USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1077 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 96 TYR OH : rot 166:sc= 0.595 USER MOD Set 1.2: A 100 LYS NZ :NH3+ -177:sc= 0.721 (180deg=0.017) USER MOD Set 2.1: A 10 ASN : amide:sc= 0.153 K(o=-0.025,f=0.62) USER MOD Set 2.2: A 89 GLN : amide:sc= -0.179 K(o=-0.025,f=0.62) USER MOD Single : A 3 THR OG1 : rot 150:sc= 0.484 USER MOD Single : A 9 SER OG : rot 100:sc= 0.00807 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 40:sc= -0.895 USER MOD Single : A 28 ASN : amide:sc=-3.38e-05 X(o=-3.4e-05,f=-0.29) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 THR OG1 : rot 29:sc= -0.381 USER MOD Single : A 34 THR OG1 : rot 150:sc= 0.0041 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 168:sc= 0.563 (180deg=0.262) USER MOD Single : A 41 LYS NZ :NH3+ -168:sc= 0.779 (180deg=0.67) USER MOD Single : A 46 LYS NZ :NH3+ 156:sc= 0.957 (180deg=0.112) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= -0.0682 X(o=-0.068,f=-0.084) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.0187 USER MOD Single : A 72 TYR OH : rot 180:sc= -0.58 USER MOD Single : A 74 GLN : amide:sc= -0.0198 K(o=-0.02,f=-3.2!) USER MOD Single : A 75 LYS NZ :NH3+ -131:sc= 0.653 (180deg=-0.235) USER MOD Single : A 84 LYS NZ :NH3+ -125:sc= -1.39 (180deg=-1.62!) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 GLN : amide:sc= -0.101 K(o=-0.1,f=-0.66) USER MOD Single : A 101 LYS NZ :NH3+ -156:sc= 0.402 (180deg=-0.0973) USER MOD Single : A 109 THR OG1 : rot 35:sc= 0.347 USER MOD Single : A 111 ASN : amide:sc= -1.8! K(o=-1.8!,f=-0.68) USER MOD Single : A 116 LYS NZ :NH3+ -164:sc= 0.587 (180deg=0.238) USER MOD Single : A 117 LYS NZ :NH3+ -140:sc= -0.196 (180deg=-1.85!) USER MOD Single : A 120 LYS NZ :NH3+ 175:sc= 0.23 (180deg=0.201) USER MOD Single : A 125 LYS NZ :NH3+ 135:sc= 0.882 (180deg=-0.413) USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -2.926 -12.933 -1.552 1.00 34.13 N ATOM 21 CA GLY A 2 -1.501 -12.688 -1.325 1.00 33.32 C ATOM 22 C GLY A 2 -1.077 -11.339 -1.893 1.00 43.21 C ATOM 23 O GLY A 2 -0.156 -11.257 -2.710 1.00 53.12 O ATOM 0 HA2 GLY A 2 -1.290 -12.718 -0.256 1.00 33.32 H new ATOM 0 HA3 GLY A 2 -0.914 -13.481 -1.788 1.00 33.32 H new ATOM 27 N THR A 3 -1.783 -10.280 -1.475 1.00 74.42 N ATOM 28 CA THR A 3 -1.569 -8.914 -1.968 1.00 60.13 C ATOM 29 C THR A 3 -0.971 -8.012 -0.866 1.00 31.13 C ATOM 30 O THR A 3 -1.410 -8.047 0.296 1.00 71.32 O ATOM 31 CB THR A 3 -2.918 -8.304 -2.480 1.00 31.22 C ATOM 32 OG1 THR A 3 -3.480 -9.156 -3.491 1.00 51.32 O ATOM 33 CG2 THR A 3 -2.750 -6.888 -3.059 1.00 22.33 C ATOM 0 H THR A 3 -2.525 -10.349 -0.779 1.00 74.42 H new ATOM 0 HA THR A 3 -0.860 -8.963 -2.794 1.00 60.13 H new ATOM 0 HB THR A 3 -3.581 -8.233 -1.618 1.00 31.22 H new ATOM 0 HG1 THR A 3 -4.457 -9.082 -3.475 1.00 51.32 H new ATOM 0 HG21 THR A 3 -3.717 -6.516 -3.398 1.00 22.33 H new ATOM 0 HG22 THR A 3 -2.356 -6.225 -2.289 1.00 22.33 H new ATOM 0 HG23 THR A 3 -2.058 -6.919 -3.901 1.00 22.33 H new ATOM 41 N VAL A 4 0.042 -7.222 -1.260 1.00 70.04 N ATOM 42 CA VAL A 4 0.604 -6.137 -0.454 1.00 75.22 C ATOM 43 C VAL A 4 -0.035 -4.837 -0.951 1.00 43.21 C ATOM 44 O VAL A 4 0.167 -4.463 -2.107 1.00 20.41 O ATOM 45 CB VAL A 4 2.175 -6.053 -0.608 1.00 43.04 C ATOM 46 CG1 VAL A 4 2.777 -4.954 0.308 1.00 44.22 C ATOM 47 CG2 VAL A 4 2.828 -7.432 -0.350 1.00 72.13 C ATOM 0 H VAL A 4 0.499 -7.326 -2.166 1.00 70.04 H new ATOM 0 HA VAL A 4 0.395 -6.311 0.601 1.00 75.22 H new ATOM 0 HB VAL A 4 2.397 -5.769 -1.637 1.00 43.04 H new ATOM 0 HG11 VAL A 4 3.859 -4.923 0.177 1.00 44.22 H new ATOM 0 HG12 VAL A 4 2.352 -3.986 0.043 1.00 44.22 H new ATOM 0 HG13 VAL A 4 2.544 -5.180 1.349 1.00 44.22 H new ATOM 0 HG21 VAL A 4 3.909 -7.349 -0.462 1.00 72.13 H new ATOM 0 HG22 VAL A 4 2.592 -7.763 0.661 1.00 72.13 H new ATOM 0 HG23 VAL A 4 2.444 -8.157 -1.068 1.00 72.13 H new ATOM 57 N VAL A 5 -0.821 -4.172 -0.096 1.00 34.44 N ATOM 58 CA VAL A 5 -1.521 -2.922 -0.447 1.00 50.31 C ATOM 59 C VAL A 5 -0.830 -1.742 0.260 1.00 1.35 C ATOM 60 O VAL A 5 -0.399 -1.868 1.403 1.00 74.14 O ATOM 61 CB VAL A 5 -3.071 -2.990 -0.135 1.00 41.44 C ATOM 62 CG1 VAL A 5 -3.702 -4.247 -0.773 1.00 54.42 C ATOM 63 CG2 VAL A 5 -3.384 -2.951 1.367 1.00 51.05 C ATOM 0 H VAL A 5 -0.992 -4.482 0.860 1.00 34.44 H new ATOM 0 HA VAL A 5 -1.454 -2.773 -1.525 1.00 50.31 H new ATOM 0 HB VAL A 5 -3.511 -2.096 -0.577 1.00 41.44 H new ATOM 0 HG11 VAL A 5 -4.768 -4.274 -0.546 1.00 54.42 H new ATOM 0 HG12 VAL A 5 -3.562 -4.216 -1.853 1.00 54.42 H new ATOM 0 HG13 VAL A 5 -3.223 -5.139 -0.370 1.00 54.42 H new ATOM 0 HG21 VAL A 5 -4.463 -3.001 1.515 1.00 51.05 H new ATOM 0 HG22 VAL A 5 -2.910 -3.800 1.860 1.00 51.05 H new ATOM 0 HG23 VAL A 5 -3.001 -2.024 1.794 1.00 51.05 H new ATOM 73 N ILE A 6 -0.643 -0.628 -0.454 1.00 32.11 N ATOM 74 CA ILE A 6 0.127 0.528 0.039 1.00 3.22 C ATOM 75 C ILE A 6 -0.761 1.783 -0.027 1.00 21.44 C ATOM 76 O ILE A 6 -1.114 2.225 -1.117 1.00 4.51 O ATOM 77 CB ILE A 6 1.462 0.781 -0.788 1.00 71.43 C ATOM 78 CG1 ILE A 6 2.430 -0.467 -0.796 1.00 61.52 C ATOM 79 CG2 ILE A 6 2.202 2.027 -0.247 1.00 63.24 C ATOM 80 CD1 ILE A 6 2.092 -1.568 -1.801 1.00 72.43 C ATOM 0 H ILE A 6 -1.020 -0.498 -1.393 1.00 32.11 H new ATOM 0 HA ILE A 6 0.424 0.310 1.065 1.00 3.22 H new ATOM 0 HB ILE A 6 1.161 0.953 -1.821 1.00 71.43 H new ATOM 0 HG12 ILE A 6 3.442 -0.116 -0.998 1.00 61.52 H new ATOM 0 HG13 ILE A 6 2.437 -0.903 0.203 1.00 61.52 H new ATOM 0 HG21 ILE A 6 3.114 2.187 -0.823 1.00 63.24 H new ATOM 0 HG22 ILE A 6 1.557 2.901 -0.338 1.00 63.24 H new ATOM 0 HG23 ILE A 6 2.458 1.872 0.801 1.00 63.24 H new ATOM 0 HD11 ILE A 6 2.822 -2.373 -1.718 1.00 72.43 H new ATOM 0 HD12 ILE A 6 1.096 -1.958 -1.592 1.00 72.43 H new ATOM 0 HD13 ILE A 6 2.117 -1.159 -2.811 1.00 72.43 H new ATOM 92 N VAL A 7 -1.121 2.339 1.141 1.00 30.50 N ATOM 93 CA VAL A 7 -1.884 3.595 1.243 1.00 4.42 C ATOM 94 C VAL A 7 -0.907 4.767 1.248 1.00 64.03 C ATOM 95 O VAL A 7 -0.020 4.846 2.111 1.00 20.41 O ATOM 96 CB VAL A 7 -2.751 3.661 2.554 1.00 3.14 C ATOM 97 CG1 VAL A 7 -3.698 4.892 2.574 1.00 73.23 C ATOM 98 CG2 VAL A 7 -3.528 2.359 2.747 1.00 2.54 C ATOM 0 H VAL A 7 -0.890 1.928 2.046 1.00 30.50 H new ATOM 0 HA VAL A 7 -2.560 3.642 0.389 1.00 4.42 H new ATOM 0 HB VAL A 7 -2.066 3.783 3.393 1.00 3.14 H new ATOM 0 HG11 VAL A 7 -4.275 4.892 3.499 1.00 73.23 H new ATOM 0 HG12 VAL A 7 -3.108 5.806 2.514 1.00 73.23 H new ATOM 0 HG13 VAL A 7 -4.377 4.842 1.723 1.00 73.23 H new ATOM 0 HG21 VAL A 7 -4.122 2.422 3.658 1.00 2.54 H new ATOM 0 HG22 VAL A 7 -4.187 2.199 1.894 1.00 2.54 H new ATOM 0 HG23 VAL A 7 -2.829 1.526 2.826 1.00 2.54 H new ATOM 108 N VAL A 8 -1.059 5.659 0.265 1.00 43.24 N ATOM 109 CA VAL A 8 -0.273 6.888 0.160 1.00 73.50 C ATOM 110 C VAL A 8 -1.241 8.089 0.114 1.00 34.43 C ATOM 111 O VAL A 8 -2.361 7.980 -0.409 1.00 61.11 O ATOM 112 CB VAL A 8 0.658 6.906 -1.112 1.00 14.21 C ATOM 113 CG1 VAL A 8 1.718 8.029 -1.019 1.00 74.44 C ATOM 114 CG2 VAL A 8 1.310 5.527 -1.371 1.00 22.43 C ATOM 0 H VAL A 8 -1.739 5.545 -0.487 1.00 43.24 H new ATOM 0 HA VAL A 8 0.380 6.946 1.031 1.00 73.50 H new ATOM 0 HB VAL A 8 0.024 7.123 -1.972 1.00 14.21 H new ATOM 0 HG11 VAL A 8 2.343 8.014 -1.912 1.00 74.44 H new ATOM 0 HG12 VAL A 8 1.219 8.995 -0.942 1.00 74.44 H new ATOM 0 HG13 VAL A 8 2.340 7.871 -0.138 1.00 74.44 H new ATOM 0 HG21 VAL A 8 1.943 5.584 -2.256 1.00 22.43 H new ATOM 0 HG22 VAL A 8 1.915 5.243 -0.510 1.00 22.43 H new ATOM 0 HG23 VAL A 8 0.532 4.780 -1.529 1.00 22.43 H new ATOM 124 N SER A 9 -0.793 9.216 0.662 1.00 22.43 N ATOM 125 CA SER A 9 -1.559 10.474 0.695 1.00 23.52 C ATOM 126 C SER A 9 -0.582 11.645 0.833 1.00 51.34 C ATOM 127 O SER A 9 0.590 11.446 1.146 1.00 31.25 O ATOM 128 CB SER A 9 -2.584 10.457 1.861 1.00 21.23 C ATOM 129 OG SER A 9 -3.243 11.707 2.005 1.00 73.44 O ATOM 0 H SER A 9 0.124 9.289 1.103 1.00 22.43 H new ATOM 0 HA SER A 9 -2.122 10.587 -0.231 1.00 23.52 H new ATOM 0 HB2 SER A 9 -3.323 9.675 1.684 1.00 21.23 H new ATOM 0 HB3 SER A 9 -2.072 10.207 2.790 1.00 21.23 H new ATOM 0 HG SER A 9 -4.127 11.661 1.586 1.00 73.44 H new ATOM 135 N ASN A 10 -1.070 12.865 0.583 1.00 75.44 N ATOM 136 CA ASN A 10 -0.272 14.098 0.738 1.00 42.23 C ATOM 137 C ASN A 10 -0.374 14.653 2.177 1.00 63.41 C ATOM 138 O ASN A 10 0.310 15.619 2.524 1.00 1.32 O ATOM 139 CB ASN A 10 -0.722 15.148 -0.309 1.00 31.33 C ATOM 140 CG ASN A 10 -0.352 14.759 -1.745 1.00 4.43 C ATOM 141 OD1 ASN A 10 -1.097 14.058 -2.433 1.00 31.30 O ATOM 142 ND2 ASN A 10 0.804 15.221 -2.216 1.00 32.50 N ATOM 0 H ASN A 10 -2.026 13.031 0.268 1.00 75.44 H new ATOM 0 HA ASN A 10 0.777 13.862 0.562 1.00 42.23 H new ATOM 0 HB2 ASN A 10 -1.802 15.281 -0.241 1.00 31.33 H new ATOM 0 HB3 ASN A 10 -0.267 16.109 -0.070 1.00 31.33 H new ATOM 0 HD21 ASN A 10 1.093 14.997 -3.168 1.00 32.50 H new ATOM 0 HD22 ASN A 10 1.401 15.799 -1.625 1.00 32.50 H new ATOM 149 N ASP A 11 -1.206 13.999 3.012 1.00 10.54 N ATOM 150 CA ASP A 11 -1.448 14.393 4.420 1.00 24.41 C ATOM 151 C ASP A 11 -1.327 13.174 5.359 1.00 0.50 C ATOM 152 O ASP A 11 -1.623 12.042 4.961 1.00 13.30 O ATOM 153 CB ASP A 11 -2.854 15.041 4.537 1.00 21.32 C ATOM 154 CG ASP A 11 -3.269 15.394 5.980 1.00 24.33 C ATOM 155 OD1 ASP A 11 -2.622 16.264 6.607 1.00 52.33 O ATOM 156 OD2 ASP A 11 -4.230 14.803 6.496 1.00 35.40 O ATOM 0 H ASP A 11 -1.735 13.174 2.728 1.00 10.54 H new ATOM 0 HA ASP A 11 -0.693 15.119 4.723 1.00 24.41 H new ATOM 0 HB2 ASP A 11 -2.875 15.948 3.933 1.00 21.32 H new ATOM 0 HB3 ASP A 11 -3.592 14.359 4.115 1.00 21.32 H new ATOM 161 N GLU A 12 -0.909 13.442 6.615 1.00 42.04 N ATOM 162 CA GLU A 12 -0.724 12.411 7.659 1.00 0.44 C ATOM 163 C GLU A 12 -2.066 11.954 8.258 1.00 0.51 C ATOM 164 O GLU A 12 -2.240 10.772 8.507 1.00 54.43 O ATOM 165 CB GLU A 12 0.194 12.942 8.790 1.00 64.13 C ATOM 166 CG GLU A 12 1.659 13.154 8.372 1.00 20.40 C ATOM 167 CD GLU A 12 2.501 13.812 9.475 1.00 1.24 C ATOM 168 OE1 GLU A 12 3.046 13.090 10.337 1.00 75.11 O ATOM 169 OE2 GLU A 12 2.597 15.060 9.495 1.00 15.30 O ATOM 0 H GLU A 12 -0.689 14.385 6.935 1.00 42.04 H new ATOM 0 HA GLU A 12 -0.255 11.551 7.181 1.00 0.44 H new ATOM 0 HB2 GLU A 12 -0.208 13.888 9.154 1.00 64.13 H new ATOM 0 HB3 GLU A 12 0.165 12.241 9.624 1.00 64.13 H new ATOM 0 HG2 GLU A 12 2.100 12.193 8.109 1.00 20.40 H new ATOM 0 HG3 GLU A 12 1.691 13.775 7.477 1.00 20.40 H new ATOM 176 N ARG A 13 -3.008 12.900 8.481 1.00 72.31 N ATOM 177 CA ARG A 13 -4.297 12.603 9.169 1.00 44.12 C ATOM 178 C ARG A 13 -5.196 11.711 8.311 1.00 4.23 C ATOM 179 O ARG A 13 -6.058 11.014 8.840 1.00 24.11 O ATOM 180 CB ARG A 13 -5.084 13.881 9.578 1.00 51.40 C ATOM 181 CG ARG A 13 -4.481 14.702 10.744 1.00 63.01 C ATOM 182 CD ARG A 13 -3.168 15.419 10.393 1.00 71.11 C ATOM 183 NE ARG A 13 -2.690 16.261 11.502 1.00 42.24 N ATOM 184 CZ ARG A 13 -2.446 17.579 11.434 1.00 2.42 C ATOM 185 NH1 ARG A 13 -2.629 18.258 10.299 1.00 1.04 N ATOM 186 NH2 ARG A 13 -2.044 18.212 12.518 1.00 62.25 N ATOM 0 H ARG A 13 -2.905 13.874 8.197 1.00 72.31 H new ATOM 0 HA ARG A 13 -4.021 12.076 10.083 1.00 44.12 H new ATOM 0 HB2 ARG A 13 -5.164 14.530 8.706 1.00 51.40 H new ATOM 0 HB3 ARG A 13 -6.098 13.588 9.852 1.00 51.40 H new ATOM 0 HG2 ARG A 13 -5.212 15.443 11.068 1.00 63.01 H new ATOM 0 HG3 ARG A 13 -4.305 14.037 11.589 1.00 63.01 H new ATOM 0 HD2 ARG A 13 -2.406 14.680 10.143 1.00 71.11 H new ATOM 0 HD3 ARG A 13 -3.317 16.036 9.507 1.00 71.11 H new ATOM 0 HE ARG A 13 -2.531 15.803 12.399 1.00 42.24 H new ATOM 0 HH11 ARG A 13 -2.960 17.775 9.464 1.00 1.04 H new ATOM 0 HH12 ARG A 13 -2.438 19.259 10.267 1.00 1.04 H new ATOM 0 HH21 ARG A 13 -1.923 17.700 13.392 1.00 62.25 H new ATOM 0 HH22 ARG A 13 -1.854 19.214 12.483 1.00 62.25 H new ATOM 200 N ILE A 14 -5.021 11.792 6.983 1.00 4.02 N ATOM 201 CA ILE A 14 -5.668 10.873 6.042 1.00 25.23 C ATOM 202 C ILE A 14 -5.111 9.455 6.260 1.00 61.20 C ATOM 203 O ILE A 14 -5.867 8.511 6.367 1.00 14.01 O ATOM 204 CB ILE A 14 -5.473 11.344 4.550 1.00 52.24 C ATOM 205 CG1 ILE A 14 -6.046 12.783 4.359 1.00 54.52 C ATOM 206 CG2 ILE A 14 -6.107 10.363 3.531 1.00 61.05 C ATOM 207 CD1 ILE A 14 -7.526 12.948 4.690 1.00 31.34 C ATOM 0 H ILE A 14 -4.430 12.493 6.536 1.00 4.02 H new ATOM 0 HA ILE A 14 -6.742 10.868 6.230 1.00 25.23 H new ATOM 0 HB ILE A 14 -4.401 11.355 4.352 1.00 52.24 H new ATOM 0 HG12 ILE A 14 -5.473 13.469 4.982 1.00 54.52 H new ATOM 0 HG13 ILE A 14 -5.887 13.084 3.324 1.00 54.52 H new ATOM 0 HG21 ILE A 14 -5.944 10.734 2.519 1.00 61.05 H new ATOM 0 HG22 ILE A 14 -5.646 9.381 3.636 1.00 61.05 H new ATOM 0 HG23 ILE A 14 -7.177 10.283 3.720 1.00 61.05 H new ATOM 0 HD11 ILE A 14 -7.823 13.984 4.524 1.00 31.34 H new ATOM 0 HD12 ILE A 14 -8.117 12.294 4.049 1.00 31.34 H new ATOM 0 HD13 ILE A 14 -7.697 12.685 5.734 1.00 31.34 H new ATOM 219 N LEU A 15 -3.779 9.341 6.402 1.00 33.55 N ATOM 220 CA LEU A 15 -3.112 8.053 6.699 1.00 54.43 C ATOM 221 C LEU A 15 -3.520 7.509 8.088 1.00 43.44 C ATOM 222 O LEU A 15 -3.657 6.305 8.264 1.00 32.43 O ATOM 223 CB LEU A 15 -1.576 8.222 6.632 1.00 64.31 C ATOM 224 CG LEU A 15 -1.007 8.626 5.244 1.00 53.50 C ATOM 225 CD1 LEU A 15 0.487 8.982 5.342 1.00 50.22 C ATOM 226 CD2 LEU A 15 -1.265 7.517 4.198 1.00 25.54 C ATOM 0 H LEU A 15 -3.136 10.128 6.316 1.00 33.55 H new ATOM 0 HA LEU A 15 -3.432 7.332 5.947 1.00 54.43 H new ATOM 0 HB2 LEU A 15 -1.279 8.976 7.360 1.00 64.31 H new ATOM 0 HB3 LEU A 15 -1.111 7.284 6.937 1.00 64.31 H new ATOM 0 HG LEU A 15 -1.532 9.520 4.908 1.00 53.50 H new ATOM 0 HD11 LEU A 15 0.860 9.261 4.357 1.00 50.22 H new ATOM 0 HD12 LEU A 15 0.618 9.818 6.029 1.00 50.22 H new ATOM 0 HD13 LEU A 15 1.043 8.120 5.710 1.00 50.22 H new ATOM 0 HD21 LEU A 15 -0.857 7.824 3.235 1.00 25.54 H new ATOM 0 HD22 LEU A 15 -0.782 6.594 4.519 1.00 25.54 H new ATOM 0 HD23 LEU A 15 -2.338 7.350 4.102 1.00 25.54 H new ATOM 238 N GLU A 16 -3.727 8.422 9.057 1.00 22.14 N ATOM 239 CA GLU A 16 -4.069 8.066 10.451 1.00 60.31 C ATOM 240 C GLU A 16 -5.515 7.563 10.553 1.00 44.13 C ATOM 241 O GLU A 16 -5.768 6.522 11.151 1.00 10.30 O ATOM 242 CB GLU A 16 -3.850 9.281 11.387 1.00 14.55 C ATOM 243 CG GLU A 16 -2.379 9.713 11.512 1.00 62.14 C ATOM 244 CD GLU A 16 -2.191 10.943 12.404 1.00 2.30 C ATOM 245 OE1 GLU A 16 -2.050 10.786 13.637 1.00 73.44 O ATOM 246 OE2 GLU A 16 -2.197 12.077 11.885 1.00 53.33 O ATOM 0 H GLU A 16 -3.662 9.427 8.897 1.00 22.14 H new ATOM 0 HA GLU A 16 -3.409 7.258 10.766 1.00 60.31 H new ATOM 0 HB2 GLU A 16 -4.436 10.123 11.017 1.00 14.55 H new ATOM 0 HB3 GLU A 16 -4.233 9.038 12.378 1.00 14.55 H new ATOM 0 HG2 GLU A 16 -1.796 8.885 11.916 1.00 62.14 H new ATOM 0 HG3 GLU A 16 -1.983 9.927 10.519 1.00 62.14 H new ATOM 253 N GLU A 17 -6.442 8.309 9.941 1.00 40.03 N ATOM 254 CA GLU A 17 -7.880 7.988 9.940 1.00 3.14 C ATOM 255 C GLU A 17 -8.143 6.690 9.151 1.00 24.13 C ATOM 256 O GLU A 17 -8.856 5.798 9.622 1.00 14.34 O ATOM 257 CB GLU A 17 -8.663 9.178 9.339 1.00 33.31 C ATOM 258 CG GLU A 17 -10.191 9.012 9.319 1.00 23.13 C ATOM 259 CD GLU A 17 -10.897 10.243 8.738 1.00 41.10 C ATOM 260 OE1 GLU A 17 -10.876 10.413 7.501 1.00 1.44 O ATOM 261 OE2 GLU A 17 -11.475 11.048 9.502 1.00 13.22 O ATOM 0 H GLU A 17 -6.216 9.161 9.427 1.00 40.03 H new ATOM 0 HA GLU A 17 -8.220 7.823 10.962 1.00 3.14 H new ATOM 0 HB2 GLU A 17 -8.418 10.077 9.906 1.00 33.31 H new ATOM 0 HB3 GLU A 17 -8.318 9.341 8.318 1.00 33.31 H new ATOM 0 HG2 GLU A 17 -10.452 8.133 8.730 1.00 23.13 H new ATOM 0 HG3 GLU A 17 -10.549 8.834 10.333 1.00 23.13 H new ATOM 268 N LEU A 18 -7.519 6.600 7.965 1.00 64.21 N ATOM 269 CA LEU A 18 -7.616 5.426 7.074 1.00 15.10 C ATOM 270 C LEU A 18 -6.910 4.202 7.697 1.00 1.52 C ATOM 271 O LEU A 18 -7.295 3.068 7.406 1.00 71.15 O ATOM 272 CB LEU A 18 -7.062 5.752 5.649 1.00 34.33 C ATOM 273 CG LEU A 18 -8.052 6.464 4.649 1.00 74.15 C ATOM 274 CD1 LEU A 18 -8.664 7.764 5.217 1.00 71.13 C ATOM 275 CD2 LEU A 18 -7.362 6.725 3.291 1.00 50.25 C ATOM 0 H LEU A 18 -6.928 7.344 7.593 1.00 64.21 H new ATOM 0 HA LEU A 18 -8.670 5.173 6.960 1.00 15.10 H new ATOM 0 HB2 LEU A 18 -6.181 6.384 5.763 1.00 34.33 H new ATOM 0 HB3 LEU A 18 -6.729 4.820 5.192 1.00 34.33 H new ATOM 0 HG LEU A 18 -8.885 5.778 4.498 1.00 74.15 H new ATOM 0 HD11 LEU A 18 -9.335 8.203 4.479 1.00 71.13 H new ATOM 0 HD12 LEU A 18 -9.222 7.537 6.125 1.00 71.13 H new ATOM 0 HD13 LEU A 18 -7.867 8.471 5.448 1.00 71.13 H new ATOM 0 HD21 LEU A 18 -8.062 7.217 2.616 1.00 50.25 H new ATOM 0 HD22 LEU A 18 -6.493 7.365 3.442 1.00 50.25 H new ATOM 0 HD23 LEU A 18 -7.044 5.777 2.857 1.00 50.25 H new ATOM 287 N LEU A 19 -5.876 4.444 8.548 1.00 31.04 N ATOM 288 CA LEU A 19 -5.219 3.377 9.338 1.00 13.31 C ATOM 289 C LEU A 19 -6.260 2.663 10.194 1.00 60.31 C ATOM 290 O LEU A 19 -6.437 1.456 10.097 1.00 51.40 O ATOM 291 CB LEU A 19 -4.114 3.951 10.271 1.00 10.14 C ATOM 292 CG LEU A 19 -3.319 2.897 11.125 1.00 64.21 C ATOM 293 CD1 LEU A 19 -2.150 2.290 10.333 1.00 20.23 C ATOM 294 CD2 LEU A 19 -2.844 3.482 12.469 1.00 74.31 C ATOM 0 H LEU A 19 -5.482 5.372 8.701 1.00 31.04 H new ATOM 0 HA LEU A 19 -4.755 2.683 8.637 1.00 13.31 H new ATOM 0 HB2 LEU A 19 -3.402 4.506 9.660 1.00 10.14 H new ATOM 0 HB3 LEU A 19 -4.576 4.667 10.951 1.00 10.14 H new ATOM 0 HG LEU A 19 -4.014 2.089 11.355 1.00 64.21 H new ATOM 0 HD11 LEU A 19 -1.625 1.566 10.957 1.00 20.23 H new ATOM 0 HD12 LEU A 19 -2.534 1.791 9.443 1.00 20.23 H new ATOM 0 HD13 LEU A 19 -1.461 3.081 10.037 1.00 20.23 H new ATOM 0 HD21 LEU A 19 -2.300 2.719 13.026 1.00 74.31 H new ATOM 0 HD22 LEU A 19 -2.189 4.333 12.284 1.00 74.31 H new ATOM 0 HD23 LEU A 19 -3.707 3.808 13.049 1.00 74.31 H new ATOM 306 N GLU A 20 -6.982 3.477 10.969 1.00 35.12 N ATOM 307 CA GLU A 20 -7.982 3.023 11.936 1.00 14.45 C ATOM 308 C GLU A 20 -9.130 2.259 11.237 1.00 31.25 C ATOM 309 O GLU A 20 -9.686 1.320 11.805 1.00 0.21 O ATOM 310 CB GLU A 20 -8.506 4.251 12.711 1.00 64.22 C ATOM 311 CG GLU A 20 -7.393 5.076 13.401 1.00 20.33 C ATOM 312 CD GLU A 20 -7.909 6.375 14.039 1.00 3.42 C ATOM 313 OE1 GLU A 20 -8.400 7.248 13.295 1.00 1.24 O ATOM 314 OE2 GLU A 20 -7.849 6.519 15.285 1.00 72.21 O ATOM 0 H GLU A 20 -6.885 4.492 10.940 1.00 35.12 H new ATOM 0 HA GLU A 20 -7.526 2.323 12.636 1.00 14.45 H new ATOM 0 HB2 GLU A 20 -9.051 4.897 12.023 1.00 64.22 H new ATOM 0 HB3 GLU A 20 -9.218 3.916 13.466 1.00 64.22 H new ATOM 0 HG2 GLU A 20 -6.920 4.465 14.169 1.00 20.33 H new ATOM 0 HG3 GLU A 20 -6.623 5.319 12.669 1.00 20.33 H new ATOM 321 N VAL A 21 -9.434 2.662 9.982 1.00 44.24 N ATOM 322 CA VAL A 21 -10.444 1.999 9.134 1.00 61.33 C ATOM 323 C VAL A 21 -9.998 0.568 8.763 1.00 65.31 C ATOM 324 O VAL A 21 -10.793 -0.373 8.853 1.00 32.44 O ATOM 325 CB VAL A 21 -10.759 2.843 7.840 1.00 53.12 C ATOM 326 CG1 VAL A 21 -11.758 2.123 6.899 1.00 74.45 C ATOM 327 CG2 VAL A 21 -11.288 4.244 8.230 1.00 40.20 C ATOM 0 H VAL A 21 -8.983 3.458 9.531 1.00 44.24 H new ATOM 0 HA VAL A 21 -11.365 1.930 9.713 1.00 61.33 H new ATOM 0 HB VAL A 21 -9.826 2.955 7.288 1.00 53.12 H new ATOM 0 HG11 VAL A 21 -11.944 2.743 6.022 1.00 74.45 H new ATOM 0 HG12 VAL A 21 -11.338 1.167 6.585 1.00 74.45 H new ATOM 0 HG13 VAL A 21 -12.696 1.951 7.427 1.00 74.45 H new ATOM 0 HG21 VAL A 21 -11.502 4.817 7.327 1.00 40.20 H new ATOM 0 HG22 VAL A 21 -12.200 4.138 8.817 1.00 40.20 H new ATOM 0 HG23 VAL A 21 -10.535 4.766 8.821 1.00 40.20 H new ATOM 337 N VAL A 22 -8.718 0.421 8.372 1.00 40.34 N ATOM 338 CA VAL A 22 -8.117 -0.889 8.045 1.00 52.01 C ATOM 339 C VAL A 22 -8.042 -1.790 9.307 1.00 3.11 C ATOM 340 O VAL A 22 -8.336 -2.985 9.241 1.00 24.44 O ATOM 341 CB VAL A 22 -6.681 -0.710 7.427 1.00 74.40 C ATOM 342 CG1 VAL A 22 -6.032 -2.070 7.115 1.00 35.45 C ATOM 343 CG2 VAL A 22 -6.720 0.170 6.155 1.00 1.03 C ATOM 0 H VAL A 22 -8.072 1.204 8.274 1.00 40.34 H new ATOM 0 HA VAL A 22 -8.756 -1.373 7.306 1.00 52.01 H new ATOM 0 HB VAL A 22 -6.071 -0.203 8.174 1.00 74.40 H new ATOM 0 HG11 VAL A 22 -5.041 -1.911 6.689 1.00 35.45 H new ATOM 0 HG12 VAL A 22 -5.944 -2.650 8.033 1.00 35.45 H new ATOM 0 HG13 VAL A 22 -6.651 -2.613 6.401 1.00 35.45 H new ATOM 0 HG21 VAL A 22 -5.712 0.274 5.753 1.00 1.03 H new ATOM 0 HG22 VAL A 22 -7.362 -0.298 5.408 1.00 1.03 H new ATOM 0 HG23 VAL A 22 -7.114 1.155 6.406 1.00 1.03 H new ATOM 353 N LEU A 23 -7.674 -1.179 10.449 1.00 71.13 N ATOM 354 CA LEU A 23 -7.536 -1.876 11.750 1.00 41.31 C ATOM 355 C LEU A 23 -8.874 -2.494 12.208 1.00 53.13 C ATOM 356 O LEU A 23 -8.917 -3.647 12.655 1.00 53.25 O ATOM 357 CB LEU A 23 -6.963 -0.892 12.829 1.00 72.33 C ATOM 358 CG LEU A 23 -5.404 -0.868 12.982 1.00 71.44 C ATOM 359 CD1 LEU A 23 -4.696 -0.620 11.650 1.00 23.43 C ATOM 360 CD2 LEU A 23 -4.961 0.163 14.036 1.00 43.10 C ATOM 0 H LEU A 23 -7.462 -0.183 10.499 1.00 71.13 H new ATOM 0 HA LEU A 23 -6.833 -2.700 11.624 1.00 41.31 H new ATOM 0 HB2 LEU A 23 -7.299 0.116 12.587 1.00 72.33 H new ATOM 0 HB3 LEU A 23 -7.398 -1.150 13.794 1.00 72.33 H new ATOM 0 HG LEU A 23 -5.108 -1.859 13.327 1.00 71.44 H new ATOM 0 HD11 LEU A 23 -3.617 -0.612 11.807 1.00 23.43 H new ATOM 0 HD12 LEU A 23 -4.955 -1.412 10.947 1.00 23.43 H new ATOM 0 HD13 LEU A 23 -5.011 0.342 11.244 1.00 23.43 H new ATOM 0 HD21 LEU A 23 -3.874 0.155 14.118 1.00 43.10 H new ATOM 0 HD22 LEU A 23 -5.295 1.156 13.736 1.00 43.10 H new ATOM 0 HD23 LEU A 23 -5.400 -0.091 15.001 1.00 43.10 H new ATOM 372 N LYS A 24 -9.963 -1.717 12.080 1.00 22.00 N ATOM 373 CA LYS A 24 -11.313 -2.156 12.491 1.00 65.12 C ATOM 374 C LYS A 24 -11.963 -3.051 11.418 1.00 14.31 C ATOM 375 O LYS A 24 -12.932 -3.758 11.703 1.00 62.50 O ATOM 376 CB LYS A 24 -12.209 -0.929 12.819 1.00 45.01 C ATOM 377 CG LYS A 24 -12.589 -0.046 11.610 1.00 4.32 C ATOM 378 CD LYS A 24 -13.315 1.254 12.026 1.00 72.23 C ATOM 379 CE LYS A 24 -13.797 2.088 10.827 1.00 41.20 C ATOM 380 NZ LYS A 24 -14.338 3.403 11.259 1.00 71.14 N ATOM 0 H LYS A 24 -9.936 -0.774 11.692 1.00 22.00 H new ATOM 0 HA LYS A 24 -11.213 -2.755 13.396 1.00 65.12 H new ATOM 0 HB2 LYS A 24 -13.125 -1.285 13.290 1.00 45.01 H new ATOM 0 HB3 LYS A 24 -11.693 -0.309 13.553 1.00 45.01 H new ATOM 0 HG2 LYS A 24 -11.687 0.209 11.053 1.00 4.32 H new ATOM 0 HG3 LYS A 24 -13.229 -0.615 10.936 1.00 4.32 H new ATOM 0 HD2 LYS A 24 -14.171 1.000 12.652 1.00 72.23 H new ATOM 0 HD3 LYS A 24 -12.643 1.859 12.635 1.00 72.23 H new ATOM 0 HE2 LYS A 24 -12.969 2.244 10.135 1.00 41.20 H new ATOM 0 HE3 LYS A 24 -14.566 1.537 10.285 1.00 41.20 H new ATOM 0 HZ1 LYS A 24 -14.654 3.939 10.426 1.00 71.14 H new ATOM 0 HZ2 LYS A 24 -15.143 3.253 11.900 1.00 71.14 H new ATOM 0 HZ3 LYS A 24 -13.596 3.938 11.754 1.00 71.14 H new ATOM 394 N SER A 25 -11.422 -2.997 10.184 1.00 41.21 N ATOM 395 CA SER A 25 -11.839 -3.880 9.082 1.00 21.30 C ATOM 396 C SER A 25 -11.327 -5.307 9.333 1.00 13.40 C ATOM 397 O SER A 25 -12.074 -6.281 9.175 1.00 40.22 O ATOM 398 CB SER A 25 -11.308 -3.345 7.732 1.00 54.32 C ATOM 399 OG SER A 25 -11.714 -4.162 6.639 1.00 1.32 O ATOM 0 H SER A 25 -10.685 -2.340 9.926 1.00 41.21 H new ATOM 0 HA SER A 25 -12.928 -3.899 9.038 1.00 21.30 H new ATOM 0 HB2 SER A 25 -11.668 -2.328 7.578 1.00 54.32 H new ATOM 0 HB3 SER A 25 -10.220 -3.296 7.764 1.00 54.32 H new ATOM 0 HG SER A 25 -12.641 -4.450 6.773 1.00 1.32 H new ATOM 405 N ASP A 26 -10.049 -5.401 9.737 1.00 32.12 N ATOM 406 CA ASP A 26 -9.394 -6.667 10.095 1.00 22.42 C ATOM 407 C ASP A 26 -8.074 -6.349 10.849 1.00 44.13 C ATOM 408 O ASP A 26 -7.171 -5.741 10.262 1.00 72.23 O ATOM 409 CB ASP A 26 -9.110 -7.535 8.832 1.00 22.12 C ATOM 410 CG ASP A 26 -8.659 -8.966 9.175 1.00 0.43 C ATOM 411 OD1 ASP A 26 -7.491 -9.164 9.570 1.00 33.25 O ATOM 412 OD2 ASP A 26 -9.486 -9.901 9.081 1.00 34.52 O ATOM 0 H ASP A 26 -9.436 -4.590 9.825 1.00 32.12 H new ATOM 0 HA ASP A 26 -10.058 -7.244 10.739 1.00 22.42 H new ATOM 0 HB2 ASP A 26 -10.010 -7.581 8.219 1.00 22.12 H new ATOM 0 HB3 ASP A 26 -8.340 -7.051 8.231 1.00 22.12 H new ATOM 417 N PRO A 27 -7.949 -6.737 12.160 1.00 72.22 N ATOM 418 CA PRO A 27 -6.752 -6.418 12.983 1.00 31.13 C ATOM 419 C PRO A 27 -5.523 -7.329 12.727 1.00 11.21 C ATOM 420 O PRO A 27 -4.429 -7.028 13.214 1.00 1.12 O ATOM 421 CB PRO A 27 -7.288 -6.579 14.427 1.00 61.33 C ATOM 422 CG PRO A 27 -8.341 -7.643 14.326 1.00 65.13 C ATOM 423 CD PRO A 27 -8.979 -7.471 12.956 1.00 60.34 C ATOM 0 HA PRO A 27 -6.360 -5.428 12.749 1.00 31.13 H new ATOM 0 HB2 PRO A 27 -6.494 -6.872 15.114 1.00 61.33 H new ATOM 0 HB3 PRO A 27 -7.705 -5.644 14.801 1.00 61.33 H new ATOM 0 HG2 PRO A 27 -7.904 -8.636 14.431 1.00 65.13 H new ATOM 0 HG3 PRO A 27 -9.082 -7.535 15.118 1.00 65.13 H new ATOM 0 HD2 PRO A 27 -9.219 -8.434 12.505 1.00 60.34 H new ATOM 0 HD3 PRO A 27 -9.910 -6.907 13.018 1.00 60.34 H new ATOM 431 N ASN A 28 -5.701 -8.444 11.982 1.00 42.34 N ATOM 432 CA ASN A 28 -4.597 -9.382 11.660 1.00 51.32 C ATOM 433 C ASN A 28 -3.777 -8.825 10.480 1.00 25.11 C ATOM 434 O ASN A 28 -2.550 -8.995 10.434 1.00 15.11 O ATOM 435 CB ASN A 28 -5.160 -10.793 11.331 1.00 13.00 C ATOM 436 CG ASN A 28 -4.137 -11.934 11.412 1.00 13.24 C ATOM 437 OD1 ASN A 28 -2.935 -11.756 11.220 1.00 10.03 O ATOM 438 ND2 ASN A 28 -4.618 -13.134 11.690 1.00 71.01 N ATOM 0 H ASN A 28 -6.602 -8.718 11.590 1.00 42.34 H new ATOM 0 HA ASN A 28 -3.943 -9.480 12.526 1.00 51.32 H new ATOM 0 HB2 ASN A 28 -5.979 -11.010 12.017 1.00 13.00 H new ATOM 0 HB3 ASN A 28 -5.582 -10.774 10.326 1.00 13.00 H new ATOM 0 HD21 ASN A 28 -3.989 -13.935 11.749 1.00 71.01 H new ATOM 0 HD22 ASN A 28 -5.618 -13.259 11.846 1.00 71.01 H new ATOM 445 N VAL A 29 -4.476 -8.159 9.529 1.00 3.45 N ATOM 446 CA VAL A 29 -3.839 -7.450 8.405 1.00 1.15 C ATOM 447 C VAL A 29 -2.918 -6.342 8.955 1.00 45.31 C ATOM 448 O VAL A 29 -3.388 -5.271 9.370 1.00 5.52 O ATOM 449 CB VAL A 29 -4.905 -6.842 7.412 1.00 1.23 C ATOM 450 CG1 VAL A 29 -4.231 -6.067 6.257 1.00 75.10 C ATOM 451 CG2 VAL A 29 -5.826 -7.941 6.848 1.00 22.33 C ATOM 0 H VAL A 29 -5.494 -8.101 9.524 1.00 3.45 H new ATOM 0 HA VAL A 29 -3.249 -8.170 7.838 1.00 1.15 H new ATOM 0 HB VAL A 29 -5.511 -6.138 7.983 1.00 1.23 H new ATOM 0 HG11 VAL A 29 -4.996 -5.663 5.594 1.00 75.10 H new ATOM 0 HG12 VAL A 29 -3.637 -5.250 6.665 1.00 75.10 H new ATOM 0 HG13 VAL A 29 -3.584 -6.741 5.696 1.00 75.10 H new ATOM 0 HG21 VAL A 29 -6.551 -7.494 6.167 1.00 22.33 H new ATOM 0 HG22 VAL A 29 -5.228 -8.676 6.310 1.00 22.33 H new ATOM 0 HG23 VAL A 29 -6.352 -8.431 7.667 1.00 22.33 H new ATOM 461 N LYS A 30 -1.610 -6.650 9.008 1.00 25.14 N ATOM 462 CA LYS A 30 -0.608 -5.776 9.622 1.00 40.01 C ATOM 463 C LYS A 30 -0.355 -4.526 8.775 1.00 75.20 C ATOM 464 O LYS A 30 0.190 -4.600 7.673 1.00 73.54 O ATOM 465 CB LYS A 30 0.712 -6.541 9.876 1.00 44.31 C ATOM 466 CG LYS A 30 0.622 -7.616 10.978 1.00 24.12 C ATOM 467 CD LYS A 30 0.212 -7.047 12.352 1.00 22.33 C ATOM 468 CE LYS A 30 1.208 -6.004 12.903 1.00 11.32 C ATOM 469 NZ LYS A 30 0.754 -5.457 14.212 1.00 34.11 N ATOM 0 H LYS A 30 -1.223 -7.513 8.625 1.00 25.14 H new ATOM 0 HA LYS A 30 -1.006 -5.449 10.583 1.00 40.01 H new ATOM 0 HB2 LYS A 30 1.027 -7.016 8.947 1.00 44.31 H new ATOM 0 HB3 LYS A 30 1.487 -5.824 10.147 1.00 44.31 H new ATOM 0 HG2 LYS A 30 -0.099 -8.376 10.677 1.00 24.12 H new ATOM 0 HG3 LYS A 30 1.588 -8.113 11.071 1.00 24.12 H new ATOM 0 HD2 LYS A 30 -0.774 -6.589 12.268 1.00 22.33 H new ATOM 0 HD3 LYS A 30 0.123 -7.867 13.065 1.00 22.33 H new ATOM 0 HE2 LYS A 30 2.190 -6.463 13.020 1.00 11.32 H new ATOM 0 HE3 LYS A 30 1.319 -5.191 12.186 1.00 11.32 H new ATOM 0 HZ1 LYS A 30 1.445 -4.759 14.555 1.00 34.11 H new ATOM 0 HZ2 LYS A 30 -0.172 -4.998 14.094 1.00 34.11 H new ATOM 0 HZ3 LYS A 30 0.672 -6.231 14.902 1.00 34.11 H new ATOM 483 N THR A 31 -0.812 -3.398 9.304 1.00 44.12 N ATOM 484 CA THR A 31 -0.519 -2.075 8.783 1.00 51.43 C ATOM 485 C THR A 31 0.821 -1.609 9.348 1.00 61.34 C ATOM 486 O THR A 31 1.047 -1.695 10.563 1.00 71.12 O ATOM 487 CB THR A 31 -1.632 -1.080 9.195 1.00 61.12 C ATOM 488 OG1 THR A 31 -1.691 -0.980 10.629 1.00 62.03 O ATOM 489 CG2 THR A 31 -3.002 -1.529 8.677 1.00 2.41 C ATOM 0 H THR A 31 -1.412 -3.381 10.129 1.00 44.12 H new ATOM 0 HA THR A 31 -0.472 -2.115 7.695 1.00 51.43 H new ATOM 0 HB THR A 31 -1.390 -0.112 8.756 1.00 61.12 H new ATOM 0 HG1 THR A 31 -0.804 -1.157 11.006 1.00 62.03 H new ATOM 0 HG21 THR A 31 -3.761 -0.809 8.983 1.00 2.41 H new ATOM 0 HG22 THR A 31 -2.978 -1.590 7.589 1.00 2.41 H new ATOM 0 HG23 THR A 31 -3.244 -2.509 9.090 1.00 2.41 H new ATOM 497 N VAL A 32 1.725 -1.166 8.471 1.00 40.12 N ATOM 498 CA VAL A 32 3.064 -0.726 8.860 1.00 61.13 C ATOM 499 C VAL A 32 3.333 0.646 8.227 1.00 43.13 C ATOM 500 O VAL A 32 3.423 0.760 7.001 1.00 11.11 O ATOM 501 CB VAL A 32 4.169 -1.761 8.397 1.00 40.12 C ATOM 502 CG1 VAL A 32 5.558 -1.370 8.950 1.00 0.24 C ATOM 503 CG2 VAL A 32 3.794 -3.214 8.795 1.00 13.24 C ATOM 0 H VAL A 32 1.547 -1.103 7.469 1.00 40.12 H new ATOM 0 HA VAL A 32 3.112 -0.658 9.947 1.00 61.13 H new ATOM 0 HB VAL A 32 4.218 -1.726 7.309 1.00 40.12 H new ATOM 0 HG11 VAL A 32 6.300 -2.097 8.618 1.00 0.24 H new ATOM 0 HG12 VAL A 32 5.830 -0.380 8.583 1.00 0.24 H new ATOM 0 HG13 VAL A 32 5.525 -1.357 10.039 1.00 0.24 H new ATOM 0 HG21 VAL A 32 4.576 -3.896 8.461 1.00 13.24 H new ATOM 0 HG22 VAL A 32 3.694 -3.280 9.878 1.00 13.24 H new ATOM 0 HG23 VAL A 32 2.849 -3.487 8.326 1.00 13.24 H new ATOM 513 N ARG A 33 3.429 1.686 9.064 1.00 3.53 N ATOM 514 CA ARG A 33 3.843 3.022 8.636 1.00 63.22 C ATOM 515 C ARG A 33 5.360 3.136 8.829 1.00 53.52 C ATOM 516 O ARG A 33 5.834 3.255 9.966 1.00 44.10 O ATOM 517 CB ARG A 33 3.105 4.125 9.451 1.00 3.54 C ATOM 518 CG ARG A 33 3.512 5.568 9.068 1.00 11.00 C ATOM 519 CD ARG A 33 2.865 6.656 9.947 1.00 61.22 C ATOM 520 NE ARG A 33 3.346 7.996 9.559 1.00 53.22 N ATOM 521 CZ ARG A 33 3.116 9.141 10.225 1.00 12.42 C ATOM 522 NH1 ARG A 33 2.399 9.159 11.349 1.00 72.33 N ATOM 523 NH2 ARG A 33 3.617 10.274 9.749 1.00 74.32 N ATOM 0 H ARG A 33 3.220 1.621 10.060 1.00 3.53 H new ATOM 0 HA ARG A 33 3.584 3.168 7.587 1.00 63.22 H new ATOM 0 HB2 ARG A 33 2.031 4.011 9.307 1.00 3.54 H new ATOM 0 HB3 ARG A 33 3.303 3.972 10.512 1.00 3.54 H new ATOM 0 HG2 ARG A 33 4.596 5.659 9.135 1.00 11.00 H new ATOM 0 HG3 ARG A 33 3.241 5.747 8.028 1.00 11.00 H new ATOM 0 HD2 ARG A 33 1.780 6.611 9.850 1.00 61.22 H new ATOM 0 HD3 ARG A 33 3.099 6.470 10.995 1.00 61.22 H new ATOM 0 HE ARG A 33 3.904 8.059 8.708 1.00 53.22 H new ATOM 0 HH11 ARG A 33 2.012 8.292 11.721 1.00 72.33 H new ATOM 0 HH12 ARG A 33 2.238 10.040 11.837 1.00 72.33 H new ATOM 0 HH21 ARG A 33 4.167 10.267 8.890 1.00 74.32 H new ATOM 0 HH22 ARG A 33 3.452 11.152 10.242 1.00 74.32 H new ATOM 537 N THR A 34 6.113 3.037 7.728 1.00 32.43 N ATOM 538 CA THR A 34 7.569 3.198 7.740 1.00 55.32 C ATOM 539 C THR A 34 8.066 3.593 6.343 1.00 5.41 C ATOM 540 O THR A 34 7.571 3.093 5.324 1.00 71.24 O ATOM 541 CB THR A 34 8.317 1.914 8.266 1.00 55.13 C ATOM 542 OG1 THR A 34 9.719 2.182 8.423 1.00 34.33 O ATOM 543 CG2 THR A 34 8.137 0.690 7.348 1.00 31.35 C ATOM 0 H THR A 34 5.729 2.843 6.803 1.00 32.43 H new ATOM 0 HA THR A 34 7.804 3.998 8.442 1.00 55.32 H new ATOM 0 HB THR A 34 7.865 1.672 9.228 1.00 55.13 H new ATOM 0 HG1 THR A 34 10.079 1.629 9.147 1.00 34.33 H new ATOM 0 HG21 THR A 34 8.676 -0.160 7.766 1.00 31.35 H new ATOM 0 HG22 THR A 34 7.078 0.446 7.271 1.00 31.35 H new ATOM 0 HG23 THR A 34 8.530 0.917 6.357 1.00 31.35 H new ATOM 551 N ASP A 35 9.022 4.531 6.319 1.00 44.42 N ATOM 552 CA ASP A 35 9.709 4.973 5.098 1.00 25.25 C ATOM 553 C ASP A 35 10.795 3.946 4.711 1.00 11.31 C ATOM 554 O ASP A 35 11.157 3.822 3.535 1.00 21.44 O ATOM 555 CB ASP A 35 10.323 6.378 5.347 1.00 1.33 C ATOM 556 CG ASP A 35 11.071 6.960 4.130 1.00 74.53 C ATOM 557 OD1 ASP A 35 10.409 7.492 3.209 1.00 3.03 O ATOM 558 OD2 ASP A 35 12.327 6.910 4.094 1.00 65.25 O ATOM 0 H ASP A 35 9.345 5.011 7.159 1.00 44.42 H new ATOM 0 HA ASP A 35 9.004 5.042 4.270 1.00 25.25 H new ATOM 0 HB2 ASP A 35 9.527 7.065 5.634 1.00 1.33 H new ATOM 0 HB3 ASP A 35 11.012 6.318 6.189 1.00 1.33 H new ATOM 563 N ASP A 36 11.274 3.188 5.722 1.00 34.22 N ATOM 564 CA ASP A 36 12.359 2.208 5.559 1.00 2.14 C ATOM 565 C ASP A 36 11.909 1.019 4.708 1.00 45.53 C ATOM 566 O ASP A 36 11.115 0.192 5.168 1.00 30.42 O ATOM 567 CB ASP A 36 12.855 1.709 6.942 1.00 34.02 C ATOM 568 CG ASP A 36 13.529 2.819 7.749 1.00 34.01 C ATOM 569 OD1 ASP A 36 12.822 3.564 8.457 1.00 21.23 O ATOM 570 OD2 ASP A 36 14.765 2.966 7.665 1.00 73.11 O ATOM 0 H ASP A 36 10.915 3.242 6.675 1.00 34.22 H new ATOM 0 HA ASP A 36 13.180 2.707 5.045 1.00 2.14 H new ATOM 0 HB2 ASP A 36 12.012 1.312 7.507 1.00 34.02 H new ATOM 0 HB3 ASP A 36 13.558 0.888 6.799 1.00 34.02 H new ATOM 575 N LYS A 37 12.445 0.941 3.472 1.00 40.21 N ATOM 576 CA LYS A 37 12.174 -0.166 2.534 1.00 74.21 C ATOM 577 C LYS A 37 12.605 -1.506 3.139 1.00 22.45 C ATOM 578 O LYS A 37 11.926 -2.513 2.958 1.00 31.33 O ATOM 579 CB LYS A 37 12.903 0.075 1.183 1.00 54.53 C ATOM 580 CG LYS A 37 14.444 -0.022 1.218 1.00 2.42 C ATOM 581 CD LYS A 37 15.122 0.577 -0.040 1.00 24.53 C ATOM 582 CE LYS A 37 15.270 2.100 0.016 1.00 5.41 C ATOM 583 NZ LYS A 37 16.045 2.625 -1.144 1.00 32.03 N ATOM 0 H LYS A 37 13.079 1.646 3.097 1.00 40.21 H new ATOM 0 HA LYS A 37 11.100 -0.201 2.349 1.00 74.21 H new ATOM 0 HB2 LYS A 37 12.530 -0.648 0.458 1.00 54.53 H new ATOM 0 HB3 LYS A 37 12.629 1.064 0.817 1.00 54.53 H new ATOM 0 HG2 LYS A 37 14.814 0.495 2.103 1.00 2.42 H new ATOM 0 HG3 LYS A 37 14.734 -1.068 1.316 1.00 2.42 H new ATOM 0 HD2 LYS A 37 16.108 0.128 -0.161 1.00 24.53 H new ATOM 0 HD3 LYS A 37 14.539 0.308 -0.921 1.00 24.53 H new ATOM 0 HE2 LYS A 37 14.282 2.561 0.031 1.00 5.41 H new ATOM 0 HE3 LYS A 37 15.768 2.383 0.943 1.00 5.41 H new ATOM 0 HZ1 LYS A 37 16.123 3.659 -1.070 1.00 32.03 H new ATOM 0 HZ2 LYS A 37 16.996 2.205 -1.145 1.00 32.03 H new ATOM 0 HZ3 LYS A 37 15.557 2.377 -2.028 1.00 32.03 H new ATOM 597 N GLU A 38 13.718 -1.465 3.907 1.00 1.03 N ATOM 598 CA GLU A 38 14.305 -2.641 4.550 1.00 22.12 C ATOM 599 C GLU A 38 13.287 -3.307 5.498 1.00 45.11 C ATOM 600 O GLU A 38 13.166 -4.529 5.514 1.00 43.14 O ATOM 601 CB GLU A 38 15.600 -2.251 5.318 1.00 21.25 C ATOM 602 CG GLU A 38 15.398 -1.230 6.461 1.00 62.31 C ATOM 603 CD GLU A 38 16.620 -1.100 7.382 1.00 53.31 C ATOM 604 OE1 GLU A 38 16.768 -1.941 8.297 1.00 34.11 O ATOM 605 OE2 GLU A 38 17.442 -0.182 7.189 1.00 75.31 O ATOM 0 H GLU A 38 14.231 -0.603 4.093 1.00 1.03 H new ATOM 0 HA GLU A 38 14.569 -3.361 3.776 1.00 22.12 H new ATOM 0 HB2 GLU A 38 16.045 -3.155 5.733 1.00 21.25 H new ATOM 0 HB3 GLU A 38 16.317 -1.841 4.607 1.00 21.25 H new ATOM 0 HG2 GLU A 38 15.170 -0.255 6.031 1.00 62.31 H new ATOM 0 HG3 GLU A 38 14.534 -1.527 7.055 1.00 62.31 H new ATOM 612 N LYS A 39 12.526 -2.466 6.238 1.00 71.10 N ATOM 613 CA LYS A 39 11.506 -2.933 7.170 1.00 24.41 C ATOM 614 C LYS A 39 10.277 -3.439 6.404 1.00 4.25 C ATOM 615 O LYS A 39 9.827 -4.549 6.663 1.00 74.23 O ATOM 616 CB LYS A 39 11.111 -1.827 8.179 1.00 54.51 C ATOM 617 CG LYS A 39 10.005 -2.274 9.163 1.00 44.12 C ATOM 618 CD LYS A 39 9.758 -1.287 10.319 1.00 54.40 C ATOM 619 CE LYS A 39 8.625 -1.764 11.243 1.00 75.23 C ATOM 620 NZ LYS A 39 8.848 -3.154 11.732 1.00 71.40 N ATOM 0 H LYS A 39 12.612 -1.450 6.196 1.00 71.10 H new ATOM 0 HA LYS A 39 11.925 -3.761 7.742 1.00 24.41 H new ATOM 0 HB2 LYS A 39 11.993 -1.527 8.745 1.00 54.51 H new ATOM 0 HB3 LYS A 39 10.769 -0.949 7.632 1.00 54.51 H new ATOM 0 HG2 LYS A 39 9.075 -2.411 8.611 1.00 44.12 H new ATOM 0 HG3 LYS A 39 10.274 -3.245 9.579 1.00 44.12 H new ATOM 0 HD2 LYS A 39 10.674 -1.168 10.898 1.00 54.40 H new ATOM 0 HD3 LYS A 39 9.508 -0.307 9.913 1.00 54.40 H new ATOM 0 HE2 LYS A 39 8.544 -1.089 12.095 1.00 75.23 H new ATOM 0 HE3 LYS A 39 7.677 -1.716 10.708 1.00 75.23 H new ATOM 0 HZ1 LYS A 39 8.180 -3.363 12.501 1.00 71.40 H new ATOM 0 HZ2 LYS A 39 8.698 -3.825 10.952 1.00 71.40 H new ATOM 0 HZ3 LYS A 39 9.822 -3.246 12.085 1.00 71.40 H new ATOM 634 N VAL A 40 9.793 -2.636 5.418 1.00 43.52 N ATOM 635 CA VAL A 40 8.585 -2.968 4.614 1.00 44.22 C ATOM 636 C VAL A 40 8.695 -4.387 4.011 1.00 33.53 C ATOM 637 O VAL A 40 7.736 -5.158 4.045 1.00 73.21 O ATOM 638 CB VAL A 40 8.354 -1.928 3.447 1.00 64.51 C ATOM 639 CG1 VAL A 40 7.141 -2.312 2.568 1.00 14.51 C ATOM 640 CG2 VAL A 40 8.188 -0.489 3.986 1.00 51.22 C ATOM 0 H VAL A 40 10.225 -1.749 5.160 1.00 43.52 H new ATOM 0 HA VAL A 40 7.734 -2.925 5.294 1.00 44.22 H new ATOM 0 HB VAL A 40 9.248 -1.957 2.825 1.00 64.51 H new ATOM 0 HG11 VAL A 40 7.016 -1.572 1.777 1.00 14.51 H new ATOM 0 HG12 VAL A 40 7.310 -3.293 2.124 1.00 14.51 H new ATOM 0 HG13 VAL A 40 6.241 -2.342 3.183 1.00 14.51 H new ATOM 0 HG21 VAL A 40 8.031 0.196 3.153 1.00 51.22 H new ATOM 0 HG22 VAL A 40 7.329 -0.448 4.656 1.00 51.22 H new ATOM 0 HG23 VAL A 40 9.087 -0.198 4.530 1.00 51.22 H new ATOM 650 N LYS A 41 9.902 -4.715 3.518 1.00 50.31 N ATOM 651 CA LYS A 41 10.204 -6.024 2.911 1.00 50.24 C ATOM 652 C LYS A 41 10.116 -7.168 3.944 1.00 1.31 C ATOM 653 O LYS A 41 9.573 -8.237 3.644 1.00 5.34 O ATOM 654 CB LYS A 41 11.605 -5.994 2.260 1.00 14.11 C ATOM 655 CG LYS A 41 11.731 -4.985 1.100 1.00 31.21 C ATOM 656 CD LYS A 41 13.154 -4.950 0.514 1.00 72.34 C ATOM 657 CE LYS A 41 13.327 -3.909 -0.594 1.00 74.23 C ATOM 658 NZ LYS A 41 14.677 -4.001 -1.223 1.00 72.35 N ATOM 0 H LYS A 41 10.698 -4.078 3.529 1.00 50.31 H new ATOM 0 HA LYS A 41 9.454 -6.218 2.144 1.00 50.24 H new ATOM 0 HB2 LYS A 41 12.345 -5.751 3.023 1.00 14.11 H new ATOM 0 HB3 LYS A 41 11.845 -6.991 1.890 1.00 14.11 H new ATOM 0 HG2 LYS A 41 11.022 -5.247 0.314 1.00 31.21 H new ATOM 0 HG3 LYS A 41 11.461 -3.990 1.455 1.00 31.21 H new ATOM 0 HD2 LYS A 41 13.864 -4.740 1.314 1.00 72.34 H new ATOM 0 HD3 LYS A 41 13.401 -5.935 0.119 1.00 72.34 H new ATOM 0 HE2 LYS A 41 12.559 -4.054 -1.354 1.00 74.23 H new ATOM 0 HE3 LYS A 41 13.183 -2.910 -0.182 1.00 74.23 H new ATOM 0 HZ1 LYS A 41 14.839 -3.165 -1.820 1.00 72.35 H new ATOM 0 HZ2 LYS A 41 15.404 -4.042 -0.480 1.00 72.35 H new ATOM 0 HZ3 LYS A 41 14.730 -4.860 -1.807 1.00 72.35 H new ATOM 672 N GLU A 42 10.644 -6.921 5.160 1.00 33.35 N ATOM 673 CA GLU A 42 10.559 -7.878 6.286 1.00 53.11 C ATOM 674 C GLU A 42 9.092 -8.178 6.617 1.00 74.52 C ATOM 675 O GLU A 42 8.724 -9.331 6.844 1.00 12.43 O ATOM 676 CB GLU A 42 11.296 -7.326 7.537 1.00 11.34 C ATOM 677 CG GLU A 42 12.811 -7.126 7.339 1.00 65.32 C ATOM 678 CD GLU A 42 13.519 -6.572 8.586 1.00 24.34 C ATOM 679 OE1 GLU A 42 13.305 -5.388 8.921 1.00 42.22 O ATOM 680 OE2 GLU A 42 14.298 -7.312 9.234 1.00 43.32 O ATOM 0 H GLU A 42 11.138 -6.059 5.390 1.00 33.35 H new ATOM 0 HA GLU A 42 11.047 -8.805 5.986 1.00 53.11 H new ATOM 0 HB2 GLU A 42 10.848 -6.373 7.818 1.00 11.34 H new ATOM 0 HB3 GLU A 42 11.137 -8.010 8.370 1.00 11.34 H new ATOM 0 HG2 GLU A 42 13.264 -8.079 7.066 1.00 65.32 H new ATOM 0 HG3 GLU A 42 12.975 -6.445 6.504 1.00 65.32 H new ATOM 687 N GLU A 43 8.263 -7.122 6.563 1.00 71.31 N ATOM 688 CA GLU A 43 6.831 -7.199 6.873 1.00 52.12 C ATOM 689 C GLU A 43 6.072 -7.982 5.772 1.00 2.11 C ATOM 690 O GLU A 43 5.133 -8.723 6.072 1.00 20.20 O ATOM 691 CB GLU A 43 6.228 -5.778 7.025 1.00 0.24 C ATOM 692 CG GLU A 43 7.002 -4.804 7.934 1.00 32.21 C ATOM 693 CD GLU A 43 7.317 -5.347 9.334 1.00 30.14 C ATOM 694 OE1 GLU A 43 6.382 -5.769 10.047 1.00 62.01 O ATOM 695 OE2 GLU A 43 8.494 -5.353 9.733 1.00 51.13 O ATOM 0 H GLU A 43 8.573 -6.186 6.301 1.00 71.31 H new ATOM 0 HA GLU A 43 6.719 -7.731 7.818 1.00 52.12 H new ATOM 0 HB2 GLU A 43 6.149 -5.332 6.034 1.00 0.24 H new ATOM 0 HB3 GLU A 43 5.214 -5.876 7.413 1.00 0.24 H new ATOM 0 HG2 GLU A 43 7.938 -4.537 7.444 1.00 32.21 H new ATOM 0 HG3 GLU A 43 6.423 -3.886 8.037 1.00 32.21 H new ATOM 702 N ILE A 44 6.488 -7.785 4.495 1.00 20.53 N ATOM 703 CA ILE A 44 5.934 -8.515 3.324 1.00 31.25 C ATOM 704 C ILE A 44 6.127 -10.042 3.511 1.00 54.41 C ATOM 705 O ILE A 44 5.231 -10.845 3.205 1.00 23.34 O ATOM 706 CB ILE A 44 6.611 -8.018 1.976 1.00 24.15 C ATOM 707 CG1 ILE A 44 6.188 -6.551 1.639 1.00 53.32 C ATOM 708 CG2 ILE A 44 6.312 -8.950 0.779 1.00 52.13 C ATOM 709 CD1 ILE A 44 6.865 -5.959 0.408 1.00 11.34 C ATOM 0 H ILE A 44 7.217 -7.116 4.247 1.00 20.53 H new ATOM 0 HA ILE A 44 4.866 -8.306 3.255 1.00 31.25 H new ATOM 0 HB ILE A 44 7.687 -8.045 2.146 1.00 24.15 H new ATOM 0 HG12 ILE A 44 5.108 -6.524 1.491 1.00 53.32 H new ATOM 0 HG13 ILE A 44 6.409 -5.917 2.498 1.00 53.32 H new ATOM 0 HG21 ILE A 44 6.800 -8.562 -0.115 1.00 52.13 H new ATOM 0 HG22 ILE A 44 6.690 -9.950 0.993 1.00 52.13 H new ATOM 0 HG23 ILE A 44 5.236 -8.997 0.614 1.00 52.13 H new ATOM 0 HD11 ILE A 44 6.510 -4.940 0.252 1.00 11.34 H new ATOM 0 HD12 ILE A 44 7.945 -5.949 0.556 1.00 11.34 H new ATOM 0 HD13 ILE A 44 6.624 -6.564 -0.466 1.00 11.34 H new ATOM 721 N GLU A 45 7.297 -10.411 4.066 1.00 41.12 N ATOM 722 CA GLU A 45 7.639 -11.804 4.373 1.00 14.44 C ATOM 723 C GLU A 45 6.789 -12.348 5.549 1.00 15.31 C ATOM 724 O GLU A 45 6.373 -13.508 5.530 1.00 64.41 O ATOM 725 CB GLU A 45 9.150 -11.933 4.673 1.00 11.42 C ATOM 726 CG GLU A 45 9.605 -13.378 4.934 1.00 71.22 C ATOM 727 CD GLU A 45 11.118 -13.543 5.009 1.00 41.24 C ATOM 728 OE1 GLU A 45 11.768 -13.481 3.945 1.00 61.43 O ATOM 729 OE2 GLU A 45 11.664 -13.728 6.124 1.00 42.42 O ATOM 0 H GLU A 45 8.030 -9.746 4.313 1.00 41.12 H new ATOM 0 HA GLU A 45 7.408 -12.411 3.497 1.00 14.44 H new ATOM 0 HB2 GLU A 45 9.714 -11.530 3.832 1.00 11.42 H new ATOM 0 HB3 GLU A 45 9.393 -11.322 5.542 1.00 11.42 H new ATOM 0 HG2 GLU A 45 9.164 -13.724 5.869 1.00 71.22 H new ATOM 0 HG3 GLU A 45 9.218 -14.019 4.142 1.00 71.22 H new ATOM 736 N LYS A 46 6.524 -11.493 6.551 1.00 72.51 N ATOM 737 CA LYS A 46 5.678 -11.848 7.718 1.00 50.15 C ATOM 738 C LYS A 46 4.217 -12.102 7.288 1.00 42.41 C ATOM 739 O LYS A 46 3.530 -12.940 7.871 1.00 44.20 O ATOM 740 CB LYS A 46 5.739 -10.723 8.787 1.00 2.25 C ATOM 741 CG LYS A 46 7.157 -10.461 9.343 1.00 62.03 C ATOM 742 CD LYS A 46 7.216 -9.219 10.263 1.00 2.34 C ATOM 743 CE LYS A 46 8.652 -8.835 10.650 1.00 21.13 C ATOM 744 NZ LYS A 46 8.701 -7.616 11.502 1.00 71.10 N ATOM 0 H LYS A 46 6.885 -10.540 6.581 1.00 72.51 H new ATOM 0 HA LYS A 46 6.067 -12.769 8.152 1.00 50.15 H new ATOM 0 HB2 LYS A 46 5.354 -9.801 8.351 1.00 2.25 H new ATOM 0 HB3 LYS A 46 5.078 -10.985 9.613 1.00 2.25 H new ATOM 0 HG2 LYS A 46 7.493 -11.336 9.899 1.00 62.03 H new ATOM 0 HG3 LYS A 46 7.850 -10.326 8.512 1.00 62.03 H new ATOM 0 HD2 LYS A 46 6.742 -8.376 9.760 1.00 2.34 H new ATOM 0 HD3 LYS A 46 6.640 -9.415 11.168 1.00 2.34 H new ATOM 0 HE2 LYS A 46 9.117 -9.666 11.181 1.00 21.13 H new ATOM 0 HE3 LYS A 46 9.237 -8.667 9.746 1.00 21.13 H new ATOM 0 HZ1 LYS A 46 9.578 -7.618 12.061 1.00 71.10 H new ATOM 0 HZ2 LYS A 46 8.677 -6.769 10.898 1.00 71.10 H new ATOM 0 HZ3 LYS A 46 7.882 -7.607 12.143 1.00 71.10 H new ATOM 758 N ALA A 47 3.771 -11.367 6.253 1.00 22.34 N ATOM 759 CA ALA A 47 2.407 -11.468 5.706 1.00 20.23 C ATOM 760 C ALA A 47 2.167 -12.816 5.010 1.00 14.01 C ATOM 761 O ALA A 47 1.165 -13.484 5.276 1.00 23.34 O ATOM 762 CB ALA A 47 2.147 -10.314 4.739 1.00 43.02 C ATOM 0 H ALA A 47 4.352 -10.682 5.770 1.00 22.34 H new ATOM 0 HA ALA A 47 1.708 -11.405 6.540 1.00 20.23 H new ATOM 0 HB1 ALA A 47 1.136 -10.395 4.339 1.00 43.02 H new ATOM 0 HB2 ALA A 47 2.253 -9.366 5.267 1.00 43.02 H new ATOM 0 HB3 ALA A 47 2.866 -10.356 3.921 1.00 43.02 H new ATOM 768 N ARG A 48 3.106 -13.193 4.117 1.00 2.42 N ATOM 769 CA ARG A 48 3.026 -14.458 3.353 1.00 13.34 C ATOM 770 C ARG A 48 3.247 -15.677 4.279 1.00 31.24 C ATOM 771 O ARG A 48 2.674 -16.744 4.051 1.00 13.14 O ATOM 772 CB ARG A 48 4.053 -14.471 2.179 1.00 63.41 C ATOM 773 CG ARG A 48 5.531 -14.444 2.625 1.00 41.23 C ATOM 774 CD ARG A 48 6.548 -14.563 1.476 1.00 15.44 C ATOM 775 NE ARG A 48 7.923 -14.656 2.015 1.00 54.25 N ATOM 776 CZ ARG A 48 8.978 -15.211 1.400 1.00 74.33 C ATOM 777 NH1 ARG A 48 8.872 -15.746 0.187 1.00 71.02 N ATOM 778 NH2 ARG A 48 10.158 -15.194 1.993 1.00 34.34 N ATOM 0 H ARG A 48 3.934 -12.636 3.906 1.00 2.42 H new ATOM 0 HA ARG A 48 2.024 -14.526 2.929 1.00 13.34 H new ATOM 0 HB2 ARG A 48 3.885 -15.362 1.575 1.00 63.41 H new ATOM 0 HB3 ARG A 48 3.864 -13.610 1.537 1.00 63.41 H new ATOM 0 HG2 ARG A 48 5.718 -13.515 3.163 1.00 41.23 H new ATOM 0 HG3 ARG A 48 5.700 -15.259 3.328 1.00 41.23 H new ATOM 0 HD2 ARG A 48 6.326 -15.444 0.874 1.00 15.44 H new ATOM 0 HD3 ARG A 48 6.466 -13.698 0.818 1.00 15.44 H new ATOM 0 HE ARG A 48 8.084 -14.261 2.942 1.00 54.25 H new ATOM 0 HH11 ARG A 48 7.974 -15.740 -0.296 1.00 71.02 H new ATOM 0 HH12 ARG A 48 9.689 -16.162 -0.260 1.00 71.02 H new ATOM 0 HH21 ARG A 48 10.261 -14.761 2.911 1.00 34.34 H new ATOM 0 HH22 ARG A 48 10.966 -15.614 1.533 1.00 34.34 H new ATOM 792 N LYS A 49 4.082 -15.486 5.327 1.00 61.55 N ATOM 793 CA LYS A 49 4.366 -16.519 6.344 1.00 15.41 C ATOM 794 C LYS A 49 3.098 -16.834 7.146 1.00 23.42 C ATOM 795 O LYS A 49 2.734 -18.001 7.336 1.00 43.32 O ATOM 796 CB LYS A 49 5.495 -16.050 7.309 1.00 0.53 C ATOM 797 CG LYS A 49 5.782 -17.026 8.481 1.00 74.05 C ATOM 798 CD LYS A 49 6.824 -16.485 9.492 1.00 61.52 C ATOM 799 CE LYS A 49 6.970 -17.398 10.723 1.00 15.32 C ATOM 800 NZ LYS A 49 8.018 -16.909 11.667 1.00 3.13 N ATOM 0 H LYS A 49 4.577 -14.609 5.489 1.00 61.55 H new ATOM 0 HA LYS A 49 4.700 -17.420 5.829 1.00 15.41 H new ATOM 0 HB2 LYS A 49 6.412 -15.910 6.736 1.00 0.53 H new ATOM 0 HB3 LYS A 49 5.224 -15.077 7.720 1.00 0.53 H new ATOM 0 HG2 LYS A 49 4.850 -17.234 9.007 1.00 74.05 H new ATOM 0 HG3 LYS A 49 6.138 -17.973 8.076 1.00 74.05 H new ATOM 0 HD2 LYS A 49 7.791 -16.388 8.998 1.00 61.52 H new ATOM 0 HD3 LYS A 49 6.529 -15.487 9.815 1.00 61.52 H new ATOM 0 HE2 LYS A 49 6.014 -17.459 11.244 1.00 15.32 H new ATOM 0 HE3 LYS A 49 7.220 -18.408 10.397 1.00 15.32 H new ATOM 0 HZ1 LYS A 49 8.081 -17.554 12.480 1.00 3.13 H new ATOM 0 HZ2 LYS A 49 8.936 -16.875 11.179 1.00 3.13 H new ATOM 0 HZ3 LYS A 49 7.768 -15.956 12.000 1.00 3.13 H new ATOM 814 N GLN A 50 2.434 -15.760 7.604 1.00 72.34 N ATOM 815 CA GLN A 50 1.226 -15.848 8.430 1.00 54.35 C ATOM 816 C GLN A 50 0.014 -16.274 7.570 1.00 14.52 C ATOM 817 O GLN A 50 -0.904 -16.942 8.064 1.00 62.00 O ATOM 818 CB GLN A 50 0.979 -14.477 9.130 1.00 23.43 C ATOM 819 CG GLN A 50 -0.140 -14.475 10.193 1.00 72.31 C ATOM 820 CD GLN A 50 0.114 -15.466 11.334 1.00 41.13 C ATOM 821 OE1 GLN A 50 0.753 -15.140 12.336 1.00 65.53 O ATOM 822 NE2 GLN A 50 -0.391 -16.680 11.200 1.00 63.21 N ATOM 0 H GLN A 50 2.725 -14.802 7.408 1.00 72.34 H new ATOM 0 HA GLN A 50 1.362 -16.609 9.199 1.00 54.35 H new ATOM 0 HB2 GLN A 50 1.907 -14.156 9.602 1.00 23.43 H new ATOM 0 HB3 GLN A 50 0.736 -13.737 8.368 1.00 23.43 H new ATOM 0 HG2 GLN A 50 -0.239 -13.471 10.607 1.00 72.31 H new ATOM 0 HG3 GLN A 50 -1.089 -14.717 9.714 1.00 72.31 H new ATOM 0 HE21 GLN A 50 -0.916 -16.924 10.360 1.00 63.21 H new ATOM 0 HE22 GLN A 50 -0.256 -17.373 11.936 1.00 63.21 H new ATOM 831 N GLY A 51 0.056 -15.910 6.275 1.00 5.42 N ATOM 832 CA GLY A 51 -1.009 -16.228 5.330 1.00 34.42 C ATOM 833 C GLY A 51 -2.190 -15.280 5.466 1.00 71.41 C ATOM 834 O GLY A 51 -3.304 -15.712 5.782 1.00 73.13 O ATOM 0 H GLY A 51 0.830 -15.389 5.864 1.00 5.42 H new ATOM 0 HA2 GLY A 51 -0.619 -16.178 4.313 1.00 34.42 H new ATOM 0 HA3 GLY A 51 -1.345 -17.252 5.493 1.00 34.42 H new ATOM 838 N ARG A 52 -1.926 -13.979 5.253 1.00 44.22 N ATOM 839 CA ARG A 52 -2.943 -12.903 5.347 1.00 42.44 C ATOM 840 C ARG A 52 -2.390 -11.600 4.690 1.00 15.04 C ATOM 841 O ARG A 52 -1.164 -11.474 4.538 1.00 22.22 O ATOM 842 CB ARG A 52 -3.399 -12.705 6.846 1.00 1.24 C ATOM 843 CG ARG A 52 -2.273 -12.510 7.897 1.00 44.21 C ATOM 844 CD ARG A 52 -1.678 -11.090 7.938 1.00 62.13 C ATOM 845 NE ARG A 52 -0.459 -11.032 8.753 1.00 12.41 N ATOM 846 CZ ARG A 52 0.556 -10.180 8.561 1.00 2.13 C ATOM 847 NH1 ARG A 52 0.511 -9.270 7.579 1.00 11.02 N ATOM 848 NH2 ARG A 52 1.629 -10.258 9.332 1.00 24.20 N ATOM 0 H ARG A 52 -0.997 -13.637 5.009 1.00 44.22 H new ATOM 0 HA ARG A 52 -3.839 -13.183 4.793 1.00 42.44 H new ATOM 0 HB2 ARG A 52 -4.059 -11.838 6.889 1.00 1.24 H new ATOM 0 HB3 ARG A 52 -3.991 -13.572 7.139 1.00 1.24 H new ATOM 0 HG2 ARG A 52 -2.668 -12.754 8.883 1.00 44.21 H new ATOM 0 HG3 ARG A 52 -1.472 -13.220 7.690 1.00 44.21 H new ATOM 0 HD2 ARG A 52 -1.453 -10.761 6.924 1.00 62.13 H new ATOM 0 HD3 ARG A 52 -2.417 -10.398 8.341 1.00 62.13 H new ATOM 0 HE ARG A 52 -0.379 -11.692 9.526 1.00 12.41 H new ATOM 0 HH11 ARG A 52 -0.303 -9.220 6.967 1.00 11.02 H new ATOM 0 HH12 ARG A 52 1.291 -8.627 7.444 1.00 11.02 H new ATOM 0 HH21 ARG A 52 1.679 -10.964 10.067 1.00 24.20 H new ATOM 0 HH22 ARG A 52 2.406 -9.612 9.191 1.00 24.20 H new ATOM 862 N PRO A 53 -3.268 -10.612 4.272 1.00 60.23 N ATOM 863 CA PRO A 53 -2.800 -9.349 3.629 1.00 62.01 C ATOM 864 C PRO A 53 -1.930 -8.452 4.554 1.00 75.12 C ATOM 865 O PRO A 53 -1.851 -8.660 5.770 1.00 64.31 O ATOM 866 CB PRO A 53 -4.117 -8.617 3.221 1.00 32.34 C ATOM 867 CG PRO A 53 -5.214 -9.647 3.325 1.00 11.13 C ATOM 868 CD PRO A 53 -4.759 -10.648 4.371 1.00 22.15 C ATOM 0 HA PRO A 53 -2.142 -9.569 2.788 1.00 62.01 H new ATOM 0 HB2 PRO A 53 -4.313 -7.770 3.879 1.00 32.34 H new ATOM 0 HB3 PRO A 53 -4.046 -8.223 2.207 1.00 32.34 H new ATOM 0 HG2 PRO A 53 -6.157 -9.183 3.615 1.00 11.13 H new ATOM 0 HG3 PRO A 53 -5.381 -10.136 2.365 1.00 11.13 H new ATOM 0 HD2 PRO A 53 -5.101 -10.369 5.368 1.00 22.15 H new ATOM 0 HD3 PRO A 53 -5.150 -11.645 4.168 1.00 22.15 H new ATOM 876 N ILE A 54 -1.302 -7.442 3.942 1.00 21.11 N ATOM 877 CA ILE A 54 -0.488 -6.425 4.636 1.00 52.24 C ATOM 878 C ILE A 54 -0.760 -5.047 4.000 1.00 23.31 C ATOM 879 O ILE A 54 -1.046 -4.959 2.802 1.00 51.33 O ATOM 880 CB ILE A 54 1.051 -6.771 4.569 1.00 25.44 C ATOM 881 CG1 ILE A 54 1.924 -5.631 5.189 1.00 53.14 C ATOM 882 CG2 ILE A 54 1.490 -7.103 3.126 1.00 64.13 C ATOM 883 CD1 ILE A 54 3.416 -5.781 4.998 1.00 2.12 C ATOM 0 H ILE A 54 -1.343 -7.302 2.933 1.00 21.11 H new ATOM 0 HA ILE A 54 -0.769 -6.409 5.689 1.00 52.24 H new ATOM 0 HB ILE A 54 1.212 -7.664 5.173 1.00 25.44 H new ATOM 0 HG12 ILE A 54 1.613 -4.681 4.755 1.00 53.14 H new ATOM 0 HG13 ILE A 54 1.715 -5.577 6.257 1.00 53.14 H new ATOM 0 HG21 ILE A 54 2.555 -7.337 3.114 1.00 64.13 H new ATOM 0 HG22 ILE A 54 0.926 -7.962 2.763 1.00 64.13 H new ATOM 0 HG23 ILE A 54 1.300 -6.245 2.481 1.00 64.13 H new ATOM 0 HD11 ILE A 54 3.929 -4.940 5.464 1.00 2.12 H new ATOM 0 HD12 ILE A 54 3.750 -6.711 5.459 1.00 2.12 H new ATOM 0 HD13 ILE A 54 3.646 -5.801 3.933 1.00 2.12 H new ATOM 895 N VAL A 55 -0.695 -3.979 4.822 1.00 14.25 N ATOM 896 CA VAL A 55 -0.888 -2.586 4.376 1.00 15.13 C ATOM 897 C VAL A 55 0.325 -1.732 4.784 1.00 43.13 C ATOM 898 O VAL A 55 0.881 -1.946 5.858 1.00 54.45 O ATOM 899 CB VAL A 55 -2.196 -1.944 4.967 1.00 31.12 C ATOM 900 CG1 VAL A 55 -2.542 -0.633 4.243 1.00 74.24 C ATOM 901 CG2 VAL A 55 -3.381 -2.921 4.917 1.00 71.44 C ATOM 0 H VAL A 55 -0.506 -4.061 5.821 1.00 14.25 H new ATOM 0 HA VAL A 55 -0.988 -2.608 3.291 1.00 15.13 H new ATOM 0 HB VAL A 55 -2.000 -1.716 6.015 1.00 31.12 H new ATOM 0 HG11 VAL A 55 -3.451 -0.210 4.671 1.00 74.24 H new ATOM 0 HG12 VAL A 55 -1.722 0.075 4.361 1.00 74.24 H new ATOM 0 HG13 VAL A 55 -2.699 -0.833 3.183 1.00 74.24 H new ATOM 0 HG21 VAL A 55 -4.266 -2.441 5.334 1.00 71.44 H new ATOM 0 HG22 VAL A 55 -3.575 -3.205 3.883 1.00 71.44 H new ATOM 0 HG23 VAL A 55 -3.143 -3.812 5.499 1.00 71.44 H new ATOM 911 N ILE A 56 0.759 -0.800 3.911 1.00 50.14 N ATOM 912 CA ILE A 56 1.895 0.115 4.193 1.00 10.11 C ATOM 913 C ILE A 56 1.411 1.576 4.095 1.00 21.23 C ATOM 914 O ILE A 56 0.785 1.943 3.106 1.00 62.24 O ATOM 915 CB ILE A 56 3.093 -0.132 3.193 1.00 65.23 C ATOM 916 CG1 ILE A 56 3.550 -1.625 3.231 1.00 22.42 C ATOM 917 CG2 ILE A 56 4.287 0.822 3.469 1.00 72.14 C ATOM 918 CD1 ILE A 56 4.071 -2.110 4.581 1.00 21.05 C ATOM 0 H ILE A 56 0.337 -0.657 2.993 1.00 50.14 H new ATOM 0 HA ILE A 56 2.259 -0.084 5.201 1.00 10.11 H new ATOM 0 HB ILE A 56 2.729 0.091 2.190 1.00 65.23 H new ATOM 0 HG12 ILE A 56 2.709 -2.253 2.937 1.00 22.42 H new ATOM 0 HG13 ILE A 56 4.332 -1.768 2.485 1.00 22.42 H new ATOM 0 HG21 ILE A 56 5.088 0.617 2.759 1.00 72.14 H new ATOM 0 HG22 ILE A 56 3.960 1.856 3.359 1.00 72.14 H new ATOM 0 HG23 ILE A 56 4.653 0.663 4.484 1.00 72.14 H new ATOM 0 HD11 ILE A 56 4.363 -3.157 4.504 1.00 21.05 H new ATOM 0 HD12 ILE A 56 4.935 -1.513 4.873 1.00 21.05 H new ATOM 0 HD13 ILE A 56 3.288 -2.006 5.332 1.00 21.05 H new ATOM 930 N PHE A 57 1.699 2.401 5.119 1.00 40.34 N ATOM 931 CA PHE A 57 1.257 3.814 5.172 1.00 23.13 C ATOM 932 C PHE A 57 2.455 4.760 4.999 1.00 13.15 C ATOM 933 O PHE A 57 3.385 4.753 5.809 1.00 24.32 O ATOM 934 CB PHE A 57 0.508 4.098 6.507 1.00 70.43 C ATOM 935 CG PHE A 57 -0.912 3.547 6.525 1.00 42.42 C ATOM 936 CD1 PHE A 57 -1.155 2.191 6.740 1.00 15.42 C ATOM 937 CD2 PHE A 57 -2.002 4.382 6.296 1.00 42.33 C ATOM 938 CE1 PHE A 57 -2.443 1.697 6.722 1.00 73.21 C ATOM 939 CE2 PHE A 57 -3.286 3.880 6.273 1.00 62.42 C ATOM 940 CZ PHE A 57 -3.505 2.541 6.486 1.00 45.03 C ATOM 0 H PHE A 57 2.243 2.112 5.932 1.00 40.34 H new ATOM 0 HA PHE A 57 0.565 3.994 4.350 1.00 23.13 H new ATOM 0 HB2 PHE A 57 1.071 3.662 7.332 1.00 70.43 H new ATOM 0 HB3 PHE A 57 0.476 5.174 6.677 1.00 70.43 H new ATOM 0 HD1 PHE A 57 -0.328 1.521 6.922 1.00 15.42 H new ATOM 0 HD2 PHE A 57 -1.840 5.437 6.134 1.00 42.33 H new ATOM 0 HE1 PHE A 57 -2.619 0.645 6.894 1.00 73.21 H new ATOM 0 HE2 PHE A 57 -4.120 4.540 6.087 1.00 62.42 H new ATOM 0 HZ PHE A 57 -4.511 2.150 6.468 1.00 45.03 H new ATOM 950 N ILE A 58 2.410 5.571 3.930 1.00 45.52 N ATOM 951 CA ILE A 58 3.474 6.530 3.563 1.00 25.03 C ATOM 952 C ILE A 58 2.855 7.792 2.935 1.00 53.12 C ATOM 953 O ILE A 58 1.697 7.783 2.524 1.00 0.10 O ATOM 954 CB ILE A 58 4.520 5.892 2.573 1.00 64.13 C ATOM 955 CG1 ILE A 58 3.806 5.107 1.445 1.00 13.44 C ATOM 956 CG2 ILE A 58 5.553 5.005 3.319 1.00 0.15 C ATOM 957 CD1 ILE A 58 4.748 4.462 0.459 1.00 64.14 C ATOM 0 H ILE A 58 1.621 5.582 3.283 1.00 45.52 H new ATOM 0 HA ILE A 58 4.004 6.801 4.476 1.00 25.03 H new ATOM 0 HB ILE A 58 5.077 6.708 2.112 1.00 64.13 H new ATOM 0 HG12 ILE A 58 3.180 4.335 1.893 1.00 13.44 H new ATOM 0 HG13 ILE A 58 3.142 5.785 0.908 1.00 13.44 H new ATOM 0 HG21 ILE A 58 6.257 4.584 2.601 1.00 0.15 H new ATOM 0 HG22 ILE A 58 6.095 5.610 4.046 1.00 0.15 H new ATOM 0 HG23 ILE A 58 5.034 4.197 3.835 1.00 0.15 H new ATOM 0 HD11 ILE A 58 4.173 3.931 -0.300 1.00 64.14 H new ATOM 0 HD12 ILE A 58 5.357 5.230 -0.018 1.00 64.14 H new ATOM 0 HD13 ILE A 58 5.396 3.758 0.982 1.00 64.14 H new ATOM 969 N ARG A 59 3.651 8.870 2.837 1.00 15.33 N ATOM 970 CA ARG A 59 3.155 10.213 2.480 1.00 32.42 C ATOM 971 C ARG A 59 3.927 10.793 1.274 1.00 30.05 C ATOM 972 O ARG A 59 5.106 11.133 1.409 1.00 33.41 O ATOM 973 CB ARG A 59 3.300 11.157 3.710 1.00 21.32 C ATOM 974 CG ARG A 59 2.651 12.551 3.546 1.00 11.14 C ATOM 975 CD ARG A 59 2.961 13.482 4.733 1.00 21.25 C ATOM 976 NE ARG A 59 4.414 13.628 4.952 1.00 52.55 N ATOM 977 CZ ARG A 59 5.000 14.283 5.971 1.00 2.45 C ATOM 978 NH1 ARG A 59 4.280 14.889 6.920 1.00 73.51 N ATOM 979 NH2 ARG A 59 6.321 14.313 6.043 1.00 54.53 N ATOM 0 H ARG A 59 4.657 8.837 3.003 1.00 15.33 H new ATOM 0 HA ARG A 59 2.106 10.132 2.196 1.00 32.42 H new ATOM 0 HB2 ARG A 59 2.859 10.668 4.578 1.00 21.32 H new ATOM 0 HB3 ARG A 59 4.361 11.290 3.924 1.00 21.32 H new ATOM 0 HG2 ARG A 59 3.008 13.010 2.624 1.00 11.14 H new ATOM 0 HG3 ARG A 59 1.571 12.438 3.448 1.00 11.14 H new ATOM 0 HD2 ARG A 59 2.521 14.462 4.550 1.00 21.25 H new ATOM 0 HD3 ARG A 59 2.495 13.087 5.636 1.00 21.25 H new ATOM 0 HE ARG A 59 5.031 13.192 4.267 1.00 52.55 H new ATOM 0 HH11 ARG A 59 3.261 14.862 6.883 1.00 73.51 H new ATOM 0 HH12 ARG A 59 4.749 15.379 7.682 1.00 73.51 H new ATOM 0 HH21 ARG A 59 6.881 13.843 5.332 1.00 54.53 H new ATOM 0 HH22 ARG A 59 6.779 14.806 6.810 1.00 54.53 H new ATOM 993 N GLY A 60 3.241 10.863 0.110 1.00 51.41 N ATOM 994 CA GLY A 60 3.713 11.574 -1.100 1.00 12.44 C ATOM 995 C GLY A 60 5.122 11.204 -1.573 1.00 64.00 C ATOM 996 O GLY A 60 5.299 10.294 -2.377 1.00 44.32 O ATOM 0 H GLY A 60 2.331 10.421 -0.017 1.00 51.41 H new ATOM 0 HA2 GLY A 60 3.013 11.378 -1.912 1.00 12.44 H new ATOM 0 HA3 GLY A 60 3.684 12.646 -0.905 1.00 12.44 H new ATOM 1000 N ALA A 61 6.123 11.940 -1.052 1.00 64.21 N ATOM 1001 CA ALA A 61 7.560 11.737 -1.352 1.00 54.40 C ATOM 1002 C ALA A 61 8.039 10.318 -0.993 1.00 74.55 C ATOM 1003 O ALA A 61 8.919 9.760 -1.652 1.00 12.10 O ATOM 1004 CB ALA A 61 8.383 12.772 -0.575 1.00 64.40 C ATOM 0 H ALA A 61 5.956 12.706 -0.399 1.00 64.21 H new ATOM 0 HA ALA A 61 7.699 11.862 -2.426 1.00 54.40 H new ATOM 0 HB1 ALA A 61 9.442 12.630 -0.790 1.00 64.40 H new ATOM 0 HB2 ALA A 61 8.083 13.776 -0.876 1.00 64.40 H new ATOM 0 HB3 ALA A 61 8.210 12.647 0.494 1.00 64.40 H new ATOM 1010 N TYR A 62 7.440 9.764 0.066 1.00 60.43 N ATOM 1011 CA TYR A 62 7.769 8.433 0.604 1.00 65.50 C ATOM 1012 C TYR A 62 7.349 7.311 -0.374 1.00 24.14 C ATOM 1013 O TYR A 62 7.896 6.207 -0.325 1.00 73.15 O ATOM 1014 CB TYR A 62 7.116 8.237 1.998 1.00 23.11 C ATOM 1015 CG TYR A 62 7.421 9.315 3.063 1.00 43.11 C ATOM 1016 CD1 TYR A 62 8.439 10.260 2.903 1.00 61.34 C ATOM 1017 CD2 TYR A 62 6.660 9.389 4.236 1.00 42.30 C ATOM 1018 CE1 TYR A 62 8.689 11.218 3.856 1.00 11.14 C ATOM 1019 CE2 TYR A 62 6.914 10.352 5.198 1.00 74.15 C ATOM 1020 CZ TYR A 62 7.925 11.267 4.999 1.00 43.34 C ATOM 1021 OH TYR A 62 8.183 12.238 5.944 1.00 63.22 O ATOM 0 H TYR A 62 6.699 10.234 0.585 1.00 60.43 H new ATOM 0 HA TYR A 62 8.851 8.372 0.721 1.00 65.50 H new ATOM 0 HB2 TYR A 62 6.035 8.187 1.864 1.00 23.11 H new ATOM 0 HB3 TYR A 62 7.434 7.271 2.390 1.00 23.11 H new ATOM 0 HD1 TYR A 62 9.044 10.236 2.008 1.00 61.34 H new ATOM 0 HD2 TYR A 62 5.859 8.681 4.393 1.00 42.30 H new ATOM 0 HE1 TYR A 62 9.485 11.932 3.708 1.00 11.14 H new ATOM 0 HE2 TYR A 62 6.322 10.386 6.101 1.00 74.15 H new ATOM 0 HH TYR A 62 7.558 12.141 6.692 1.00 63.22 H new ATOM 1031 N GLU A 63 6.318 7.591 -1.213 1.00 73.05 N ATOM 1032 CA GLU A 63 5.839 6.651 -2.260 1.00 2.11 C ATOM 1033 C GLU A 63 6.969 6.259 -3.237 1.00 14.55 C ATOM 1034 O GLU A 63 6.954 5.158 -3.785 1.00 43.53 O ATOM 1035 CB GLU A 63 4.644 7.251 -3.041 1.00 1.32 C ATOM 1036 CG GLU A 63 3.878 6.237 -3.934 1.00 70.35 C ATOM 1037 CD GLU A 63 2.894 6.871 -4.945 1.00 11.32 C ATOM 1038 OE1 GLU A 63 2.119 7.776 -4.569 1.00 62.33 O ATOM 1039 OE2 GLU A 63 2.876 6.439 -6.122 1.00 1.24 O ATOM 0 H GLU A 63 5.799 8.468 -1.183 1.00 73.05 H new ATOM 0 HA GLU A 63 5.506 5.747 -1.750 1.00 2.11 H new ATOM 0 HB2 GLU A 63 3.944 7.688 -2.328 1.00 1.32 H new ATOM 0 HB3 GLU A 63 5.009 8.064 -3.669 1.00 1.32 H new ATOM 0 HG2 GLU A 63 4.604 5.638 -4.483 1.00 70.35 H new ATOM 0 HG3 GLU A 63 3.324 5.554 -3.290 1.00 70.35 H new ATOM 1046 N GLU A 64 7.961 7.166 -3.420 1.00 73.33 N ATOM 1047 CA GLU A 64 9.145 6.927 -4.279 1.00 40.43 C ATOM 1048 C GLU A 64 9.863 5.604 -3.901 1.00 34.11 C ATOM 1049 O GLU A 64 10.290 4.837 -4.779 1.00 61.12 O ATOM 1050 CB GLU A 64 10.122 8.136 -4.176 1.00 52.24 C ATOM 1051 CG GLU A 64 11.494 7.950 -4.872 1.00 61.13 C ATOM 1052 CD GLU A 64 11.390 7.587 -6.369 1.00 15.21 C ATOM 1053 OE1 GLU A 64 11.018 8.455 -7.180 1.00 35.25 O ATOM 1054 OE2 GLU A 64 11.696 6.436 -6.747 1.00 62.51 O ATOM 0 H GLU A 64 7.961 8.084 -2.975 1.00 73.33 H new ATOM 0 HA GLU A 64 8.807 6.829 -5.311 1.00 40.43 H new ATOM 0 HB2 GLU A 64 9.634 9.012 -4.603 1.00 52.24 H new ATOM 0 HB3 GLU A 64 10.296 8.351 -3.122 1.00 52.24 H new ATOM 0 HG2 GLU A 64 12.070 8.870 -4.770 1.00 61.13 H new ATOM 0 HG3 GLU A 64 12.049 7.167 -4.356 1.00 61.13 H new ATOM 1061 N VAL A 65 9.918 5.324 -2.592 1.00 11.10 N ATOM 1062 CA VAL A 65 10.622 4.155 -2.037 1.00 71.22 C ATOM 1063 C VAL A 65 9.977 2.821 -2.520 1.00 15.31 C ATOM 1064 O VAL A 65 10.680 1.816 -2.678 1.00 74.15 O ATOM 1065 CB VAL A 65 10.668 4.207 -0.457 1.00 2.21 C ATOM 1066 CG1 VAL A 65 11.612 3.142 0.111 1.00 74.50 C ATOM 1067 CG2 VAL A 65 11.061 5.619 0.054 1.00 35.42 C ATOM 0 H VAL A 65 9.473 5.905 -1.882 1.00 11.10 H new ATOM 0 HA VAL A 65 11.646 4.190 -2.408 1.00 71.22 H new ATOM 0 HB VAL A 65 9.662 3.989 -0.099 1.00 2.21 H new ATOM 0 HG11 VAL A 65 11.620 3.206 1.199 1.00 74.50 H new ATOM 0 HG12 VAL A 65 11.269 2.153 -0.192 1.00 74.50 H new ATOM 0 HG13 VAL A 65 12.620 3.309 -0.269 1.00 74.50 H new ATOM 0 HG21 VAL A 65 11.083 5.619 1.144 1.00 35.42 H new ATOM 0 HG22 VAL A 65 12.047 5.883 -0.329 1.00 35.42 H new ATOM 0 HG23 VAL A 65 10.330 6.348 -0.294 1.00 35.42 H new ATOM 1077 N VAL A 66 8.640 2.848 -2.781 1.00 41.54 N ATOM 1078 CA VAL A 66 7.856 1.663 -3.232 1.00 41.11 C ATOM 1079 C VAL A 66 8.448 1.017 -4.497 1.00 64.41 C ATOM 1080 O VAL A 66 8.457 -0.204 -4.604 1.00 31.30 O ATOM 1081 CB VAL A 66 6.337 2.008 -3.498 1.00 52.25 C ATOM 1082 CG1 VAL A 66 5.528 0.787 -4.014 1.00 42.43 C ATOM 1083 CG2 VAL A 66 5.685 2.578 -2.233 1.00 2.12 C ATOM 0 H VAL A 66 8.076 3.692 -2.684 1.00 41.54 H new ATOM 0 HA VAL A 66 7.917 0.952 -2.408 1.00 41.11 H new ATOM 0 HB VAL A 66 6.319 2.762 -4.285 1.00 52.25 H new ATOM 0 HG11 VAL A 66 4.492 1.081 -4.180 1.00 42.43 H new ATOM 0 HG12 VAL A 66 5.959 0.434 -4.951 1.00 42.43 H new ATOM 0 HG13 VAL A 66 5.564 -0.013 -3.274 1.00 42.43 H new ATOM 0 HG21 VAL A 66 4.639 2.810 -2.435 1.00 2.12 H new ATOM 0 HG22 VAL A 66 5.745 1.843 -1.430 1.00 2.12 H new ATOM 0 HG23 VAL A 66 6.206 3.487 -1.933 1.00 2.12 H new ATOM 1093 N ARG A 67 8.956 1.846 -5.434 1.00 70.10 N ATOM 1094 CA ARG A 67 9.538 1.362 -6.717 1.00 75.11 C ATOM 1095 C ARG A 67 10.666 0.319 -6.481 1.00 33.33 C ATOM 1096 O ARG A 67 10.825 -0.627 -7.262 1.00 54.52 O ATOM 1097 CB ARG A 67 10.024 2.574 -7.575 1.00 12.21 C ATOM 1098 CG ARG A 67 10.830 2.213 -8.854 1.00 31.43 C ATOM 1099 CD ARG A 67 10.865 3.337 -9.918 1.00 54.32 C ATOM 1100 NE ARG A 67 11.302 4.657 -9.407 1.00 31.35 N ATOM 1101 CZ ARG A 67 11.736 5.681 -10.182 1.00 45.15 C ATOM 1102 NH1 ARG A 67 11.822 5.559 -11.506 1.00 30.25 N ATOM 1103 NH2 ARG A 67 12.040 6.849 -9.628 1.00 65.33 N ATOM 0 H ARG A 67 8.977 2.860 -5.330 1.00 70.10 H new ATOM 0 HA ARG A 67 8.759 0.844 -7.276 1.00 75.11 H new ATOM 0 HB2 ARG A 67 9.153 3.160 -7.870 1.00 12.21 H new ATOM 0 HB3 ARG A 67 10.642 3.216 -6.947 1.00 12.21 H new ATOM 0 HG2 ARG A 67 11.852 1.966 -8.568 1.00 31.43 H new ATOM 0 HG3 ARG A 67 10.399 1.317 -9.301 1.00 31.43 H new ATOM 0 HD2 ARG A 67 11.533 3.035 -10.725 1.00 54.32 H new ATOM 0 HD3 ARG A 67 9.870 3.441 -10.351 1.00 54.32 H new ATOM 0 HE ARG A 67 11.274 4.806 -8.398 1.00 31.35 H new ATOM 0 HH11 ARG A 67 11.559 4.682 -11.956 1.00 30.25 H new ATOM 0 HH12 ARG A 67 12.151 6.343 -12.070 1.00 30.25 H new ATOM 0 HH21 ARG A 67 11.947 6.975 -8.620 1.00 65.33 H new ATOM 0 HH22 ARG A 67 12.367 7.620 -10.210 1.00 65.33 H new ATOM 1117 N ASP A 68 11.402 0.487 -5.364 1.00 32.00 N ATOM 1118 CA ASP A 68 12.442 -0.464 -4.918 1.00 54.04 C ATOM 1119 C ASP A 68 11.793 -1.725 -4.298 1.00 62.52 C ATOM 1120 O ASP A 68 12.166 -2.860 -4.617 1.00 25.24 O ATOM 1121 CB ASP A 68 13.365 0.229 -3.878 1.00 73.20 C ATOM 1122 CG ASP A 68 14.632 -0.585 -3.551 1.00 33.31 C ATOM 1123 OD1 ASP A 68 14.587 -1.471 -2.671 1.00 31.42 O ATOM 1124 OD2 ASP A 68 15.687 -0.318 -4.166 1.00 53.11 O ATOM 0 H ASP A 68 11.292 1.289 -4.743 1.00 32.00 H new ATOM 0 HA ASP A 68 13.035 -0.772 -5.779 1.00 54.04 H new ATOM 0 HB2 ASP A 68 13.658 1.208 -4.258 1.00 73.20 H new ATOM 0 HB3 ASP A 68 12.803 0.399 -2.960 1.00 73.20 H new ATOM 1129 N ILE A 69 10.788 -1.478 -3.441 1.00 55.35 N ATOM 1130 CA ILE A 69 10.107 -2.505 -2.617 1.00 64.34 C ATOM 1131 C ILE A 69 9.310 -3.517 -3.487 1.00 60.12 C ATOM 1132 O ILE A 69 9.182 -4.696 -3.115 1.00 42.13 O ATOM 1133 CB ILE A 69 9.139 -1.811 -1.584 1.00 25.35 C ATOM 1134 CG1 ILE A 69 9.901 -0.740 -0.738 1.00 61.11 C ATOM 1135 CG2 ILE A 69 8.460 -2.848 -0.667 1.00 31.40 C ATOM 1136 CD1 ILE A 69 9.014 0.125 0.150 1.00 64.32 C ATOM 0 H ILE A 69 10.414 -0.540 -3.295 1.00 55.35 H new ATOM 0 HA ILE A 69 10.878 -3.062 -2.085 1.00 64.34 H new ATOM 0 HB ILE A 69 8.358 -1.306 -2.152 1.00 25.35 H new ATOM 0 HG12 ILE A 69 10.634 -1.248 -0.111 1.00 61.11 H new ATOM 0 HG13 ILE A 69 10.456 -0.091 -1.415 1.00 61.11 H new ATOM 0 HG21 ILE A 69 7.799 -2.337 0.033 1.00 31.40 H new ATOM 0 HG22 ILE A 69 7.879 -3.544 -1.272 1.00 31.40 H new ATOM 0 HG23 ILE A 69 9.221 -3.397 -0.113 1.00 31.40 H new ATOM 0 HD11 ILE A 69 9.631 0.837 0.698 1.00 64.32 H new ATOM 0 HD12 ILE A 69 8.297 0.666 -0.468 1.00 64.32 H new ATOM 0 HD13 ILE A 69 8.478 -0.509 0.856 1.00 64.32 H new ATOM 1148 N VAL A 70 8.799 -3.029 -4.646 1.00 24.12 N ATOM 1149 CA VAL A 70 7.988 -3.817 -5.601 1.00 40.43 C ATOM 1150 C VAL A 70 8.693 -5.134 -5.967 1.00 23.22 C ATOM 1151 O VAL A 70 8.082 -6.205 -5.881 1.00 73.12 O ATOM 1152 CB VAL A 70 7.683 -2.981 -6.916 1.00 45.51 C ATOM 1153 CG1 VAL A 70 7.185 -3.877 -8.078 1.00 61.45 C ATOM 1154 CG2 VAL A 70 6.657 -1.856 -6.631 1.00 63.15 C ATOM 0 H VAL A 70 8.942 -2.064 -4.945 1.00 24.12 H new ATOM 0 HA VAL A 70 7.043 -4.052 -5.112 1.00 40.43 H new ATOM 0 HB VAL A 70 8.625 -2.531 -7.228 1.00 45.51 H new ATOM 0 HG11 VAL A 70 6.990 -3.260 -8.955 1.00 61.45 H new ATOM 0 HG12 VAL A 70 7.947 -4.618 -8.318 1.00 61.45 H new ATOM 0 HG13 VAL A 70 6.267 -4.384 -7.779 1.00 61.45 H new ATOM 0 HG21 VAL A 70 6.465 -1.298 -7.547 1.00 63.15 H new ATOM 0 HG22 VAL A 70 5.726 -2.295 -6.272 1.00 63.15 H new ATOM 0 HG23 VAL A 70 7.057 -1.182 -5.873 1.00 63.15 H new ATOM 1164 N GLU A 71 10.003 -5.023 -6.294 1.00 54.33 N ATOM 1165 CA GLU A 71 10.838 -6.156 -6.731 1.00 4.30 C ATOM 1166 C GLU A 71 10.773 -7.323 -5.736 1.00 14.00 C ATOM 1167 O GLU A 71 10.604 -8.474 -6.150 1.00 64.03 O ATOM 1168 CB GLU A 71 12.308 -5.704 -6.908 1.00 42.24 C ATOM 1169 CG GLU A 71 13.286 -6.848 -7.273 1.00 35.43 C ATOM 1170 CD GLU A 71 14.755 -6.467 -7.073 1.00 63.34 C ATOM 1171 OE1 GLU A 71 15.193 -6.386 -5.905 1.00 11.12 O ATOM 1172 OE2 GLU A 71 15.482 -6.253 -8.065 1.00 23.14 O ATOM 0 H GLU A 71 10.508 -4.138 -6.260 1.00 54.33 H new ATOM 0 HA GLU A 71 10.446 -6.502 -7.687 1.00 4.30 H new ATOM 0 HB2 GLU A 71 12.351 -4.943 -7.687 1.00 42.24 H new ATOM 0 HB3 GLU A 71 12.645 -5.234 -5.984 1.00 42.24 H new ATOM 0 HG2 GLU A 71 13.057 -7.722 -6.664 1.00 35.43 H new ATOM 0 HG3 GLU A 71 13.129 -7.134 -8.313 1.00 35.43 H new ATOM 1179 N TYR A 72 10.868 -6.988 -4.430 1.00 74.05 N ATOM 1180 CA TYR A 72 10.847 -7.971 -3.338 1.00 72.42 C ATOM 1181 C TYR A 72 9.539 -8.774 -3.348 1.00 0.12 C ATOM 1182 O TYR A 72 9.560 -9.998 -3.337 1.00 34.12 O ATOM 1183 CB TYR A 72 11.034 -7.274 -1.966 1.00 21.22 C ATOM 1184 CG TYR A 72 11.142 -8.249 -0.779 1.00 12.24 C ATOM 1185 CD1 TYR A 72 10.003 -8.690 -0.092 1.00 43.42 C ATOM 1186 CD2 TYR A 72 12.380 -8.742 -0.356 1.00 20.31 C ATOM 1187 CE1 TYR A 72 10.097 -9.578 0.959 1.00 4.04 C ATOM 1188 CE2 TYR A 72 12.472 -9.628 0.700 1.00 70.14 C ATOM 1189 CZ TYR A 72 11.332 -10.043 1.351 1.00 54.43 C ATOM 1190 OH TYR A 72 11.431 -10.924 2.406 1.00 52.34 O ATOM 0 H TYR A 72 10.961 -6.024 -4.109 1.00 74.05 H new ATOM 0 HA TYR A 72 11.677 -8.660 -3.495 1.00 72.42 H new ATOM 0 HB2 TYR A 72 11.934 -6.660 -2.002 1.00 21.22 H new ATOM 0 HB3 TYR A 72 10.194 -6.600 -1.795 1.00 21.22 H new ATOM 0 HD1 TYR A 72 9.031 -8.327 -0.392 1.00 43.42 H new ATOM 0 HD2 TYR A 72 13.279 -8.425 -0.863 1.00 20.31 H new ATOM 0 HE1 TYR A 72 9.206 -9.907 1.472 1.00 4.04 H new ATOM 0 HE2 TYR A 72 13.438 -9.995 1.015 1.00 70.14 H new ATOM 0 HH TYR A 72 12.372 -11.154 2.553 1.00 52.34 H new ATOM 1200 N ALA A 73 8.404 -8.072 -3.377 1.00 14.13 N ATOM 1201 CA ALA A 73 7.086 -8.721 -3.335 1.00 54.24 C ATOM 1202 C ALA A 73 6.836 -9.563 -4.603 1.00 61.13 C ATOM 1203 O ALA A 73 6.248 -10.629 -4.513 1.00 54.30 O ATOM 1204 CB ALA A 73 5.990 -7.681 -3.121 1.00 45.45 C ATOM 0 H ALA A 73 8.368 -7.054 -3.429 1.00 14.13 H new ATOM 0 HA ALA A 73 7.066 -9.408 -2.489 1.00 54.24 H new ATOM 0 HB1 ALA A 73 5.019 -8.176 -3.092 1.00 45.45 H new ATOM 0 HB2 ALA A 73 6.161 -7.161 -2.178 1.00 45.45 H new ATOM 0 HB3 ALA A 73 6.006 -6.962 -3.940 1.00 45.45 H new ATOM 1210 N GLN A 74 7.352 -9.100 -5.762 1.00 12.03 N ATOM 1211 CA GLN A 74 7.165 -9.793 -7.061 1.00 71.21 C ATOM 1212 C GLN A 74 7.889 -11.164 -7.076 1.00 41.04 C ATOM 1213 O GLN A 74 7.315 -12.173 -7.508 1.00 70.21 O ATOM 1214 CB GLN A 74 7.664 -8.897 -8.230 1.00 24.24 C ATOM 1215 CG GLN A 74 6.879 -7.570 -8.429 1.00 3.22 C ATOM 1216 CD GLN A 74 5.445 -7.709 -8.986 1.00 63.41 C ATOM 1217 OE1 GLN A 74 4.758 -8.712 -8.781 1.00 31.31 O ATOM 1218 NE2 GLN A 74 4.980 -6.685 -9.692 1.00 20.11 N ATOM 0 H GLN A 74 7.904 -8.245 -5.827 1.00 12.03 H new ATOM 0 HA GLN A 74 6.099 -9.978 -7.194 1.00 71.21 H new ATOM 0 HB2 GLN A 74 8.714 -8.657 -8.060 1.00 24.24 H new ATOM 0 HB3 GLN A 74 7.614 -9.472 -9.154 1.00 24.24 H new ATOM 0 HG2 GLN A 74 6.827 -7.055 -7.470 1.00 3.22 H new ATOM 0 HG3 GLN A 74 7.449 -6.931 -9.103 1.00 3.22 H new ATOM 0 HE21 GLN A 74 5.567 -5.865 -9.849 1.00 20.11 H new ATOM 0 HE22 GLN A 74 4.036 -6.718 -10.077 1.00 20.11 H new ATOM 1227 N LYS A 75 9.150 -11.184 -6.589 1.00 44.02 N ATOM 1228 CA LYS A 75 9.953 -12.432 -6.473 1.00 33.13 C ATOM 1229 C LYS A 75 9.424 -13.321 -5.326 1.00 54.51 C ATOM 1230 O LYS A 75 9.614 -14.541 -5.326 1.00 4.10 O ATOM 1231 CB LYS A 75 11.464 -12.100 -6.274 1.00 13.44 C ATOM 1232 CG LYS A 75 11.768 -11.232 -5.040 1.00 3.44 C ATOM 1233 CD LYS A 75 13.265 -10.956 -4.801 1.00 71.51 C ATOM 1234 CE LYS A 75 14.033 -12.211 -4.368 1.00 12.13 C ATOM 1235 NZ LYS A 75 13.476 -12.817 -3.120 1.00 55.02 N ATOM 0 H LYS A 75 9.639 -10.349 -6.268 1.00 44.02 H new ATOM 0 HA LYS A 75 9.851 -12.991 -7.403 1.00 33.13 H new ATOM 0 HB2 LYS A 75 12.021 -13.034 -6.192 1.00 13.44 H new ATOM 0 HB3 LYS A 75 11.831 -11.587 -7.163 1.00 13.44 H new ATOM 0 HG2 LYS A 75 11.249 -10.279 -5.146 1.00 3.44 H new ATOM 0 HG3 LYS A 75 11.357 -11.722 -4.157 1.00 3.44 H new ATOM 0 HD2 LYS A 75 13.708 -10.560 -5.715 1.00 71.51 H new ATOM 0 HD3 LYS A 75 13.372 -10.187 -4.036 1.00 71.51 H new ATOM 0 HE2 LYS A 75 14.003 -12.947 -5.171 1.00 12.13 H new ATOM 0 HE3 LYS A 75 15.081 -11.956 -4.209 1.00 12.13 H new ATOM 0 HZ1 LYS A 75 14.249 -13.001 -2.449 1.00 55.02 H new ATOM 0 HZ2 LYS A 75 12.793 -12.161 -2.691 1.00 55.02 H new ATOM 0 HZ3 LYS A 75 12.999 -13.711 -3.352 1.00 55.02 H new ATOM 1249 N GLU A 76 8.740 -12.684 -4.356 1.00 14.01 N ATOM 1250 CA GLU A 76 8.030 -13.366 -3.251 1.00 13.45 C ATOM 1251 C GLU A 76 6.627 -13.858 -3.693 1.00 51.11 C ATOM 1252 O GLU A 76 5.860 -14.354 -2.863 1.00 3.41 O ATOM 1253 CB GLU A 76 7.951 -12.408 -2.008 1.00 42.34 C ATOM 1254 CG GLU A 76 9.091 -12.569 -0.961 1.00 43.42 C ATOM 1255 CD GLU A 76 10.528 -12.693 -1.539 1.00 23.43 C ATOM 1256 OE1 GLU A 76 10.983 -13.827 -1.820 1.00 10.32 O ATOM 1257 OE2 GLU A 76 11.220 -11.671 -1.689 1.00 71.11 O ATOM 0 H GLU A 76 8.663 -11.668 -4.315 1.00 14.01 H new ATOM 0 HA GLU A 76 8.591 -14.256 -2.967 1.00 13.45 H new ATOM 0 HB2 GLU A 76 7.953 -11.378 -2.365 1.00 42.34 H new ATOM 0 HB3 GLU A 76 6.997 -12.570 -1.507 1.00 42.34 H new ATOM 0 HG2 GLU A 76 9.063 -11.713 -0.287 1.00 43.42 H new ATOM 0 HG3 GLU A 76 8.884 -13.454 -0.360 1.00 43.42 H new ATOM 1264 N GLY A 77 6.302 -13.711 -5.000 1.00 41.33 N ATOM 1265 CA GLY A 77 5.060 -14.253 -5.573 1.00 33.03 C ATOM 1266 C GLY A 77 3.802 -13.565 -5.053 1.00 21.32 C ATOM 1267 O GLY A 77 2.725 -14.165 -5.007 1.00 73.10 O ATOM 0 H GLY A 77 6.889 -13.219 -5.674 1.00 41.33 H new ATOM 0 HA2 GLY A 77 5.096 -14.155 -6.658 1.00 33.03 H new ATOM 0 HA3 GLY A 77 5.001 -15.318 -5.351 1.00 33.03 H new ATOM 1271 N LEU A 78 3.959 -12.298 -4.671 1.00 30.42 N ATOM 1272 CA LEU A 78 2.917 -11.480 -4.043 1.00 61.42 C ATOM 1273 C LEU A 78 2.598 -10.285 -4.949 1.00 44.44 C ATOM 1274 O LEU A 78 3.504 -9.560 -5.378 1.00 70.31 O ATOM 1275 CB LEU A 78 3.385 -10.999 -2.632 1.00 65.33 C ATOM 1276 CG LEU A 78 3.689 -12.128 -1.589 1.00 50.40 C ATOM 1277 CD1 LEU A 78 4.151 -11.547 -0.244 1.00 43.54 C ATOM 1278 CD2 LEU A 78 2.475 -13.063 -1.401 1.00 22.05 C ATOM 0 H LEU A 78 4.839 -11.796 -4.792 1.00 30.42 H new ATOM 0 HA LEU A 78 2.014 -12.076 -3.912 1.00 61.42 H new ATOM 0 HB2 LEU A 78 4.283 -10.394 -2.755 1.00 65.33 H new ATOM 0 HB3 LEU A 78 2.616 -10.347 -2.218 1.00 65.33 H new ATOM 0 HG LEU A 78 4.510 -12.723 -1.989 1.00 50.40 H new ATOM 0 HD11 LEU A 78 4.352 -12.360 0.454 1.00 43.54 H new ATOM 0 HD12 LEU A 78 5.059 -10.963 -0.393 1.00 43.54 H new ATOM 0 HD13 LEU A 78 3.370 -10.905 0.163 1.00 43.54 H new ATOM 0 HD21 LEU A 78 2.720 -13.835 -0.671 1.00 22.05 H new ATOM 0 HD22 LEU A 78 1.622 -12.485 -1.046 1.00 22.05 H new ATOM 0 HD23 LEU A 78 2.225 -13.531 -2.353 1.00 22.05 H new ATOM 1290 N ARG A 79 1.301 -10.106 -5.244 1.00 12.42 N ATOM 1291 CA ARG A 79 0.810 -9.017 -6.097 1.00 34.12 C ATOM 1292 C ARG A 79 0.878 -7.701 -5.300 1.00 1.11 C ATOM 1293 O ARG A 79 0.540 -7.671 -4.119 1.00 31.53 O ATOM 1294 CB ARG A 79 -0.637 -9.356 -6.578 1.00 1.44 C ATOM 1295 CG ARG A 79 -1.267 -8.385 -7.621 1.00 44.14 C ATOM 1296 CD ARG A 79 -2.003 -7.179 -7.002 1.00 63.43 C ATOM 1297 NE ARG A 79 -3.208 -7.589 -6.263 1.00 11.10 N ATOM 1298 CZ ARG A 79 -4.476 -7.393 -6.670 1.00 64.11 C ATOM 1299 NH1 ARG A 79 -4.745 -6.783 -7.831 1.00 14.21 N ATOM 1300 NH2 ARG A 79 -5.477 -7.804 -5.905 1.00 75.53 N ATOM 0 H ARG A 79 0.562 -10.716 -4.895 1.00 12.42 H new ATOM 0 HA ARG A 79 1.427 -8.899 -6.988 1.00 34.12 H new ATOM 0 HB2 ARG A 79 -0.628 -10.358 -7.006 1.00 1.44 H new ATOM 0 HB3 ARG A 79 -1.288 -9.388 -5.705 1.00 1.44 H new ATOM 0 HG2 ARG A 79 -0.480 -8.017 -8.279 1.00 44.14 H new ATOM 0 HG3 ARG A 79 -1.967 -8.943 -8.243 1.00 44.14 H new ATOM 0 HD2 ARG A 79 -1.328 -6.649 -6.330 1.00 63.43 H new ATOM 0 HD3 ARG A 79 -2.282 -6.480 -7.791 1.00 63.43 H new ATOM 0 HE ARG A 79 -3.071 -8.060 -5.369 1.00 11.10 H new ATOM 0 HH11 ARG A 79 -3.982 -6.457 -8.425 1.00 14.21 H new ATOM 0 HH12 ARG A 79 -5.713 -6.644 -8.122 1.00 14.21 H new ATOM 0 HH21 ARG A 79 -5.283 -8.265 -5.016 1.00 75.53 H new ATOM 0 HH22 ARG A 79 -6.441 -7.660 -6.205 1.00 75.53 H new ATOM 1314 N VAL A 80 1.302 -6.624 -5.967 1.00 23.42 N ATOM 1315 CA VAL A 80 1.492 -5.300 -5.349 1.00 72.12 C ATOM 1316 C VAL A 80 0.387 -4.357 -5.842 1.00 4.00 C ATOM 1317 O VAL A 80 0.114 -4.272 -7.048 1.00 22.31 O ATOM 1318 CB VAL A 80 2.932 -4.686 -5.627 1.00 1.41 C ATOM 1319 CG1 VAL A 80 3.979 -5.262 -4.654 1.00 31.12 C ATOM 1320 CG2 VAL A 80 3.380 -4.914 -7.090 1.00 22.03 C ATOM 0 H VAL A 80 1.527 -6.642 -6.962 1.00 23.42 H new ATOM 0 HA VAL A 80 1.425 -5.421 -4.268 1.00 72.12 H new ATOM 0 HB VAL A 80 2.857 -3.611 -5.462 1.00 1.41 H new ATOM 0 HG11 VAL A 80 4.954 -4.824 -4.868 1.00 31.12 H new ATOM 0 HG12 VAL A 80 3.692 -5.026 -3.629 1.00 31.12 H new ATOM 0 HG13 VAL A 80 4.033 -6.344 -4.776 1.00 31.12 H new ATOM 0 HG21 VAL A 80 4.369 -4.480 -7.240 1.00 22.03 H new ATOM 0 HG22 VAL A 80 3.418 -5.984 -7.296 1.00 22.03 H new ATOM 0 HG23 VAL A 80 2.669 -4.439 -7.766 1.00 22.03 H new ATOM 1330 N LEU A 81 -0.248 -3.685 -4.886 1.00 43.40 N ATOM 1331 CA LEU A 81 -1.405 -2.821 -5.107 1.00 52.54 C ATOM 1332 C LEU A 81 -1.096 -1.493 -4.423 1.00 13.20 C ATOM 1333 O LEU A 81 -1.094 -1.425 -3.197 1.00 22.23 O ATOM 1334 CB LEU A 81 -2.658 -3.507 -4.472 1.00 54.42 C ATOM 1335 CG LEU A 81 -4.078 -3.041 -4.927 1.00 52.13 C ATOM 1336 CD1 LEU A 81 -4.294 -3.262 -6.424 1.00 64.24 C ATOM 1337 CD2 LEU A 81 -5.164 -3.781 -4.129 1.00 4.51 C ATOM 0 H LEU A 81 0.036 -3.727 -3.907 1.00 43.40 H new ATOM 0 HA LEU A 81 -1.608 -2.653 -6.165 1.00 52.54 H new ATOM 0 HB2 LEU A 81 -2.583 -4.577 -4.666 1.00 54.42 H new ATOM 0 HB3 LEU A 81 -2.596 -3.374 -3.392 1.00 54.42 H new ATOM 0 HG LEU A 81 -4.149 -1.971 -4.731 1.00 52.13 H new ATOM 0 HD11 LEU A 81 -5.293 -2.925 -6.701 1.00 64.24 H new ATOM 0 HD12 LEU A 81 -3.551 -2.696 -6.986 1.00 64.24 H new ATOM 0 HD13 LEU A 81 -4.192 -4.323 -6.654 1.00 64.24 H new ATOM 0 HD21 LEU A 81 -6.148 -3.446 -4.457 1.00 4.51 H new ATOM 0 HD22 LEU A 81 -5.071 -4.854 -4.297 1.00 4.51 H new ATOM 0 HD23 LEU A 81 -5.044 -3.568 -3.067 1.00 4.51 H new ATOM 1349 N VAL A 82 -0.797 -0.445 -5.195 1.00 41.31 N ATOM 1350 CA VAL A 82 -0.458 0.870 -4.623 1.00 3.35 C ATOM 1351 C VAL A 82 -1.652 1.795 -4.802 1.00 74.13 C ATOM 1352 O VAL A 82 -1.993 2.177 -5.920 1.00 62.14 O ATOM 1353 CB VAL A 82 0.837 1.485 -5.277 1.00 34.41 C ATOM 1354 CG1 VAL A 82 1.193 2.865 -4.654 1.00 13.30 C ATOM 1355 CG2 VAL A 82 2.018 0.493 -5.164 1.00 54.25 C ATOM 0 H VAL A 82 -0.781 -0.476 -6.214 1.00 41.31 H new ATOM 0 HA VAL A 82 -0.236 0.748 -3.563 1.00 3.35 H new ATOM 0 HB VAL A 82 0.634 1.657 -6.334 1.00 34.41 H new ATOM 0 HG11 VAL A 82 2.091 3.258 -5.130 1.00 13.30 H new ATOM 0 HG12 VAL A 82 0.367 3.559 -4.810 1.00 13.30 H new ATOM 0 HG13 VAL A 82 1.371 2.747 -3.585 1.00 13.30 H new ATOM 0 HG21 VAL A 82 2.906 0.931 -5.620 1.00 54.25 H new ATOM 0 HG22 VAL A 82 2.216 0.282 -4.113 1.00 54.25 H new ATOM 0 HG23 VAL A 82 1.765 -0.434 -5.679 1.00 54.25 H new ATOM 1365 N ILE A 83 -2.288 2.136 -3.688 1.00 43.43 N ATOM 1366 CA ILE A 83 -3.485 2.964 -3.664 1.00 73.14 C ATOM 1367 C ILE A 83 -3.143 4.331 -3.063 1.00 33.33 C ATOM 1368 O ILE A 83 -2.856 4.443 -1.868 1.00 4.10 O ATOM 1369 CB ILE A 83 -4.636 2.253 -2.858 1.00 2.51 C ATOM 1370 CG1 ILE A 83 -4.987 0.897 -3.551 1.00 33.31 C ATOM 1371 CG2 ILE A 83 -5.890 3.156 -2.720 1.00 62.32 C ATOM 1372 CD1 ILE A 83 -6.099 0.114 -2.890 1.00 22.03 C ATOM 0 H ILE A 83 -1.981 1.840 -2.762 1.00 43.43 H new ATOM 0 HA ILE A 83 -3.846 3.111 -4.682 1.00 73.14 H new ATOM 0 HB ILE A 83 -4.283 2.059 -1.845 1.00 2.51 H new ATOM 0 HG12 ILE A 83 -5.268 1.096 -4.585 1.00 33.31 H new ATOM 0 HG13 ILE A 83 -4.091 0.276 -3.577 1.00 33.31 H new ATOM 0 HG21 ILE A 83 -6.659 2.627 -2.158 1.00 62.32 H new ATOM 0 HG22 ILE A 83 -5.622 4.073 -2.195 1.00 62.32 H new ATOM 0 HG23 ILE A 83 -6.271 3.404 -3.711 1.00 62.32 H new ATOM 0 HD11 ILE A 83 -6.271 -0.810 -3.441 1.00 22.03 H new ATOM 0 HD12 ILE A 83 -5.817 -0.122 -1.864 1.00 22.03 H new ATOM 0 HD13 ILE A 83 -7.012 0.710 -2.888 1.00 22.03 H new ATOM 1384 N LYS A 84 -3.148 5.366 -3.905 1.00 30.33 N ATOM 1385 CA LYS A 84 -2.948 6.751 -3.474 1.00 23.23 C ATOM 1386 C LYS A 84 -4.076 7.600 -4.028 1.00 1.41 C ATOM 1387 O LYS A 84 -4.569 7.356 -5.151 1.00 12.32 O ATOM 1388 CB LYS A 84 -1.555 7.340 -3.866 1.00 51.15 C ATOM 1389 CG LYS A 84 -1.314 7.719 -5.346 1.00 62.44 C ATOM 1390 CD LYS A 84 -1.171 6.512 -6.295 1.00 44.42 C ATOM 1391 CE LYS A 84 -0.635 6.944 -7.665 1.00 13.32 C ATOM 1392 NZ LYS A 84 0.726 7.558 -7.564 1.00 0.44 N ATOM 0 H LYS A 84 -3.292 5.267 -4.910 1.00 30.33 H new ATOM 0 HA LYS A 84 -2.961 6.762 -2.384 1.00 23.23 H new ATOM 0 HB2 LYS A 84 -1.388 8.232 -3.262 1.00 51.15 H new ATOM 0 HB3 LYS A 84 -0.794 6.614 -3.580 1.00 51.15 H new ATOM 0 HG2 LYS A 84 -2.141 8.340 -5.689 1.00 62.44 H new ATOM 0 HG3 LYS A 84 -0.411 8.326 -5.411 1.00 62.44 H new ATOM 0 HD2 LYS A 84 -0.498 5.777 -5.854 1.00 44.42 H new ATOM 0 HD3 LYS A 84 -2.139 6.025 -6.417 1.00 44.42 H new ATOM 0 HE2 LYS A 84 -0.595 6.080 -8.328 1.00 13.32 H new ATOM 0 HE3 LYS A 84 -1.323 7.659 -8.115 1.00 13.32 H new ATOM 0 HZ1 LYS A 84 0.714 8.502 -8.000 1.00 0.44 H new ATOM 0 HZ2 LYS A 84 0.996 7.642 -6.563 1.00 0.44 H new ATOM 0 HZ3 LYS A 84 1.416 6.957 -8.059 1.00 0.44 H new ATOM 1406 N VAL A 85 -4.511 8.574 -3.234 1.00 13.11 N ATOM 1407 CA VAL A 85 -5.607 9.451 -3.617 1.00 62.41 C ATOM 1408 C VAL A 85 -5.061 10.531 -4.562 1.00 23.54 C ATOM 1409 O VAL A 85 -4.139 11.287 -4.219 1.00 43.55 O ATOM 1410 CB VAL A 85 -6.331 10.090 -2.375 1.00 32.21 C ATOM 1411 CG1 VAL A 85 -5.338 10.708 -1.379 1.00 45.12 C ATOM 1412 CG2 VAL A 85 -7.383 11.134 -2.815 1.00 21.10 C ATOM 0 H VAL A 85 -4.116 8.775 -2.315 1.00 13.11 H new ATOM 0 HA VAL A 85 -6.366 8.858 -4.128 1.00 62.41 H new ATOM 0 HB VAL A 85 -6.846 9.279 -1.861 1.00 32.21 H new ATOM 0 HG11 VAL A 85 -5.884 11.136 -0.539 1.00 45.12 H new ATOM 0 HG12 VAL A 85 -4.660 9.936 -1.015 1.00 45.12 H new ATOM 0 HG13 VAL A 85 -4.764 11.490 -1.875 1.00 45.12 H new ATOM 0 HG21 VAL A 85 -7.866 11.557 -1.934 1.00 21.10 H new ATOM 0 HG22 VAL A 85 -6.894 11.929 -3.378 1.00 21.10 H new ATOM 0 HG23 VAL A 85 -8.132 10.653 -3.444 1.00 21.10 H new ATOM 1422 N ALA A 86 -5.611 10.530 -5.783 1.00 31.40 N ATOM 1423 CA ALA A 86 -5.186 11.428 -6.845 1.00 23.23 C ATOM 1424 C ALA A 86 -5.709 12.850 -6.588 1.00 12.22 C ATOM 1425 O ALA A 86 -6.711 13.054 -5.888 1.00 73.21 O ATOM 1426 CB ALA A 86 -5.648 10.893 -8.212 1.00 51.34 C ATOM 0 H ALA A 86 -6.366 9.901 -6.055 1.00 31.40 H new ATOM 0 HA ALA A 86 -4.097 11.474 -6.856 1.00 23.23 H new ATOM 0 HB1 ALA A 86 -5.323 11.575 -8.998 1.00 51.34 H new ATOM 0 HB2 ALA A 86 -5.213 9.908 -8.383 1.00 51.34 H new ATOM 0 HB3 ALA A 86 -6.735 10.817 -8.224 1.00 51.34 H new ATOM 1432 N GLN A 87 -4.977 13.795 -7.151 1.00 53.21 N ATOM 1433 CA GLN A 87 -5.263 15.229 -7.145 1.00 1.42 C ATOM 1434 C GLN A 87 -4.318 15.848 -8.187 1.00 51.01 C ATOM 1435 O GLN A 87 -3.359 15.176 -8.608 1.00 75.53 O ATOM 1436 CB GLN A 87 -5.072 15.871 -5.735 1.00 50.51 C ATOM 1437 CG GLN A 87 -3.683 15.656 -5.112 1.00 12.51 C ATOM 1438 CD GLN A 87 -3.495 16.389 -3.778 1.00 23.41 C ATOM 1439 OE1 GLN A 87 -3.069 17.544 -3.750 1.00 73.02 O ATOM 1440 NE2 GLN A 87 -3.796 15.734 -2.670 1.00 52.23 N ATOM 0 H GLN A 87 -4.117 13.576 -7.654 1.00 53.21 H new ATOM 0 HA GLN A 87 -6.308 15.416 -7.393 1.00 1.42 H new ATOM 0 HB2 GLN A 87 -5.259 16.942 -5.811 1.00 50.51 H new ATOM 0 HB3 GLN A 87 -5.825 15.463 -5.060 1.00 50.51 H new ATOM 0 HG2 GLN A 87 -3.523 14.589 -4.958 1.00 12.51 H new ATOM 0 HG3 GLN A 87 -2.921 15.994 -5.815 1.00 12.51 H new ATOM 0 HE21 GLN A 87 -4.147 14.778 -2.722 1.00 52.23 H new ATOM 0 HE22 GLN A 87 -3.677 16.185 -1.763 1.00 52.23 H new ATOM 1449 N ASP A 88 -4.573 17.106 -8.588 1.00 3.02 N ATOM 1450 CA ASP A 88 -3.876 17.756 -9.721 1.00 64.33 C ATOM 1451 C ASP A 88 -2.358 17.951 -9.427 1.00 52.43 C ATOM 1452 O ASP A 88 -1.925 18.999 -8.933 1.00 41.11 O ATOM 1453 CB ASP A 88 -4.595 19.083 -10.074 1.00 32.03 C ATOM 1454 CG ASP A 88 -4.013 19.786 -11.318 1.00 22.02 C ATOM 1455 OD1 ASP A 88 -4.237 19.299 -12.452 1.00 55.13 O ATOM 1456 OD2 ASP A 88 -3.323 20.819 -11.172 1.00 32.34 O ATOM 0 H ASP A 88 -5.267 17.703 -8.139 1.00 3.02 H new ATOM 0 HA ASP A 88 -3.923 17.104 -10.594 1.00 64.33 H new ATOM 0 HB2 ASP A 88 -5.653 18.880 -10.242 1.00 32.03 H new ATOM 0 HB3 ASP A 88 -4.532 19.759 -9.221 1.00 32.03 H new ATOM 1461 N GLN A 89 -1.588 16.862 -9.669 1.00 33.11 N ATOM 1462 CA GLN A 89 -0.127 16.784 -9.514 1.00 64.41 C ATOM 1463 C GLN A 89 0.444 15.940 -10.679 1.00 64.12 C ATOM 1464 O GLN A 89 0.118 14.747 -10.803 1.00 21.30 O ATOM 1465 CB GLN A 89 0.276 16.110 -8.165 1.00 65.52 C ATOM 1466 CG GLN A 89 -0.285 16.754 -6.885 1.00 13.04 C ATOM 1467 CD GLN A 89 0.165 16.019 -5.617 1.00 41.00 C ATOM 1468 OE1 GLN A 89 1.175 16.360 -5.000 1.00 74.25 O ATOM 1469 NE2 GLN A 89 -0.550 14.968 -5.246 1.00 41.21 N ATOM 0 H GLN A 89 -1.991 15.982 -9.990 1.00 33.11 H new ATOM 0 HA GLN A 89 0.274 17.797 -9.521 1.00 64.41 H new ATOM 0 HB2 GLN A 89 -0.046 15.069 -8.193 1.00 65.52 H new ATOM 0 HB3 GLN A 89 1.364 16.105 -8.097 1.00 65.52 H new ATOM 0 HG2 GLN A 89 0.038 17.794 -6.833 1.00 13.04 H new ATOM 0 HG3 GLN A 89 -1.374 16.760 -6.931 1.00 13.04 H new ATOM 0 HE21 GLN A 89 -1.383 14.706 -5.773 1.00 41.21 H new ATOM 0 HE22 GLN A 89 -0.268 14.421 -4.433 1.00 41.21 H new ATOM 1478 N GLU A 90 1.288 16.564 -11.514 1.00 73.11 N ATOM 1479 CA GLU A 90 1.988 15.881 -12.620 1.00 34.13 C ATOM 1480 C GLU A 90 3.041 14.894 -12.078 1.00 35.33 C ATOM 1481 O GLU A 90 3.284 13.847 -12.680 1.00 15.32 O ATOM 1482 CB GLU A 90 2.646 16.926 -13.556 1.00 33.32 C ATOM 1483 CG GLU A 90 1.632 17.859 -14.253 1.00 73.10 C ATOM 1484 CD GLU A 90 2.293 18.938 -15.119 1.00 51.04 C ATOM 1485 OE1 GLU A 90 2.634 18.660 -16.288 1.00 5.43 O ATOM 1486 OE2 GLU A 90 2.492 20.070 -14.636 1.00 51.34 O ATOM 0 H GLU A 90 1.507 17.558 -11.444 1.00 73.11 H new ATOM 0 HA GLU A 90 1.258 15.309 -13.192 1.00 34.13 H new ATOM 0 HB2 GLU A 90 3.345 17.530 -12.977 1.00 33.32 H new ATOM 0 HB3 GLU A 90 3.229 16.405 -14.316 1.00 33.32 H new ATOM 0 HG2 GLU A 90 0.967 17.260 -14.876 1.00 73.10 H new ATOM 0 HG3 GLU A 90 1.012 18.340 -13.496 1.00 73.10 H new ATOM 1493 N LEU A 91 3.641 15.250 -10.924 1.00 52.43 N ATOM 1494 CA LEU A 91 4.641 14.421 -10.218 1.00 53.05 C ATOM 1495 C LEU A 91 4.025 13.079 -9.760 1.00 0.41 C ATOM 1496 O LEU A 91 4.641 12.014 -9.923 1.00 73.21 O ATOM 1497 CB LEU A 91 5.190 15.213 -8.999 1.00 71.24 C ATOM 1498 CG LEU A 91 6.274 14.504 -8.121 1.00 11.35 C ATOM 1499 CD1 LEU A 91 7.544 14.188 -8.933 1.00 31.40 C ATOM 1500 CD2 LEU A 91 6.601 15.339 -6.860 1.00 23.11 C ATOM 0 H LEU A 91 3.443 16.131 -10.450 1.00 52.43 H new ATOM 0 HA LEU A 91 5.459 14.192 -10.901 1.00 53.05 H new ATOM 0 HB2 LEU A 91 5.610 16.150 -9.365 1.00 71.24 H new ATOM 0 HB3 LEU A 91 4.349 15.471 -8.356 1.00 71.24 H new ATOM 0 HG LEU A 91 5.859 13.552 -7.790 1.00 11.35 H new ATOM 0 HD11 LEU A 91 8.274 13.696 -8.290 1.00 31.40 H new ATOM 0 HD12 LEU A 91 7.290 13.530 -9.764 1.00 31.40 H new ATOM 0 HD13 LEU A 91 7.968 15.114 -9.321 1.00 31.40 H new ATOM 0 HD21 LEU A 91 7.357 14.823 -6.268 1.00 23.11 H new ATOM 0 HD22 LEU A 91 6.979 16.317 -7.159 1.00 23.11 H new ATOM 0 HD23 LEU A 91 5.698 15.466 -6.264 1.00 23.11 H new ATOM 1512 N LEU A 92 2.789 13.158 -9.209 1.00 1.33 N ATOM 1513 CA LEU A 92 2.025 11.983 -8.722 1.00 70.14 C ATOM 1514 C LEU A 92 1.810 10.972 -9.860 1.00 14.31 C ATOM 1515 O LEU A 92 2.015 9.767 -9.672 1.00 33.10 O ATOM 1516 CB LEU A 92 0.669 12.458 -8.094 1.00 31.24 C ATOM 1517 CG LEU A 92 -0.350 11.358 -7.563 1.00 35.14 C ATOM 1518 CD1 LEU A 92 -1.176 11.878 -6.359 1.00 11.23 C ATOM 1519 CD2 LEU A 92 -1.318 10.865 -8.678 1.00 33.11 C ATOM 0 H LEU A 92 2.293 14.041 -9.090 1.00 1.33 H new ATOM 0 HA LEU A 92 2.595 11.474 -7.945 1.00 70.14 H new ATOM 0 HB2 LEU A 92 0.904 13.121 -7.261 1.00 31.24 H new ATOM 0 HB3 LEU A 92 0.150 13.057 -8.842 1.00 31.24 H new ATOM 0 HG LEU A 92 0.260 10.515 -7.239 1.00 35.14 H new ATOM 0 HD11 LEU A 92 -1.861 11.099 -6.024 1.00 11.23 H new ATOM 0 HD12 LEU A 92 -0.503 12.145 -5.544 1.00 11.23 H new ATOM 0 HD13 LEU A 92 -1.746 12.757 -6.661 1.00 11.23 H new ATOM 0 HD21 LEU A 92 -1.994 10.115 -8.267 1.00 33.11 H new ATOM 0 HD22 LEU A 92 -1.897 11.708 -9.056 1.00 33.11 H new ATOM 0 HD23 LEU A 92 -0.742 10.426 -9.493 1.00 33.11 H new ATOM 1531 N GLU A 93 1.423 11.493 -11.042 1.00 52.15 N ATOM 1532 CA GLU A 93 1.123 10.673 -12.230 1.00 2.41 C ATOM 1533 C GLU A 93 2.400 10.180 -12.937 1.00 63.33 C ATOM 1534 O GLU A 93 2.382 9.113 -13.566 1.00 33.44 O ATOM 1535 CB GLU A 93 0.247 11.461 -13.226 1.00 14.43 C ATOM 1536 CG GLU A 93 -1.149 11.835 -12.701 1.00 71.23 C ATOM 1537 CD GLU A 93 -2.008 12.469 -13.796 1.00 53.03 C ATOM 1538 OE1 GLU A 93 -1.960 13.702 -13.961 1.00 45.21 O ATOM 1539 OE2 GLU A 93 -2.695 11.735 -14.539 1.00 42.02 O ATOM 0 H GLU A 93 1.310 12.495 -11.198 1.00 52.15 H new ATOM 0 HA GLU A 93 0.578 9.797 -11.880 1.00 2.41 H new ATOM 0 HB2 GLU A 93 0.771 12.375 -13.505 1.00 14.43 H new ATOM 0 HB3 GLU A 93 0.132 10.869 -14.134 1.00 14.43 H new ATOM 0 HG2 GLU A 93 -1.646 10.944 -12.318 1.00 71.23 H new ATOM 0 HG3 GLU A 93 -1.051 12.529 -11.866 1.00 71.23 H new ATOM 1546 N ARG A 94 3.499 10.953 -12.839 1.00 23.31 N ATOM 1547 CA ARG A 94 4.758 10.605 -13.521 1.00 4.03 C ATOM 1548 C ARG A 94 5.338 9.324 -12.915 1.00 63.03 C ATOM 1549 O ARG A 94 5.617 8.359 -13.635 1.00 54.24 O ATOM 1550 CB ARG A 94 5.795 11.750 -13.435 1.00 3.14 C ATOM 1551 CG ARG A 94 7.021 11.548 -14.359 1.00 62.02 C ATOM 1552 CD ARG A 94 8.176 12.501 -14.032 1.00 51.22 C ATOM 1553 NE ARG A 94 8.713 12.246 -12.692 1.00 12.10 N ATOM 1554 CZ ARG A 94 9.485 13.083 -11.987 1.00 51.41 C ATOM 1555 NH1 ARG A 94 9.833 14.279 -12.466 1.00 34.03 N ATOM 1556 NH2 ARG A 94 9.908 12.711 -10.794 1.00 35.53 N ATOM 0 H ARG A 94 3.540 11.817 -12.298 1.00 23.31 H new ATOM 0 HA ARG A 94 4.534 10.444 -14.575 1.00 4.03 H new ATOM 0 HB2 ARG A 94 5.308 12.690 -13.693 1.00 3.14 H new ATOM 0 HB3 ARG A 94 6.138 11.841 -12.405 1.00 3.14 H new ATOM 0 HG2 ARG A 94 7.370 10.519 -14.272 1.00 62.02 H new ATOM 0 HG3 ARG A 94 6.717 11.695 -15.395 1.00 62.02 H new ATOM 0 HD2 ARG A 94 8.968 12.384 -14.772 1.00 51.22 H new ATOM 0 HD3 ARG A 94 7.829 13.532 -14.097 1.00 51.22 H new ATOM 0 HE ARG A 94 8.478 11.353 -12.259 1.00 12.10 H new ATOM 0 HH11 ARG A 94 9.510 14.573 -13.388 1.00 34.03 H new ATOM 0 HH12 ARG A 94 10.422 14.899 -11.910 1.00 34.03 H new ATOM 0 HH21 ARG A 94 9.646 11.798 -10.422 1.00 35.53 H new ATOM 0 HH22 ARG A 94 10.497 13.336 -10.244 1.00 35.53 H new ATOM 1570 N PHE A 95 5.450 9.326 -11.573 1.00 71.44 N ATOM 1571 CA PHE A 95 5.961 8.184 -10.811 1.00 75.00 C ATOM 1572 C PHE A 95 5.011 6.978 -10.933 1.00 60.12 C ATOM 1573 O PHE A 95 5.461 5.848 -11.115 1.00 75.51 O ATOM 1574 CB PHE A 95 6.173 8.578 -9.329 1.00 13.51 C ATOM 1575 CG PHE A 95 6.721 7.433 -8.484 1.00 11.45 C ATOM 1576 CD1 PHE A 95 8.001 6.927 -8.726 1.00 1.04 C ATOM 1577 CD2 PHE A 95 5.949 6.830 -7.492 1.00 15.34 C ATOM 1578 CE1 PHE A 95 8.484 5.861 -8.001 1.00 14.42 C ATOM 1579 CE2 PHE A 95 6.434 5.758 -6.779 1.00 41.23 C ATOM 1580 CZ PHE A 95 7.702 5.275 -7.029 1.00 45.54 C ATOM 0 H PHE A 95 5.187 10.122 -10.992 1.00 71.44 H new ATOM 0 HA PHE A 95 6.925 7.892 -11.227 1.00 75.00 H new ATOM 0 HB2 PHE A 95 6.860 9.422 -9.277 1.00 13.51 H new ATOM 0 HB3 PHE A 95 5.225 8.912 -8.908 1.00 13.51 H new ATOM 0 HD1 PHE A 95 8.618 7.377 -9.490 1.00 1.04 H new ATOM 0 HD2 PHE A 95 4.960 7.208 -7.281 1.00 15.34 H new ATOM 0 HE1 PHE A 95 9.477 5.483 -8.194 1.00 14.42 H new ATOM 0 HE2 PHE A 95 5.820 5.293 -6.021 1.00 41.23 H new ATOM 0 HZ PHE A 95 8.082 4.437 -6.463 1.00 45.54 H new ATOM 1590 N TYR A 96 3.699 7.266 -10.873 1.00 2.34 N ATOM 1591 CA TYR A 96 2.602 6.275 -11.015 1.00 43.32 C ATOM 1592 C TYR A 96 2.748 5.413 -12.300 1.00 13.53 C ATOM 1593 O TYR A 96 2.341 4.242 -12.323 1.00 62.34 O ATOM 1594 CB TYR A 96 1.235 7.053 -10.953 1.00 2.14 C ATOM 1595 CG TYR A 96 0.101 6.605 -11.892 1.00 4.03 C ATOM 1596 CD1 TYR A 96 -0.738 5.553 -11.556 1.00 14.33 C ATOM 1597 CD2 TYR A 96 -0.127 7.255 -13.106 1.00 61.31 C ATOM 1598 CE1 TYR A 96 -1.755 5.154 -12.395 1.00 11.21 C ATOM 1599 CE2 TYR A 96 -1.140 6.869 -13.947 1.00 14.05 C ATOM 1600 CZ TYR A 96 -1.954 5.820 -13.591 1.00 24.34 C ATOM 1601 OH TYR A 96 -2.948 5.423 -14.450 1.00 13.01 O ATOM 0 H TYR A 96 3.357 8.215 -10.721 1.00 2.34 H new ATOM 0 HA TYR A 96 2.644 5.557 -10.196 1.00 43.32 H new ATOM 0 HB2 TYR A 96 0.864 6.993 -9.930 1.00 2.14 H new ATOM 0 HB3 TYR A 96 1.440 8.104 -11.156 1.00 2.14 H new ATOM 0 HD1 TYR A 96 -0.591 5.037 -10.619 1.00 14.33 H new ATOM 0 HD2 TYR A 96 0.509 8.081 -13.390 1.00 61.31 H new ATOM 0 HE1 TYR A 96 -2.393 4.327 -12.121 1.00 11.21 H new ATOM 0 HE2 TYR A 96 -1.297 7.386 -14.882 1.00 14.05 H new ATOM 0 HH TYR A 96 -3.093 6.117 -15.126 1.00 13.01 H new ATOM 1611 N GLU A 97 3.341 6.007 -13.353 1.00 62.23 N ATOM 1612 CA GLU A 97 3.525 5.342 -14.652 1.00 34.44 C ATOM 1613 C GLU A 97 4.657 4.297 -14.578 1.00 71.23 C ATOM 1614 O GLU A 97 4.554 3.237 -15.202 1.00 52.45 O ATOM 1615 CB GLU A 97 3.826 6.375 -15.758 1.00 60.30 C ATOM 1616 CG GLU A 97 3.927 5.760 -17.167 1.00 31.14 C ATOM 1617 CD GLU A 97 4.373 6.754 -18.237 1.00 5.10 C ATOM 1618 OE1 GLU A 97 3.516 7.430 -18.836 1.00 22.30 O ATOM 1619 OE2 GLU A 97 5.593 6.841 -18.503 1.00 0.41 O ATOM 0 H GLU A 97 3.705 6.960 -13.325 1.00 62.23 H new ATOM 0 HA GLU A 97 2.596 4.829 -14.900 1.00 34.44 H new ATOM 0 HB2 GLU A 97 3.043 7.134 -15.757 1.00 60.30 H new ATOM 0 HB3 GLU A 97 4.762 6.882 -15.524 1.00 60.30 H new ATOM 0 HG2 GLU A 97 4.630 4.927 -17.141 1.00 31.14 H new ATOM 0 HG3 GLU A 97 2.956 5.350 -17.446 1.00 31.14 H new ATOM 1626 N GLN A 98 5.720 4.605 -13.799 1.00 33.50 N ATOM 1627 CA GLN A 98 6.872 3.689 -13.589 1.00 30.14 C ATOM 1628 C GLN A 98 6.427 2.364 -12.936 1.00 43.14 C ATOM 1629 O GLN A 98 7.044 1.314 -13.159 1.00 1.11 O ATOM 1630 CB GLN A 98 7.989 4.364 -12.731 1.00 33.22 C ATOM 1631 CG GLN A 98 8.934 5.316 -13.505 1.00 2.02 C ATOM 1632 CD GLN A 98 8.272 6.613 -13.950 1.00 61.02 C ATOM 1633 OE1 GLN A 98 8.321 7.623 -13.249 1.00 41.25 O ATOM 1634 NE2 GLN A 98 7.639 6.601 -15.113 1.00 31.51 N ATOM 0 H GLN A 98 5.806 5.490 -13.299 1.00 33.50 H new ATOM 0 HA GLN A 98 7.284 3.465 -14.573 1.00 30.14 H new ATOM 0 HB2 GLN A 98 7.516 4.925 -11.925 1.00 33.22 H new ATOM 0 HB3 GLN A 98 8.589 3.582 -12.266 1.00 33.22 H new ATOM 0 HG2 GLN A 98 9.790 5.554 -12.874 1.00 2.02 H new ATOM 0 HG3 GLN A 98 9.319 4.796 -14.382 1.00 2.02 H new ATOM 0 HE21 GLN A 98 7.616 5.748 -15.672 1.00 31.51 H new ATOM 0 HE22 GLN A 98 7.175 7.445 -15.450 1.00 31.51 H new ATOM 1643 N LEU A 99 5.361 2.443 -12.122 1.00 0.40 N ATOM 1644 CA LEU A 99 4.741 1.268 -11.487 1.00 62.43 C ATOM 1645 C LEU A 99 4.104 0.373 -12.566 1.00 70.24 C ATOM 1646 O LEU A 99 4.375 -0.822 -12.626 1.00 51.03 O ATOM 1647 CB LEU A 99 3.691 1.700 -10.412 1.00 63.54 C ATOM 1648 CG LEU A 99 4.265 2.208 -9.041 1.00 2.43 C ATOM 1649 CD1 LEU A 99 5.178 3.423 -9.215 1.00 70.44 C ATOM 1650 CD2 LEU A 99 3.138 2.528 -8.050 1.00 71.54 C ATOM 0 H LEU A 99 4.905 3.324 -11.886 1.00 0.40 H new ATOM 0 HA LEU A 99 5.512 0.696 -10.971 1.00 62.43 H new ATOM 0 HB2 LEU A 99 3.072 2.490 -10.837 1.00 63.54 H new ATOM 0 HB3 LEU A 99 3.035 0.852 -10.215 1.00 63.54 H new ATOM 0 HG LEU A 99 4.867 1.396 -8.633 1.00 2.43 H new ATOM 0 HD11 LEU A 99 5.552 3.740 -8.241 1.00 70.44 H new ATOM 0 HD12 LEU A 99 6.018 3.158 -9.857 1.00 70.44 H new ATOM 0 HD13 LEU A 99 4.616 4.238 -9.671 1.00 70.44 H new ATOM 0 HD21 LEU A 99 3.567 2.877 -7.111 1.00 71.54 H new ATOM 0 HD22 LEU A 99 2.497 3.305 -8.467 1.00 71.54 H new ATOM 0 HD23 LEU A 99 2.548 1.630 -7.867 1.00 71.54 H new ATOM 1662 N LYS A 100 3.307 0.988 -13.455 1.00 60.23 N ATOM 1663 CA LYS A 100 2.617 0.270 -14.556 1.00 24.04 C ATOM 1664 C LYS A 100 3.616 -0.249 -15.608 1.00 43.52 C ATOM 1665 O LYS A 100 3.341 -1.244 -16.284 1.00 13.34 O ATOM 1666 CB LYS A 100 1.576 1.191 -15.228 1.00 1.51 C ATOM 1667 CG LYS A 100 0.542 1.775 -14.250 1.00 5.34 C ATOM 1668 CD LYS A 100 -0.594 2.532 -14.962 1.00 10.12 C ATOM 1669 CE LYS A 100 -0.090 3.690 -15.838 1.00 41.24 C ATOM 1670 NZ LYS A 100 -1.203 4.331 -16.595 1.00 21.42 N ATOM 0 H LYS A 100 3.119 1.990 -13.437 1.00 60.23 H new ATOM 0 HA LYS A 100 2.109 -0.590 -14.120 1.00 24.04 H new ATOM 0 HB2 LYS A 100 2.096 2.010 -15.725 1.00 1.51 H new ATOM 0 HB3 LYS A 100 1.053 0.629 -16.002 1.00 1.51 H new ATOM 0 HG2 LYS A 100 0.116 0.968 -13.654 1.00 5.34 H new ATOM 0 HG3 LYS A 100 1.045 2.451 -13.558 1.00 5.34 H new ATOM 0 HD2 LYS A 100 -1.156 1.833 -15.582 1.00 10.12 H new ATOM 0 HD3 LYS A 100 -1.286 2.923 -14.216 1.00 10.12 H new ATOM 0 HE2 LYS A 100 0.400 4.435 -15.211 1.00 41.24 H new ATOM 0 HE3 LYS A 100 0.659 3.319 -16.537 1.00 41.24 H new ATOM 0 HZ1 LYS A 100 -0.819 5.074 -17.213 1.00 21.42 H new ATOM 0 HZ2 LYS A 100 -1.687 3.615 -17.173 1.00 21.42 H new ATOM 0 HZ3 LYS A 100 -1.880 4.752 -15.927 1.00 21.42 H new ATOM 1684 N LYS A 101 4.757 0.458 -15.733 1.00 10.45 N ATOM 1685 CA LYS A 101 5.874 0.080 -16.622 1.00 24.34 C ATOM 1686 C LYS A 101 6.376 -1.332 -16.243 1.00 60.05 C ATOM 1687 O LYS A 101 6.646 -2.168 -17.110 1.00 31.13 O ATOM 1688 CB LYS A 101 7.038 1.141 -16.520 1.00 21.11 C ATOM 1689 CG LYS A 101 7.430 1.830 -17.847 1.00 5.21 C ATOM 1690 CD LYS A 101 6.336 2.768 -18.412 1.00 11.02 C ATOM 1691 CE LYS A 101 6.757 3.415 -19.746 1.00 64.21 C ATOM 1692 NZ LYS A 101 5.730 4.364 -20.253 1.00 72.40 N ATOM 0 H LYS A 101 4.931 1.318 -15.213 1.00 10.45 H new ATOM 0 HA LYS A 101 5.527 0.063 -17.655 1.00 24.34 H new ATOM 0 HB2 LYS A 101 6.744 1.909 -15.805 1.00 21.11 H new ATOM 0 HB3 LYS A 101 7.921 0.648 -16.113 1.00 21.11 H new ATOM 0 HG2 LYS A 101 8.343 2.405 -17.691 1.00 5.21 H new ATOM 0 HG3 LYS A 101 7.658 1.065 -18.589 1.00 5.21 H new ATOM 0 HD2 LYS A 101 5.415 2.203 -18.559 1.00 11.02 H new ATOM 0 HD3 LYS A 101 6.118 3.549 -17.684 1.00 11.02 H new ATOM 0 HE2 LYS A 101 7.702 3.941 -19.611 1.00 64.21 H new ATOM 0 HE3 LYS A 101 6.929 2.636 -20.489 1.00 64.21 H new ATOM 0 HZ1 LYS A 101 5.828 4.463 -21.284 1.00 72.40 H new ATOM 0 HZ2 LYS A 101 4.781 4.002 -20.028 1.00 72.40 H new ATOM 0 HZ3 LYS A 101 5.862 5.292 -19.802 1.00 72.40 H new ATOM 1706 N ASP A 102 6.474 -1.569 -14.920 1.00 22.02 N ATOM 1707 CA ASP A 102 6.771 -2.894 -14.347 1.00 43.24 C ATOM 1708 C ASP A 102 5.567 -3.840 -14.557 1.00 31.32 C ATOM 1709 O ASP A 102 5.712 -4.950 -15.071 1.00 1.11 O ATOM 1710 CB ASP A 102 7.083 -2.751 -12.825 1.00 63.42 C ATOM 1711 CG ASP A 102 7.340 -4.102 -12.117 1.00 64.32 C ATOM 1712 OD1 ASP A 102 8.473 -4.620 -12.215 1.00 2.41 O ATOM 1713 OD2 ASP A 102 6.418 -4.649 -11.463 1.00 43.21 O ATOM 0 H ASP A 102 6.348 -0.842 -14.216 1.00 22.02 H new ATOM 0 HA ASP A 102 7.641 -3.316 -14.850 1.00 43.24 H new ATOM 0 HB2 ASP A 102 7.958 -2.113 -12.700 1.00 63.42 H new ATOM 0 HB3 ASP A 102 6.248 -2.247 -12.337 1.00 63.42 H new ATOM 1718 N GLY A 103 4.377 -3.345 -14.169 1.00 73.13 N ATOM 1719 CA GLY A 103 3.125 -4.112 -14.212 1.00 61.43 C ATOM 1720 C GLY A 103 2.413 -4.136 -12.864 1.00 75.23 C ATOM 1721 O GLY A 103 1.553 -4.993 -12.628 1.00 5.33 O ATOM 0 H GLY A 103 4.260 -2.396 -13.815 1.00 73.13 H new ATOM 0 HA2 GLY A 103 2.463 -3.680 -14.962 1.00 61.43 H new ATOM 0 HA3 GLY A 103 3.338 -5.134 -14.526 1.00 61.43 H new ATOM 1725 N VAL A 104 2.797 -3.196 -11.979 1.00 53.31 N ATOM 1726 CA VAL A 104 2.175 -2.997 -10.652 1.00 63.22 C ATOM 1727 C VAL A 104 0.720 -2.537 -10.797 1.00 30.22 C ATOM 1728 O VAL A 104 0.418 -1.668 -11.629 1.00 65.41 O ATOM 1729 CB VAL A 104 2.968 -1.919 -9.814 1.00 53.11 C ATOM 1730 CG1 VAL A 104 2.320 -1.639 -8.432 1.00 52.43 C ATOM 1731 CG2 VAL A 104 4.443 -2.327 -9.667 1.00 31.54 C ATOM 0 H VAL A 104 3.558 -2.544 -12.167 1.00 53.31 H new ATOM 0 HA VAL A 104 2.205 -3.954 -10.132 1.00 63.22 H new ATOM 0 HB VAL A 104 2.920 -0.982 -10.370 1.00 53.11 H new ATOM 0 HG11 VAL A 104 2.907 -0.891 -7.900 1.00 52.43 H new ATOM 0 HG12 VAL A 104 1.304 -1.270 -8.574 1.00 52.43 H new ATOM 0 HG13 VAL A 104 2.293 -2.560 -7.850 1.00 52.43 H new ATOM 0 HG21 VAL A 104 4.973 -1.572 -9.087 1.00 31.54 H new ATOM 0 HG22 VAL A 104 4.506 -3.288 -9.156 1.00 31.54 H new ATOM 0 HG23 VAL A 104 4.897 -2.411 -10.654 1.00 31.54 H new ATOM 1741 N ASP A 105 -0.165 -3.116 -9.970 1.00 1.40 N ATOM 1742 CA ASP A 105 -1.574 -2.731 -9.898 1.00 31.14 C ATOM 1743 C ASP A 105 -1.699 -1.443 -9.065 1.00 74.11 C ATOM 1744 O ASP A 105 -2.024 -1.479 -7.878 1.00 12.02 O ATOM 1745 CB ASP A 105 -2.417 -3.868 -9.251 1.00 34.53 C ATOM 1746 CG ASP A 105 -2.388 -5.207 -10.003 1.00 0.24 C ATOM 1747 OD1 ASP A 105 -1.292 -5.787 -10.144 1.00 23.10 O ATOM 1748 OD2 ASP A 105 -3.462 -5.714 -10.400 1.00 32.13 O ATOM 0 H ASP A 105 0.084 -3.870 -9.330 1.00 1.40 H new ATOM 0 HA ASP A 105 -1.952 -2.557 -10.905 1.00 31.14 H new ATOM 0 HB2 ASP A 105 -2.059 -4.032 -8.235 1.00 34.53 H new ATOM 0 HB3 ASP A 105 -3.452 -3.534 -9.175 1.00 34.53 H new ATOM 1753 N VAL A 106 -1.378 -0.301 -9.669 1.00 52.31 N ATOM 1754 CA VAL A 106 -1.501 0.993 -8.983 1.00 14.40 C ATOM 1755 C VAL A 106 -2.891 1.579 -9.265 1.00 21.03 C ATOM 1756 O VAL A 106 -3.259 1.848 -10.417 1.00 4.04 O ATOM 1757 CB VAL A 106 -0.344 1.987 -9.376 1.00 74.35 C ATOM 1758 CG1 VAL A 106 -0.204 2.150 -10.894 1.00 3.54 C ATOM 1759 CG2 VAL A 106 -0.492 3.353 -8.651 1.00 53.33 C ATOM 0 H VAL A 106 -1.032 -0.240 -10.627 1.00 52.31 H new ATOM 0 HA VAL A 106 -1.397 0.835 -7.910 1.00 14.40 H new ATOM 0 HB VAL A 106 0.588 1.540 -9.030 1.00 74.35 H new ATOM 0 HG11 VAL A 106 0.607 2.845 -11.112 1.00 3.54 H new ATOM 0 HG12 VAL A 106 0.016 1.182 -11.345 1.00 3.54 H new ATOM 0 HG13 VAL A 106 -1.135 2.539 -11.306 1.00 3.54 H new ATOM 0 HG21 VAL A 106 0.324 4.012 -8.947 1.00 53.33 H new ATOM 0 HG22 VAL A 106 -1.444 3.809 -8.924 1.00 53.33 H new ATOM 0 HG23 VAL A 106 -0.460 3.198 -7.573 1.00 53.33 H new ATOM 1769 N ARG A 107 -3.676 1.720 -8.188 1.00 21.04 N ATOM 1770 CA ARG A 107 -5.069 2.158 -8.245 1.00 54.40 C ATOM 1771 C ARG A 107 -5.175 3.577 -7.676 1.00 2.03 C ATOM 1772 O ARG A 107 -4.970 3.794 -6.477 1.00 30.21 O ATOM 1773 CB ARG A 107 -5.974 1.156 -7.468 1.00 0.43 C ATOM 1774 CG ARG A 107 -5.807 -0.316 -7.908 1.00 24.20 C ATOM 1775 CD ARG A 107 -6.203 -0.577 -9.377 1.00 63.43 C ATOM 1776 NE ARG A 107 -7.667 -0.630 -9.556 1.00 31.42 N ATOM 1777 CZ ARG A 107 -8.401 0.175 -10.342 1.00 31.43 C ATOM 1778 NH1 ARG A 107 -7.834 1.147 -11.062 1.00 20.22 N ATOM 1779 NH2 ARG A 107 -9.706 -0.030 -10.426 1.00 13.21 N ATOM 0 H ARG A 107 -3.352 1.529 -7.240 1.00 21.04 H new ATOM 0 HA ARG A 107 -5.414 2.177 -9.279 1.00 54.40 H new ATOM 0 HB2 ARG A 107 -5.753 1.233 -6.403 1.00 0.43 H new ATOM 0 HB3 ARG A 107 -7.016 1.447 -7.599 1.00 0.43 H new ATOM 0 HG2 ARG A 107 -4.768 -0.613 -7.763 1.00 24.20 H new ATOM 0 HG3 ARG A 107 -6.413 -0.950 -7.260 1.00 24.20 H new ATOM 0 HD2 ARG A 107 -5.789 0.209 -10.009 1.00 63.43 H new ATOM 0 HD3 ARG A 107 -5.763 -1.517 -9.709 1.00 63.43 H new ATOM 0 HE ARG A 107 -8.170 -1.347 -9.033 1.00 31.42 H new ATOM 0 HH11 ARG A 107 -6.825 1.289 -11.021 1.00 20.22 H new ATOM 0 HH12 ARG A 107 -8.410 1.747 -11.652 1.00 20.22 H new ATOM 0 HH21 ARG A 107 -10.138 -0.789 -9.899 1.00 13.21 H new ATOM 0 HH22 ARG A 107 -10.280 0.571 -11.018 1.00 13.21 H new ATOM 1793 N VAL A 108 -5.466 4.540 -8.558 1.00 45.25 N ATOM 1794 CA VAL A 108 -5.680 5.941 -8.178 1.00 5.45 C ATOM 1795 C VAL A 108 -7.140 6.110 -7.725 1.00 11.12 C ATOM 1796 O VAL A 108 -8.056 5.534 -8.322 1.00 70.52 O ATOM 1797 CB VAL A 108 -5.337 6.926 -9.364 1.00 23.15 C ATOM 1798 CG1 VAL A 108 -3.821 6.908 -9.672 1.00 13.01 C ATOM 1799 CG2 VAL A 108 -6.160 6.592 -10.631 1.00 71.12 C ATOM 0 H VAL A 108 -5.560 4.369 -9.559 1.00 45.25 H new ATOM 0 HA VAL A 108 -5.008 6.195 -7.358 1.00 5.45 H new ATOM 0 HB VAL A 108 -5.610 7.933 -9.048 1.00 23.15 H new ATOM 0 HG11 VAL A 108 -3.608 7.594 -10.492 1.00 13.01 H new ATOM 0 HG12 VAL A 108 -3.266 7.218 -8.786 1.00 13.01 H new ATOM 0 HG13 VAL A 108 -3.519 5.900 -9.955 1.00 13.01 H new ATOM 0 HG21 VAL A 108 -5.900 7.289 -11.428 1.00 71.12 H new ATOM 0 HG22 VAL A 108 -5.937 5.574 -10.952 1.00 71.12 H new ATOM 0 HG23 VAL A 108 -7.223 6.678 -10.407 1.00 71.12 H new ATOM 1809 N THR A 109 -7.330 6.863 -6.645 1.00 42.51 N ATOM 1810 CA THR A 109 -8.632 7.033 -5.998 1.00 73.54 C ATOM 1811 C THR A 109 -8.831 8.520 -5.669 1.00 13.41 C ATOM 1812 O THR A 109 -8.604 8.952 -4.555 1.00 72.43 O ATOM 1813 CB THR A 109 -8.743 6.103 -4.721 1.00 53.12 C ATOM 1814 OG1 THR A 109 -9.948 6.357 -3.988 1.00 31.34 O ATOM 1815 CG2 THR A 109 -7.528 6.222 -3.782 1.00 33.51 C ATOM 0 H THR A 109 -6.578 7.379 -6.188 1.00 42.51 H new ATOM 0 HA THR A 109 -9.433 6.725 -6.670 1.00 73.54 H new ATOM 0 HB THR A 109 -8.765 5.082 -5.103 1.00 53.12 H new ATOM 0 HG1 THR A 109 -10.670 6.579 -4.612 1.00 31.34 H new ATOM 0 HG21 THR A 109 -7.664 5.561 -2.926 1.00 33.51 H new ATOM 0 HG22 THR A 109 -6.623 5.939 -4.320 1.00 33.51 H new ATOM 0 HG23 THR A 109 -7.436 7.251 -3.435 1.00 33.51 H new ATOM 1823 N ASP A 110 -9.193 9.311 -6.698 1.00 51.24 N ATOM 1824 CA ASP A 110 -9.359 10.784 -6.600 1.00 54.51 C ATOM 1825 C ASP A 110 -10.625 11.130 -5.777 1.00 72.42 C ATOM 1826 O ASP A 110 -11.656 11.486 -6.339 1.00 64.32 O ATOM 1827 CB ASP A 110 -9.419 11.377 -8.040 1.00 3.01 C ATOM 1828 CG ASP A 110 -9.430 12.924 -8.112 1.00 23.31 C ATOM 1829 OD1 ASP A 110 -10.503 13.544 -7.922 1.00 43.02 O ATOM 1830 OD2 ASP A 110 -8.371 13.527 -8.386 1.00 1.20 O ATOM 0 H ASP A 110 -9.381 8.947 -7.632 1.00 51.24 H new ATOM 0 HA ASP A 110 -8.511 11.226 -6.077 1.00 54.51 H new ATOM 0 HB2 ASP A 110 -8.562 11.008 -8.604 1.00 3.01 H new ATOM 0 HB3 ASP A 110 -10.313 10.999 -8.535 1.00 3.01 H new ATOM 1835 N ASN A 111 -10.502 10.921 -4.458 1.00 54.44 N ATOM 1836 CA ASN A 111 -11.524 11.125 -3.406 1.00 20.33 C ATOM 1837 C ASN A 111 -10.981 10.444 -2.141 1.00 13.21 C ATOM 1838 O ASN A 111 -10.817 9.221 -2.115 1.00 21.35 O ATOM 1839 CB ASN A 111 -12.956 10.567 -3.748 1.00 42.22 C ATOM 1840 CG ASN A 111 -13.877 11.566 -4.478 1.00 3.31 C ATOM 1841 OD1 ASN A 111 -14.693 11.179 -5.317 1.00 53.32 O ATOM 1842 ND2 ASN A 111 -13.780 12.849 -4.146 1.00 22.04 N ATOM 0 H ASN A 111 -9.625 10.580 -4.064 1.00 54.44 H new ATOM 0 HA ASN A 111 -11.678 12.197 -3.287 1.00 20.33 H new ATOM 0 HB2 ASN A 111 -12.846 9.676 -4.366 1.00 42.22 H new ATOM 0 HB3 ASN A 111 -13.441 10.256 -2.823 1.00 42.22 H new ATOM 0 HD21 ASN A 111 -14.389 13.538 -4.588 1.00 22.04 H new ATOM 0 HD22 ASN A 111 -13.097 13.145 -3.449 1.00 22.04 H new ATOM 1849 N GLU A 112 -10.665 11.251 -1.113 1.00 22.23 N ATOM 1850 CA GLU A 112 -10.060 10.776 0.156 1.00 45.13 C ATOM 1851 C GLU A 112 -11.072 9.963 0.995 1.00 42.32 C ATOM 1852 O GLU A 112 -10.680 9.159 1.852 1.00 42.35 O ATOM 1853 CB GLU A 112 -9.489 11.998 0.936 1.00 54.33 C ATOM 1854 CG GLU A 112 -8.498 12.823 0.086 1.00 45.13 C ATOM 1855 CD GLU A 112 -7.988 14.107 0.739 1.00 45.32 C ATOM 1856 OE1 GLU A 112 -8.654 15.159 0.601 1.00 74.32 O ATOM 1857 OE2 GLU A 112 -6.916 14.082 1.372 1.00 41.31 O ATOM 0 H GLU A 112 -10.821 12.259 -1.134 1.00 22.23 H new ATOM 0 HA GLU A 112 -9.239 10.094 -0.066 1.00 45.13 H new ATOM 0 HB2 GLU A 112 -10.311 12.638 1.256 1.00 54.33 H new ATOM 0 HB3 GLU A 112 -8.987 11.648 1.838 1.00 54.33 H new ATOM 0 HG2 GLU A 112 -7.642 12.194 -0.157 1.00 45.13 H new ATOM 0 HG3 GLU A 112 -8.981 13.081 -0.856 1.00 45.13 H new ATOM 1864 N ASP A 113 -12.374 10.177 0.713 1.00 61.10 N ATOM 1865 CA ASP A 113 -13.476 9.346 1.242 1.00 51.42 C ATOM 1866 C ASP A 113 -13.467 7.964 0.566 1.00 24.42 C ATOM 1867 O ASP A 113 -13.611 6.936 1.228 1.00 75.01 O ATOM 1868 CB ASP A 113 -14.852 10.030 1.001 1.00 74.00 C ATOM 1869 CG ASP A 113 -14.950 11.428 1.629 1.00 63.10 C ATOM 1870 OD1 ASP A 113 -15.239 11.528 2.836 1.00 23.43 O ATOM 1871 OD2 ASP A 113 -14.724 12.429 0.923 1.00 40.13 O ATOM 0 H ASP A 113 -12.692 10.935 0.109 1.00 61.10 H new ATOM 0 HA ASP A 113 -13.326 9.229 2.315 1.00 51.42 H new ATOM 0 HB2 ASP A 113 -15.029 10.107 -0.072 1.00 74.00 H new ATOM 0 HB3 ASP A 113 -15.641 9.399 1.410 1.00 74.00 H new ATOM 1876 N GLU A 114 -13.283 7.969 -0.769 1.00 34.44 N ATOM 1877 CA GLU A 114 -13.298 6.750 -1.600 1.00 72.02 C ATOM 1878 C GLU A 114 -12.081 5.858 -1.308 1.00 3.12 C ATOM 1879 O GLU A 114 -12.195 4.632 -1.359 1.00 34.41 O ATOM 1880 CB GLU A 114 -13.330 7.125 -3.100 1.00 40.14 C ATOM 1881 CG GLU A 114 -13.364 5.921 -4.069 1.00 14.35 C ATOM 1882 CD GLU A 114 -13.235 6.318 -5.543 1.00 23.11 C ATOM 1883 OE1 GLU A 114 -12.250 7.002 -5.888 1.00 5.14 O ATOM 1884 OE2 GLU A 114 -14.082 5.908 -6.372 1.00 23.44 O ATOM 0 H GLU A 114 -13.119 8.823 -1.303 1.00 34.44 H new ATOM 0 HA GLU A 114 -14.198 6.188 -1.350 1.00 72.02 H new ATOM 0 HB2 GLU A 114 -14.205 7.748 -3.286 1.00 40.14 H new ATOM 0 HB3 GLU A 114 -12.453 7.732 -3.327 1.00 40.14 H new ATOM 0 HG2 GLU A 114 -12.555 5.236 -3.813 1.00 14.35 H new ATOM 0 HG3 GLU A 114 -14.298 5.378 -3.928 1.00 14.35 H new ATOM 1891 N ALA A 115 -10.933 6.495 -1.001 1.00 64.11 N ATOM 1892 CA ALA A 115 -9.686 5.797 -0.637 1.00 4.35 C ATOM 1893 C ALA A 115 -9.928 4.861 0.556 1.00 74.34 C ATOM 1894 O ALA A 115 -9.594 3.679 0.512 1.00 3.32 O ATOM 1895 CB ALA A 115 -8.589 6.824 -0.305 1.00 14.42 C ATOM 0 H ALA A 115 -10.846 7.511 -0.999 1.00 64.11 H new ATOM 0 HA ALA A 115 -9.356 5.194 -1.483 1.00 4.35 H new ATOM 0 HB1 ALA A 115 -7.671 6.302 -0.037 1.00 14.42 H new ATOM 0 HB2 ALA A 115 -8.407 7.456 -1.174 1.00 14.42 H new ATOM 0 HB3 ALA A 115 -8.912 7.443 0.532 1.00 14.42 H new ATOM 1901 N LYS A 116 -10.590 5.433 1.570 1.00 52.04 N ATOM 1902 CA LYS A 116 -11.010 4.761 2.802 1.00 53.14 C ATOM 1903 C LYS A 116 -11.939 3.558 2.521 1.00 12.31 C ATOM 1904 O LYS A 116 -11.781 2.485 3.124 1.00 30.24 O ATOM 1905 CB LYS A 116 -11.735 5.833 3.647 1.00 15.22 C ATOM 1906 CG LYS A 116 -12.498 5.328 4.880 1.00 72.23 C ATOM 1907 CD LYS A 116 -13.269 6.469 5.576 1.00 45.14 C ATOM 1908 CE LYS A 116 -12.346 7.587 6.093 1.00 64.24 C ATOM 1909 NZ LYS A 116 -13.102 8.646 6.812 1.00 20.42 N ATOM 0 H LYS A 116 -10.858 6.417 1.552 1.00 52.04 H new ATOM 0 HA LYS A 116 -10.148 4.349 3.326 1.00 53.14 H new ATOM 0 HB2 LYS A 116 -10.997 6.564 3.977 1.00 15.22 H new ATOM 0 HB3 LYS A 116 -12.438 6.359 3.001 1.00 15.22 H new ATOM 0 HG2 LYS A 116 -13.196 4.545 4.582 1.00 72.23 H new ATOM 0 HG3 LYS A 116 -11.797 4.879 5.584 1.00 72.23 H new ATOM 0 HD2 LYS A 116 -13.989 6.894 4.877 1.00 45.14 H new ATOM 0 HD3 LYS A 116 -13.838 6.060 6.411 1.00 45.14 H new ATOM 0 HE2 LYS A 116 -11.598 7.160 6.760 1.00 64.24 H new ATOM 0 HE3 LYS A 116 -11.809 8.031 5.254 1.00 64.24 H new ATOM 0 HZ1 LYS A 116 -12.508 9.495 6.905 1.00 20.42 H new ATOM 0 HZ2 LYS A 116 -13.962 8.882 6.277 1.00 20.42 H new ATOM 0 HZ3 LYS A 116 -13.366 8.303 7.758 1.00 20.42 H new ATOM 1923 N LYS A 117 -12.892 3.769 1.592 1.00 41.02 N ATOM 1924 CA LYS A 117 -13.889 2.754 1.199 1.00 13.22 C ATOM 1925 C LYS A 117 -13.195 1.552 0.527 1.00 21.24 C ATOM 1926 O LYS A 117 -13.407 0.405 0.934 1.00 60.21 O ATOM 1927 CB LYS A 117 -14.946 3.387 0.244 1.00 34.11 C ATOM 1928 CG LYS A 117 -15.764 4.541 0.880 1.00 34.44 C ATOM 1929 CD LYS A 117 -16.670 5.318 -0.119 1.00 51.32 C ATOM 1930 CE LYS A 117 -17.910 4.542 -0.604 1.00 24.44 C ATOM 1931 NZ LYS A 117 -17.586 3.446 -1.559 1.00 43.15 N ATOM 0 H LYS A 117 -12.992 4.652 1.091 1.00 41.02 H new ATOM 0 HA LYS A 117 -14.400 2.395 2.092 1.00 13.22 H new ATOM 0 HB2 LYS A 117 -14.438 3.763 -0.644 1.00 34.11 H new ATOM 0 HB3 LYS A 117 -15.633 2.608 -0.087 1.00 34.11 H new ATOM 0 HG2 LYS A 117 -16.388 4.132 1.674 1.00 34.44 H new ATOM 0 HG3 LYS A 117 -15.074 5.244 1.347 1.00 34.44 H new ATOM 0 HD2 LYS A 117 -17.000 6.243 0.355 1.00 51.32 H new ATOM 0 HD3 LYS A 117 -16.073 5.600 -0.986 1.00 51.32 H new ATOM 0 HE2 LYS A 117 -18.426 4.121 0.259 1.00 24.44 H new ATOM 0 HE3 LYS A 117 -18.601 5.237 -1.081 1.00 24.44 H new ATOM 0 HZ1 LYS A 117 -18.302 3.419 -2.313 1.00 43.15 H new ATOM 0 HZ2 LYS A 117 -16.649 3.616 -1.978 1.00 43.15 H new ATOM 0 HZ3 LYS A 117 -17.580 2.537 -1.055 1.00 43.15 H new ATOM 1945 N ARG A 118 -12.308 1.858 -0.447 1.00 42.35 N ATOM 1946 CA ARG A 118 -11.592 0.850 -1.252 1.00 25.55 C ATOM 1947 C ARG A 118 -10.697 -0.039 -0.371 1.00 23.31 C ATOM 1948 O ARG A 118 -10.564 -1.228 -0.646 1.00 54.51 O ATOM 1949 CB ARG A 118 -10.741 1.528 -2.370 1.00 11.15 C ATOM 1950 CG ARG A 118 -11.565 2.190 -3.502 1.00 71.31 C ATOM 1951 CD ARG A 118 -10.672 2.791 -4.609 1.00 30.43 C ATOM 1952 NE ARG A 118 -11.456 3.428 -5.685 1.00 61.03 N ATOM 1953 CZ ARG A 118 -10.974 3.791 -6.891 1.00 24.02 C ATOM 1954 NH1 ARG A 118 -9.695 3.586 -7.212 1.00 15.42 N ATOM 1955 NH2 ARG A 118 -11.771 4.403 -7.758 1.00 13.50 N ATOM 0 H ARG A 118 -12.070 2.818 -0.696 1.00 42.35 H new ATOM 0 HA ARG A 118 -12.344 0.217 -1.723 1.00 25.55 H new ATOM 0 HB2 ARG A 118 -10.104 2.285 -1.913 1.00 11.15 H new ATOM 0 HB3 ARG A 118 -10.082 0.779 -2.810 1.00 11.15 H new ATOM 0 HG2 ARG A 118 -12.234 1.450 -3.941 1.00 71.31 H new ATOM 0 HG3 ARG A 118 -12.192 2.975 -3.079 1.00 71.31 H new ATOM 0 HD2 ARG A 118 -10.000 3.528 -4.169 1.00 30.43 H new ATOM 0 HD3 ARG A 118 -10.049 2.005 -5.035 1.00 30.43 H new ATOM 0 HE ARG A 118 -12.443 3.608 -5.501 1.00 61.03 H new ATOM 0 HH11 ARG A 118 -9.064 3.148 -6.540 1.00 15.42 H new ATOM 0 HH12 ARG A 118 -9.348 3.867 -8.129 1.00 15.42 H new ATOM 0 HH21 ARG A 118 -12.741 4.596 -7.510 1.00 13.50 H new ATOM 0 HH22 ARG A 118 -11.413 4.680 -8.672 1.00 13.50 H new ATOM 1969 N LEU A 119 -10.109 0.562 0.690 1.00 74.31 N ATOM 1970 CA LEU A 119 -9.260 -0.159 1.662 1.00 3.44 C ATOM 1971 C LEU A 119 -10.025 -1.300 2.329 1.00 54.44 C ATOM 1972 O LEU A 119 -9.577 -2.448 2.318 1.00 4.11 O ATOM 1973 CB LEU A 119 -8.716 0.811 2.750 1.00 14.12 C ATOM 1974 CG LEU A 119 -7.700 1.871 2.254 1.00 12.33 C ATOM 1975 CD1 LEU A 119 -7.214 2.765 3.412 1.00 64.22 C ATOM 1976 CD2 LEU A 119 -6.530 1.194 1.518 1.00 43.43 C ATOM 0 H LEU A 119 -10.210 1.556 0.894 1.00 74.31 H new ATOM 0 HA LEU A 119 -8.421 -0.580 1.108 1.00 3.44 H new ATOM 0 HB2 LEU A 119 -9.561 1.328 3.205 1.00 14.12 H new ATOM 0 HB3 LEU A 119 -8.244 0.220 3.535 1.00 14.12 H new ATOM 0 HG LEU A 119 -8.204 2.524 1.542 1.00 12.33 H new ATOM 0 HD11 LEU A 119 -6.503 3.498 3.032 1.00 64.22 H new ATOM 0 HD12 LEU A 119 -8.066 3.282 3.855 1.00 64.22 H new ATOM 0 HD13 LEU A 119 -6.730 2.148 4.169 1.00 64.22 H new ATOM 0 HD21 LEU A 119 -5.827 1.953 1.177 1.00 43.43 H new ATOM 0 HD22 LEU A 119 -6.022 0.507 2.196 1.00 43.43 H new ATOM 0 HD23 LEU A 119 -6.911 0.641 0.660 1.00 43.43 H new ATOM 1988 N LYS A 120 -11.203 -0.965 2.880 1.00 11.02 N ATOM 1989 CA LYS A 120 -12.029 -1.925 3.613 1.00 3.31 C ATOM 1990 C LYS A 120 -12.580 -3.004 2.645 1.00 12.33 C ATOM 1991 O LYS A 120 -12.643 -4.177 3.009 1.00 40.53 O ATOM 1992 CB LYS A 120 -13.158 -1.185 4.381 1.00 72.22 C ATOM 1993 CG LYS A 120 -13.869 -2.060 5.434 1.00 20.14 C ATOM 1994 CD LYS A 120 -14.890 -1.294 6.302 1.00 32.12 C ATOM 1995 CE LYS A 120 -16.072 -0.741 5.492 1.00 43.44 C ATOM 1996 NZ LYS A 120 -16.809 -1.815 4.775 1.00 34.33 N ATOM 0 H LYS A 120 -11.603 -0.028 2.828 1.00 11.02 H new ATOM 0 HA LYS A 120 -11.419 -2.439 4.356 1.00 3.31 H new ATOM 0 HB2 LYS A 120 -12.736 -0.309 4.874 1.00 72.22 H new ATOM 0 HB3 LYS A 120 -13.895 -0.823 3.665 1.00 72.22 H new ATOM 0 HG2 LYS A 120 -14.381 -2.878 4.926 1.00 20.14 H new ATOM 0 HG3 LYS A 120 -13.119 -2.509 6.085 1.00 20.14 H new ATOM 0 HD2 LYS A 120 -15.268 -1.958 7.079 1.00 32.12 H new ATOM 0 HD3 LYS A 120 -14.385 -0.470 6.805 1.00 32.12 H new ATOM 0 HE2 LYS A 120 -16.755 -0.217 6.160 1.00 43.44 H new ATOM 0 HE3 LYS A 120 -15.707 -0.009 4.771 1.00 43.44 H new ATOM 0 HZ1 LYS A 120 -17.647 -1.410 4.310 1.00 34.33 H new ATOM 0 HZ2 LYS A 120 -16.189 -2.243 4.058 1.00 34.33 H new ATOM 0 HZ3 LYS A 120 -17.108 -2.544 5.454 1.00 34.33 H new ATOM 2010 N GLU A 121 -12.898 -2.589 1.387 1.00 42.44 N ATOM 2011 CA GLU A 121 -13.338 -3.508 0.302 1.00 70.05 C ATOM 2012 C GLU A 121 -12.309 -4.636 0.063 1.00 73.41 C ATOM 2013 O GLU A 121 -12.693 -5.781 -0.207 1.00 71.05 O ATOM 2014 CB GLU A 121 -13.553 -2.733 -1.030 1.00 1.23 C ATOM 2015 CG GLU A 121 -14.719 -1.726 -1.026 1.00 61.45 C ATOM 2016 CD GLU A 121 -16.098 -2.388 -0.856 1.00 1.20 C ATOM 2017 OE1 GLU A 121 -16.595 -2.992 -1.825 1.00 23.34 O ATOM 2018 OE2 GLU A 121 -16.692 -2.305 0.240 1.00 74.42 O ATOM 0 H GLU A 121 -12.856 -1.611 1.099 1.00 42.44 H new ATOM 0 HA GLU A 121 -14.281 -3.950 0.625 1.00 70.05 H new ATOM 0 HB2 GLU A 121 -12.634 -2.199 -1.273 1.00 1.23 H new ATOM 0 HB3 GLU A 121 -13.722 -3.456 -1.828 1.00 1.23 H new ATOM 0 HG2 GLU A 121 -14.567 -1.008 -0.220 1.00 61.45 H new ATOM 0 HG3 GLU A 121 -14.707 -1.164 -1.960 1.00 61.45 H new ATOM 2025 N LEU A 122 -11.011 -4.280 0.165 1.00 65.34 N ATOM 2026 CA LEU A 122 -9.898 -5.226 -0.045 1.00 72.44 C ATOM 2027 C LEU A 122 -9.887 -6.316 1.031 1.00 32.30 C ATOM 2028 O LEU A 122 -9.894 -7.491 0.708 1.00 64.53 O ATOM 2029 CB LEU A 122 -8.535 -4.491 -0.040 1.00 14.43 C ATOM 2030 CG LEU A 122 -8.356 -3.396 -1.119 1.00 44.32 C ATOM 2031 CD1 LEU A 122 -7.033 -2.648 -0.918 1.00 52.43 C ATOM 2032 CD2 LEU A 122 -8.480 -3.973 -2.543 1.00 32.15 C ATOM 0 H LEU A 122 -10.708 -3.333 0.394 1.00 65.34 H new ATOM 0 HA LEU A 122 -10.051 -5.690 -1.019 1.00 72.44 H new ATOM 0 HB2 LEU A 122 -8.393 -4.035 0.940 1.00 14.43 H new ATOM 0 HB3 LEU A 122 -7.744 -5.231 -0.165 1.00 14.43 H new ATOM 0 HG LEU A 122 -9.165 -2.675 -1.003 1.00 44.32 H new ATOM 0 HD11 LEU A 122 -6.927 -1.883 -1.687 1.00 52.43 H new ATOM 0 HD12 LEU A 122 -7.027 -2.178 0.065 1.00 52.43 H new ATOM 0 HD13 LEU A 122 -6.203 -3.351 -0.989 1.00 52.43 H new ATOM 0 HD21 LEU A 122 -8.348 -3.174 -3.272 1.00 32.15 H new ATOM 0 HD22 LEU A 122 -7.714 -4.733 -2.696 1.00 32.15 H new ATOM 0 HD23 LEU A 122 -9.466 -4.421 -2.670 1.00 32.15 H new ATOM 2044 N LEU A 123 -9.908 -5.888 2.307 1.00 14.11 N ATOM 2045 CA LEU A 123 -9.768 -6.792 3.479 1.00 13.34 C ATOM 2046 C LEU A 123 -10.959 -7.768 3.585 1.00 53.21 C ATOM 2047 O LEU A 123 -10.779 -8.944 3.926 1.00 61.45 O ATOM 2048 CB LEU A 123 -9.614 -5.975 4.794 1.00 21.11 C ATOM 2049 CG LEU A 123 -8.194 -5.386 5.096 1.00 24.12 C ATOM 2050 CD1 LEU A 123 -7.726 -4.357 4.049 1.00 55.14 C ATOM 2051 CD2 LEU A 123 -8.160 -4.790 6.510 1.00 35.44 C ATOM 0 H LEU A 123 -10.022 -4.907 2.561 1.00 14.11 H new ATOM 0 HA LEU A 123 -8.864 -7.383 3.331 1.00 13.34 H new ATOM 0 HB2 LEU A 123 -10.326 -5.150 4.767 1.00 21.11 H new ATOM 0 HB3 LEU A 123 -9.901 -6.616 5.628 1.00 21.11 H new ATOM 0 HG LEU A 123 -7.487 -6.214 5.036 1.00 24.12 H new ATOM 0 HD11 LEU A 123 -6.736 -3.989 4.318 1.00 55.14 H new ATOM 0 HD12 LEU A 123 -7.683 -4.830 3.068 1.00 55.14 H new ATOM 0 HD13 LEU A 123 -8.427 -3.523 4.019 1.00 55.14 H new ATOM 0 HD21 LEU A 123 -7.169 -4.383 6.710 1.00 35.44 H new ATOM 0 HD22 LEU A 123 -8.901 -3.994 6.587 1.00 35.44 H new ATOM 0 HD23 LEU A 123 -8.386 -5.569 7.239 1.00 35.44 H new ATOM 2063 N GLU A 124 -12.159 -7.260 3.263 1.00 1.35 N ATOM 2064 CA GLU A 124 -13.413 -8.041 3.283 1.00 13.51 C ATOM 2065 C GLU A 124 -13.436 -9.110 2.161 1.00 4.31 C ATOM 2066 O GLU A 124 -14.135 -10.122 2.275 1.00 52.10 O ATOM 2067 CB GLU A 124 -14.624 -7.075 3.180 1.00 20.22 C ATOM 2068 CG GLU A 124 -14.751 -6.105 4.383 1.00 30.21 C ATOM 2069 CD GLU A 124 -15.845 -5.035 4.204 1.00 53.11 C ATOM 2070 OE1 GLU A 124 -15.686 -4.161 3.326 1.00 54.02 O ATOM 2071 OE2 GLU A 124 -16.861 -5.047 4.939 1.00 40.11 O ATOM 0 H GLU A 124 -12.291 -6.289 2.979 1.00 1.35 H new ATOM 0 HA GLU A 124 -13.476 -8.582 4.227 1.00 13.51 H new ATOM 0 HB2 GLU A 124 -14.536 -6.493 2.263 1.00 20.22 H new ATOM 0 HB3 GLU A 124 -15.539 -7.661 3.099 1.00 20.22 H new ATOM 0 HG2 GLU A 124 -14.964 -6.682 5.283 1.00 30.21 H new ATOM 0 HG3 GLU A 124 -13.793 -5.609 4.541 1.00 30.21 H new ATOM 2078 N LYS A 125 -12.662 -8.870 1.080 1.00 53.32 N ATOM 2079 CA LYS A 125 -12.509 -9.817 -0.056 1.00 33.03 C ATOM 2080 C LYS A 125 -11.062 -10.369 -0.123 1.00 25.10 C ATOM 2081 O LYS A 125 -10.672 -10.985 -1.123 1.00 51.55 O ATOM 2082 CB LYS A 125 -12.896 -9.104 -1.381 1.00 24.54 C ATOM 2083 CG LYS A 125 -14.279 -8.421 -1.338 1.00 55.03 C ATOM 2084 CD LYS A 125 -14.647 -7.702 -2.652 1.00 3.53 C ATOM 2085 CE LYS A 125 -15.869 -6.793 -2.485 1.00 2.31 C ATOM 2086 NZ LYS A 125 -15.577 -5.663 -1.562 1.00 32.34 N ATOM 0 H LYS A 125 -12.122 -8.012 0.967 1.00 53.32 H new ATOM 0 HA LYS A 125 -13.176 -10.666 0.095 1.00 33.03 H new ATOM 0 HB2 LYS A 125 -12.139 -8.356 -1.615 1.00 24.54 H new ATOM 0 HB3 LYS A 125 -12.886 -9.833 -2.192 1.00 24.54 H new ATOM 0 HG2 LYS A 125 -15.039 -9.170 -1.117 1.00 55.03 H new ATOM 0 HG3 LYS A 125 -14.295 -7.700 -0.521 1.00 55.03 H new ATOM 0 HD2 LYS A 125 -13.798 -7.109 -2.991 1.00 3.53 H new ATOM 0 HD3 LYS A 125 -14.849 -8.442 -3.426 1.00 3.53 H new ATOM 0 HE2 LYS A 125 -16.171 -6.403 -3.457 1.00 2.31 H new ATOM 0 HE3 LYS A 125 -16.707 -7.373 -2.100 1.00 2.31 H new ATOM 0 HZ1 LYS A 125 -15.943 -4.779 -1.969 1.00 32.34 H new ATOM 0 HZ2 LYS A 125 -16.035 -5.837 -0.645 1.00 32.34 H new ATOM 0 HZ3 LYS A 125 -14.549 -5.583 -1.426 1.00 32.34 H new ATOM 2100 N VAL A 126 -10.299 -10.154 0.977 1.00 63.25 N ATOM 2101 CA VAL A 126 -8.894 -10.596 1.146 1.00 4.24 C ATOM 2102 C VAL A 126 -7.976 -10.129 -0.022 1.00 70.33 C ATOM 2103 O VAL A 126 -7.714 -10.879 -0.978 1.00 65.31 O ATOM 2104 CB VAL A 126 -8.790 -12.155 1.387 1.00 71.23 C ATOM 2105 CG1 VAL A 126 -7.336 -12.602 1.688 1.00 41.00 C ATOM 2106 CG2 VAL A 126 -9.749 -12.604 2.520 1.00 64.44 C ATOM 0 H VAL A 126 -10.654 -9.655 1.793 1.00 63.25 H new ATOM 0 HA VAL A 126 -8.524 -10.105 2.046 1.00 4.24 H new ATOM 0 HB VAL A 126 -9.094 -12.644 0.462 1.00 71.23 H new ATOM 0 HG11 VAL A 126 -7.312 -13.680 1.847 1.00 41.00 H new ATOM 0 HG12 VAL A 126 -6.695 -12.345 0.845 1.00 41.00 H new ATOM 0 HG13 VAL A 126 -6.978 -12.095 2.584 1.00 41.00 H new ATOM 0 HG21 VAL A 126 -9.659 -13.680 2.667 1.00 64.44 H new ATOM 0 HG22 VAL A 126 -9.487 -12.088 3.444 1.00 64.44 H new ATOM 0 HG23 VAL A 126 -10.775 -12.359 2.246 1.00 64.44 H new ATOM 2116 N GLY A 127 -7.552 -8.848 0.057 1.00 5.04 N ATOM 2117 CA GLY A 127 -6.574 -8.264 -0.864 1.00 54.53 C ATOM 2118 C GLY A 127 -7.068 -8.091 -2.306 1.00 72.05 C ATOM 2119 O GLY A 127 -6.262 -8.142 -3.239 1.00 55.41 O ATOM 0 H GLY A 127 -7.885 -8.195 0.766 1.00 5.04 H new ATOM 0 HA2 GLY A 127 -6.271 -7.290 -0.480 1.00 54.53 H new ATOM 0 HA3 GLY A 127 -5.684 -8.894 -0.873 1.00 54.53 H new