USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=20 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 972 MET CE :methyl 165:sc= -0.334 (180deg=-1.35!) USER MOD Set 1.2: A 981 CYS SG : rot 156:sc= 1.22 USER MOD Set 2.1: A 939 TYR OH : rot 180:sc= -0.154 USER MOD Set 2.2: A 971 MET CE :methyl 170:sc= -2.66! (180deg=-3.19!) USER MOD Set 3.1: A 948 GLN : amide:sc= -3.72 K(o=-6.7,f=-3.5) USER MOD Set 3.2: A 955 GLN : amide:sc= -3.01 K(o=-6.7,f=-4.6!) USER MOD Set 4.1: A 915 CYS SG : rot 56:sc= -6.02! USER MOD Set 4.2: A 930 ASN : amide:sc= -6.27! C(o=-13!,f=-20!) USER MOD Set 4.3: A 932 THR OG1 : rot 159:sc= -0.472 USER MOD Set 5.1: A 911 SER OG : rot 58:sc= 1.14 USER MOD Set 5.2: A 997 LYS NZ :NH3+ -147:sc= 0.0339 (180deg=0) USER MOD Set 6.1: A 909 ASN : amide:sc= -2.93! C(o=-3.8!,f=-6!) USER MOD Set 6.2: A 966 GLN : amide:sc= -0.917 K(o=-3.8,f=-9.2!) USER MOD Set 7.1: A 907 CYS SG : rot 122:sc= 0.461! USER MOD Set 7.2: A 962 CYS SG : rot -173:sc= 1.38 USER MOD Single : A 898 ASN : amide:sc= -1.48 K(o=-1.5,f=-0.62) USER MOD Single : A 899 ASN : amide:sc= -2.15 K(o=-2.2,f=-4.4!) USER MOD Single : A 901 SER OG : rot 180:sc= 0 USER MOD Single : A 904 THR OG1 : rot 180:sc= -0.853 USER MOD Single : A 908 LYS NZ :NH3+ 149:sc= -0.133 (180deg=-0.655) USER MOD Single : A 916 SER OG : rot -118:sc= -0.806 USER MOD Single : A 921 HIS : no HD1:sc= -0.0217 X(o=-0.022,f=-0.24) USER MOD Single : A 931 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 936 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 944 ASN : amide:sc= -13.7! C(o=-14!,f=-6.6!) USER MOD Single : A 945 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 957 ASN : amide:sc= -1.66 K(o=-1.7,f=-0.4) USER MOD Single : A 963 LYS NZ :NH3+ -163:sc= -0.572 (180deg=-1.35) USER MOD Single : A 970 THR OG1 : rot 180:sc=-0.00433 USER MOD Single : A 974 HIS : no HD1:sc= -3.32! C(o=-3.3!,f=-5.9!) USER MOD Single : A 975 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 983 LYS NZ :NH3+ -125:sc= -6.52! (180deg=-6.88!) USER MOD Single : A 986 ASN : amide:sc= -4.84! C(o=-4.8!,f=-4!) USER MOD Single : A 992 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 998 LYS NZ :NH3+ -165:sc= -0.0799 (180deg=-0.445) USER MOD Single : A 999 GLN : amide:sc= -1.41! K(o=-1.4!,f=-0.51) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A1009 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 101 N ASN A 898 16.368 -9.326 -5.250 1.00 73.42 N ATOM 102 CA ASN A 898 17.459 -10.236 -5.553 1.00 65.11 C ATOM 103 C ASN A 898 18.027 -10.797 -4.248 1.00 5.23 C ATOM 104 O ASN A 898 19.219 -11.089 -4.160 1.00 70.41 O ATOM 105 CB ASN A 898 18.590 -9.514 -6.289 1.00 31.10 C ATOM 106 CG ASN A 898 18.427 -9.642 -7.805 1.00 20.31 C ATOM 107 OD1 ASN A 898 18.249 -8.670 -8.521 1.00 21.35 O ATOM 108 ND2 ASN A 898 18.497 -10.893 -8.253 1.00 5.43 N ATOM 0 HA ASN A 898 17.068 -11.033 -6.186 1.00 65.11 H new ATOM 0 HB2 ASN A 898 18.597 -8.461 -6.008 1.00 31.10 H new ATOM 0 HB3 ASN A 898 19.550 -9.931 -5.986 1.00 31.10 H new ATOM 0 HD21 ASN A 898 18.400 -11.084 -9.250 1.00 5.43 H new ATOM 0 HD22 ASN A 898 18.648 -11.661 -7.599 1.00 5.43 H new ATOM 115 N ASN A 899 17.148 -10.930 -3.266 1.00 10.42 N ATOM 116 CA ASN A 899 17.547 -11.450 -1.969 1.00 71.01 C ATOM 117 C ASN A 899 16.663 -12.646 -1.610 1.00 73.15 C ATOM 118 O ASN A 899 15.438 -12.532 -1.586 1.00 63.31 O ATOM 119 CB ASN A 899 17.378 -10.393 -0.876 1.00 5.00 C ATOM 120 CG ASN A 899 18.370 -10.623 0.266 1.00 0.34 C ATOM 121 OD1 ASN A 899 19.406 -11.247 0.108 1.00 70.45 O ATOM 122 ND2 ASN A 899 17.996 -10.084 1.424 1.00 62.54 N ATOM 0 H ASN A 899 16.160 -10.687 -3.342 1.00 10.42 H new ATOM 0 HA ASN A 899 18.596 -11.741 -2.031 1.00 71.01 H new ATOM 0 HB2 ASN A 899 17.529 -9.400 -1.299 1.00 5.00 H new ATOM 0 HB3 ASN A 899 16.359 -10.424 -0.490 1.00 5.00 H new ATOM 0 HD21 ASN A 899 18.590 -10.181 2.247 1.00 62.54 H new ATOM 0 HD22 ASN A 899 17.115 -9.574 1.488 1.00 62.54 H new ATOM 129 N PRO A 900 17.335 -13.795 -1.334 1.00 21.41 N ATOM 130 CA PRO A 900 16.624 -15.011 -0.978 1.00 31.34 C ATOM 131 C PRO A 900 16.093 -14.936 0.455 1.00 30.24 C ATOM 132 O PRO A 900 15.478 -15.883 0.944 1.00 54.24 O ATOM 133 CB PRO A 900 17.632 -16.130 -1.180 1.00 24.44 C ATOM 134 CG PRO A 900 18.998 -15.463 -1.192 1.00 63.52 C ATOM 135 CD PRO A 900 18.785 -13.967 -1.353 1.00 32.22 C ATOM 0 HA PRO A 900 15.738 -15.175 -1.592 1.00 31.34 H new ATOM 0 HB2 PRO A 900 17.564 -16.866 -0.379 1.00 24.44 H new ATOM 0 HB3 PRO A 900 17.447 -16.658 -2.115 1.00 24.44 H new ATOM 0 HG2 PRO A 900 19.534 -15.675 -0.267 1.00 63.52 H new ATOM 0 HG3 PRO A 900 19.606 -15.852 -2.009 1.00 63.52 H new ATOM 0 HD2 PRO A 900 19.260 -13.410 -0.546 1.00 32.22 H new ATOM 0 HD3 PRO A 900 19.215 -13.604 -2.287 1.00 32.22 H new ATOM 143 N SER A 901 16.350 -13.802 1.089 1.00 3.51 N ATOM 144 CA SER A 901 15.906 -13.590 2.456 1.00 31.43 C ATOM 145 C SER A 901 14.476 -13.046 2.464 1.00 42.45 C ATOM 146 O SER A 901 13.744 -13.226 3.436 1.00 44.53 O ATOM 147 CB SER A 901 16.842 -12.634 3.198 1.00 30.43 C ATOM 148 OG SER A 901 16.496 -12.510 4.575 1.00 25.52 O ATOM 0 H SER A 901 16.861 -13.019 0.681 1.00 3.51 H new ATOM 0 HA SER A 901 15.926 -14.549 2.974 1.00 31.43 H new ATOM 0 HB2 SER A 901 17.868 -12.992 3.113 1.00 30.43 H new ATOM 0 HB3 SER A 901 16.807 -11.652 2.725 1.00 30.43 H new ATOM 0 HG SER A 901 17.118 -11.893 5.014 1.00 25.52 H new ATOM 154 N LEU A 902 14.121 -12.391 1.368 1.00 41.40 N ATOM 155 CA LEU A 902 12.792 -11.818 1.236 1.00 61.32 C ATOM 156 C LEU A 902 11.860 -12.848 0.593 1.00 10.43 C ATOM 157 O LEU A 902 10.644 -12.784 0.769 1.00 62.11 O ATOM 158 CB LEU A 902 12.854 -10.489 0.481 1.00 12.10 C ATOM 159 CG LEU A 902 14.111 -9.647 0.707 1.00 63.11 C ATOM 160 CD1 LEU A 902 14.459 -8.834 -0.542 1.00 35.32 C ATOM 161 CD2 LEU A 902 13.963 -8.760 1.945 1.00 74.51 C ATOM 0 H LEU A 902 14.731 -12.244 0.563 1.00 41.40 H new ATOM 0 HA LEU A 902 12.379 -11.581 2.217 1.00 61.32 H new ATOM 0 HB2 LEU A 902 12.766 -10.695 -0.586 1.00 12.10 H new ATOM 0 HB3 LEU A 902 11.986 -9.893 0.763 1.00 12.10 H new ATOM 0 HG LEU A 902 14.945 -10.323 0.894 1.00 63.11 H new ATOM 0 HD11 LEU A 902 15.356 -8.245 -0.354 1.00 35.32 H new ATOM 0 HD12 LEU A 902 14.637 -9.510 -1.378 1.00 35.32 H new ATOM 0 HD13 LEU A 902 13.631 -8.167 -0.785 1.00 35.32 H new ATOM 0 HD21 LEU A 902 14.871 -8.172 2.082 1.00 74.51 H new ATOM 0 HD22 LEU A 902 13.113 -8.090 1.813 1.00 74.51 H new ATOM 0 HD23 LEU A 902 13.799 -9.385 2.823 1.00 74.51 H new ATOM 173 N ILE A 903 12.465 -13.772 -0.138 1.00 4.13 N ATOM 174 CA ILE A 903 11.705 -14.813 -0.807 1.00 72.33 C ATOM 175 C ILE A 903 11.748 -16.091 0.034 1.00 52.25 C ATOM 176 O ILE A 903 12.663 -16.281 0.833 1.00 31.51 O ATOM 177 CB ILE A 903 12.204 -15.004 -2.241 1.00 51.50 C ATOM 178 CG1 ILE A 903 13.436 -15.910 -2.277 1.00 3.41 C ATOM 179 CG2 ILE A 903 12.464 -13.655 -2.914 1.00 44.44 C ATOM 180 CD1 ILE A 903 14.364 -15.528 -3.432 1.00 73.25 C ATOM 0 H ILE A 903 13.474 -13.821 -0.282 1.00 4.13 H new ATOM 0 HA ILE A 903 10.658 -14.523 -0.894 1.00 72.33 H new ATOM 0 HB ILE A 903 11.421 -15.503 -2.812 1.00 51.50 H new ATOM 0 HG12 ILE A 903 13.975 -15.835 -1.333 1.00 3.41 H new ATOM 0 HG13 ILE A 903 13.125 -16.949 -2.384 1.00 3.41 H new ATOM 0 HG21 ILE A 903 12.818 -13.818 -3.932 1.00 44.44 H new ATOM 0 HG22 ILE A 903 11.540 -13.077 -2.939 1.00 44.44 H new ATOM 0 HG23 ILE A 903 13.220 -13.107 -2.351 1.00 44.44 H new ATOM 0 HD11 ILE A 903 15.232 -16.187 -3.435 1.00 73.25 H new ATOM 0 HD12 ILE A 903 13.829 -15.628 -4.377 1.00 73.25 H new ATOM 0 HD13 ILE A 903 14.693 -14.496 -3.309 1.00 73.25 H new ATOM 192 N THR A 904 10.747 -16.933 -0.176 1.00 53.00 N ATOM 193 CA THR A 904 10.659 -18.187 0.553 1.00 73.13 C ATOM 194 C THR A 904 9.987 -19.258 -0.309 1.00 24.41 C ATOM 195 O THR A 904 9.261 -18.939 -1.248 1.00 74.14 O ATOM 196 CB THR A 904 9.926 -17.919 1.869 1.00 42.32 C ATOM 197 OG1 THR A 904 10.206 -16.550 2.149 1.00 51.21 O ATOM 198 CG2 THR A 904 10.544 -18.674 3.047 1.00 11.03 C ATOM 0 H THR A 904 9.990 -16.772 -0.840 1.00 53.00 H new ATOM 0 HA THR A 904 11.649 -18.577 0.789 1.00 73.13 H new ATOM 0 HB THR A 904 8.879 -18.202 1.766 1.00 42.32 H new ATOM 0 HG1 THR A 904 9.767 -16.291 2.986 1.00 51.21 H new ATOM 0 HG21 THR A 904 9.986 -18.449 3.956 1.00 11.03 H new ATOM 0 HG22 THR A 904 10.505 -19.746 2.853 1.00 11.03 H new ATOM 0 HG23 THR A 904 11.582 -18.366 3.172 1.00 11.03 H new ATOM 206 N PHE A 905 10.255 -20.508 0.042 1.00 11.30 N ATOM 207 CA PHE A 905 9.686 -21.628 -0.687 1.00 71.14 C ATOM 208 C PHE A 905 8.480 -22.209 0.054 1.00 62.51 C ATOM 209 O PHE A 905 8.493 -22.318 1.279 1.00 3.41 O ATOM 210 CB PHE A 905 10.775 -22.698 -0.784 1.00 32.42 C ATOM 211 CG PHE A 905 12.090 -22.196 -1.383 1.00 51.11 C ATOM 212 CD1 PHE A 905 12.145 -20.970 -1.970 1.00 62.20 C ATOM 213 CD2 PHE A 905 13.203 -22.975 -1.329 1.00 44.20 C ATOM 214 CE1 PHE A 905 13.366 -20.504 -2.526 1.00 54.13 C ATOM 215 CE2 PHE A 905 14.424 -22.508 -1.885 1.00 72.53 C ATOM 216 CZ PHE A 905 14.479 -21.283 -2.472 1.00 42.22 C ATOM 0 H PHE A 905 10.859 -20.769 0.822 1.00 11.30 H new ATOM 0 HA PHE A 905 9.350 -21.300 -1.671 1.00 71.14 H new ATOM 0 HB2 PHE A 905 10.970 -23.095 0.212 1.00 32.42 H new ATOM 0 HB3 PHE A 905 10.404 -23.525 -1.390 1.00 32.42 H new ATOM 0 HD1 PHE A 905 11.261 -20.351 -2.013 1.00 62.20 H new ATOM 0 HD2 PHE A 905 13.159 -23.949 -0.864 1.00 44.20 H new ATOM 0 HE1 PHE A 905 13.410 -19.531 -2.992 1.00 54.13 H new ATOM 0 HE2 PHE A 905 15.309 -23.126 -1.841 1.00 72.53 H new ATOM 0 HZ PHE A 905 15.407 -20.929 -2.896 1.00 42.22 H new ATOM 226 N LEU A 906 7.467 -22.568 -0.720 1.00 73.53 N ATOM 227 CA LEU A 906 6.256 -23.136 -0.152 1.00 74.05 C ATOM 228 C LEU A 906 5.848 -24.369 -0.961 1.00 75.03 C ATOM 229 O LEU A 906 6.458 -24.720 -1.971 1.00 14.51 O ATOM 230 CB LEU A 906 5.159 -22.073 -0.057 1.00 5.13 C ATOM 231 CG LEU A 906 5.632 -20.646 0.226 1.00 4.51 C ATOM 232 CD1 LEU A 906 4.669 -19.620 -0.374 1.00 11.31 C ATOM 233 CD2 LEU A 906 5.844 -20.425 1.725 1.00 12.12 C ATOM 0 H LEU A 906 7.460 -22.477 -1.736 1.00 73.53 H new ATOM 0 HA LEU A 906 6.435 -23.469 0.870 1.00 74.05 H new ATOM 0 HB2 LEU A 906 4.601 -22.071 -0.993 1.00 5.13 H new ATOM 0 HB3 LEU A 906 4.463 -22.367 0.729 1.00 5.13 H new ATOM 0 HG LEU A 906 6.597 -20.504 -0.260 1.00 4.51 H new ATOM 0 HD11 LEU A 906 5.029 -18.614 -0.158 1.00 11.31 H new ATOM 0 HD12 LEU A 906 4.613 -19.762 -1.453 1.00 11.31 H new ATOM 0 HD13 LEU A 906 3.679 -19.752 0.062 1.00 11.31 H new ATOM 0 HD21 LEU A 906 6.180 -19.403 1.898 1.00 12.12 H new ATOM 0 HD22 LEU A 906 4.906 -20.593 2.254 1.00 12.12 H new ATOM 0 HD23 LEU A 906 6.597 -21.122 2.093 1.00 12.12 H new ATOM 245 N CYS A 907 4.791 -25.025 -0.491 1.00 23.22 N ATOM 246 CA CYS A 907 4.278 -26.221 -1.148 1.00 44.02 C ATOM 247 C CYS A 907 3.249 -25.857 -2.215 1.00 23.44 C ATOM 248 O CYS A 907 2.290 -25.151 -1.909 1.00 33.22 O ATOM 249 CB CYS A 907 3.652 -27.165 -0.120 1.00 52.22 C ATOM 250 SG CYS A 907 2.962 -28.691 -0.837 1.00 34.33 S ATOM 0 H CYS A 907 4.273 -24.748 0.343 1.00 23.22 H new ATOM 0 HA CYS A 907 5.114 -26.726 -1.632 1.00 44.02 H new ATOM 0 HB2 CYS A 907 4.407 -27.432 0.619 1.00 52.22 H new ATOM 0 HB3 CYS A 907 2.861 -26.635 0.410 1.00 52.22 H new ATOM 0 HG CYS A 907 3.537 -29.724 -0.295 1.00 34.33 H new ATOM 255 N LYS A 908 3.469 -26.341 -3.428 1.00 54.14 N ATOM 256 CA LYS A 908 2.555 -26.059 -4.523 1.00 2.23 C ATOM 257 C LYS A 908 1.143 -26.494 -4.127 1.00 53.22 C ATOM 258 O LYS A 908 0.230 -25.672 -4.069 1.00 55.24 O ATOM 259 CB LYS A 908 3.056 -26.701 -5.818 1.00 4.21 C ATOM 260 CG LYS A 908 1.959 -26.712 -6.884 1.00 63.34 C ATOM 261 CD LYS A 908 2.555 -26.556 -8.285 1.00 73.01 C ATOM 262 CE LYS A 908 2.729 -27.917 -8.962 1.00 31.22 C ATOM 263 NZ LYS A 908 1.412 -28.551 -9.197 1.00 24.31 N ATOM 0 H LYS A 908 4.266 -26.926 -3.677 1.00 54.14 H new ATOM 0 HA LYS A 908 2.516 -24.988 -4.720 1.00 2.23 H new ATOM 0 HB2 LYS A 908 3.922 -26.153 -6.188 1.00 4.21 H new ATOM 0 HB3 LYS A 908 3.385 -27.721 -5.619 1.00 4.21 H new ATOM 0 HG2 LYS A 908 1.399 -27.645 -6.825 1.00 63.34 H new ATOM 0 HG3 LYS A 908 1.253 -25.904 -6.693 1.00 63.34 H new ATOM 0 HD2 LYS A 908 1.906 -25.924 -8.892 1.00 73.01 H new ATOM 0 HD3 LYS A 908 3.520 -26.052 -8.220 1.00 73.01 H new ATOM 0 HE2 LYS A 908 3.254 -27.794 -9.909 1.00 31.22 H new ATOM 0 HE3 LYS A 908 3.345 -28.564 -8.338 1.00 31.22 H new ATOM 0 HZ1 LYS A 908 1.458 -29.141 -10.052 1.00 24.31 H new ATOM 0 HZ2 LYS A 908 1.161 -29.144 -8.380 1.00 24.31 H new ATOM 0 HZ3 LYS A 908 0.690 -27.814 -9.324 1.00 24.31 H new ATOM 276 N ASN A 909 1.007 -27.785 -3.865 1.00 63.51 N ATOM 277 CA ASN A 909 -0.279 -28.340 -3.477 1.00 5.43 C ATOM 278 C ASN A 909 -0.921 -27.435 -2.423 1.00 74.32 C ATOM 279 O ASN A 909 -2.034 -26.947 -2.615 1.00 2.52 O ATOM 280 CB ASN A 909 -0.116 -29.734 -2.868 1.00 12.43 C ATOM 281 CG ASN A 909 -0.214 -30.817 -3.944 1.00 13.14 C ATOM 282 OD1 ASN A 909 -0.013 -30.577 -5.123 1.00 23.12 O ATOM 283 ND2 ASN A 909 -0.534 -32.019 -3.473 1.00 74.04 N ATOM 0 H ASN A 909 1.767 -28.464 -3.914 1.00 63.51 H new ATOM 0 HA ASN A 909 -0.901 -28.408 -4.369 1.00 5.43 H new ATOM 0 HB2 ASN A 909 0.848 -29.804 -2.363 1.00 12.43 H new ATOM 0 HB3 ASN A 909 -0.884 -29.897 -2.112 1.00 12.43 H new ATOM 0 HD21 ASN A 909 -0.625 -32.809 -4.111 1.00 74.04 H new ATOM 0 HD22 ASN A 909 -0.689 -32.150 -2.473 1.00 74.04 H new ATOM 290 N CYS A 910 -0.194 -27.240 -1.333 1.00 64.14 N ATOM 291 CA CYS A 910 -0.679 -26.403 -0.249 1.00 61.23 C ATOM 292 C CYS A 910 -0.020 -25.028 -0.372 1.00 54.24 C ATOM 293 O CYS A 910 -0.417 -24.218 -1.209 1.00 73.32 O ATOM 294 CB CYS A 910 -0.419 -27.040 1.117 1.00 24.42 C ATOM 295 SG CYS A 910 -1.298 -28.618 1.408 1.00 33.41 S ATOM 0 H CYS A 910 0.728 -27.648 -1.177 1.00 64.14 H new ATOM 0 HA CYS A 910 -1.761 -26.295 -0.326 1.00 61.23 H new ATOM 0 HB2 CYS A 910 0.652 -27.212 1.224 1.00 24.42 H new ATOM 0 HB3 CYS A 910 -0.707 -26.331 1.893 1.00 24.42 H new ATOM 300 N SER A 911 0.975 -24.806 0.474 1.00 52.45 N ATOM 301 CA SER A 911 1.692 -23.542 0.470 1.00 62.01 C ATOM 302 C SER A 911 2.325 -23.296 1.841 1.00 45.12 C ATOM 303 O SER A 911 2.299 -22.176 2.349 1.00 34.10 O ATOM 304 CB SER A 911 0.765 -22.383 0.098 1.00 71.42 C ATOM 305 OG SER A 911 0.756 -22.136 -1.306 1.00 31.34 O ATOM 0 H SER A 911 1.302 -25.480 1.167 1.00 52.45 H new ATOM 0 HA SER A 911 2.479 -23.598 -0.282 1.00 62.01 H new ATOM 0 HB2 SER A 911 -0.248 -22.607 0.433 1.00 71.42 H new ATOM 0 HB3 SER A 911 1.083 -21.482 0.623 1.00 71.42 H new ATOM 0 HG SER A 911 0.485 -22.950 -1.780 1.00 31.34 H new ATOM 311 N VAL A 912 2.880 -24.361 2.400 1.00 5.14 N ATOM 312 CA VAL A 912 3.520 -24.275 3.703 1.00 55.44 C ATOM 313 C VAL A 912 5.010 -23.981 3.516 1.00 34.42 C ATOM 314 O VAL A 912 5.681 -24.640 2.724 1.00 62.32 O ATOM 315 CB VAL A 912 3.257 -25.554 4.500 1.00 42.20 C ATOM 316 CG1 VAL A 912 1.841 -26.075 4.250 1.00 14.20 C ATOM 317 CG2 VAL A 912 4.301 -26.625 4.177 1.00 74.13 C ATOM 0 H VAL A 912 2.900 -25.288 1.975 1.00 5.14 H new ATOM 0 HA VAL A 912 3.098 -23.455 4.283 1.00 55.44 H new ATOM 0 HB VAL A 912 3.342 -25.312 5.559 1.00 42.20 H new ATOM 0 HG11 VAL A 912 1.681 -26.985 4.829 1.00 14.20 H new ATOM 0 HG12 VAL A 912 1.116 -25.319 4.554 1.00 14.20 H new ATOM 0 HG13 VAL A 912 1.715 -26.293 3.189 1.00 14.20 H new ATOM 0 HG21 VAL A 912 4.091 -27.524 4.757 1.00 74.13 H new ATOM 0 HG22 VAL A 912 4.263 -26.862 3.114 1.00 74.13 H new ATOM 0 HG23 VAL A 912 5.294 -26.253 4.430 1.00 74.13 H new ATOM 327 N LEU A 913 5.483 -22.992 4.259 1.00 12.05 N ATOM 328 CA LEU A 913 6.881 -22.603 4.186 1.00 30.41 C ATOM 329 C LEU A 913 7.759 -23.800 4.557 1.00 34.51 C ATOM 330 O LEU A 913 7.829 -24.185 5.723 1.00 30.52 O ATOM 331 CB LEU A 913 7.138 -21.363 5.044 1.00 21.02 C ATOM 332 CG LEU A 913 8.585 -20.868 5.090 1.00 11.44 C ATOM 333 CD1 LEU A 913 9.323 -21.442 6.301 1.00 33.12 C ATOM 334 CD2 LEU A 913 9.311 -21.173 3.779 1.00 42.22 C ATOM 0 H LEU A 913 4.923 -22.448 4.915 1.00 12.05 H new ATOM 0 HA LEU A 913 7.144 -22.317 3.167 1.00 30.41 H new ATOM 0 HB2 LEU A 913 6.509 -20.553 4.674 1.00 21.02 H new ATOM 0 HB3 LEU A 913 6.815 -21.577 6.063 1.00 21.02 H new ATOM 0 HG LEU A 913 8.571 -19.784 5.206 1.00 11.44 H new ATOM 0 HD11 LEU A 913 10.349 -21.074 6.310 1.00 33.12 H new ATOM 0 HD12 LEU A 913 8.818 -21.131 7.216 1.00 33.12 H new ATOM 0 HD13 LEU A 913 9.328 -22.530 6.242 1.00 33.12 H new ATOM 0 HD21 LEU A 913 10.337 -20.811 3.839 1.00 42.22 H new ATOM 0 HD22 LEU A 913 9.316 -22.249 3.608 1.00 42.22 H new ATOM 0 HD23 LEU A 913 8.798 -20.677 2.955 1.00 42.22 H new ATOM 346 N ALA A 914 8.406 -24.356 3.543 1.00 11.21 N ATOM 347 CA ALA A 914 9.276 -25.501 3.748 1.00 61.30 C ATOM 348 C ALA A 914 10.682 -25.012 4.099 1.00 3.54 C ATOM 349 O ALA A 914 11.380 -25.637 4.896 1.00 65.23 O ATOM 350 CB ALA A 914 9.261 -26.384 2.498 1.00 3.23 C ATOM 0 H ALA A 914 8.345 -24.034 2.577 1.00 11.21 H new ATOM 0 HA ALA A 914 8.921 -26.108 4.581 1.00 61.30 H new ATOM 0 HB1 ALA A 914 9.914 -27.243 2.652 1.00 3.23 H new ATOM 0 HB2 ALA A 914 8.245 -26.730 2.309 1.00 3.23 H new ATOM 0 HB3 ALA A 914 9.614 -25.809 1.642 1.00 3.23 H new ATOM 356 N CYS A 915 11.056 -23.897 3.488 1.00 22.11 N ATOM 357 CA CYS A 915 12.367 -23.316 3.726 1.00 34.24 C ATOM 358 C CYS A 915 12.485 -22.040 2.891 1.00 3.23 C ATOM 359 O CYS A 915 11.738 -21.849 1.933 1.00 60.00 O ATOM 360 CB CYS A 915 13.490 -24.308 3.416 1.00 13.21 C ATOM 361 SG CYS A 915 14.116 -25.050 4.967 1.00 13.24 S ATOM 0 H CYS A 915 10.474 -23.380 2.828 1.00 22.11 H new ATOM 0 HA CYS A 915 12.472 -23.069 4.782 1.00 34.24 H new ATOM 0 HB2 CYS A 915 13.122 -25.090 2.752 1.00 13.21 H new ATOM 0 HB3 CYS A 915 14.301 -23.800 2.893 1.00 13.21 H new ATOM 0 HG CYS A 915 13.130 -25.594 5.616 1.00 13.24 H new ATOM 367 N SER A 916 13.430 -21.199 3.285 1.00 1.32 N ATOM 368 CA SER A 916 13.656 -19.946 2.585 1.00 42.21 C ATOM 369 C SER A 916 14.913 -20.050 1.719 1.00 4.21 C ATOM 370 O SER A 916 15.777 -20.889 1.970 1.00 33.21 O ATOM 371 CB SER A 916 13.784 -18.781 3.568 1.00 13.41 C ATOM 372 OG SER A 916 15.050 -18.769 4.221 1.00 22.43 O ATOM 0 H SER A 916 14.048 -21.361 4.080 1.00 1.32 H new ATOM 0 HA SER A 916 12.796 -19.752 1.944 1.00 42.21 H new ATOM 0 HB2 SER A 916 13.642 -17.840 3.036 1.00 13.41 H new ATOM 0 HB3 SER A 916 12.992 -18.848 4.314 1.00 13.41 H new ATOM 0 HG SER A 916 14.921 -18.878 5.186 1.00 22.43 H new ATOM 378 N GLY A 917 14.977 -19.185 0.718 1.00 54.33 N ATOM 379 CA GLY A 917 16.114 -19.169 -0.187 1.00 12.53 C ATOM 380 C GLY A 917 17.432 -19.132 0.590 1.00 54.41 C ATOM 381 O GLY A 917 18.320 -19.949 0.352 1.00 53.42 O ATOM 0 H GLY A 917 14.260 -18.490 0.513 1.00 54.33 H new ATOM 0 HA2 GLY A 917 16.088 -20.053 -0.825 1.00 12.53 H new ATOM 0 HA3 GLY A 917 16.050 -18.301 -0.843 1.00 12.53 H new ATOM 385 N GLU A 918 17.517 -18.175 1.503 1.00 72.31 N ATOM 386 CA GLU A 918 18.711 -18.021 2.316 1.00 22.10 C ATOM 387 C GLU A 918 18.962 -19.288 3.136 1.00 22.21 C ATOM 388 O GLU A 918 20.098 -19.572 3.514 1.00 72.52 O ATOM 389 CB GLU A 918 18.602 -16.794 3.223 1.00 44.31 C ATOM 390 CG GLU A 918 17.459 -16.953 4.227 1.00 22.51 C ATOM 391 CD GLU A 918 17.761 -16.203 5.526 1.00 65.12 C ATOM 392 OE1 GLU A 918 18.568 -15.261 5.524 1.00 31.23 O ATOM 393 OE2 GLU A 918 17.124 -16.629 6.563 1.00 74.41 O ATOM 0 H GLU A 918 16.778 -17.499 1.697 1.00 72.31 H new ATOM 0 HA GLU A 918 19.562 -17.867 1.652 1.00 22.10 H new ATOM 0 HB2 GLU A 918 19.541 -16.647 3.756 1.00 44.31 H new ATOM 0 HB3 GLU A 918 18.437 -15.903 2.617 1.00 44.31 H new ATOM 0 HG2 GLU A 918 16.533 -16.576 3.792 1.00 22.51 H new ATOM 0 HG3 GLU A 918 17.303 -18.010 4.441 1.00 22.51 H new ATOM 401 N ASP A 919 17.884 -20.015 3.387 1.00 33.53 N ATOM 402 CA ASP A 919 17.973 -21.246 4.156 1.00 52.53 C ATOM 403 C ASP A 919 18.152 -22.427 3.200 1.00 54.10 C ATOM 404 O ASP A 919 17.750 -23.547 3.510 1.00 33.32 O ATOM 405 CB ASP A 919 16.697 -21.482 4.966 1.00 20.23 C ATOM 406 CG ASP A 919 16.892 -22.267 6.265 1.00 63.31 C ATOM 407 OD1 ASP A 919 18.008 -22.702 6.587 1.00 42.40 O ATOM 408 OD2 ASP A 919 15.824 -22.430 6.970 1.00 40.15 O ATOM 0 H ASP A 919 16.944 -19.776 3.072 1.00 33.53 H new ATOM 0 HA ASP A 919 18.821 -21.159 4.836 1.00 52.53 H new ATOM 0 HB2 ASP A 919 16.253 -20.516 5.206 1.00 20.23 H new ATOM 0 HB3 ASP A 919 15.981 -22.015 4.341 1.00 20.23 H new ATOM 414 N ILE A 920 18.755 -22.136 2.057 1.00 40.01 N ATOM 415 CA ILE A 920 18.992 -23.160 1.054 1.00 70.31 C ATOM 416 C ILE A 920 20.436 -23.058 0.558 1.00 72.00 C ATOM 417 O ILE A 920 21.009 -21.970 0.524 1.00 75.02 O ATOM 418 CB ILE A 920 17.950 -23.068 -0.063 1.00 1.12 C ATOM 419 CG1 ILE A 920 16.535 -23.250 0.491 1.00 64.42 C ATOM 420 CG2 ILE A 920 18.259 -24.061 -1.185 1.00 23.34 C ATOM 421 CD1 ILE A 920 16.062 -24.695 0.320 1.00 60.22 C ATOM 0 H ILE A 920 19.087 -21.205 1.803 1.00 40.01 H new ATOM 0 HA ILE A 920 18.873 -24.153 1.488 1.00 70.31 H new ATOM 0 HB ILE A 920 18.000 -22.069 -0.496 1.00 1.12 H new ATOM 0 HG12 ILE A 920 16.516 -22.980 1.547 1.00 64.42 H new ATOM 0 HG13 ILE A 920 15.850 -22.576 -0.023 1.00 64.42 H new ATOM 0 HG21 ILE A 920 17.503 -23.975 -1.966 1.00 23.34 H new ATOM 0 HG22 ILE A 920 19.241 -23.842 -1.605 1.00 23.34 H new ATOM 0 HG23 ILE A 920 18.253 -25.075 -0.785 1.00 23.34 H new ATOM 0 HD11 ILE A 920 15.054 -24.798 0.722 1.00 60.22 H new ATOM 0 HD12 ILE A 920 16.059 -24.954 -0.739 1.00 60.22 H new ATOM 0 HD13 ILE A 920 16.736 -25.364 0.855 1.00 60.22 H new ATOM 433 N HIS A 921 20.983 -24.206 0.186 1.00 54.01 N ATOM 434 CA HIS A 921 22.349 -24.259 -0.307 1.00 34.44 C ATOM 435 C HIS A 921 22.356 -24.781 -1.745 1.00 55.30 C ATOM 436 O HIS A 921 21.422 -25.462 -2.167 1.00 24.33 O ATOM 437 CB HIS A 921 23.231 -25.088 0.629 1.00 63.13 C ATOM 438 CG HIS A 921 23.684 -24.346 1.863 1.00 4.13 C ATOM 439 ND1 HIS A 921 23.438 -24.804 3.146 1.00 44.11 N ATOM 440 CD2 HIS A 921 24.371 -23.175 1.998 1.00 53.15 C ATOM 441 CE1 HIS A 921 23.957 -23.939 4.005 1.00 32.24 C ATOM 442 NE2 HIS A 921 24.534 -22.930 3.292 1.00 53.02 N ATOM 0 H HIS A 921 20.505 -25.107 0.216 1.00 54.01 H new ATOM 0 HA HIS A 921 22.775 -23.256 -0.320 1.00 34.44 H new ATOM 0 HB2 HIS A 921 22.682 -25.979 0.934 1.00 63.13 H new ATOM 0 HB3 HIS A 921 24.109 -25.427 0.079 1.00 63.13 H new ATOM 0 HD2 HIS A 921 24.723 -22.553 1.189 1.00 53.15 H new ATOM 0 HE1 HIS A 921 23.928 -24.019 5.082 1.00 32.24 H new ATOM 0 HE2 HIS A 921 25.012 -22.121 3.688 1.00 53.02 H new ATOM 450 N VAL A 922 23.419 -24.440 -2.459 1.00 34.23 N ATOM 451 CA VAL A 922 23.559 -24.865 -3.841 1.00 64.30 C ATOM 452 C VAL A 922 24.867 -25.643 -4.000 1.00 44.11 C ATOM 453 O VAL A 922 25.748 -25.566 -3.144 1.00 54.14 O ATOM 454 CB VAL A 922 23.466 -23.655 -4.773 1.00 23.23 C ATOM 455 CG1 VAL A 922 23.797 -24.046 -6.214 1.00 61.53 C ATOM 456 CG2 VAL A 922 22.086 -23.001 -4.685 1.00 41.20 C ATOM 0 H VAL A 922 24.191 -23.874 -2.106 1.00 34.23 H new ATOM 0 HA VAL A 922 22.746 -25.535 -4.119 1.00 64.30 H new ATOM 0 HB VAL A 922 24.205 -22.923 -4.447 1.00 23.23 H new ATOM 0 HG11 VAL A 922 23.723 -23.168 -6.855 1.00 61.53 H new ATOM 0 HG12 VAL A 922 24.811 -24.444 -6.259 1.00 61.53 H new ATOM 0 HG13 VAL A 922 23.093 -24.805 -6.556 1.00 61.53 H new ATOM 0 HG21 VAL A 922 22.046 -22.144 -5.357 1.00 41.20 H new ATOM 0 HG22 VAL A 922 21.322 -23.723 -4.973 1.00 41.20 H new ATOM 0 HG23 VAL A 922 21.905 -22.669 -3.663 1.00 41.20 H new ATOM 573 N VAL A 929 20.314 -28.661 -3.377 1.00 24.10 N ATOM 574 CA VAL A 929 20.153 -29.510 -2.209 1.00 33.11 C ATOM 575 C VAL A 929 19.769 -28.647 -1.006 1.00 14.34 C ATOM 576 O VAL A 929 20.350 -27.585 -0.788 1.00 41.21 O ATOM 577 CB VAL A 929 21.425 -30.328 -1.976 1.00 53.02 C ATOM 578 CG1 VAL A 929 21.516 -31.492 -2.965 1.00 24.12 C ATOM 579 CG2 VAL A 929 22.669 -29.441 -2.056 1.00 71.21 C ATOM 0 HA VAL A 929 19.347 -30.226 -2.366 1.00 33.11 H new ATOM 0 HB VAL A 929 21.376 -30.746 -0.970 1.00 53.02 H new ATOM 0 HG11 VAL A 929 22.429 -32.058 -2.778 1.00 24.12 H new ATOM 0 HG12 VAL A 929 20.652 -32.145 -2.839 1.00 24.12 H new ATOM 0 HG13 VAL A 929 21.532 -31.104 -3.983 1.00 24.12 H new ATOM 0 HG21 VAL A 929 23.559 -30.047 -1.887 1.00 71.21 H new ATOM 0 HG22 VAL A 929 22.725 -28.981 -3.043 1.00 71.21 H new ATOM 0 HG23 VAL A 929 22.610 -28.662 -1.296 1.00 71.21 H new ATOM 589 N ASN A 930 18.792 -29.135 -0.255 1.00 52.32 N ATOM 590 CA ASN A 930 18.323 -28.421 0.921 1.00 43.05 C ATOM 591 C ASN A 930 18.925 -29.060 2.173 1.00 25.14 C ATOM 592 O ASN A 930 18.398 -30.046 2.686 1.00 23.12 O ATOM 593 CB ASN A 930 16.800 -28.494 1.038 1.00 13.13 C ATOM 594 CG ASN A 930 16.282 -27.501 2.081 1.00 41.34 C ATOM 595 OD1 ASN A 930 16.799 -26.408 2.245 1.00 53.43 O ATOM 596 ND2 ASN A 930 15.236 -27.940 2.774 1.00 74.12 N ATOM 0 H ASN A 930 18.312 -30.016 -0.438 1.00 52.32 H new ATOM 0 HA ASN A 930 18.628 -27.379 0.827 1.00 43.05 H new ATOM 0 HB2 ASN A 930 16.347 -28.280 0.070 1.00 13.13 H new ATOM 0 HB3 ASN A 930 16.501 -29.505 1.313 1.00 13.13 H new ATOM 0 HD21 ASN A 930 14.817 -27.351 3.494 1.00 74.12 H new ATOM 0 HD22 ASN A 930 14.852 -28.866 2.586 1.00 74.12 H new ATOM 603 N MET A 931 20.021 -28.472 2.630 1.00 25.42 N ATOM 604 CA MET A 931 20.701 -28.972 3.813 1.00 21.14 C ATOM 605 C MET A 931 20.052 -28.430 5.089 1.00 71.25 C ATOM 606 O MET A 931 20.744 -27.962 5.991 1.00 41.20 O ATOM 607 CB MET A 931 22.172 -28.554 3.772 1.00 63.20 C ATOM 608 CG MET A 931 23.021 -29.607 3.057 1.00 64.21 C ATOM 609 SD MET A 931 24.735 -29.431 3.526 1.00 34.42 S ATOM 610 CE MET A 931 25.388 -30.968 2.895 1.00 31.25 C ATOM 0 H MET A 931 20.455 -27.654 2.202 1.00 25.42 H new ATOM 0 HA MET A 931 20.623 -30.059 3.821 1.00 21.14 H new ATOM 0 HB2 MET A 931 22.268 -27.596 3.261 1.00 63.20 H new ATOM 0 HB3 MET A 931 22.542 -28.412 4.787 1.00 63.20 H new ATOM 0 HG2 MET A 931 22.667 -30.606 3.311 1.00 64.21 H new ATOM 0 HG3 MET A 931 22.918 -29.498 1.977 1.00 64.21 H new ATOM 0 HE1 MET A 931 26.456 -31.023 3.104 1.00 31.25 H new ATOM 0 HE2 MET A 931 24.881 -31.804 3.377 1.00 31.25 H new ATOM 0 HE3 MET A 931 25.226 -31.017 1.818 1.00 31.25 H new ATOM 620 N THR A 932 18.730 -28.512 5.122 1.00 30.12 N ATOM 621 CA THR A 932 17.980 -28.036 6.272 1.00 53.22 C ATOM 622 C THR A 932 17.502 -29.214 7.122 1.00 32.33 C ATOM 623 O THR A 932 16.837 -30.119 6.619 1.00 0.50 O ATOM 624 CB THR A 932 16.839 -27.154 5.760 1.00 70.15 C ATOM 625 OG1 THR A 932 17.360 -26.569 4.569 1.00 21.03 O ATOM 626 CG2 THR A 932 16.567 -25.958 6.674 1.00 30.34 C ATOM 0 H THR A 932 18.159 -28.901 4.371 1.00 30.12 H new ATOM 0 HA THR A 932 18.606 -27.434 6.930 1.00 53.22 H new ATOM 0 HB THR A 932 15.933 -27.752 5.666 1.00 70.15 H new ATOM 0 HG1 THR A 932 16.620 -26.271 4.000 1.00 21.03 H new ATOM 0 HG21 THR A 932 15.749 -25.366 6.264 1.00 30.34 H new ATOM 0 HG22 THR A 932 16.295 -26.314 7.668 1.00 30.34 H new ATOM 0 HG23 THR A 932 17.463 -25.341 6.742 1.00 30.34 H new ATOM 634 N PRO A 933 17.869 -29.165 8.431 1.00 52.31 N ATOM 635 CA PRO A 933 17.485 -30.217 9.356 1.00 31.12 C ATOM 636 C PRO A 933 16.006 -30.105 9.731 1.00 73.21 C ATOM 637 O PRO A 933 15.292 -31.106 9.760 1.00 75.21 O ATOM 638 CB PRO A 933 18.414 -30.051 10.548 1.00 72.31 C ATOM 639 CG PRO A 933 18.965 -28.638 10.453 1.00 23.00 C ATOM 640 CD PRO A 933 18.656 -28.109 9.062 1.00 70.41 C ATOM 0 HA PRO A 933 17.585 -31.213 8.925 1.00 31.12 H new ATOM 0 HB2 PRO A 933 17.877 -30.199 11.485 1.00 72.31 H new ATOM 0 HB3 PRO A 933 19.218 -30.786 10.522 1.00 72.31 H new ATOM 0 HG2 PRO A 933 18.513 -28.000 11.213 1.00 23.00 H new ATOM 0 HG3 PRO A 933 20.040 -28.635 10.632 1.00 23.00 H new ATOM 0 HD2 PRO A 933 18.098 -27.174 9.109 1.00 70.41 H new ATOM 0 HD3 PRO A 933 19.570 -27.908 8.503 1.00 70.41 H new ATOM 648 N GLU A 934 15.590 -28.878 10.008 1.00 33.23 N ATOM 649 CA GLU A 934 14.208 -28.622 10.380 1.00 64.42 C ATOM 650 C GLU A 934 13.267 -29.058 9.255 1.00 11.21 C ATOM 651 O GLU A 934 12.112 -29.401 9.505 1.00 5.11 O ATOM 652 CB GLU A 934 13.999 -27.148 10.730 1.00 10.12 C ATOM 653 CG GLU A 934 14.142 -26.264 9.490 1.00 55.14 C ATOM 654 CD GLU A 934 14.598 -24.854 9.870 1.00 31.14 C ATOM 655 OE1 GLU A 934 15.772 -24.654 10.215 1.00 63.51 O ATOM 656 OE2 GLU A 934 13.684 -23.947 9.798 1.00 14.21 O ATOM 0 H GLU A 934 16.185 -28.050 9.982 1.00 33.23 H new ATOM 0 HA GLU A 934 13.976 -29.208 11.269 1.00 64.42 H new ATOM 0 HB2 GLU A 934 13.010 -27.011 11.166 1.00 10.12 H new ATOM 0 HB3 GLU A 934 14.725 -26.843 11.484 1.00 10.12 H new ATOM 0 HG2 GLU A 934 14.861 -26.710 8.803 1.00 55.14 H new ATOM 0 HG3 GLU A 934 13.189 -26.212 8.964 1.00 55.14 H new ATOM 664 N PHE A 935 13.795 -29.030 8.040 1.00 0.43 N ATOM 665 CA PHE A 935 13.016 -29.417 6.876 1.00 21.05 C ATOM 666 C PHE A 935 12.751 -30.924 6.871 1.00 15.23 C ATOM 667 O PHE A 935 11.839 -31.395 6.193 1.00 15.34 O ATOM 668 CB PHE A 935 13.844 -29.053 5.643 1.00 43.13 C ATOM 669 CG PHE A 935 13.256 -29.563 4.326 1.00 53.24 C ATOM 670 CD1 PHE A 935 12.198 -28.921 3.760 1.00 64.43 C ATOM 671 CD2 PHE A 935 13.790 -30.658 3.721 1.00 40.53 C ATOM 672 CE1 PHE A 935 11.652 -29.395 2.537 1.00 3.53 C ATOM 673 CE2 PHE A 935 13.244 -31.131 2.498 1.00 11.33 C ATOM 674 CZ PHE A 935 12.187 -30.489 1.932 1.00 34.24 C ATOM 0 H PHE A 935 14.753 -28.745 7.836 1.00 0.43 H new ATOM 0 HA PHE A 935 12.053 -28.906 6.885 1.00 21.05 H new ATOM 0 HB2 PHE A 935 13.941 -27.969 5.590 1.00 43.13 H new ATOM 0 HB3 PHE A 935 14.849 -29.457 5.761 1.00 43.13 H new ATOM 0 HD1 PHE A 935 11.774 -28.052 4.240 1.00 64.43 H new ATOM 0 HD2 PHE A 935 14.629 -31.168 4.171 1.00 40.53 H new ATOM 0 HE1 PHE A 935 10.812 -28.886 2.088 1.00 3.53 H new ATOM 0 HE2 PHE A 935 13.668 -32.000 2.018 1.00 11.33 H new ATOM 0 HZ PHE A 935 11.772 -30.848 1.002 1.00 34.24 H new ATOM 684 N LYS A 936 13.564 -31.638 7.635 1.00 32.41 N ATOM 685 CA LYS A 936 13.428 -33.082 7.727 1.00 21.21 C ATOM 686 C LYS A 936 12.094 -33.423 8.395 1.00 63.23 C ATOM 687 O LYS A 936 11.620 -34.554 8.299 1.00 15.12 O ATOM 688 CB LYS A 936 14.642 -33.691 8.432 1.00 1.52 C ATOM 689 CG LYS A 936 14.397 -33.815 9.937 1.00 14.33 C ATOM 690 CD LYS A 936 15.670 -34.249 10.666 1.00 34.34 C ATOM 691 CE LYS A 936 16.515 -33.037 11.063 1.00 20.42 C ATOM 692 NZ LYS A 936 17.583 -33.437 12.007 1.00 50.03 N ATOM 0 H LYS A 936 14.319 -31.244 8.196 1.00 32.41 H new ATOM 0 HA LYS A 936 13.410 -33.527 6.732 1.00 21.21 H new ATOM 0 HB2 LYS A 936 14.855 -34.674 8.012 1.00 1.52 H new ATOM 0 HB3 LYS A 936 15.520 -33.071 8.253 1.00 1.52 H new ATOM 0 HG2 LYS A 936 14.055 -32.859 10.333 1.00 14.33 H new ATOM 0 HG3 LYS A 936 13.603 -34.539 10.121 1.00 14.33 H new ATOM 0 HD2 LYS A 936 15.407 -34.820 11.556 1.00 34.34 H new ATOM 0 HD3 LYS A 936 16.254 -34.909 10.024 1.00 34.34 H new ATOM 0 HE2 LYS A 936 16.957 -32.587 10.174 1.00 20.42 H new ATOM 0 HE3 LYS A 936 15.881 -32.279 11.522 1.00 20.42 H new ATOM 0 HZ1 LYS A 936 18.147 -32.603 12.266 1.00 50.03 H new ATOM 0 HZ2 LYS A 936 17.155 -33.845 12.862 1.00 50.03 H new ATOM 0 HZ3 LYS A 936 18.198 -34.144 11.556 1.00 50.03 H new ATOM 705 N GLU A 937 11.528 -32.425 9.056 1.00 54.32 N ATOM 706 CA GLU A 937 10.258 -32.605 9.739 1.00 11.30 C ATOM 707 C GLU A 937 9.130 -31.938 8.948 1.00 24.12 C ATOM 708 O GLU A 937 7.986 -31.909 9.397 1.00 13.44 O ATOM 709 CB GLU A 937 10.322 -32.060 11.167 1.00 31.24 C ATOM 710 CG GLU A 937 11.724 -32.229 11.756 1.00 10.12 C ATOM 711 CD GLU A 937 11.657 -32.534 13.254 1.00 35.00 C ATOM 712 OE1 GLU A 937 11.938 -33.668 13.669 1.00 20.10 O ATOM 713 OE2 GLU A 937 11.297 -31.542 13.997 1.00 63.32 O ATOM 0 H GLU A 937 11.925 -31.489 9.133 1.00 54.32 H new ATOM 0 HA GLU A 937 10.049 -33.673 9.801 1.00 11.30 H new ATOM 0 HB2 GLU A 937 10.047 -31.005 11.170 1.00 31.24 H new ATOM 0 HB3 GLU A 937 9.596 -32.581 11.792 1.00 31.24 H new ATOM 0 HG2 GLU A 937 12.244 -33.036 11.240 1.00 10.12 H new ATOM 0 HG3 GLU A 937 12.303 -31.320 11.592 1.00 10.12 H new ATOM 721 N LEU A 938 9.493 -31.420 7.784 1.00 4.54 N ATOM 722 CA LEU A 938 8.527 -30.755 6.927 1.00 74.32 C ATOM 723 C LEU A 938 8.256 -31.628 5.699 1.00 11.44 C ATOM 724 O LEU A 938 7.309 -31.380 4.954 1.00 22.11 O ATOM 725 CB LEU A 938 8.998 -29.340 6.584 1.00 35.50 C ATOM 726 CG LEU A 938 9.549 -28.516 7.749 1.00 25.51 C ATOM 727 CD1 LEU A 938 10.134 -27.192 7.255 1.00 4.12 C ATOM 728 CD2 LEU A 938 8.483 -28.306 8.826 1.00 72.13 C ATOM 0 H LEU A 938 10.443 -31.448 7.414 1.00 4.54 H new ATOM 0 HA LEU A 938 7.577 -30.632 7.448 1.00 74.32 H new ATOM 0 HB2 LEU A 938 9.770 -29.411 5.818 1.00 35.50 H new ATOM 0 HB3 LEU A 938 8.162 -28.797 6.144 1.00 35.50 H new ATOM 0 HG LEU A 938 10.363 -29.076 8.208 1.00 25.51 H new ATOM 0 HD11 LEU A 938 10.519 -26.625 8.103 1.00 4.12 H new ATOM 0 HD12 LEU A 938 10.944 -27.391 6.554 1.00 4.12 H new ATOM 0 HD13 LEU A 938 9.356 -26.614 6.756 1.00 4.12 H new ATOM 0 HD21 LEU A 938 8.902 -27.717 9.642 1.00 72.13 H new ATOM 0 HD22 LEU A 938 7.632 -27.778 8.397 1.00 72.13 H new ATOM 0 HD23 LEU A 938 8.155 -29.273 9.207 1.00 72.13 H new ATOM 740 N TYR A 939 9.104 -32.631 5.527 1.00 2.33 N ATOM 741 CA TYR A 939 8.968 -33.541 4.403 1.00 24.21 C ATOM 742 C TYR A 939 8.923 -34.995 4.877 1.00 33.14 C ATOM 743 O TYR A 939 9.528 -35.340 5.891 1.00 70.40 O ATOM 744 CB TYR A 939 10.216 -33.337 3.542 1.00 64.10 C ATOM 745 CG TYR A 939 11.367 -34.287 3.879 1.00 3.15 C ATOM 746 CD1 TYR A 939 11.237 -35.640 3.644 1.00 71.43 C ATOM 747 CD2 TYR A 939 12.536 -33.790 4.420 1.00 62.22 C ATOM 748 CE1 TYR A 939 12.320 -36.534 3.961 1.00 21.43 C ATOM 749 CE2 TYR A 939 13.620 -34.684 4.738 1.00 75.25 C ATOM 750 CZ TYR A 939 13.458 -36.012 4.493 1.00 70.24 C ATOM 751 OH TYR A 939 14.481 -36.856 4.793 1.00 61.44 O ATOM 0 H TYR A 939 9.888 -32.833 6.147 1.00 2.33 H new ATOM 0 HA TYR A 939 8.046 -33.341 3.857 1.00 24.21 H new ATOM 0 HB2 TYR A 939 9.947 -33.467 2.494 1.00 64.10 H new ATOM 0 HB3 TYR A 939 10.561 -32.309 3.658 1.00 64.10 H new ATOM 0 HD1 TYR A 939 10.322 -36.029 3.222 1.00 71.43 H new ATOM 0 HD2 TYR A 939 12.638 -32.731 4.605 1.00 62.22 H new ATOM 0 HE1 TYR A 939 12.231 -37.595 3.781 1.00 21.43 H new ATOM 0 HE2 TYR A 939 14.540 -34.308 5.161 1.00 75.25 H new ATOM 0 HH TYR A 939 15.229 -36.344 5.164 1.00 61.44 H new ATOM 761 N ILE A 940 8.199 -35.808 4.122 1.00 61.12 N ATOM 762 CA ILE A 940 8.067 -37.217 4.452 1.00 14.13 C ATOM 763 C ILE A 940 8.482 -38.061 3.245 1.00 1.44 C ATOM 764 O ILE A 940 8.102 -37.762 2.114 1.00 3.23 O ATOM 765 CB ILE A 940 6.654 -37.518 4.956 1.00 32.43 C ATOM 766 CG1 ILE A 940 6.055 -36.304 5.668 1.00 53.51 C ATOM 767 CG2 ILE A 940 6.642 -38.765 5.843 1.00 65.30 C ATOM 768 CD1 ILE A 940 4.656 -36.616 6.202 1.00 35.14 C ATOM 0 H ILE A 940 7.698 -35.518 3.283 1.00 61.12 H new ATOM 0 HA ILE A 940 8.736 -37.481 5.271 1.00 14.13 H new ATOM 0 HB ILE A 940 6.022 -37.730 4.093 1.00 32.43 H new ATOM 0 HG12 ILE A 940 6.704 -36.004 6.491 1.00 53.51 H new ATOM 0 HG13 ILE A 940 6.005 -35.461 4.978 1.00 53.51 H new ATOM 0 HG21 ILE A 940 5.626 -38.956 6.188 1.00 65.30 H new ATOM 0 HG22 ILE A 940 6.999 -39.622 5.271 1.00 65.30 H new ATOM 0 HG23 ILE A 940 7.293 -38.606 6.703 1.00 65.30 H new ATOM 0 HD11 ILE A 940 4.253 -35.736 6.704 1.00 35.14 H new ATOM 0 HD12 ILE A 940 4.004 -36.892 5.374 1.00 35.14 H new ATOM 0 HD13 ILE A 940 4.713 -37.443 6.910 1.00 35.14 H new ATOM 780 N VAL A 941 9.256 -39.098 3.527 1.00 4.05 N ATOM 781 CA VAL A 941 9.728 -39.987 2.479 1.00 34.12 C ATOM 782 C VAL A 941 8.835 -41.229 2.430 1.00 1.23 C ATOM 783 O VAL A 941 8.621 -41.884 3.449 1.00 72.22 O ATOM 784 CB VAL A 941 11.204 -40.321 2.700 1.00 3.35 C ATOM 785 CG1 VAL A 941 11.538 -41.715 2.165 1.00 14.34 C ATOM 786 CG2 VAL A 941 12.107 -39.260 2.067 1.00 11.12 C ATOM 0 H VAL A 941 9.568 -39.343 4.467 1.00 4.05 H new ATOM 0 HA VAL A 941 9.662 -39.499 1.506 1.00 34.12 H new ATOM 0 HB VAL A 941 11.389 -40.322 3.774 1.00 3.35 H new ATOM 0 HG11 VAL A 941 12.594 -41.927 2.335 1.00 14.34 H new ATOM 0 HG12 VAL A 941 10.931 -42.458 2.682 1.00 14.34 H new ATOM 0 HG13 VAL A 941 11.328 -41.755 1.096 1.00 14.34 H new ATOM 0 HG21 VAL A 941 13.151 -39.521 2.239 1.00 11.12 H new ATOM 0 HG22 VAL A 941 11.916 -39.213 0.995 1.00 11.12 H new ATOM 0 HG23 VAL A 941 11.898 -38.289 2.516 1.00 11.12 H new ATOM 796 N ARG A 942 8.338 -41.515 1.236 1.00 45.33 N ATOM 797 CA ARG A 942 7.474 -42.666 1.041 1.00 70.24 C ATOM 798 C ARG A 942 8.232 -43.784 0.321 1.00 4.44 C ATOM 799 O ARG A 942 8.732 -43.587 -0.786 1.00 34.05 O ATOM 800 CB ARG A 942 6.235 -42.293 0.224 1.00 1.32 C ATOM 801 CG ARG A 942 5.066 -41.922 1.140 1.00 65.23 C ATOM 802 CD ARG A 942 5.503 -40.916 2.207 1.00 64.43 C ATOM 803 NE ARG A 942 5.917 -41.630 3.436 1.00 41.14 N ATOM 804 CZ ARG A 942 5.087 -42.379 4.192 1.00 72.13 C ATOM 805 NH1 ARG A 942 3.788 -42.519 3.850 1.00 22.12 N ATOM 806 NH2 ARG A 942 5.564 -42.973 5.270 1.00 13.51 N ATOM 0 H ARG A 942 8.517 -40.969 0.393 1.00 45.33 H new ATOM 0 HA ARG A 942 7.157 -43.012 2.025 1.00 70.24 H new ATOM 0 HB2 ARG A 942 6.467 -41.455 -0.433 1.00 1.32 H new ATOM 0 HB3 ARG A 942 5.950 -43.129 -0.414 1.00 1.32 H new ATOM 0 HG2 ARG A 942 4.255 -41.499 0.547 1.00 65.23 H new ATOM 0 HG3 ARG A 942 4.676 -42.820 1.620 1.00 65.23 H new ATOM 0 HD2 ARG A 942 6.329 -40.311 1.832 1.00 64.43 H new ATOM 0 HD3 ARG A 942 4.684 -40.233 2.432 1.00 64.43 H new ATOM 0 HE ARG A 942 6.891 -41.551 3.730 1.00 41.14 H new ATOM 0 HH11 ARG A 942 3.428 -42.057 3.015 1.00 22.12 H new ATOM 0 HH12 ARG A 942 3.167 -43.087 4.427 1.00 22.12 H new ATOM 0 HH21 ARG A 942 6.546 -42.862 5.521 1.00 13.51 H new ATOM 0 HH22 ARG A 942 4.950 -43.543 5.852 1.00 13.51 H new ATOM 819 N GLU A 943 8.295 -44.932 0.980 1.00 51.43 N ATOM 820 CA GLU A 943 8.984 -46.080 0.417 1.00 60.51 C ATOM 821 C GLU A 943 8.648 -46.226 -1.069 1.00 13.05 C ATOM 822 O GLU A 943 7.556 -46.670 -1.421 1.00 21.32 O ATOM 823 CB GLU A 943 8.638 -47.358 1.185 1.00 2.40 C ATOM 824 CG GLU A 943 9.326 -48.575 0.563 1.00 2.33 C ATOM 825 CD GLU A 943 8.770 -49.876 1.146 1.00 43.31 C ATOM 826 OE1 GLU A 943 7.554 -50.110 1.091 1.00 12.51 O ATOM 827 OE2 GLU A 943 9.652 -50.659 1.669 1.00 34.10 O ATOM 0 H GLU A 943 7.880 -45.091 1.898 1.00 51.43 H new ATOM 0 HA GLU A 943 10.057 -45.917 0.512 1.00 60.51 H new ATOM 0 HB2 GLU A 943 8.944 -47.255 2.226 1.00 2.40 H new ATOM 0 HB3 GLU A 943 7.558 -47.506 1.184 1.00 2.40 H new ATOM 0 HG2 GLU A 943 9.182 -48.566 -0.517 1.00 2.33 H new ATOM 0 HG3 GLU A 943 10.400 -48.521 0.742 1.00 2.33 H new ATOM 835 N ASN A 944 9.606 -45.843 -1.900 1.00 33.13 N ATOM 836 CA ASN A 944 9.425 -45.925 -3.339 1.00 73.31 C ATOM 837 C ASN A 944 10.793 -46.040 -4.015 1.00 54.40 C ATOM 838 O ASN A 944 11.606 -45.120 -3.937 1.00 61.34 O ATOM 839 CB ASN A 944 8.733 -44.672 -3.880 1.00 25.22 C ATOM 840 CG ASN A 944 8.665 -44.700 -5.408 1.00 51.10 C ATOM 841 OD1 ASN A 944 7.648 -45.016 -6.004 1.00 23.20 O ATOM 842 ND2 ASN A 944 9.800 -44.352 -6.007 1.00 23.21 N ATOM 0 H ASN A 944 10.510 -45.475 -1.604 1.00 33.13 H new ATOM 0 HA ASN A 944 8.807 -46.798 -3.552 1.00 73.31 H new ATOM 0 HB2 ASN A 944 7.726 -44.602 -3.469 1.00 25.22 H new ATOM 0 HB3 ASN A 944 9.273 -43.784 -3.553 1.00 25.22 H new ATOM 0 HD21 ASN A 944 9.856 -44.338 -7.025 1.00 23.21 H new ATOM 0 HD22 ASN A 944 10.615 -44.099 -5.448 1.00 23.21 H new ATOM 849 N LYS A 945 11.004 -47.176 -4.663 1.00 12.11 N ATOM 850 CA LYS A 945 12.259 -47.422 -5.352 1.00 21.31 C ATOM 851 C LYS A 945 12.149 -46.929 -6.796 1.00 14.00 C ATOM 852 O LYS A 945 13.138 -46.911 -7.527 1.00 12.52 O ATOM 853 CB LYS A 945 12.655 -48.896 -5.234 1.00 12.41 C ATOM 854 CG LYS A 945 11.526 -49.807 -5.720 1.00 63.14 C ATOM 855 CD LYS A 945 12.066 -51.181 -6.123 1.00 21.04 C ATOM 856 CE LYS A 945 12.835 -51.103 -7.443 1.00 4.22 C ATOM 857 NZ LYS A 945 13.210 -52.458 -7.906 1.00 12.24 N ATOM 0 H LYS A 945 10.327 -47.936 -4.725 1.00 12.11 H new ATOM 0 HA LYS A 945 13.067 -46.860 -4.884 1.00 21.31 H new ATOM 0 HB2 LYS A 945 13.555 -49.082 -5.820 1.00 12.41 H new ATOM 0 HB3 LYS A 945 12.895 -49.130 -4.197 1.00 12.41 H new ATOM 0 HG2 LYS A 945 10.781 -49.922 -4.932 1.00 63.14 H new ATOM 0 HG3 LYS A 945 11.022 -49.346 -6.570 1.00 63.14 H new ATOM 0 HD2 LYS A 945 12.720 -51.563 -5.339 1.00 21.04 H new ATOM 0 HD3 LYS A 945 11.240 -51.886 -6.220 1.00 21.04 H new ATOM 0 HE2 LYS A 945 12.223 -50.611 -8.199 1.00 4.22 H new ATOM 0 HE3 LYS A 945 13.731 -50.496 -7.313 1.00 4.22 H new ATOM 0 HZ1 LYS A 945 13.731 -52.386 -8.803 1.00 12.24 H new ATOM 0 HZ2 LYS A 945 13.812 -52.915 -7.191 1.00 12.24 H new ATOM 0 HZ3 LYS A 945 12.351 -53.026 -8.049 1.00 12.24 H new ATOM 870 N ALA A 946 10.936 -46.541 -7.164 1.00 23.20 N ATOM 871 CA ALA A 946 10.684 -46.049 -8.508 1.00 33.04 C ATOM 872 C ALA A 946 11.425 -44.726 -8.709 1.00 14.40 C ATOM 873 O ALA A 946 11.506 -44.220 -9.827 1.00 42.31 O ATOM 874 CB ALA A 946 9.176 -45.912 -8.726 1.00 74.11 C ATOM 0 H ALA A 946 10.118 -46.557 -6.555 1.00 23.20 H new ATOM 0 HA ALA A 946 11.059 -46.753 -9.252 1.00 33.04 H new ATOM 0 HB1 ALA A 946 8.986 -45.543 -9.734 1.00 74.11 H new ATOM 0 HB2 ALA A 946 8.700 -46.885 -8.600 1.00 74.11 H new ATOM 0 HB3 ALA A 946 8.766 -45.211 -8.000 1.00 74.11 H new ATOM 880 N LEU A 947 11.946 -44.203 -7.609 1.00 11.31 N ATOM 881 CA LEU A 947 12.677 -42.948 -7.651 1.00 3.15 C ATOM 882 C LEU A 947 14.175 -43.231 -7.519 1.00 1.03 C ATOM 883 O LEU A 947 14.956 -42.882 -8.402 1.00 65.12 O ATOM 884 CB LEU A 947 12.139 -41.979 -6.596 1.00 4.13 C ATOM 885 CG LEU A 947 11.033 -41.029 -7.059 1.00 70.24 C ATOM 886 CD1 LEU A 947 11.362 -40.432 -8.429 1.00 13.42 C ATOM 887 CD2 LEU A 947 9.672 -41.728 -7.051 1.00 13.54 C ATOM 0 H LEU A 947 11.876 -44.625 -6.683 1.00 11.31 H new ATOM 0 HA LEU A 947 12.529 -42.453 -8.611 1.00 3.15 H new ATOM 0 HB2 LEU A 947 11.762 -42.561 -5.755 1.00 4.13 H new ATOM 0 HB3 LEU A 947 12.971 -41.382 -6.222 1.00 4.13 H new ATOM 0 HG LEU A 947 10.975 -40.201 -6.352 1.00 70.24 H new ATOM 0 HD11 LEU A 947 10.560 -39.760 -8.735 1.00 13.42 H new ATOM 0 HD12 LEU A 947 12.298 -39.876 -8.368 1.00 13.42 H new ATOM 0 HD13 LEU A 947 11.463 -41.234 -9.161 1.00 13.42 H new ATOM 0 HD21 LEU A 947 8.903 -41.031 -7.384 1.00 13.54 H new ATOM 0 HD22 LEU A 947 9.700 -42.586 -7.723 1.00 13.54 H new ATOM 0 HD23 LEU A 947 9.442 -42.066 -6.040 1.00 13.54 H new ATOM 899 N GLN A 948 14.530 -43.861 -6.409 1.00 3.25 N ATOM 900 CA GLN A 948 15.921 -44.195 -6.150 1.00 15.34 C ATOM 901 C GLN A 948 16.352 -45.379 -7.017 1.00 45.43 C ATOM 902 O GLN A 948 15.554 -46.272 -7.297 1.00 4.15 O ATOM 903 CB GLN A 948 16.146 -44.491 -4.666 1.00 20.42 C ATOM 904 CG GLN A 948 15.921 -45.974 -4.363 1.00 22.23 C ATOM 905 CD GLN A 948 17.253 -46.704 -4.178 1.00 22.03 C ATOM 906 OE1 GLN A 948 17.370 -47.655 -3.422 1.00 51.11 O ATOM 907 NE2 GLN A 948 18.248 -46.208 -4.908 1.00 0.33 N ATOM 0 H GLN A 948 13.879 -44.149 -5.679 1.00 3.25 H new ATOM 0 HA GLN A 948 16.537 -43.335 -6.412 1.00 15.34 H new ATOM 0 HB2 GLN A 948 17.160 -44.208 -4.385 1.00 20.42 H new ATOM 0 HB3 GLN A 948 15.468 -43.886 -4.064 1.00 20.42 H new ATOM 0 HG2 GLN A 948 15.317 -46.077 -3.461 1.00 22.23 H new ATOM 0 HG3 GLN A 948 15.360 -46.434 -5.176 1.00 22.23 H new ATOM 0 HE21 GLN A 948 18.082 -45.410 -5.521 1.00 0.33 H new ATOM 0 HE22 GLN A 948 19.177 -46.626 -4.855 1.00 0.33 H new ATOM 1013 N GLN A 955 23.036 -41.648 -4.947 1.00 32.11 N ATOM 1014 CA GLN A 955 22.123 -42.624 -4.377 1.00 31.51 C ATOM 1015 C GLN A 955 20.945 -41.919 -3.703 1.00 34.15 C ATOM 1016 O GLN A 955 21.138 -40.990 -2.920 1.00 41.44 O ATOM 1017 CB GLN A 955 22.848 -43.544 -3.392 1.00 42.32 C ATOM 1018 CG GLN A 955 21.853 -44.262 -2.478 1.00 4.31 C ATOM 1019 CD GLN A 955 20.949 -45.200 -3.281 1.00 4.55 C ATOM 1020 OE1 GLN A 955 21.053 -45.318 -4.490 1.00 73.44 O ATOM 1021 NE2 GLN A 955 20.060 -45.857 -2.542 1.00 20.02 N ATOM 0 HA GLN A 955 21.736 -43.245 -5.185 1.00 31.51 H new ATOM 0 HB2 GLN A 955 23.438 -44.278 -3.941 1.00 42.32 H new ATOM 0 HB3 GLN A 955 23.545 -42.961 -2.790 1.00 42.32 H new ATOM 0 HG2 GLN A 955 22.394 -44.831 -1.722 1.00 4.31 H new ATOM 0 HG3 GLN A 955 21.244 -43.528 -1.950 1.00 4.31 H new ATOM 0 HE21 GLN A 955 20.028 -45.711 -1.533 1.00 20.02 H new ATOM 0 HE22 GLN A 955 19.410 -46.507 -2.984 1.00 20.02 H new ATOM 1030 N ILE A 956 19.749 -42.388 -4.030 1.00 45.20 N ATOM 1031 CA ILE A 956 18.540 -41.814 -3.466 1.00 11.53 C ATOM 1032 C ILE A 956 17.949 -42.785 -2.442 1.00 52.11 C ATOM 1033 O ILE A 956 18.233 -43.981 -2.480 1.00 20.11 O ATOM 1034 CB ILE A 956 17.564 -41.422 -4.577 1.00 12.22 C ATOM 1035 CG1 ILE A 956 18.310 -41.090 -5.871 1.00 3.25 C ATOM 1036 CG2 ILE A 956 16.655 -40.275 -4.129 1.00 71.32 C ATOM 1037 CD1 ILE A 956 19.061 -39.763 -5.745 1.00 44.21 C ATOM 0 H ILE A 956 19.592 -43.159 -4.679 1.00 45.20 H new ATOM 0 HA ILE A 956 18.769 -40.890 -2.934 1.00 11.53 H new ATOM 0 HB ILE A 956 16.923 -42.278 -4.786 1.00 12.22 H new ATOM 0 HG12 ILE A 956 19.013 -41.889 -6.105 1.00 3.25 H new ATOM 0 HG13 ILE A 956 17.603 -41.035 -6.699 1.00 3.25 H new ATOM 0 HG21 ILE A 956 15.971 -40.016 -4.937 1.00 71.32 H new ATOM 0 HG22 ILE A 956 16.083 -40.585 -3.255 1.00 71.32 H new ATOM 0 HG23 ILE A 956 17.263 -39.407 -3.876 1.00 71.32 H new ATOM 0 HD11 ILE A 956 19.583 -39.550 -6.678 1.00 44.21 H new ATOM 0 HD12 ILE A 956 18.352 -38.962 -5.535 1.00 44.21 H new ATOM 0 HD13 ILE A 956 19.784 -39.830 -4.932 1.00 44.21 H new ATOM 1049 N ASN A 957 17.137 -42.234 -1.551 1.00 61.33 N ATOM 1050 CA ASN A 957 16.503 -43.037 -0.519 1.00 65.22 C ATOM 1051 C ASN A 957 15.034 -43.259 -0.882 1.00 53.20 C ATOM 1052 O ASN A 957 14.423 -44.233 -0.444 1.00 53.54 O ATOM 1053 CB ASN A 957 16.554 -42.331 0.837 1.00 43.31 C ATOM 1054 CG ASN A 957 17.801 -42.742 1.623 1.00 12.00 C ATOM 1055 OD1 ASN A 957 17.844 -43.774 2.272 1.00 5.03 O ATOM 1056 ND2 ASN A 957 18.809 -41.880 1.529 1.00 52.44 N ATOM 0 H ASN A 957 16.904 -41.241 -1.523 1.00 61.33 H new ATOM 0 HA ASN A 957 17.038 -43.984 -0.452 1.00 65.22 H new ATOM 0 HB2 ASN A 957 16.553 -41.251 0.689 1.00 43.31 H new ATOM 0 HB3 ASN A 957 15.661 -42.575 1.412 1.00 43.31 H new ATOM 0 HD21 ASN A 957 19.685 -42.064 2.018 1.00 52.44 H new ATOM 0 HD22 ASN A 957 18.706 -41.034 0.968 1.00 52.44 H new ATOM 1063 N GLY A 958 14.509 -42.339 -1.678 1.00 72.23 N ATOM 1064 CA GLY A 958 13.122 -42.422 -2.105 1.00 2.11 C ATOM 1065 C GLY A 958 12.636 -41.078 -2.652 1.00 34.25 C ATOM 1066 O GLY A 958 13.385 -40.368 -3.319 1.00 42.44 O ATOM 0 H GLY A 958 15.019 -41.532 -2.039 1.00 72.23 H new ATOM 0 HA2 GLY A 958 13.019 -43.190 -2.872 1.00 2.11 H new ATOM 0 HA3 GLY A 958 12.497 -42.725 -1.265 1.00 2.11 H new ATOM 1070 N GLU A 959 11.383 -40.771 -2.347 1.00 43.55 N ATOM 1071 CA GLU A 959 10.788 -39.525 -2.800 1.00 12.31 C ATOM 1072 C GLU A 959 10.293 -38.708 -1.605 1.00 34.25 C ATOM 1073 O GLU A 959 9.658 -39.248 -0.699 1.00 64.14 O ATOM 1074 CB GLU A 959 9.653 -39.788 -3.792 1.00 1.11 C ATOM 1075 CG GLU A 959 9.422 -38.575 -4.695 1.00 50.30 C ATOM 1076 CD GLU A 959 7.980 -38.539 -5.207 1.00 5.23 C ATOM 1077 OE1 GLU A 959 7.627 -37.657 -6.004 1.00 3.25 O ATOM 1078 OE2 GLU A 959 7.216 -39.471 -4.748 1.00 13.10 O ATOM 0 H GLU A 959 10.764 -41.363 -1.792 1.00 43.55 H new ATOM 0 HA GLU A 959 11.553 -38.947 -3.319 1.00 12.31 H new ATOM 0 HB2 GLU A 959 9.893 -40.659 -4.402 1.00 1.11 H new ATOM 0 HB3 GLU A 959 8.737 -40.021 -3.249 1.00 1.11 H new ATOM 0 HG2 GLU A 959 9.639 -37.660 -4.144 1.00 50.30 H new ATOM 0 HG3 GLU A 959 10.111 -38.609 -5.539 1.00 50.30 H new ATOM 1086 N ILE A 960 10.601 -37.420 -1.640 1.00 21.11 N ATOM 1087 CA ILE A 960 10.195 -36.524 -0.571 1.00 3.24 C ATOM 1088 C ILE A 960 8.886 -35.835 -0.958 1.00 55.53 C ATOM 1089 O ILE A 960 8.768 -35.289 -2.055 1.00 34.35 O ATOM 1090 CB ILE A 960 11.325 -35.550 -0.230 1.00 23.10 C ATOM 1091 CG1 ILE A 960 11.866 -34.875 -1.492 1.00 3.11 C ATOM 1092 CG2 ILE A 960 12.430 -36.249 0.565 1.00 42.02 C ATOM 1093 CD1 ILE A 960 12.497 -33.521 -1.162 1.00 1.34 C ATOM 0 H ILE A 960 11.127 -36.975 -2.392 1.00 21.11 H new ATOM 0 HA ILE A 960 10.002 -37.085 0.343 1.00 3.24 H new ATOM 0 HB ILE A 960 10.918 -34.764 0.407 1.00 23.10 H new ATOM 0 HG12 ILE A 960 12.607 -35.520 -1.965 1.00 3.11 H new ATOM 0 HG13 ILE A 960 11.058 -34.738 -2.210 1.00 3.11 H new ATOM 0 HG21 ILE A 960 13.221 -35.535 0.794 1.00 42.02 H new ATOM 0 HG22 ILE A 960 12.017 -36.643 1.493 1.00 42.02 H new ATOM 0 HG23 ILE A 960 12.841 -37.068 -0.026 1.00 42.02 H new ATOM 0 HD11 ILE A 960 12.874 -33.063 -2.076 1.00 1.34 H new ATOM 0 HD12 ILE A 960 11.747 -32.870 -0.712 1.00 1.34 H new ATOM 0 HD13 ILE A 960 13.320 -33.664 -0.462 1.00 1.34 H new ATOM 1105 N ILE A 961 7.934 -35.881 -0.037 1.00 62.42 N ATOM 1106 CA ILE A 961 6.637 -35.268 -0.269 1.00 24.21 C ATOM 1107 C ILE A 961 6.249 -34.431 0.951 1.00 34.24 C ATOM 1108 O ILE A 961 6.615 -34.762 2.078 1.00 61.30 O ATOM 1109 CB ILE A 961 5.601 -36.331 -0.641 1.00 43.45 C ATOM 1110 CG1 ILE A 961 5.574 -37.457 0.394 1.00 42.21 C ATOM 1111 CG2 ILE A 961 5.842 -36.859 -2.057 1.00 4.10 C ATOM 1112 CD1 ILE A 961 4.463 -38.461 0.083 1.00 54.03 C ATOM 0 H ILE A 961 8.035 -36.333 0.872 1.00 62.42 H new ATOM 0 HA ILE A 961 6.683 -34.589 -1.121 1.00 24.21 H new ATOM 0 HB ILE A 961 4.616 -35.865 -0.634 1.00 43.45 H new ATOM 0 HG12 ILE A 961 6.537 -37.967 0.407 1.00 42.21 H new ATOM 0 HG13 ILE A 961 5.422 -37.038 1.389 1.00 42.21 H new ATOM 0 HG21 ILE A 961 5.092 -37.613 -2.297 1.00 4.10 H new ATOM 0 HG22 ILE A 961 5.770 -36.037 -2.769 1.00 4.10 H new ATOM 0 HG23 ILE A 961 6.835 -37.304 -2.115 1.00 4.10 H new ATOM 0 HD11 ILE A 961 4.466 -39.251 0.834 1.00 54.03 H new ATOM 0 HD12 ILE A 961 3.499 -37.952 0.095 1.00 54.03 H new ATOM 0 HD13 ILE A 961 4.631 -38.896 -0.902 1.00 54.03 H new ATOM 1124 N CYS A 962 5.511 -33.363 0.686 1.00 43.12 N ATOM 1125 CA CYS A 962 5.069 -32.476 1.748 1.00 32.03 C ATOM 1126 C CYS A 962 4.100 -33.248 2.646 1.00 12.10 C ATOM 1127 O CYS A 962 3.894 -34.446 2.458 1.00 51.14 O ATOM 1128 CB CYS A 962 4.437 -31.198 1.192 1.00 31.41 C ATOM 1129 SG CYS A 962 2.633 -31.298 0.901 1.00 60.31 S ATOM 0 H CYS A 962 5.208 -33.092 -0.250 1.00 43.12 H new ATOM 0 HA CYS A 962 5.928 -32.152 2.336 1.00 32.03 H new ATOM 0 HB2 CYS A 962 4.634 -30.380 1.885 1.00 31.41 H new ATOM 0 HB3 CYS A 962 4.929 -30.945 0.253 1.00 31.41 H new ATOM 0 HG CYS A 962 2.232 -30.223 0.289 1.00 60.31 H new ATOM 1134 N LYS A 963 3.530 -32.530 3.603 1.00 64.00 N ATOM 1135 CA LYS A 963 2.588 -33.133 4.530 1.00 10.44 C ATOM 1136 C LYS A 963 1.406 -33.708 3.748 1.00 53.43 C ATOM 1137 O LYS A 963 1.051 -34.873 3.919 1.00 64.04 O ATOM 1138 CB LYS A 963 2.181 -32.127 5.609 1.00 34.13 C ATOM 1139 CG LYS A 963 3.395 -31.350 6.122 1.00 63.54 C ATOM 1140 CD LYS A 963 4.579 -32.287 6.371 1.00 44.21 C ATOM 1141 CE LYS A 963 4.332 -33.169 7.596 1.00 61.31 C ATOM 1142 NZ LYS A 963 3.551 -32.434 8.616 1.00 44.44 N ATOM 0 H LYS A 963 3.703 -31.536 3.756 1.00 64.00 H new ATOM 0 HA LYS A 963 3.054 -33.964 5.060 1.00 10.44 H new ATOM 0 HB2 LYS A 963 1.445 -31.432 5.204 1.00 34.13 H new ATOM 0 HB3 LYS A 963 1.703 -32.650 6.437 1.00 34.13 H new ATOM 0 HG2 LYS A 963 3.676 -30.587 5.396 1.00 63.54 H new ATOM 0 HG3 LYS A 963 3.136 -30.832 7.045 1.00 63.54 H new ATOM 0 HD2 LYS A 963 4.742 -32.914 5.494 1.00 44.21 H new ATOM 0 HD3 LYS A 963 5.486 -31.701 6.517 1.00 44.21 H new ATOM 0 HE2 LYS A 963 3.796 -34.071 7.300 1.00 61.31 H new ATOM 0 HE3 LYS A 963 5.284 -33.488 8.019 1.00 61.31 H new ATOM 0 HZ1 LYS A 963 3.635 -32.918 9.533 1.00 44.44 H new ATOM 0 HZ2 LYS A 963 3.917 -31.464 8.702 1.00 44.44 H new ATOM 0 HZ3 LYS A 963 2.551 -32.402 8.331 1.00 44.44 H new ATOM 1155 N CYS A 964 0.828 -32.863 2.906 1.00 71.31 N ATOM 1156 CA CYS A 964 -0.307 -33.273 2.096 1.00 11.14 C ATOM 1157 C CYS A 964 0.098 -34.509 1.291 1.00 44.22 C ATOM 1158 O CYS A 964 -0.704 -35.422 1.103 1.00 63.23 O ATOM 1159 CB CYS A 964 -0.797 -32.139 1.194 1.00 42.32 C ATOM 1160 SG CYS A 964 -0.854 -30.493 1.992 1.00 0.00 S ATOM 0 H CYS A 964 1.124 -31.897 2.767 1.00 71.31 H new ATOM 0 HA CYS A 964 -1.148 -33.523 2.743 1.00 11.14 H new ATOM 0 HB2 CYS A 964 -0.147 -32.082 0.321 1.00 42.32 H new ATOM 0 HB3 CYS A 964 -1.795 -32.387 0.833 1.00 42.32 H new ATOM 1165 N GLY A 965 1.343 -34.498 0.837 1.00 40.43 N ATOM 1166 CA GLY A 965 1.865 -35.606 0.056 1.00 73.33 C ATOM 1167 C GLY A 965 2.239 -35.154 -1.357 1.00 42.51 C ATOM 1168 O GLY A 965 2.125 -35.923 -2.310 1.00 1.20 O ATOM 0 H GLY A 965 2.005 -33.739 0.995 1.00 40.43 H new ATOM 0 HA2 GLY A 965 2.741 -36.024 0.552 1.00 73.33 H new ATOM 0 HA3 GLY A 965 1.120 -36.400 0.002 1.00 73.33 H new ATOM 1172 N GLN A 966 2.679 -33.907 -1.447 1.00 55.15 N ATOM 1173 CA GLN A 966 3.070 -33.342 -2.728 1.00 25.52 C ATOM 1174 C GLN A 966 4.549 -33.623 -3.001 1.00 65.12 C ATOM 1175 O GLN A 966 5.413 -33.246 -2.211 1.00 0.32 O ATOM 1176 CB GLN A 966 2.779 -31.841 -2.778 1.00 30.44 C ATOM 1177 CG GLN A 966 3.441 -31.194 -3.996 1.00 32.41 C ATOM 1178 CD GLN A 966 2.798 -31.686 -5.295 1.00 23.25 C ATOM 1179 OE1 GLN A 966 1.859 -32.465 -5.297 1.00 22.13 O ATOM 1180 NE2 GLN A 966 3.355 -31.189 -6.396 1.00 20.35 N ATOM 0 H GLN A 966 2.773 -33.272 -0.654 1.00 55.15 H new ATOM 0 HA GLN A 966 2.478 -33.819 -3.509 1.00 25.52 H new ATOM 0 HB2 GLN A 966 1.702 -31.677 -2.815 1.00 30.44 H new ATOM 0 HB3 GLN A 966 3.143 -31.366 -1.867 1.00 30.44 H new ATOM 0 HG2 GLN A 966 3.352 -30.110 -3.930 1.00 32.41 H new ATOM 0 HG3 GLN A 966 4.506 -31.427 -4.002 1.00 32.41 H new ATOM 0 HE21 GLN A 966 4.139 -30.541 -6.323 1.00 20.35 H new ATOM 0 HE22 GLN A 966 2.998 -31.456 -7.313 1.00 20.35 H new ATOM 1189 N ALA A 967 4.796 -34.283 -4.123 1.00 61.31 N ATOM 1190 CA ALA A 967 6.156 -34.619 -4.511 1.00 13.24 C ATOM 1191 C ALA A 967 7.005 -33.346 -4.528 1.00 22.51 C ATOM 1192 O ALA A 967 7.064 -32.649 -5.539 1.00 42.13 O ATOM 1193 CB ALA A 967 6.140 -35.328 -5.866 1.00 41.03 C ATOM 0 H ALA A 967 4.077 -34.594 -4.776 1.00 61.31 H new ATOM 0 HA ALA A 967 6.603 -35.304 -3.791 1.00 13.24 H new ATOM 0 HB1 ALA A 967 7.160 -35.580 -6.157 1.00 41.03 H new ATOM 0 HB2 ALA A 967 5.548 -36.240 -5.792 1.00 41.03 H new ATOM 0 HB3 ALA A 967 5.701 -34.670 -6.616 1.00 41.03 H new ATOM 1199 N TRP A 968 7.642 -33.083 -3.396 1.00 61.14 N ATOM 1200 CA TRP A 968 8.486 -31.907 -3.269 1.00 13.12 C ATOM 1201 C TRP A 968 9.684 -32.081 -4.204 1.00 24.14 C ATOM 1202 O TRP A 968 10.082 -31.142 -4.891 1.00 13.30 O ATOM 1203 CB TRP A 968 8.892 -31.679 -1.811 1.00 63.35 C ATOM 1204 CG TRP A 968 7.946 -30.759 -1.038 1.00 33.42 C ATOM 1205 CD1 TRP A 968 6.950 -30.004 -1.522 1.00 5.00 C ATOM 1206 CD2 TRP A 968 7.946 -30.527 0.387 1.00 70.23 C ATOM 1207 NE1 TRP A 968 6.312 -29.305 -0.518 1.00 52.41 N ATOM 1208 CE2 TRP A 968 6.936 -29.633 0.679 1.00 24.14 C ATOM 1209 CE3 TRP A 968 8.772 -31.055 1.394 1.00 31.55 C ATOM 1210 CZ2 TRP A 968 6.659 -29.189 1.978 1.00 53.54 C ATOM 1211 CZ3 TRP A 968 8.481 -30.601 2.687 1.00 64.15 C ATOM 1212 CH2 TRP A 968 7.469 -29.701 2.998 1.00 72.32 C ATOM 0 H TRP A 968 7.591 -33.664 -2.559 1.00 61.14 H new ATOM 0 HA TRP A 968 7.943 -31.009 -3.564 1.00 13.12 H new ATOM 0 HB2 TRP A 968 8.941 -32.642 -1.303 1.00 63.35 H new ATOM 0 HB3 TRP A 968 9.896 -31.255 -1.786 1.00 63.35 H new ATOM 0 HD1 TRP A 968 6.681 -29.950 -2.566 1.00 5.00 H new ATOM 0 HE1 TRP A 968 5.526 -28.665 -0.633 1.00 52.41 H new ATOM 0 HE3 TRP A 968 9.568 -31.755 1.187 1.00 31.55 H new ATOM 0 HZ2 TRP A 968 5.863 -28.489 2.182 1.00 53.54 H new ATOM 0 HZ3 TRP A 968 9.086 -30.977 3.499 1.00 64.15 H new ATOM 0 HH2 TRP A 968 7.308 -29.398 4.022 1.00 72.32 H new ATOM 1223 N GLY A 969 10.227 -33.290 -4.199 1.00 10.20 N ATOM 1224 CA GLY A 969 11.372 -33.599 -5.038 1.00 62.20 C ATOM 1225 C GLY A 969 11.862 -35.028 -4.792 1.00 50.23 C ATOM 1226 O GLY A 969 11.133 -35.988 -5.035 1.00 33.21 O ATOM 0 H GLY A 969 9.895 -34.067 -3.627 1.00 10.20 H new ATOM 0 HA2 GLY A 969 11.102 -33.479 -6.087 1.00 62.20 H new ATOM 0 HA3 GLY A 969 12.178 -32.894 -4.834 1.00 62.20 H new ATOM 1230 N THR A 970 13.094 -35.123 -4.314 1.00 51.11 N ATOM 1231 CA THR A 970 13.690 -36.418 -4.033 1.00 34.11 C ATOM 1232 C THR A 970 14.778 -36.284 -2.966 1.00 62.02 C ATOM 1233 O THR A 970 15.275 -35.187 -2.715 1.00 71.04 O ATOM 1234 CB THR A 970 14.200 -37.000 -5.352 1.00 62.14 C ATOM 1235 OG1 THR A 970 14.540 -35.855 -6.129 1.00 4.54 O ATOM 1236 CG2 THR A 970 13.093 -37.681 -6.159 1.00 61.43 C ATOM 0 H THR A 970 13.696 -34.324 -4.114 1.00 51.11 H new ATOM 0 HA THR A 970 12.956 -37.110 -3.619 1.00 34.11 H new ATOM 0 HB THR A 970 14.995 -37.718 -5.148 1.00 62.14 H new ATOM 0 HG1 THR A 970 14.882 -36.142 -7.002 1.00 4.54 H new ATOM 0 HG21 THR A 970 13.509 -38.077 -7.086 1.00 61.43 H new ATOM 0 HG22 THR A 970 12.667 -38.497 -5.575 1.00 61.43 H new ATOM 0 HG23 THR A 970 12.314 -36.955 -6.392 1.00 61.43 H new ATOM 1244 N MET A 971 15.117 -37.416 -2.367 1.00 0.12 N ATOM 1245 CA MET A 971 16.138 -37.439 -1.333 1.00 13.21 C ATOM 1246 C MET A 971 17.441 -38.041 -1.862 1.00 41.42 C ATOM 1247 O MET A 971 17.612 -39.259 -1.860 1.00 44.43 O ATOM 1248 CB MET A 971 15.641 -38.263 -0.143 1.00 40.32 C ATOM 1249 CG MET A 971 16.789 -38.593 0.812 1.00 24.53 C ATOM 1250 SD MET A 971 17.646 -37.098 1.278 1.00 33.33 S ATOM 1251 CE MET A 971 16.295 -36.180 1.999 1.00 44.41 C ATOM 0 H MET A 971 14.703 -38.324 -2.578 1.00 0.12 H new ATOM 0 HA MET A 971 16.334 -36.414 -1.020 1.00 13.21 H new ATOM 0 HB2 MET A 971 14.868 -37.710 0.390 1.00 40.32 H new ATOM 0 HB3 MET A 971 15.184 -39.186 -0.500 1.00 40.32 H new ATOM 0 HG2 MET A 971 16.402 -39.092 1.700 1.00 24.53 H new ATOM 0 HG3 MET A 971 17.482 -39.285 0.335 1.00 24.53 H new ATOM 0 HE1 MET A 971 16.684 -35.295 2.502 1.00 44.41 H new ATOM 0 HE2 MET A 971 15.602 -35.876 1.215 1.00 44.41 H new ATOM 0 HE3 MET A 971 15.773 -36.808 2.721 1.00 44.41 H new ATOM 1261 N MET A 972 18.326 -37.159 -2.303 1.00 5.12 N ATOM 1262 CA MET A 972 19.609 -37.588 -2.834 1.00 41.20 C ATOM 1263 C MET A 972 20.606 -37.860 -1.706 1.00 64.20 C ATOM 1264 O MET A 972 20.478 -37.310 -0.613 1.00 63.42 O ATOM 1265 CB MET A 972 20.167 -36.504 -3.758 1.00 42.14 C ATOM 1266 CG MET A 972 19.750 -36.753 -5.209 1.00 42.33 C ATOM 1267 SD MET A 972 20.052 -35.292 -6.190 1.00 73.22 S ATOM 1268 CE MET A 972 21.609 -34.767 -5.494 1.00 22.22 C ATOM 0 H MET A 972 18.180 -36.149 -2.304 1.00 5.12 H new ATOM 0 HA MET A 972 19.459 -38.512 -3.392 1.00 41.20 H new ATOM 0 HB2 MET A 972 19.809 -35.526 -3.435 1.00 42.14 H new ATOM 0 HB3 MET A 972 21.254 -36.485 -3.687 1.00 42.14 H new ATOM 0 HG2 MET A 972 20.307 -37.596 -5.617 1.00 42.33 H new ATOM 0 HG3 MET A 972 18.694 -37.018 -5.252 1.00 42.33 H new ATOM 0 HE1 MET A 972 22.074 -34.034 -6.154 1.00 22.22 H new ATOM 0 HE2 MET A 972 21.437 -34.318 -4.516 1.00 22.22 H new ATOM 0 HE3 MET A 972 22.268 -35.628 -5.387 1.00 22.22 H new ATOM 1278 N VAL A 973 21.577 -38.709 -2.010 1.00 4.21 N ATOM 1279 CA VAL A 973 22.596 -39.061 -1.035 1.00 51.23 C ATOM 1280 C VAL A 973 23.980 -38.844 -1.650 1.00 23.22 C ATOM 1281 O VAL A 973 24.158 -38.998 -2.857 1.00 43.51 O ATOM 1282 CB VAL A 973 22.377 -40.493 -0.544 1.00 64.31 C ATOM 1283 CG1 VAL A 973 23.265 -40.800 0.664 1.00 74.00 C ATOM 1284 CG2 VAL A 973 20.903 -40.743 -0.219 1.00 42.43 C ATOM 0 H VAL A 973 21.680 -39.163 -2.917 1.00 4.21 H new ATOM 0 HA VAL A 973 22.526 -38.417 -0.158 1.00 51.23 H new ATOM 0 HB VAL A 973 22.661 -41.170 -1.350 1.00 64.31 H new ATOM 0 HG11 VAL A 973 23.090 -41.824 0.993 1.00 74.00 H new ATOM 0 HG12 VAL A 973 24.312 -40.683 0.385 1.00 74.00 H new ATOM 0 HG13 VAL A 973 23.026 -40.112 1.475 1.00 74.00 H new ATOM 0 HG21 VAL A 973 20.776 -41.769 0.128 1.00 42.43 H new ATOM 0 HG22 VAL A 973 20.580 -40.054 0.561 1.00 42.43 H new ATOM 0 HG23 VAL A 973 20.301 -40.585 -1.114 1.00 42.43 H new ATOM 1294 N HIS A 974 24.925 -38.491 -0.791 1.00 21.02 N ATOM 1295 CA HIS A 974 26.288 -38.252 -1.234 1.00 41.20 C ATOM 1296 C HIS A 974 27.268 -38.900 -0.254 1.00 12.13 C ATOM 1297 O HIS A 974 27.523 -38.361 0.822 1.00 44.31 O ATOM 1298 CB HIS A 974 26.543 -36.755 -1.424 1.00 74.23 C ATOM 1299 CG HIS A 974 27.921 -36.308 -0.999 1.00 13.40 C ATOM 1300 ND1 HIS A 974 29.049 -37.092 -1.167 1.00 53.32 N ATOM 1301 CD2 HIS A 974 28.340 -35.150 -0.412 1.00 63.02 C ATOM 1302 CE1 HIS A 974 30.094 -36.426 -0.698 1.00 61.53 C ATOM 1303 NE2 HIS A 974 29.653 -35.224 -0.230 1.00 50.44 N ATOM 0 H HIS A 974 24.774 -38.365 0.210 1.00 21.02 H new ATOM 0 HA HIS A 974 26.443 -38.715 -2.209 1.00 41.20 H new ATOM 0 HB2 HIS A 974 26.398 -36.503 -2.474 1.00 74.23 H new ATOM 0 HB3 HIS A 974 25.800 -36.195 -0.856 1.00 74.23 H new ATOM 0 HD2 HIS A 974 27.711 -34.315 -0.141 1.00 63.02 H new ATOM 0 HE1 HIS A 974 31.116 -36.774 -0.688 1.00 61.53 H new ATOM 0 HE2 HIS A 974 30.236 -34.500 0.191 1.00 50.44 H new ATOM 1311 N LYS A 975 27.790 -40.048 -0.661 1.00 14.35 N ATOM 1312 CA LYS A 975 28.736 -40.775 0.168 1.00 33.34 C ATOM 1313 C LYS A 975 28.069 -41.140 1.496 1.00 15.01 C ATOM 1314 O LYS A 975 28.750 -41.375 2.493 1.00 35.11 O ATOM 1315 CB LYS A 975 30.031 -39.977 0.330 1.00 70.12 C ATOM 1316 CG LYS A 975 30.699 -39.736 -1.026 1.00 12.25 C ATOM 1317 CD LYS A 975 31.753 -40.806 -1.316 1.00 34.41 C ATOM 1318 CE LYS A 975 32.019 -40.920 -2.818 1.00 72.52 C ATOM 1319 NZ LYS A 975 33.240 -41.718 -3.069 1.00 42.30 N ATOM 0 H LYS A 975 27.576 -40.492 -1.554 1.00 14.35 H new ATOM 0 HA LYS A 975 29.023 -41.710 -0.313 1.00 33.34 H new ATOM 0 HB2 LYS A 975 29.816 -39.022 0.809 1.00 70.12 H new ATOM 0 HB3 LYS A 975 30.715 -40.516 0.986 1.00 70.12 H new ATOM 0 HG2 LYS A 975 29.945 -39.741 -1.813 1.00 12.25 H new ATOM 0 HG3 LYS A 975 31.164 -38.750 -1.036 1.00 12.25 H new ATOM 0 HD2 LYS A 975 32.679 -40.560 -0.797 1.00 34.41 H new ATOM 0 HD3 LYS A 975 31.416 -41.768 -0.929 1.00 34.41 H new ATOM 0 HE2 LYS A 975 31.165 -41.386 -3.310 1.00 72.52 H new ATOM 0 HE3 LYS A 975 32.132 -39.926 -3.250 1.00 72.52 H new ATOM 0 HZ1 LYS A 975 33.406 -41.786 -4.093 1.00 42.30 H new ATOM 0 HZ2 LYS A 975 34.055 -41.258 -2.616 1.00 42.30 H new ATOM 0 HZ3 LYS A 975 33.118 -42.672 -2.674 1.00 42.30 H new ATOM 1332 N GLY A 976 26.744 -41.176 1.466 1.00 5.32 N ATOM 1333 CA GLY A 976 25.978 -41.508 2.655 1.00 53.20 C ATOM 1334 C GLY A 976 25.375 -40.252 3.287 1.00 12.32 C ATOM 1335 O GLY A 976 24.717 -40.329 4.324 1.00 51.33 O ATOM 0 H GLY A 976 26.182 -40.981 0.637 1.00 5.32 H new ATOM 0 HA2 GLY A 976 25.183 -42.207 2.396 1.00 53.20 H new ATOM 0 HA3 GLY A 976 26.621 -42.010 3.378 1.00 53.20 H new ATOM 1339 N LEU A 977 25.621 -39.124 2.637 1.00 72.14 N ATOM 1340 CA LEU A 977 25.110 -37.853 3.122 1.00 24.22 C ATOM 1341 C LEU A 977 23.637 -37.718 2.732 1.00 1.23 C ATOM 1342 O LEU A 977 23.137 -38.480 1.906 1.00 44.41 O ATOM 1343 CB LEU A 977 25.986 -36.700 2.628 1.00 71.13 C ATOM 1344 CG LEU A 977 25.891 -35.397 3.423 1.00 14.43 C ATOM 1345 CD1 LEU A 977 26.021 -35.660 4.925 1.00 50.03 C ATOM 1346 CD2 LEU A 977 26.918 -34.376 2.929 1.00 30.20 C ATOM 0 H LEU A 977 26.168 -39.064 1.778 1.00 72.14 H new ATOM 0 HA LEU A 977 25.156 -37.814 4.210 1.00 24.22 H new ATOM 0 HB2 LEU A 977 27.025 -37.031 2.634 1.00 71.13 H new ATOM 0 HB3 LEU A 977 25.724 -36.490 1.591 1.00 71.13 H new ATOM 0 HG LEU A 977 24.904 -34.967 3.256 1.00 14.43 H new ATOM 0 HD11 LEU A 977 25.950 -34.717 5.467 1.00 50.03 H new ATOM 0 HD12 LEU A 977 25.221 -36.326 5.248 1.00 50.03 H new ATOM 0 HD13 LEU A 977 26.985 -36.125 5.131 1.00 50.03 H new ATOM 0 HD21 LEU A 977 26.829 -33.459 3.511 1.00 30.20 H new ATOM 0 HD22 LEU A 977 27.922 -34.784 3.046 1.00 30.20 H new ATOM 0 HD23 LEU A 977 26.736 -34.157 1.877 1.00 30.20 H new ATOM 1358 N ASP A 978 22.983 -36.742 3.346 1.00 60.52 N ATOM 1359 CA ASP A 978 21.577 -36.497 3.073 1.00 31.42 C ATOM 1360 C ASP A 978 21.421 -35.125 2.415 1.00 61.11 C ATOM 1361 O ASP A 978 21.711 -34.101 3.031 1.00 44.32 O ATOM 1362 CB ASP A 978 20.757 -36.498 4.365 1.00 3.10 C ATOM 1363 CG ASP A 978 21.225 -35.502 5.428 1.00 23.01 C ATOM 1364 OD1 ASP A 978 22.190 -35.759 6.163 1.00 3.02 O ATOM 1365 OD2 ASP A 978 20.545 -34.407 5.487 1.00 63.34 O ATOM 0 H ASP A 978 23.401 -36.112 4.031 1.00 60.52 H new ATOM 0 HA ASP A 978 21.218 -37.290 2.417 1.00 31.42 H new ATOM 0 HB2 ASP A 978 19.718 -36.281 4.118 1.00 3.10 H new ATOM 0 HB3 ASP A 978 20.781 -37.501 4.792 1.00 3.10 H new ATOM 1371 N LEU A 979 20.963 -35.149 1.172 1.00 62.11 N ATOM 1372 CA LEU A 979 20.765 -33.919 0.423 1.00 23.54 C ATOM 1373 C LEU A 979 19.437 -33.996 -0.332 1.00 43.25 C ATOM 1374 O LEU A 979 19.371 -34.561 -1.423 1.00 30.33 O ATOM 1375 CB LEU A 979 21.970 -33.641 -0.477 1.00 44.32 C ATOM 1376 CG LEU A 979 23.304 -34.233 -0.016 1.00 74.22 C ATOM 1377 CD1 LEU A 979 23.464 -35.672 -0.510 1.00 32.42 C ATOM 1378 CD2 LEU A 979 24.475 -33.347 -0.444 1.00 52.33 C ATOM 0 H LEU A 979 20.723 -36.001 0.664 1.00 62.11 H new ATOM 0 HA LEU A 979 20.698 -33.067 1.099 1.00 23.54 H new ATOM 0 HB2 LEU A 979 21.750 -34.025 -1.473 1.00 44.32 H new ATOM 0 HB3 LEU A 979 22.087 -32.561 -0.570 1.00 44.32 H new ATOM 0 HG LEU A 979 23.306 -34.264 1.074 1.00 74.22 H new ATOM 0 HD11 LEU A 979 24.420 -36.070 -0.169 1.00 32.42 H new ATOM 0 HD12 LEU A 979 22.654 -36.285 -0.114 1.00 32.42 H new ATOM 0 HD13 LEU A 979 23.432 -35.688 -1.599 1.00 32.42 H new ATOM 0 HD21 LEU A 979 25.411 -33.791 -0.104 1.00 52.33 H new ATOM 0 HD22 LEU A 979 24.488 -33.261 -1.531 1.00 52.33 H new ATOM 0 HD23 LEU A 979 24.362 -32.357 -0.003 1.00 52.33 H new ATOM 1390 N PRO A 980 18.385 -33.403 0.293 1.00 42.21 N ATOM 1391 CA PRO A 980 17.063 -33.398 -0.309 1.00 33.22 C ATOM 1392 C PRO A 980 16.988 -32.394 -1.461 1.00 70.41 C ATOM 1393 O PRO A 980 17.203 -31.200 -1.263 1.00 43.33 O ATOM 1394 CB PRO A 980 16.113 -33.066 0.831 1.00 61.23 C ATOM 1395 CG PRO A 980 16.971 -32.443 1.920 1.00 51.33 C ATOM 1396 CD PRO A 980 18.427 -32.724 1.585 1.00 55.44 C ATOM 0 HA PRO A 980 16.803 -34.355 -0.761 1.00 33.22 H new ATOM 0 HB2 PRO A 980 15.336 -32.376 0.503 1.00 61.23 H new ATOM 0 HB3 PRO A 980 15.611 -33.962 1.194 1.00 61.23 H new ATOM 0 HG2 PRO A 980 16.793 -31.369 1.978 1.00 51.33 H new ATOM 0 HG3 PRO A 980 16.716 -32.862 2.893 1.00 51.33 H new ATOM 0 HD2 PRO A 980 19.006 -31.802 1.529 1.00 55.44 H new ATOM 0 HD3 PRO A 980 18.895 -33.349 2.346 1.00 55.44 H new ATOM 1404 N CYS A 981 16.682 -32.917 -2.640 1.00 1.33 N ATOM 1405 CA CYS A 981 16.576 -32.081 -3.824 1.00 21.32 C ATOM 1406 C CYS A 981 15.099 -31.757 -4.052 1.00 14.51 C ATOM 1407 O CYS A 981 14.307 -32.642 -4.370 1.00 74.30 O ATOM 1408 CB CYS A 981 17.209 -32.750 -5.046 1.00 50.50 C ATOM 1409 SG CYS A 981 18.971 -32.274 -5.177 1.00 2.01 S ATOM 0 H CYS A 981 16.504 -33.909 -2.800 1.00 1.33 H new ATOM 0 HA CYS A 981 17.130 -31.155 -3.670 1.00 21.32 H new ATOM 0 HB2 CYS A 981 17.122 -33.833 -4.964 1.00 50.50 H new ATOM 0 HB3 CYS A 981 16.676 -32.455 -5.950 1.00 50.50 H new ATOM 0 HG CYS A 981 19.619 -33.186 -5.840 1.00 2.01 H new ATOM 1415 N LEU A 982 14.772 -30.484 -3.881 1.00 10.04 N ATOM 1416 CA LEU A 982 13.403 -30.031 -4.064 1.00 24.32 C ATOM 1417 C LEU A 982 13.264 -29.388 -5.445 1.00 3.31 C ATOM 1418 O LEU A 982 14.197 -28.752 -5.934 1.00 53.01 O ATOM 1419 CB LEU A 982 12.984 -29.115 -2.913 1.00 53.40 C ATOM 1420 CG LEU A 982 13.011 -29.737 -1.516 1.00 33.14 C ATOM 1421 CD1 LEU A 982 14.360 -30.402 -1.237 1.00 43.34 C ATOM 1422 CD2 LEU A 982 12.650 -28.703 -0.447 1.00 42.45 C ATOM 0 H LEU A 982 15.432 -29.752 -3.618 1.00 10.04 H new ATOM 0 HA LEU A 982 12.714 -30.875 -4.035 1.00 24.32 H new ATOM 0 HB2 LEU A 982 13.637 -28.243 -2.913 1.00 53.40 H new ATOM 0 HB3 LEU A 982 11.974 -28.756 -3.110 1.00 53.40 H new ATOM 0 HG LEU A 982 12.252 -30.519 -1.477 1.00 33.14 H new ATOM 0 HD11 LEU A 982 14.352 -30.836 -0.237 1.00 43.34 H new ATOM 0 HD12 LEU A 982 14.538 -31.187 -1.972 1.00 43.34 H new ATOM 0 HD13 LEU A 982 15.153 -29.657 -1.303 1.00 43.34 H new ATOM 0 HD21 LEU A 982 12.677 -29.172 0.537 1.00 42.45 H new ATOM 0 HD22 LEU A 982 13.367 -27.883 -0.478 1.00 42.45 H new ATOM 0 HD23 LEU A 982 11.649 -28.317 -0.638 1.00 42.45 H new ATOM 1434 N LYS A 983 12.093 -29.575 -6.034 1.00 73.04 N ATOM 1435 CA LYS A 983 11.820 -29.021 -7.349 1.00 55.45 C ATOM 1436 C LYS A 983 10.843 -27.851 -7.212 1.00 42.32 C ATOM 1437 O LYS A 983 9.775 -27.995 -6.620 1.00 30.23 O ATOM 1438 CB LYS A 983 11.337 -30.116 -8.303 1.00 11.31 C ATOM 1439 CG LYS A 983 12.460 -31.108 -8.611 1.00 72.31 C ATOM 1440 CD LYS A 983 12.510 -32.222 -7.563 1.00 71.13 C ATOM 1441 CE LYS A 983 13.937 -32.743 -7.385 1.00 4.13 C ATOM 1442 NZ LYS A 983 14.882 -31.617 -7.208 1.00 34.02 N ATOM 0 H LYS A 983 11.322 -30.103 -5.625 1.00 73.04 H new ATOM 0 HA LYS A 983 12.734 -28.625 -7.792 1.00 55.45 H new ATOM 0 HB2 LYS A 983 10.492 -30.643 -7.859 1.00 11.31 H new ATOM 0 HB3 LYS A 983 10.981 -29.665 -9.229 1.00 11.31 H new ATOM 0 HG2 LYS A 983 12.307 -31.541 -9.600 1.00 72.31 H new ATOM 0 HG3 LYS A 983 13.416 -30.585 -8.636 1.00 72.31 H new ATOM 0 HD2 LYS A 983 12.134 -31.848 -6.611 1.00 71.13 H new ATOM 0 HD3 LYS A 983 11.855 -33.040 -7.865 1.00 71.13 H new ATOM 0 HE2 LYS A 983 13.984 -33.404 -6.520 1.00 4.13 H new ATOM 0 HE3 LYS A 983 14.226 -33.334 -8.254 1.00 4.13 H new ATOM 0 HZ1 LYS A 983 15.640 -31.685 -7.917 1.00 34.02 H new ATOM 0 HZ2 LYS A 983 14.376 -30.717 -7.329 1.00 34.02 H new ATOM 0 HZ3 LYS A 983 15.295 -31.657 -6.254 1.00 34.02 H new ATOM 1455 N ILE A 984 11.245 -26.718 -7.770 1.00 12.13 N ATOM 1456 CA ILE A 984 10.419 -25.524 -7.717 1.00 13.31 C ATOM 1457 C ILE A 984 9.067 -25.814 -8.372 1.00 62.44 C ATOM 1458 O ILE A 984 8.059 -25.202 -8.023 1.00 22.00 O ATOM 1459 CB ILE A 984 11.157 -24.334 -8.332 1.00 44.54 C ATOM 1460 CG1 ILE A 984 11.930 -23.556 -7.265 1.00 22.21 C ATOM 1461 CG2 ILE A 984 10.195 -23.435 -9.112 1.00 4.20 C ATOM 1462 CD1 ILE A 984 12.537 -22.279 -7.848 1.00 50.35 C ATOM 0 H ILE A 984 12.132 -26.602 -8.261 1.00 12.13 H new ATOM 0 HA ILE A 984 10.219 -25.246 -6.682 1.00 13.31 H new ATOM 0 HB ILE A 984 11.888 -24.717 -9.044 1.00 44.54 H new ATOM 0 HG12 ILE A 984 11.263 -23.302 -6.441 1.00 22.21 H new ATOM 0 HG13 ILE A 984 12.721 -24.184 -6.854 1.00 22.21 H new ATOM 0 HG21 ILE A 984 10.746 -22.597 -9.539 1.00 4.20 H new ATOM 0 HG22 ILE A 984 9.729 -24.009 -9.913 1.00 4.20 H new ATOM 0 HG23 ILE A 984 9.424 -23.058 -8.440 1.00 4.20 H new ATOM 0 HD11 ILE A 984 13.081 -21.746 -7.068 1.00 50.35 H new ATOM 0 HD12 ILE A 984 13.222 -22.537 -8.656 1.00 50.35 H new ATOM 0 HD13 ILE A 984 11.742 -21.642 -8.236 1.00 50.35 H new ATOM 1474 N ARG A 985 9.090 -26.749 -9.311 1.00 53.03 N ATOM 1475 CA ARG A 985 7.879 -27.128 -10.019 1.00 35.32 C ATOM 1476 C ARG A 985 6.876 -27.762 -9.053 1.00 32.24 C ATOM 1477 O ARG A 985 5.727 -28.008 -9.417 1.00 50.43 O ATOM 1478 CB ARG A 985 8.186 -28.117 -11.145 1.00 54.14 C ATOM 1479 CG ARG A 985 9.164 -29.196 -10.677 1.00 2.43 C ATOM 1480 CD ARG A 985 8.917 -30.516 -11.409 1.00 50.03 C ATOM 1481 NE ARG A 985 10.153 -31.330 -11.415 1.00 74.44 N ATOM 1482 CZ ARG A 985 11.219 -31.082 -12.205 1.00 2.43 C ATOM 1483 NH1 ARG A 985 11.210 -30.037 -13.060 1.00 31.01 N ATOM 1484 NH2 ARG A 985 12.271 -31.875 -12.128 1.00 23.02 N ATOM 0 H ARG A 985 9.928 -27.255 -9.598 1.00 53.03 H new ATOM 0 HA ARG A 985 7.451 -26.224 -10.451 1.00 35.32 H new ATOM 0 HB2 ARG A 985 7.262 -28.583 -11.487 1.00 54.14 H new ATOM 0 HB3 ARG A 985 8.608 -27.584 -11.997 1.00 54.14 H new ATOM 0 HG2 ARG A 985 10.187 -28.865 -10.853 1.00 2.43 H new ATOM 0 HG3 ARG A 985 9.058 -29.347 -9.603 1.00 2.43 H new ATOM 0 HD2 ARG A 985 8.112 -31.066 -10.922 1.00 50.03 H new ATOM 0 HD3 ARG A 985 8.596 -30.320 -12.432 1.00 50.03 H new ATOM 0 HE ARG A 985 10.202 -32.129 -10.782 1.00 74.44 H new ATOM 0 HH11 ARG A 985 10.393 -29.428 -13.112 1.00 31.01 H new ATOM 0 HH12 ARG A 985 12.020 -29.857 -13.653 1.00 31.01 H new ATOM 0 HH21 ARG A 985 12.270 -32.661 -11.478 1.00 23.02 H new ATOM 0 HH22 ARG A 985 13.085 -31.701 -12.718 1.00 23.02 H new ATOM 1497 N ASN A 986 7.347 -28.009 -7.839 1.00 72.21 N ATOM 1498 CA ASN A 986 6.506 -28.610 -6.818 1.00 13.22 C ATOM 1499 C ASN A 986 6.357 -27.635 -5.648 1.00 34.11 C ATOM 1500 O ASN A 986 5.633 -27.912 -4.693 1.00 22.45 O ATOM 1501 CB ASN A 986 7.127 -29.901 -6.281 1.00 44.33 C ATOM 1502 CG ASN A 986 7.358 -30.908 -7.409 1.00 73.44 C ATOM 1503 OD1 ASN A 986 6.560 -31.052 -8.321 1.00 33.10 O ATOM 1504 ND2 ASN A 986 8.491 -31.596 -7.297 1.00 75.14 N ATOM 0 H ASN A 986 8.300 -27.804 -7.540 1.00 72.21 H new ATOM 0 HA ASN A 986 5.539 -28.836 -7.268 1.00 13.22 H new ATOM 0 HB2 ASN A 986 8.074 -29.676 -5.789 1.00 44.33 H new ATOM 0 HB3 ASN A 986 6.472 -30.338 -5.527 1.00 44.33 H new ATOM 0 HD21 ASN A 986 8.736 -32.293 -8.000 1.00 75.14 H new ATOM 0 HD22 ASN A 986 9.115 -31.426 -6.508 1.00 75.14 H new ATOM 1511 N PHE A 987 7.053 -26.514 -5.761 1.00 51.33 N ATOM 1512 CA PHE A 987 7.007 -25.496 -4.725 1.00 21.31 C ATOM 1513 C PHE A 987 6.574 -24.146 -5.300 1.00 71.43 C ATOM 1514 O PHE A 987 6.252 -24.046 -6.483 1.00 74.42 O ATOM 1515 CB PHE A 987 8.424 -25.367 -4.163 1.00 1.53 C ATOM 1516 CG PHE A 987 8.802 -26.466 -3.167 1.00 53.44 C ATOM 1517 CD1 PHE A 987 9.035 -27.731 -3.608 1.00 13.02 C ATOM 1518 CD2 PHE A 987 8.904 -26.177 -1.842 1.00 44.13 C ATOM 1519 CE1 PHE A 987 9.385 -28.751 -2.684 1.00 42.01 C ATOM 1520 CE2 PHE A 987 9.255 -27.197 -0.919 1.00 11.23 C ATOM 1521 CZ PHE A 987 9.488 -28.462 -1.359 1.00 30.30 C ATOM 0 H PHE A 987 7.652 -26.288 -6.555 1.00 51.33 H new ATOM 0 HA PHE A 987 6.288 -25.780 -3.956 1.00 21.31 H new ATOM 0 HB2 PHE A 987 9.134 -25.380 -4.990 1.00 1.53 H new ATOM 0 HB3 PHE A 987 8.523 -24.398 -3.674 1.00 1.53 H new ATOM 0 HD1 PHE A 987 8.954 -27.960 -4.660 1.00 13.02 H new ATOM 0 HD2 PHE A 987 8.718 -25.172 -1.492 1.00 44.13 H new ATOM 0 HE1 PHE A 987 9.569 -29.756 -3.033 1.00 42.01 H new ATOM 0 HE2 PHE A 987 9.337 -26.968 0.133 1.00 11.23 H new ATOM 0 HZ PHE A 987 9.755 -29.238 -0.656 1.00 30.30 H new ATOM 1531 N VAL A 988 6.580 -23.142 -4.437 1.00 2.42 N ATOM 1532 CA VAL A 988 6.192 -21.802 -4.844 1.00 71.04 C ATOM 1533 C VAL A 988 7.140 -20.785 -4.206 1.00 54.51 C ATOM 1534 O VAL A 988 7.837 -21.099 -3.243 1.00 31.51 O ATOM 1535 CB VAL A 988 4.724 -21.553 -4.494 1.00 35.33 C ATOM 1536 CG1 VAL A 988 4.207 -20.280 -5.167 1.00 2.04 C ATOM 1537 CG2 VAL A 988 3.859 -22.760 -4.866 1.00 1.51 C ATOM 0 H VAL A 988 6.848 -23.229 -3.457 1.00 2.42 H new ATOM 0 HA VAL A 988 6.277 -21.692 -5.925 1.00 71.04 H new ATOM 0 HB VAL A 988 4.657 -21.412 -3.415 1.00 35.33 H new ATOM 0 HG11 VAL A 988 3.161 -20.127 -4.901 1.00 2.04 H new ATOM 0 HG12 VAL A 988 4.795 -19.426 -4.831 1.00 2.04 H new ATOM 0 HG13 VAL A 988 4.296 -20.379 -6.249 1.00 2.04 H new ATOM 0 HG21 VAL A 988 2.820 -22.557 -4.607 1.00 1.51 H new ATOM 0 HG22 VAL A 988 3.936 -22.946 -5.937 1.00 1.51 H new ATOM 0 HG23 VAL A 988 4.204 -23.637 -4.319 1.00 1.51 H new ATOM 1547 N VAL A 989 7.135 -19.585 -4.769 1.00 34.04 N ATOM 1548 CA VAL A 989 7.985 -18.519 -4.266 1.00 63.45 C ATOM 1549 C VAL A 989 7.112 -17.350 -3.806 1.00 64.11 C ATOM 1550 O VAL A 989 6.244 -16.890 -4.546 1.00 20.22 O ATOM 1551 CB VAL A 989 9.007 -18.119 -5.333 1.00 21.14 C ATOM 1552 CG1 VAL A 989 10.170 -17.342 -4.713 1.00 22.02 C ATOM 1553 CG2 VAL A 989 9.512 -19.345 -6.096 1.00 73.21 C ATOM 0 H VAL A 989 6.556 -19.328 -5.568 1.00 34.04 H new ATOM 0 HA VAL A 989 8.554 -18.859 -3.401 1.00 63.45 H new ATOM 0 HB VAL A 989 8.508 -17.463 -6.046 1.00 21.14 H new ATOM 0 HG11 VAL A 989 10.882 -17.070 -5.492 1.00 22.02 H new ATOM 0 HG12 VAL A 989 9.791 -16.438 -4.236 1.00 22.02 H new ATOM 0 HG13 VAL A 989 10.667 -17.964 -3.968 1.00 22.02 H new ATOM 0 HG21 VAL A 989 10.237 -19.033 -6.848 1.00 73.21 H new ATOM 0 HG22 VAL A 989 9.987 -20.037 -5.400 1.00 73.21 H new ATOM 0 HG23 VAL A 989 8.673 -19.841 -6.585 1.00 73.21 H new ATOM 1563 N VAL A 990 7.373 -16.903 -2.587 1.00 5.24 N ATOM 1564 CA VAL A 990 6.623 -15.796 -2.019 1.00 15.02 C ATOM 1565 C VAL A 990 7.585 -14.661 -1.663 1.00 63.33 C ATOM 1566 O VAL A 990 8.488 -14.841 -0.847 1.00 15.23 O ATOM 1567 CB VAL A 990 5.801 -16.280 -0.822 1.00 62.11 C ATOM 1568 CG1 VAL A 990 5.835 -15.258 0.316 1.00 40.23 C ATOM 1569 CG2 VAL A 990 4.362 -16.593 -1.236 1.00 32.13 C ATOM 0 H VAL A 990 8.094 -17.288 -1.976 1.00 5.24 H new ATOM 0 HA VAL A 990 5.913 -15.403 -2.747 1.00 15.02 H new ATOM 0 HB VAL A 990 6.252 -17.202 -0.457 1.00 62.11 H new ATOM 0 HG11 VAL A 990 5.243 -15.627 1.154 1.00 40.23 H new ATOM 0 HG12 VAL A 990 6.865 -15.106 0.638 1.00 40.23 H new ATOM 0 HG13 VAL A 990 5.421 -14.312 -0.032 1.00 40.23 H new ATOM 0 HG21 VAL A 990 3.800 -16.935 -0.367 1.00 32.13 H new ATOM 0 HG22 VAL A 990 3.896 -15.694 -1.639 1.00 32.13 H new ATOM 0 HG23 VAL A 990 4.364 -17.373 -1.997 1.00 32.13 H new ATOM 1579 N PHE A 991 7.361 -13.518 -2.294 1.00 15.01 N ATOM 1580 CA PHE A 991 8.197 -12.354 -2.054 1.00 72.14 C ATOM 1581 C PHE A 991 7.647 -11.512 -0.901 1.00 43.13 C ATOM 1582 O PHE A 991 6.488 -11.100 -0.926 1.00 24.20 O ATOM 1583 CB PHE A 991 8.177 -11.518 -3.335 1.00 42.05 C ATOM 1584 CG PHE A 991 8.969 -12.132 -4.492 1.00 21.23 C ATOM 1585 CD1 PHE A 991 10.323 -12.007 -4.531 1.00 12.11 C ATOM 1586 CD2 PHE A 991 8.319 -12.803 -5.480 1.00 63.40 C ATOM 1587 CE1 PHE A 991 11.058 -12.577 -5.604 1.00 14.21 C ATOM 1588 CE2 PHE A 991 9.054 -13.373 -6.553 1.00 63.31 C ATOM 1589 CZ PHE A 991 10.408 -13.248 -6.592 1.00 50.04 C ATOM 0 H PHE A 991 6.612 -13.373 -2.971 1.00 15.01 H new ATOM 0 HA PHE A 991 9.206 -12.669 -1.789 1.00 72.14 H new ATOM 0 HB2 PHE A 991 7.143 -11.379 -3.650 1.00 42.05 H new ATOM 0 HB3 PHE A 991 8.580 -10.529 -3.117 1.00 42.05 H new ATOM 0 HD1 PHE A 991 10.839 -11.474 -3.746 1.00 12.11 H new ATOM 0 HD2 PHE A 991 7.244 -12.902 -5.449 1.00 63.40 H new ATOM 0 HE1 PHE A 991 12.133 -12.478 -5.635 1.00 14.21 H new ATOM 0 HE2 PHE A 991 8.538 -13.906 -7.338 1.00 63.31 H new ATOM 0 HZ PHE A 991 10.967 -13.682 -7.408 1.00 50.04 H new ATOM 1599 N LYS A 992 8.505 -11.281 0.082 1.00 50.13 N ATOM 1600 CA LYS A 992 8.120 -10.495 1.242 1.00 71.22 C ATOM 1601 C LYS A 992 8.347 -9.011 0.946 1.00 61.43 C ATOM 1602 O LYS A 992 7.895 -8.149 1.696 1.00 14.45 O ATOM 1603 CB LYS A 992 8.850 -10.992 2.491 1.00 13.25 C ATOM 1604 CG LYS A 992 8.268 -10.356 3.755 1.00 13.44 C ATOM 1605 CD LYS A 992 9.330 -10.242 4.851 1.00 73.10 C ATOM 1606 CE LYS A 992 10.243 -11.469 4.858 1.00 21.53 C ATOM 1607 NZ LYS A 992 10.983 -11.557 6.137 1.00 32.53 N ATOM 0 H LYS A 992 9.465 -11.624 0.099 1.00 50.13 H new ATOM 0 HA LYS A 992 7.057 -10.619 1.451 1.00 71.22 H new ATOM 0 HB2 LYS A 992 8.770 -12.077 2.556 1.00 13.25 H new ATOM 0 HB3 LYS A 992 9.911 -10.754 2.415 1.00 13.25 H new ATOM 0 HG2 LYS A 992 7.875 -9.367 3.521 1.00 13.44 H new ATOM 0 HG3 LYS A 992 7.431 -10.955 4.115 1.00 13.44 H new ATOM 0 HD2 LYS A 992 9.925 -9.342 4.694 1.00 73.10 H new ATOM 0 HD3 LYS A 992 8.846 -10.139 5.822 1.00 73.10 H new ATOM 0 HE2 LYS A 992 9.650 -12.372 4.711 1.00 21.53 H new ATOM 0 HE3 LYS A 992 10.946 -11.411 4.027 1.00 21.53 H new ATOM 0 HZ1 LYS A 992 11.598 -12.395 6.125 1.00 32.53 H new ATOM 0 HZ2 LYS A 992 11.564 -10.703 6.262 1.00 32.53 H new ATOM 0 HZ3 LYS A 992 10.308 -11.634 6.924 1.00 32.53 H new ATOM 1673 N LYS A 997 3.179 -13.409 -4.802 1.00 44.43 N ATOM 1674 CA LYS A 997 3.478 -14.831 -4.815 1.00 50.44 C ATOM 1675 C LYS A 997 3.535 -15.322 -6.263 1.00 71.03 C ATOM 1676 O LYS A 997 2.529 -15.297 -6.971 1.00 62.10 O ATOM 1677 CB LYS A 997 2.479 -15.596 -3.945 1.00 41.11 C ATOM 1678 CG LYS A 997 2.109 -16.936 -4.585 1.00 14.35 C ATOM 1679 CD LYS A 997 1.086 -17.687 -3.729 1.00 63.24 C ATOM 1680 CE LYS A 997 1.648 -17.982 -2.337 1.00 75.51 C ATOM 1681 NZ LYS A 997 0.814 -18.991 -1.645 1.00 53.14 N ATOM 0 HA LYS A 997 4.458 -15.019 -4.375 1.00 50.44 H new ATOM 0 HB2 LYS A 997 2.907 -15.766 -2.957 1.00 41.11 H new ATOM 0 HB3 LYS A 997 1.580 -14.996 -3.803 1.00 41.11 H new ATOM 0 HG2 LYS A 997 1.701 -16.767 -5.582 1.00 14.35 H new ATOM 0 HG3 LYS A 997 3.005 -17.545 -4.706 1.00 14.35 H new ATOM 0 HD2 LYS A 997 0.176 -17.094 -3.640 1.00 63.24 H new ATOM 0 HD3 LYS A 997 0.811 -18.621 -4.220 1.00 63.24 H new ATOM 0 HE2 LYS A 997 2.673 -18.344 -2.421 1.00 75.51 H new ATOM 0 HE3 LYS A 997 1.681 -17.064 -1.750 1.00 75.51 H new ATOM 0 HZ1 LYS A 997 0.812 -18.798 -0.623 1.00 53.14 H new ATOM 0 HZ2 LYS A 997 -0.159 -18.945 -2.008 1.00 53.14 H new ATOM 0 HZ3 LYS A 997 1.203 -19.940 -1.817 1.00 53.14 H new ATOM 1694 N LYS A 998 4.722 -15.757 -6.661 1.00 34.35 N ATOM 1695 CA LYS A 998 4.923 -16.254 -8.011 1.00 51.22 C ATOM 1696 C LYS A 998 5.090 -17.774 -7.971 1.00 61.15 C ATOM 1697 O LYS A 998 5.337 -18.348 -6.912 1.00 15.44 O ATOM 1698 CB LYS A 998 6.088 -15.524 -8.682 1.00 64.21 C ATOM 1699 CG LYS A 998 5.599 -14.286 -9.437 1.00 30.52 C ATOM 1700 CD LYS A 998 5.005 -13.256 -8.474 1.00 25.21 C ATOM 1701 CE LYS A 998 4.480 -12.036 -9.232 1.00 45.44 C ATOM 1702 NZ LYS A 998 5.558 -11.428 -10.045 1.00 54.14 N ATOM 0 H LYS A 998 5.554 -15.775 -6.072 1.00 34.35 H new ATOM 0 HA LYS A 998 4.049 -16.046 -8.628 1.00 51.22 H new ATOM 0 HB2 LYS A 998 6.819 -15.230 -7.929 1.00 64.21 H new ATOM 0 HB3 LYS A 998 6.595 -16.198 -9.372 1.00 64.21 H new ATOM 0 HG2 LYS A 998 6.428 -13.840 -9.987 1.00 30.52 H new ATOM 0 HG3 LYS A 998 4.849 -14.577 -10.172 1.00 30.52 H new ATOM 0 HD2 LYS A 998 4.195 -13.711 -7.904 1.00 25.21 H new ATOM 0 HD3 LYS A 998 5.764 -12.944 -7.756 1.00 25.21 H new ATOM 0 HE2 LYS A 998 3.652 -12.330 -9.877 1.00 45.44 H new ATOM 0 HE3 LYS A 998 4.090 -11.302 -8.527 1.00 45.44 H new ATOM 0 HZ1 LYS A 998 5.270 -10.475 -10.347 1.00 54.14 H new ATOM 0 HZ2 LYS A 998 6.427 -11.363 -9.477 1.00 54.14 H new ATOM 0 HZ3 LYS A 998 5.736 -12.018 -10.883 1.00 54.14 H new ATOM 1715 N GLN A 999 4.949 -18.384 -9.139 1.00 45.44 N ATOM 1716 CA GLN A 999 5.082 -19.826 -9.252 1.00 31.25 C ATOM 1717 C GLN A 999 6.064 -20.184 -10.369 1.00 4.14 C ATOM 1718 O GLN A 999 5.758 -20.014 -11.548 1.00 0.34 O ATOM 1719 CB GLN A 999 3.721 -20.485 -9.486 1.00 63.14 C ATOM 1720 CG GLN A 999 3.712 -21.924 -8.967 1.00 70.20 C ATOM 1721 CD GLN A 999 2.293 -22.366 -8.602 1.00 63.32 C ATOM 1722 OE1 GLN A 999 1.307 -21.866 -9.118 1.00 4.41 O ATOM 1723 NE2 GLN A 999 2.246 -23.330 -7.687 1.00 15.13 N ATOM 0 H GLN A 999 4.744 -17.905 -10.016 1.00 45.44 H new ATOM 0 HA GLN A 999 5.478 -20.209 -8.312 1.00 31.25 H new ATOM 0 HB2 GLN A 999 2.943 -19.909 -8.985 1.00 63.14 H new ATOM 0 HB3 GLN A 999 3.487 -20.477 -10.551 1.00 63.14 H new ATOM 0 HG2 GLN A 999 4.121 -22.591 -9.726 1.00 70.20 H new ATOM 0 HG3 GLN A 999 4.358 -22.003 -8.092 1.00 70.20 H new ATOM 0 HE21 GLN A 999 3.110 -23.704 -7.296 1.00 15.13 H new ATOM 0 HE22 GLN A 999 1.346 -23.695 -7.377 1.00 15.13 H new ATOM 1732 N TYR A1000 7.225 -20.673 -9.958 1.00 3.21 N ATOM 1733 CA TYR A1000 8.255 -21.056 -10.909 1.00 54.13 C ATOM 1734 C TYR A1000 8.256 -22.569 -11.137 1.00 15.04 C ATOM 1735 O TYR A1000 7.376 -23.275 -10.646 1.00 14.53 O ATOM 1736 CB TYR A1000 9.586 -20.646 -10.277 1.00 64.43 C ATOM 1737 CG TYR A1000 9.781 -19.133 -10.161 1.00 71.32 C ATOM 1738 CD1 TYR A1000 9.252 -18.450 -9.085 1.00 61.10 C ATOM 1739 CD2 TYR A1000 10.485 -18.451 -11.133 1.00 22.42 C ATOM 1740 CE1 TYR A1000 9.435 -17.026 -8.976 1.00 21.03 C ATOM 1741 CE2 TYR A1000 10.668 -17.027 -11.024 1.00 22.35 C ATOM 1742 CZ TYR A1000 10.134 -16.385 -9.950 1.00 41.14 C ATOM 1743 OH TYR A1000 10.307 -15.040 -9.847 1.00 50.12 O ATOM 0 H TYR A1000 7.475 -20.813 -8.979 1.00 3.21 H new ATOM 0 HA TYR A1000 8.085 -20.576 -11.873 1.00 54.13 H new ATOM 0 HB2 TYR A1000 9.656 -21.088 -9.283 1.00 64.43 H new ATOM 0 HB3 TYR A1000 10.401 -21.063 -10.869 1.00 64.43 H new ATOM 0 HD1 TYR A1000 8.701 -18.983 -8.325 1.00 61.10 H new ATOM 0 HD2 TYR A1000 10.899 -18.986 -11.975 1.00 22.42 H new ATOM 0 HE1 TYR A1000 9.026 -16.479 -8.139 1.00 21.03 H new ATOM 0 HE2 TYR A1000 11.216 -16.481 -11.777 1.00 22.35 H new ATOM 0 HH TYR A1000 10.826 -14.717 -10.613 1.00 50.12 H new ATOM 1753 N LYS A1001 9.253 -23.023 -11.881 1.00 2.20 N ATOM 1754 CA LYS A1001 9.380 -24.439 -12.179 1.00 61.23 C ATOM 1755 C LYS A1001 10.768 -24.923 -11.755 1.00 44.24 C ATOM 1756 O LYS A1001 10.894 -25.931 -11.061 1.00 55.44 O ATOM 1757 CB LYS A1001 9.058 -24.708 -13.651 1.00 1.23 C ATOM 1758 CG LYS A1001 10.079 -24.030 -14.568 1.00 34.52 C ATOM 1759 CD LYS A1001 9.725 -24.252 -16.040 1.00 14.32 C ATOM 1760 CE LYS A1001 10.321 -23.151 -16.919 1.00 5.34 C ATOM 1761 NZ LYS A1001 9.965 -23.370 -18.338 1.00 72.32 N ATOM 0 H LYS A1001 9.981 -22.435 -12.287 1.00 2.20 H new ATOM 0 HA LYS A1001 8.653 -25.015 -11.607 1.00 61.23 H new ATOM 0 HB2 LYS A1001 9.055 -25.782 -13.836 1.00 1.23 H new ATOM 0 HB3 LYS A1001 8.057 -24.342 -13.881 1.00 1.23 H new ATOM 0 HG2 LYS A1001 10.111 -22.961 -14.355 1.00 34.52 H new ATOM 0 HG3 LYS A1001 11.074 -24.426 -14.366 1.00 34.52 H new ATOM 0 HD2 LYS A1001 10.098 -25.223 -16.365 1.00 14.32 H new ATOM 0 HD3 LYS A1001 8.642 -24.270 -16.158 1.00 14.32 H new ATOM 0 HE2 LYS A1001 9.954 -22.178 -16.592 1.00 5.34 H new ATOM 0 HE3 LYS A1001 11.405 -23.136 -16.808 1.00 5.34 H new ATOM 0 HZ1 LYS A1001 10.378 -22.614 -18.920 1.00 72.32 H new ATOM 0 HZ2 LYS A1001 10.336 -24.290 -18.651 1.00 72.32 H new ATOM 0 HZ3 LYS A1001 8.930 -23.361 -18.442 1.00 72.32 H new ATOM 1774 N LYS A1002 11.777 -24.181 -12.191 1.00 34.44 N ATOM 1775 CA LYS A1002 13.151 -24.522 -11.865 1.00 1.01 C ATOM 1776 C LYS A1002 13.778 -23.381 -11.062 1.00 1.43 C ATOM 1777 O LYS A1002 13.302 -22.247 -11.111 1.00 62.51 O ATOM 1778 CB LYS A1002 13.929 -24.882 -13.132 1.00 52.45 C ATOM 1779 CG LYS A1002 13.441 -26.209 -13.717 1.00 40.20 C ATOM 1780 CD LYS A1002 13.752 -26.296 -15.213 1.00 31.45 C ATOM 1781 CE LYS A1002 13.780 -27.752 -15.682 1.00 73.33 C ATOM 1782 NZ LYS A1002 14.128 -27.827 -17.119 1.00 1.32 N ATOM 0 H LYS A1002 11.670 -23.346 -12.767 1.00 34.44 H new ATOM 0 HA LYS A1002 13.184 -25.411 -11.235 1.00 1.01 H new ATOM 0 HB2 LYS A1002 13.813 -24.090 -13.872 1.00 52.45 H new ATOM 0 HB3 LYS A1002 14.992 -24.951 -12.903 1.00 52.45 H new ATOM 0 HG2 LYS A1002 13.917 -27.038 -13.194 1.00 40.20 H new ATOM 0 HG3 LYS A1002 12.367 -26.307 -13.559 1.00 40.20 H new ATOM 0 HD2 LYS A1002 13.001 -25.743 -15.777 1.00 31.45 H new ATOM 0 HD3 LYS A1002 14.714 -25.826 -15.416 1.00 31.45 H new ATOM 0 HE2 LYS A1002 14.506 -28.315 -15.096 1.00 73.33 H new ATOM 0 HE3 LYS A1002 12.807 -28.214 -15.513 1.00 73.33 H new ATOM 0 HZ1 LYS A1002 14.143 -28.822 -17.421 1.00 1.32 H new ATOM 0 HZ2 LYS A1002 13.420 -27.307 -17.675 1.00 1.32 H new ATOM 0 HZ3 LYS A1002 15.066 -27.405 -17.271 1.00 1.32 H new ATOM 1795 N TRP A1003 14.837 -23.719 -10.340 1.00 73.24 N ATOM 1796 CA TRP A1003 15.534 -22.737 -9.528 1.00 12.12 C ATOM 1797 C TRP A1003 16.257 -21.772 -10.469 1.00 42.13 C ATOM 1798 O TRP A1003 16.587 -20.652 -10.083 1.00 15.43 O ATOM 1799 CB TRP A1003 16.474 -23.418 -8.531 1.00 43.44 C ATOM 1800 CG TRP A1003 15.832 -24.569 -7.756 1.00 74.41 C ATOM 1801 CD1 TRP A1003 15.870 -25.878 -8.040 1.00 62.45 C ATOM 1802 CD2 TRP A1003 15.048 -24.462 -6.549 1.00 54.42 C ATOM 1803 NE1 TRP A1003 15.171 -26.619 -7.109 1.00 63.21 N ATOM 1804 CE2 TRP A1003 14.655 -25.730 -6.173 1.00 64.14 C ATOM 1805 CE3 TRP A1003 14.682 -23.330 -5.800 1.00 3.44 C ATOM 1806 CZ2 TRP A1003 13.877 -25.987 -5.038 1.00 62.23 C ATOM 1807 CZ3 TRP A1003 13.905 -23.603 -4.668 1.00 75.41 C ATOM 1808 CH2 TRP A1003 13.501 -24.875 -4.276 1.00 42.43 C ATOM 0 H TRP A1003 15.229 -24.660 -10.301 1.00 73.24 H new ATOM 0 HA TRP A1003 14.829 -22.168 -8.921 1.00 12.12 H new ATOM 0 HB2 TRP A1003 17.344 -23.796 -9.068 1.00 43.44 H new ATOM 0 HB3 TRP A1003 16.836 -22.673 -7.822 1.00 43.44 H new ATOM 0 HD1 TRP A1003 16.383 -26.300 -8.891 1.00 62.45 H new ATOM 0 HE1 TRP A1003 15.054 -27.632 -7.108 1.00 63.21 H new ATOM 0 HE3 TRP A1003 14.977 -22.328 -6.076 1.00 3.44 H new ATOM 0 HZ2 TRP A1003 13.583 -26.990 -4.765 1.00 62.23 H new ATOM 0 HZ3 TRP A1003 13.598 -22.768 -4.056 1.00 75.41 H new ATOM 0 HH2 TRP A1003 12.900 -25.004 -3.388 1.00 42.43 H new ATOM 1819 N VAL A1004 16.483 -22.242 -11.687 1.00 43.02 N ATOM 1820 CA VAL A1004 17.162 -21.435 -12.687 1.00 53.20 C ATOM 1821 C VAL A1004 16.269 -20.255 -13.075 1.00 55.31 C ATOM 1822 O VAL A1004 16.762 -19.213 -13.504 1.00 60.05 O ATOM 1823 CB VAL A1004 17.556 -22.305 -13.882 1.00 51.34 C ATOM 1824 CG1 VAL A1004 16.391 -23.194 -14.321 1.00 51.12 C ATOM 1825 CG2 VAL A1004 18.058 -21.445 -15.044 1.00 54.13 C ATOM 0 H VAL A1004 16.208 -23.172 -12.004 1.00 43.02 H new ATOM 0 HA VAL A1004 18.087 -21.024 -12.283 1.00 53.20 H new ATOM 0 HB VAL A1004 18.373 -22.955 -13.569 1.00 51.34 H new ATOM 0 HG11 VAL A1004 16.698 -23.802 -15.172 1.00 51.12 H new ATOM 0 HG12 VAL A1004 16.099 -23.845 -13.497 1.00 51.12 H new ATOM 0 HG13 VAL A1004 15.545 -22.570 -14.608 1.00 51.12 H new ATOM 0 HG21 VAL A1004 18.332 -22.088 -15.881 1.00 54.13 H new ATOM 0 HG22 VAL A1004 17.270 -20.759 -15.356 1.00 54.13 H new ATOM 0 HG23 VAL A1004 18.930 -20.875 -14.724 1.00 54.13 H new ATOM 1835 N GLU A1005 14.970 -20.458 -12.910 1.00 53.52 N ATOM 1836 CA GLU A1005 14.003 -19.423 -13.238 1.00 22.21 C ATOM 1837 C GLU A1005 14.024 -18.322 -12.176 1.00 40.43 C ATOM 1838 O GLU A1005 13.568 -17.207 -12.425 1.00 12.43 O ATOM 1839 CB GLU A1005 12.599 -20.013 -13.389 1.00 4.42 C ATOM 1840 CG GLU A1005 12.586 -21.139 -14.424 1.00 60.11 C ATOM 1841 CD GLU A1005 12.683 -20.579 -15.845 1.00 33.22 C ATOM 1842 OE1 GLU A1005 12.147 -19.496 -16.122 1.00 0.21 O ATOM 1843 OE2 GLU A1005 13.344 -21.312 -16.676 1.00 11.33 O ATOM 0 H GLU A1005 14.564 -21.323 -12.554 1.00 53.52 H new ATOM 0 HA GLU A1005 14.281 -18.983 -14.195 1.00 22.21 H new ATOM 0 HB2 GLU A1005 12.256 -20.394 -12.427 1.00 4.42 H new ATOM 0 HB3 GLU A1005 11.902 -19.230 -13.689 1.00 4.42 H new ATOM 0 HG2 GLU A1005 13.419 -21.817 -14.239 1.00 60.11 H new ATOM 0 HG3 GLU A1005 11.671 -21.722 -14.321 1.00 60.11 H new ATOM 1851 N LEU A1006 14.558 -18.672 -11.016 1.00 22.42 N ATOM 1852 CA LEU A1006 14.645 -17.727 -9.915 1.00 75.25 C ATOM 1853 C LEU A1006 15.706 -16.673 -10.236 1.00 71.05 C ATOM 1854 O LEU A1006 16.892 -16.987 -10.324 1.00 73.53 O ATOM 1855 CB LEU A1006 14.887 -18.462 -8.596 1.00 22.24 C ATOM 1856 CG LEU A1006 14.235 -17.847 -7.356 1.00 2.03 C ATOM 1857 CD1 LEU A1006 12.769 -17.502 -7.621 1.00 74.15 C ATOM 1858 CD2 LEU A1006 14.398 -18.762 -6.140 1.00 13.41 C ATOM 0 H LEU A1006 14.935 -19.598 -10.814 1.00 22.42 H new ATOM 0 HA LEU A1006 13.699 -17.200 -9.790 1.00 75.25 H new ATOM 0 HB2 LEU A1006 14.527 -19.485 -8.702 1.00 22.24 H new ATOM 0 HB3 LEU A1006 15.962 -18.519 -8.426 1.00 22.24 H new ATOM 0 HG LEU A1006 14.749 -16.913 -7.128 1.00 2.03 H new ATOM 0 HD11 LEU A1006 12.330 -17.067 -6.723 1.00 74.15 H new ATOM 0 HD12 LEU A1006 12.706 -16.786 -8.440 1.00 74.15 H new ATOM 0 HD13 LEU A1006 12.225 -18.408 -7.889 1.00 74.15 H new ATOM 0 HD21 LEU A1006 13.926 -18.301 -5.272 1.00 13.41 H new ATOM 0 HD22 LEU A1006 13.926 -19.724 -6.342 1.00 13.41 H new ATOM 0 HD23 LEU A1006 15.458 -18.914 -5.938 1.00 13.41 H new ATOM 1870 N PRO A1007 15.229 -15.411 -10.407 1.00 40.13 N ATOM 1871 CA PRO A1007 16.123 -14.308 -10.717 1.00 24.43 C ATOM 1872 C PRO A1007 16.914 -13.879 -9.479 1.00 33.42 C ATOM 1873 O PRO A1007 17.721 -12.954 -9.543 1.00 43.14 O ATOM 1874 CB PRO A1007 15.222 -13.210 -11.256 1.00 51.11 C ATOM 1875 CG PRO A1007 13.816 -13.561 -10.797 1.00 22.32 C ATOM 1876 CD PRO A1007 13.831 -15.001 -10.311 1.00 31.41 C ATOM 0 HA PRO A1007 16.883 -14.576 -11.451 1.00 24.43 H new ATOM 0 HB2 PRO A1007 15.525 -12.234 -10.875 1.00 51.11 H new ATOM 0 HB3 PRO A1007 15.276 -13.159 -12.343 1.00 51.11 H new ATOM 0 HG2 PRO A1007 13.497 -12.892 -9.998 1.00 22.32 H new ATOM 0 HG3 PRO A1007 13.106 -13.442 -11.615 1.00 22.32 H new ATOM 0 HD2 PRO A1007 13.466 -15.077 -9.287 1.00 31.41 H new ATOM 0 HD3 PRO A1007 13.190 -15.633 -10.926 1.00 31.41 H new ATOM 1884 N ILE A1008 16.653 -14.573 -8.380 1.00 43.13 N ATOM 1885 CA ILE A1008 17.330 -14.275 -7.129 1.00 63.44 C ATOM 1886 C ILE A1008 18.596 -15.128 -7.024 1.00 62.34 C ATOM 1887 O ILE A1008 18.553 -16.339 -7.237 1.00 52.01 O ATOM 1888 CB ILE A1008 16.373 -14.447 -5.948 1.00 62.32 C ATOM 1889 CG1 ILE A1008 15.504 -13.202 -5.761 1.00 3.12 C ATOM 1890 CG2 ILE A1008 17.136 -14.811 -4.673 1.00 22.02 C ATOM 1891 CD1 ILE A1008 15.083 -12.619 -7.111 1.00 45.23 C ATOM 0 H ILE A1008 15.983 -15.340 -8.330 1.00 43.13 H new ATOM 0 HA ILE A1008 17.645 -13.232 -7.105 1.00 63.44 H new ATOM 0 HB ILE A1008 15.702 -15.277 -6.169 1.00 62.32 H new ATOM 0 HG12 ILE A1008 14.618 -13.457 -5.179 1.00 3.12 H new ATOM 0 HG13 ILE A1008 16.054 -12.452 -5.193 1.00 3.12 H new ATOM 0 HG21 ILE A1008 16.432 -14.927 -3.849 1.00 22.02 H new ATOM 0 HG22 ILE A1008 17.674 -15.746 -4.826 1.00 22.02 H new ATOM 0 HG23 ILE A1008 17.846 -14.019 -4.435 1.00 22.02 H new ATOM 0 HD11 ILE A1008 14.466 -11.735 -6.949 1.00 45.23 H new ATOM 0 HD12 ILE A1008 15.970 -12.343 -7.681 1.00 45.23 H new ATOM 0 HD13 ILE A1008 14.512 -13.363 -7.666 1.00 45.23 H new ATOM 1903 N THR A1009 19.694 -14.463 -6.696 1.00 50.13 N ATOM 1904 CA THR A1009 20.970 -15.145 -6.560 1.00 51.35 C ATOM 1905 C THR A1009 20.929 -16.123 -5.385 1.00 60.42 C ATOM 1906 O THR A1009 20.110 -15.977 -4.479 1.00 71.44 O ATOM 1907 CB THR A1009 22.062 -14.082 -6.428 1.00 43.33 C ATOM 1908 OG1 THR A1009 23.238 -14.732 -6.902 1.00 44.31 O ATOM 1909 CG2 THR A1009 22.382 -13.749 -4.969 1.00 64.25 C ATOM 0 H THR A1009 19.726 -13.459 -6.520 1.00 50.13 H new ATOM 0 HA THR A1009 21.191 -15.751 -7.439 1.00 51.35 H new ATOM 0 HB THR A1009 21.751 -13.175 -6.947 1.00 43.33 H new ATOM 0 HG1 THR A1009 23.996 -14.113 -6.853 1.00 44.31 H new ATOM 0 HG21 THR A1009 23.163 -12.990 -4.932 1.00 64.25 H new ATOM 0 HG22 THR A1009 21.486 -13.372 -4.477 1.00 64.25 H new ATOM 0 HG23 THR A1009 22.726 -14.648 -4.458 1.00 64.25 H new ATOM 1917 N PHE A1010 21.823 -17.100 -5.438 1.00 43.52 N ATOM 1918 CA PHE A1010 21.900 -18.102 -4.389 1.00 72.23 C ATOM 1919 C PHE A1010 23.351 -18.348 -3.970 1.00 53.32 C ATOM 1920 O PHE A1010 24.278 -18.010 -4.704 1.00 3.31 O ATOM 1921 CB PHE A1010 21.322 -19.396 -4.965 1.00 33.52 C ATOM 1922 CG PHE A1010 19.802 -19.512 -4.832 1.00 72.04 C ATOM 1923 CD1 PHE A1010 18.991 -18.842 -5.694 1.00 42.44 C ATOM 1924 CD2 PHE A1010 19.261 -20.285 -3.853 1.00 24.23 C ATOM 1925 CE1 PHE A1010 17.581 -18.949 -5.572 1.00 14.15 C ATOM 1926 CE2 PHE A1010 17.851 -20.392 -3.730 1.00 31.52 C ATOM 1927 CZ PHE A1010 17.040 -19.722 -4.592 1.00 22.12 C ATOM 0 H PHE A1010 22.500 -17.219 -6.191 1.00 43.52 H new ATOM 0 HA PHE A1010 21.349 -17.765 -3.511 1.00 72.23 H new ATOM 0 HB2 PHE A1010 21.590 -19.464 -6.019 1.00 33.52 H new ATOM 0 HB3 PHE A1010 21.786 -20.245 -4.462 1.00 33.52 H new ATOM 0 HD1 PHE A1010 19.420 -18.228 -6.472 1.00 42.44 H new ATOM 0 HD2 PHE A1010 19.904 -20.818 -3.169 1.00 24.23 H new ATOM 0 HE1 PHE A1010 16.938 -18.417 -6.257 1.00 14.15 H new ATOM 0 HE2 PHE A1010 17.422 -21.006 -2.952 1.00 31.52 H new ATOM 0 HZ PHE A1010 15.967 -19.804 -4.499 1.00 22.12 H new ATOM 1937 N PRO A1011 23.506 -18.949 -2.760 1.00 74.54 N ATOM 1938 CA PRO A1011 24.828 -19.244 -2.235 1.00 33.21 C ATOM 1939 C PRO A1011 25.447 -20.446 -2.951 1.00 21.21 C ATOM 1940 O PRO A1011 24.933 -20.897 -3.973 1.00 51.45 O ATOM 1941 CB PRO A1011 24.616 -19.482 -0.749 1.00 22.33 C ATOM 1942 CG PRO A1011 23.133 -19.770 -0.580 1.00 23.54 C ATOM 1943 CD PRO A1011 22.430 -19.364 -1.864 1.00 41.22 C ATOM 0 HA PRO A1011 25.537 -18.432 -2.398 1.00 33.21 H new ATOM 0 HB2 PRO A1011 25.219 -20.319 -0.398 1.00 22.33 H new ATOM 0 HB3 PRO A1011 24.913 -18.609 -0.167 1.00 22.33 H new ATOM 0 HG2 PRO A1011 22.971 -20.828 -0.374 1.00 23.54 H new ATOM 0 HG3 PRO A1011 22.731 -19.215 0.267 1.00 23.54 H new ATOM 0 HD2 PRO A1011 21.863 -20.194 -2.284 1.00 41.22 H new ATOM 0 HD3 PRO A1011 21.724 -18.552 -1.689 1.00 41.22 H new