USER MOD reduce.3.24.130724 H: found=0, std=0, add=1016, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1016 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 119 THR OG1 : rot 119:sc= 0.138 USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0.133 USER MOD Set 2.1: A 113 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 128 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Set 3.1: A 82 SER OG : rot 7:sc= 0.654 USER MOD Set 3.2: A 94 GLN : amide:sc= 0.574 K(o=1.2,f=-2.7!) USER MOD Set 4.1: A 20 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 96 GLN : amide:sc= 0.641 K(o=0.64,f=-0.3) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= -0.336 USER MOD Single : A 14 HIS : no HE2:sc= 1.21 K(o=1.2,f=-5!) USER MOD Single : A 15 ASN : amide:sc= 0.551 K(o=0.55,f=0.03) USER MOD Single : A 21 SER OG : rot 180:sc= -0.299 USER MOD Single : A 22 LYS NZ :NH3+ -149:sc= 1.08 (180deg=-0.685!) USER MOD Single : A 26 SER OG : rot 151:sc= 1.26 USER MOD Single : A 29 THR OG1 : rot -170:sc= 0.447 USER MOD Single : A 31 GLN : amide:sc= 1.31 K(o=1.3,f=0) USER MOD Single : A 34 ASN : amide:sc= 0.549 K(o=0.55,f=-0.14) USER MOD Single : A 35 THR OG1 : rot 111:sc= 1.19 USER MOD Single : A 37 THR OG1 : rot -100:sc= 0.678 USER MOD Single : A 39 THR OG1 : rot 137:sc= 1.23 USER MOD Single : A 41 THR OG1 : rot 72:sc= 1.29 USER MOD Single : A 43 THR OG1 : rot -43:sc= 0.567 USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 MET CE :methyl -176:sc= 0 (180deg=-0.0251) USER MOD Single : A 50 THR OG1 : rot -172:sc= -1.68! USER MOD Single : A 51 MET CE :methyl -178:sc= 0 (180deg=-0.00672) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= -0.188 USER MOD Single : A 56 THR OG1 : rot -170:sc= -0.274 USER MOD Single : A 58 LYS NZ :NH3+ -147:sc= 2.47 (180deg=0.519) USER MOD Single : A 59 ASN : amide:sc=0.000541 K(o=0.00054,f=-0.58) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 173:sc= 1.19 (180deg=0.943) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot 172:sc= 0.974 USER MOD Single : A 75 SER OG : rot -26:sc= 0.706 USER MOD Single : A 79 ASN : amide:sc= 0.984 K(o=0.98,f=-0.0035) USER MOD Single : A 81 LYS NZ :NH3+ 158:sc= 0.889 (180deg=0.574) USER MOD Single : A 86 LYS NZ :NH3+ -167:sc= 1.65 (180deg=1.54) USER MOD Single : A 87 ASN : amide:sc= 1.09 K(o=1.1,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 179:sc= 1.19 (180deg=1.13) USER MOD Single : A 93 THR OG1 : rot 95:sc= 1.1 USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.685 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 102 THR OG1 : rot 57:sc= 0.679 USER MOD Single : A 103 THR OG1 : rot -130:sc= 0.79 USER MOD Single : A 114 MET CE :methyl 180:sc= -0.147 (180deg=-0.147) USER MOD Single : A 115 LYS NZ :NH3+ 173:sc= 2.32 (180deg=2.13) USER MOD Single : A 116 THR OG1 : rot 61:sc= 1.4 USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.261 USER MOD Single : A 129 TYR OH : rot 150:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 41 N PHE A 4 -2.368 -13.318 9.384 1.00 0.00 N ATOM 42 CA PHE A 4 -3.245 -12.156 9.083 1.00 0.00 C ATOM 43 C PHE A 4 -3.725 -11.996 7.602 1.00 0.00 C ATOM 44 O PHE A 4 -3.797 -10.881 7.075 1.00 0.00 O ATOM 45 CB PHE A 4 -2.645 -10.880 9.709 1.00 0.00 C ATOM 46 CG PHE A 4 -1.287 -10.310 9.305 1.00 0.00 C ATOM 47 CD1 PHE A 4 -0.478 -10.805 8.262 1.00 0.00 C ATOM 48 CD2 PHE A 4 -0.842 -9.189 10.019 1.00 0.00 C ATOM 49 CE1 PHE A 4 0.721 -10.174 7.937 1.00 0.00 C ATOM 50 CE2 PHE A 4 0.359 -8.561 9.692 1.00 0.00 C ATOM 51 CZ PHE A 4 1.129 -9.048 8.643 1.00 0.00 C ATOM 0 HA PHE A 4 -4.201 -12.366 9.564 1.00 0.00 H new ATOM 0 HB2 PHE A 4 -3.373 -10.085 9.548 1.00 0.00 H new ATOM 0 HB3 PHE A 4 -2.598 -11.056 10.784 1.00 0.00 H new ATOM 0 HD1 PHE A 4 -0.790 -11.680 7.711 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -1.438 -8.806 10.834 1.00 0.00 H new ATOM 0 HE1 PHE A 4 1.334 -10.560 7.136 1.00 0.00 H new ATOM 0 HE2 PHE A 4 0.690 -7.699 10.252 1.00 0.00 H new ATOM 0 HZ PHE A 4 2.049 -8.549 8.375 1.00 0.00 H new ATOM 61 N LEU A 5 -4.182 -13.097 6.980 1.00 0.00 N ATOM 62 CA LEU A 5 -4.805 -13.068 5.632 1.00 0.00 C ATOM 63 C LEU A 5 -6.264 -12.488 5.662 1.00 0.00 C ATOM 64 O LEU A 5 -7.093 -12.925 6.470 1.00 0.00 O ATOM 65 CB LEU A 5 -4.856 -14.515 5.064 1.00 0.00 C ATOM 66 CG LEU A 5 -3.492 -15.122 4.674 1.00 0.00 C ATOM 67 CD1 LEU A 5 -3.639 -16.638 4.457 1.00 0.00 C ATOM 68 CD2 LEU A 5 -2.899 -14.497 3.409 1.00 0.00 C ATOM 0 H LEU A 5 -4.133 -14.030 7.389 1.00 0.00 H new ATOM 0 HA LEU A 5 -4.197 -12.418 5.003 1.00 0.00 H new ATOM 0 HB2 LEU A 5 -5.324 -15.162 5.806 1.00 0.00 H new ATOM 0 HB3 LEU A 5 -5.501 -14.520 4.185 1.00 0.00 H new ATOM 0 HG LEU A 5 -2.810 -14.910 5.497 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -2.673 -17.062 4.182 1.00 0.00 H new ATOM 0 HD12 LEU A 5 -3.991 -17.105 5.377 1.00 0.00 H new ATOM 0 HD13 LEU A 5 -4.357 -16.823 3.658 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.940 -14.966 3.187 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -3.581 -14.651 2.573 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -2.753 -13.428 3.565 1.00 0.00 H new ATOM 80 N GLY A 6 -6.553 -11.532 4.774 1.00 0.00 N ATOM 81 CA GLY A 6 -7.898 -10.941 4.619 1.00 0.00 C ATOM 82 C GLY A 6 -7.913 -9.430 4.324 1.00 0.00 C ATOM 83 O GLY A 6 -6.881 -8.755 4.322 1.00 0.00 O ATOM 0 H GLY A 6 -5.861 -11.140 4.136 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -8.415 -11.459 3.812 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -8.466 -11.124 5.531 1.00 0.00 H new ATOM 87 N LYS A 7 -9.120 -8.886 4.098 1.00 0.00 N ATOM 88 CA LYS A 7 -9.319 -7.408 4.011 1.00 0.00 C ATOM 89 C LYS A 7 -9.511 -6.753 5.402 1.00 0.00 C ATOM 90 O LYS A 7 -10.108 -7.345 6.303 1.00 0.00 O ATOM 91 CB LYS A 7 -10.420 -7.009 2.998 1.00 0.00 C ATOM 92 CG LYS A 7 -11.849 -7.479 3.279 1.00 0.00 C ATOM 93 CD LYS A 7 -12.579 -8.154 2.105 1.00 0.00 C ATOM 94 CE LYS A 7 -11.940 -9.487 1.676 1.00 0.00 C ATOM 95 NZ LYS A 7 -12.864 -10.234 0.782 1.00 0.00 N ATOM 0 H LYS A 7 -9.973 -9.431 3.972 1.00 0.00 H new ATOM 0 HA LYS A 7 -8.391 -6.999 3.612 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -10.432 -5.921 2.927 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -10.128 -7.389 2.019 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -11.823 -8.178 4.115 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -12.437 -6.619 3.601 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -13.617 -8.330 2.385 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -12.590 -7.474 1.253 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -10.998 -9.298 1.162 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -11.708 -10.088 2.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -12.423 -11.132 0.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -13.753 -10.429 1.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -13.064 -9.664 -0.065 1.00 0.00 H new ATOM 109 N TRP A 8 -8.958 -5.556 5.595 1.00 0.00 N ATOM 110 CA TRP A 8 -8.859 -4.926 6.928 1.00 0.00 C ATOM 111 C TRP A 8 -9.562 -3.532 6.842 1.00 0.00 C ATOM 112 O TRP A 8 -9.157 -2.701 6.019 1.00 0.00 O ATOM 113 CB TRP A 8 -7.376 -4.701 7.290 1.00 0.00 C ATOM 114 CG TRP A 8 -6.382 -5.888 7.477 1.00 0.00 C ATOM 115 CD1 TRP A 8 -6.532 -7.290 7.217 1.00 0.00 C ATOM 116 CD2 TRP A 8 -5.050 -5.756 7.875 1.00 0.00 C ATOM 117 NE1 TRP A 8 -5.334 -8.000 7.413 1.00 0.00 N ATOM 118 CE2 TRP A 8 -4.434 -7.035 7.811 1.00 0.00 C ATOM 119 CE3 TRP A 8 -4.289 -4.620 8.326 1.00 0.00 C ATOM 120 CZ2 TRP A 8 -3.068 -7.182 8.164 1.00 0.00 C ATOM 121 CZ3 TRP A 8 -2.955 -4.800 8.675 1.00 0.00 C ATOM 122 CH2 TRP A 8 -2.350 -6.067 8.593 1.00 0.00 C ATOM 0 H TRP A 8 -8.565 -4.991 4.842 1.00 0.00 H new ATOM 0 HA TRP A 8 -9.322 -5.563 7.681 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -6.957 -4.059 6.515 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -7.362 -4.130 8.218 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -7.459 -7.748 6.906 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -5.169 -8.999 7.289 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -4.747 -3.644 8.392 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -2.589 -8.148 8.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -2.375 -3.954 9.014 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -1.311 -6.178 8.867 1.00 0.00 H new ATOM 133 N LYS A 9 -10.579 -3.265 7.680 1.00 0.00 N ATOM 134 CA LYS A 9 -11.179 -1.907 7.764 1.00 0.00 C ATOM 135 C LYS A 9 -10.816 -1.238 9.116 1.00 0.00 C ATOM 136 O LYS A 9 -10.798 -1.895 10.160 1.00 0.00 O ATOM 137 CB LYS A 9 -12.697 -1.935 7.474 1.00 0.00 C ATOM 138 CG LYS A 9 -13.610 -2.511 8.567 1.00 0.00 C ATOM 139 CD LYS A 9 -15.092 -2.297 8.210 1.00 0.00 C ATOM 140 CE LYS A 9 -16.045 -2.772 9.319 1.00 0.00 C ATOM 141 NZ LYS A 9 -16.167 -1.745 10.397 1.00 0.00 N ATOM 0 H LYS A 9 -11.002 -3.954 8.302 1.00 0.00 H new ATOM 0 HA LYS A 9 -10.749 -1.283 6.981 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -13.020 -0.915 7.267 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -12.856 -2.511 6.563 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -13.411 -3.576 8.690 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -13.388 -2.033 9.521 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -15.265 -1.238 8.017 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -15.320 -2.831 7.288 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -17.028 -2.978 8.895 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -15.678 -3.707 9.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -16.816 -2.090 11.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -15.231 -1.568 10.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -16.539 -0.861 9.994 1.00 0.00 H new ATOM 155 N LEU A 10 -10.561 0.070 9.092 1.00 0.00 N ATOM 156 CA LEU A 10 -10.066 0.828 10.265 1.00 0.00 C ATOM 157 C LEU A 10 -11.085 0.875 11.446 1.00 0.00 C ATOM 158 O LEU A 10 -12.242 1.273 11.286 1.00 0.00 O ATOM 159 CB LEU A 10 -9.667 2.231 9.740 1.00 0.00 C ATOM 160 CG LEU A 10 -8.827 3.085 10.714 1.00 0.00 C ATOM 161 CD1 LEU A 10 -7.378 2.601 10.843 1.00 0.00 C ATOM 162 CD2 LEU A 10 -8.805 4.546 10.230 1.00 0.00 C ATOM 0 H LEU A 10 -10.689 0.646 8.260 1.00 0.00 H new ATOM 0 HA LEU A 10 -9.204 0.328 10.706 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -9.106 2.108 8.814 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -10.575 2.780 9.492 1.00 0.00 H new ATOM 0 HG LEU A 10 -9.299 2.994 11.692 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -6.841 3.243 11.542 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -7.368 1.575 11.212 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -6.893 2.641 9.868 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.212 5.148 10.918 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.364 4.593 9.234 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -9.823 4.933 10.195 1.00 0.00 H new ATOM 174 N SER A 11 -10.629 0.413 12.612 1.00 0.00 N ATOM 175 CA SER A 11 -11.441 0.340 13.850 1.00 0.00 C ATOM 176 C SER A 11 -11.328 1.558 14.803 1.00 0.00 C ATOM 177 O SER A 11 -12.332 1.939 15.408 1.00 0.00 O ATOM 178 CB SER A 11 -11.108 -0.985 14.568 1.00 0.00 C ATOM 179 OG SER A 11 -12.061 -1.274 15.589 1.00 0.00 O ATOM 0 H SER A 11 -9.675 0.073 12.735 1.00 0.00 H new ATOM 0 HA SER A 11 -12.487 0.370 13.544 1.00 0.00 H new ATOM 0 HB2 SER A 11 -11.090 -1.799 13.844 1.00 0.00 H new ATOM 0 HB3 SER A 11 -10.111 -0.924 15.005 1.00 0.00 H new ATOM 0 HG SER A 11 -11.826 -2.119 16.026 1.00 0.00 H new ATOM 185 N GLU A 12 -10.130 2.127 14.949 1.00 0.00 N ATOM 186 CA GLU A 12 -9.919 3.433 15.617 1.00 0.00 C ATOM 187 C GLU A 12 -8.855 4.261 14.832 1.00 0.00 C ATOM 188 O GLU A 12 -8.075 3.728 14.028 1.00 0.00 O ATOM 189 CB GLU A 12 -9.595 3.217 17.115 1.00 0.00 C ATOM 190 CG GLU A 12 -8.194 2.679 17.432 1.00 0.00 C ATOM 191 CD GLU A 12 -7.157 3.726 17.785 1.00 0.00 C ATOM 192 OE1 GLU A 12 -7.063 4.111 18.972 1.00 0.00 O ATOM 193 OE2 GLU A 12 -6.434 4.186 16.872 1.00 0.00 O ATOM 0 H GLU A 12 -9.268 1.701 14.609 1.00 0.00 H new ATOM 0 HA GLU A 12 -10.831 4.030 15.600 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -9.723 4.167 17.634 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -10.330 2.526 17.529 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -8.273 1.977 18.262 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -7.837 2.115 16.570 1.00 0.00 H new ATOM 200 N SER A 13 -8.823 5.575 15.085 1.00 0.00 N ATOM 201 CA SER A 13 -7.813 6.473 14.471 1.00 0.00 C ATOM 202 C SER A 13 -7.193 7.424 15.529 1.00 0.00 C ATOM 203 O SER A 13 -7.671 8.546 15.720 1.00 0.00 O ATOM 204 CB SER A 13 -8.550 7.227 13.332 1.00 0.00 C ATOM 205 OG SER A 13 -7.761 8.257 12.745 1.00 0.00 O ATOM 0 H SER A 13 -9.479 6.048 15.707 1.00 0.00 H new ATOM 0 HA SER A 13 -6.966 5.920 14.066 1.00 0.00 H new ATOM 0 HB2 SER A 13 -8.840 6.514 12.560 1.00 0.00 H new ATOM 0 HB3 SER A 13 -9.469 7.661 13.726 1.00 0.00 H new ATOM 0 HG SER A 13 -8.273 8.696 12.034 1.00 0.00 H new ATOM 211 N HIS A 14 -6.114 6.982 16.202 1.00 0.00 N ATOM 212 CA HIS A 14 -5.613 7.681 17.425 1.00 0.00 C ATOM 213 C HIS A 14 -4.893 9.027 17.159 1.00 0.00 C ATOM 214 O HIS A 14 -5.384 10.073 17.583 1.00 0.00 O ATOM 215 CB HIS A 14 -4.771 6.706 18.280 1.00 0.00 C ATOM 216 CG HIS A 14 -5.036 6.840 19.788 1.00 0.00 C ATOM 217 ND1 HIS A 14 -5.853 5.937 20.430 1.00 0.00 N ATOM 218 CD2 HIS A 14 -4.607 7.838 20.701 1.00 0.00 C ATOM 219 CE1 HIS A 14 -5.880 6.451 21.693 1.00 0.00 C ATOM 220 NE2 HIS A 14 -5.149 7.585 21.953 1.00 0.00 N ATOM 0 H HIS A 14 -5.573 6.160 15.935 1.00 0.00 H new ATOM 0 HA HIS A 14 -6.493 7.980 17.995 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -4.985 5.683 17.970 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -3.713 6.884 18.086 1.00 0.00 H new ATOM 0 HD1 HIS A 14 -6.315 5.106 20.060 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -3.958 8.667 20.459 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -6.462 5.978 22.470 1.00 0.00 H new ATOM 229 N ASN A 15 -3.756 8.976 16.459 1.00 0.00 N ATOM 230 CA ASN A 15 -3.126 10.182 15.871 1.00 0.00 C ATOM 231 C ASN A 15 -3.063 10.099 14.289 1.00 0.00 C ATOM 232 O ASN A 15 -2.178 10.706 13.679 1.00 0.00 O ATOM 233 CB ASN A 15 -1.711 10.344 16.491 1.00 0.00 C ATOM 234 CG ASN A 15 -1.617 10.610 17.992 1.00 0.00 C ATOM 235 OD1 ASN A 15 -2.579 10.896 18.697 1.00 0.00 O ATOM 236 ND2 ASN A 15 -0.437 10.524 18.553 1.00 0.00 N ATOM 0 H ASN A 15 -3.244 8.112 16.280 1.00 0.00 H new ATOM 0 HA ASN A 15 -3.731 11.058 16.103 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -1.145 9.438 16.276 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.211 11.163 15.974 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -0.334 10.693 19.554 1.00 0.00 H new ATOM 0 HD22 ASN A 15 0.380 10.288 17.989 1.00 0.00 H new ATOM 243 N PHE A 16 -3.983 9.359 13.620 1.00 0.00 N ATOM 244 CA PHE A 16 -3.868 9.070 12.166 1.00 0.00 C ATOM 245 C PHE A 16 -4.484 10.180 11.266 1.00 0.00 C ATOM 246 O PHE A 16 -5.536 10.004 10.646 1.00 0.00 O ATOM 247 CB PHE A 16 -4.456 7.646 11.971 1.00 0.00 C ATOM 248 CG PHE A 16 -4.356 7.067 10.554 1.00 0.00 C ATOM 249 CD1 PHE A 16 -3.103 6.844 9.966 1.00 0.00 C ATOM 250 CD2 PHE A 16 -5.511 6.747 9.823 1.00 0.00 C ATOM 251 CE1 PHE A 16 -3.004 6.330 8.670 1.00 0.00 C ATOM 252 CE2 PHE A 16 -5.414 6.216 8.537 1.00 0.00 C ATOM 253 CZ PHE A 16 -4.162 6.010 7.960 1.00 0.00 C ATOM 0 H PHE A 16 -4.809 8.953 14.060 1.00 0.00 H new ATOM 0 HA PHE A 16 -2.830 9.081 11.832 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -3.948 6.967 12.656 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -5.506 7.665 12.261 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -2.205 7.072 10.520 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.484 6.914 10.261 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -2.034 6.181 8.219 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -6.309 5.964 7.988 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.088 5.602 6.963 1.00 0.00 H new ATOM 263 N ASP A 17 -3.764 11.307 11.158 1.00 0.00 N ATOM 264 CA ASP A 17 -4.097 12.407 10.215 1.00 0.00 C ATOM 265 C ASP A 17 -2.816 13.135 9.692 1.00 0.00 C ATOM 266 O ASP A 17 -2.587 13.201 8.481 1.00 0.00 O ATOM 267 CB ASP A 17 -5.245 13.296 10.742 1.00 0.00 C ATOM 268 CG ASP A 17 -4.898 14.569 11.490 1.00 0.00 C ATOM 269 OD1 ASP A 17 -4.337 14.488 12.601 1.00 0.00 O ATOM 270 OD2 ASP A 17 -5.113 15.665 10.919 1.00 0.00 O ATOM 0 H ASP A 17 -2.932 11.490 11.719 1.00 0.00 H new ATOM 0 HA ASP A 17 -4.522 11.980 9.307 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -5.866 13.573 9.890 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -5.861 12.684 11.400 1.00 0.00 H new ATOM 275 N ALA A 18 -1.992 13.671 10.610 1.00 0.00 N ATOM 276 CA ALA A 18 -0.752 14.407 10.270 1.00 0.00 C ATOM 277 C ALA A 18 0.575 13.585 10.166 1.00 0.00 C ATOM 278 O ALA A 18 1.584 14.091 9.679 1.00 0.00 O ATOM 279 CB ALA A 18 -0.552 15.463 11.372 1.00 0.00 C ATOM 0 H ALA A 18 -2.164 13.608 11.613 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.914 14.792 9.263 1.00 0.00 H new ATOM 0 HB1 ALA A 18 0.353 16.035 11.168 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -1.410 16.135 11.392 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -0.457 14.967 12.338 1.00 0.00 H new ATOM 285 N VAL A 19 0.537 12.336 10.613 1.00 0.00 N ATOM 286 CA VAL A 19 1.607 11.323 10.454 1.00 0.00 C ATOM 287 C VAL A 19 2.265 11.230 9.064 1.00 0.00 C ATOM 288 O VAL A 19 3.478 11.417 8.938 1.00 0.00 O ATOM 289 CB VAL A 19 1.035 9.987 11.022 1.00 0.00 C ATOM 290 CG1 VAL A 19 -0.150 9.349 10.269 1.00 0.00 C ATOM 291 CG2 VAL A 19 2.118 8.923 11.218 1.00 0.00 C ATOM 0 H VAL A 19 -0.270 11.972 11.120 1.00 0.00 H new ATOM 0 HA VAL A 19 2.483 11.632 11.025 1.00 0.00 H new ATOM 0 HB VAL A 19 0.632 10.320 11.978 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.446 8.428 10.771 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -0.990 10.043 10.258 1.00 0.00 H new ATOM 0 HG13 VAL A 19 0.148 9.125 9.245 1.00 0.00 H new ATOM 0 HG21 VAL A 19 1.667 8.014 11.615 1.00 0.00 H new ATOM 0 HG22 VAL A 19 2.592 8.705 10.261 1.00 0.00 H new ATOM 0 HG23 VAL A 19 2.868 9.292 11.918 1.00 0.00 H new ATOM 301 N MET A 20 1.436 11.022 8.038 1.00 0.00 N ATOM 302 CA MET A 20 1.884 11.114 6.638 1.00 0.00 C ATOM 303 C MET A 20 1.786 12.552 6.026 1.00 0.00 C ATOM 304 O MET A 20 2.530 12.839 5.090 1.00 0.00 O ATOM 305 CB MET A 20 1.215 10.029 5.770 1.00 0.00 C ATOM 306 CG MET A 20 1.574 8.582 6.159 1.00 0.00 C ATOM 307 SD MET A 20 0.880 7.452 4.939 1.00 0.00 S ATOM 308 CE MET A 20 1.568 5.900 5.543 1.00 0.00 C ATOM 0 H MET A 20 0.449 10.788 8.146 1.00 0.00 H new ATOM 0 HA MET A 20 2.955 10.910 6.642 1.00 0.00 H new ATOM 0 HB2 MET A 20 0.133 10.150 5.831 1.00 0.00 H new ATOM 0 HB3 MET A 20 1.495 10.191 4.729 1.00 0.00 H new ATOM 0 HG2 MET A 20 2.656 8.464 6.208 1.00 0.00 H new ATOM 0 HG3 MET A 20 1.183 8.351 7.150 1.00 0.00 H new ATOM 0 HE1 MET A 20 1.240 5.082 4.901 1.00 0.00 H new ATOM 0 HE2 MET A 20 2.657 5.956 5.531 1.00 0.00 H new ATOM 0 HE3 MET A 20 1.225 5.722 6.562 1.00 0.00 H new ATOM 318 N SER A 21 0.978 13.491 6.558 1.00 0.00 N ATOM 319 CA SER A 21 1.093 14.933 6.208 1.00 0.00 C ATOM 320 C SER A 21 2.460 15.614 6.504 1.00 0.00 C ATOM 321 O SER A 21 2.969 16.338 5.650 1.00 0.00 O ATOM 322 CB SER A 21 -0.096 15.723 6.829 1.00 0.00 C ATOM 323 OG SER A 21 0.216 16.477 8.009 1.00 0.00 O ATOM 0 H SER A 21 0.239 13.284 7.230 1.00 0.00 H new ATOM 0 HA SER A 21 1.043 14.964 5.120 1.00 0.00 H new ATOM 0 HB2 SER A 21 -0.490 16.405 6.076 1.00 0.00 H new ATOM 0 HB3 SER A 21 -0.893 15.019 7.068 1.00 0.00 H new ATOM 0 HG SER A 21 -0.589 16.939 8.325 1.00 0.00 H new ATOM 329 N LYS A 22 3.034 15.380 7.694 1.00 0.00 N ATOM 330 CA LYS A 22 4.398 15.855 8.055 1.00 0.00 C ATOM 331 C LYS A 22 5.581 15.221 7.256 1.00 0.00 C ATOM 332 O LYS A 22 6.595 15.879 7.018 1.00 0.00 O ATOM 333 CB LYS A 22 4.499 15.823 9.599 1.00 0.00 C ATOM 334 CG LYS A 22 5.125 14.605 10.292 1.00 0.00 C ATOM 335 CD LYS A 22 6.665 14.610 10.303 1.00 0.00 C ATOM 336 CE LYS A 22 7.291 13.970 11.550 1.00 0.00 C ATOM 337 NZ LYS A 22 7.372 14.913 12.698 1.00 0.00 N ATOM 0 H LYS A 22 2.574 14.857 8.439 1.00 0.00 H new ATOM 0 HA LYS A 22 4.527 16.884 7.719 1.00 0.00 H new ATOM 0 HB2 LYS A 22 5.067 16.701 9.907 1.00 0.00 H new ATOM 0 HB3 LYS A 22 3.490 15.941 9.994 1.00 0.00 H new ATOM 0 HG2 LYS A 22 4.765 14.561 11.320 1.00 0.00 H new ATOM 0 HG3 LYS A 22 4.779 13.699 9.794 1.00 0.00 H new ATOM 0 HD2 LYS A 22 7.024 14.083 9.419 1.00 0.00 H new ATOM 0 HD3 LYS A 22 7.014 15.640 10.224 1.00 0.00 H new ATOM 0 HE2 LYS A 22 6.703 13.099 11.841 1.00 0.00 H new ATOM 0 HE3 LYS A 22 8.292 13.613 11.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 8.201 14.679 13.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 7.462 15.886 12.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 6.510 14.834 13.274 1.00 0.00 H new ATOM 351 N LEU A 23 5.410 13.963 6.820 1.00 0.00 N ATOM 352 CA LEU A 23 6.155 13.379 5.681 1.00 0.00 C ATOM 353 C LEU A 23 5.922 14.129 4.321 1.00 0.00 C ATOM 354 O LEU A 23 6.901 14.554 3.706 1.00 0.00 O ATOM 355 CB LEU A 23 5.731 11.889 5.647 1.00 0.00 C ATOM 356 CG LEU A 23 6.563 11.004 4.700 1.00 0.00 C ATOM 357 CD1 LEU A 23 7.743 10.366 5.435 1.00 0.00 C ATOM 358 CD2 LEU A 23 5.670 9.910 4.095 1.00 0.00 C ATOM 0 H LEU A 23 4.748 13.314 7.247 1.00 0.00 H new ATOM 0 HA LEU A 23 7.231 13.483 5.819 1.00 0.00 H new ATOM 0 HB2 LEU A 23 5.800 11.483 6.656 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.684 11.830 5.351 1.00 0.00 H new ATOM 0 HG LEU A 23 6.960 11.633 3.904 1.00 0.00 H new ATOM 0 HD11 LEU A 23 8.312 9.747 4.741 1.00 0.00 H new ATOM 0 HD12 LEU A 23 8.388 11.148 5.836 1.00 0.00 H new ATOM 0 HD13 LEU A 23 7.371 9.748 6.252 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.262 9.286 3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.257 9.295 4.894 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.857 10.372 3.535 1.00 0.00 H new ATOM 370 N GLY A 24 4.662 14.301 3.884 1.00 0.00 N ATOM 371 CA GLY A 24 4.325 15.172 2.740 1.00 0.00 C ATOM 372 C GLY A 24 3.216 14.649 1.814 1.00 0.00 C ATOM 373 O GLY A 24 3.469 14.420 0.630 1.00 0.00 O ATOM 0 H GLY A 24 3.854 13.845 4.308 1.00 0.00 H new ATOM 0 HA2 GLY A 24 4.024 16.147 3.124 1.00 0.00 H new ATOM 0 HA3 GLY A 24 5.226 15.328 2.147 1.00 0.00 H new ATOM 377 N VAL A 25 1.991 14.529 2.331 1.00 0.00 N ATOM 378 CA VAL A 25 0.808 14.047 1.560 1.00 0.00 C ATOM 379 C VAL A 25 -0.019 15.245 0.999 1.00 0.00 C ATOM 380 O VAL A 25 -0.173 16.293 1.634 1.00 0.00 O ATOM 381 CB VAL A 25 0.000 13.075 2.479 1.00 0.00 C ATOM 382 CG1 VAL A 25 -1.382 12.682 1.941 1.00 0.00 C ATOM 383 CG2 VAL A 25 0.748 11.722 2.621 1.00 0.00 C ATOM 0 H VAL A 25 1.775 14.761 3.300 1.00 0.00 H new ATOM 0 HA VAL A 25 1.110 13.489 0.674 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.108 13.631 3.410 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -1.868 12.006 2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -1.992 13.577 1.817 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -1.269 12.183 0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.174 11.055 3.264 1.00 0.00 H new ATOM 0 HG22 VAL A 25 0.866 11.266 1.638 1.00 0.00 H new ATOM 0 HG23 VAL A 25 1.730 11.894 3.061 1.00 0.00 H new ATOM 393 N SER A 26 -0.570 15.048 -0.209 1.00 0.00 N ATOM 394 CA SER A 26 -1.389 16.073 -0.897 1.00 0.00 C ATOM 395 C SER A 26 -2.871 16.093 -0.416 1.00 0.00 C ATOM 396 O SER A 26 -3.433 15.049 -0.069 1.00 0.00 O ATOM 397 CB SER A 26 -1.359 15.786 -2.426 1.00 0.00 C ATOM 398 OG SER A 26 -0.033 15.798 -2.969 1.00 0.00 O ATOM 0 H SER A 26 -0.465 14.182 -0.738 1.00 0.00 H new ATOM 0 HA SER A 26 -0.961 17.047 -0.661 1.00 0.00 H new ATOM 0 HB2 SER A 26 -1.816 14.815 -2.617 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.965 16.531 -2.942 1.00 0.00 H new ATOM 0 HG SER A 26 0.010 15.195 -3.740 1.00 0.00 H new ATOM 404 N TRP A 27 -3.543 17.255 -0.483 1.00 0.00 N ATOM 405 CA TRP A 27 -4.989 17.377 -0.110 1.00 0.00 C ATOM 406 C TRP A 27 -6.060 16.766 -1.104 1.00 0.00 C ATOM 407 O TRP A 27 -7.187 17.254 -1.215 1.00 0.00 O ATOM 408 CB TRP A 27 -5.272 18.864 0.211 1.00 0.00 C ATOM 409 CG TRP A 27 -4.857 19.288 1.656 1.00 0.00 C ATOM 410 CD1 TRP A 27 -3.749 20.092 2.030 1.00 0.00 C ATOM 411 CD2 TRP A 27 -5.545 19.050 2.850 1.00 0.00 C ATOM 412 NE1 TRP A 27 -3.734 20.361 3.411 1.00 0.00 N ATOM 413 CE2 TRP A 27 -4.861 19.727 3.895 1.00 0.00 C ATOM 414 CE3 TRP A 27 -6.746 18.324 3.134 1.00 0.00 C ATOM 415 CZ2 TRP A 27 -5.382 19.695 5.223 1.00 0.00 C ATOM 416 CZ3 TRP A 27 -7.222 18.299 4.440 1.00 0.00 C ATOM 417 CH2 TRP A 27 -6.551 18.980 5.473 1.00 0.00 C ATOM 0 H TRP A 27 -3.120 18.131 -0.790 1.00 0.00 H new ATOM 0 HA TRP A 27 -5.127 16.735 0.760 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -4.741 19.488 -0.507 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -6.336 19.059 0.077 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -3.005 20.455 1.336 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -3.046 20.902 3.936 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -7.273 17.805 2.347 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -4.877 20.217 6.022 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -8.123 17.747 4.666 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -6.949 18.948 6.476 1.00 0.00 H new ATOM 428 N ALA A 28 -5.741 15.604 -1.681 1.00 0.00 N ATOM 429 CA ALA A 28 -6.733 14.585 -2.097 1.00 0.00 C ATOM 430 C ALA A 28 -6.755 13.393 -1.081 1.00 0.00 C ATOM 431 O ALA A 28 -7.794 13.099 -0.483 1.00 0.00 O ATOM 432 CB ALA A 28 -6.400 14.165 -3.534 1.00 0.00 C ATOM 0 H ALA A 28 -4.778 15.333 -1.879 1.00 0.00 H new ATOM 0 HA ALA A 28 -7.746 14.988 -2.088 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -7.115 13.414 -3.868 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -6.454 15.035 -4.189 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.393 13.748 -3.567 1.00 0.00 H new ATOM 438 N THR A 29 -5.603 12.758 -0.842 1.00 0.00 N ATOM 439 CA THR A 29 -5.443 11.676 0.160 1.00 0.00 C ATOM 440 C THR A 29 -5.286 12.096 1.656 1.00 0.00 C ATOM 441 O THR A 29 -5.542 11.253 2.522 1.00 0.00 O ATOM 442 CB THR A 29 -4.230 10.780 -0.233 1.00 0.00 C ATOM 443 OG1 THR A 29 -3.050 11.551 -0.424 1.00 0.00 O ATOM 444 CG2 THR A 29 -4.398 9.990 -1.516 1.00 0.00 C ATOM 0 H THR A 29 -4.740 12.977 -1.340 1.00 0.00 H new ATOM 0 HA THR A 29 -6.398 11.152 0.123 1.00 0.00 H new ATOM 0 HB THR A 29 -4.161 10.091 0.609 1.00 0.00 H new ATOM 0 HG1 THR A 29 -2.350 10.987 -0.814 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.500 9.400 -1.700 1.00 0.00 H new ATOM 0 HG22 THR A 29 -5.257 9.325 -1.424 1.00 0.00 H new ATOM 0 HG23 THR A 29 -4.558 10.676 -2.348 1.00 0.00 H new ATOM 452 N ARG A 30 -4.948 13.360 1.977 1.00 0.00 N ATOM 453 CA ARG A 30 -4.859 13.833 3.388 1.00 0.00 C ATOM 454 C ARG A 30 -6.224 13.949 4.149 1.00 0.00 C ATOM 455 O ARG A 30 -6.232 14.105 5.371 1.00 0.00 O ATOM 456 CB ARG A 30 -4.058 15.165 3.413 1.00 0.00 C ATOM 457 CG ARG A 30 -3.129 15.364 4.635 1.00 0.00 C ATOM 458 CD ARG A 30 -3.520 16.477 5.620 1.00 0.00 C ATOM 459 NE ARG A 30 -4.680 16.090 6.446 1.00 0.00 N ATOM 460 CZ ARG A 30 -4.773 16.136 7.768 1.00 0.00 C ATOM 461 NH1 ARG A 30 -3.830 16.532 8.583 1.00 0.00 N ATOM 462 NH2 ARG A 30 -5.881 15.745 8.316 1.00 0.00 N ATOM 0 H ARG A 30 -4.731 14.077 1.285 1.00 0.00 H new ATOM 0 HA ARG A 30 -4.335 13.059 3.949 1.00 0.00 H new ATOM 0 HB2 ARG A 30 -3.454 15.222 2.507 1.00 0.00 H new ATOM 0 HB3 ARG A 30 -4.765 15.994 3.378 1.00 0.00 H new ATOM 0 HG2 ARG A 30 -3.082 14.424 5.184 1.00 0.00 H new ATOM 0 HG3 ARG A 30 -2.123 15.570 4.269 1.00 0.00 H new ATOM 0 HD2 ARG A 30 -2.673 16.706 6.266 1.00 0.00 H new ATOM 0 HD3 ARG A 30 -3.754 17.387 5.067 1.00 0.00 H new ATOM 0 HE ARG A 30 -5.501 15.750 5.945 1.00 0.00 H new ATOM 0 HH11 ARG A 30 -2.931 16.840 8.212 1.00 0.00 H new ATOM 0 HH12 ARG A 30 -3.993 16.533 9.590 1.00 0.00 H new ATOM 0 HH21 ARG A 30 -6.650 15.414 7.733 1.00 0.00 H new ATOM 0 HH22 ARG A 30 -5.984 15.768 9.331 1.00 0.00 H new ATOM 476 N GLN A 31 -7.358 13.833 3.440 1.00 0.00 N ATOM 477 CA GLN A 31 -8.674 13.580 4.057 1.00 0.00 C ATOM 478 C GLN A 31 -9.253 12.162 3.810 1.00 0.00 C ATOM 479 O GLN A 31 -9.859 11.637 4.740 1.00 0.00 O ATOM 480 CB GLN A 31 -9.627 14.752 3.787 1.00 0.00 C ATOM 481 CG GLN A 31 -10.276 14.934 2.410 1.00 0.00 C ATOM 482 CD GLN A 31 -9.606 15.980 1.537 1.00 0.00 C ATOM 483 OE1 GLN A 31 -9.748 17.181 1.736 1.00 0.00 O ATOM 484 NE2 GLN A 31 -8.854 15.581 0.551 1.00 0.00 N ATOM 0 H GLN A 31 -7.391 13.912 2.424 1.00 0.00 H new ATOM 0 HA GLN A 31 -8.527 13.550 5.137 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -10.435 14.682 4.515 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -9.078 15.668 4.006 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -10.263 13.978 1.886 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -11.322 15.208 2.548 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -8.729 14.584 0.376 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -8.390 16.266 -0.046 1.00 0.00 H new ATOM 493 N ILE A 32 -9.048 11.521 2.636 1.00 0.00 N ATOM 494 CA ILE A 32 -9.538 10.122 2.361 1.00 0.00 C ATOM 495 C ILE A 32 -8.920 9.044 3.290 1.00 0.00 C ATOM 496 O ILE A 32 -9.658 8.165 3.726 1.00 0.00 O ATOM 497 CB ILE A 32 -9.435 9.834 0.824 1.00 0.00 C ATOM 498 CG1 ILE A 32 -10.751 10.165 0.056 1.00 0.00 C ATOM 499 CG2 ILE A 32 -9.043 8.397 0.396 1.00 0.00 C ATOM 500 CD1 ILE A 32 -11.205 11.616 0.164 1.00 0.00 C ATOM 0 H ILE A 32 -8.547 11.940 1.853 1.00 0.00 H new ATOM 0 HA ILE A 32 -10.593 10.056 2.628 1.00 0.00 H new ATOM 0 HB ILE A 32 -8.613 10.499 0.559 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -10.612 9.920 -0.997 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -11.546 9.521 0.431 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -9.009 8.338 -0.692 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -8.063 8.151 0.804 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.781 7.690 0.775 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -12.127 11.752 -0.401 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -11.381 11.865 1.210 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -10.432 12.270 -0.240 1.00 0.00 H new ATOM 512 N GLY A 33 -7.621 9.136 3.630 1.00 0.00 N ATOM 513 CA GLY A 33 -7.037 8.313 4.730 1.00 0.00 C ATOM 514 C GLY A 33 -7.790 8.298 6.088 1.00 0.00 C ATOM 515 O GLY A 33 -8.094 7.229 6.618 1.00 0.00 O ATOM 0 H GLY A 33 -6.956 9.760 3.172 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -6.959 7.285 4.377 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -6.022 8.665 4.912 1.00 0.00 H new ATOM 519 N ASN A 34 -8.124 9.485 6.594 1.00 0.00 N ATOM 520 CA ASN A 34 -9.029 9.690 7.755 1.00 0.00 C ATOM 521 C ASN A 34 -10.537 9.969 7.432 1.00 0.00 C ATOM 522 O ASN A 34 -11.195 10.749 8.122 1.00 0.00 O ATOM 523 CB ASN A 34 -8.352 10.779 8.633 1.00 0.00 C ATOM 524 CG ASN A 34 -8.053 12.132 7.987 1.00 0.00 C ATOM 525 OD1 ASN A 34 -8.891 13.012 7.835 1.00 0.00 O ATOM 526 ND2 ASN A 34 -6.840 12.308 7.519 1.00 0.00 N ATOM 0 H ASN A 34 -7.771 10.360 6.208 1.00 0.00 H new ATOM 0 HA ASN A 34 -9.134 8.747 8.292 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -8.990 10.955 9.499 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -7.413 10.372 9.007 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -6.601 13.172 7.033 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -6.136 11.580 7.641 1.00 0.00 H new ATOM 533 N THR A 35 -11.089 9.281 6.425 1.00 0.00 N ATOM 534 CA THR A 35 -12.501 9.440 5.973 1.00 0.00 C ATOM 535 C THR A 35 -12.988 8.090 5.382 1.00 0.00 C ATOM 536 O THR A 35 -13.915 7.480 5.920 1.00 0.00 O ATOM 537 CB THR A 35 -12.673 10.629 4.989 1.00 0.00 C ATOM 538 OG1 THR A 35 -12.247 11.854 5.583 1.00 0.00 O ATOM 539 CG2 THR A 35 -14.087 10.877 4.489 1.00 0.00 C ATOM 0 H THR A 35 -10.572 8.586 5.886 1.00 0.00 H new ATOM 0 HA THR A 35 -13.129 9.693 6.827 1.00 0.00 H new ATOM 0 HB THR A 35 -12.060 10.327 4.140 1.00 0.00 H new ATOM 0 HG1 THR A 35 -11.428 12.163 5.143 1.00 0.00 H new ATOM 0 HG21 THR A 35 -14.088 11.729 3.810 1.00 0.00 H new ATOM 0 HG22 THR A 35 -14.447 9.993 3.963 1.00 0.00 H new ATOM 0 HG23 THR A 35 -14.741 11.087 5.336 1.00 0.00 H new ATOM 547 N VAL A 36 -12.378 7.645 4.278 1.00 0.00 N ATOM 548 CA VAL A 36 -12.755 6.402 3.588 1.00 0.00 C ATOM 549 C VAL A 36 -11.718 5.336 4.026 1.00 0.00 C ATOM 550 O VAL A 36 -10.561 5.365 3.597 1.00 0.00 O ATOM 551 CB VAL A 36 -12.797 6.617 2.039 1.00 0.00 C ATOM 552 CG1 VAL A 36 -13.397 5.371 1.355 1.00 0.00 C ATOM 553 CG2 VAL A 36 -13.625 7.861 1.640 1.00 0.00 C ATOM 0 H VAL A 36 -11.604 8.139 3.834 1.00 0.00 H new ATOM 0 HA VAL A 36 -13.759 6.072 3.855 1.00 0.00 H new ATOM 0 HB VAL A 36 -11.771 6.778 1.709 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -13.424 5.526 0.276 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -12.782 4.500 1.581 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -14.409 5.206 1.723 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -13.623 7.966 0.555 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -14.650 7.744 1.992 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -13.186 8.751 2.092 1.00 0.00 H new ATOM 563 N THR A 37 -12.169 4.431 4.901 1.00 0.00 N ATOM 564 CA THR A 37 -11.344 3.357 5.515 1.00 0.00 C ATOM 565 C THR A 37 -10.250 2.699 4.612 1.00 0.00 C ATOM 566 O THR A 37 -10.646 2.027 3.655 1.00 0.00 O ATOM 567 CB THR A 37 -12.271 2.284 6.183 1.00 0.00 C ATOM 568 OG1 THR A 37 -11.504 1.158 6.602 1.00 0.00 O ATOM 569 CG2 THR A 37 -13.400 1.729 5.323 1.00 0.00 C ATOM 0 H THR A 37 -13.139 4.415 5.217 1.00 0.00 H new ATOM 0 HA THR A 37 -10.747 3.869 6.269 1.00 0.00 H new ATOM 0 HB THR A 37 -12.729 2.837 7.003 1.00 0.00 H new ATOM 0 HG1 THR A 37 -11.594 0.438 5.944 1.00 0.00 H new ATOM 0 HG21 THR A 37 -13.968 0.997 5.897 1.00 0.00 H new ATOM 0 HG22 THR A 37 -14.059 2.542 5.018 1.00 0.00 H new ATOM 0 HG23 THR A 37 -12.981 1.250 4.438 1.00 0.00 H new ATOM 577 N PRO A 38 -8.914 2.816 4.870 1.00 0.00 N ATOM 578 CA PRO A 38 -7.875 2.234 3.958 1.00 0.00 C ATOM 579 C PRO A 38 -7.904 0.694 3.885 1.00 0.00 C ATOM 580 O PRO A 38 -7.519 0.002 4.830 1.00 0.00 O ATOM 581 CB PRO A 38 -6.550 2.857 4.466 1.00 0.00 C ATOM 582 CG PRO A 38 -6.847 3.380 5.884 1.00 0.00 C ATOM 583 CD PRO A 38 -8.335 3.756 5.854 1.00 0.00 C ATOM 0 HA PRO A 38 -8.044 2.480 2.910 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -5.751 2.116 4.482 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -6.222 3.665 3.812 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -6.646 2.619 6.638 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -6.225 4.242 6.127 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -8.796 3.643 6.835 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -8.480 4.793 5.551 1.00 0.00 H new ATOM 591 N THR A 39 -8.400 0.169 2.752 1.00 0.00 N ATOM 592 CA THR A 39 -8.808 -1.267 2.632 1.00 0.00 C ATOM 593 C THR A 39 -7.588 -2.205 2.353 1.00 0.00 C ATOM 594 O THR A 39 -7.471 -2.845 1.301 1.00 0.00 O ATOM 595 CB THR A 39 -9.891 -1.338 1.505 1.00 0.00 C ATOM 596 OG1 THR A 39 -10.906 -0.335 1.632 1.00 0.00 O ATOM 597 CG2 THR A 39 -10.624 -2.669 1.410 1.00 0.00 C ATOM 0 H THR A 39 -8.534 0.708 1.896 1.00 0.00 H new ATOM 0 HA THR A 39 -9.222 -1.628 3.573 1.00 0.00 H new ATOM 0 HB THR A 39 -9.292 -1.183 0.607 1.00 0.00 H new ATOM 0 HG1 THR A 39 -11.099 0.048 0.751 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.354 -2.625 0.602 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.908 -3.465 1.209 1.00 0.00 H new ATOM 0 HG23 THR A 39 -11.136 -2.871 2.351 1.00 0.00 H new ATOM 605 N VAL A 40 -6.682 -2.282 3.336 1.00 0.00 N ATOM 606 CA VAL A 40 -5.304 -2.809 3.137 1.00 0.00 C ATOM 607 C VAL A 40 -5.306 -4.361 3.190 1.00 0.00 C ATOM 608 O VAL A 40 -5.246 -4.986 4.252 1.00 0.00 O ATOM 609 CB VAL A 40 -4.251 -2.148 4.086 1.00 0.00 C ATOM 610 CG1 VAL A 40 -3.982 -0.676 3.697 1.00 0.00 C ATOM 611 CG2 VAL A 40 -4.555 -2.204 5.590 1.00 0.00 C ATOM 0 H VAL A 40 -6.872 -1.985 4.293 1.00 0.00 H new ATOM 0 HA VAL A 40 -4.977 -2.522 2.138 1.00 0.00 H new ATOM 0 HB VAL A 40 -3.370 -2.771 3.933 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.246 -0.249 4.378 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -3.601 -0.633 2.677 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -4.909 -0.107 3.762 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -3.753 -1.714 6.142 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -5.498 -1.694 5.790 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -4.631 -3.244 5.907 1.00 0.00 H new ATOM 621 N THR A 41 -5.487 -4.964 2.008 1.00 0.00 N ATOM 622 CA THR A 41 -6.064 -6.331 1.907 1.00 0.00 C ATOM 623 C THR A 41 -4.949 -7.367 1.702 1.00 0.00 C ATOM 624 O THR A 41 -4.427 -7.540 0.601 1.00 0.00 O ATOM 625 CB THR A 41 -7.180 -6.295 0.839 1.00 0.00 C ATOM 626 OG1 THR A 41 -8.236 -5.439 1.283 1.00 0.00 O ATOM 627 CG2 THR A 41 -7.801 -7.646 0.504 1.00 0.00 C ATOM 0 H THR A 41 -5.248 -4.541 1.111 1.00 0.00 H new ATOM 0 HA THR A 41 -6.542 -6.658 2.830 1.00 0.00 H new ATOM 0 HB THR A 41 -6.690 -5.935 -0.066 1.00 0.00 H new ATOM 0 HG1 THR A 41 -7.943 -4.505 1.234 1.00 0.00 H new ATOM 0 HG21 THR A 41 -8.572 -7.514 -0.255 1.00 0.00 H new ATOM 0 HG22 THR A 41 -7.030 -8.317 0.125 1.00 0.00 H new ATOM 0 HG23 THR A 41 -8.245 -8.075 1.402 1.00 0.00 H new ATOM 635 N PHE A 42 -4.582 -8.032 2.799 1.00 0.00 N ATOM 636 CA PHE A 42 -3.345 -8.828 2.896 1.00 0.00 C ATOM 637 C PHE A 42 -3.567 -10.288 2.446 1.00 0.00 C ATOM 638 O PHE A 42 -4.350 -11.028 3.045 1.00 0.00 O ATOM 639 CB PHE A 42 -2.837 -8.764 4.367 1.00 0.00 C ATOM 640 CG PHE A 42 -1.489 -8.060 4.512 1.00 0.00 C ATOM 641 CD1 PHE A 42 -0.328 -8.678 4.029 1.00 0.00 C ATOM 642 CD2 PHE A 42 -1.383 -6.813 5.140 1.00 0.00 C ATOM 643 CE1 PHE A 42 0.917 -8.073 4.189 1.00 0.00 C ATOM 644 CE2 PHE A 42 -0.135 -6.214 5.316 1.00 0.00 C ATOM 645 CZ PHE A 42 1.015 -6.846 4.847 1.00 0.00 C ATOM 0 H PHE A 42 -5.136 -8.037 3.655 1.00 0.00 H new ATOM 0 HA PHE A 42 -2.594 -8.411 2.225 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -3.577 -8.246 4.977 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -2.754 -9.777 4.759 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -0.399 -9.632 3.528 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -2.273 -6.311 5.490 1.00 0.00 H new ATOM 0 HE1 PHE A 42 1.805 -8.553 3.804 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -0.060 -5.260 5.816 1.00 0.00 H new ATOM 0 HZ PHE A 42 1.982 -6.387 4.993 1.00 0.00 H new ATOM 655 N THR A 43 -2.895 -10.666 1.355 1.00 0.00 N ATOM 656 CA THR A 43 -3.236 -11.907 0.614 1.00 0.00 C ATOM 657 C THR A 43 -1.948 -12.568 0.036 1.00 0.00 C ATOM 658 O THR A 43 -1.144 -11.886 -0.597 1.00 0.00 O ATOM 659 CB THR A 43 -4.228 -11.596 -0.556 1.00 0.00 C ATOM 660 OG1 THR A 43 -3.648 -10.727 -1.526 1.00 0.00 O ATOM 661 CG2 THR A 43 -5.538 -10.945 -0.116 1.00 0.00 C ATOM 0 H THR A 43 -2.115 -10.142 0.959 1.00 0.00 H new ATOM 0 HA THR A 43 -3.712 -12.595 1.312 1.00 0.00 H new ATOM 0 HB THR A 43 -4.443 -12.580 -0.973 1.00 0.00 H new ATOM 0 HG1 THR A 43 -3.168 -10.003 -1.072 1.00 0.00 H new ATOM 0 HG21 THR A 43 -6.166 -10.764 -0.989 1.00 0.00 H new ATOM 0 HG22 THR A 43 -6.059 -11.607 0.575 1.00 0.00 H new ATOM 0 HG23 THR A 43 -5.325 -9.998 0.380 1.00 0.00 H new ATOM 669 N MET A 44 -1.746 -13.879 0.218 1.00 0.00 N ATOM 670 CA MET A 44 -0.561 -14.585 -0.354 1.00 0.00 C ATOM 671 C MET A 44 -0.810 -15.064 -1.811 1.00 0.00 C ATOM 672 O MET A 44 -1.558 -16.018 -2.045 1.00 0.00 O ATOM 673 CB MET A 44 -0.028 -15.678 0.599 1.00 0.00 C ATOM 674 CG MET A 44 -0.927 -16.872 0.930 1.00 0.00 C ATOM 675 SD MET A 44 -0.092 -17.880 2.172 1.00 0.00 S ATOM 676 CE MET A 44 -1.249 -19.255 2.280 1.00 0.00 C ATOM 0 H MET A 44 -2.375 -14.480 0.751 1.00 0.00 H new ATOM 0 HA MET A 44 0.250 -13.862 -0.437 1.00 0.00 H new ATOM 0 HB2 MET A 44 0.894 -16.069 0.169 1.00 0.00 H new ATOM 0 HB3 MET A 44 0.238 -15.195 1.539 1.00 0.00 H new ATOM 0 HG2 MET A 44 -1.892 -16.529 1.305 1.00 0.00 H new ATOM 0 HG3 MET A 44 -1.124 -17.460 0.033 1.00 0.00 H new ATOM 0 HE1 MET A 44 -0.886 -19.980 3.009 1.00 0.00 H new ATOM 0 HE2 MET A 44 -2.226 -18.885 2.592 1.00 0.00 H new ATOM 0 HE3 MET A 44 -1.337 -19.734 1.305 1.00 0.00 H new ATOM 686 N ASP A 45 -0.185 -14.391 -2.789 1.00 0.00 N ATOM 687 CA ASP A 45 -0.348 -14.722 -4.231 1.00 0.00 C ATOM 688 C ASP A 45 0.779 -15.690 -4.700 1.00 0.00 C ATOM 689 O ASP A 45 1.810 -15.280 -5.245 1.00 0.00 O ATOM 690 CB ASP A 45 -0.408 -13.374 -4.985 1.00 0.00 C ATOM 691 CG ASP A 45 -0.884 -13.491 -6.429 1.00 0.00 C ATOM 692 OD1 ASP A 45 -2.038 -13.919 -6.647 1.00 0.00 O ATOM 693 OD2 ASP A 45 -0.113 -13.150 -7.351 1.00 0.00 O ATOM 0 H ASP A 45 0.444 -13.607 -2.615 1.00 0.00 H new ATOM 0 HA ASP A 45 -1.267 -15.270 -4.439 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -1.073 -12.698 -4.448 1.00 0.00 H new ATOM 0 HB3 ASP A 45 0.583 -12.920 -4.976 1.00 0.00 H new ATOM 698 N GLY A 46 0.579 -16.995 -4.434 1.00 0.00 N ATOM 699 CA GLY A 46 1.527 -18.061 -4.836 1.00 0.00 C ATOM 700 C GLY A 46 2.836 -18.149 -4.029 1.00 0.00 C ATOM 701 O GLY A 46 3.014 -19.043 -3.201 1.00 0.00 O ATOM 0 H GLY A 46 -0.240 -17.343 -3.936 1.00 0.00 H new ATOM 0 HA2 GLY A 46 1.015 -19.020 -4.763 1.00 0.00 H new ATOM 0 HA3 GLY A 46 1.781 -17.915 -5.886 1.00 0.00 H new ATOM 705 N ASP A 47 3.728 -17.204 -4.325 1.00 0.00 N ATOM 706 CA ASP A 47 4.989 -16.985 -3.573 1.00 0.00 C ATOM 707 C ASP A 47 4.811 -16.022 -2.362 1.00 0.00 C ATOM 708 O ASP A 47 5.282 -16.337 -1.265 1.00 0.00 O ATOM 709 CB ASP A 47 6.012 -16.507 -4.635 1.00 0.00 C ATOM 710 CG ASP A 47 7.400 -16.109 -4.150 1.00 0.00 C ATOM 711 OD1 ASP A 47 8.204 -16.974 -3.752 1.00 0.00 O ATOM 712 OD2 ASP A 47 7.725 -14.902 -4.190 1.00 0.00 O ATOM 0 H ASP A 47 3.605 -16.554 -5.102 1.00 0.00 H new ATOM 0 HA ASP A 47 5.344 -17.895 -3.089 1.00 0.00 H new ATOM 0 HB2 ASP A 47 6.129 -17.303 -5.371 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.581 -15.652 -5.156 1.00 0.00 H new ATOM 717 N LYS A 48 4.210 -14.836 -2.571 1.00 0.00 N ATOM 718 CA LYS A 48 4.449 -13.667 -1.697 1.00 0.00 C ATOM 719 C LYS A 48 3.181 -12.837 -1.372 1.00 0.00 C ATOM 720 O LYS A 48 2.148 -12.880 -2.048 1.00 0.00 O ATOM 721 CB LYS A 48 5.622 -12.866 -2.302 1.00 0.00 C ATOM 722 CG LYS A 48 5.372 -12.062 -3.583 1.00 0.00 C ATOM 723 CD LYS A 48 6.697 -11.532 -4.158 1.00 0.00 C ATOM 724 CE LYS A 48 6.559 -10.687 -5.430 1.00 0.00 C ATOM 725 NZ LYS A 48 6.174 -11.498 -6.603 1.00 0.00 N ATOM 0 H LYS A 48 3.557 -14.660 -3.334 1.00 0.00 H new ATOM 0 HA LYS A 48 4.732 -14.007 -0.701 1.00 0.00 H new ATOM 0 HB2 LYS A 48 5.979 -12.173 -1.540 1.00 0.00 H new ATOM 0 HB3 LYS A 48 6.433 -13.566 -2.502 1.00 0.00 H new ATOM 0 HG2 LYS A 48 4.874 -12.690 -4.322 1.00 0.00 H new ATOM 0 HG3 LYS A 48 4.702 -11.229 -3.371 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.194 -10.933 -3.394 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.348 -12.380 -4.372 1.00 0.00 H new ATOM 0 HE2 LYS A 48 5.812 -9.910 -5.268 1.00 0.00 H new ATOM 0 HE3 LYS A 48 7.504 -10.184 -5.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 6.093 -10.884 -7.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 6.898 -12.224 -6.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 5.259 -11.958 -6.422 1.00 0.00 H new ATOM 738 N MET A 49 3.278 -12.077 -0.278 1.00 0.00 N ATOM 739 CA MET A 49 2.136 -11.323 0.294 1.00 0.00 C ATOM 740 C MET A 49 1.825 -10.011 -0.468 1.00 0.00 C ATOM 741 O MET A 49 2.719 -9.269 -0.886 1.00 0.00 O ATOM 742 CB MET A 49 2.380 -11.138 1.809 1.00 0.00 C ATOM 743 CG MET A 49 3.554 -10.243 2.214 1.00 0.00 C ATOM 744 SD MET A 49 4.040 -10.619 3.906 1.00 0.00 S ATOM 745 CE MET A 49 5.826 -10.727 3.685 1.00 0.00 C ATOM 0 H MET A 49 4.147 -11.961 0.244 1.00 0.00 H new ATOM 0 HA MET A 49 1.220 -11.900 0.165 1.00 0.00 H new ATOM 0 HB2 MET A 49 1.472 -10.729 2.252 1.00 0.00 H new ATOM 0 HB3 MET A 49 2.535 -12.122 2.251 1.00 0.00 H new ATOM 0 HG2 MET A 49 4.395 -10.401 1.539 1.00 0.00 H new ATOM 0 HG3 MET A 49 3.271 -9.194 2.130 1.00 0.00 H new ATOM 0 HE1 MET A 49 6.291 -11.026 4.624 1.00 0.00 H new ATOM 0 HE2 MET A 49 6.053 -11.465 2.916 1.00 0.00 H new ATOM 0 HE3 MET A 49 6.214 -9.755 3.381 1.00 0.00 H new ATOM 755 N THR A 50 0.535 -9.760 -0.691 1.00 0.00 N ATOM 756 CA THR A 50 0.068 -8.715 -1.627 1.00 0.00 C ATOM 757 C THR A 50 -1.012 -7.901 -0.882 1.00 0.00 C ATOM 758 O THR A 50 -2.070 -8.440 -0.526 1.00 0.00 O ATOM 759 CB THR A 50 -0.498 -9.376 -2.920 1.00 0.00 C ATOM 760 OG1 THR A 50 0.424 -10.316 -3.459 1.00 0.00 O ATOM 761 CG2 THR A 50 -0.770 -8.370 -4.033 1.00 0.00 C ATOM 0 H THR A 50 -0.221 -10.269 -0.233 1.00 0.00 H new ATOM 0 HA THR A 50 0.880 -8.058 -1.938 1.00 0.00 H new ATOM 0 HB THR A 50 -1.429 -9.849 -2.608 1.00 0.00 H new ATOM 0 HG1 THR A 50 0.104 -10.623 -4.333 1.00 0.00 H new ATOM 0 HG21 THR A 50 -1.162 -8.891 -4.906 1.00 0.00 H new ATOM 0 HG22 THR A 50 -1.499 -7.636 -3.690 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.157 -7.863 -4.299 1.00 0.00 H new ATOM 769 N MET A 51 -0.734 -6.608 -0.673 1.00 0.00 N ATOM 770 CA MET A 51 -1.739 -5.656 -0.158 1.00 0.00 C ATOM 771 C MET A 51 -2.620 -5.143 -1.336 1.00 0.00 C ATOM 772 O MET A 51 -2.175 -4.344 -2.169 1.00 0.00 O ATOM 773 CB MET A 51 -1.065 -4.459 0.549 1.00 0.00 C ATOM 774 CG MET A 51 -0.524 -4.744 1.952 1.00 0.00 C ATOM 775 SD MET A 51 0.630 -3.430 2.409 1.00 0.00 S ATOM 776 CE MET A 51 -0.484 -2.123 2.953 1.00 0.00 C ATOM 0 H MET A 51 0.180 -6.192 -0.852 1.00 0.00 H new ATOM 0 HA MET A 51 -2.361 -6.174 0.572 1.00 0.00 H new ATOM 0 HB2 MET A 51 -0.243 -4.107 -0.074 1.00 0.00 H new ATOM 0 HB3 MET A 51 -1.787 -3.645 0.615 1.00 0.00 H new ATOM 0 HG2 MET A 51 -1.343 -4.793 2.670 1.00 0.00 H new ATOM 0 HG3 MET A 51 -0.022 -5.711 1.974 1.00 0.00 H new ATOM 0 HE1 MET A 51 0.096 -1.242 3.229 1.00 0.00 H new ATOM 0 HE2 MET A 51 -1.169 -1.868 2.144 1.00 0.00 H new ATOM 0 HE3 MET A 51 -1.054 -2.467 3.816 1.00 0.00 H new ATOM 786 N LEU A 52 -3.872 -5.603 -1.378 1.00 0.00 N ATOM 787 CA LEU A 52 -4.841 -5.223 -2.440 1.00 0.00 C ATOM 788 C LEU A 52 -5.643 -3.964 -1.970 1.00 0.00 C ATOM 789 O LEU A 52 -6.825 -4.019 -1.624 1.00 0.00 O ATOM 790 CB LEU A 52 -5.730 -6.445 -2.816 1.00 0.00 C ATOM 791 CG LEU A 52 -4.976 -7.752 -3.162 1.00 0.00 C ATOM 792 CD1 LEU A 52 -5.904 -8.970 -3.195 1.00 0.00 C ATOM 793 CD2 LEU A 52 -4.228 -7.654 -4.489 1.00 0.00 C ATOM 0 H LEU A 52 -4.254 -6.247 -0.686 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.327 -4.943 -3.360 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.405 -6.648 -1.984 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.349 -6.170 -3.669 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.251 -7.888 -2.360 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.327 -9.861 -3.442 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.370 -9.099 -2.218 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.677 -8.818 -3.948 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -3.715 -8.595 -4.688 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.937 -7.450 -5.292 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -3.498 -6.847 -4.436 1.00 0.00 H new ATOM 805 N THR A 53 -4.926 -2.834 -1.904 1.00 0.00 N ATOM 806 CA THR A 53 -5.359 -1.620 -1.174 1.00 0.00 C ATOM 807 C THR A 53 -6.424 -0.830 -1.963 1.00 0.00 C ATOM 808 O THR A 53 -6.108 -0.163 -2.945 1.00 0.00 O ATOM 809 CB THR A 53 -4.078 -0.785 -0.871 1.00 0.00 C ATOM 810 OG1 THR A 53 -3.225 -1.491 0.028 1.00 0.00 O ATOM 811 CG2 THR A 53 -4.370 0.556 -0.205 1.00 0.00 C ATOM 0 H THR A 53 -4.019 -2.729 -2.358 1.00 0.00 H new ATOM 0 HA THR A 53 -5.849 -1.884 -0.237 1.00 0.00 H new ATOM 0 HB THR A 53 -3.615 -0.616 -1.843 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.424 -0.955 0.208 1.00 0.00 H new ATOM 0 HG21 THR A 53 -3.434 1.084 -0.023 1.00 0.00 H new ATOM 0 HG22 THR A 53 -5.004 1.156 -0.858 1.00 0.00 H new ATOM 0 HG23 THR A 53 -4.882 0.388 0.743 1.00 0.00 H new ATOM 819 N GLU A 54 -7.667 -0.887 -1.484 1.00 0.00 N ATOM 820 CA GLU A 54 -8.840 -0.376 -2.230 1.00 0.00 C ATOM 821 C GLU A 54 -9.510 0.812 -1.472 1.00 0.00 C ATOM 822 O GLU A 54 -10.510 0.674 -0.755 1.00 0.00 O ATOM 823 CB GLU A 54 -9.788 -1.570 -2.513 1.00 0.00 C ATOM 824 CG GLU A 54 -9.355 -2.468 -3.695 1.00 0.00 C ATOM 825 CD GLU A 54 -9.364 -1.800 -5.060 1.00 0.00 C ATOM 826 OE1 GLU A 54 -10.454 -1.642 -5.648 1.00 0.00 O ATOM 827 OE2 GLU A 54 -8.278 -1.422 -5.547 1.00 0.00 O ATOM 0 H GLU A 54 -7.899 -1.285 -0.574 1.00 0.00 H new ATOM 0 HA GLU A 54 -8.544 0.045 -3.191 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -9.858 -2.183 -1.614 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -10.787 -1.184 -2.714 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -8.349 -2.839 -3.498 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.014 -3.336 -3.730 1.00 0.00 H new ATOM 834 N SER A 55 -8.902 1.990 -1.636 1.00 0.00 N ATOM 835 CA SER A 55 -9.424 3.281 -1.116 1.00 0.00 C ATOM 836 C SER A 55 -9.955 4.193 -2.274 1.00 0.00 C ATOM 837 O SER A 55 -9.679 3.944 -3.448 1.00 0.00 O ATOM 838 CB SER A 55 -8.240 3.980 -0.387 1.00 0.00 C ATOM 839 OG SER A 55 -7.657 3.137 0.608 1.00 0.00 O ATOM 0 H SER A 55 -8.020 2.088 -2.139 1.00 0.00 H new ATOM 0 HA SER A 55 -10.263 3.104 -0.443 1.00 0.00 H new ATOM 0 HB2 SER A 55 -7.480 4.261 -1.116 1.00 0.00 H new ATOM 0 HB3 SER A 55 -8.592 4.901 0.078 1.00 0.00 H new ATOM 0 HG SER A 55 -6.916 3.609 1.043 1.00 0.00 H new ATOM 845 N THR A 56 -10.671 5.289 -1.962 1.00 0.00 N ATOM 846 CA THR A 56 -11.186 6.236 -3.021 1.00 0.00 C ATOM 847 C THR A 56 -10.109 6.844 -3.983 1.00 0.00 C ATOM 848 O THR A 56 -10.317 6.838 -5.197 1.00 0.00 O ATOM 849 CB THR A 56 -12.088 7.308 -2.348 1.00 0.00 C ATOM 850 OG1 THR A 56 -13.245 6.687 -1.806 1.00 0.00 O ATOM 851 CG2 THR A 56 -12.637 8.403 -3.255 1.00 0.00 C ATOM 0 H THR A 56 -10.914 5.555 -1.008 1.00 0.00 H new ATOM 0 HA THR A 56 -11.780 5.637 -3.711 1.00 0.00 H new ATOM 0 HB THR A 56 -11.419 7.768 -1.620 1.00 0.00 H new ATOM 0 HG1 THR A 56 -13.884 7.375 -1.524 1.00 0.00 H new ATOM 0 HG21 THR A 56 -13.250 9.088 -2.669 1.00 0.00 H new ATOM 0 HG22 THR A 56 -11.810 8.951 -3.705 1.00 0.00 H new ATOM 0 HG23 THR A 56 -13.245 7.954 -4.040 1.00 0.00 H new ATOM 859 N PHE A 57 -8.997 7.354 -3.448 1.00 0.00 N ATOM 860 CA PHE A 57 -7.848 7.835 -4.251 1.00 0.00 C ATOM 861 C PHE A 57 -6.734 6.774 -4.449 1.00 0.00 C ATOM 862 O PHE A 57 -6.270 6.615 -5.580 1.00 0.00 O ATOM 863 CB PHE A 57 -7.344 9.150 -3.604 1.00 0.00 C ATOM 864 CG PHE A 57 -8.228 10.377 -3.918 1.00 0.00 C ATOM 865 CD1 PHE A 57 -8.525 10.735 -5.243 1.00 0.00 C ATOM 866 CD2 PHE A 57 -8.800 11.124 -2.882 1.00 0.00 C ATOM 867 CE1 PHE A 57 -9.427 11.760 -5.517 1.00 0.00 C ATOM 868 CE2 PHE A 57 -9.681 12.174 -3.158 1.00 0.00 C ATOM 869 CZ PHE A 57 -10.000 12.483 -4.477 1.00 0.00 C ATOM 0 H PHE A 57 -8.858 7.449 -2.442 1.00 0.00 H new ATOM 0 HA PHE A 57 -8.177 8.031 -5.271 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -7.294 9.017 -2.523 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -6.329 9.348 -3.948 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -8.049 10.210 -6.058 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -8.558 10.886 -1.857 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -9.682 11.994 -6.540 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -10.113 12.744 -2.349 1.00 0.00 H new ATOM 0 HZ PHE A 57 -10.692 13.284 -4.692 1.00 0.00 H new ATOM 879 N LYS A 58 -6.316 6.042 -3.398 1.00 0.00 N ATOM 880 CA LYS A 58 -5.412 4.874 -3.582 1.00 0.00 C ATOM 881 C LYS A 58 -6.200 3.529 -3.692 1.00 0.00 C ATOM 882 O LYS A 58 -6.215 2.719 -2.762 1.00 0.00 O ATOM 883 CB LYS A 58 -4.305 4.851 -2.487 1.00 0.00 C ATOM 884 CG LYS A 58 -3.157 5.837 -2.788 1.00 0.00 C ATOM 885 CD LYS A 58 -1.901 5.629 -1.924 1.00 0.00 C ATOM 886 CE LYS A 58 -1.800 6.562 -0.710 1.00 0.00 C ATOM 887 NZ LYS A 58 -0.387 6.633 -0.235 1.00 0.00 N ATOM 0 H LYS A 58 -6.579 6.227 -2.430 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.905 4.989 -4.540 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -4.748 5.097 -1.522 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.901 3.842 -2.404 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.881 5.745 -3.838 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.520 6.854 -2.642 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.883 4.597 -1.575 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -1.019 5.770 -2.549 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.153 7.558 -0.977 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.444 6.200 0.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -0.374 6.753 0.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 0.109 5.754 -0.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.090 7.441 -0.684 1.00 0.00 H new ATOM 901 N ASN A 59 -6.789 3.285 -4.872 1.00 0.00 N ATOM 902 CA ASN A 59 -7.242 1.933 -5.297 1.00 0.00 C ATOM 903 C ASN A 59 -6.134 1.249 -6.151 1.00 0.00 C ATOM 904 O ASN A 59 -6.047 1.444 -7.368 1.00 0.00 O ATOM 905 CB ASN A 59 -8.633 1.982 -5.970 1.00 0.00 C ATOM 906 CG ASN A 59 -8.808 2.822 -7.222 1.00 0.00 C ATOM 907 OD1 ASN A 59 -8.670 4.041 -7.219 1.00 0.00 O ATOM 908 ND2 ASN A 59 -9.121 2.214 -8.341 1.00 0.00 N ATOM 0 H ASN A 59 -6.969 4.012 -5.565 1.00 0.00 H new ATOM 0 HA ASN A 59 -7.388 1.303 -4.420 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -8.917 0.959 -6.216 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.346 2.341 -5.228 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -9.247 2.754 -9.197 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -9.238 1.201 -8.355 1.00 0.00 H new ATOM 915 N LEU A 60 -5.234 0.516 -5.483 1.00 0.00 N ATOM 916 CA LEU A 60 -4.012 -0.039 -6.110 1.00 0.00 C ATOM 917 C LEU A 60 -3.503 -1.301 -5.370 1.00 0.00 C ATOM 918 O LEU A 60 -3.410 -1.325 -4.141 1.00 0.00 O ATOM 919 CB LEU A 60 -2.916 1.054 -6.279 1.00 0.00 C ATOM 920 CG LEU A 60 -2.445 1.793 -5.004 1.00 0.00 C ATOM 921 CD1 LEU A 60 -1.222 1.134 -4.347 1.00 0.00 C ATOM 922 CD2 LEU A 60 -2.061 3.244 -5.352 1.00 0.00 C ATOM 0 H LEU A 60 -5.326 0.287 -4.493 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.275 -0.371 -7.114 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.045 0.589 -6.740 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -3.289 1.799 -6.982 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.279 1.753 -4.303 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -0.939 1.697 -3.458 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.468 0.110 -4.065 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.390 1.126 -5.052 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -1.730 3.759 -4.450 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -1.254 3.241 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -2.927 3.760 -5.768 1.00 0.00 H new ATOM 934 N SER A 61 -3.117 -2.339 -6.121 1.00 0.00 N ATOM 935 CA SER A 61 -2.446 -3.529 -5.552 1.00 0.00 C ATOM 936 C SER A 61 -0.896 -3.442 -5.600 1.00 0.00 C ATOM 937 O SER A 61 -0.307 -2.996 -6.591 1.00 0.00 O ATOM 938 CB SER A 61 -2.930 -4.802 -6.299 1.00 0.00 C ATOM 939 OG SER A 61 -2.693 -4.755 -7.707 1.00 0.00 O ATOM 0 H SER A 61 -3.256 -2.385 -7.130 1.00 0.00 H new ATOM 0 HA SER A 61 -2.720 -3.577 -4.498 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.426 -5.674 -5.882 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.997 -4.936 -6.121 1.00 0.00 H new ATOM 0 HG SER A 61 -3.016 -5.582 -8.121 1.00 0.00 H new ATOM 945 N VAL A 62 -0.243 -3.917 -4.534 1.00 0.00 N ATOM 946 CA VAL A 62 1.234 -3.929 -4.425 1.00 0.00 C ATOM 947 C VAL A 62 1.695 -5.326 -3.889 1.00 0.00 C ATOM 948 O VAL A 62 1.235 -5.790 -2.841 1.00 0.00 O ATOM 949 CB VAL A 62 1.817 -2.759 -3.592 1.00 0.00 C ATOM 950 CG1 VAL A 62 1.959 -1.473 -4.431 1.00 0.00 C ATOM 951 CG2 VAL A 62 1.088 -2.432 -2.289 1.00 0.00 C ATOM 0 H VAL A 62 -0.716 -4.306 -3.718 1.00 0.00 H new ATOM 0 HA VAL A 62 1.639 -3.769 -5.424 1.00 0.00 H new ATOM 0 HB VAL A 62 2.796 -3.136 -3.297 1.00 0.00 H new ATOM 0 HG11 VAL A 62 2.371 -0.677 -3.810 1.00 0.00 H new ATOM 0 HG12 VAL A 62 2.626 -1.659 -5.272 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.980 -1.172 -4.804 1.00 0.00 H new ATOM 0 HG21 VAL A 62 1.585 -1.598 -1.793 1.00 0.00 H new ATOM 0 HG22 VAL A 62 0.055 -2.160 -2.508 1.00 0.00 H new ATOM 0 HG23 VAL A 62 1.103 -3.304 -1.635 1.00 0.00 H new ATOM 961 N THR A 63 2.589 -5.977 -4.645 1.00 0.00 N ATOM 962 CA THR A 63 3.023 -7.382 -4.387 1.00 0.00 C ATOM 963 C THR A 63 4.502 -7.409 -3.893 1.00 0.00 C ATOM 964 O THR A 63 5.364 -6.729 -4.461 1.00 0.00 O ATOM 965 CB THR A 63 2.904 -8.230 -5.698 1.00 0.00 C ATOM 966 OG1 THR A 63 1.721 -7.925 -6.438 1.00 0.00 O ATOM 967 CG2 THR A 63 2.879 -9.735 -5.446 1.00 0.00 C ATOM 0 H THR A 63 3.040 -5.555 -5.457 1.00 0.00 H new ATOM 0 HA THR A 63 2.378 -7.806 -3.618 1.00 0.00 H new ATOM 0 HB THR A 63 3.798 -7.961 -6.261 1.00 0.00 H new ATOM 0 HG1 THR A 63 1.690 -8.476 -7.248 1.00 0.00 H new ATOM 0 HG21 THR A 63 2.795 -10.262 -6.397 1.00 0.00 H new ATOM 0 HG22 THR A 63 3.799 -10.035 -4.945 1.00 0.00 H new ATOM 0 HG23 THR A 63 2.025 -9.984 -4.817 1.00 0.00 H new ATOM 975 N PHE A 64 4.789 -8.173 -2.828 1.00 0.00 N ATOM 976 CA PHE A 64 6.065 -8.020 -2.074 1.00 0.00 C ATOM 977 C PHE A 64 6.444 -9.224 -1.170 1.00 0.00 C ATOM 978 O PHE A 64 5.582 -9.907 -0.612 1.00 0.00 O ATOM 979 CB PHE A 64 6.064 -6.690 -1.274 1.00 0.00 C ATOM 980 CG PHE A 64 4.986 -6.508 -0.196 1.00 0.00 C ATOM 981 CD1 PHE A 64 5.215 -6.881 1.137 1.00 0.00 C ATOM 982 CD2 PHE A 64 3.766 -5.899 -0.523 1.00 0.00 C ATOM 983 CE1 PHE A 64 4.266 -6.612 2.124 1.00 0.00 C ATOM 984 CE2 PHE A 64 2.806 -5.655 0.455 1.00 0.00 C ATOM 985 CZ PHE A 64 3.062 -6.001 1.779 1.00 0.00 C ATOM 0 H PHE A 64 4.170 -8.898 -2.464 1.00 0.00 H new ATOM 0 HA PHE A 64 6.849 -7.993 -2.831 1.00 0.00 H new ATOM 0 HB2 PHE A 64 7.038 -6.585 -0.796 1.00 0.00 H new ATOM 0 HB3 PHE A 64 5.969 -5.870 -1.986 1.00 0.00 H new ATOM 0 HD1 PHE A 64 6.135 -7.381 1.402 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.569 -5.616 -1.546 1.00 0.00 H new ATOM 0 HE1 PHE A 64 4.464 -6.877 3.152 1.00 0.00 H new ATOM 0 HE2 PHE A 64 1.865 -5.198 0.187 1.00 0.00 H new ATOM 0 HZ PHE A 64 2.325 -5.795 2.541 1.00 0.00 H new ATOM 995 N LYS A 65 7.757 -9.440 -0.978 1.00 0.00 N ATOM 996 CA LYS A 65 8.281 -10.402 0.031 1.00 0.00 C ATOM 997 C LYS A 65 9.201 -9.744 1.093 1.00 0.00 C ATOM 998 O LYS A 65 9.722 -8.640 0.910 1.00 0.00 O ATOM 999 CB LYS A 65 8.889 -11.621 -0.698 1.00 0.00 C ATOM 1000 CG LYS A 65 10.238 -11.440 -1.413 1.00 0.00 C ATOM 1001 CD LYS A 65 10.385 -12.363 -2.637 1.00 0.00 C ATOM 1002 CE LYS A 65 10.436 -13.863 -2.326 1.00 0.00 C ATOM 1003 NZ LYS A 65 10.226 -14.596 -3.598 1.00 0.00 N ATOM 0 H LYS A 65 8.486 -8.962 -1.508 1.00 0.00 H new ATOM 0 HA LYS A 65 7.453 -10.769 0.638 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.004 -12.423 0.032 1.00 0.00 H new ATOM 0 HB3 LYS A 65 8.164 -11.963 -1.436 1.00 0.00 H new ATOM 0 HG2 LYS A 65 10.341 -10.402 -1.730 1.00 0.00 H new ATOM 0 HG3 LYS A 65 11.047 -11.641 -0.711 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.550 -12.177 -3.313 1.00 0.00 H new ATOM 0 HD3 LYS A 65 11.295 -12.089 -3.171 1.00 0.00 H new ATOM 0 HE2 LYS A 65 11.397 -14.130 -1.885 1.00 0.00 H new ATOM 0 HE3 LYS A 65 9.668 -14.129 -1.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 10.373 -15.613 -3.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.256 -14.434 -3.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 10.902 -14.255 -4.311 1.00 0.00 H new ATOM 1017 N PHE A 66 9.423 -10.455 2.209 1.00 0.00 N ATOM 1018 CA PHE A 66 10.338 -10.023 3.299 1.00 0.00 C ATOM 1019 C PHE A 66 11.852 -10.102 2.937 1.00 0.00 C ATOM 1020 O PHE A 66 12.593 -11.004 3.332 1.00 0.00 O ATOM 1021 CB PHE A 66 9.914 -10.729 4.603 1.00 0.00 C ATOM 1022 CG PHE A 66 10.020 -12.255 4.720 1.00 0.00 C ATOM 1023 CD1 PHE A 66 9.010 -13.091 4.212 1.00 0.00 C ATOM 1024 CD2 PHE A 66 11.106 -12.845 5.385 1.00 0.00 C ATOM 1025 CE1 PHE A 66 9.105 -14.478 4.332 1.00 0.00 C ATOM 1026 CE2 PHE A 66 11.196 -14.233 5.514 1.00 0.00 C ATOM 1027 CZ PHE A 66 10.196 -15.047 4.985 1.00 0.00 C ATOM 0 H PHE A 66 8.974 -11.353 2.390 1.00 0.00 H new ATOM 0 HA PHE A 66 10.229 -8.950 3.460 1.00 0.00 H new ATOM 0 HB2 PHE A 66 10.507 -10.300 5.411 1.00 0.00 H new ATOM 0 HB3 PHE A 66 8.875 -10.461 4.793 1.00 0.00 H new ATOM 0 HD1 PHE A 66 8.151 -12.655 3.724 1.00 0.00 H new ATOM 0 HD2 PHE A 66 11.881 -12.219 5.802 1.00 0.00 H new ATOM 0 HE1 PHE A 66 8.333 -15.110 3.919 1.00 0.00 H new ATOM 0 HE2 PHE A 66 12.040 -14.675 6.023 1.00 0.00 H new ATOM 0 HZ PHE A 66 10.267 -16.120 5.081 1.00 0.00 H new ATOM 1037 N GLY A 67 12.263 -9.119 2.134 1.00 0.00 N ATOM 1038 CA GLY A 67 13.581 -9.116 1.469 1.00 0.00 C ATOM 1039 C GLY A 67 13.651 -8.133 0.287 1.00 0.00 C ATOM 1040 O GLY A 67 14.477 -7.220 0.302 1.00 0.00 O ATOM 0 H GLY A 67 11.696 -8.298 1.922 1.00 0.00 H new ATOM 0 HA2 GLY A 67 14.350 -8.857 2.197 1.00 0.00 H new ATOM 0 HA3 GLY A 67 13.805 -10.122 1.113 1.00 0.00 H new ATOM 1044 N GLU A 68 12.781 -8.327 -0.716 1.00 0.00 N ATOM 1045 CA GLU A 68 12.679 -7.415 -1.881 1.00 0.00 C ATOM 1046 C GLU A 68 11.846 -6.140 -1.517 1.00 0.00 C ATOM 1047 O GLU A 68 10.659 -6.232 -1.181 1.00 0.00 O ATOM 1048 CB GLU A 68 12.005 -8.133 -3.084 1.00 0.00 C ATOM 1049 CG GLU A 68 12.727 -9.367 -3.651 1.00 0.00 C ATOM 1050 CD GLU A 68 14.060 -9.104 -4.324 1.00 0.00 C ATOM 1051 OE1 GLU A 68 14.068 -8.778 -5.530 1.00 0.00 O ATOM 1052 OE2 GLU A 68 15.106 -9.255 -3.659 1.00 0.00 O ATOM 0 H GLU A 68 12.130 -9.112 -0.749 1.00 0.00 H new ATOM 0 HA GLU A 68 13.691 -7.119 -2.157 1.00 0.00 H new ATOM 0 HB2 GLU A 68 11.003 -8.436 -2.780 1.00 0.00 H new ATOM 0 HB3 GLU A 68 11.888 -7.408 -3.890 1.00 0.00 H new ATOM 0 HG2 GLU A 68 12.886 -10.076 -2.838 1.00 0.00 H new ATOM 0 HG3 GLU A 68 12.067 -9.851 -4.372 1.00 0.00 H new ATOM 1059 N GLU A 69 12.481 -4.962 -1.592 1.00 0.00 N ATOM 1060 CA GLU A 69 11.812 -3.673 -1.286 1.00 0.00 C ATOM 1061 C GLU A 69 10.859 -3.195 -2.423 1.00 0.00 C ATOM 1062 O GLU A 69 11.283 -2.957 -3.558 1.00 0.00 O ATOM 1063 CB GLU A 69 12.839 -2.603 -0.841 1.00 0.00 C ATOM 1064 CG GLU A 69 13.898 -2.150 -1.856 1.00 0.00 C ATOM 1065 CD GLU A 69 14.791 -0.997 -1.423 1.00 0.00 C ATOM 1066 OE1 GLU A 69 14.635 -0.418 -0.328 1.00 0.00 O ATOM 1067 OE2 GLU A 69 15.647 -0.600 -2.246 1.00 0.00 O ATOM 0 H GLU A 69 13.460 -4.867 -1.862 1.00 0.00 H new ATOM 0 HA GLU A 69 11.152 -3.843 -0.435 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.284 -1.721 -0.522 1.00 0.00 H new ATOM 0 HB3 GLU A 69 13.360 -2.986 0.036 1.00 0.00 H new ATOM 0 HG2 GLU A 69 14.532 -3.004 -2.094 1.00 0.00 H new ATOM 0 HG3 GLU A 69 13.390 -1.863 -2.777 1.00 0.00 H new ATOM 1074 N PHE A 70 9.560 -3.085 -2.112 1.00 0.00 N ATOM 1075 CA PHE A 70 8.523 -2.704 -3.110 1.00 0.00 C ATOM 1076 C PHE A 70 8.299 -1.170 -3.224 1.00 0.00 C ATOM 1077 O PHE A 70 8.506 -0.457 -2.239 1.00 0.00 O ATOM 1078 CB PHE A 70 7.217 -3.489 -2.833 1.00 0.00 C ATOM 1079 CG PHE A 70 6.294 -2.983 -1.722 1.00 0.00 C ATOM 1080 CD1 PHE A 70 6.448 -3.425 -0.404 1.00 0.00 C ATOM 1081 CD2 PHE A 70 5.267 -2.071 -2.012 1.00 0.00 C ATOM 1082 CE1 PHE A 70 5.559 -3.014 0.589 1.00 0.00 C ATOM 1083 CE2 PHE A 70 4.412 -1.619 -1.009 1.00 0.00 C ATOM 1084 CZ PHE A 70 4.544 -2.110 0.286 1.00 0.00 C ATOM 0 H PHE A 70 9.191 -3.253 -1.176 1.00 0.00 H new ATOM 0 HA PHE A 70 8.892 -2.989 -4.095 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.641 -3.516 -3.758 1.00 0.00 H new ATOM 0 HB3 PHE A 70 7.490 -4.518 -2.597 1.00 0.00 H new ATOM 0 HD1 PHE A 70 7.262 -4.090 -0.153 1.00 0.00 H new ATOM 0 HD2 PHE A 70 5.138 -1.716 -3.024 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.658 -3.397 1.594 1.00 0.00 H new ATOM 0 HE2 PHE A 70 3.649 -0.889 -1.236 1.00 0.00 H new ATOM 0 HZ PHE A 70 3.859 -1.790 1.057 1.00 0.00 H new ATOM 1094 N ASP A 71 7.776 -0.684 -4.359 1.00 0.00 N ATOM 1095 CA ASP A 71 7.254 0.710 -4.479 1.00 0.00 C ATOM 1096 C ASP A 71 5.695 0.814 -4.435 1.00 0.00 C ATOM 1097 O ASP A 71 4.993 -0.032 -5.000 1.00 0.00 O ATOM 1098 CB ASP A 71 7.888 1.416 -5.698 1.00 0.00 C ATOM 1099 CG ASP A 71 7.481 0.967 -7.092 1.00 0.00 C ATOM 1100 OD1 ASP A 71 7.722 -0.206 -7.449 1.00 0.00 O ATOM 1101 OD2 ASP A 71 6.935 1.801 -7.849 1.00 0.00 O ATOM 0 H ASP A 71 7.697 -1.229 -5.218 1.00 0.00 H new ATOM 0 HA ASP A 71 7.566 1.249 -3.584 1.00 0.00 H new ATOM 0 HB2 ASP A 71 7.668 2.480 -5.616 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.970 1.307 -5.618 1.00 0.00 H new ATOM 1106 N GLU A 72 5.152 1.878 -3.803 1.00 0.00 N ATOM 1107 CA GLU A 72 3.768 2.345 -4.092 1.00 0.00 C ATOM 1108 C GLU A 72 3.844 3.707 -4.846 1.00 0.00 C ATOM 1109 O GLU A 72 4.413 4.690 -4.355 1.00 0.00 O ATOM 1110 CB GLU A 72 2.797 2.342 -2.883 1.00 0.00 C ATOM 1111 CG GLU A 72 3.003 3.335 -1.732 1.00 0.00 C ATOM 1112 CD GLU A 72 1.801 3.463 -0.791 1.00 0.00 C ATOM 1113 OE1 GLU A 72 1.520 2.509 -0.037 1.00 0.00 O ATOM 1114 OE2 GLU A 72 1.138 4.529 -0.782 1.00 0.00 O ATOM 0 H GLU A 72 5.641 2.428 -3.096 1.00 0.00 H new ATOM 0 HA GLU A 72 3.301 1.605 -4.742 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.792 2.502 -3.274 1.00 0.00 H new ATOM 0 HB3 GLU A 72 2.816 1.340 -2.454 1.00 0.00 H new ATOM 0 HG2 GLU A 72 3.873 3.027 -1.152 1.00 0.00 H new ATOM 0 HG3 GLU A 72 3.230 4.316 -2.149 1.00 0.00 H new ATOM 1121 N LYS A 73 3.265 3.744 -6.055 1.00 0.00 N ATOM 1122 CA LYS A 73 3.087 5.003 -6.825 1.00 0.00 C ATOM 1123 C LYS A 73 1.667 5.565 -6.553 1.00 0.00 C ATOM 1124 O LYS A 73 0.669 4.894 -6.837 1.00 0.00 O ATOM 1125 CB LYS A 73 3.313 4.686 -8.325 1.00 0.00 C ATOM 1126 CG LYS A 73 3.281 5.919 -9.253 1.00 0.00 C ATOM 1127 CD LYS A 73 2.213 5.888 -10.362 1.00 0.00 C ATOM 1128 CE LYS A 73 0.765 5.980 -9.856 1.00 0.00 C ATOM 1129 NZ LYS A 73 -0.169 6.105 -11.009 1.00 0.00 N ATOM 0 H LYS A 73 2.907 2.916 -6.531 1.00 0.00 H new ATOM 0 HA LYS A 73 3.805 5.765 -6.522 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.276 4.188 -8.437 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.550 3.981 -8.653 1.00 0.00 H new ATOM 0 HG2 LYS A 73 3.120 6.807 -8.642 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.260 6.026 -9.719 1.00 0.00 H new ATOM 0 HD2 LYS A 73 2.397 6.714 -11.049 1.00 0.00 H new ATOM 0 HD3 LYS A 73 2.327 4.966 -10.933 1.00 0.00 H new ATOM 0 HE2 LYS A 73 0.518 5.094 -9.271 1.00 0.00 H new ATOM 0 HE3 LYS A 73 0.656 6.839 -9.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -1.146 6.167 -10.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 0.060 6.963 -11.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -0.074 5.272 -11.625 1.00 0.00 H new ATOM 1143 N THR A 74 1.556 6.782 -6.004 1.00 0.00 N ATOM 1144 CA THR A 74 0.341 7.143 -5.229 1.00 0.00 C ATOM 1145 C THR A 74 -0.525 8.247 -5.888 1.00 0.00 C ATOM 1146 O THR A 74 -0.014 9.161 -6.543 1.00 0.00 O ATOM 1147 CB THR A 74 0.764 7.564 -3.783 1.00 0.00 C ATOM 1148 OG1 THR A 74 1.397 8.840 -3.710 1.00 0.00 O ATOM 1149 CG2 THR A 74 1.693 6.593 -3.064 1.00 0.00 C ATOM 0 H THR A 74 2.260 7.517 -6.072 1.00 0.00 H new ATOM 0 HA THR A 74 -0.294 6.258 -5.202 1.00 0.00 H new ATOM 0 HB THR A 74 -0.206 7.578 -3.286 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.511 9.095 -2.771 1.00 0.00 H new ATOM 0 HG21 THR A 74 1.925 6.979 -2.071 1.00 0.00 H new ATOM 0 HG22 THR A 74 1.205 5.623 -2.972 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.615 6.482 -3.634 1.00 0.00 H new ATOM 1157 N SER A 75 -1.839 8.234 -5.599 1.00 0.00 N ATOM 1158 CA SER A 75 -2.696 9.440 -5.744 1.00 0.00 C ATOM 1159 C SER A 75 -2.442 10.645 -4.763 1.00 0.00 C ATOM 1160 O SER A 75 -3.038 11.705 -4.972 1.00 0.00 O ATOM 1161 CB SER A 75 -4.167 8.993 -5.672 1.00 0.00 C ATOM 1162 OG SER A 75 -5.039 10.088 -5.964 1.00 0.00 O ATOM 0 H SER A 75 -2.335 7.408 -5.264 1.00 0.00 H new ATOM 0 HA SER A 75 -2.422 9.863 -6.710 1.00 0.00 H new ATOM 0 HB2 SER A 75 -4.342 8.183 -6.380 1.00 0.00 H new ATOM 0 HB3 SER A 75 -4.386 8.601 -4.679 1.00 0.00 H new ATOM 0 HG SER A 75 -4.592 10.931 -5.739 1.00 0.00 H new ATOM 1168 N ASP A 76 -1.547 10.513 -3.772 1.00 0.00 N ATOM 1169 CA ASP A 76 -0.794 11.659 -3.200 1.00 0.00 C ATOM 1170 C ASP A 76 0.116 12.446 -4.256 1.00 0.00 C ATOM 1171 O ASP A 76 0.291 13.661 -4.140 1.00 0.00 O ATOM 1172 CB ASP A 76 0.128 11.263 -2.002 1.00 0.00 C ATOM 1173 CG ASP A 76 -0.202 10.047 -1.151 1.00 0.00 C ATOM 1174 OD1 ASP A 76 -1.234 10.047 -0.451 1.00 0.00 O ATOM 1175 OD2 ASP A 76 0.561 9.054 -1.204 1.00 0.00 O ATOM 0 H ASP A 76 -1.320 9.617 -3.341 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.595 12.314 -2.858 1.00 0.00 H new ATOM 0 HB2 ASP A 76 1.131 11.115 -2.402 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.175 12.122 -1.333 1.00 0.00 H new ATOM 1180 N GLY A 77 0.699 11.711 -5.212 1.00 0.00 N ATOM 1181 CA GLY A 77 1.666 12.207 -6.206 1.00 0.00 C ATOM 1182 C GLY A 77 3.131 11.887 -5.873 1.00 0.00 C ATOM 1183 O GLY A 77 3.949 12.809 -5.831 1.00 0.00 O ATOM 0 H GLY A 77 0.504 10.716 -5.320 1.00 0.00 H new ATOM 0 HA2 GLY A 77 1.424 11.777 -7.178 1.00 0.00 H new ATOM 0 HA3 GLY A 77 1.554 13.287 -6.298 1.00 0.00 H new ATOM 1187 N ARG A 78 3.452 10.615 -5.591 1.00 0.00 N ATOM 1188 CA ARG A 78 4.735 10.221 -4.978 1.00 0.00 C ATOM 1189 C ARG A 78 4.990 8.722 -5.381 1.00 0.00 C ATOM 1190 O ARG A 78 4.130 7.862 -5.171 1.00 0.00 O ATOM 1191 CB ARG A 78 4.740 10.284 -3.418 1.00 0.00 C ATOM 1192 CG ARG A 78 4.148 11.507 -2.709 1.00 0.00 C ATOM 1193 CD ARG A 78 4.993 12.781 -2.733 1.00 0.00 C ATOM 1194 NE ARG A 78 4.239 13.869 -2.054 1.00 0.00 N ATOM 1195 CZ ARG A 78 3.389 14.713 -2.635 1.00 0.00 C ATOM 1196 NH1 ARG A 78 3.199 14.801 -3.924 1.00 0.00 N ATOM 1197 NH2 ARG A 78 2.691 15.488 -1.861 1.00 0.00 N ATOM 0 H ARG A 78 2.831 9.828 -5.781 1.00 0.00 H new ATOM 0 HA ARG A 78 5.495 10.918 -5.332 1.00 0.00 H new ATOM 0 HB2 ARG A 78 4.206 9.406 -3.054 1.00 0.00 H new ATOM 0 HB3 ARG A 78 5.775 10.186 -3.091 1.00 0.00 H new ATOM 0 HG2 ARG A 78 3.181 11.729 -3.161 1.00 0.00 H new ATOM 0 HG3 ARG A 78 3.960 11.241 -1.669 1.00 0.00 H new ATOM 0 HD2 ARG A 78 5.946 12.612 -2.231 1.00 0.00 H new ATOM 0 HD3 ARG A 78 5.220 13.064 -3.761 1.00 0.00 H new ATOM 0 HE ARG A 78 4.387 13.978 -1.051 1.00 0.00 H new ATOM 0 HH11 ARG A 78 3.721 14.197 -4.559 1.00 0.00 H new ATOM 0 HH12 ARG A 78 2.529 15.474 -4.296 1.00 0.00 H new ATOM 0 HH21 ARG A 78 2.806 15.435 -0.849 1.00 0.00 H new ATOM 0 HH22 ARG A 78 2.028 16.149 -2.265 1.00 0.00 H new ATOM 1211 N ASN A 79 6.185 8.417 -5.888 1.00 0.00 N ATOM 1212 CA ASN A 79 6.731 7.034 -5.833 1.00 0.00 C ATOM 1213 C ASN A 79 7.521 6.854 -4.505 1.00 0.00 C ATOM 1214 O ASN A 79 8.523 7.546 -4.289 1.00 0.00 O ATOM 1215 CB ASN A 79 7.582 6.770 -7.095 1.00 0.00 C ATOM 1216 CG ASN A 79 7.929 5.294 -7.284 1.00 0.00 C ATOM 1217 OD1 ASN A 79 8.885 4.782 -6.715 1.00 0.00 O ATOM 1218 ND2 ASN A 79 7.149 4.573 -8.053 1.00 0.00 N ATOM 0 H ASN A 79 6.800 9.094 -6.341 1.00 0.00 H new ATOM 0 HA ASN A 79 5.933 6.292 -5.833 1.00 0.00 H new ATOM 0 HB2 ASN A 79 7.041 7.125 -7.972 1.00 0.00 H new ATOM 0 HB3 ASN A 79 8.503 7.349 -7.033 1.00 0.00 H new ATOM 0 HD21 ASN A 79 7.337 3.579 -8.181 1.00 0.00 H new ATOM 0 HD22 ASN A 79 6.355 5.007 -8.524 1.00 0.00 H new ATOM 1225 N VAL A 80 7.052 5.970 -3.615 1.00 0.00 N ATOM 1226 CA VAL A 80 7.723 5.731 -2.304 1.00 0.00 C ATOM 1227 C VAL A 80 7.990 4.217 -2.135 1.00 0.00 C ATOM 1228 O VAL A 80 7.136 3.392 -2.472 1.00 0.00 O ATOM 1229 CB VAL A 80 6.972 6.313 -1.068 1.00 0.00 C ATOM 1230 CG1 VAL A 80 6.731 7.830 -1.195 1.00 0.00 C ATOM 1231 CG2 VAL A 80 5.628 5.665 -0.703 1.00 0.00 C ATOM 0 H VAL A 80 6.216 5.405 -3.765 1.00 0.00 H new ATOM 0 HA VAL A 80 8.663 6.283 -2.333 1.00 0.00 H new ATOM 0 HB VAL A 80 7.666 6.074 -0.262 1.00 0.00 H new ATOM 0 HG11 VAL A 80 6.205 8.190 -0.311 1.00 0.00 H new ATOM 0 HG12 VAL A 80 7.688 8.344 -1.283 1.00 0.00 H new ATOM 0 HG13 VAL A 80 6.129 8.030 -2.082 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.211 6.161 0.173 1.00 0.00 H new ATOM 0 HG22 VAL A 80 4.937 5.764 -1.540 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.781 4.609 -0.483 1.00 0.00 H new ATOM 1241 N LYS A 81 9.163 3.864 -1.592 1.00 0.00 N ATOM 1242 CA LYS A 81 9.544 2.439 -1.422 1.00 0.00 C ATOM 1243 C LYS A 81 9.358 1.942 0.029 1.00 0.00 C ATOM 1244 O LYS A 81 8.931 2.689 0.913 1.00 0.00 O ATOM 1245 CB LYS A 81 10.881 2.168 -2.137 1.00 0.00 C ATOM 1246 CG LYS A 81 12.162 2.600 -1.419 1.00 0.00 C ATOM 1247 CD LYS A 81 13.403 2.301 -2.278 1.00 0.00 C ATOM 1248 CE LYS A 81 14.702 2.592 -1.509 1.00 0.00 C ATOM 1249 NZ LYS A 81 15.848 1.986 -2.234 1.00 0.00 N ATOM 0 H LYS A 81 9.863 4.530 -1.264 1.00 0.00 H new ATOM 0 HA LYS A 81 8.844 1.780 -1.936 1.00 0.00 H new ATOM 0 HB2 LYS A 81 10.948 1.098 -2.332 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.853 2.667 -3.106 1.00 0.00 H new ATOM 0 HG2 LYS A 81 12.117 3.666 -1.197 1.00 0.00 H new ATOM 0 HG3 LYS A 81 12.242 2.079 -0.465 1.00 0.00 H new ATOM 0 HD2 LYS A 81 13.389 1.256 -2.589 1.00 0.00 H new ATOM 0 HD3 LYS A 81 13.373 2.904 -3.185 1.00 0.00 H new ATOM 0 HE2 LYS A 81 14.847 3.668 -1.411 1.00 0.00 H new ATOM 0 HE3 LYS A 81 14.639 2.185 -0.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 16.727 2.467 -1.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 15.916 0.976 -1.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 15.704 2.090 -3.259 1.00 0.00 H new ATOM 1263 N SER A 82 9.559 0.642 0.263 1.00 0.00 N ATOM 1264 CA SER A 82 9.235 0.002 1.562 1.00 0.00 C ATOM 1265 C SER A 82 10.081 -1.275 1.780 1.00 0.00 C ATOM 1266 O SER A 82 9.934 -2.253 1.041 1.00 0.00 O ATOM 1267 CB SER A 82 7.726 -0.315 1.634 1.00 0.00 C ATOM 1268 OG SER A 82 6.962 0.885 1.716 1.00 0.00 O ATOM 0 H SER A 82 9.947 0.000 -0.429 1.00 0.00 H new ATOM 0 HA SER A 82 9.482 0.699 2.362 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.426 -0.883 0.753 1.00 0.00 H new ATOM 0 HB3 SER A 82 7.522 -0.942 2.502 1.00 0.00 H new ATOM 0 HG SER A 82 7.553 1.658 1.600 1.00 0.00 H new ATOM 1274 N VAL A 83 10.952 -1.265 2.800 1.00 0.00 N ATOM 1275 CA VAL A 83 11.886 -2.389 3.084 1.00 0.00 C ATOM 1276 C VAL A 83 11.269 -3.340 4.135 1.00 0.00 C ATOM 1277 O VAL A 83 11.057 -2.983 5.300 1.00 0.00 O ATOM 1278 CB VAL A 83 13.303 -1.828 3.371 1.00 0.00 C ATOM 1279 CG1 VAL A 83 13.525 -1.055 4.672 1.00 0.00 C ATOM 1280 CG2 VAL A 83 14.371 -2.931 3.254 1.00 0.00 C ATOM 0 H VAL A 83 11.037 -0.487 3.454 1.00 0.00 H new ATOM 0 HA VAL A 83 12.031 -3.034 2.217 1.00 0.00 H new ATOM 0 HB VAL A 83 13.402 -1.072 2.592 1.00 0.00 H new ATOM 0 HG11 VAL A 83 14.563 -0.728 4.728 1.00 0.00 H new ATOM 0 HG12 VAL A 83 12.869 -0.185 4.695 1.00 0.00 H new ATOM 0 HG13 VAL A 83 13.301 -1.700 5.521 1.00 0.00 H new ATOM 0 HG21 VAL A 83 15.354 -2.509 3.460 1.00 0.00 H new ATOM 0 HG22 VAL A 83 14.158 -3.722 3.973 1.00 0.00 H new ATOM 0 HG23 VAL A 83 14.358 -3.344 2.246 1.00 0.00 H new ATOM 1290 N VAL A 84 10.905 -4.543 3.675 1.00 0.00 N ATOM 1291 CA VAL A 84 9.909 -5.391 4.367 1.00 0.00 C ATOM 1292 C VAL A 84 10.635 -6.407 5.301 1.00 0.00 C ATOM 1293 O VAL A 84 11.460 -7.219 4.874 1.00 0.00 O ATOM 1294 CB VAL A 84 9.009 -6.128 3.319 1.00 0.00 C ATOM 1295 CG1 VAL A 84 7.900 -6.970 3.998 1.00 0.00 C ATOM 1296 CG2 VAL A 84 8.296 -5.184 2.327 1.00 0.00 C ATOM 0 H VAL A 84 11.283 -4.958 2.824 1.00 0.00 H new ATOM 0 HA VAL A 84 9.264 -4.763 4.982 1.00 0.00 H new ATOM 0 HB VAL A 84 9.714 -6.757 2.775 1.00 0.00 H new ATOM 0 HG11 VAL A 84 7.299 -7.464 3.234 1.00 0.00 H new ATOM 0 HG12 VAL A 84 8.357 -7.721 4.643 1.00 0.00 H new ATOM 0 HG13 VAL A 84 7.263 -6.318 4.595 1.00 0.00 H new ATOM 0 HG21 VAL A 84 7.693 -5.772 1.635 1.00 0.00 H new ATOM 0 HG22 VAL A 84 7.652 -4.498 2.877 1.00 0.00 H new ATOM 0 HG23 VAL A 84 9.039 -4.615 1.768 1.00 0.00 H new ATOM 1306 N GLU A 85 10.221 -6.378 6.562 1.00 0.00 N ATOM 1307 CA GLU A 85 10.616 -7.377 7.592 1.00 0.00 C ATOM 1308 C GLU A 85 9.324 -8.077 8.070 1.00 0.00 C ATOM 1309 O GLU A 85 8.360 -7.417 8.456 1.00 0.00 O ATOM 1310 CB GLU A 85 11.392 -6.576 8.658 1.00 0.00 C ATOM 1311 CG GLU A 85 11.830 -7.277 9.947 1.00 0.00 C ATOM 1312 CD GLU A 85 10.840 -7.454 11.093 1.00 0.00 C ATOM 1313 OE1 GLU A 85 9.912 -6.637 11.300 1.00 0.00 O ATOM 1314 OE2 GLU A 85 11.047 -8.422 11.854 1.00 0.00 O ATOM 0 H GLU A 85 9.593 -5.658 6.919 1.00 0.00 H new ATOM 0 HA GLU A 85 11.269 -8.182 7.256 1.00 0.00 H new ATOM 0 HB2 GLU A 85 12.287 -6.177 8.181 1.00 0.00 H new ATOM 0 HB3 GLU A 85 10.775 -5.724 8.942 1.00 0.00 H new ATOM 0 HG2 GLU A 85 12.187 -8.269 9.671 1.00 0.00 H new ATOM 0 HG3 GLU A 85 12.686 -6.728 10.340 1.00 0.00 H new ATOM 1321 N LYS A 86 9.268 -9.412 8.000 1.00 0.00 N ATOM 1322 CA LYS A 86 8.127 -10.202 8.540 1.00 0.00 C ATOM 1323 C LYS A 86 8.730 -10.997 9.708 1.00 0.00 C ATOM 1324 O LYS A 86 9.572 -11.879 9.497 1.00 0.00 O ATOM 1325 CB LYS A 86 7.544 -10.989 7.357 1.00 0.00 C ATOM 1326 CG LYS A 86 6.433 -12.019 7.592 1.00 0.00 C ATOM 1327 CD LYS A 86 6.803 -13.266 8.400 1.00 0.00 C ATOM 1328 CE LYS A 86 8.025 -14.061 7.923 1.00 0.00 C ATOM 1329 NZ LYS A 86 8.498 -14.860 9.076 1.00 0.00 N ATOM 0 H LYS A 86 9.999 -9.982 7.574 1.00 0.00 H new ATOM 0 HA LYS A 86 7.276 -9.656 8.947 1.00 0.00 H new ATOM 0 HB2 LYS A 86 7.164 -10.261 6.640 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.372 -11.510 6.875 1.00 0.00 H new ATOM 0 HG2 LYS A 86 5.608 -11.518 8.100 1.00 0.00 H new ATOM 0 HG3 LYS A 86 6.060 -12.343 6.620 1.00 0.00 H new ATOM 0 HD2 LYS A 86 6.977 -12.963 9.432 1.00 0.00 H new ATOM 0 HD3 LYS A 86 5.943 -13.935 8.405 1.00 0.00 H new ATOM 0 HE2 LYS A 86 7.761 -14.709 7.087 1.00 0.00 H new ATOM 0 HE3 LYS A 86 8.809 -13.390 7.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 9.443 -15.242 8.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 8.546 -14.256 9.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 7.838 -15.645 9.249 1.00 0.00 H new ATOM 1343 N ASN A 87 8.319 -10.683 10.943 1.00 0.00 N ATOM 1344 CA ASN A 87 8.929 -11.308 12.155 1.00 0.00 C ATOM 1345 C ASN A 87 8.261 -12.693 12.392 1.00 0.00 C ATOM 1346 O ASN A 87 8.720 -13.697 11.836 1.00 0.00 O ATOM 1347 CB ASN A 87 8.877 -10.268 13.297 1.00 0.00 C ATOM 1348 CG ASN A 87 9.912 -10.488 14.385 1.00 0.00 C ATOM 1349 OD1 ASN A 87 9.681 -11.186 15.366 1.00 0.00 O ATOM 1350 ND2 ASN A 87 11.072 -9.895 14.245 1.00 0.00 N ATOM 0 H ASN A 87 7.578 -10.011 11.143 1.00 0.00 H new ATOM 0 HA ASN A 87 9.987 -11.552 12.058 1.00 0.00 H new ATOM 0 HB2 ASN A 87 9.016 -9.273 12.874 1.00 0.00 H new ATOM 0 HB3 ASN A 87 7.884 -10.287 13.746 1.00 0.00 H new ATOM 0 HD21 ASN A 87 11.794 -10.012 14.956 1.00 0.00 H new ATOM 0 HD22 ASN A 87 11.253 -9.317 13.425 1.00 0.00 H new ATOM 1357 N SER A 88 7.112 -12.712 13.080 1.00 0.00 N ATOM 1358 CA SER A 88 6.090 -13.769 12.881 1.00 0.00 C ATOM 1359 C SER A 88 5.123 -13.404 11.706 1.00 0.00 C ATOM 1360 O SER A 88 5.040 -12.259 11.246 1.00 0.00 O ATOM 1361 CB SER A 88 5.322 -13.915 14.219 1.00 0.00 C ATOM 1362 OG SER A 88 6.195 -14.336 15.268 1.00 0.00 O ATOM 0 H SER A 88 6.860 -12.013 13.779 1.00 0.00 H new ATOM 0 HA SER A 88 6.561 -14.713 12.607 1.00 0.00 H new ATOM 0 HB2 SER A 88 4.862 -12.963 14.484 1.00 0.00 H new ATOM 0 HB3 SER A 88 4.514 -14.637 14.102 1.00 0.00 H new ATOM 0 HG SER A 88 5.688 -14.419 16.102 1.00 0.00 H new ATOM 1368 N GLU A 89 4.343 -14.382 11.255 1.00 0.00 N ATOM 1369 CA GLU A 89 3.379 -14.228 10.126 1.00 0.00 C ATOM 1370 C GLU A 89 2.071 -13.401 10.406 1.00 0.00 C ATOM 1371 O GLU A 89 1.235 -13.226 9.517 1.00 0.00 O ATOM 1372 CB GLU A 89 3.056 -15.669 9.653 1.00 0.00 C ATOM 1373 CG GLU A 89 4.178 -16.452 8.929 1.00 0.00 C ATOM 1374 CD GLU A 89 5.416 -16.810 9.742 1.00 0.00 C ATOM 1375 OE1 GLU A 89 5.279 -17.236 10.907 1.00 0.00 O ATOM 1376 OE2 GLU A 89 6.541 -16.603 9.242 1.00 0.00 O ATOM 0 H GLU A 89 4.349 -15.320 11.655 1.00 0.00 H new ATOM 0 HA GLU A 89 3.857 -13.614 9.363 1.00 0.00 H new ATOM 0 HB2 GLU A 89 2.750 -16.248 10.524 1.00 0.00 H new ATOM 0 HB3 GLU A 89 2.196 -15.619 8.985 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.749 -17.377 8.543 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.498 -15.865 8.068 1.00 0.00 H new ATOM 1383 N SER A 90 1.966 -12.851 11.620 1.00 0.00 N ATOM 1384 CA SER A 90 1.214 -11.613 11.889 1.00 0.00 C ATOM 1385 C SER A 90 1.984 -10.626 12.829 1.00 0.00 C ATOM 1386 O SER A 90 1.423 -10.126 13.808 1.00 0.00 O ATOM 1387 CB SER A 90 -0.214 -11.964 12.370 1.00 0.00 C ATOM 1388 OG SER A 90 -0.242 -12.801 13.529 1.00 0.00 O ATOM 0 H SER A 90 2.401 -13.252 12.451 1.00 0.00 H new ATOM 0 HA SER A 90 1.113 -11.055 10.958 1.00 0.00 H new ATOM 0 HB2 SER A 90 -0.752 -11.041 12.587 1.00 0.00 H new ATOM 0 HB3 SER A 90 -0.748 -12.462 11.561 1.00 0.00 H new ATOM 0 HG SER A 90 -1.172 -12.982 13.779 1.00 0.00 H new ATOM 1394 N LYS A 91 3.257 -10.311 12.509 1.00 0.00 N ATOM 1395 CA LYS A 91 4.022 -9.221 13.168 1.00 0.00 C ATOM 1396 C LYS A 91 5.078 -8.713 12.132 1.00 0.00 C ATOM 1397 O LYS A 91 6.206 -9.200 12.090 1.00 0.00 O ATOM 1398 CB LYS A 91 4.625 -9.720 14.501 1.00 0.00 C ATOM 1399 CG LYS A 91 4.932 -8.645 15.559 1.00 0.00 C ATOM 1400 CD LYS A 91 6.029 -7.640 15.195 1.00 0.00 C ATOM 1401 CE LYS A 91 6.532 -6.793 16.383 1.00 0.00 C ATOM 1402 NZ LYS A 91 5.489 -5.876 16.929 1.00 0.00 N ATOM 0 H LYS A 91 3.786 -10.802 11.788 1.00 0.00 H new ATOM 0 HA LYS A 91 3.389 -8.379 13.448 1.00 0.00 H new ATOM 0 HB2 LYS A 91 3.936 -10.443 14.938 1.00 0.00 H new ATOM 0 HB3 LYS A 91 5.549 -10.254 14.279 1.00 0.00 H new ATOM 0 HG2 LYS A 91 4.015 -8.093 15.765 1.00 0.00 H new ATOM 0 HG3 LYS A 91 5.217 -9.145 16.484 1.00 0.00 H new ATOM 0 HD2 LYS A 91 6.873 -8.180 14.766 1.00 0.00 H new ATOM 0 HD3 LYS A 91 5.651 -6.972 14.421 1.00 0.00 H new ATOM 0 HE2 LYS A 91 6.875 -7.457 17.176 1.00 0.00 H new ATOM 0 HE3 LYS A 91 7.393 -6.206 16.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 5.880 -5.346 17.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 5.190 -5.210 16.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 4.669 -6.432 17.245 1.00 0.00 H new ATOM 1416 N LEU A 92 4.686 -7.771 11.272 1.00 0.00 N ATOM 1417 CA LEU A 92 5.497 -7.329 10.088 1.00 0.00 C ATOM 1418 C LEU A 92 5.872 -5.830 10.209 1.00 0.00 C ATOM 1419 O LEU A 92 5.233 -5.063 10.926 1.00 0.00 O ATOM 1420 CB LEU A 92 4.594 -7.697 8.881 1.00 0.00 C ATOM 1421 CG LEU A 92 5.173 -7.650 7.461 1.00 0.00 C ATOM 1422 CD1 LEU A 92 4.351 -8.576 6.535 1.00 0.00 C ATOM 1423 CD2 LEU A 92 5.209 -6.263 6.811 1.00 0.00 C ATOM 0 H LEU A 92 3.797 -7.279 11.359 1.00 0.00 H new ATOM 0 HA LEU A 92 6.470 -7.811 9.990 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.221 -8.708 9.048 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.731 -7.031 8.904 1.00 0.00 H new ATOM 0 HG LEU A 92 6.208 -7.972 7.575 1.00 0.00 H new ATOM 0 HD11 LEU A 92 4.764 -8.541 5.527 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.395 -9.598 6.910 1.00 0.00 H new ATOM 0 HD13 LEU A 92 3.314 -8.242 6.514 1.00 0.00 H new ATOM 0 HD21 LEU A 92 5.635 -6.341 5.811 1.00 0.00 H new ATOM 0 HD22 LEU A 92 4.196 -5.866 6.744 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.821 -5.594 7.415 1.00 0.00 H new ATOM 1435 N THR A 93 6.920 -5.397 9.512 1.00 0.00 N ATOM 1436 CA THR A 93 7.436 -4.008 9.591 1.00 0.00 C ATOM 1437 C THR A 93 7.798 -3.538 8.136 1.00 0.00 C ATOM 1438 O THR A 93 8.888 -3.778 7.606 1.00 0.00 O ATOM 1439 CB THR A 93 8.680 -3.992 10.512 1.00 0.00 C ATOM 1440 OG1 THR A 93 8.509 -4.680 11.766 1.00 0.00 O ATOM 1441 CG2 THR A 93 9.314 -2.626 10.740 1.00 0.00 C ATOM 0 H THR A 93 7.446 -5.991 8.871 1.00 0.00 H new ATOM 0 HA THR A 93 6.692 -3.329 10.007 1.00 0.00 H new ATOM 0 HB THR A 93 9.390 -4.565 9.916 1.00 0.00 H new ATOM 0 HG1 THR A 93 8.840 -5.599 11.683 1.00 0.00 H new ATOM 0 HG21 THR A 93 10.176 -2.730 11.399 1.00 0.00 H new ATOM 0 HG22 THR A 93 9.635 -2.210 9.785 1.00 0.00 H new ATOM 0 HG23 THR A 93 8.585 -1.959 11.200 1.00 0.00 H new ATOM 1449 N GLN A 94 6.837 -2.866 7.506 1.00 0.00 N ATOM 1450 CA GLN A 94 6.908 -2.492 6.055 1.00 0.00 C ATOM 1451 C GLN A 94 7.596 -1.105 5.781 1.00 0.00 C ATOM 1452 O GLN A 94 7.022 -0.201 5.178 1.00 0.00 O ATOM 1453 CB GLN A 94 5.426 -2.578 5.602 1.00 0.00 C ATOM 1454 CG GLN A 94 5.137 -2.394 4.104 1.00 0.00 C ATOM 1455 CD GLN A 94 4.142 -1.290 3.756 1.00 0.00 C ATOM 1456 OE1 GLN A 94 2.939 -1.509 3.642 1.00 0.00 O ATOM 1457 NE2 GLN A 94 4.578 -0.070 3.585 1.00 0.00 N ATOM 0 H GLN A 94 5.981 -2.556 7.966 1.00 0.00 H new ATOM 0 HA GLN A 94 7.556 -3.154 5.480 1.00 0.00 H new ATOM 0 HB2 GLN A 94 5.036 -3.550 5.904 1.00 0.00 H new ATOM 0 HB3 GLN A 94 4.861 -1.824 6.150 1.00 0.00 H new ATOM 0 HG2 GLN A 94 6.077 -2.185 3.594 1.00 0.00 H new ATOM 0 HG3 GLN A 94 4.761 -3.336 3.706 1.00 0.00 H new ATOM 0 HE21 GLN A 94 5.573 0.133 3.675 1.00 0.00 H new ATOM 0 HE22 GLN A 94 3.923 0.679 3.361 1.00 0.00 H new ATOM 1466 N THR A 95 8.849 -0.991 6.227 1.00 0.00 N ATOM 1467 CA THR A 95 9.535 0.294 6.552 1.00 0.00 C ATOM 1468 C THR A 95 9.705 1.264 5.354 1.00 0.00 C ATOM 1469 O THR A 95 10.524 1.030 4.463 1.00 0.00 O ATOM 1470 CB THR A 95 10.910 -0.021 7.232 1.00 0.00 C ATOM 1471 OG1 THR A 95 10.815 -1.098 8.166 1.00 0.00 O ATOM 1472 CG2 THR A 95 11.463 1.184 7.993 1.00 0.00 C ATOM 0 H THR A 95 9.445 -1.804 6.382 1.00 0.00 H new ATOM 0 HA THR A 95 8.883 0.833 7.239 1.00 0.00 H new ATOM 0 HB THR A 95 11.576 -0.290 6.412 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.694 -1.263 8.566 1.00 0.00 H new ATOM 0 HG21 THR A 95 12.417 0.920 8.448 1.00 0.00 H new ATOM 0 HG22 THR A 95 11.608 2.015 7.303 1.00 0.00 H new ATOM 0 HG23 THR A 95 10.758 1.477 8.771 1.00 0.00 H new ATOM 1480 N GLN A 96 8.908 2.339 5.342 1.00 0.00 N ATOM 1481 CA GLN A 96 8.733 3.207 4.154 1.00 0.00 C ATOM 1482 C GLN A 96 9.935 4.170 3.937 1.00 0.00 C ATOM 1483 O GLN A 96 10.359 4.877 4.855 1.00 0.00 O ATOM 1484 CB GLN A 96 7.392 3.975 4.290 1.00 0.00 C ATOM 1485 CG GLN A 96 6.237 3.413 3.448 1.00 0.00 C ATOM 1486 CD GLN A 96 4.928 4.177 3.620 1.00 0.00 C ATOM 1487 OE1 GLN A 96 3.987 3.700 4.247 1.00 0.00 O ATOM 1488 NE2 GLN A 96 4.808 5.370 3.081 1.00 0.00 N ATOM 0 H GLN A 96 8.363 2.638 6.151 1.00 0.00 H new ATOM 0 HA GLN A 96 8.702 2.579 3.263 1.00 0.00 H new ATOM 0 HB2 GLN A 96 7.093 3.972 5.338 1.00 0.00 H new ATOM 0 HB3 GLN A 96 7.555 5.015 4.008 1.00 0.00 H new ATOM 0 HG2 GLN A 96 6.523 3.431 2.396 1.00 0.00 H new ATOM 0 HG3 GLN A 96 6.077 2.369 3.717 1.00 0.00 H new ATOM 0 HE21 GLN A 96 5.585 5.774 2.558 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.938 5.892 3.186 1.00 0.00 H new ATOM 1497 N VAL A 97 10.483 4.185 2.719 1.00 0.00 N ATOM 1498 CA VAL A 97 11.660 5.021 2.375 1.00 0.00 C ATOM 1499 C VAL A 97 11.169 6.001 1.263 1.00 0.00 C ATOM 1500 O VAL A 97 11.109 5.676 0.073 1.00 0.00 O ATOM 1501 CB VAL A 97 12.848 4.083 2.010 1.00 0.00 C ATOM 1502 CG1 VAL A 97 14.051 4.870 1.468 1.00 0.00 C ATOM 1503 CG2 VAL A 97 13.355 3.292 3.250 1.00 0.00 C ATOM 0 H VAL A 97 10.134 3.626 1.941 1.00 0.00 H new ATOM 0 HA VAL A 97 12.052 5.633 3.188 1.00 0.00 H new ATOM 0 HB VAL A 97 12.461 3.404 1.250 1.00 0.00 H new ATOM 0 HG11 VAL A 97 14.858 4.179 1.225 1.00 0.00 H new ATOM 0 HG12 VAL A 97 13.756 5.413 0.570 1.00 0.00 H new ATOM 0 HG13 VAL A 97 14.393 5.577 2.224 1.00 0.00 H new ATOM 0 HG21 VAL A 97 14.184 2.648 2.957 1.00 0.00 H new ATOM 0 HG22 VAL A 97 13.692 3.992 4.015 1.00 0.00 H new ATOM 0 HG23 VAL A 97 12.545 2.681 3.648 1.00 0.00 H new ATOM 1513 N ASP A 98 10.770 7.186 1.723 1.00 0.00 N ATOM 1514 CA ASP A 98 10.002 8.177 0.924 1.00 0.00 C ATOM 1515 C ASP A 98 10.914 9.419 0.570 1.00 0.00 C ATOM 1516 O ASP A 98 12.024 9.516 1.112 1.00 0.00 O ATOM 1517 CB ASP A 98 8.825 8.627 1.849 1.00 0.00 C ATOM 1518 CG ASP A 98 8.037 7.548 2.588 1.00 0.00 C ATOM 1519 OD1 ASP A 98 8.531 7.144 3.662 1.00 0.00 O ATOM 1520 OD2 ASP A 98 6.958 7.109 2.147 1.00 0.00 O ATOM 0 H ASP A 98 10.967 7.502 2.673 1.00 0.00 H new ATOM 0 HA ASP A 98 9.648 7.754 -0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.230 9.313 2.593 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.122 9.196 1.241 1.00 0.00 H new ATOM 1525 N PRO A 99 10.506 10.467 -0.201 1.00 0.00 N ATOM 1526 CA PRO A 99 11.266 11.773 -0.234 1.00 0.00 C ATOM 1527 C PRO A 99 11.445 12.576 1.097 1.00 0.00 C ATOM 1528 O PRO A 99 12.244 13.514 1.126 1.00 0.00 O ATOM 1529 CB PRO A 99 10.529 12.561 -1.344 1.00 0.00 C ATOM 1530 CG PRO A 99 9.098 11.984 -1.353 1.00 0.00 C ATOM 1531 CD PRO A 99 9.302 10.489 -1.050 1.00 0.00 C ATOM 0 HA PRO A 99 12.322 11.580 -0.424 1.00 0.00 H new ATOM 0 HB2 PRO A 99 10.523 13.630 -1.133 1.00 0.00 H new ATOM 0 HB3 PRO A 99 11.014 12.430 -2.311 1.00 0.00 H new ATOM 0 HG2 PRO A 99 8.469 12.462 -0.602 1.00 0.00 H new ATOM 0 HG3 PRO A 99 8.612 12.134 -2.317 1.00 0.00 H new ATOM 0 HD2 PRO A 99 8.441 10.063 -0.535 1.00 0.00 H new ATOM 0 HD3 PRO A 99 9.445 9.911 -1.963 1.00 0.00 H new ATOM 1539 N LYS A 100 10.768 12.175 2.184 1.00 0.00 N ATOM 1540 CA LYS A 100 11.163 12.531 3.573 1.00 0.00 C ATOM 1541 C LYS A 100 11.706 11.349 4.476 1.00 0.00 C ATOM 1542 O LYS A 100 12.214 11.651 5.557 1.00 0.00 O ATOM 1543 CB LYS A 100 9.952 13.220 4.273 1.00 0.00 C ATOM 1544 CG LYS A 100 10.182 14.695 4.658 1.00 0.00 C ATOM 1545 CD LYS A 100 11.105 14.835 5.882 1.00 0.00 C ATOM 1546 CE LYS A 100 11.340 16.284 6.338 1.00 0.00 C ATOM 1547 NZ LYS A 100 12.250 17.007 5.403 1.00 0.00 N ATOM 0 H LYS A 100 9.931 11.595 2.134 1.00 0.00 H new ATOM 0 HA LYS A 100 12.019 13.197 3.469 1.00 0.00 H new ATOM 0 HB2 LYS A 100 9.087 13.162 3.612 1.00 0.00 H new ATOM 0 HB3 LYS A 100 9.703 12.659 5.174 1.00 0.00 H new ATOM 0 HG2 LYS A 100 10.618 15.226 3.812 1.00 0.00 H new ATOM 0 HG3 LYS A 100 9.223 15.168 4.871 1.00 0.00 H new ATOM 0 HD2 LYS A 100 10.677 14.271 6.711 1.00 0.00 H new ATOM 0 HD3 LYS A 100 12.068 14.379 5.650 1.00 0.00 H new ATOM 0 HE2 LYS A 100 10.386 16.808 6.398 1.00 0.00 H new ATOM 0 HE3 LYS A 100 11.768 16.287 7.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 12.389 17.982 5.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 13.168 16.520 5.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 11.829 17.024 4.452 1.00 0.00 H new ATOM 1561 N ASN A 101 11.580 10.071 4.069 1.00 0.00 N ATOM 1562 CA ASN A 101 11.882 8.873 4.904 1.00 0.00 C ATOM 1563 C ASN A 101 10.921 8.676 6.119 1.00 0.00 C ATOM 1564 O ASN A 101 10.917 9.474 7.060 1.00 0.00 O ATOM 1565 CB ASN A 101 13.384 8.769 5.267 1.00 0.00 C ATOM 1566 CG ASN A 101 13.836 7.356 5.615 1.00 0.00 C ATOM 1567 OD1 ASN A 101 14.192 6.565 4.750 1.00 0.00 O ATOM 1568 ND2 ASN A 101 13.814 6.977 6.870 1.00 0.00 N ATOM 0 H ASN A 101 11.259 9.828 3.132 1.00 0.00 H new ATOM 0 HA ASN A 101 11.668 8.015 4.267 1.00 0.00 H new ATOM 0 HB2 ASN A 101 13.977 9.134 4.428 1.00 0.00 H new ATOM 0 HB3 ASN A 101 13.590 9.425 6.113 1.00 0.00 H new ATOM 0 HD21 ASN A 101 14.092 6.028 7.121 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.519 7.631 7.595 1.00 0.00 H new ATOM 1575 N THR A 102 10.152 7.581 6.121 1.00 0.00 N ATOM 1576 CA THR A 102 9.259 7.217 7.257 1.00 0.00 C ATOM 1577 C THR A 102 10.028 6.348 8.301 1.00 0.00 C ATOM 1578 O THR A 102 10.898 5.538 7.960 1.00 0.00 O ATOM 1579 CB THR A 102 8.017 6.461 6.697 1.00 0.00 C ATOM 1580 OG1 THR A 102 7.353 7.197 5.677 1.00 0.00 O ATOM 1581 CG2 THR A 102 6.896 6.195 7.685 1.00 0.00 C ATOM 0 H THR A 102 10.122 6.918 5.346 1.00 0.00 H new ATOM 0 HA THR A 102 8.925 8.119 7.769 1.00 0.00 H new ATOM 0 HB THR A 102 8.477 5.529 6.367 1.00 0.00 H new ATOM 0 HG1 THR A 102 7.985 7.399 4.956 1.00 0.00 H new ATOM 0 HG21 THR A 102 6.087 5.664 7.183 1.00 0.00 H new ATOM 0 HG22 THR A 102 7.273 5.588 8.508 1.00 0.00 H new ATOM 0 HG23 THR A 102 6.522 7.142 8.075 1.00 0.00 H new ATOM 1589 N THR A 103 9.672 6.476 9.587 1.00 0.00 N ATOM 1590 CA THR A 103 10.145 5.528 10.644 1.00 0.00 C ATOM 1591 C THR A 103 9.471 4.119 10.516 1.00 0.00 C ATOM 1592 O THR A 103 8.583 3.899 9.690 1.00 0.00 O ATOM 1593 CB THR A 103 9.981 6.286 11.983 1.00 0.00 C ATOM 1594 OG1 THR A 103 10.756 7.483 11.955 1.00 0.00 O ATOM 1595 CG2 THR A 103 10.456 5.585 13.237 1.00 0.00 C ATOM 0 H THR A 103 9.063 7.217 9.934 1.00 0.00 H new ATOM 0 HA THR A 103 11.195 5.252 10.549 1.00 0.00 H new ATOM 0 HB THR A 103 8.900 6.414 12.046 1.00 0.00 H new ATOM 0 HG1 THR A 103 11.303 7.537 12.766 1.00 0.00 H new ATOM 0 HG21 THR A 103 10.282 6.227 14.101 1.00 0.00 H new ATOM 0 HG22 THR A 103 9.907 4.652 13.362 1.00 0.00 H new ATOM 0 HG23 THR A 103 11.521 5.371 13.153 1.00 0.00 H new ATOM 1603 N VAL A 104 9.939 3.130 11.286 1.00 0.00 N ATOM 1604 CA VAL A 104 9.397 1.745 11.278 1.00 0.00 C ATOM 1605 C VAL A 104 7.859 1.632 11.571 1.00 0.00 C ATOM 1606 O VAL A 104 7.414 1.718 12.720 1.00 0.00 O ATOM 1607 CB VAL A 104 10.207 0.781 12.210 1.00 0.00 C ATOM 1608 CG1 VAL A 104 11.588 0.414 11.633 1.00 0.00 C ATOM 1609 CG2 VAL A 104 10.386 1.222 13.673 1.00 0.00 C ATOM 0 H VAL A 104 10.710 3.258 11.941 1.00 0.00 H new ATOM 0 HA VAL A 104 9.526 1.425 10.244 1.00 0.00 H new ATOM 0 HB VAL A 104 9.555 -0.092 12.234 1.00 0.00 H new ATOM 0 HG11 VAL A 104 12.104 -0.256 12.321 1.00 0.00 H new ATOM 0 HG12 VAL A 104 11.460 -0.082 10.671 1.00 0.00 H new ATOM 0 HG13 VAL A 104 12.178 1.320 11.498 1.00 0.00 H new ATOM 0 HG21 VAL A 104 10.963 0.470 14.212 1.00 0.00 H new ATOM 0 HG22 VAL A 104 10.914 2.175 13.704 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.408 1.333 14.142 1.00 0.00 H new ATOM 1619 N ILE A 105 7.054 1.401 10.525 1.00 0.00 N ATOM 1620 CA ILE A 105 5.568 1.333 10.647 1.00 0.00 C ATOM 1621 C ILE A 105 5.097 -0.145 10.819 1.00 0.00 C ATOM 1622 O ILE A 105 4.474 -0.767 9.949 1.00 0.00 O ATOM 1623 CB ILE A 105 4.847 2.115 9.506 1.00 0.00 C ATOM 1624 CG1 ILE A 105 5.050 1.616 8.067 1.00 0.00 C ATOM 1625 CG2 ILE A 105 5.132 3.635 9.592 1.00 0.00 C ATOM 1626 CD1 ILE A 105 6.452 1.700 7.509 1.00 0.00 C ATOM 0 H ILE A 105 7.397 1.256 9.575 1.00 0.00 H new ATOM 0 HA ILE A 105 5.268 1.851 11.558 1.00 0.00 H new ATOM 0 HB ILE A 105 3.797 1.905 9.708 1.00 0.00 H new ATOM 0 HG12 ILE A 105 4.727 0.576 8.019 1.00 0.00 H new ATOM 0 HG13 ILE A 105 4.389 2.186 7.413 1.00 0.00 H new ATOM 0 HG21 ILE A 105 4.614 4.149 8.782 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.778 4.018 10.549 1.00 0.00 H new ATOM 0 HG23 ILE A 105 6.204 3.810 9.505 1.00 0.00 H new ATOM 0 HD11 ILE A 105 6.461 1.318 6.488 1.00 0.00 H new ATOM 0 HD12 ILE A 105 6.783 2.739 7.510 1.00 0.00 H new ATOM 0 HD13 ILE A 105 7.125 1.104 8.125 1.00 0.00 H new ATOM 1638 N VAL A 106 5.410 -0.673 12.009 1.00 0.00 N ATOM 1639 CA VAL A 106 5.100 -2.072 12.404 1.00 0.00 C ATOM 1640 C VAL A 106 3.564 -2.428 12.311 1.00 0.00 C ATOM 1641 O VAL A 106 2.683 -1.560 12.350 1.00 0.00 O ATOM 1642 CB VAL A 106 5.663 -2.429 13.833 1.00 0.00 C ATOM 1643 CG1 VAL A 106 7.185 -2.223 13.960 1.00 0.00 C ATOM 1644 CG2 VAL A 106 4.964 -1.698 14.989 1.00 0.00 C ATOM 0 H VAL A 106 5.890 -0.145 12.738 1.00 0.00 H new ATOM 0 HA VAL A 106 5.614 -2.691 11.669 1.00 0.00 H new ATOM 0 HB VAL A 106 5.440 -3.492 13.924 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.505 -2.487 14.968 1.00 0.00 H new ATOM 0 HG12 VAL A 106 7.699 -2.857 13.238 1.00 0.00 H new ATOM 0 HG13 VAL A 106 7.428 -1.179 13.764 1.00 0.00 H new ATOM 0 HG21 VAL A 106 5.412 -2.001 15.935 1.00 0.00 H new ATOM 0 HG22 VAL A 106 5.079 -0.622 14.861 1.00 0.00 H new ATOM 0 HG23 VAL A 106 3.904 -1.952 14.992 1.00 0.00 H new ATOM 1654 N ARG A 107 3.276 -3.721 12.174 1.00 0.00 N ATOM 1655 CA ARG A 107 1.890 -4.236 12.056 1.00 0.00 C ATOM 1656 C ARG A 107 1.678 -5.596 12.757 1.00 0.00 C ATOM 1657 O ARG A 107 2.096 -6.642 12.253 1.00 0.00 O ATOM 1658 CB ARG A 107 1.344 -4.165 10.618 1.00 0.00 C ATOM 1659 CG ARG A 107 2.088 -4.892 9.499 1.00 0.00 C ATOM 1660 CD ARG A 107 1.656 -4.431 8.098 1.00 0.00 C ATOM 1661 NE ARG A 107 2.114 -3.035 7.871 1.00 0.00 N ATOM 1662 CZ ARG A 107 1.998 -2.362 6.741 1.00 0.00 C ATOM 1663 NH1 ARG A 107 1.569 -2.889 5.627 1.00 0.00 N ATOM 1664 NH2 ARG A 107 2.360 -1.113 6.730 1.00 0.00 N ATOM 0 H ARG A 107 3.988 -4.450 12.140 1.00 0.00 H new ATOM 0 HA ARG A 107 1.264 -3.547 12.623 1.00 0.00 H new ATOM 0 HB2 ARG A 107 0.324 -4.548 10.636 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.285 -3.112 10.342 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.159 -4.729 9.616 1.00 0.00 H new ATOM 0 HG3 ARG A 107 1.917 -5.964 9.592 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.078 -5.091 7.340 1.00 0.00 H new ATOM 0 HD3 ARG A 107 0.572 -4.489 8.003 1.00 0.00 H new ATOM 0 HE ARG A 107 2.556 -2.556 8.656 1.00 0.00 H new ATOM 0 HH11 ARG A 107 1.301 -3.873 5.598 1.00 0.00 H new ATOM 0 HH12 ARG A 107 1.501 -2.317 4.785 1.00 0.00 H new ATOM 0 HH21 ARG A 107 2.722 -0.679 7.579 1.00 0.00 H new ATOM 0 HH22 ARG A 107 2.282 -0.567 5.872 1.00 0.00 H new ATOM 1678 N GLU A 108 1.006 -5.544 13.914 1.00 0.00 N ATOM 1679 CA GLU A 108 0.721 -6.730 14.773 1.00 0.00 C ATOM 1680 C GLU A 108 -0.794 -7.118 14.719 1.00 0.00 C ATOM 1681 O GLU A 108 -1.577 -6.592 13.920 1.00 0.00 O ATOM 1682 CB GLU A 108 1.269 -6.286 16.159 1.00 0.00 C ATOM 1683 CG GLU A 108 1.418 -7.366 17.244 1.00 0.00 C ATOM 1684 CD GLU A 108 2.311 -6.891 18.382 1.00 0.00 C ATOM 1685 OE1 GLU A 108 3.551 -6.970 18.239 1.00 0.00 O ATOM 1686 OE2 GLU A 108 1.780 -6.404 19.402 1.00 0.00 O ATOM 0 H GLU A 108 0.635 -4.674 14.296 1.00 0.00 H new ATOM 0 HA GLU A 108 1.195 -7.660 14.459 1.00 0.00 H new ATOM 0 HB2 GLU A 108 2.246 -5.829 16.003 1.00 0.00 H new ATOM 0 HB3 GLU A 108 0.611 -5.508 16.547 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.435 -7.628 17.636 1.00 0.00 H new ATOM 0 HG3 GLU A 108 1.837 -8.271 16.804 1.00 0.00 H new ATOM 1693 N VAL A 109 -1.212 -8.076 15.553 1.00 0.00 N ATOM 1694 CA VAL A 109 -2.650 -8.428 15.748 1.00 0.00 C ATOM 1695 C VAL A 109 -2.947 -8.717 17.244 1.00 0.00 C ATOM 1696 O VAL A 109 -2.194 -9.436 17.909 1.00 0.00 O ATOM 1697 CB VAL A 109 -3.092 -9.569 14.785 1.00 0.00 C ATOM 1698 CG1 VAL A 109 -2.480 -10.943 15.084 1.00 0.00 C ATOM 1699 CG2 VAL A 109 -4.623 -9.716 14.713 1.00 0.00 C ATOM 0 H VAL A 109 -0.575 -8.637 16.118 1.00 0.00 H new ATOM 0 HA VAL A 109 -3.264 -7.569 15.478 1.00 0.00 H new ATOM 0 HB VAL A 109 -2.700 -9.244 13.821 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -2.848 -11.670 14.360 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -1.394 -10.880 15.015 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -2.763 -11.256 16.089 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -4.879 -10.525 14.028 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -5.014 -9.943 15.705 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -5.061 -8.785 14.355 1.00 0.00 H new ATOM 1709 N ASP A 110 -4.088 -8.216 17.733 1.00 0.00 N ATOM 1710 CA ASP A 110 -4.524 -8.436 19.139 1.00 0.00 C ATOM 1711 C ASP A 110 -5.863 -9.263 19.212 1.00 0.00 C ATOM 1712 O ASP A 110 -6.783 -8.927 19.962 1.00 0.00 O ATOM 1713 CB ASP A 110 -4.591 -7.037 19.802 1.00 0.00 C ATOM 1714 CG ASP A 110 -3.225 -6.415 20.105 1.00 0.00 C ATOM 1715 OD1 ASP A 110 -2.496 -6.063 19.152 1.00 0.00 O ATOM 1716 OD2 ASP A 110 -2.861 -6.240 21.285 1.00 0.00 O ATOM 0 H ASP A 110 -4.736 -7.652 17.182 1.00 0.00 H new ATOM 0 HA ASP A 110 -3.818 -9.055 19.693 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -5.146 -6.364 19.148 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -5.155 -7.115 20.731 1.00 0.00 H new ATOM 1721 N GLY A 111 -5.949 -10.371 18.444 1.00 0.00 N ATOM 1722 CA GLY A 111 -7.198 -11.152 18.276 1.00 0.00 C ATOM 1723 C GLY A 111 -8.136 -10.634 17.171 1.00 0.00 C ATOM 1724 O GLY A 111 -9.167 -10.028 17.467 1.00 0.00 O ATOM 0 H GLY A 111 -5.158 -10.750 17.924 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.937 -12.187 18.056 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -7.739 -11.154 19.222 1.00 0.00 H new ATOM 1728 N ASP A 112 -7.733 -10.840 15.909 1.00 0.00 N ATOM 1729 CA ASP A 112 -8.339 -10.183 14.703 1.00 0.00 C ATOM 1730 C ASP A 112 -8.684 -8.638 14.779 1.00 0.00 C ATOM 1731 O ASP A 112 -9.657 -8.145 14.198 1.00 0.00 O ATOM 1732 CB ASP A 112 -9.450 -11.073 14.116 1.00 0.00 C ATOM 1733 CG ASP A 112 -8.984 -12.343 13.388 1.00 0.00 C ATOM 1734 OD1 ASP A 112 -7.783 -12.500 13.067 1.00 0.00 O ATOM 1735 OD2 ASP A 112 -9.851 -13.175 13.059 1.00 0.00 O ATOM 0 H ASP A 112 -6.968 -11.473 15.676 1.00 0.00 H new ATOM 0 HA ASP A 112 -7.521 -10.121 13.985 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -10.118 -11.367 14.926 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -10.037 -10.474 13.420 1.00 0.00 H new ATOM 1740 N THR A 113 -7.799 -7.893 15.448 1.00 0.00 N ATOM 1741 CA THR A 113 -7.843 -6.424 15.598 1.00 0.00 C ATOM 1742 C THR A 113 -6.371 -5.953 15.439 1.00 0.00 C ATOM 1743 O THR A 113 -5.544 -6.020 16.352 1.00 0.00 O ATOM 1744 CB THR A 113 -8.587 -5.969 16.865 1.00 0.00 C ATOM 1745 OG1 THR A 113 -8.695 -4.549 16.869 1.00 0.00 O ATOM 1746 CG2 THR A 113 -8.074 -6.380 18.231 1.00 0.00 C ATOM 0 H THR A 113 -6.997 -8.308 15.922 1.00 0.00 H new ATOM 0 HA THR A 113 -8.450 -5.937 14.835 1.00 0.00 H new ATOM 0 HB THR A 113 -9.527 -6.511 16.764 1.00 0.00 H new ATOM 0 HG1 THR A 113 -9.170 -4.259 17.676 1.00 0.00 H new ATOM 0 HG21 THR A 113 -8.724 -5.968 19.003 1.00 0.00 H new ATOM 0 HG22 THR A 113 -8.067 -7.467 18.305 1.00 0.00 H new ATOM 0 HG23 THR A 113 -7.062 -6.001 18.369 1.00 0.00 H new ATOM 1754 N MET A 114 -6.056 -5.594 14.195 1.00 0.00 N ATOM 1755 CA MET A 114 -4.675 -5.468 13.684 1.00 0.00 C ATOM 1756 C MET A 114 -4.003 -4.172 14.200 1.00 0.00 C ATOM 1757 O MET A 114 -4.273 -3.079 13.692 1.00 0.00 O ATOM 1758 CB MET A 114 -4.689 -5.505 12.132 1.00 0.00 C ATOM 1759 CG MET A 114 -5.302 -6.759 11.498 1.00 0.00 C ATOM 1760 SD MET A 114 -4.245 -8.185 11.761 1.00 0.00 S ATOM 1761 CE MET A 114 -5.420 -9.472 11.318 1.00 0.00 C ATOM 0 H MET A 114 -6.763 -5.376 13.493 1.00 0.00 H new ATOM 0 HA MET A 114 -4.087 -6.308 14.054 1.00 0.00 H new ATOM 0 HB2 MET A 114 -5.237 -4.634 11.772 1.00 0.00 H new ATOM 0 HB3 MET A 114 -3.664 -5.406 11.776 1.00 0.00 H new ATOM 0 HG2 MET A 114 -6.286 -6.946 11.928 1.00 0.00 H new ATOM 0 HG3 MET A 114 -5.446 -6.599 10.429 1.00 0.00 H new ATOM 0 HE1 MET A 114 -4.945 -10.448 11.418 1.00 0.00 H new ATOM 0 HE2 MET A 114 -6.284 -9.419 11.980 1.00 0.00 H new ATOM 0 HE3 MET A 114 -5.743 -9.330 10.287 1.00 0.00 H new ATOM 1771 N LYS A 115 -3.171 -4.309 15.241 1.00 0.00 N ATOM 1772 CA LYS A 115 -2.547 -3.145 15.920 1.00 0.00 C ATOM 1773 C LYS A 115 -1.258 -2.707 15.165 1.00 0.00 C ATOM 1774 O LYS A 115 -0.188 -3.303 15.315 1.00 0.00 O ATOM 1775 CB LYS A 115 -2.290 -3.548 17.389 1.00 0.00 C ATOM 1776 CG LYS A 115 -1.828 -2.386 18.286 1.00 0.00 C ATOM 1777 CD LYS A 115 -1.451 -2.818 19.715 1.00 0.00 C ATOM 1778 CE LYS A 115 -0.115 -3.581 19.832 1.00 0.00 C ATOM 1779 NZ LYS A 115 -0.317 -5.024 20.128 1.00 0.00 N ATOM 0 H LYS A 115 -2.909 -5.211 15.638 1.00 0.00 H new ATOM 0 HA LYS A 115 -3.202 -2.274 15.910 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -3.204 -3.972 17.804 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.535 -4.334 17.413 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -0.968 -1.902 17.824 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.622 -1.642 18.339 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.402 -1.931 20.346 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -2.248 -3.447 20.111 1.00 0.00 H new ATOM 0 HE2 LYS A 115 0.443 -3.477 18.902 1.00 0.00 H new ATOM 0 HE3 LYS A 115 0.491 -3.132 20.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.596 -5.519 20.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -0.719 -5.130 21.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.969 -5.434 19.429 1.00 0.00 H new ATOM 1793 N THR A 116 -1.386 -1.666 14.340 1.00 0.00 N ATOM 1794 CA THR A 116 -0.309 -1.197 13.441 1.00 0.00 C ATOM 1795 C THR A 116 0.068 0.272 13.736 1.00 0.00 C ATOM 1796 O THR A 116 -0.497 1.227 13.191 1.00 0.00 O ATOM 1797 CB THR A 116 -0.576 -1.524 11.953 1.00 0.00 C ATOM 1798 OG1 THR A 116 0.467 -0.961 11.149 1.00 0.00 O ATOM 1799 CG2 THR A 116 -1.906 -1.146 11.338 1.00 0.00 C ATOM 0 H THR A 116 -2.242 -1.116 14.270 1.00 0.00 H new ATOM 0 HA THR A 116 0.588 -1.774 13.664 1.00 0.00 H new ATOM 0 HB THR A 116 -0.604 -2.614 11.960 1.00 0.00 H new ATOM 0 HG1 THR A 116 1.328 -1.348 11.412 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.922 -1.448 10.291 1.00 0.00 H new ATOM 0 HG22 THR A 116 -2.711 -1.650 11.873 1.00 0.00 H new ATOM 0 HG23 THR A 116 -2.045 -0.067 11.406 1.00 0.00 H new ATOM 1807 N THR A 117 1.099 0.403 14.575 1.00 0.00 N ATOM 1808 CA THR A 117 1.633 1.692 15.052 1.00 0.00 C ATOM 1809 C THR A 117 2.352 2.466 13.916 1.00 0.00 C ATOM 1810 O THR A 117 3.472 2.112 13.527 1.00 0.00 O ATOM 1811 CB THR A 117 2.640 1.357 16.209 1.00 0.00 C ATOM 1812 OG1 THR A 117 2.103 0.460 17.178 1.00 0.00 O ATOM 1813 CG2 THR A 117 3.099 2.580 16.986 1.00 0.00 C ATOM 0 H THR A 117 1.601 -0.400 14.953 1.00 0.00 H new ATOM 0 HA THR A 117 0.823 2.334 15.400 1.00 0.00 H new ATOM 0 HB THR A 117 3.477 0.903 15.678 1.00 0.00 H new ATOM 0 HG1 THR A 117 2.774 0.287 17.871 1.00 0.00 H new ATOM 0 HG21 THR A 117 3.793 2.274 17.769 1.00 0.00 H new ATOM 0 HG22 THR A 117 3.598 3.274 16.310 1.00 0.00 H new ATOM 0 HG23 THR A 117 2.236 3.070 17.437 1.00 0.00 H new ATOM 1821 N VAL A 118 1.713 3.519 13.383 1.00 0.00 N ATOM 1822 CA VAL A 118 2.329 4.334 12.303 1.00 0.00 C ATOM 1823 C VAL A 118 3.032 5.572 12.905 1.00 0.00 C ATOM 1824 O VAL A 118 2.381 6.519 13.341 1.00 0.00 O ATOM 1825 CB VAL A 118 1.340 4.502 11.122 1.00 0.00 C ATOM 1826 CG1 VAL A 118 0.089 5.338 11.330 1.00 0.00 C ATOM 1827 CG2 VAL A 118 2.049 4.974 9.836 1.00 0.00 C ATOM 0 H VAL A 118 0.785 3.829 13.670 1.00 0.00 H new ATOM 0 HA VAL A 118 3.161 3.831 11.810 1.00 0.00 H new ATOM 0 HB VAL A 118 0.966 3.482 11.033 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.494 5.355 10.409 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -0.510 4.904 12.131 1.00 0.00 H new ATOM 0 HG13 VAL A 118 0.372 6.356 11.599 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.318 5.078 9.035 1.00 0.00 H new ATOM 0 HG22 VAL A 118 2.529 5.936 10.017 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.803 4.242 9.546 1.00 0.00 H new ATOM 1837 N THR A 119 4.370 5.537 12.989 1.00 0.00 N ATOM 1838 CA THR A 119 5.199 6.646 13.546 1.00 0.00 C ATOM 1839 C THR A 119 6.198 7.207 12.489 1.00 0.00 C ATOM 1840 O THR A 119 6.619 6.505 11.564 1.00 0.00 O ATOM 1841 CB THR A 119 5.941 6.171 14.834 1.00 0.00 C ATOM 1842 OG1 THR A 119 6.751 7.220 15.369 1.00 0.00 O ATOM 1843 CG2 THR A 119 6.812 4.928 14.677 1.00 0.00 C ATOM 0 H THR A 119 4.922 4.739 12.674 1.00 0.00 H new ATOM 0 HA THR A 119 4.531 7.465 13.815 1.00 0.00 H new ATOM 0 HB THR A 119 5.132 5.898 15.511 1.00 0.00 H new ATOM 0 HG1 THR A 119 6.448 7.437 16.276 1.00 0.00 H new ATOM 0 HG21 THR A 119 7.279 4.688 15.632 1.00 0.00 H new ATOM 0 HG22 THR A 119 6.195 4.090 14.354 1.00 0.00 H new ATOM 0 HG23 THR A 119 7.585 5.117 13.932 1.00 0.00 H new ATOM 1851 N VAL A 120 6.576 8.485 12.654 1.00 0.00 N ATOM 1852 CA VAL A 120 7.532 9.185 11.739 1.00 0.00 C ATOM 1853 C VAL A 120 8.404 10.120 12.629 1.00 0.00 C ATOM 1854 O VAL A 120 8.096 11.301 12.803 1.00 0.00 O ATOM 1855 CB VAL A 120 6.807 9.980 10.598 1.00 0.00 C ATOM 1856 CG1 VAL A 120 7.810 10.422 9.524 1.00 0.00 C ATOM 1857 CG2 VAL A 120 5.653 9.179 9.986 1.00 0.00 C ATOM 0 H VAL A 120 6.238 9.071 13.417 1.00 0.00 H new ATOM 0 HA VAL A 120 8.151 8.454 11.219 1.00 0.00 H new ATOM 0 HB VAL A 120 6.370 10.873 11.046 1.00 0.00 H new ATOM 0 HG11 VAL A 120 7.287 10.972 8.742 1.00 0.00 H new ATOM 0 HG12 VAL A 120 8.567 11.064 9.975 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.290 9.544 9.091 1.00 0.00 H new ATOM 0 HG21 VAL A 120 5.179 9.767 9.200 1.00 0.00 H new ATOM 0 HG22 VAL A 120 6.038 8.251 9.563 1.00 0.00 H new ATOM 0 HG23 VAL A 120 4.920 8.948 10.759 1.00 0.00 H new ATOM 1867 N GLY A 121 9.420 9.551 13.285 1.00 0.00 N ATOM 1868 CA GLY A 121 10.148 10.220 14.387 1.00 0.00 C ATOM 1869 C GLY A 121 9.401 10.381 15.733 1.00 0.00 C ATOM 1870 O GLY A 121 9.929 10.041 16.791 1.00 0.00 O ATOM 0 H GLY A 121 9.767 8.615 13.074 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.065 9.661 14.574 1.00 0.00 H new ATOM 0 HA3 GLY A 121 10.443 11.212 14.044 1.00 0.00 H new ATOM 1874 N ASP A 122 8.211 10.982 15.647 1.00 0.00 N ATOM 1875 CA ASP A 122 7.575 11.720 16.768 1.00 0.00 C ATOM 1876 C ASP A 122 6.005 11.775 16.810 1.00 0.00 C ATOM 1877 O ASP A 122 5.437 12.569 17.563 1.00 0.00 O ATOM 1878 CB ASP A 122 8.203 13.143 16.858 1.00 0.00 C ATOM 1879 CG ASP A 122 7.980 14.036 15.636 1.00 0.00 C ATOM 1880 OD1 ASP A 122 6.928 14.698 15.530 1.00 0.00 O ATOM 1881 OD2 ASP A 122 8.828 14.041 14.715 1.00 0.00 O ATOM 0 H ASP A 122 7.649 10.976 14.796 1.00 0.00 H new ATOM 0 HA ASP A 122 7.797 11.124 17.653 1.00 0.00 H new ATOM 0 HB2 ASP A 122 7.796 13.647 17.735 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.276 13.039 17.020 1.00 0.00 H new ATOM 1886 N VAL A 123 5.316 10.910 16.057 1.00 0.00 N ATOM 1887 CA VAL A 123 3.838 11.000 15.870 1.00 0.00 C ATOM 1888 C VAL A 123 3.115 9.800 16.543 1.00 0.00 C ATOM 1889 O VAL A 123 2.267 10.013 17.411 1.00 0.00 O ATOM 1890 CB VAL A 123 3.434 11.232 14.371 1.00 0.00 C ATOM 1891 CG1 VAL A 123 1.903 11.443 14.245 1.00 0.00 C ATOM 1892 CG2 VAL A 123 4.094 12.496 13.763 1.00 0.00 C ATOM 0 H VAL A 123 5.748 10.131 15.559 1.00 0.00 H new ATOM 0 HA VAL A 123 3.489 11.893 16.388 1.00 0.00 H new ATOM 0 HB VAL A 123 3.771 10.343 13.838 1.00 0.00 H new ATOM 0 HG11 VAL A 123 1.643 11.602 13.199 1.00 0.00 H new ATOM 0 HG12 VAL A 123 1.382 10.561 14.618 1.00 0.00 H new ATOM 0 HG13 VAL A 123 1.606 12.314 14.829 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.780 12.607 12.725 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.789 13.375 14.331 1.00 0.00 H new ATOM 0 HG23 VAL A 123 5.179 12.396 13.805 1.00 0.00 H new ATOM 1902 N THR A 124 3.440 8.567 16.126 1.00 0.00 N ATOM 1903 CA THR A 124 2.949 7.310 16.759 1.00 0.00 C ATOM 1904 C THR A 124 1.407 7.164 16.781 1.00 0.00 C ATOM 1905 O THR A 124 0.743 7.380 17.800 1.00 0.00 O ATOM 1906 CB THR A 124 3.663 7.068 18.116 1.00 0.00 C ATOM 1907 OG1 THR A 124 5.081 7.169 17.974 1.00 0.00 O ATOM 1908 CG2 THR A 124 3.419 5.704 18.744 1.00 0.00 C ATOM 0 H THR A 124 4.058 8.401 15.331 1.00 0.00 H new ATOM 0 HA THR A 124 3.237 6.482 16.112 1.00 0.00 H new ATOM 0 HB THR A 124 3.236 7.837 18.760 1.00 0.00 H new ATOM 0 HG1 THR A 124 5.509 7.014 18.842 1.00 0.00 H new ATOM 0 HG21 THR A 124 3.961 5.635 19.687 1.00 0.00 H new ATOM 0 HG22 THR A 124 2.353 5.574 18.928 1.00 0.00 H new ATOM 0 HG23 THR A 124 3.768 4.924 18.067 1.00 0.00 H new ATOM 1916 N ALA A 125 0.844 6.774 15.634 1.00 0.00 N ATOM 1917 CA ALA A 125 -0.610 6.570 15.486 1.00 0.00 C ATOM 1918 C ALA A 125 -0.924 5.073 15.665 1.00 0.00 C ATOM 1919 O ALA A 125 -0.707 4.254 14.767 1.00 0.00 O ATOM 1920 CB ALA A 125 -0.979 7.183 14.134 1.00 0.00 C ATOM 0 H ALA A 125 1.375 6.590 14.783 1.00 0.00 H new ATOM 0 HA ALA A 125 -1.222 7.061 16.242 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -2.049 7.065 13.961 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -0.726 8.243 14.134 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -0.426 6.678 13.342 1.00 0.00 H new ATOM 1926 N ILE A 126 -1.397 4.732 16.873 1.00 0.00 N ATOM 1927 CA ILE A 126 -1.624 3.324 17.312 1.00 0.00 C ATOM 1928 C ILE A 126 -2.872 2.674 16.669 1.00 0.00 C ATOM 1929 O ILE A 126 -3.915 2.513 17.302 1.00 0.00 O ATOM 1930 CB ILE A 126 -1.528 3.318 18.878 1.00 0.00 C ATOM 1931 CG1 ILE A 126 -1.427 1.902 19.501 1.00 0.00 C ATOM 1932 CG2 ILE A 126 -2.625 4.096 19.634 1.00 0.00 C ATOM 1933 CD1 ILE A 126 -0.112 1.214 19.155 1.00 0.00 C ATOM 0 H ILE A 126 -1.638 5.421 17.586 1.00 0.00 H new ATOM 0 HA ILE A 126 -0.854 2.650 16.938 1.00 0.00 H new ATOM 0 HB ILE A 126 -0.590 3.855 19.019 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.523 1.976 20.584 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.258 1.292 19.148 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -2.452 4.019 20.707 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -2.598 5.144 19.337 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -3.601 3.675 19.393 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.087 0.225 19.613 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -0.027 1.115 18.073 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.720 1.809 19.531 1.00 0.00 H new ATOM 1945 N ARG A 127 -2.761 2.307 15.377 1.00 0.00 N ATOM 1946 CA ARG A 127 -3.957 2.015 14.554 1.00 0.00 C ATOM 1947 C ARG A 127 -4.523 0.591 14.816 1.00 0.00 C ATOM 1948 O ARG A 127 -3.796 -0.391 14.685 1.00 0.00 O ATOM 1949 CB ARG A 127 -3.677 2.068 13.032 1.00 0.00 C ATOM 1950 CG ARG A 127 -3.198 3.394 12.446 1.00 0.00 C ATOM 1951 CD ARG A 127 -2.913 3.289 10.938 1.00 0.00 C ATOM 1952 NE ARG A 127 -1.722 2.441 10.676 1.00 0.00 N ATOM 1953 CZ ARG A 127 -1.236 2.153 9.477 1.00 0.00 C ATOM 1954 NH1 ARG A 127 -1.685 2.682 8.368 1.00 0.00 N ATOM 1955 NH2 ARG A 127 -0.261 1.296 9.395 1.00 0.00 N ATOM 0 H ARG A 127 -1.873 2.206 14.885 1.00 0.00 H new ATOM 0 HA ARG A 127 -4.664 2.791 14.847 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -2.929 1.309 12.802 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -4.591 1.782 12.512 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -3.953 4.161 12.620 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -2.294 3.714 12.964 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -3.781 2.869 10.429 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -2.752 4.285 10.525 1.00 0.00 H new ATOM 0 HE ARG A 127 -1.239 2.049 11.484 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -2.450 3.356 8.398 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -1.270 2.421 7.474 1.00 0.00 H new ATOM 0 HH21 ARG A 127 0.111 0.864 10.241 1.00 0.00 H new ATOM 0 HH22 ARG A 127 0.132 1.056 8.485 1.00 0.00 H new ATOM 1969 N ASN A 128 -5.823 0.491 15.058 1.00 0.00 N ATOM 1970 CA ASN A 128 -6.536 -0.806 15.027 1.00 0.00 C ATOM 1971 C ASN A 128 -7.329 -0.950 13.683 1.00 0.00 C ATOM 1972 O ASN A 128 -7.959 0.002 13.215 1.00 0.00 O ATOM 1973 CB ASN A 128 -7.522 -0.847 16.216 1.00 0.00 C ATOM 1974 CG ASN A 128 -6.887 -1.093 17.576 1.00 0.00 C ATOM 1975 OD1 ASN A 128 -6.661 -0.184 18.364 1.00 0.00 O ATOM 1976 ND2 ASN A 128 -6.593 -2.324 17.917 1.00 0.00 N ATOM 0 H ASN A 128 -6.419 1.289 15.280 1.00 0.00 H new ATOM 0 HA ASN A 128 -5.820 -1.625 15.100 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -8.063 0.099 16.251 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -8.258 -1.629 16.030 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -6.181 -2.516 18.830 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -6.776 -3.090 17.269 1.00 0.00 H new ATOM 1983 N TYR A 129 -7.334 -2.157 13.108 1.00 0.00 N ATOM 1984 CA TYR A 129 -8.198 -2.504 11.953 1.00 0.00 C ATOM 1985 C TYR A 129 -8.911 -3.886 12.222 1.00 0.00 C ATOM 1986 O TYR A 129 -8.260 -4.855 12.616 1.00 0.00 O ATOM 1987 CB TYR A 129 -7.429 -2.673 10.619 1.00 0.00 C ATOM 1988 CG TYR A 129 -6.726 -1.474 9.982 1.00 0.00 C ATOM 1989 CD1 TYR A 129 -5.559 -0.927 10.541 1.00 0.00 C ATOM 1990 CD2 TYR A 129 -7.159 -0.994 8.739 1.00 0.00 C ATOM 1991 CE1 TYR A 129 -4.862 0.085 9.877 1.00 0.00 C ATOM 1992 CE2 TYR A 129 -6.456 0.015 8.078 1.00 0.00 C ATOM 1993 CZ TYR A 129 -5.304 0.549 8.642 1.00 0.00 C ATOM 1994 OH TYR A 129 -4.605 1.516 7.983 1.00 0.00 O ATOM 0 H TYR A 129 -6.743 -2.927 13.423 1.00 0.00 H new ATOM 0 HA TYR A 129 -8.894 -1.671 11.856 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -6.675 -3.445 10.775 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -8.135 -3.061 9.885 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -5.198 -1.292 11.491 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -8.047 -1.410 8.287 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -3.975 0.510 10.324 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -6.809 0.382 7.125 1.00 0.00 H new ATOM 0 HH TYR A 129 -4.719 1.401 7.016 1.00 0.00 H new ATOM 2004 N LYS A 130 -10.215 -3.998 11.922 1.00 0.00 N ATOM 2005 CA LYS A 130 -10.918 -5.306 12.026 1.00 0.00 C ATOM 2006 C LYS A 130 -10.759 -6.129 10.706 1.00 0.00 C ATOM 2007 O LYS A 130 -11.031 -5.640 9.605 1.00 0.00 O ATOM 2008 CB LYS A 130 -12.414 -5.143 12.384 1.00 0.00 C ATOM 2009 CG LYS A 130 -12.746 -4.670 13.811 1.00 0.00 C ATOM 2010 CD LYS A 130 -12.111 -5.423 14.989 1.00 0.00 C ATOM 2011 CE LYS A 130 -12.368 -6.934 15.102 1.00 0.00 C ATOM 2012 NZ LYS A 130 -13.753 -7.246 15.552 1.00 0.00 N ATOM 0 H LYS A 130 -10.801 -3.223 11.611 1.00 0.00 H new ATOM 0 HA LYS A 130 -10.448 -5.854 12.843 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -12.855 -4.435 11.682 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -12.907 -6.102 12.222 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -12.457 -3.622 13.891 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -13.828 -4.712 13.933 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -11.033 -5.270 14.941 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -12.458 -4.955 15.910 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -12.190 -7.403 14.134 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -11.655 -7.369 15.803 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.875 -8.277 15.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -13.918 -6.823 16.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -14.435 -6.856 14.871 1.00 0.00 H new ATOM 2026 N ARG A 131 -10.327 -7.382 10.870 1.00 0.00 N ATOM 2027 CA ARG A 131 -10.103 -8.332 9.755 1.00 0.00 C ATOM 2028 C ARG A 131 -11.425 -8.987 9.261 1.00 0.00 C ATOM 2029 O ARG A 131 -12.243 -9.471 10.048 1.00 0.00 O ATOM 2030 CB ARG A 131 -9.139 -9.391 10.328 1.00 0.00 C ATOM 2031 CG ARG A 131 -8.596 -10.433 9.319 1.00 0.00 C ATOM 2032 CD ARG A 131 -8.152 -11.666 10.113 1.00 0.00 C ATOM 2033 NE ARG A 131 -7.537 -12.708 9.277 1.00 0.00 N ATOM 2034 CZ ARG A 131 -6.978 -13.813 9.760 1.00 0.00 C ATOM 2035 NH1 ARG A 131 -6.904 -14.114 11.038 1.00 0.00 N ATOM 2036 NH2 ARG A 131 -6.461 -14.640 8.904 1.00 0.00 N ATOM 0 H ARG A 131 -10.118 -7.778 11.786 1.00 0.00 H new ATOM 0 HA ARG A 131 -9.695 -7.826 8.880 1.00 0.00 H new ATOM 0 HB2 ARG A 131 -8.291 -8.875 10.779 1.00 0.00 H new ATOM 0 HB3 ARG A 131 -9.651 -9.924 11.129 1.00 0.00 H new ATOM 0 HG2 ARG A 131 -9.366 -10.701 8.595 1.00 0.00 H new ATOM 0 HG3 ARG A 131 -7.759 -10.020 8.756 1.00 0.00 H new ATOM 0 HD2 ARG A 131 -7.441 -11.359 10.880 1.00 0.00 H new ATOM 0 HD3 ARG A 131 -9.015 -12.087 10.629 1.00 0.00 H new ATOM 0 HE ARG A 131 -7.540 -12.575 8.266 1.00 0.00 H new ATOM 0 HH11 ARG A 131 -7.292 -13.478 11.735 1.00 0.00 H new ATOM 0 HH12 ARG A 131 -6.459 -14.983 11.332 1.00 0.00 H new ATOM 0 HH21 ARG A 131 -6.494 -14.429 7.907 1.00 0.00 H new ATOM 0 HH22 ARG A 131 -6.021 -15.501 9.229 1.00 0.00 H new ATOM 2050 N LEU A 132 -11.588 -8.996 7.938 1.00 0.00 N ATOM 2051 CA LEU A 132 -12.860 -9.350 7.278 1.00 0.00 C ATOM 2052 C LEU A 132 -12.631 -10.385 6.121 1.00 0.00 C ATOM 2053 O LEU A 132 -11.661 -10.309 5.354 1.00 0.00 O ATOM 2054 CB LEU A 132 -13.496 -8.063 6.691 1.00 0.00 C ATOM 2055 CG LEU A 132 -13.919 -6.953 7.677 1.00 0.00 C ATOM 2056 CD1 LEU A 132 -14.618 -5.847 6.870 1.00 0.00 C ATOM 2057 CD2 LEU A 132 -14.837 -7.417 8.806 1.00 0.00 C ATOM 0 H LEU A 132 -10.842 -8.758 7.284 1.00 0.00 H new ATOM 0 HA LEU A 132 -13.521 -9.803 8.017 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -12.786 -7.631 5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -14.376 -8.356 6.119 1.00 0.00 H new ATOM 0 HG LEU A 132 -13.012 -6.601 8.169 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -14.929 -5.047 7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -13.928 -5.448 6.126 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -15.493 -6.260 6.369 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -15.081 -6.570 9.448 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -15.754 -7.829 8.384 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -14.332 -8.184 9.394 1.00 0.00 H new