34 N ATOM 1064 CA GLY A 958 13.340 -42.118 -2.342 1.00 32.43 C ATOM 1065 C GLY A 958 12.875 -40.752 -2.849 1.00 2.31 C ATOM 1066 O GLY A 958 13.647 -40.020 -3.466 1.00 41.52 O ATOM 0 H GLY A 958 15.224 -41.236 -2.087 1.00 12.34 H new ATOM 0 HA2 GLY A 958 13.333 -42.836 -3.162 1.00 32.43 H new ATOM 0 HA3 GLY A 958 12.643 -42.487 -1.590 1.00 32.43 H new ATOM 1070 N GLU A 959 11.616 -40.449 -2.570 1.00 32.43 N ATOM 1071 CA GLU A 959 11.039 -39.184 -2.990 1.00 2.40 C ATOM 1072 C GLU A 959 10.443 -38.447 -1.789 1.00 31.12 C ATOM 1073 O GLU A 959 9.675 -39.025 -1.021 1.00 0.43 O ATOM 1074 CB GLU A 959 9.987 -39.396 -4.081 1.00 3.55 C ATOM 1075 CG GLU A 959 9.924 -38.192 -5.023 1.00 44.10 C ATOM 1076 CD GLU A 959 8.672 -38.247 -5.900 1.00 15.24 C ATOM 1077 OE1 GLU A 959 7.555 -38.382 -5.377 1.00 61.44 O ATOM 1078 OE2 GLU A 959 8.888 -38.142 -7.167 1.00 12.30 O ATOM 0 H GLU A 959 10.979 -41.059 -2.058 1.00 32.43 H new ATOM 0 HA GLU A 959 11.833 -38.568 -3.412 1.00 2.40 H new ATOM 0 HB2 GLU A 959 10.224 -40.295 -4.650 1.00 3.55 H new ATOM 0 HB3 GLU A 959 9.011 -39.556 -3.624 1.00 3.55 H new ATOM 0 HG2 GLU A 959 9.925 -37.270 -4.441 1.00 44.10 H new ATOM 0 HG3 GLU A 959 10.813 -38.172 -5.653 1.00 44.10 H new ATOM 1086 N ILE A 960 10.819 -37.183 -1.664 1.00 51.20 N ATOM 1087 CA ILE A 960 10.331 -36.361 -0.569 1.00 71.43 C ATOM 1088 C ILE A 960 8.995 -35.731 -0.967 1.00 12.21 C ATOM 1089 O ILE A 960 8.840 -35.251 -2.089 1.00 3.32 O ATOM 1090 CB ILE A 960 11.392 -35.342 -0.150 1.00 52.54 C ATOM 1091 CG1 ILE A 960 11.958 -34.608 -1.368 1.00 12.31 C ATOM 1092 CG2 ILE A 960 12.491 -36.005 0.681 1.00 4.45 C ATOM 1093 CD1 ILE A 960 12.493 -33.229 -0.977 1.00 11.31 C ATOM 0 H ILE A 960 11.456 -36.707 -2.303 1.00 51.20 H new ATOM 0 HA ILE A 960 10.145 -36.973 0.314 1.00 71.43 H new ATOM 0 HB ILE A 960 10.916 -34.594 0.484 1.00 52.54 H new ATOM 0 HG12 ILE A 960 12.758 -35.199 -1.814 1.00 12.31 H new ATOM 0 HG13 ILE A 960 11.181 -34.500 -2.125 1.00 12.31 H new ATOM 0 HG21 ILE A 960 13.232 -35.258 0.966 1.00 4.45 H new ATOM 0 HG22 ILE A 960 12.054 -36.443 1.578 1.00 4.45 H new ATOM 0 HG23 ILE A 960 12.971 -36.787 0.092 1.00 4.45 H new ATOM 0 HD11 ILE A 960 12.889 -32.729 -1.861 1.00 11.31 H new ATOM 0 HD12 ILE A 960 11.685 -32.632 -0.554 1.00 11.31 H new ATOM 0 HD13 ILE A 960 13.286 -33.343 -0.238 1.00 11.31 H new ATOM 1105 N ILE A 961 8.063 -35.752 -0.025 1.00 61.42 N ATOM 1106 CA ILE A 961 6.745 -35.189 -0.263 1.00 42.22 C ATOM 1107 C ILE A 961 6.308 -34.389 0.965 1.00 0.45 C ATOM 1108 O ILE A 961 6.630 -34.754 2.095 1.00 14.22 O ATOM 1109 CB ILE A 961 5.758 -36.286 -0.666 1.00 31.13 C ATOM 1110 CG1 ILE A 961 5.761 -37.427 0.353 1.00 23.53 C ATOM 1111 CG2 ILE A 961 6.040 -36.784 -2.085 1.00 11.23 C ATOM 1112 CD1 ILE A 961 4.744 -38.505 -0.027 1.00 13.12 C ATOM 0 H ILE A 961 8.195 -36.150 0.905 1.00 61.42 H new ATOM 0 HA ILE A 961 6.773 -34.495 -1.103 1.00 42.22 H new ATOM 0 HB ILE A 961 4.755 -35.859 -0.669 1.00 31.13 H new ATOM 0 HG12 ILE A 961 6.757 -37.866 0.410 1.00 23.53 H new ATOM 0 HG13 ILE A 961 5.528 -37.035 1.343 1.00 23.53 H new ATOM 0 HG21 ILE A 961 5.324 -37.563 -2.346 1.00 11.23 H new ATOM 0 HG22 ILE A 961 5.946 -35.955 -2.787 1.00 11.23 H new ATOM 0 HG23 ILE A 961 7.051 -37.189 -2.134 1.00 11.23 H new ATOM 0 HD11 ILE A 961 4.767 -39.304 0.714 1.00 13.12 H new ATOM 0 HD12 ILE A 961 3.746 -38.068 -0.059 1.00 13.12 H new ATOM 0 HD13 ILE A 961 4.994 -38.912 -1.007 1.00 13.12 H new ATOM 1124 N CYS A 962 5.582 -33.312 0.703 1.00 34.22 N ATOM 1125 CA CYS A 962 5.097 -32.457 1.774 1.00 70.25 C ATOM 1126 C CYS A 962 4.165 -33.283 2.663 1.00 40.41 C ATOM 1127 O CYS A 962 4.028 -34.490 2.472 1.00 14.03 O ATOM 1128 CB CYS A 962 4.406 -31.206 1.229 1.00 53.32 C ATOM 1129 SG CYS A 962 2.620 -31.405 0.883 1.00 51.44 S ATOM 0 H CYS A 962 5.318 -33.012 -0.235 1.00 34.22 H new ATOM 0 HA CYS A 962 5.939 -32.098 2.367 1.00 70.25 H new ATOM 0 HB2 CYS A 962 4.535 -30.395 1.946 1.00 53.32 H new ATOM 0 HB3 CYS A 962 4.908 -30.902 0.311 1.00 53.32 H new ATOM 0 HG CYS A 962 2.188 -30.371 0.224 1.00 51.44 H new ATOM 1134 N LYS A 963 3.549 -32.598 3.616 1.00 71.35 N ATOM 1135 CA LYS A 963 2.634 -33.253 4.535 1.00 72.11 C ATOM 1136 C LYS A 963 1.496 -33.899 3.742 1.00 61.24 C ATOM 1137 O LYS A 963 1.206 -35.082 3.917 1.00 53.50 O ATOM 1138 CB LYS A 963 2.156 -32.271 5.606 1.00 40.40 C ATOM 1139 CG LYS A 963 3.313 -31.408 6.115 1.00 63.45 C ATOM 1140 CD LYS A 963 4.555 -32.261 6.384 1.00 51.11 C ATOM 1141 CE LYS A 963 4.348 -33.161 7.604 1.00 71.04 C ATOM 1142 NZ LYS A 963 3.392 -32.542 8.549 1.00 51.45 N ATOM 0 H LYS A 963 3.666 -31.597 3.771 1.00 71.35 H new ATOM 0 HA LYS A 963 3.143 -34.053 5.073 1.00 72.11 H new ATOM 0 HB2 LYS A 963 1.374 -31.632 5.195 1.00 40.40 H new ATOM 0 HB3 LYS A 963 1.715 -32.821 6.437 1.00 40.40 H new ATOM 0 HG2 LYS A 963 3.548 -30.638 5.380 1.00 63.45 H new ATOM 0 HG3 LYS A 963 3.014 -30.895 7.029 1.00 63.45 H new ATOM 0 HD2 LYS A 963 4.777 -32.873 5.510 1.00 51.11 H new ATOM 0 HD3 LYS A 963 5.417 -31.614 6.547 1.00 51.11 H new ATOM 0 HE2 LYS A 963 3.975 -34.135 7.286 1.00 71.04 H new ATOM 0 HE3 LYS A 963 5.302 -33.332 8.103 1.00 71.04 H new ATOM 0 HZ1 LYS A 963 3.428 -33.045 9.458 1.00 51.45 H new ATOM 0 HZ2 LYS A 963 3.645 -31.544 8.695 1.00 51.45 H new ATOM 0 HZ3 LYS A 963 2.430 -32.601 8.158 1.00 51.45 H new ATOM 1155 N CYS A 964 0.883 -33.095 2.886 1.00 51.30 N ATOM 1156 CA CYS A 964 -0.217 -33.573 2.065 1.00 25.32 C ATOM 1157 C CYS A 964 0.268 -34.791 1.275 1.00 1.35 C ATOM 1158 O CYS A 964 -0.466 -35.765 1.118 1.00 60.03 O ATOM 1159 CB CYS A 964 -0.756 -32.475 1.147 1.00 74.12 C ATOM 1160 SG CYS A 964 -0.950 -30.837 1.940 1.00 22.42 S ATOM 0 H CYS A 964 1.127 -32.115 2.743 1.00 51.30 H new ATOM 0 HA CYS A 964 -1.052 -33.864 2.703 1.00 25.32 H new ATOM 0 HB2 CYS A 964 -0.085 -32.373 0.294 1.00 74.12 H new ATOM 0 HB3 CYS A 964 -1.723 -32.790 0.756 1.00 74.12 H new ATOM 1165 N GLY A 965 1.501 -34.695 0.800 1.00 21.31 N ATOM 1166 CA GLY A 965 2.092 -35.777 0.031 1.00 43.24 C ATOM 1167 C GLY A 965 2.458 -35.310 -1.380 1.00 4.13 C ATOM 1168 O GLY A 965 2.410 -36.091 -2.328 1.00 73.34 O ATOM 0 H GLY A 965 2.107 -33.885 0.933 1.00 21.31 H new ATOM 0 HA2 GLY A 965 2.984 -36.144 0.539 1.00 43.24 H new ATOM 0 HA3 GLY A 965 1.392 -36.611 -0.028 1.00 43.24 H new ATOM 1172 N GLN A 966 2.817 -34.038 -1.473 1.00 11.21 N ATOM 1173 CA GLN A 966 3.191 -33.458 -2.751 1.00 42.54 C ATOM 1174 C GLN A 966 4.696 -33.610 -2.984 1.00 33.33 C ATOM 1175 O GLN A 966 5.502 -33.137 -2.184 1.00 50.15 O ATOM 1176 CB GLN A 966 2.771 -31.989 -2.831 1.00 54.30 C ATOM 1177 CG GLN A 966 3.439 -31.290 -4.017 1.00 22.32 C ATOM 1178 CD GLN A 966 2.956 -31.880 -5.344 1.00 4.24 C ATOM 1179 OE1 GLN A 966 2.175 -32.815 -5.389 1.00 33.40 O ATOM 1180 NE2 GLN A 966 3.464 -31.282 -6.418 1.00 20.02 N ATOM 0 H GLN A 966 2.857 -33.393 -0.684 1.00 11.21 H new ATOM 0 HA GLN A 966 2.664 -33.996 -3.539 1.00 42.54 H new ATOM 0 HB2 GLN A 966 1.687 -31.922 -2.928 1.00 54.30 H new ATOM 0 HB3 GLN A 966 3.040 -31.480 -1.906 1.00 54.30 H new ATOM 0 HG2 GLN A 966 3.217 -30.223 -3.987 1.00 22.32 H new ATOM 0 HG3 GLN A 966 4.522 -31.393 -3.942 1.00 22.32 H new ATOM 0 HE21 GLN A 966 4.114 -30.503 -6.309 1.00 20.02 H new ATOM 0 HE22 GLN A 966 3.204 -31.602 -7.351 1.00 20.02 H new ATOM 1189 N ALA A 967 5.028 -34.273 -4.082 1.00 23.35 N ATOM 1190 CA ALA A 967 6.422 -34.494 -4.429 1.00 32.40 C ATOM 1191 C ALA A 967 7.175 -33.164 -4.371 1.00 54.34 C ATOM 1192 O ALA A 967 7.127 -32.378 -5.316 1.00 52.15 O ATOM 1193 CB ALA A 967 6.506 -35.153 -5.808 1.00 1.25 C ATOM 0 H ALA A 967 4.356 -34.664 -4.743 1.00 23.35 H new ATOM 0 HA ALA A 967 6.893 -35.170 -3.715 1.00 32.40 H new ATOM 0 HB1 ALA A 967 7.551 -35.319 -6.069 1.00 1.25 H new ATOM 0 HB2 ALA A 967 5.981 -36.108 -5.787 1.00 1.25 H new ATOM 0 HB3 ALA A 967 6.046 -34.502 -6.551 1.00 1.25 H new ATOM 1199 N TRP A 968 7.852 -32.952 -3.253 1.00 3.22 N ATOM 1200 CA TRP A 968 8.614 -31.730 -3.060 1.00 3.35 C ATOM 1201 C TRP A 968 9.870 -31.813 -3.930 1.00 10.23 C ATOM 1202 O TRP A 968 10.308 -30.810 -4.491 1.00 2.22 O ATOM 1203 CB TRP A 968 8.927 -31.507 -1.579 1.00 30.15 C ATOM 1204 CG TRP A 968 7.917 -30.613 -0.857 1.00 33.02 C ATOM 1205 CD1 TRP A 968 6.915 -29.902 -1.391 1.00 54.14 C ATOM 1206 CD2 TRP A 968 7.851 -30.362 0.563 1.00 71.10 C ATOM 1207 NE1 TRP A 968 6.211 -29.214 -0.424 1.00 54.32 N ATOM 1208 CE2 TRP A 968 6.798 -29.503 0.802 1.00 1.30 C ATOM 1209 CE3 TRP A 968 8.654 -30.846 1.611 1.00 44.35 C ATOM 1210 CZ2 TRP A 968 6.452 -29.052 2.081 1.00 0.44 C ATOM 1211 CZ3 TRP A 968 8.295 -30.385 2.883 1.00 25.42 C ATOM 1212 CH2 TRP A 968 7.239 -29.520 3.140 1.00 34.15 C ATOM 0 H TRP A 968 7.889 -33.606 -2.471 1.00 3.22 H new ATOM 0 HA TRP A 968 8.033 -30.861 -3.369 1.00 3.35 H new ATOM 0 HB2 TRP A 968 8.965 -32.474 -1.077 1.00 30.15 H new ATOM 0 HB3 TRP A 968 9.918 -31.063 -1.491 1.00 30.15 H new ATOM 0 HD1 TRP A 968 6.687 -29.871 -2.446 1.00 54.14 H new ATOM 0 HE1 TRP A 968 5.408 -28.605 -0.580 1.00 54.32 H new ATOM 0 HE3 TRP A 968 9.482 -31.520 1.447 1.00 44.35 H new ATOM 0 HZ2 TRP A 968 5.623 -28.379 2.242 1.00 0.44 H new ATOM 0 HZ3 TRP A 968 8.880 -30.726 3.724 1.00 25.42 H new ATOM 0 HH2 TRP A 968 7.026 -29.210 4.152 1.00 34.15 H new ATOM 1223 N GLY A 969 10.413 -33.018 -4.015 1.00 25.13 N ATOM 1224 CA GLY A 969 11.610 -33.245 -4.807 1.00 61.31 C ATOM 1225 C GLY A 969 12.119 -34.678 -4.633 1.00 50.25 C ATOM 1226 O GLY A 969 11.367 -35.634 -4.816 1.00 50.11 O ATOM 0 H GLY A 969 10.046 -33.848 -3.549 1.00 25.13 H new ATOM 0 HA2 GLY A 969 11.396 -33.057 -5.859 1.00 61.31 H new ATOM 0 HA3 GLY A 969 12.387 -32.541 -4.509 1.00 61.31 H new ATOM 1230 N THR A 970 13.392 -34.781 -4.283 1.00 4.13 N ATOM 1231 CA THR A 970 14.011 -36.081 -4.082 1.00 54.44 C ATOM 1232 C THR A 970 15.068 -36.004 -2.979 1.00 51.22 C ATOM 1233 O THR A 970 15.650 -34.946 -2.745 1.00 13.24 O ATOM 1234 CB THR A 970 14.568 -36.551 -5.427 1.00 64.10 C ATOM 1235 OG1 THR A 970 14.875 -35.343 -6.118 1.00 1.04 O ATOM 1236 CG2 THR A 970 13.505 -37.220 -6.300 1.00 50.15 C ATOM 0 H THR A 970 14.013 -33.986 -4.133 1.00 4.13 H new ATOM 0 HA THR A 970 13.284 -36.817 -3.740 1.00 54.44 H new ATOM 0 HB THR A 970 15.388 -37.248 -5.256 1.00 64.10 H new ATOM 0 HG1 THR A 970 15.244 -35.556 -7.001 1.00 1.04 H new ATOM 0 HG21 THR A 970 13.953 -37.534 -7.242 1.00 50.15 H new ATOM 0 HG22 THR A 970 13.103 -38.090 -5.781 1.00 50.15 H new ATOM 0 HG23 THR A 970 12.700 -36.513 -6.499 1.00 50.15 H new ATOM 1244 N MET A 971 15.285 -37.139 -2.331 1.00 75.14 N ATOM 1245 CA MET A 971 16.262 -37.214 -1.259 1.00 13.24 C ATOM 1246 C MET A 971 17.595 -37.764 -1.769 1.00 20.33 C ATOM 1247 O MET A 971 17.801 -38.977 -1.796 1.00 15.30 O ATOM 1248 CB MET A 971 15.729 -38.117 -0.145 1.00 31.33 C ATOM 1249 CG MET A 971 16.835 -38.470 0.851 1.00 24.15 C ATOM 1250 SD MET A 971 17.683 -36.988 1.372 1.00 22.23 S ATOM 1251 CE MET A 971 16.289 -35.998 1.885 1.00 45.42 C ATOM 0 H MET A 971 14.800 -38.015 -2.528 1.00 75.14 H new ATOM 0 HA MET A 971 16.430 -36.208 -0.874 1.00 13.24 H new ATOM 0 HB2 MET A 971 14.913 -37.616 0.375 1.00 31.33 H new ATOM 0 HB3 MET A 971 15.319 -39.030 -0.577 1.00 31.33 H new ATOM 0 HG2 MET A 971 16.408 -38.978 1.716 1.00 24.15 H new ATOM 0 HG3 MET A 971 17.542 -39.161 0.392 1.00 24.15 H new ATOM 0 HE1 MET A 971 16.639 -35.165 2.494 1.00 45.42 H new ATOM 0 HE2 MET A 971 15.773 -35.613 1.006 1.00 45.42 H new ATOM 0 HE3 MET A 971 15.602 -36.611 2.469 1.00 45.42 H new ATOM 1261 N MET A 972 18.467 -36.846 -2.160 1.00 74.43 N ATOM 1262 CA MET A 972 19.774 -37.225 -2.668 1.00 45.30 C ATOM 1263 C MET A 972 20.748 -37.506 -1.521 1.00 54.32 C ATOM 1264 O MET A 972 20.641 -36.908 -0.451 1.00 73.52 O ATOM 1265 CB MET A 972 20.328 -36.098 -3.543 1.00 31.20 C ATOM 1266 CG MET A 972 19.960 -36.314 -5.012 1.00 63.34 C ATOM 1267 SD MET A 972 19.954 -34.752 -5.876 1.00 65.43 S ATOM 1268 CE MET A 972 21.668 -34.289 -5.690 1.00 42.22 C ATOM 0 H MET A 972 18.294 -35.841 -2.135 1.00 74.43 H new ATOM 0 HA MET A 972 19.664 -38.135 -3.258 1.00 45.30 H new ATOM 0 HB2 MET A 972 19.933 -35.141 -3.202 1.00 31.20 H new ATOM 0 HB3 MET A 972 21.412 -36.051 -3.439 1.00 31.20 H new ATOM 0 HG2 MET A 972 20.673 -36.994 -5.478 1.00 63.34 H new ATOM 0 HG3 MET A 972 18.979 -36.783 -5.084 1.00 63.34 H new ATOM 0 HE1 MET A 972 21.891 -33.448 -6.347 1.00 42.22 H new ATOM 0 HE2 MET A 972 21.857 -34.002 -4.656 1.00 42.22 H new ATOM 0 HE3 MET A 972 22.304 -35.134 -5.954 1.00 42.22 H new ATOM 1278 N VAL A 973 21.675 -38.415 -1.784 1.00 33.13 N ATOM 1279 CA VAL A 973 22.666 -38.783 -0.787 1.00 10.51 C ATOM 1280 C VAL A 973 24.067 -38.556 -1.359 1.00 53.31 C ATOM 1281 O VAL A 973 24.271 -38.657 -2.568 1.00 1.42 O ATOM 1282 CB VAL A 973 22.435 -40.223 -0.325 1.00 52.21 C ATOM 1283 CG1 VAL A 973 23.230 -40.525 0.947 1.00 70.14 C ATOM 1284 CG2 VAL A 973 20.944 -40.500 -0.119 1.00 3.11 C ATOM 0 H VAL A 973 21.761 -38.908 -2.673 1.00 33.13 H new ATOM 0 HA VAL A 973 22.570 -38.153 0.097 1.00 10.51 H new ATOM 0 HB VAL A 973 22.794 -40.889 -1.110 1.00 52.21 H new ATOM 0 HG11 VAL A 973 23.048 -41.555 1.254 1.00 70.14 H new ATOM 0 HG12 VAL A 973 24.294 -40.387 0.753 1.00 70.14 H new ATOM 0 HG13 VAL A 973 22.916 -39.849 1.742 1.00 70.14 H new ATOM 0 HG21 VAL A 973 20.807 -41.530 0.209 1.00 3.11 H new ATOM 0 HG22 VAL A 973 20.549 -39.823 0.638 1.00 3.11 H new ATOM 0 HG23 VAL A 973 20.412 -40.345 -1.058 1.00 3.11 H new ATOM 1294 N HIS A 974 24.995 -38.254 -0.464 1.00 2.54 N ATOM 1295 CA HIS A 974 26.371 -38.012 -0.864 1.00 52.43 C ATOM 1296 C HIS A 974 27.321 -38.641 0.156 1.00 31.51 C ATOM 1297 O HIS A 974 27.545 -38.083 1.229 1.00 53.21 O ATOM 1298 CB HIS A 974 26.623 -36.516 -1.065 1.00 41.00 C ATOM 1299 CG HIS A 974 28.085 -36.143 -1.130 1.00 30.02 C ATOM 1300 ND1 HIS A 974 28.948 -36.305 -0.060 1.00 61.11 N ATOM 1301 CD2 HIS A 974 28.826 -35.616 -2.146 1.00 41.32 C ATOM 1302 CE1 HIS A 974 30.152 -35.890 -0.427 1.00 55.11 C ATOM 1303 NE2 HIS A 974 30.074 -35.462 -1.720 1.00 73.51 N ATOM 0 H HIS A 974 24.821 -38.171 0.538 1.00 2.54 H new ATOM 0 HA HIS A 974 26.562 -38.486 -1.827 1.00 52.43 H new ATOM 0 HB2 HIS A 974 26.136 -36.196 -1.986 1.00 41.00 H new ATOM 0 HB3 HIS A 974 26.154 -35.966 -0.249 1.00 41.00 H new ATOM 0 HD1 HIS A 974 28.700 -36.680 0.855 1.00 61.11 H new ATOM 0 HD2 HIS A 974 28.460 -35.366 -3.131 1.00 41.32 H new ATOM 0 HE1 HIS A 974 31.039 -35.891 0.189 1.00 55.11 H new ATOM 1311 N LYS A 975 27.854 -39.796 -0.214 1.00 64.32 N ATOM 1312 CA LYS A 975 28.775 -40.508 0.655 1.00 23.44 C ATOM 1313 C LYS A 975 28.066 -40.858 1.965 1.00 20.02 C ATOM 1314 O LYS A 975 28.712 -41.039 2.996 1.00 22.30 O ATOM 1315 CB LYS A 975 30.061 -39.702 0.849 1.00 64.54 C ATOM 1316 CG LYS A 975 30.692 -39.345 -0.499 1.00 23.42 C ATOM 1317 CD LYS A 975 32.216 -39.262 -0.386 1.00 11.32 C ATOM 1318 CE LYS A 975 32.649 -37.919 0.206 1.00 13.11 C ATOM 1319 NZ LYS A 975 31.921 -37.649 1.466 1.00 34.10 N ATOM 0 H LYS A 975 27.665 -40.257 -1.104 1.00 64.32 H new ATOM 0 HA LYS A 975 29.081 -41.448 0.196 1.00 23.44 H new ATOM 0 HB2 LYS A 975 29.843 -38.790 1.405 1.00 64.54 H new ATOM 0 HB3 LYS A 975 30.769 -40.278 1.445 1.00 64.54 H new ATOM 0 HG2 LYS A 975 30.419 -40.094 -1.242 1.00 23.42 H new ATOM 0 HG3 LYS A 975 30.297 -38.391 -0.848 1.00 23.42 H new ATOM 0 HD2 LYS A 975 32.583 -40.075 0.241 1.00 11.32 H new ATOM 0 HD3 LYS A 975 32.665 -39.391 -1.371 1.00 11.32 H new ATOM 0 HE2 LYS A 975 33.723 -37.927 0.394 1.00 13.11 H new ATOM 0 HE3 LYS A 975 32.457 -37.120 -0.510 1.00 13.11 H new ATOM 0 HZ1 LYS A 975 32.332 -36.815 1.932 1.00 34.10 H new ATOM 0 HZ2 LYS A 975 30.918 -37.470 1.256 1.00 34.10 H new ATOM 0 HZ3 LYS A 975 32.001 -38.472 2.096 1.00 34.10 H new ATOM 1332 N GLY A 976 26.746 -40.942 1.882 1.00 24.22 N ATOM 1333 CA GLY A 976 25.942 -41.267 3.048 1.00 4.12 C ATOM 1334 C GLY A 976 25.324 -40.006 3.656 1.00 20.32 C ATOM 1335 O GLY A 976 24.605 -40.081 4.651 1.00 33.21 O ATOM 0 H GLY A 976 26.213 -40.791 1.025 1.00 24.22 H new ATOM 0 HA2 GLY A 976 25.153 -41.964 2.767 1.00 4.12 H new ATOM 0 HA3 GLY A 976 26.560 -41.769 3.792 1.00 4.12 H new ATOM 1339 N LEU A 977 25.627 -38.877 3.032 1.00 31.34 N ATOM 1340 CA LEU A 977 25.110 -37.602 3.500 1.00 71.24 C ATOM 1341 C LEU A 977 23.664 -37.439 3.027 1.00 71.12 C ATOM 1342 O LEU A 977 23.215 -38.155 2.133 1.00 52.10 O ATOM 1343 CB LEU A 977 26.031 -36.460 3.067 1.00 10.31 C ATOM 1344 CG LEU A 977 26.040 -35.226 3.972 1.00 32.01 C ATOM 1345 CD1 LEU A 977 24.869 -34.298 3.645 1.00 55.31 C ATOM 1346 CD2 LEU A 977 26.057 -35.629 5.448 1.00 51.20 C ATOM 0 H LEU A 977 26.224 -38.819 2.207 1.00 31.34 H new ATOM 0 HA LEU A 977 25.095 -37.573 4.590 1.00 71.24 H new ATOM 0 HB2 LEU A 977 27.049 -36.845 3.001 1.00 10.31 H new ATOM 0 HB3 LEU A 977 25.743 -36.148 2.063 1.00 10.31 H new ATOM 0 HG LEU A 977 26.956 -34.668 3.780 1.00 32.01 H new ATOM 0 HD11 LEU A 977 24.899 -33.429 4.302 1.00 55.31 H new ATOM 0 HD12 LEU A 977 24.943 -33.971 2.608 1.00 55.31 H new ATOM 0 HD13 LEU A 977 23.930 -34.832 3.791 1.00 55.31 H new ATOM 0 HD21 LEU A 977 26.063 -34.734 6.070 1.00 51.20 H new ATOM 0 HD22 LEU A 977 25.170 -36.221 5.674 1.00 51.20 H new ATOM 0 HD23 LEU A 977 26.950 -36.220 5.654 1.00 51.20 H new ATOM 1358 N ASP A 978 22.975 -36.493 3.648 1.00 41.12 N ATOM 1359 CA ASP A 978 21.589 -36.227 3.302 1.00 43.43 C ATOM 1360 C ASP A 978 21.486 -34.844 2.655 1.00 2.22 C ATOM 1361 O ASP A 978 21.829 -33.838 3.275 1.00 43.15 O ATOM 1362 CB ASP A 978 20.700 -36.234 4.546 1.00 34.12 C ATOM 1363 CG ASP A 978 20.375 -37.623 5.101 1.00 42.31 C ATOM 1364 OD1 ASP A 978 21.270 -38.460 5.290 1.00 2.34 O ATOM 1365 OD2 ASP A 978 19.126 -37.834 5.345 1.00 62.23 O ATOM 0 H ASP A 978 23.351 -35.901 4.389 1.00 41.12 H new ATOM 0 HA ASP A 978 21.257 -37.007 2.617 1.00 43.43 H new ATOM 0 HB2 ASP A 978 21.190 -35.653 5.327 1.00 34.12 H new ATOM 0 HB3 ASP A 978 19.765 -35.726 4.309 1.00 34.12 H new ATOM 1371 N LEU A 979 21.012 -34.838 1.418 1.00 1.00 N ATOM 1372 CA LEU A 979 20.860 -33.595 0.681 1.00 74.12 C ATOM 1373 C LEU A 979 19.554 -33.637 -0.117 1.00 24.15 C ATOM 1374 O LEU A 979 19.512 -34.185 -1.217 1.00 44.30 O ATOM 1375 CB LEU A 979 22.097 -33.326 -0.178 1.00 73.53 C ATOM 1376 CG LEU A 979 23.431 -33.806 0.398 1.00 55.10 C ATOM 1377 CD1 LEU A 979 23.586 -35.319 0.235 1.00 31.21 C ATOM 1378 CD2 LEU A 979 24.602 -33.040 -0.220 1.00 11.31 C ATOM 0 H LEU A 979 20.728 -35.674 0.907 1.00 1.00 H new ATOM 0 HA LEU A 979 20.788 -32.751 1.368 1.00 74.12 H new ATOM 0 HB2 LEU A 979 21.951 -33.800 -1.148 1.00 73.53 H new ATOM 0 HB3 LEU A 979 22.166 -32.253 -0.355 1.00 73.53 H new ATOM 0 HG LEU A 979 23.437 -33.595 1.467 1.00 55.10 H new ATOM 0 HD11 LEU A 979 24.542 -35.634 0.653 1.00 31.21 H new ATOM 0 HD12 LEU A 979 22.776 -35.826 0.760 1.00 31.21 H new ATOM 0 HD13 LEU A 979 23.550 -35.577 -0.824 1.00 31.21 H new ATOM 0 HD21 LEU A 979 25.538 -33.400 0.207 1.00 11.31 H new ATOM 0 HD22 LEU A 979 24.611 -33.197 -1.299 1.00 11.31 H new ATOM 0 HD23 LEU A 979 24.493 -31.976 -0.009 1.00 11.31 H new ATOM 1390 N PRO A 980 18.494 -33.036 0.486 1.00 55.24 N ATOM 1391 CA PRO A 980 17.191 -32.999 -0.156 1.00 75.33 C ATOM 1392 C PRO A 980 17.168 -31.977 -1.294 1.00 43.14 C ATOM 1393 O PRO A 980 17.465 -30.802 -1.084 1.00 10.11 O ATOM 1394 CB PRO A 980 16.212 -32.668 0.959 1.00 71.53 C ATOM 1395 CG PRO A 980 17.046 -32.076 2.083 1.00 32.42 C ATOM 1396 CD PRO A 980 18.506 -32.377 1.789 1.00 62.25 C ATOM 0 HA PRO A 980 16.930 -33.945 -0.630 1.00 75.33 H new ATOM 0 HB2 PRO A 980 15.457 -31.960 0.618 1.00 71.53 H new ATOM 0 HB3 PRO A 980 15.684 -33.561 1.293 1.00 71.53 H new ATOM 0 HG2 PRO A 980 16.885 -31.000 2.152 1.00 32.42 H new ATOM 0 HG3 PRO A 980 16.754 -32.504 3.042 1.00 32.42 H new ATOM 0 HD2 PRO A 980 19.101 -31.464 1.766 1.00 62.25 H new ATOM 0 HD3 PRO A 980 18.939 -33.021 2.554 1.00 62.25 H new ATOM 1404 N CYS A 981 16.814 -32.461 -2.475 1.00 75.44 N ATOM 1405 CA CYS A 981 16.749 -31.604 -3.647 1.00 35.40 C ATOM 1406 C CYS A 981 15.277 -31.308 -3.944 1.00 3.51 C ATOM 1407 O CYS A 981 14.563 -32.158 -4.472 1.00 61.24 O ATOM 1408 CB CYS A 981 17.458 -32.234 -4.848 1.00 55.50 C ATOM 1409 SG CYS A 981 19.212 -31.714 -4.881 1.00 70.35 S ATOM 0 H CYS A 981 16.569 -33.436 -2.646 1.00 75.44 H new ATOM 0 HA CYS A 981 17.274 -30.670 -3.448 1.00 35.40 H new ATOM 0 HB2 CYS A 981 17.393 -33.321 -4.790 1.00 55.50 H new ATOM 0 HB3 CYS A 981 16.963 -31.934 -5.772 1.00 55.50 H new ATOM 0 HG CYS A 981 19.906 -32.573 -5.567 1.00 70.35 H new ATOM 1415 N LEU A 982 14.868 -30.098 -3.591 1.00 51.22 N ATOM 1416 CA LEU A 982 13.495 -29.678 -3.813 1.00 74.23 C ATOM 1417 C LEU A 982 13.304 -29.333 -5.292 1.00 22.13 C ATOM 1418 O LEU A 982 14.278 -29.158 -6.022 1.00 70.14 O ATOM 1419 CB LEU A 982 13.122 -28.538 -2.863 1.00 23.52 C ATOM 1420 CG LEU A 982 13.201 -28.858 -1.369 1.00 24.33 C ATOM 1421 CD1 LEU A 982 13.053 -30.361 -1.121 1.00 13.30 C ATOM 1422 CD2 LEU A 982 14.488 -28.301 -0.756 1.00 51.01 C ATOM 0 H LEU A 982 15.463 -29.395 -3.153 1.00 51.22 H new ATOM 0 HA LEU A 982 12.807 -30.491 -3.583 1.00 74.23 H new ATOM 0 HB2 LEU A 982 13.777 -27.691 -3.068 1.00 23.52 H new ATOM 0 HB3 LEU A 982 12.106 -28.218 -3.093 1.00 23.52 H new ATOM 0 HG LEU A 982 12.366 -28.365 -0.870 1.00 24.33 H new ATOM 0 HD11 LEU A 982 13.113 -30.561 -0.051 1.00 13.30 H new ATOM 0 HD12 LEU A 982 12.089 -30.699 -1.500 1.00 13.30 H new ATOM 0 HD13 LEU A 982 13.852 -30.895 -1.635 1.00 13.30 H new ATOM 0 HD21 LEU A 982 14.519 -28.542 0.306 1.00 51.01 H new ATOM 0 HD22 LEU A 982 15.350 -28.745 -1.254 1.00 51.01 H new ATOM 0 HD23 LEU A 982 14.513 -27.219 -0.883 1.00 51.01 H new ATOM 1434 N LYS A 983 12.043 -29.245 -5.688 1.00 60.52 N ATOM 1435 CA LYS A 983 11.712 -28.924 -7.066 1.00 64.42 C ATOM 1436 C LYS A 983 10.696 -27.781 -7.089 1.00 44.32 C ATOM 1437 O LYS A 983 9.581 -27.926 -6.591 1.00 23.14 O ATOM 1438 CB LYS A 983 11.246 -30.177 -7.811 1.00 15.21 C ATOM 1439 CG LYS A 983 12.366 -31.215 -7.894 1.00 22.24 C ATOM 1440 CD LYS A 983 11.830 -32.562 -8.382 1.00 64.43 C ATOM 1441 CE LYS A 983 12.638 -33.720 -7.793 1.00 23.22 C ATOM 1442 NZ LYS A 983 11.755 -34.871 -7.498 1.00 65.01 N ATOM 0 H LYS A 983 11.238 -29.390 -5.079 1.00 60.52 H new ATOM 0 HA LYS A 983 12.596 -28.575 -7.599 1.00 64.42 H new ATOM 0 HB2 LYS A 983 10.384 -30.607 -7.302 1.00 15.21 H new ATOM 0 HB3 LYS A 983 10.921 -29.907 -8.816 1.00 15.21 H new ATOM 0 HG2 LYS A 983 13.144 -30.862 -8.571 1.00 22.24 H new ATOM 0 HG3 LYS A 983 12.827 -31.337 -6.914 1.00 22.24 H new ATOM 0 HD2 LYS A 983 10.782 -32.664 -8.099 1.00 64.43 H new ATOM 0 HD3 LYS A 983 11.872 -32.601 -9.470 1.00 64.43 H new ATOM 0 HE2 LYS A 983 13.416 -34.022 -8.494 1.00 23.22 H new ATOM 0 HE3 LYS A 983 13.139 -33.395 -6.881 1.00 23.22 H new ATOM 0 HZ1 LYS A 983 11.773 -35.070 -6.477 1.00 65.01 H new ATOM 0 HZ2 LYS A 983 10.782 -34.646 -7.790 1.00 65.01 H new ATOM 0 HZ3 LYS A 983 12.089 -35.707 -8.019 1.00 65.01 H new ATOM 1455 N ILE A 984 11.118 -26.669 -7.673 1.00 41.31 N ATOM 1456 CA ILE A 984 10.259 -25.501 -7.768 1.00 11.34 C ATOM 1457 C ILE A 984 8.977 -25.875 -8.515 1.00 4.11 C ATOM 1458 O ILE A 984 7.949 -25.219 -8.358 1.00 50.40 O ATOM 1459 CB ILE A 984 11.016 -24.328 -8.394 1.00 0.11 C ATOM 1460 CG1 ILE A 984 11.703 -23.482 -7.320 1.00 30.44 C ATOM 1461 CG2 ILE A 984 10.092 -23.489 -9.280 1.00 22.44 C ATOM 1462 CD1 ILE A 984 12.393 -22.265 -7.938 1.00 54.32 C ATOM 0 H ILE A 984 12.044 -26.552 -8.085 1.00 41.31 H new ATOM 0 HA ILE A 984 9.963 -25.165 -6.774 1.00 11.34 H new ATOM 0 HB ILE A 984 11.799 -24.731 -9.036 1.00 0.11 H new ATOM 0 HG12 ILE A 984 10.968 -23.153 -6.586 1.00 30.44 H new ATOM 0 HG13 ILE A 984 12.436 -24.089 -6.788 1.00 30.44 H new ATOM 0 HG21 ILE A 984 10.655 -22.662 -9.713 1.00 22.44 H new ATOM 0 HG22 ILE A 984 9.690 -24.112 -10.079 1.00 22.44 H new ATOM 0 HG23 ILE A 984 9.272 -23.095 -8.680 1.00 22.44 H new ATOM 0 HD11 ILE A 984 12.873 -21.681 -7.153 1.00 54.32 H new ATOM 0 HD12 ILE A 984 13.145 -22.597 -8.654 1.00 54.32 H new ATOM 0 HD13 ILE A 984 11.654 -21.648 -8.448 1.00 54.32 H new ATOM 1474 N ARG A 985 9.081 -26.928 -9.312 1.00 21.34 N ATOM 1475 CA ARG A 985 7.943 -27.398 -10.084 1.00 1.33 C ATOM 1476 C ARG A 985 6.893 -28.016 -9.159 1.00 13.23 C ATOM 1477 O ARG A 985 5.804 -28.375 -9.603 1.00 74.32 O ATOM 1478 CB ARG A 985 8.373 -28.436 -11.122 1.00 74.00 C ATOM 1479 CG ARG A 985 9.275 -29.499 -10.493 1.00 63.42 C ATOM 1480 CD ARG A 985 9.080 -30.856 -11.173 1.00 31.21 C ATOM 1481 NE ARG A 985 10.352 -31.613 -11.168 1.00 11.32 N ATOM 1482 CZ ARG A 985 11.486 -31.190 -11.765 1.00 4.21 C ATOM 1483 NH1 ARG A 985 11.517 -30.010 -12.421 1.00 73.42 N ATOM 1484 NH2 ARG A 985 12.566 -31.947 -11.698 1.00 14.25 N ATOM 0 H ARG A 985 9.936 -27.469 -9.440 1.00 21.34 H new ATOM 0 HA ARG A 985 7.516 -26.539 -10.601 1.00 1.33 H new ATOM 0 HB2 ARG A 985 7.492 -28.911 -11.553 1.00 74.00 H new ATOM 0 HB3 ARG A 985 8.901 -27.942 -11.938 1.00 74.00 H new ATOM 0 HG2 ARG A 985 10.318 -29.192 -10.577 1.00 63.42 H new ATOM 0 HG3 ARG A 985 9.053 -29.586 -9.429 1.00 63.42 H new ATOM 0 HD2 ARG A 985 8.307 -31.424 -10.655 1.00 31.21 H new ATOM 0 HD3 ARG A 985 8.737 -30.712 -12.198 1.00 31.21 H new ATOM 0 HE ARG A 985 10.373 -32.510 -10.683 1.00 11.32 H new ATOM 0 HH11 ARG A 985 10.679 -29.431 -12.468 1.00 73.42 H new ATOM 0 HH12 ARG A 985 12.379 -29.698 -12.869 1.00 73.42 H new ATOM 0 HH21 ARG A 985 12.535 -32.837 -11.200 1.00 14.25 H new ATOM 0 HH22 ARG A 985 13.431 -31.642 -12.144 1.00 14.25 H new ATOM 1497 N ASN A 986 7.257 -28.120 -7.889 1.00 74.31 N ATOM 1498 CA ASN A 986 6.359 -28.689 -6.898 1.00 1.33 C ATOM 1499 C ASN A 986 6.237 -27.726 -5.715 1.00 4.02 C ATOM 1500 O ASN A 986 5.559 -28.026 -4.733 1.00 43.53 O ATOM 1501 CB ASN A 986 6.894 -30.021 -6.370 1.00 25.13 C ATOM 1502 CG ASN A 986 7.161 -30.998 -7.517 1.00 32.14 C ATOM 1503 OD1 ASN A 986 6.398 -31.108 -8.463 1.00 4.22 O ATOM 1504 ND2 ASN A 986 8.282 -31.700 -7.380 1.00 43.21 N ATOM 0 H ASN A 986 8.161 -27.820 -7.524 1.00 74.31 H new ATOM 0 HA ASN A 986 5.392 -28.852 -7.373 1.00 1.33 H new ATOM 0 HB2 ASN A 986 7.814 -29.851 -5.810 1.00 25.13 H new ATOM 0 HB3 ASN A 986 6.175 -30.457 -5.676 1.00 25.13 H new ATOM 0 HD21 ASN A 986 8.548 -32.380 -8.092 1.00 43.21 H new ATOM 0 HD22 ASN A 986 8.876 -31.558 -6.563 1.00 43.21 H new ATOM 1511 N PHE A 987 6.905 -26.589 -5.847 1.00 70.21 N ATOM 1512 CA PHE A 987 6.880 -25.581 -4.801 1.00 41.33 C ATOM 1513 C PHE A 987 6.376 -24.241 -5.343 1.00 63.40 C ATOM 1514 O PHE A 987 5.985 -24.145 -6.505 1.00 63.43 O ATOM 1515 CB PHE A 987 8.319 -25.410 -4.310 1.00 41.14 C ATOM 1516 CG PHE A 987 8.712 -26.372 -3.187 1.00 53.03 C ATOM 1517 CD1 PHE A 987 9.121 -27.634 -3.485 1.00 62.13 C ATOM 1518 CD2 PHE A 987 8.651 -25.965 -1.891 1.00 43.10 C ATOM 1519 CE1 PHE A 987 9.486 -28.527 -2.443 1.00 53.00 C ATOM 1520 CE2 PHE A 987 9.016 -26.858 -0.849 1.00 13.32 C ATOM 1521 CZ PHE A 987 9.425 -28.120 -1.147 1.00 3.13 C ATOM 0 H PHE A 987 7.467 -26.344 -6.662 1.00 70.21 H new ATOM 0 HA PHE A 987 6.211 -25.893 -3.999 1.00 41.33 H new ATOM 0 HB2 PHE A 987 8.998 -25.552 -5.151 1.00 41.14 H new ATOM 0 HB3 PHE A 987 8.454 -24.386 -3.961 1.00 41.14 H new ATOM 0 HD1 PHE A 987 9.168 -27.957 -4.514 1.00 62.13 H new ATOM 0 HD2 PHE A 987 8.325 -24.963 -1.654 1.00 43.10 H new ATOM 0 HE1 PHE A 987 9.812 -29.529 -2.680 1.00 53.00 H new ATOM 0 HE2 PHE A 987 8.969 -26.535 0.180 1.00 13.32 H new ATOM 0 HZ PHE A 987 9.701 -28.799 -0.354 1.00 3.13 H new ATOM 1531 N VAL A 988 6.402 -23.241 -4.475 1.00 11.12 N ATOM 1532 CA VAL A 988 5.953 -21.911 -4.852 1.00 34.45 C ATOM 1533 C VAL A 988 6.909 -20.870 -4.267 1.00 41.12 C ATOM 1534 O VAL A 988 7.638 -21.155 -3.318 1.00 42.34 O ATOM 1535 CB VAL A 988 4.502 -21.705 -4.411 1.00 1.22 C ATOM 1536 CG1 VAL A 988 3.938 -20.400 -4.976 1.00 10.21 C ATOM 1537 CG2 VAL A 988 3.632 -22.898 -4.812 1.00 0.40 C ATOM 0 H VAL A 988 6.727 -23.325 -3.512 1.00 11.12 H new ATOM 0 HA VAL A 988 5.970 -21.795 -5.936 1.00 34.45 H new ATOM 0 HB VAL A 988 4.489 -21.633 -3.323 1.00 1.22 H new ATOM 0 HG11 VAL A 988 2.906 -20.278 -4.648 1.00 10.21 H new ATOM 0 HG12 VAL A 988 4.535 -19.561 -4.618 1.00 10.21 H new ATOM 0 HG13 VAL A 988 3.971 -20.431 -6.065 1.00 10.21 H new ATOM 0 HG21 VAL A 988 2.606 -22.726 -4.487 1.00 0.40 H new ATOM 0 HG22 VAL A 988 3.654 -23.017 -5.895 1.00 0.40 H new ATOM 0 HG23 VAL A 988 4.015 -23.803 -4.340 1.00 0.40 H new ATOM 1547 N VAL A 989 6.875 -19.685 -4.858 1.00 42.33 N ATOM 1548 CA VAL A 989 7.730 -18.599 -4.408 1.00 60.22 C ATOM 1549 C VAL A 989 6.864 -17.395 -4.034 1.00 54.15 C ATOM 1550 O VAL A 989 6.137 -16.864 -4.873 1.00 43.03 O ATOM 1551 CB VAL A 989 8.773 -18.276 -5.480 1.00 1.21 C ATOM 1552 CG1 VAL A 989 9.966 -17.532 -4.877 1.00 2.12 C ATOM 1553 CG2 VAL A 989 9.227 -19.545 -6.204 1.00 11.11 C ATOM 0 H VAL A 989 6.269 -19.453 -5.645 1.00 42.33 H new ATOM 0 HA VAL A 989 8.282 -18.892 -3.515 1.00 60.22 H new ATOM 0 HB VAL A 989 8.306 -17.621 -6.215 1.00 1.21 H new ATOM 0 HG11 VAL A 989 10.693 -17.314 -5.660 1.00 2.12 H new ATOM 0 HG12 VAL A 989 9.624 -16.599 -4.429 1.00 2.12 H new ATOM 0 HG13 VAL A 989 10.432 -18.152 -4.111 1.00 2.12 H new ATOM 0 HG21 VAL A 989 9.968 -19.287 -6.961 1.00 11.11 H new ATOM 0 HG22 VAL A 989 9.668 -20.236 -5.485 1.00 11.11 H new ATOM 0 HG23 VAL A 989 8.369 -20.017 -6.683 1.00 11.11 H new ATOM 1563 N VAL A 990 6.969 -16.999 -2.774 1.00 52.15 N ATOM 1564 CA VAL A 990 6.204 -15.867 -2.279 1.00 72.14 C ATOM 1565 C VAL A 990 7.165 -14.768 -1.823 1.00 42.33 C ATOM 1566 O VAL A 990 7.980 -14.983 -0.928 1.00 23.13 O ATOM 1567 CB VAL A 990 5.250 -16.324 -1.174 1.00 10.44 C ATOM 1568 CG1 VAL A 990 5.001 -15.200 -0.166 1.00 3.14 C ATOM 1569 CG2 VAL A 990 3.933 -16.834 -1.762 1.00 20.12 C ATOM 0 H VAL A 990 7.572 -17.442 -2.081 1.00 52.15 H new ATOM 0 HA VAL A 990 5.585 -15.448 -3.072 1.00 72.14 H new ATOM 0 HB VAL A 990 5.723 -17.151 -0.645 1.00 10.44 H new ATOM 0 HG11 VAL A 990 4.320 -15.551 0.609 1.00 3.14 H new ATOM 0 HG12 VAL A 990 5.946 -14.903 0.289 1.00 3.14 H new ATOM 0 HG13 VAL A 990 4.560 -14.344 -0.677 1.00 3.14 H new ATOM 0 HG21 VAL A 990 3.273 -17.152 -0.955 1.00 20.12 H new ATOM 0 HG22 VAL A 990 3.454 -16.035 -2.328 1.00 20.12 H new ATOM 0 HG23 VAL A 990 4.132 -17.678 -2.422 1.00 20.12 H new ATOM 1579 N PHE A 991 7.038 -13.613 -2.460 1.00 51.13 N ATOM 1580 CA PHE A 991 7.885 -12.479 -2.131 1.00 63.43 C ATOM 1581 C PHE A 991 7.356 -11.738 -0.902 1.00 3.11 C ATOM 1582 O PHE A 991 6.153 -11.515 -0.777 1.00 41.33 O ATOM 1583 CB PHE A 991 7.855 -11.534 -3.334 1.00 62.42 C ATOM 1584 CG PHE A 991 8.743 -11.980 -4.498 1.00 75.42 C ATOM 1585 CD1 PHE A 991 10.092 -11.826 -4.423 1.00 14.31 C ATOM 1586 CD2 PHE A 991 8.182 -12.531 -5.608 1.00 61.41 C ATOM 1587 CE1 PHE A 991 10.915 -12.240 -5.503 1.00 41.41 C ATOM 1588 CE2 PHE A 991 9.006 -12.945 -6.688 1.00 74.24 C ATOM 1589 CZ PHE A 991 10.355 -12.791 -6.613 1.00 52.41 C ATOM 0 H PHE A 991 6.361 -13.438 -3.203 1.00 51.13 H new ATOM 0 HA PHE A 991 8.895 -12.822 -1.908 1.00 63.43 H new ATOM 0 HB2 PHE A 991 6.828 -11.445 -3.688 1.00 62.42 H new ATOM 0 HB3 PHE A 991 8.168 -10.541 -3.011 1.00 62.42 H new ATOM 0 HD1 PHE A 991 10.537 -11.389 -3.542 1.00 14.31 H new ATOM 0 HD2 PHE A 991 7.111 -12.654 -5.668 1.00 61.41 H new ATOM 0 HE1 PHE A 991 11.986 -12.117 -5.443 1.00 41.41 H new ATOM 0 HE2 PHE A 991 8.561 -13.382 -7.569 1.00 74.24 H new ATOM 0 HZ PHE A 991 10.981 -13.106 -7.435 1.00 52.41 H new ATOM 1599 N LYS A 992 8.281 -11.377 -0.025 1.00 4.41 N ATOM 1600 CA LYS A 992 7.923 -10.665 1.190 1.00 3.12 C ATOM 1601 C LYS A 992 7.862 -9.164 0.898 1.00 23.31 C ATOM 1602 O LYS A 992 6.980 -8.467 1.396 1.00 51.33 O ATOM 1603 CB LYS A 992 8.879 -11.032 2.327 1.00 11.34 C ATOM 1604 CG LYS A 992 8.352 -10.524 3.671 1.00 22.44 C ATOM 1605 CD LYS A 992 9.409 -10.676 4.767 1.00 21.51 C ATOM 1606 CE LYS A 992 10.062 -12.059 4.711 1.00 42.11 C ATOM 1607 NZ LYS A 992 9.039 -13.121 4.834 1.00 53.12 N ATOM 0 H LYS A 992 9.278 -11.564 -0.132 1.00 4.41 H new ATOM 0 HA LYS A 992 6.931 -10.964 1.529 1.00 3.12 H new ATOM 0 HB2 LYS A 992 9.004 -12.114 2.367 1.00 11.34 H new ATOM 0 HB3 LYS A 992 9.862 -10.604 2.133 1.00 11.34 H new ATOM 0 HG2 LYS A 992 8.065 -9.476 3.581 1.00 22.44 H new ATOM 0 HG3 LYS A 992 7.455 -11.078 3.947 1.00 22.44 H new ATOM 0 HD2 LYS A 992 10.171 -9.905 4.652 1.00 21.51 H new ATOM 0 HD3 LYS A 992 8.949 -10.526 5.744 1.00 21.51 H new ATOM 0 HE2 LYS A 992 10.603 -12.174 3.772 1.00 42.11 H new ATOM 0 HE3 LYS A 992 10.793 -12.155 5.514 1.00 42.11 H new ATOM 0 HZ1 LYS A 992 9.362 -13.837 5.516 1.00 53.12 H new ATOM 0 HZ2 LYS A 992 8.145 -12.705 5.165 1.00 53.12 H new ATOM 0 HZ3 LYS A 992 8.890 -13.569 3.907 1.00 53.12 H new ATOM 1673 N LYS A 997 2.436 -13.748 -4.900 1.00 12.44 N ATOM 1674 CA LYS A 997 2.686 -15.179 -4.915 1.00 53.15 C ATOM 1675 C LYS A 997 2.994 -15.622 -6.347 1.00 25.42 C ATOM 1676 O LYS A 997 2.106 -15.650 -7.197 1.00 62.12 O ATOM 1677 CB LYS A 997 1.519 -15.934 -4.276 1.00 13.31 C ATOM 1678 CG LYS A 997 1.378 -17.335 -4.875 1.00 13.41 C ATOM 1679 CD LYS A 997 0.199 -18.083 -4.249 1.00 0.43 C ATOM 1680 CE LYS A 997 0.179 -17.901 -2.730 1.00 25.54 C ATOM 1681 NZ LYS A 997 -0.530 -16.655 -2.365 1.00 54.14 N ATOM 0 HA LYS A 997 3.560 -15.420 -4.310 1.00 53.15 H new ATOM 0 HB2 LYS A 997 1.675 -16.009 -3.200 1.00 13.31 H new ATOM 0 HB3 LYS A 997 0.595 -15.376 -4.426 1.00 13.31 H new ATOM 0 HG2 LYS A 997 1.235 -17.261 -5.953 1.00 13.41 H new ATOM 0 HG3 LYS A 997 2.297 -17.898 -4.713 1.00 13.41 H new ATOM 0 HD2 LYS A 997 -0.736 -17.718 -4.675 1.00 0.43 H new ATOM 0 HD3 LYS A 997 0.267 -19.144 -4.491 1.00 0.43 H new ATOM 0 HE2 LYS A 997 -0.311 -18.755 -2.262 1.00 25.54 H new ATOM 0 HE3 LYS A 997 1.200 -17.870 -2.348 1.00 25.54 H new ATOM 0 HZ1 LYS A 997 0.130 -16.006 -1.892 1.00 54.14 H new ATOM 0 HZ2 LYS A 997 -0.903 -16.203 -3.224 1.00 54.14 H new ATOM 0 HZ3 LYS A 997 -1.316 -16.879 -1.722 1.00 54.14 H new ATOM 1694 N LYS A 998 4.257 -15.958 -6.569 1.00 33.40 N ATOM 1695 CA LYS A 998 4.694 -16.399 -7.883 1.00 33.33 C ATOM 1696 C LYS A 998 4.904 -17.915 -7.863 1.00 41.35 C ATOM 1697 O LYS A 998 5.076 -18.508 -6.800 1.00 4.44 O ATOM 1698 CB LYS A 998 5.928 -15.613 -8.329 1.00 11.33 C ATOM 1699 CG LYS A 998 5.533 -14.430 -9.216 1.00 64.42 C ATOM 1700 CD LYS A 998 4.574 -13.491 -8.483 1.00 1.30 C ATOM 1701 CE LYS A 998 3.960 -12.473 -9.447 1.00 33.44 C ATOM 1702 NZ LYS A 998 2.715 -13.009 -10.041 1.00 72.13 N ATOM 0 H LYS A 998 4.991 -15.934 -5.861 1.00 33.40 H new ATOM 0 HA LYS A 998 3.927 -16.193 -8.629 1.00 33.33 H new ATOM 0 HB2 LYS A 998 6.469 -15.252 -7.455 1.00 11.33 H new ATOM 0 HB3 LYS A 998 6.605 -16.271 -8.874 1.00 11.33 H new ATOM 0 HG2 LYS A 998 6.426 -13.882 -9.516 1.00 64.42 H new ATOM 0 HG3 LYS A 998 5.062 -14.796 -10.128 1.00 64.42 H new ATOM 0 HD2 LYS A 998 3.783 -14.071 -8.009 1.00 1.30 H new ATOM 0 HD3 LYS A 998 5.107 -12.969 -7.688 1.00 1.30 H new ATOM 0 HE2 LYS A 998 3.747 -11.544 -8.918 1.00 33.44 H new ATOM 0 HE3 LYS A 998 4.673 -12.234 -10.236 1.00 33.44 H new ATOM 0 HZ1 LYS A 998 2.311 -12.306 -10.693 1.00 72.13 H new ATOM 0 HZ2 LYS A 998 2.928 -13.883 -10.563 1.00 72.13 H new ATOM 0 HZ3 LYS A 998 2.030 -13.215 -9.286 1.00 72.13 H new ATOM 1715 N GLN A 999 4.883 -18.498 -9.053 1.00 21.01 N ATOM 1716 CA GLN A 999 5.069 -19.933 -9.186 1.00 43.11 C ATOM 1717 C GLN A 999 6.049 -20.238 -10.321 1.00 54.14 C ATOM 1718 O GLN A 999 5.713 -20.080 -11.494 1.00 44.13 O ATOM 1719 CB GLN A 999 3.732 -20.641 -9.411 1.00 12.13 C ATOM 1720 CG GLN A 999 3.818 -22.115 -9.011 1.00 61.45 C ATOM 1721 CD GLN A 999 2.436 -22.671 -8.663 1.00 54.14 C ATOM 1722 OE1 GLN A 999 1.412 -22.196 -9.128 1.00 2.45 O ATOM 1723 NE2 GLN A 999 2.462 -23.701 -7.823 1.00 25.31 N ATOM 0 H GLN A 999 4.740 -18.003 -9.933 1.00 21.01 H new ATOM 0 HA GLN A 999 5.491 -20.313 -8.256 1.00 43.11 H new ATOM 0 HB2 GLN A 999 2.953 -20.148 -8.830 1.00 12.13 H new ATOM 0 HB3 GLN A 999 3.446 -20.561 -10.460 1.00 12.13 H new ATOM 0 HG2 GLN A 999 4.251 -22.692 -9.828 1.00 61.45 H new ATOM 0 HG3 GLN A 999 4.484 -22.225 -8.155 1.00 61.45 H new ATOM 0 HE21 GLN A 999 3.354 -24.050 -7.471 1.00 25.31 H new ATOM 0 HE22 GLN A 999 1.590 -24.143 -7.531 1.00 25.31 H new ATOM 1732 N TYR A1000 7.239 -20.670 -9.933 1.00 5.51 N ATOM 1733 CA TYR A1000 8.270 -20.998 -10.904 1.00 33.15 C ATOM 1734 C TYR A1000 8.277 -22.497 -11.210 1.00 34.24 C ATOM 1735 O TYR A1000 7.431 -23.240 -10.713 1.00 3.25 O ATOM 1736 CB TYR A1000 9.600 -20.617 -10.252 1.00 2.43 C ATOM 1737 CG TYR A1000 9.777 -19.113 -10.032 1.00 10.11 C ATOM 1738 CD1 TYR A1000 9.073 -18.474 -9.032 1.00 33.24 C ATOM 1739 CD2 TYR A1000 10.641 -18.395 -10.834 1.00 72.11 C ATOM 1740 CE1 TYR A1000 9.239 -17.059 -8.825 1.00 0.12 C ATOM 1741 CE2 TYR A1000 10.807 -16.980 -10.627 1.00 42.23 C ATOM 1742 CZ TYR A1000 10.098 -16.381 -9.633 1.00 20.51 C ATOM 1743 OH TYR A1000 10.255 -15.045 -9.438 1.00 2.24 O ATOM 0 H TYR A1000 7.513 -20.801 -8.959 1.00 5.51 H new ATOM 0 HA TYR A1000 8.097 -20.469 -11.841 1.00 33.15 H new ATOM 0 HB2 TYR A1000 9.681 -21.126 -9.292 1.00 2.43 H new ATOM 0 HB3 TYR A1000 10.416 -20.981 -10.876 1.00 2.43 H new ATOM 0 HD1 TYR A1000 8.397 -19.036 -8.404 1.00 33.24 H new ATOM 0 HD2 TYR A1000 11.192 -18.895 -11.617 1.00 72.11 H new ATOM 0 HE1 TYR A1000 8.694 -16.547 -8.046 1.00 0.12 H new ATOM 0 HE2 TYR A1000 11.480 -16.407 -11.248 1.00 42.23 H new ATOM 0 HH TYR A1000 10.900 -14.693 -10.087 1.00 2.24 H new ATOM 1753 N LYS A1001 9.240 -22.897 -12.026 1.00 70.43 N ATOM 1754 CA LYS A1001 9.368 -24.295 -12.405 1.00 1.54 C ATOM 1755 C LYS A1001 10.739 -24.813 -11.966 1.00 61.43 C ATOM 1756 O LYS A1001 10.837 -25.869 -11.342 1.00 51.13 O ATOM 1757 CB LYS A1001 9.092 -24.473 -13.899 1.00 1.51 C ATOM 1758 CG LYS A1001 9.542 -23.242 -14.690 1.00 34.22 C ATOM 1759 CD LYS A1001 9.378 -23.468 -16.194 1.00 42.23 C ATOM 1760 CE LYS A1001 9.226 -22.138 -16.935 1.00 15.33 C ATOM 1761 NZ LYS A1001 7.802 -21.737 -16.992 1.00 51.11 N ATOM 0 H LYS A1001 9.940 -22.278 -12.436 1.00 70.43 H new ATOM 0 HA LYS A1001 8.619 -24.899 -11.893 1.00 1.54 H new ATOM 0 HB2 LYS A1001 9.614 -25.357 -14.266 1.00 1.51 H new ATOM 0 HB3 LYS A1001 8.027 -24.643 -14.058 1.00 1.51 H new ATOM 0 HG2 LYS A1001 8.958 -22.374 -14.383 1.00 34.22 H new ATOM 0 HG3 LYS A1001 10.585 -23.021 -14.463 1.00 34.22 H new ATOM 0 HD2 LYS A1001 10.243 -24.007 -16.581 1.00 42.23 H new ATOM 0 HD3 LYS A1001 8.504 -24.093 -16.378 1.00 42.23 H new ATOM 0 HE2 LYS A1001 9.808 -21.366 -16.432 1.00 15.33 H new ATOM 0 HE3 LYS A1001 9.625 -22.230 -17.945 1.00 15.33 H new ATOM 0 HZ1 LYS A1001 7.716 -20.832 -17.498 1.00 51.11 H new ATOM 0 HZ2 LYS A1001 7.256 -22.467 -17.492 1.00 51.11 H new ATOM 0 HZ3 LYS A1001 7.433 -21.630 -16.026 1.00 51.11 H new ATOM 1774 N LYS A1002 11.764 -24.047 -12.310 1.00 72.33 N ATOM 1775 CA LYS A1002 13.125 -24.416 -11.960 1.00 71.42 C ATOM 1776 C LYS A1002 13.731 -23.329 -11.070 1.00 74.41 C ATOM 1777 O LYS A1002 13.263 -22.192 -11.068 1.00 51.31 O ATOM 1778 CB LYS A1002 13.943 -24.706 -13.221 1.00 13.44 C ATOM 1779 CG LYS A1002 13.323 -25.850 -14.025 1.00 64.04 C ATOM 1780 CD LYS A1002 12.356 -25.315 -15.084 1.00 24.52 C ATOM 1781 CE LYS A1002 11.783 -26.455 -15.928 1.00 61.22 C ATOM 1782 NZ LYS A1002 12.852 -27.406 -16.310 1.00 14.32 N ATOM 0 H LYS A1002 11.679 -23.172 -12.828 1.00 72.33 H new ATOM 0 HA LYS A1002 13.133 -25.341 -11.384 1.00 71.42 H new ATOM 0 HB2 LYS A1002 13.996 -23.809 -13.839 1.00 13.44 H new ATOM 0 HB3 LYS A1002 14.965 -24.963 -12.944 1.00 13.44 H new ATOM 0 HG2 LYS A1002 14.111 -26.430 -14.506 1.00 64.04 H new ATOM 0 HG3 LYS A1002 12.794 -26.527 -13.353 1.00 64.04 H new ATOM 0 HD2 LYS A1002 11.544 -24.773 -14.600 1.00 24.52 H new ATOM 0 HD3 LYS A1002 12.874 -24.605 -15.729 1.00 24.52 H new ATOM 0 HE2 LYS A1002 11.008 -26.977 -15.367 1.00 61.22 H new ATOM 0 HE3 LYS A1002 11.311 -26.051 -16.823 1.00 61.22 H new ATOM 0 HZ1 LYS A1002 12.543 -27.963 -17.132 1.00 14.32 H new ATOM 0 HZ2 LYS A1002 13.715 -26.879 -16.553 1.00 14.32 H new ATOM 0 HZ3 LYS A1002 13.050 -28.045 -15.513 1.00 14.32 H new ATOM 1795 N TRP A1003 14.762 -23.718 -10.335 1.00 1.00 N ATOM 1796 CA TRP A1003 15.437 -22.791 -9.442 1.00 54.35 C ATOM 1797 C TRP A1003 16.211 -21.788 -10.300 1.00 2.21 C ATOM 1798 O TRP A1003 16.580 -20.714 -9.826 1.00 34.44 O ATOM 1799 CB TRP A1003 16.326 -23.537 -8.446 1.00 73.41 C ATOM 1800 CG TRP A1003 15.611 -24.664 -7.697 1.00 61.23 C ATOM 1801 CD1 TRP A1003 15.619 -25.975 -7.976 1.00 3.11 C ATOM 1802 CD2 TRP A1003 14.777 -24.525 -6.527 1.00 65.53 C ATOM 1803 NE1 TRP A1003 14.855 -26.688 -7.075 1.00 22.31 N ATOM 1804 CE2 TRP A1003 14.327 -25.779 -6.166 1.00 1.20 C ATOM 1805 CE3 TRP A1003 14.416 -23.379 -5.798 1.00 42.23 C ATOM 1806 CZ2 TRP A1003 13.491 -26.005 -5.066 1.00 74.34 C ATOM 1807 CZ3 TRP A1003 13.580 -23.622 -4.702 1.00 73.13 C ATOM 1808 CH2 TRP A1003 13.118 -24.878 -4.325 1.00 55.45 C ATOM 0 H TRP A1003 15.147 -24.663 -10.339 1.00 1.00 H new ATOM 0 HA TRP A1003 14.715 -22.246 -8.834 1.00 54.35 H new ATOM 0 HB2 TRP A1003 17.181 -23.954 -8.979 1.00 73.41 H new ATOM 0 HB3 TRP A1003 16.719 -22.825 -7.721 1.00 73.41 H new ATOM 0 HD1 TRP A1003 16.156 -26.418 -8.802 1.00 3.11 H new ATOM 0 HE1 TRP A1003 14.705 -27.697 -7.076 1.00 22.31 H new ATOM 0 HE3 TRP A1003 14.757 -22.389 -6.063 1.00 42.23 H new ATOM 0 HZ2 TRP A1003 13.152 -26.996 -4.803 1.00 74.34 H new ATOM 0 HZ3 TRP A1003 13.272 -22.774 -4.108 1.00 73.13 H new ATOM 0 HH2 TRP A1003 12.474 -24.983 -3.464 1.00 55.45 H new ATOM 1819 N VAL A1004 16.435 -22.173 -11.548 1.00 22.45 N ATOM 1820 CA VAL A1004 17.159 -21.321 -12.476 1.00 22.44 C ATOM 1821 C VAL A1004 16.288 -20.118 -12.842 1.00 4.01 C ATOM 1822 O VAL A1004 16.803 -19.036 -13.118 1.00 44.35 O ATOM 1823 CB VAL A1004 17.601 -22.133 -13.695 1.00 42.11 C ATOM 1824 CG1 VAL A1004 16.449 -22.981 -14.236 1.00 74.21 C ATOM 1825 CG2 VAL A1004 18.169 -21.221 -14.784 1.00 51.42 C ATOM 0 H VAL A1004 16.128 -23.064 -11.938 1.00 22.45 H new ATOM 0 HA VAL A1004 18.067 -20.935 -12.013 1.00 22.44 H new ATOM 0 HB VAL A1004 18.394 -22.810 -13.377 1.00 42.11 H new ATOM 0 HG11 VAL A1004 16.790 -23.548 -15.102 1.00 74.21 H new ATOM 0 HG12 VAL A1004 16.109 -23.670 -13.462 1.00 74.21 H new ATOM 0 HG13 VAL A1004 15.625 -22.331 -14.530 1.00 74.21 H new ATOM 0 HG21 VAL A1004 18.476 -21.823 -15.639 1.00 51.42 H new ATOM 0 HG22 VAL A1004 17.406 -20.509 -15.097 1.00 51.42 H new ATOM 0 HG23 VAL A1004 19.031 -20.681 -14.393 1.00 51.42 H new ATOM 1835 N GLU A1005 14.983 -20.347 -12.832 1.00 65.40 N ATOM 1836 CA GLU A1005 14.036 -19.295 -13.160 1.00 22.52 C ATOM 1837 C GLU A1005 14.075 -18.196 -12.097 1.00 2.23 C ATOM 1838 O GLU A1005 13.714 -17.052 -12.368 1.00 51.23 O ATOM 1839 CB GLU A1005 12.622 -19.859 -13.314 1.00 23.34 C ATOM 1840 CG GLU A1005 12.550 -20.847 -14.480 1.00 31.54 C ATOM 1841 CD GLU A1005 12.901 -20.162 -15.802 1.00 24.24 C ATOM 1842 OE1 GLU A1005 12.128 -19.326 -16.291 1.00 40.31 O ATOM 1843 OE2 GLU A1005 14.024 -20.526 -16.322 1.00 43.44 O ATOM 0 H GLU A1005 14.559 -21.246 -12.602 1.00 65.40 H new ATOM 0 HA GLU A1005 14.324 -18.859 -14.116 1.00 22.52 H new ATOM 0 HB2 GLU A1005 12.323 -20.357 -12.392 1.00 23.34 H new ATOM 0 HB3 GLU A1005 11.917 -19.044 -13.479 1.00 23.34 H new ATOM 0 HG2 GLU A1005 13.236 -21.675 -14.302 1.00 31.54 H new ATOM 0 HG3 GLU A1005 11.548 -21.271 -14.541 1.00 31.54 H new ATOM 1851 N LEU A1006 14.517 -18.581 -10.908 1.00 71.15 N ATOM 1852 CA LEU A1006 14.608 -17.642 -9.803 1.00 72.13 C ATOM 1853 C LEU A1006 15.705 -16.618 -10.099 1.00 41.31 C ATOM 1854 O LEU A1006 16.885 -16.963 -10.147 1.00 53.41 O ATOM 1855 CB LEU A1006 14.803 -18.388 -8.482 1.00 14.45 C ATOM 1856 CG LEU A1006 14.174 -17.739 -7.247 1.00 1.34 C ATOM 1857 CD1 LEU A1006 12.721 -17.344 -7.515 1.00 14.43 C ATOM 1858 CD2 LEU A1006 14.304 -18.648 -6.023 1.00 65.11 C ATOM 0 H LEU A1006 14.816 -19.531 -10.686 1.00 71.15 H new ATOM 0 HA LEU A1006 13.675 -17.088 -9.695 1.00 72.13 H new ATOM 0 HB2 LEU A1006 14.392 -19.392 -8.590 1.00 14.45 H new ATOM 0 HB3 LEU A1006 15.873 -18.499 -8.305 1.00 14.45 H new ATOM 0 HG LEU A1006 14.722 -16.823 -7.027 1.00 1.34 H new ATOM 0 HD11 LEU A1006 12.298 -16.885 -6.621 1.00 14.43 H new ATOM 0 HD12 LEU A1006 12.684 -16.633 -8.340 1.00 14.43 H new ATOM 0 HD13 LEU A1006 12.145 -18.232 -7.775 1.00 14.43 H new ATOM 0 HD21 LEU A1006 13.849 -18.163 -5.159 1.00 65.11 H new ATOM 0 HD22 LEU A1006 13.798 -19.594 -6.217 1.00 65.11 H new ATOM 0 HD23 LEU A1006 15.358 -18.836 -5.820 1.00 65.11 H new ATOM 1870 N PRO A1007 15.266 -15.345 -10.295 1.00 20.51 N ATOM 1871 CA PRO A1007 16.197 -14.269 -10.585 1.00 4.43 C ATOM 1872 C PRO A1007 16.959 -13.849 -9.326 1.00 2.20 C ATOM 1873 O PRO A1007 17.781 -12.935 -9.369 1.00 65.15 O ATOM 1874 CB PRO A1007 15.341 -13.153 -11.161 1.00 4.51 C ATOM 1875 CG PRO A1007 13.913 -13.464 -10.743 1.00 65.54 C ATOM 1876 CD PRO A1007 13.876 -14.900 -10.246 1.00 24.22 C ATOM 0 HA PRO A1007 16.973 -14.563 -11.292 1.00 4.43 H new ATOM 0 HB2 PRO A1007 15.657 -12.182 -10.779 1.00 4.51 H new ATOM 0 HB3 PRO A1007 15.430 -13.113 -12.247 1.00 4.51 H new ATOM 0 HG2 PRO A1007 13.587 -12.780 -9.959 1.00 65.54 H new ATOM 0 HG3 PRO A1007 13.232 -13.333 -11.584 1.00 65.54 H new ATOM 0 HD2 PRO A1007 13.477 -14.958 -9.233 1.00 24.22 H new ATOM 0 HD3 PRO A1007 13.239 -15.521 -10.876 1.00 24.22 H new ATOM 1884 N ILE A1008 16.659 -14.536 -8.234 1.00 75.52 N ATOM 1885 CA ILE A1008 17.305 -14.247 -6.965 1.00 51.45 C ATOM 1886 C ILE A1008 18.613 -15.034 -6.873 1.00 21.42 C ATOM 1887 O ILE A1008 18.638 -16.236 -7.134 1.00 62.14 O ATOM 1888 CB ILE A1008 16.345 -14.509 -5.803 1.00 63.00 C ATOM 1889 CG1 ILE A1008 15.359 -13.352 -5.634 1.00 52.44 C ATOM 1890 CG2 ILE A1008 17.114 -14.800 -4.512 1.00 50.44 C ATOM 1891 CD1 ILE A1008 14.887 -12.831 -6.994 1.00 1.14 C ATOM 0 H ILE A1008 15.976 -15.293 -8.202 1.00 75.52 H new ATOM 0 HA ILE A1008 17.564 -13.190 -6.901 1.00 51.45 H new ATOM 0 HB ILE A1008 15.760 -15.398 -6.037 1.00 63.00 H new ATOM 0 HG12 ILE A1008 14.501 -13.683 -5.050 1.00 52.44 H new ATOM 0 HG13 ILE A1008 15.832 -12.545 -5.075 1.00 52.44 H new ATOM 0 HG21 ILE A1008 16.408 -14.983 -3.702 1.00 50.44 H new ATOM 0 HG22 ILE A1008 17.741 -15.680 -4.653 1.00 50.44 H new ATOM 0 HG23 ILE A1008 17.741 -13.944 -4.261 1.00 50.44 H new ATOM 0 HD11 ILE A1008 14.187 -12.009 -6.846 1.00 1.14 H new ATOM 0 HD12 ILE A1008 15.745 -12.478 -7.566 1.00 1.14 H new ATOM 0 HD13 ILE A1008 14.393 -13.635 -7.540 1.00 1.14 H new ATOM 1903 N THR A1009 19.668 -14.326 -6.500 1.00 4.54 N ATOM 1904 CA THR A1009 20.977 -14.943 -6.369 1.00 60.51 C ATOM 1905 C THR A1009 21.024 -15.834 -5.126 1.00 65.43 C ATOM 1906 O THR A1009 20.285 -15.611 -4.169 1.00 53.03 O ATOM 1907 CB THR A1009 22.027 -13.830 -6.359 1.00 74.33 C ATOM 1908 OG1 THR A1009 22.229 -13.532 -7.738 1.00 22.02 O ATOM 1909 CG2 THR A1009 23.394 -14.320 -5.879 1.00 5.50 C ATOM 0 H THR A1009 19.643 -13.329 -6.284 1.00 4.54 H new ATOM 0 HA THR A1009 21.190 -15.601 -7.211 1.00 60.51 H new ATOM 0 HB THR A1009 21.688 -13.016 -5.718 1.00 74.33 H new ATOM 0 HG1 THR A1009 22.895 -12.818 -7.824 1.00 22.02 H new ATOM 0 HG21 THR A1009 24.102 -13.492 -5.891 1.00 5.50 H new ATOM 0 HG22 THR A1009 23.306 -14.707 -4.864 1.00 5.50 H new ATOM 0 HG23 THR A1009 23.750 -15.111 -6.540 1.00 5.50 H new ATOM 1917 N PHE A1010 21.902 -16.826 -5.181 1.00 40.51 N ATOM 1918 CA PHE A1010 22.056 -17.751 -4.072 1.00 33.23 C ATOM 1919 C PHE A1010 23.523 -17.864 -3.651 1.00 75.53 C ATOM 1920 O PHE A1010 24.416 -17.432 -4.378 1.00 75.12 O ATOM 1921 CB PHE A1010 21.570 -19.118 -4.559 1.00 43.20 C ATOM 1922 CG PHE A1010 20.088 -19.384 -4.290 1.00 13.22 C ATOM 1923 CD1 PHE A1010 19.140 -18.823 -5.088 1.00 43.22 C ATOM 1924 CD2 PHE A1010 19.717 -20.181 -3.252 1.00 44.01 C ATOM 1925 CE1 PHE A1010 17.765 -19.070 -4.838 1.00 55.43 C ATOM 1926 CE2 PHE A1010 18.341 -20.428 -3.002 1.00 45.31 C ATOM 1927 CZ PHE A1010 17.394 -19.867 -3.801 1.00 1.24 C ATOM 0 H PHE A1010 22.514 -17.008 -5.977 1.00 40.51 H new ATOM 0 HA PHE A1010 21.486 -17.399 -3.212 1.00 33.23 H new ATOM 0 HB2 PHE A1010 21.754 -19.197 -5.630 1.00 43.20 H new ATOM 0 HB3 PHE A1010 22.162 -19.896 -4.076 1.00 43.20 H new ATOM 0 HD1 PHE A1010 19.434 -18.190 -5.912 1.00 43.22 H new ATOM 0 HD2 PHE A1010 20.469 -20.626 -2.618 1.00 44.01 H new ATOM 0 HE1 PHE A1010 17.013 -18.624 -5.472 1.00 55.43 H new ATOM 0 HE2 PHE A1010 18.047 -21.061 -2.178 1.00 45.31 H new ATOM 0 HZ PHE A1010 16.347 -20.055 -3.612 1.00 1.24 H new ATOM 1937 N PRO A1011 23.731 -18.464 -2.448 1.00 40.34 N ATOM 1938 CA PRO A1011 25.074 -18.639 -1.922 1.00 60.35 C ATOM 1939 C PRO A1011 25.805 -19.769 -2.651 1.00 32.11 C ATOM 1940 O PRO A1011 25.392 -20.184 -3.732 1.00 72.45 O ATOM 1941 CB PRO A1011 24.883 -18.914 -0.440 1.00 21.32 C ATOM 1942 CG PRO A1011 23.434 -19.342 -0.279 1.00 34.45 C ATOM 1943 CD PRO A1011 22.698 -18.988 -1.560 1.00 74.03 C ATOM 0 HA PRO A1011 25.703 -17.762 -2.073 1.00 60.35 H new ATOM 0 HB2 PRO A1011 25.561 -19.695 -0.097 1.00 21.32 H new ATOM 0 HB3 PRO A1011 25.096 -18.024 0.153 1.00 21.32 H new ATOM 0 HG2 PRO A1011 23.372 -20.413 -0.087 1.00 34.45 H new ATOM 0 HG3 PRO A1011 22.980 -18.838 0.574 1.00 34.45 H new ATOM 0 HD2 PRO A1011 22.211 -19.863 -1.992 1.00 74.03 H new ATOM 0 HD3 PRO A1011 21.919 -18.247 -1.378 1.00 74.03 H new