USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 960 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 180 ASN : amide:sc= -0.901 X(o=-0.9,f=-0.75) USER MOD Set 1.2: A 183 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 150 HIS : no HD1:sc= -2.04 X(o=-1.8,f=-1.7) USER MOD Set 2.2: A 154 TYR OH : rot 160:sc= 0.28 USER MOD Single : A 70 THR OG1 : rot 37:sc= 0.2 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 GLN : amide:sc= 0.251 K(o=0.25,f=-0.42) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -0.358 X(o=-0.36,f=-0.16) USER MOD Single : A 103 TYR OH : rot -165:sc= -0.619 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -3.04 K(o=-3,f=-9.9!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 HIS : no HE2:sc= -2.28! C(o=-2.3!,f=-8!) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0.18) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= -0.169 USER MOD Single : A 128 SER OG : rot 180:sc= 0.00135 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 54:sc= 1.02 USER MOD Single : A 134 SER OG : rot -19:sc= 1.14 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ -110:sc= -0.177 (180deg=-0.979) USER MOD Single : A 140 HIS : no HD1:sc= -0.164 X(o=-0.16,f=-0.32) USER MOD Single : A 142 THR OG1 : rot -63:sc= -0.215! USER MOD Single : A 147 THR OG1 : rot -55:sc= -0.593 USER MOD Single : A 148 THR OG1 : rot 58:sc= -1.41 USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot 81:sc= -2.86 USER MOD Single : A 161 ASN : amide:sc= -0.496 X(o=-0.5,f=-0.55) USER MOD Single : A 164 HIS : no HD1:sc= -0.844 K(o=-0.84,f=-3.5!) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot -61:sc= 0.317 USER MOD Single : A 178 ASN : amide:sc= -0.228 K(o=-0.23,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 70 -43.675 -1.171 -8.411 1.00 0.00 N ATOM 2 CA THR A 70 -43.000 -1.742 -9.606 1.00 0.00 C ATOM 3 C THR A 70 -42.023 -0.743 -10.217 1.00 0.00 C ATOM 4 O THR A 70 -42.233 0.468 -10.147 1.00 0.00 O ATOM 5 CB THR A 70 -44.068 -2.129 -10.631 1.00 0.00 C ATOM 6 OG1 THR A 70 -45.055 -2.956 -10.038 1.00 0.00 O ATOM 7 CG2 THR A 70 -43.509 -2.866 -11.828 1.00 0.00 C ATOM 0 HA THR A 70 -42.428 -2.621 -9.308 1.00 0.00 H new ATOM 0 HB THR A 70 -44.496 -1.187 -10.973 1.00 0.00 H new ATOM 0 HG1 THR A 70 -45.222 -2.659 -9.119 1.00 0.00 H new ATOM 0 HG21 THR A 70 -44.319 -3.111 -12.515 1.00 0.00 H new ATOM 0 HG22 THR A 70 -42.780 -2.235 -12.336 1.00 0.00 H new ATOM 0 HG23 THR A 70 -43.025 -3.784 -11.496 1.00 0.00 H new ATOM 15 N ALA A 71 -40.955 -1.259 -10.816 1.00 0.00 N ATOM 16 CA ALA A 71 -39.945 -0.412 -11.439 1.00 0.00 C ATOM 17 C ALA A 71 -39.501 -0.983 -12.781 1.00 0.00 C ATOM 18 O ALA A 71 -38.699 -1.915 -12.834 1.00 0.00 O ATOM 19 CB ALA A 71 -38.750 -0.247 -10.512 1.00 0.00 C ATOM 0 H ALA A 71 -40.767 -2.259 -10.883 1.00 0.00 H new ATOM 0 HA ALA A 71 -40.389 0.567 -11.620 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -38.004 0.388 -10.990 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -39.074 0.214 -9.579 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -38.315 -1.224 -10.302 1.00 0.00 H new ATOM 25 N SER A 72 -40.028 -0.419 -13.863 1.00 0.00 N ATOM 26 CA SER A 72 -39.685 -0.872 -15.205 1.00 0.00 C ATOM 27 C SER A 72 -38.324 -0.331 -15.632 1.00 0.00 C ATOM 28 O SER A 72 -37.587 -0.989 -16.365 1.00 0.00 O ATOM 29 CB SER A 72 -40.757 -0.433 -16.203 1.00 0.00 C ATOM 30 OG SER A 72 -41.758 -1.426 -16.349 1.00 0.00 O ATOM 0 H SER A 72 -40.694 0.353 -13.836 1.00 0.00 H new ATOM 0 HA SER A 72 -39.634 -1.961 -15.192 1.00 0.00 H new ATOM 0 HB2 SER A 72 -41.212 0.499 -15.866 1.00 0.00 H new ATOM 0 HB3 SER A 72 -40.297 -0.232 -17.170 1.00 0.00 H new ATOM 0 HG SER A 72 -42.432 -1.119 -16.991 1.00 0.00 H new ATOM 36 N GLY A 73 -37.999 0.871 -15.168 1.00 0.00 N ATOM 37 CA GLY A 73 -36.728 1.479 -15.513 1.00 0.00 C ATOM 38 C GLY A 73 -36.313 2.554 -14.527 1.00 0.00 C ATOM 39 O GLY A 73 -37.084 3.469 -14.237 1.00 0.00 O ATOM 0 H GLY A 73 -38.593 1.434 -14.560 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -35.958 0.708 -15.551 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -36.795 1.912 -16.511 1.00 0.00 H new ATOM 43 N GLY A 74 -35.093 2.443 -14.011 1.00 0.00 N ATOM 44 CA GLY A 74 -34.598 3.420 -13.059 1.00 0.00 C ATOM 45 C GLY A 74 -33.314 4.081 -13.519 1.00 0.00 C ATOM 46 O GLY A 74 -32.508 3.466 -14.219 1.00 0.00 O ATOM 0 H GLY A 74 -34.438 1.694 -14.235 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -35.359 4.184 -12.899 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -34.428 2.933 -12.099 1.00 0.00 H new ATOM 50 N GLU A 75 -33.123 5.335 -13.127 1.00 0.00 N ATOM 51 CA GLU A 75 -31.927 6.081 -13.504 1.00 0.00 C ATOM 52 C GLU A 75 -31.058 6.369 -12.284 1.00 0.00 C ATOM 53 O GLU A 75 -31.562 6.745 -11.226 1.00 0.00 O ATOM 54 CB GLU A 75 -32.315 7.393 -14.190 1.00 0.00 C ATOM 55 CG GLU A 75 -31.379 7.787 -15.321 1.00 0.00 C ATOM 56 CD GLU A 75 -30.425 8.898 -14.929 1.00 0.00 C ATOM 57 OE1 GLU A 75 -29.454 8.615 -14.196 1.00 0.00 O ATOM 58 OE2 GLU A 75 -30.648 10.050 -15.356 1.00 0.00 O1- ATOM 0 H GLU A 75 -33.781 5.857 -12.548 1.00 0.00 H new ATOM 0 HA GLU A 75 -31.352 5.470 -14.200 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -33.328 7.303 -14.582 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -32.331 8.191 -13.448 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -30.806 6.914 -15.634 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -31.968 8.106 -16.181 1.00 0.00 H new ATOM 65 N ASN A 76 -29.751 6.190 -12.440 1.00 0.00 N ATOM 66 CA ASN A 76 -28.811 6.431 -11.351 1.00 0.00 C ATOM 67 C ASN A 76 -27.477 6.940 -11.886 1.00 0.00 C ATOM 68 O ASN A 76 -27.126 8.105 -11.700 1.00 0.00 O ATOM 69 CB ASN A 76 -28.596 5.150 -10.543 1.00 0.00 C ATOM 70 CG ASN A 76 -29.640 4.967 -9.460 1.00 0.00 C ATOM 71 OD1 ASN A 76 -30.624 4.251 -9.644 1.00 0.00 O ATOM 72 ND2 ASN A 76 -29.431 5.615 -8.319 1.00 0.00 N ATOM 0 H ASN A 76 -29.318 5.879 -13.310 1.00 0.00 H new ATOM 0 HA ASN A 76 -29.235 7.196 -10.700 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -28.619 4.292 -11.215 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -27.605 5.172 -10.089 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -30.100 5.529 -7.554 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -28.602 6.198 -8.208 1.00 0.00 H new ATOM 79 N GLU A 77 -26.737 6.057 -12.550 1.00 0.00 N ATOM 80 CA GLU A 77 -25.440 6.418 -13.111 1.00 0.00 C ATOM 81 C GLU A 77 -25.608 7.257 -14.375 1.00 0.00 C ATOM 82 O GLU A 77 -26.421 6.934 -15.241 1.00 0.00 O ATOM 83 CB GLU A 77 -24.630 5.159 -13.427 1.00 0.00 C ATOM 84 CG GLU A 77 -24.611 4.147 -12.294 1.00 0.00 C ATOM 85 CD GLU A 77 -24.389 2.728 -12.782 1.00 0.00 C ATOM 86 OE1 GLU A 77 -24.780 2.427 -13.929 1.00 0.00 O ATOM 87 OE2 GLU A 77 -23.824 1.918 -12.017 1.00 0.00 O1- ATOM 0 H GLU A 77 -27.013 5.089 -12.712 1.00 0.00 H new ATOM 0 HA GLU A 77 -24.904 7.012 -12.370 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -25.042 4.686 -14.318 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -23.605 5.446 -13.664 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -23.823 4.412 -11.589 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -25.555 4.197 -11.751 1.00 0.00 H new ATOM 94 N ARG A 78 -24.835 8.333 -14.472 1.00 0.00 N ATOM 95 CA ARG A 78 -24.901 9.216 -15.630 1.00 0.00 C ATOM 96 C ARG A 78 -23.503 9.526 -16.159 1.00 0.00 C ATOM 97 O ARG A 78 -23.078 8.981 -17.177 1.00 0.00 O ATOM 98 CB ARG A 78 -25.629 10.514 -15.269 1.00 0.00 C ATOM 99 CG ARG A 78 -25.708 11.510 -16.415 1.00 0.00 C ATOM 100 CD ARG A 78 -27.037 12.248 -16.422 1.00 0.00 C ATOM 101 NE ARG A 78 -27.417 12.679 -17.765 1.00 0.00 N ATOM 102 CZ ARG A 78 -27.702 11.841 -18.759 1.00 0.00 C ATOM 103 NH1 ARG A 78 -27.651 10.529 -18.566 1.00 0.00 N1+ ATOM 104 NH2 ARG A 78 -28.039 12.316 -19.950 1.00 0.00 N ATOM 0 H ARG A 78 -24.157 8.614 -13.764 1.00 0.00 H new ATOM 0 HA ARG A 78 -25.459 8.705 -16.415 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -26.639 10.273 -14.938 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -25.121 10.983 -14.426 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -24.892 12.228 -16.331 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -25.576 10.987 -17.362 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -27.814 11.600 -16.016 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -26.973 13.117 -15.767 1.00 0.00 H new ATOM 0 HE ARG A 78 -27.467 13.680 -17.952 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -27.392 10.158 -17.652 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -27.871 9.892 -19.332 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -28.080 13.323 -20.104 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -28.257 11.674 -20.712 1.00 0.00 H new ATOM 118 N GLU A 79 -22.794 10.402 -15.458 1.00 0.00 N ATOM 119 CA GLU A 79 -21.444 10.784 -15.850 1.00 0.00 C ATOM 120 C GLU A 79 -20.747 11.503 -14.705 1.00 0.00 C ATOM 121 O GLU A 79 -19.865 12.335 -14.922 1.00 0.00 O ATOM 122 CB GLU A 79 -21.483 11.682 -17.088 1.00 0.00 C ATOM 123 CG GLU A 79 -22.317 12.939 -16.903 1.00 0.00 C ATOM 124 CD GLU A 79 -23.119 13.294 -18.140 1.00 0.00 C ATOM 125 OE1 GLU A 79 -24.152 12.637 -18.386 1.00 0.00 O1- ATOM 126 OE2 GLU A 79 -22.713 14.229 -18.862 1.00 0.00 O ATOM 0 H GLU A 79 -23.133 10.862 -14.613 1.00 0.00 H new ATOM 0 HA GLU A 79 -20.884 9.880 -16.091 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -20.465 11.967 -17.351 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -21.882 11.112 -17.927 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -22.996 12.799 -16.062 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -21.661 13.772 -16.648 1.00 0.00 H new ATOM 133 N ASP A 80 -21.151 11.178 -13.481 1.00 0.00 N ATOM 134 CA ASP A 80 -20.568 11.794 -12.298 1.00 0.00 C ATOM 135 C ASP A 80 -20.579 10.827 -11.117 1.00 0.00 C ATOM 136 O ASP A 80 -19.580 10.682 -10.411 1.00 0.00 O ATOM 137 CB ASP A 80 -21.327 13.074 -11.937 1.00 0.00 C ATOM 138 CG ASP A 80 -20.428 14.295 -11.925 1.00 0.00 C ATOM 139 OD1 ASP A 80 -20.136 14.828 -13.016 1.00 0.00 O1- ATOM 140 OD2 ASP A 80 -20.015 14.718 -10.824 1.00 0.00 O ATOM 0 H ASP A 80 -21.880 10.492 -13.284 1.00 0.00 H new ATOM 0 HA ASP A 80 -19.532 12.047 -12.524 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -22.135 13.228 -12.652 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -21.788 12.956 -10.956 1.00 0.00 H new ATOM 145 N LEU A 81 -21.715 10.170 -10.907 1.00 0.00 N ATOM 146 CA LEU A 81 -21.861 9.218 -9.811 1.00 0.00 C ATOM 147 C LEU A 81 -20.770 8.150 -9.859 1.00 0.00 C ATOM 148 O LEU A 81 -20.399 7.584 -8.832 1.00 0.00 O ATOM 149 CB LEU A 81 -23.240 8.558 -9.866 1.00 0.00 C ATOM 150 CG LEU A 81 -24.339 9.289 -9.093 1.00 0.00 C ATOM 151 CD1 LEU A 81 -23.924 9.501 -7.646 1.00 0.00 C ATOM 152 CD2 LEU A 81 -24.661 10.619 -9.758 1.00 0.00 C ATOM 0 H LEU A 81 -22.550 10.280 -11.483 1.00 0.00 H new ATOM 0 HA LEU A 81 -21.761 9.765 -8.874 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -23.545 8.475 -10.909 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -23.156 7.543 -9.476 1.00 0.00 H new ATOM 0 HG LEU A 81 -25.237 8.672 -9.104 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -24.719 10.022 -7.112 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -23.743 8.535 -7.174 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -23.012 10.098 -7.613 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -25.445 11.127 -9.196 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -23.767 11.242 -9.777 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -25.002 10.443 -10.778 1.00 0.00 H new ATOM 164 N GLU A 82 -20.264 7.878 -11.058 1.00 0.00 N ATOM 165 CA GLU A 82 -19.219 6.876 -11.235 1.00 0.00 C ATOM 166 C GLU A 82 -17.899 7.527 -11.638 1.00 0.00 C ATOM 167 O GLU A 82 -17.797 8.144 -12.698 1.00 0.00 O ATOM 168 CB GLU A 82 -19.639 5.854 -12.293 1.00 0.00 C ATOM 169 CG GLU A 82 -19.152 4.443 -12.002 1.00 0.00 C ATOM 170 CD GLU A 82 -17.647 4.368 -11.843 1.00 0.00 C ATOM 171 OE1 GLU A 82 -16.934 4.503 -12.860 1.00 0.00 O1- ATOM 172 OE2 GLU A 82 -17.179 4.172 -10.701 1.00 0.00 O ATOM 0 H GLU A 82 -20.560 8.337 -11.920 1.00 0.00 H new ATOM 0 HA GLU A 82 -19.075 6.367 -10.282 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -20.726 5.846 -12.367 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -19.255 6.169 -13.263 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -19.629 4.078 -11.092 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -19.462 3.781 -12.811 1.00 0.00 H new ATOM 179 N GLN A 83 -16.889 7.380 -10.785 1.00 0.00 N ATOM 180 CA GLN A 83 -15.573 7.949 -11.052 1.00 0.00 C ATOM 181 C GLN A 83 -14.617 6.879 -11.566 1.00 0.00 C ATOM 182 O GLN A 83 -14.304 5.922 -10.859 1.00 0.00 O ATOM 183 CB GLN A 83 -15.006 8.592 -9.785 1.00 0.00 C ATOM 184 CG GLN A 83 -15.933 9.619 -9.155 1.00 0.00 C ATOM 185 CD GLN A 83 -15.978 10.919 -9.934 1.00 0.00 C ATOM 186 OE1 GLN A 83 -15.072 11.746 -9.837 1.00 0.00 O ATOM 187 NE2 GLN A 83 -17.038 11.107 -10.712 1.00 0.00 N ATOM 0 H GLN A 83 -16.957 6.872 -9.903 1.00 0.00 H new ATOM 0 HA GLN A 83 -15.682 8.715 -11.820 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -14.794 7.811 -9.055 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -14.057 9.071 -10.025 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -16.939 9.204 -9.090 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -15.605 9.822 -8.135 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -17.766 10.395 -10.763 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -17.124 11.964 -11.259 1.00 0.00 H new ATOM 196 N GLU A 84 -14.159 7.044 -12.803 1.00 0.00 N ATOM 197 CA GLU A 84 -13.242 6.086 -13.411 1.00 0.00 C ATOM 198 C GLU A 84 -11.881 6.721 -13.682 1.00 0.00 C ATOM 199 O GLU A 84 -11.772 7.679 -14.447 1.00 0.00 O ATOM 200 CB GLU A 84 -13.831 5.543 -14.714 1.00 0.00 C ATOM 201 CG GLU A 84 -13.229 4.217 -15.149 1.00 0.00 C ATOM 202 CD GLU A 84 -13.512 3.898 -16.603 1.00 0.00 C ATOM 203 OE1 GLU A 84 -14.461 4.482 -17.166 1.00 0.00 O1- ATOM 204 OE2 GLU A 84 -12.785 3.061 -17.180 1.00 0.00 O ATOM 0 H GLU A 84 -14.407 7.831 -13.403 1.00 0.00 H new ATOM 0 HA GLU A 84 -13.102 5.264 -12.709 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -14.907 5.421 -14.593 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.680 6.278 -15.505 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -12.151 4.242 -14.989 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.626 3.419 -14.522 1.00 0.00 H new ATOM 211 N TRP A 85 -10.845 6.175 -13.053 1.00 0.00 N ATOM 212 CA TRP A 85 -9.488 6.678 -13.230 1.00 0.00 C ATOM 213 C TRP A 85 -8.808 5.973 -14.404 1.00 0.00 C ATOM 214 O TRP A 85 -9.071 4.800 -14.671 1.00 0.00 O ATOM 215 CB TRP A 85 -8.682 6.487 -11.935 1.00 0.00 C ATOM 216 CG TRP A 85 -7.202 6.367 -12.148 1.00 0.00 C ATOM 217 CD1 TRP A 85 -6.384 7.270 -12.766 1.00 0.00 C ATOM 218 CD2 TRP A 85 -6.365 5.277 -11.749 1.00 0.00 C ATOM 219 NE1 TRP A 85 -5.091 6.803 -12.775 1.00 0.00 N ATOM 220 CE2 TRP A 85 -5.056 5.584 -12.162 1.00 0.00 C ATOM 221 CE3 TRP A 85 -6.591 4.069 -11.083 1.00 0.00 C ATOM 222 CZ2 TRP A 85 -3.985 4.732 -11.937 1.00 0.00 C ATOM 223 CZ3 TRP A 85 -5.519 3.227 -10.859 1.00 0.00 C ATOM 224 CH2 TRP A 85 -4.235 3.562 -11.287 1.00 0.00 C ATOM 0 H TRP A 85 -10.920 5.383 -12.415 1.00 0.00 H new ATOM 0 HA TRP A 85 -9.532 7.744 -13.454 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -8.876 7.330 -11.271 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.039 5.592 -11.426 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -6.706 8.212 -13.186 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -4.288 7.289 -13.175 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -7.583 3.800 -10.751 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -2.988 4.987 -12.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -5.678 2.292 -10.343 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -3.421 2.878 -11.099 1.00 0.00 H new ATOM 235 N LYS A 86 -7.942 6.697 -15.107 1.00 0.00 N ATOM 236 CA LYS A 86 -7.239 6.151 -16.251 1.00 0.00 C ATOM 237 C LYS A 86 -6.192 5.126 -15.816 1.00 0.00 C ATOM 238 O LYS A 86 -5.489 5.330 -14.828 1.00 0.00 O ATOM 239 CB LYS A 86 -6.571 7.274 -17.047 1.00 0.00 C ATOM 240 CG LYS A 86 -6.288 6.909 -18.495 1.00 0.00 C ATOM 241 CD LYS A 86 -5.989 8.141 -19.333 1.00 0.00 C ATOM 242 CE LYS A 86 -4.881 7.877 -20.339 1.00 0.00 C ATOM 243 NZ LYS A 86 -4.163 9.125 -20.717 1.00 0.00 N1+ ATOM 0 H LYS A 86 -7.713 7.669 -14.898 1.00 0.00 H new ATOM 0 HA LYS A 86 -7.968 5.647 -16.885 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.211 8.156 -17.022 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.635 7.546 -16.560 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.442 6.224 -18.540 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -7.146 6.383 -18.913 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.892 8.452 -19.858 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -5.700 8.965 -18.680 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -4.172 7.164 -19.919 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -5.304 7.417 -21.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -3.416 8.901 -21.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.834 9.797 -21.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -3.737 9.551 -19.869 1.00 0.00 H new ATOM 257 N PRO A 87 -6.073 4.004 -16.549 1.00 0.00 N ATOM 258 CA PRO A 87 -5.106 2.952 -16.223 1.00 0.00 C ATOM 259 C PRO A 87 -3.663 3.374 -16.509 1.00 0.00 C ATOM 260 O PRO A 87 -3.372 3.934 -17.565 1.00 0.00 O ATOM 261 CB PRO A 87 -5.515 1.799 -17.139 1.00 0.00 C ATOM 262 CG PRO A 87 -6.181 2.456 -18.299 1.00 0.00 C ATOM 263 CD PRO A 87 -6.871 3.673 -17.745 1.00 0.00 C ATOM 0 HA PRO A 87 -5.122 2.701 -15.163 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -4.649 1.219 -17.456 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -6.191 1.111 -16.632 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -5.453 2.733 -19.061 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -6.896 1.783 -18.771 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -6.878 4.493 -18.463 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -7.910 3.465 -17.490 1.00 0.00 H new ATOM 271 N PRO A 88 -2.738 3.105 -15.568 1.00 0.00 N ATOM 272 CA PRO A 88 -1.327 3.456 -15.723 1.00 0.00 C ATOM 273 C PRO A 88 -0.543 2.383 -16.474 1.00 0.00 C ATOM 274 O PRO A 88 -1.128 1.524 -17.132 1.00 0.00 O ATOM 275 CB PRO A 88 -0.857 3.554 -14.274 1.00 0.00 C ATOM 276 CG PRO A 88 -1.671 2.537 -13.549 1.00 0.00 C ATOM 277 CD PRO A 88 -2.993 2.440 -14.274 1.00 0.00 C ATOM 0 HA PRO A 88 -1.179 4.365 -16.306 1.00 0.00 H new ATOM 0 HB2 PRO A 88 0.209 3.344 -14.187 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -1.019 4.554 -13.871 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -1.164 1.572 -13.538 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -1.820 2.830 -12.510 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -3.298 1.403 -14.411 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -3.790 2.936 -13.720 1.00 0.00 H new ATOM 285 N ASP A 89 0.782 2.432 -16.364 1.00 0.00 N ATOM 286 CA ASP A 89 1.638 1.470 -17.019 1.00 0.00 C ATOM 287 C ASP A 89 2.442 0.694 -15.988 1.00 0.00 C ATOM 288 O ASP A 89 2.812 1.229 -14.943 1.00 0.00 O ATOM 289 CB ASP A 89 2.578 2.169 -18.003 1.00 0.00 C ATOM 290 CG ASP A 89 1.827 2.948 -19.066 1.00 0.00 C ATOM 291 OD1 ASP A 89 0.647 2.623 -19.317 1.00 0.00 O ATOM 292 OD2 ASP A 89 2.418 3.883 -19.645 1.00 0.00 O1- ATOM 0 H ASP A 89 1.281 3.137 -15.821 1.00 0.00 H new ATOM 0 HA ASP A 89 1.011 0.773 -17.575 1.00 0.00 H new ATOM 0 HB2 ASP A 89 3.234 2.846 -17.456 1.00 0.00 H new ATOM 0 HB3 ASP A 89 3.215 1.426 -18.483 1.00 0.00 H new ATOM 297 N GLU A 90 2.712 -0.568 -16.289 1.00 0.00 N ATOM 298 CA GLU A 90 3.473 -1.421 -15.395 1.00 0.00 C ATOM 299 C GLU A 90 4.793 -0.769 -14.997 1.00 0.00 C ATOM 300 O GLU A 90 5.381 -1.114 -13.974 1.00 0.00 O ATOM 301 CB GLU A 90 3.739 -2.767 -16.058 1.00 0.00 C ATOM 302 CG GLU A 90 4.102 -2.668 -17.532 1.00 0.00 C ATOM 303 CD GLU A 90 2.966 -3.088 -18.443 1.00 0.00 C ATOM 304 OE1 GLU A 90 2.827 -4.304 -18.696 1.00 0.00 O ATOM 305 OE2 GLU A 90 2.213 -2.204 -18.902 1.00 0.00 O1- ATOM 0 H GLU A 90 2.412 -1.024 -17.151 1.00 0.00 H new ATOM 0 HA GLU A 90 2.883 -1.572 -14.491 1.00 0.00 H new ATOM 0 HB2 GLU A 90 4.549 -3.268 -15.528 1.00 0.00 H new ATOM 0 HB3 GLU A 90 2.853 -3.394 -15.953 1.00 0.00 H new ATOM 0 HG2 GLU A 90 4.388 -1.642 -17.764 1.00 0.00 H new ATOM 0 HG3 GLU A 90 4.972 -3.294 -17.731 1.00 0.00 H new ATOM 312 N GLU A 91 5.252 0.183 -15.808 1.00 0.00 N ATOM 313 CA GLU A 91 6.497 0.885 -15.527 1.00 0.00 C ATOM 314 C GLU A 91 6.454 1.493 -14.134 1.00 0.00 C ATOM 315 O GLU A 91 7.337 1.261 -13.306 1.00 0.00 O ATOM 316 CB GLU A 91 6.728 1.986 -16.562 1.00 0.00 C ATOM 317 CG GLU A 91 6.641 1.499 -18.000 1.00 0.00 C ATOM 318 CD GLU A 91 7.116 2.539 -18.995 1.00 0.00 C ATOM 319 OE1 GLU A 91 7.910 3.419 -18.603 1.00 0.00 O ATOM 320 OE2 GLU A 91 6.692 2.474 -20.169 1.00 0.00 O1- ATOM 0 H GLU A 91 4.780 0.483 -16.661 1.00 0.00 H new ATOM 0 HA GLU A 91 7.318 0.169 -15.579 1.00 0.00 H new ATOM 0 HB2 GLU A 91 5.993 2.776 -16.410 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.710 2.429 -16.396 1.00 0.00 H new ATOM 0 HG2 GLU A 91 7.240 0.595 -18.111 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.610 1.228 -18.227 1.00 0.00 H new ATOM 327 N LEU A 92 5.408 2.268 -13.886 1.00 0.00 N ATOM 328 CA LEU A 92 5.226 2.912 -12.597 1.00 0.00 C ATOM 329 C LEU A 92 4.747 1.910 -11.551 1.00 0.00 C ATOM 330 O LEU A 92 4.940 2.112 -10.353 1.00 0.00 O ATOM 331 CB LEU A 92 4.235 4.066 -12.724 1.00 0.00 C ATOM 332 CG LEU A 92 4.256 5.079 -11.575 1.00 0.00 C ATOM 333 CD1 LEU A 92 3.633 4.481 -10.324 1.00 0.00 C ATOM 334 CD2 LEU A 92 5.679 5.542 -11.294 1.00 0.00 C ATOM 0 H LEU A 92 4.672 2.465 -14.564 1.00 0.00 H new ATOM 0 HA LEU A 92 6.188 3.307 -12.270 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.436 4.595 -13.656 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.230 3.652 -12.803 1.00 0.00 H new ATOM 0 HG LEU A 92 3.666 5.946 -11.872 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.657 5.215 -9.519 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.600 4.202 -10.530 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.195 3.596 -10.025 1.00 0.00 H new ATOM 0 HD21 LEU A 92 5.673 6.261 -10.475 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.293 4.684 -11.019 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.091 6.013 -12.187 1.00 0.00 H new ATOM 346 N ILE A 93 4.128 0.821 -12.006 1.00 0.00 N ATOM 347 CA ILE A 93 3.637 -0.204 -11.098 1.00 0.00 C ATOM 348 C ILE A 93 4.796 -0.935 -10.432 1.00 0.00 C ATOM 349 O ILE A 93 4.720 -1.301 -9.259 1.00 0.00 O ATOM 350 CB ILE A 93 2.740 -1.220 -11.830 1.00 0.00 C ATOM 351 CG1 ILE A 93 1.560 -0.498 -12.485 1.00 0.00 C ATOM 352 CG2 ILE A 93 2.247 -2.293 -10.870 1.00 0.00 C ATOM 353 CD1 ILE A 93 0.703 -1.397 -13.345 1.00 0.00 C ATOM 0 H ILE A 93 3.957 0.630 -12.993 1.00 0.00 H new ATOM 0 HA ILE A 93 3.042 0.297 -10.334 1.00 0.00 H new ATOM 0 HB ILE A 93 3.328 -1.709 -12.607 1.00 0.00 H new ATOM 0 HG12 ILE A 93 0.939 -0.054 -11.707 1.00 0.00 H new ATOM 0 HG13 ILE A 93 1.940 0.321 -13.096 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.615 -3.000 -11.408 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.101 -2.820 -10.444 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.671 -1.828 -10.069 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.113 -0.818 -13.776 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.310 -1.821 -14.145 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.293 -2.202 -12.735 1.00 0.00 H new ATOM 365 N LYS A 94 5.872 -1.134 -11.184 1.00 0.00 N ATOM 366 CA LYS A 94 7.050 -1.811 -10.659 1.00 0.00 C ATOM 367 C LYS A 94 7.787 -0.907 -9.679 1.00 0.00 C ATOM 368 O LYS A 94 8.368 -1.376 -8.700 1.00 0.00 O ATOM 369 CB LYS A 94 7.983 -2.224 -11.798 1.00 0.00 C ATOM 370 CG LYS A 94 7.420 -3.330 -12.675 1.00 0.00 C ATOM 371 CD LYS A 94 8.343 -3.642 -13.841 1.00 0.00 C ATOM 372 CE LYS A 94 7.806 -4.784 -14.688 1.00 0.00 C ATOM 373 NZ LYS A 94 8.330 -4.738 -16.081 1.00 0.00 N1+ ATOM 0 H LYS A 94 5.953 -0.837 -12.156 1.00 0.00 H new ATOM 0 HA LYS A 94 6.725 -2.709 -10.133 1.00 0.00 H new ATOM 0 HB2 LYS A 94 8.194 -1.352 -12.418 1.00 0.00 H new ATOM 0 HB3 LYS A 94 8.933 -2.554 -11.377 1.00 0.00 H new ATOM 0 HG2 LYS A 94 7.271 -4.229 -12.077 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.442 -3.033 -13.053 1.00 0.00 H new ATOM 0 HD2 LYS A 94 8.461 -2.753 -14.460 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.332 -3.902 -13.464 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.078 -5.735 -14.229 1.00 0.00 H new ATOM 0 HE3 LYS A 94 6.717 -4.740 -14.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 7.940 -5.534 -16.625 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.049 -3.842 -16.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 9.368 -4.806 -16.064 1.00 0.00 H new ATOM 387 N LYS A 95 7.749 0.397 -9.941 1.00 0.00 N ATOM 388 CA LYS A 95 8.405 1.366 -9.071 1.00 0.00 C ATOM 389 C LYS A 95 7.738 1.381 -7.699 1.00 0.00 C ATOM 390 O LYS A 95 8.395 1.191 -6.675 1.00 0.00 O ATOM 391 CB LYS A 95 8.353 2.762 -9.695 1.00 0.00 C ATOM 392 CG LYS A 95 9.548 3.079 -10.577 1.00 0.00 C ATOM 393 CD LYS A 95 10.720 3.602 -9.762 1.00 0.00 C ATOM 394 CE LYS A 95 12.043 3.059 -10.276 1.00 0.00 C ATOM 395 NZ LYS A 95 12.475 1.848 -9.526 1.00 0.00 N1+ ATOM 0 H LYS A 95 7.273 0.805 -10.746 1.00 0.00 H new ATOM 0 HA LYS A 95 9.448 1.074 -8.952 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.442 2.853 -10.286 1.00 0.00 H new ATOM 0 HB3 LYS A 95 8.292 3.504 -8.899 1.00 0.00 H new ATOM 0 HG2 LYS A 95 9.851 2.182 -11.117 1.00 0.00 H new ATOM 0 HG3 LYS A 95 9.264 3.820 -11.324 1.00 0.00 H new ATOM 0 HD2 LYS A 95 10.733 4.691 -9.800 1.00 0.00 H new ATOM 0 HD3 LYS A 95 10.592 3.321 -8.717 1.00 0.00 H new ATOM 0 HE2 LYS A 95 11.949 2.816 -11.334 1.00 0.00 H new ATOM 0 HE3 LYS A 95 12.809 3.830 -10.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 13.381 1.509 -9.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 12.589 2.085 -8.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 11.756 1.103 -9.626 1.00 0.00 H new ATOM 409 N LEU A 96 6.426 1.601 -7.689 1.00 0.00 N ATOM 410 CA LEU A 96 5.661 1.634 -6.447 1.00 0.00 C ATOM 411 C LEU A 96 5.857 0.346 -5.653 1.00 0.00 C ATOM 412 O LEU A 96 6.272 0.373 -4.493 1.00 0.00 O ATOM 413 CB LEU A 96 4.174 1.837 -6.750 1.00 0.00 C ATOM 414 CG LEU A 96 3.617 3.192 -6.341 1.00 0.00 C ATOM 415 CD1 LEU A 96 2.608 3.694 -7.363 1.00 0.00 C ATOM 416 CD2 LEU A 96 2.989 3.113 -4.960 1.00 0.00 C ATOM 0 H LEU A 96 5.870 1.759 -8.529 1.00 0.00 H new ATOM 0 HA LEU A 96 6.023 2.468 -5.846 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.014 1.703 -7.820 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.605 1.058 -6.242 1.00 0.00 H new ATOM 0 HG LEU A 96 4.442 3.904 -6.304 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.224 4.664 -7.049 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.093 3.793 -8.334 1.00 0.00 H new ATOM 0 HD13 LEU A 96 1.784 2.985 -7.439 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.595 4.091 -4.683 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.178 2.385 -4.970 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.743 2.806 -4.235 1.00 0.00 H new ATOM 428 N VAL A 97 5.555 -0.782 -6.286 1.00 0.00 N ATOM 429 CA VAL A 97 5.695 -2.083 -5.643 1.00 0.00 C ATOM 430 C VAL A 97 7.101 -2.269 -5.083 1.00 0.00 C ATOM 431 O VAL A 97 7.287 -2.884 -4.033 1.00 0.00 O ATOM 432 CB VAL A 97 5.380 -3.228 -6.625 1.00 0.00 C ATOM 433 CG1 VAL A 97 6.419 -3.291 -7.732 1.00 0.00 C ATOM 434 CG2 VAL A 97 5.295 -4.555 -5.887 1.00 0.00 C ATOM 0 H VAL A 97 5.211 -0.822 -7.245 1.00 0.00 H new ATOM 0 HA VAL A 97 4.978 -2.115 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 97 4.411 -3.029 -7.084 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.176 -4.107 -8.413 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.424 -2.349 -8.281 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.404 -3.462 -7.297 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.072 -5.352 -6.596 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.247 -4.761 -5.398 1.00 0.00 H new ATOM 0 HG23 VAL A 97 4.505 -4.505 -5.138 1.00 0.00 H new ATOM 444 N ASP A 98 8.089 -1.729 -5.791 1.00 0.00 N ATOM 445 CA ASP A 98 9.478 -1.830 -5.365 1.00 0.00 C ATOM 446 C ASP A 98 9.664 -1.200 -3.988 1.00 0.00 C ATOM 447 O ASP A 98 10.538 -1.605 -3.222 1.00 0.00 O ATOM 448 CB ASP A 98 10.397 -1.150 -6.383 1.00 0.00 C ATOM 449 CG ASP A 98 11.176 -2.148 -7.216 1.00 0.00 C ATOM 450 OD1 ASP A 98 11.769 -3.077 -6.628 1.00 0.00 O ATOM 451 OD2 ASP A 98 11.193 -2.003 -8.456 1.00 0.00 O1- ATOM 0 H ASP A 98 7.952 -1.217 -6.662 1.00 0.00 H new ATOM 0 HA ASP A 98 9.742 -2.886 -5.302 1.00 0.00 H new ATOM 0 HB2 ASP A 98 9.801 -0.518 -7.041 1.00 0.00 H new ATOM 0 HB3 ASP A 98 11.094 -0.496 -5.859 1.00 0.00 H new ATOM 456 N GLN A 99 8.833 -0.209 -3.680 1.00 0.00 N ATOM 457 CA GLN A 99 8.903 0.473 -2.395 1.00 0.00 C ATOM 458 C GLN A 99 8.392 -0.431 -1.277 1.00 0.00 C ATOM 459 O GLN A 99 8.945 -0.448 -0.178 1.00 0.00 O ATOM 460 CB GLN A 99 8.091 1.771 -2.436 1.00 0.00 C ATOM 461 CG GLN A 99 8.942 3.025 -2.324 1.00 0.00 C ATOM 462 CD GLN A 99 10.065 3.063 -3.343 1.00 0.00 C ATOM 463 OE1 GLN A 99 9.846 3.379 -4.512 1.00 0.00 O ATOM 464 NE2 GLN A 99 11.274 2.739 -2.903 1.00 0.00 N ATOM 0 H GLN A 99 8.104 0.139 -4.303 1.00 0.00 H new ATOM 0 HA GLN A 99 9.946 0.717 -2.194 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.526 1.807 -3.368 1.00 0.00 H new ATOM 0 HB3 GLN A 99 7.365 1.761 -1.623 1.00 0.00 H new ATOM 0 HG2 GLN A 99 8.308 3.902 -2.455 1.00 0.00 H new ATOM 0 HG3 GLN A 99 9.365 3.084 -1.321 1.00 0.00 H new ATOM 0 HE21 GLN A 99 11.409 2.483 -1.925 1.00 0.00 H new ATOM 0 HE22 GLN A 99 12.068 2.746 -3.543 1.00 0.00 H new ATOM 473 N ILE A 100 7.333 -1.183 -1.567 1.00 0.00 N ATOM 474 CA ILE A 100 6.751 -2.088 -0.587 1.00 0.00 C ATOM 475 C ILE A 100 7.703 -3.220 -0.266 1.00 0.00 C ATOM 476 O ILE A 100 8.173 -3.356 0.863 1.00 0.00 O ATOM 477 CB ILE A 100 5.427 -2.696 -1.086 1.00 0.00 C ATOM 478 CG1 ILE A 100 4.622 -1.681 -1.901 1.00 0.00 C ATOM 479 CG2 ILE A 100 4.611 -3.187 0.092 1.00 0.00 C ATOM 480 CD1 ILE A 100 4.505 -0.333 -1.231 1.00 0.00 C ATOM 0 H ILE A 100 6.863 -1.182 -2.472 1.00 0.00 H new ATOM 0 HA ILE A 100 6.558 -1.495 0.307 1.00 0.00 H new ATOM 0 HB ILE A 100 5.662 -3.537 -1.738 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.092 -1.554 -2.876 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.623 -2.079 -2.078 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.676 -3.616 -0.267 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.175 -3.947 0.634 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.395 -2.352 0.758 1.00 0.00 H new ATOM 0 HD11 ILE A 100 3.923 0.338 -1.862 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.008 -0.447 -0.268 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.500 0.085 -1.078 1.00 0.00 H new ATOM 492 N GLU A 101 8.002 -4.023 -1.277 1.00 0.00 N ATOM 493 CA GLU A 101 8.924 -5.143 -1.110 1.00 0.00 C ATOM 494 C GLU A 101 10.200 -4.674 -0.417 1.00 0.00 C ATOM 495 O GLU A 101 10.904 -5.458 0.220 1.00 0.00 O ATOM 496 CB GLU A 101 9.259 -5.768 -2.465 1.00 0.00 C ATOM 497 CG GLU A 101 10.145 -6.998 -2.366 1.00 0.00 C ATOM 498 CD GLU A 101 11.091 -7.134 -3.543 1.00 0.00 C ATOM 499 OE1 GLU A 101 11.827 -6.165 -3.827 1.00 0.00 O1- ATOM 500 OE2 GLU A 101 11.096 -8.208 -4.181 1.00 0.00 O ATOM 0 H GLU A 101 7.623 -3.923 -2.219 1.00 0.00 H new ATOM 0 HA GLU A 101 8.443 -5.899 -0.490 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.332 -6.038 -2.970 1.00 0.00 H new ATOM 0 HB3 GLU A 101 9.755 -5.023 -3.087 1.00 0.00 H new ATOM 0 HG2 GLU A 101 10.724 -6.951 -1.444 1.00 0.00 H new ATOM 0 HG3 GLU A 101 9.519 -7.888 -2.304 1.00 0.00 H new ATOM 507 N PHE A 102 10.473 -3.378 -0.536 1.00 0.00 N ATOM 508 CA PHE A 102 11.640 -2.771 0.085 1.00 0.00 C ATOM 509 C PHE A 102 11.316 -2.397 1.525 1.00 0.00 C ATOM 510 O PHE A 102 12.103 -2.626 2.443 1.00 0.00 O ATOM 511 CB PHE A 102 12.048 -1.525 -0.706 1.00 0.00 C ATOM 512 CG PHE A 102 12.924 -0.564 0.051 1.00 0.00 C ATOM 513 CD1 PHE A 102 12.372 0.320 0.965 1.00 0.00 C ATOM 514 CD2 PHE A 102 14.293 -0.543 -0.156 1.00 0.00 C ATOM 515 CE1 PHE A 102 13.171 1.207 1.660 1.00 0.00 C ATOM 516 CE2 PHE A 102 15.097 0.344 0.536 1.00 0.00 C ATOM 517 CZ PHE A 102 14.536 1.219 1.445 1.00 0.00 C ATOM 0 H PHE A 102 9.894 -2.724 -1.063 1.00 0.00 H new ATOM 0 HA PHE A 102 12.467 -3.481 0.083 1.00 0.00 H new ATOM 0 HB2 PHE A 102 12.571 -1.839 -1.609 1.00 0.00 H new ATOM 0 HB3 PHE A 102 11.147 -1.001 -1.025 1.00 0.00 H new ATOM 0 HD1 PHE A 102 11.306 0.315 1.136 1.00 0.00 H new ATOM 0 HD2 PHE A 102 14.737 -1.226 -0.865 1.00 0.00 H new ATOM 0 HE1 PHE A 102 12.729 1.890 2.370 1.00 0.00 H new ATOM 0 HE2 PHE A 102 16.163 0.352 0.366 1.00 0.00 H new ATOM 0 HZ PHE A 102 15.163 1.912 1.987 1.00 0.00 H new ATOM 527 N TYR A 103 10.142 -1.814 1.693 1.00 0.00 N ATOM 528 CA TYR A 103 9.661 -1.381 2.996 1.00 0.00 C ATOM 529 C TYR A 103 9.653 -2.535 3.993 1.00 0.00 C ATOM 530 O TYR A 103 10.230 -2.444 5.076 1.00 0.00 O ATOM 531 CB TYR A 103 8.247 -0.802 2.852 1.00 0.00 C ATOM 532 CG TYR A 103 7.190 -1.568 3.623 1.00 0.00 C ATOM 533 CD1 TYR A 103 7.046 -1.380 4.988 1.00 0.00 C ATOM 534 CD2 TYR A 103 6.348 -2.482 2.994 1.00 0.00 C ATOM 535 CE1 TYR A 103 6.098 -2.071 5.710 1.00 0.00 C ATOM 536 CE2 TYR A 103 5.393 -3.179 3.710 1.00 0.00 C ATOM 537 CZ TYR A 103 5.272 -2.970 5.069 1.00 0.00 C ATOM 538 OH TYR A 103 4.324 -3.663 5.787 1.00 0.00 O ATOM 0 H TYR A 103 9.493 -1.626 0.929 1.00 0.00 H new ATOM 0 HA TYR A 103 10.336 -0.614 3.376 1.00 0.00 H new ATOM 0 HB2 TYR A 103 8.252 0.234 3.192 1.00 0.00 H new ATOM 0 HB3 TYR A 103 7.976 -0.789 1.796 1.00 0.00 H new ATOM 0 HD1 TYR A 103 7.690 -0.678 5.496 1.00 0.00 H new ATOM 0 HD2 TYR A 103 6.443 -2.649 1.931 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.002 -1.909 6.774 1.00 0.00 H new ATOM 0 HE2 TYR A 103 4.745 -3.883 3.209 1.00 0.00 H new ATOM 0 HH TYR A 103 3.994 -4.415 5.252 1.00 0.00 H new ATOM 548 N PHE A 104 8.956 -3.605 3.630 1.00 0.00 N ATOM 549 CA PHE A 104 8.828 -4.765 4.503 1.00 0.00 C ATOM 550 C PHE A 104 10.128 -5.564 4.628 1.00 0.00 C ATOM 551 O PHE A 104 10.162 -6.587 5.312 1.00 0.00 O ATOM 552 CB PHE A 104 7.689 -5.673 4.015 1.00 0.00 C ATOM 553 CG PHE A 104 8.136 -6.807 3.130 1.00 0.00 C ATOM 554 CD1 PHE A 104 8.776 -6.555 1.928 1.00 0.00 C ATOM 555 CD2 PHE A 104 7.919 -8.123 3.506 1.00 0.00 C ATOM 556 CE1 PHE A 104 9.190 -7.595 1.116 1.00 0.00 C ATOM 557 CE2 PHE A 104 8.330 -9.167 2.699 1.00 0.00 C ATOM 558 CZ PHE A 104 8.966 -8.902 1.503 1.00 0.00 C ATOM 0 H PHE A 104 8.471 -3.693 2.737 1.00 0.00 H new ATOM 0 HA PHE A 104 8.595 -4.387 5.498 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.173 -6.086 4.882 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.965 -5.067 3.471 1.00 0.00 H new ATOM 0 HD1 PHE A 104 8.954 -5.535 1.621 1.00 0.00 H new ATOM 0 HD2 PHE A 104 7.423 -8.335 4.441 1.00 0.00 H new ATOM 0 HE1 PHE A 104 9.688 -7.386 0.181 1.00 0.00 H new ATOM 0 HE2 PHE A 104 8.154 -10.188 3.004 1.00 0.00 H new ATOM 0 HZ PHE A 104 9.288 -9.716 0.870 1.00 0.00 H new ATOM 568 N SER A 105 11.199 -5.100 3.994 1.00 0.00 N ATOM 569 CA SER A 105 12.477 -5.799 4.088 1.00 0.00 C ATOM 570 C SER A 105 12.924 -5.880 5.547 1.00 0.00 C ATOM 571 O SER A 105 12.770 -4.920 6.300 1.00 0.00 O ATOM 572 CB SER A 105 13.542 -5.087 3.251 1.00 0.00 C ATOM 573 OG SER A 105 14.523 -5.999 2.790 1.00 0.00 O ATOM 0 H SER A 105 11.211 -4.258 3.419 1.00 0.00 H new ATOM 0 HA SER A 105 12.349 -6.809 3.699 1.00 0.00 H new ATOM 0 HB2 SER A 105 13.071 -4.594 2.400 1.00 0.00 H new ATOM 0 HB3 SER A 105 14.017 -4.308 3.848 1.00 0.00 H new ATOM 0 HG SER A 105 15.191 -5.519 2.257 1.00 0.00 H new ATOM 579 N ASP A 106 13.469 -7.031 5.944 1.00 0.00 N ATOM 580 CA ASP A 106 13.932 -7.242 7.324 1.00 0.00 C ATOM 581 C ASP A 106 14.601 -5.990 7.895 1.00 0.00 C ATOM 582 O ASP A 106 14.143 -5.411 8.884 1.00 0.00 O ATOM 583 CB ASP A 106 14.930 -8.405 7.379 1.00 0.00 C ATOM 584 CG ASP A 106 15.773 -8.519 6.121 1.00 0.00 C ATOM 585 OD1 ASP A 106 15.196 -8.744 5.037 1.00 0.00 O1- ATOM 586 OD2 ASP A 106 17.012 -8.382 6.223 1.00 0.00 O ATOM 0 H ASP A 106 13.602 -7.835 5.331 1.00 0.00 H new ATOM 0 HA ASP A 106 13.053 -7.473 7.926 1.00 0.00 H new ATOM 0 HB2 ASP A 106 15.586 -8.274 8.240 1.00 0.00 H new ATOM 0 HB3 ASP A 106 14.386 -9.337 7.532 1.00 0.00 H new ATOM 591 N GLU A 107 15.696 -5.589 7.260 1.00 0.00 N ATOM 592 CA GLU A 107 16.461 -4.419 7.678 1.00 0.00 C ATOM 593 C GLU A 107 15.655 -3.135 7.546 1.00 0.00 C ATOM 594 O GLU A 107 16.007 -2.105 8.120 1.00 0.00 O ATOM 595 CB GLU A 107 17.716 -4.303 6.826 1.00 0.00 C ATOM 596 CG GLU A 107 18.662 -5.476 6.987 1.00 0.00 C ATOM 597 CD GLU A 107 19.404 -5.452 8.308 1.00 0.00 C ATOM 598 OE1 GLU A 107 20.322 -4.618 8.459 1.00 0.00 O ATOM 599 OE2 GLU A 107 19.068 -6.267 9.193 1.00 0.00 O1- ATOM 0 H GLU A 107 16.078 -6.064 6.442 1.00 0.00 H new ATOM 0 HA GLU A 107 16.719 -4.552 8.729 1.00 0.00 H new ATOM 0 HB2 GLU A 107 17.428 -4.219 5.778 1.00 0.00 H new ATOM 0 HB3 GLU A 107 18.240 -3.384 7.088 1.00 0.00 H new ATOM 0 HG2 GLU A 107 18.098 -6.406 6.909 1.00 0.00 H new ATOM 0 HG3 GLU A 107 19.383 -5.471 6.170 1.00 0.00 H new ATOM 606 N ASN A 108 14.581 -3.202 6.782 1.00 0.00 N ATOM 607 CA ASN A 108 13.729 -2.044 6.562 1.00 0.00 C ATOM 608 C ASN A 108 12.645 -1.965 7.625 1.00 0.00 C ATOM 609 O ASN A 108 12.058 -0.910 7.843 1.00 0.00 O ATOM 610 CB ASN A 108 13.108 -2.092 5.167 1.00 0.00 C ATOM 611 CG ASN A 108 14.049 -1.555 4.105 1.00 0.00 C ATOM 612 OD1 ASN A 108 14.421 -2.262 3.169 1.00 0.00 O ATOM 613 ND2 ASN A 108 14.442 -0.295 4.249 1.00 0.00 N ATOM 0 H ASN A 108 14.276 -4.048 6.301 1.00 0.00 H new ATOM 0 HA ASN A 108 14.345 -1.148 6.634 1.00 0.00 H new ATOM 0 HB2 ASN A 108 12.839 -3.120 4.926 1.00 0.00 H new ATOM 0 HB3 ASN A 108 12.186 -1.511 5.161 1.00 0.00 H new ATOM 0 HD21 ASN A 108 15.077 0.122 3.568 1.00 0.00 H new ATOM 0 HD22 ASN A 108 14.109 0.256 5.040 1.00 0.00 H new ATOM 620 N LEU A 109 12.401 -3.082 8.299 1.00 0.00 N ATOM 621 CA LEU A 109 11.416 -3.136 9.350 1.00 0.00 C ATOM 622 C LEU A 109 11.923 -2.380 10.554 1.00 0.00 C ATOM 623 O LEU A 109 11.264 -1.475 11.065 1.00 0.00 O ATOM 624 CB LEU A 109 11.161 -4.578 9.713 1.00 0.00 C ATOM 625 CG LEU A 109 10.069 -5.253 8.905 1.00 0.00 C ATOM 626 CD1 LEU A 109 8.769 -5.216 9.683 1.00 0.00 C ATOM 627 CD2 LEU A 109 9.887 -4.595 7.550 1.00 0.00 C ATOM 0 H LEU A 109 12.881 -3.965 8.128 1.00 0.00 H new ATOM 0 HA LEU A 109 10.486 -2.679 9.012 1.00 0.00 H new ATOM 0 HB2 LEU A 109 12.087 -5.139 9.587 1.00 0.00 H new ATOM 0 HB3 LEU A 109 10.898 -4.631 10.769 1.00 0.00 H new ATOM 0 HG LEU A 109 10.364 -6.287 8.730 1.00 0.00 H new ATOM 0 HD11 LEU A 109 7.984 -5.701 9.103 1.00 0.00 H new ATOM 0 HD12 LEU A 109 8.897 -5.740 10.630 1.00 0.00 H new ATOM 0 HD13 LEU A 109 8.490 -4.180 9.876 1.00 0.00 H new ATOM 0 HD21 LEU A 109 9.096 -5.106 7.001 1.00 0.00 H new ATOM 0 HD22 LEU A 109 9.615 -3.548 7.687 1.00 0.00 H new ATOM 0 HD23 LEU A 109 10.818 -4.657 6.987 1.00 0.00 H new ATOM 639 N GLU A 110 13.127 -2.741 10.981 1.00 0.00 N ATOM 640 CA GLU A 110 13.769 -2.094 12.095 1.00 0.00 C ATOM 641 C GLU A 110 13.767 -0.576 11.910 1.00 0.00 C ATOM 642 O GLU A 110 13.992 0.178 12.856 1.00 0.00 O ATOM 643 CB GLU A 110 15.203 -2.601 12.201 1.00 0.00 C ATOM 644 CG GLU A 110 15.460 -3.437 13.438 1.00 0.00 C ATOM 645 CD GLU A 110 15.749 -2.597 14.665 1.00 0.00 C ATOM 646 OE1 GLU A 110 15.185 -1.487 14.772 1.00 0.00 O1- ATOM 647 OE2 GLU A 110 16.540 -3.047 15.520 1.00 0.00 O ATOM 0 H GLU A 110 13.676 -3.490 10.559 1.00 0.00 H new ATOM 0 HA GLU A 110 13.223 -2.327 13.009 1.00 0.00 H new ATOM 0 HB2 GLU A 110 15.436 -3.194 11.317 1.00 0.00 H new ATOM 0 HB3 GLU A 110 15.882 -1.748 12.201 1.00 0.00 H new ATOM 0 HG2 GLU A 110 14.592 -4.068 13.631 1.00 0.00 H new ATOM 0 HG3 GLU A 110 16.303 -4.103 13.252 1.00 0.00 H new ATOM 654 N LYS A 111 13.534 -0.142 10.670 1.00 0.00 N ATOM 655 CA LYS A 111 13.529 1.270 10.334 1.00 0.00 C ATOM 656 C LYS A 111 12.160 1.742 9.838 1.00 0.00 C ATOM 657 O LYS A 111 11.909 2.944 9.753 1.00 0.00 O ATOM 658 CB LYS A 111 14.577 1.519 9.254 1.00 0.00 C ATOM 659 CG LYS A 111 15.949 1.858 9.809 1.00 0.00 C ATOM 660 CD LYS A 111 15.935 3.174 10.571 1.00 0.00 C ATOM 661 CE LYS A 111 15.881 2.947 12.072 1.00 0.00 C ATOM 662 NZ LYS A 111 15.009 3.943 12.753 1.00 0.00 N1+ ATOM 0 H LYS A 111 13.346 -0.760 9.881 1.00 0.00 H new ATOM 0 HA LYS A 111 13.759 1.835 11.237 1.00 0.00 H new ATOM 0 HB2 LYS A 111 14.657 0.632 8.625 1.00 0.00 H new ATOM 0 HB3 LYS A 111 14.241 2.335 8.614 1.00 0.00 H new ATOM 0 HG2 LYS A 111 16.283 1.058 10.470 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.668 1.918 8.992 1.00 0.00 H new ATOM 0 HD2 LYS A 111 16.826 3.750 10.321 1.00 0.00 H new ATOM 0 HD3 LYS A 111 15.075 3.767 10.260 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.511 1.942 12.274 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.888 3.004 12.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 14.999 3.754 13.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.376 4.901 12.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.042 3.871 12.378 1.00 0.00 H new ATOM 676 N ASP A 112 11.288 0.802 9.483 1.00 0.00 N ATOM 677 CA ASP A 112 9.968 1.151 8.966 1.00 0.00 C ATOM 678 C ASP A 112 8.859 0.808 9.945 1.00 0.00 C ATOM 679 O ASP A 112 7.979 -0.005 9.660 1.00 0.00 O ATOM 680 CB ASP A 112 9.728 0.447 7.643 1.00 0.00 C ATOM 681 CG ASP A 112 8.533 1.001 6.899 1.00 0.00 C ATOM 682 OD1 ASP A 112 7.459 1.143 7.522 1.00 0.00 O ATOM 683 OD2 ASP A 112 8.669 1.296 5.694 1.00 0.00 O1- ATOM 0 H ASP A 112 11.469 -0.200 9.543 1.00 0.00 H new ATOM 0 HA ASP A 112 9.950 2.231 8.818 1.00 0.00 H new ATOM 0 HB2 ASP A 112 10.616 0.542 7.019 1.00 0.00 H new ATOM 0 HB3 ASP A 112 9.578 -0.617 7.824 1.00 0.00 H new ATOM 688 N ALA A 113 8.904 1.452 11.091 1.00 0.00 N ATOM 689 CA ALA A 113 7.899 1.248 12.127 1.00 0.00 C ATOM 690 C ALA A 113 6.621 2.032 11.822 1.00 0.00 C ATOM 691 O ALA A 113 5.621 1.898 12.526 1.00 0.00 O ATOM 692 CB ALA A 113 8.456 1.644 13.485 1.00 0.00 C ATOM 0 H ALA A 113 9.629 2.127 11.336 1.00 0.00 H new ATOM 0 HA ALA A 113 7.643 0.189 12.146 1.00 0.00 H new ATOM 0 HB1 ALA A 113 7.696 1.487 14.250 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.330 1.034 13.712 1.00 0.00 H new ATOM 0 HB3 ALA A 113 8.742 2.696 13.468 1.00 0.00 H new ATOM 698 N PHE A 114 6.661 2.857 10.775 1.00 0.00 N ATOM 699 CA PHE A 114 5.506 3.667 10.391 1.00 0.00 C ATOM 700 C PHE A 114 4.501 2.861 9.568 1.00 0.00 C ATOM 701 O PHE A 114 3.291 3.017 9.728 1.00 0.00 O ATOM 702 CB PHE A 114 5.961 4.894 9.593 1.00 0.00 C ATOM 703 CG PHE A 114 6.908 4.563 8.472 1.00 0.00 C ATOM 704 CD1 PHE A 114 6.453 3.923 7.330 1.00 0.00 C ATOM 705 CD2 PHE A 114 8.253 4.882 8.566 1.00 0.00 C ATOM 706 CE1 PHE A 114 7.319 3.606 6.304 1.00 0.00 C ATOM 707 CE2 PHE A 114 9.126 4.568 7.542 1.00 0.00 C ATOM 708 CZ PHE A 114 8.660 3.927 6.410 1.00 0.00 C ATOM 0 H PHE A 114 7.479 2.981 10.179 1.00 0.00 H new ATOM 0 HA PHE A 114 5.012 3.990 11.307 1.00 0.00 H new ATOM 0 HB2 PHE A 114 5.085 5.396 9.182 1.00 0.00 H new ATOM 0 HB3 PHE A 114 6.444 5.599 10.270 1.00 0.00 H new ATOM 0 HD1 PHE A 114 5.407 3.669 7.242 1.00 0.00 H new ATOM 0 HD2 PHE A 114 8.623 5.381 9.449 1.00 0.00 H new ATOM 0 HE1 PHE A 114 6.950 3.108 5.419 1.00 0.00 H new ATOM 0 HE2 PHE A 114 10.172 4.823 7.626 1.00 0.00 H new ATOM 0 HZ PHE A 114 9.341 3.677 5.610 1.00 0.00 H new ATOM 718 N LEU A 115 5.008 2.013 8.678 1.00 0.00 N ATOM 719 CA LEU A 115 4.153 1.199 7.821 1.00 0.00 C ATOM 720 C LEU A 115 3.709 -0.072 8.540 1.00 0.00 C ATOM 721 O LEU A 115 2.643 -0.617 8.255 1.00 0.00 O ATOM 722 CB LEU A 115 4.887 0.849 6.521 1.00 0.00 C ATOM 723 CG LEU A 115 3.988 0.485 5.332 1.00 0.00 C ATOM 724 CD1 LEU A 115 2.973 1.589 5.067 1.00 0.00 C ATOM 725 CD2 LEU A 115 4.825 0.219 4.082 1.00 0.00 C ATOM 0 H LEU A 115 6.008 1.872 8.532 1.00 0.00 H new ATOM 0 HA LEU A 115 3.262 1.778 7.578 1.00 0.00 H new ATOM 0 HB2 LEU A 115 5.510 1.697 6.237 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.557 0.012 6.717 1.00 0.00 H new ATOM 0 HG LEU A 115 3.447 -0.427 5.584 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.346 1.311 4.220 1.00 0.00 H new ATOM 0 HD12 LEU A 115 2.349 1.729 5.950 1.00 0.00 H new ATOM 0 HD13 LEU A 115 3.497 2.518 4.841 1.00 0.00 H new ATOM 0 HD21 LEU A 115 4.167 -0.037 3.251 1.00 0.00 H new ATOM 0 HD22 LEU A 115 5.397 1.112 3.830 1.00 0.00 H new ATOM 0 HD23 LEU A 115 5.509 -0.608 4.271 1.00 0.00 H new ATOM 737 N LEU A 116 4.533 -0.538 9.475 1.00 0.00 N ATOM 738 CA LEU A 116 4.224 -1.745 10.234 1.00 0.00 C ATOM 739 C LEU A 116 3.307 -1.435 11.414 1.00 0.00 C ATOM 740 O LEU A 116 2.187 -1.940 11.490 1.00 0.00 O ATOM 741 CB LEU A 116 5.514 -2.403 10.729 1.00 0.00 C ATOM 742 CG LEU A 116 5.750 -3.824 10.217 1.00 0.00 C ATOM 743 CD1 LEU A 116 4.666 -4.762 10.727 1.00 0.00 C ATOM 744 CD2 LEU A 116 5.799 -3.841 8.696 1.00 0.00 C ATOM 0 H LEU A 116 5.419 -0.098 9.725 1.00 0.00 H new ATOM 0 HA LEU A 116 3.702 -2.435 9.571 1.00 0.00 H new ATOM 0 HB2 LEU A 116 6.359 -1.781 10.433 1.00 0.00 H new ATOM 0 HB3 LEU A 116 5.499 -2.423 11.819 1.00 0.00 H new ATOM 0 HG LEU A 116 6.711 -4.172 10.596 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.850 -5.769 10.352 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.677 -4.773 11.817 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.693 -4.417 10.378 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.968 -4.860 8.349 1.00 0.00 H new ATOM 0 HD22 LEU A 116 4.853 -3.474 8.297 1.00 0.00 H new ATOM 0 HD23 LEU A 116 6.611 -3.201 8.351 1.00 0.00 H new ATOM 756 N LYS A 117 3.791 -0.608 12.337 1.00 0.00 N ATOM 757 CA LYS A 117 3.014 -0.238 13.518 1.00 0.00 C ATOM 758 C LYS A 117 1.650 0.326 13.130 1.00 0.00 C ATOM 759 O LYS A 117 0.692 0.237 13.900 1.00 0.00 O ATOM 760 CB LYS A 117 3.779 0.784 14.361 1.00 0.00 C ATOM 761 CG LYS A 117 5.186 0.342 14.726 1.00 0.00 C ATOM 762 CD LYS A 117 5.246 -0.219 16.138 1.00 0.00 C ATOM 763 CE LYS A 117 4.967 -1.713 16.156 1.00 0.00 C ATOM 764 NZ LYS A 117 4.393 -2.156 17.457 1.00 0.00 N1+ ATOM 0 H LYS A 117 4.716 -0.181 12.291 1.00 0.00 H new ATOM 0 HA LYS A 117 2.855 -1.141 14.107 1.00 0.00 H new ATOM 0 HB2 LYS A 117 3.834 1.725 13.814 1.00 0.00 H new ATOM 0 HB3 LYS A 117 3.220 0.979 15.276 1.00 0.00 H new ATOM 0 HG2 LYS A 117 5.526 -0.414 14.018 1.00 0.00 H new ATOM 0 HG3 LYS A 117 5.868 1.188 14.640 1.00 0.00 H new ATOM 0 HD2 LYS A 117 6.230 -0.026 16.566 1.00 0.00 H new ATOM 0 HD3 LYS A 117 4.519 0.296 16.766 1.00 0.00 H new ATOM 0 HE2 LYS A 117 4.276 -1.963 15.351 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.892 -2.257 15.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.217 -3.181 17.428 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 5.063 -1.941 18.223 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 3.498 -1.656 17.630 1.00 0.00 H new ATOM 778 N HIS A 118 1.564 0.904 11.935 1.00 0.00 N ATOM 779 CA HIS A 118 0.311 1.477 11.451 1.00 0.00 C ATOM 780 C HIS A 118 -0.834 0.475 11.581 1.00 0.00 C ATOM 781 O HIS A 118 -1.994 0.857 11.736 1.00 0.00 O ATOM 782 CB HIS A 118 0.457 1.919 9.993 1.00 0.00 C ATOM 783 CG HIS A 118 0.124 3.362 9.769 1.00 0.00 C ATOM 784 ND1 HIS A 118 1.062 4.302 9.398 1.00 0.00 N ATOM 785 CD2 HIS A 118 -1.052 4.025 9.868 1.00 0.00 C ATOM 786 CE1 HIS A 118 0.477 5.481 9.277 1.00 0.00 C ATOM 787 NE2 HIS A 118 -0.805 5.340 9.556 1.00 0.00 N ATOM 0 H HIS A 118 2.345 0.988 11.285 1.00 0.00 H new ATOM 0 HA HIS A 118 0.078 2.347 12.065 1.00 0.00 H new ATOM 0 HB2 HIS A 118 1.481 1.736 9.667 1.00 0.00 H new ATOM 0 HB3 HIS A 118 -0.191 1.304 9.369 1.00 0.00 H new ATOM 0 HD1 HIS A 118 2.053 4.116 9.241 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -2.006 3.600 10.141 1.00 0.00 H new ATOM 0 HE1 HIS A 118 0.965 6.403 8.997 1.00 0.00 H new ATOM 796 N VAL A 119 -0.495 -0.808 11.519 1.00 0.00 N ATOM 797 CA VAL A 119 -1.488 -1.867 11.630 1.00 0.00 C ATOM 798 C VAL A 119 -1.870 -2.113 13.086 1.00 0.00 C ATOM 799 O VAL A 119 -2.983 -2.547 13.382 1.00 0.00 O ATOM 800 CB VAL A 119 -0.973 -3.184 11.017 1.00 0.00 C ATOM 801 CG1 VAL A 119 -2.085 -4.217 10.957 1.00 0.00 C ATOM 802 CG2 VAL A 119 -0.389 -2.936 9.635 1.00 0.00 C ATOM 0 H VAL A 119 0.462 -1.139 11.392 1.00 0.00 H new ATOM 0 HA VAL A 119 -2.368 -1.536 11.078 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.181 -3.576 11.656 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -1.701 -5.140 10.521 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.451 -4.416 11.964 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -2.901 -3.838 10.343 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -0.030 -3.877 9.217 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -1.158 -2.520 8.984 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.441 -2.233 9.711 1.00 0.00 H new ATOM 812 N ARG A 120 -0.938 -1.834 13.993 1.00 0.00 N ATOM 813 CA ARG A 120 -1.175 -2.026 15.420 1.00 0.00 C ATOM 814 C ARG A 120 -1.345 -3.505 15.749 1.00 0.00 C ATOM 815 O ARG A 120 -1.505 -4.335 14.856 1.00 0.00 O ATOM 816 CB ARG A 120 -2.415 -1.245 15.866 1.00 0.00 C ATOM 817 CG ARG A 120 -2.274 -0.612 17.241 1.00 0.00 C ATOM 818 CD ARG A 120 -1.953 0.871 17.141 1.00 0.00 C ATOM 819 NE ARG A 120 -0.521 1.132 17.264 1.00 0.00 N ATOM 820 CZ ARG A 120 0.013 2.351 17.271 1.00 0.00 C ATOM 821 NH1 ARG A 120 -0.763 3.423 17.164 1.00 0.00 N1+ ATOM 822 NH2 ARG A 120 1.325 2.499 17.388 1.00 0.00 N ATOM 0 H ARG A 120 -0.011 -1.474 13.765 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.306 -1.650 15.960 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.624 -0.464 15.135 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.274 -1.916 15.870 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.199 -0.748 17.802 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -1.486 -1.119 17.797 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -2.311 1.255 16.186 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -2.488 1.411 17.922 1.00 0.00 H new ATOM 0 HE ARG A 120 0.107 0.333 17.350 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -1.773 3.314 17.076 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -0.349 4.355 17.170 1.00 0.00 H new ATOM 0 HH21 ARG A 120 1.925 1.679 17.473 1.00 0.00 H new ATOM 0 HH22 ARG A 120 1.734 3.433 17.393 1.00 0.00 H new ATOM 836 N ARG A 121 -1.307 -3.828 17.038 1.00 0.00 N ATOM 837 CA ARG A 121 -1.456 -5.207 17.487 1.00 0.00 C ATOM 838 C ARG A 121 -2.792 -5.787 17.035 1.00 0.00 C ATOM 839 O ARG A 121 -3.801 -5.662 17.728 1.00 0.00 O ATOM 840 CB ARG A 121 -1.344 -5.284 19.011 1.00 0.00 C ATOM 841 CG ARG A 121 -0.186 -4.478 19.577 1.00 0.00 C ATOM 842 CD ARG A 121 0.108 -4.860 21.019 1.00 0.00 C ATOM 843 NE ARG A 121 -0.450 -3.896 21.966 1.00 0.00 N ATOM 844 CZ ARG A 121 -1.709 -3.920 22.397 1.00 0.00 C ATOM 845 NH1 ARG A 121 -2.548 -4.857 21.972 1.00 0.00 N1+ ATOM 846 NH2 ARG A 121 -2.131 -3.003 23.258 1.00 0.00 N ATOM 0 H ARG A 121 -1.174 -3.152 17.790 1.00 0.00 H new ATOM 0 HA ARG A 121 -0.655 -5.796 17.039 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -2.274 -4.928 19.454 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -1.229 -6.327 19.306 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.703 -4.640 18.968 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -0.420 -3.415 19.522 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.303 -5.848 21.223 1.00 0.00 H new ATOM 0 HD3 ARG A 121 1.186 -4.928 21.163 1.00 0.00 H new ATOM 0 HE ARG A 121 0.163 -3.160 22.318 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -2.229 -5.565 21.311 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -3.511 -4.869 22.307 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -1.491 -2.281 23.589 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -3.096 -3.020 23.589 1.00 0.00 H new ATOM 860 N ASN A 122 -2.791 -6.422 15.867 1.00 0.00 N ATOM 861 CA ASN A 122 -4.004 -7.023 15.323 1.00 0.00 C ATOM 862 C ASN A 122 -3.747 -8.449 14.841 1.00 0.00 C ATOM 863 O ASN A 122 -4.524 -8.997 14.060 1.00 0.00 O ATOM 864 CB ASN A 122 -4.545 -6.173 14.171 1.00 0.00 C ATOM 865 CG ASN A 122 -6.059 -6.120 14.154 1.00 0.00 C ATOM 866 OD1 ASN A 122 -6.721 -7.061 13.717 1.00 0.00 O ATOM 867 ND2 ASN A 122 -6.618 -5.014 14.631 1.00 0.00 N ATOM 0 H ASN A 122 -1.965 -6.534 15.280 1.00 0.00 H new ATOM 0 HA ASN A 122 -4.745 -7.061 16.121 1.00 0.00 H new ATOM 0 HB2 ASN A 122 -4.150 -5.161 14.253 1.00 0.00 H new ATOM 0 HB3 ASN A 122 -4.188 -6.579 13.225 1.00 0.00 H new ATOM 0 HD21 ASN A 122 -7.634 -4.921 14.645 1.00 0.00 H new ATOM 0 HD22 ASN A 122 -6.032 -4.258 14.984 1.00 0.00 H new ATOM 874 N LYS A 123 -2.654 -9.046 15.312 1.00 0.00 N ATOM 875 CA LYS A 123 -2.298 -10.408 14.929 1.00 0.00 C ATOM 876 C LYS A 123 -2.057 -10.513 13.424 1.00 0.00 C ATOM 877 O LYS A 123 -0.913 -10.495 12.969 1.00 0.00 O ATOM 878 CB LYS A 123 -3.398 -11.385 15.354 1.00 0.00 C ATOM 879 CG LYS A 123 -3.433 -11.645 16.851 1.00 0.00 C ATOM 880 CD LYS A 123 -4.461 -10.766 17.545 1.00 0.00 C ATOM 881 CE LYS A 123 -4.263 -10.761 19.053 1.00 0.00 C ATOM 882 NZ LYS A 123 -3.514 -9.559 19.510 1.00 0.00 N1+ ATOM 0 H LYS A 123 -2.000 -8.607 15.960 1.00 0.00 H new ATOM 0 HA LYS A 123 -1.372 -10.669 15.441 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -4.364 -10.991 15.039 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -3.254 -12.331 14.832 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -3.667 -12.694 17.034 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -2.447 -11.459 17.277 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -4.387 -9.747 17.164 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -5.464 -11.122 17.310 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -5.234 -10.793 19.547 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -3.724 -11.660 19.351 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -3.400 -9.593 20.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -2.577 -9.541 19.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -4.041 -8.701 19.248 1.00 0.00 H new ATOM 896 N LEU A 124 -3.137 -10.622 12.657 1.00 0.00 N ATOM 897 CA LEU A 124 -3.038 -10.731 11.206 1.00 0.00 C ATOM 898 C LEU A 124 -3.417 -9.416 10.530 1.00 0.00 C ATOM 899 O LEU A 124 -3.855 -9.402 9.380 1.00 0.00 O ATOM 900 CB LEU A 124 -3.938 -11.858 10.697 1.00 0.00 C ATOM 901 CG LEU A 124 -3.352 -12.689 9.554 1.00 0.00 C ATOM 902 CD1 LEU A 124 -4.224 -13.904 9.276 1.00 0.00 C ATOM 903 CD2 LEU A 124 -3.202 -11.841 8.301 1.00 0.00 C ATOM 0 H LEU A 124 -4.091 -10.637 13.016 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.002 -10.959 10.955 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.167 -12.524 11.529 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -4.882 -11.426 10.365 1.00 0.00 H new ATOM 0 HG LEU A 124 -2.363 -13.037 9.853 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -3.792 -14.483 8.460 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -4.280 -14.524 10.171 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -5.226 -13.577 8.998 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.784 -12.449 7.498 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -4.179 -11.463 7.999 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.536 -11.003 8.506 1.00 0.00 H new ATOM 915 N GLY A 125 -3.248 -8.311 11.252 1.00 0.00 N ATOM 916 CA GLY A 125 -3.578 -7.010 10.702 1.00 0.00 C ATOM 917 C GLY A 125 -2.795 -6.695 9.442 1.00 0.00 C ATOM 918 O GLY A 125 -1.594 -6.952 9.368 1.00 0.00 O ATOM 0 H GLY A 125 -2.889 -8.295 12.207 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -4.645 -6.973 10.481 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -3.380 -6.242 11.450 1.00 0.00 H new ATOM 922 N TYR A 126 -3.481 -6.137 8.447 1.00 0.00 N ATOM 923 CA TYR A 126 -2.848 -5.786 7.178 1.00 0.00 C ATOM 924 C TYR A 126 -2.560 -4.288 7.108 1.00 0.00 C ATOM 925 O TYR A 126 -3.046 -3.514 7.931 1.00 0.00 O ATOM 926 CB TYR A 126 -3.748 -6.193 6.008 1.00 0.00 C ATOM 927 CG TYR A 126 -4.362 -7.570 6.154 1.00 0.00 C ATOM 928 CD1 TYR A 126 -5.393 -7.801 7.057 1.00 0.00 C ATOM 929 CD2 TYR A 126 -3.912 -8.638 5.386 1.00 0.00 C ATOM 930 CE1 TYR A 126 -5.955 -9.056 7.192 1.00 0.00 C ATOM 931 CE2 TYR A 126 -4.470 -9.895 5.516 1.00 0.00 C ATOM 932 CZ TYR A 126 -5.491 -10.099 6.419 1.00 0.00 C ATOM 933 OH TYR A 126 -6.049 -11.350 6.551 1.00 0.00 O ATOM 0 H TYR A 126 -4.476 -5.918 8.495 1.00 0.00 H new ATOM 0 HA TYR A 126 -1.903 -6.325 7.111 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -4.547 -5.459 5.905 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.166 -6.162 5.087 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -5.761 -6.986 7.663 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -3.113 -8.482 4.676 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -6.754 -9.219 7.900 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -4.108 -10.714 4.913 1.00 0.00 H new ATOM 0 HH TYR A 126 -5.609 -11.971 5.934 1.00 0.00 H new ATOM 943 N VAL A 127 -1.771 -3.884 6.115 1.00 0.00 N ATOM 944 CA VAL A 127 -1.427 -2.482 5.933 1.00 0.00 C ATOM 945 C VAL A 127 -2.331 -1.852 4.883 1.00 0.00 C ATOM 946 O VAL A 127 -2.381 -2.306 3.742 1.00 0.00 O ATOM 947 CB VAL A 127 0.044 -2.331 5.503 1.00 0.00 C ATOM 948 CG1 VAL A 127 0.364 -0.897 5.111 1.00 0.00 C ATOM 949 CG2 VAL A 127 0.970 -2.818 6.603 1.00 0.00 C ATOM 0 H VAL A 127 -1.359 -4.512 5.425 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.568 -1.972 6.886 1.00 0.00 H new ATOM 0 HB VAL A 127 0.203 -2.951 4.621 1.00 0.00 H new ATOM 0 HG11 VAL A 127 1.410 -0.826 4.813 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.272 -0.597 4.278 1.00 0.00 H new ATOM 0 HG13 VAL A 127 0.183 -0.239 5.961 1.00 0.00 H new ATOM 0 HG21 VAL A 127 2.006 -2.705 6.283 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.803 -2.231 7.506 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.767 -3.869 6.811 1.00 0.00 H new ATOM 959 N SER A 128 -3.053 -0.813 5.272 1.00 0.00 N ATOM 960 CA SER A 128 -3.963 -0.145 4.357 1.00 0.00 C ATOM 961 C SER A 128 -3.209 0.590 3.251 1.00 0.00 C ATOM 962 O SER A 128 -2.296 1.375 3.515 1.00 0.00 O ATOM 963 CB SER A 128 -4.863 0.831 5.116 1.00 0.00 C ATOM 964 OG SER A 128 -4.104 1.662 5.976 1.00 0.00 O ATOM 0 H SER A 128 -3.027 -0.416 6.211 1.00 0.00 H new ATOM 0 HA SER A 128 -4.581 -0.912 3.890 1.00 0.00 H new ATOM 0 HB2 SER A 128 -5.417 1.446 4.407 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.598 0.275 5.698 1.00 0.00 H new ATOM 0 HG SER A 128 -4.703 2.278 6.448 1.00 0.00 H new ATOM 970 N VAL A 129 -3.608 0.334 2.009 1.00 0.00 N ATOM 971 CA VAL A 129 -2.980 0.975 0.864 1.00 0.00 C ATOM 972 C VAL A 129 -3.155 2.488 0.935 1.00 0.00 C ATOM 973 O VAL A 129 -2.276 3.245 0.525 1.00 0.00 O ATOM 974 CB VAL A 129 -3.554 0.451 -0.470 1.00 0.00 C ATOM 975 CG1 VAL A 129 -4.947 1.008 -0.725 1.00 0.00 C ATOM 976 CG2 VAL A 129 -2.613 0.791 -1.617 1.00 0.00 C ATOM 0 H VAL A 129 -4.362 -0.311 1.772 1.00 0.00 H new ATOM 0 HA VAL A 129 -1.919 0.730 0.899 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.641 -0.633 -0.403 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -5.326 0.622 -1.671 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -5.613 0.706 0.083 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.901 2.096 -0.770 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -3.029 0.416 -2.552 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -2.493 1.873 -1.681 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -1.642 0.328 -1.440 1.00 0.00 H new ATOM 986 N LYS A 130 -4.295 2.921 1.472 1.00 0.00 N ATOM 987 CA LYS A 130 -4.582 4.346 1.613 1.00 0.00 C ATOM 988 C LYS A 130 -3.416 5.056 2.290 1.00 0.00 C ATOM 989 O LYS A 130 -3.169 6.239 2.053 1.00 0.00 O ATOM 990 CB LYS A 130 -5.864 4.554 2.421 1.00 0.00 C ATOM 991 CG LYS A 130 -6.704 5.725 1.938 1.00 0.00 C ATOM 992 CD LYS A 130 -7.637 6.229 3.028 1.00 0.00 C ATOM 993 CE LYS A 130 -7.063 7.449 3.730 1.00 0.00 C ATOM 994 NZ LYS A 130 -7.815 7.778 4.974 1.00 0.00 N1+ ATOM 0 H LYS A 130 -5.033 2.306 1.816 1.00 0.00 H new ATOM 0 HA LYS A 130 -4.722 4.770 0.619 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -6.463 3.645 2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.603 4.712 3.467 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -6.050 6.535 1.615 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -7.288 5.421 1.069 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.605 6.479 2.593 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -7.810 5.436 3.756 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -6.016 7.268 3.975 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -7.089 8.303 3.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -7.393 8.616 5.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -8.808 7.976 4.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -7.769 6.973 5.631 1.00 0.00 H new ATOM 1008 N LEU A 131 -2.693 4.315 3.124 1.00 0.00 N ATOM 1009 CA LEU A 131 -1.544 4.854 3.826 1.00 0.00 C ATOM 1010 C LEU A 131 -0.339 4.894 2.893 1.00 0.00 C ATOM 1011 O LEU A 131 0.397 5.881 2.854 1.00 0.00 O ATOM 1012 CB LEU A 131 -1.243 4.005 5.065 1.00 0.00 C ATOM 1013 CG LEU A 131 0.232 3.901 5.438 1.00 0.00 C ATOM 1014 CD1 LEU A 131 0.794 5.273 5.767 1.00 0.00 C ATOM 1015 CD2 LEU A 131 0.426 2.940 6.601 1.00 0.00 C ATOM 0 H LEU A 131 -2.888 3.335 3.328 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.764 5.871 4.151 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -1.787 4.422 5.912 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -1.631 3.000 4.900 1.00 0.00 H new ATOM 0 HG LEU A 131 0.778 3.506 4.581 1.00 0.00 H new ATOM 0 HD11 LEU A 131 1.848 5.181 6.031 1.00 0.00 H new ATOM 0 HD12 LEU A 131 0.693 5.925 4.899 1.00 0.00 H new ATOM 0 HD13 LEU A 131 0.245 5.699 6.607 1.00 0.00 H new ATOM 0 HD21 LEU A 131 1.485 2.880 6.851 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -0.131 3.299 7.466 1.00 0.00 H new ATOM 0 HD23 LEU A 131 0.063 1.951 6.320 1.00 0.00 H new ATOM 1027 N LEU A 132 -0.149 3.817 2.136 1.00 0.00 N ATOM 1028 CA LEU A 132 0.962 3.734 1.196 1.00 0.00 C ATOM 1029 C LEU A 132 0.958 4.925 0.245 1.00 0.00 C ATOM 1030 O LEU A 132 2.010 5.383 -0.201 1.00 0.00 O ATOM 1031 CB LEU A 132 0.879 2.438 0.393 1.00 0.00 C ATOM 1032 CG LEU A 132 1.537 1.223 1.044 1.00 0.00 C ATOM 1033 CD1 LEU A 132 1.060 1.057 2.480 1.00 0.00 C ATOM 1034 CD2 LEU A 132 1.239 -0.027 0.235 1.00 0.00 C ATOM 0 H LEU A 132 -0.749 2.992 2.156 1.00 0.00 H new ATOM 0 HA LEU A 132 1.890 3.746 1.768 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -0.171 2.209 0.212 1.00 0.00 H new ATOM 0 HB3 LEU A 132 1.341 2.603 -0.580 1.00 0.00 H new ATOM 0 HG LEU A 132 2.616 1.380 1.062 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.541 0.186 2.925 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.318 1.947 3.054 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -0.021 0.919 2.491 1.00 0.00 H new ATOM 0 HD21 LEU A 132 1.713 -0.888 0.707 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.161 -0.184 0.192 1.00 0.00 H new ATOM 0 HD23 LEU A 132 1.629 0.092 -0.776 1.00 0.00 H new ATOM 1046 N THR A 133 -0.236 5.423 -0.057 1.00 0.00 N ATOM 1047 CA THR A 133 -0.387 6.560 -0.947 1.00 0.00 C ATOM 1048 C THR A 133 0.103 7.827 -0.268 1.00 0.00 C ATOM 1049 O THR A 133 0.718 8.691 -0.894 1.00 0.00 O ATOM 1050 CB THR A 133 -1.849 6.706 -1.350 1.00 0.00 C ATOM 1051 OG1 THR A 133 -2.703 6.131 -0.374 1.00 0.00 O ATOM 1052 CG2 THR A 133 -2.156 6.056 -2.675 1.00 0.00 C ATOM 0 H THR A 133 -1.115 5.053 0.305 1.00 0.00 H new ATOM 0 HA THR A 133 0.213 6.395 -1.842 1.00 0.00 H new ATOM 0 HB THR A 133 -2.026 7.778 -1.435 1.00 0.00 H new ATOM 0 HG1 THR A 133 -2.499 6.513 0.505 1.00 0.00 H new ATOM 0 HG21 THR A 133 -3.211 6.192 -2.911 1.00 0.00 H new ATOM 0 HG22 THR A 133 -1.548 6.515 -3.455 1.00 0.00 H new ATOM 0 HG23 THR A 133 -1.931 4.991 -2.619 1.00 0.00 H new ATOM 1060 N SER A 134 -0.160 7.913 1.026 1.00 0.00 N ATOM 1061 CA SER A 134 0.264 9.055 1.824 1.00 0.00 C ATOM 1062 C SER A 134 1.606 8.761 2.493 1.00 0.00 C ATOM 1063 O SER A 134 1.982 9.407 3.470 1.00 0.00 O ATOM 1064 CB SER A 134 -0.790 9.390 2.880 1.00 0.00 C ATOM 1065 OG SER A 134 -0.301 10.348 3.804 1.00 0.00 O ATOM 0 H SER A 134 -0.669 7.201 1.550 1.00 0.00 H new ATOM 0 HA SER A 134 0.380 9.915 1.165 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.687 9.774 2.394 1.00 0.00 H new ATOM 0 HB3 SER A 134 -1.079 8.483 3.411 1.00 0.00 H new ATOM 0 HG SER A 134 0.678 10.367 3.768 1.00 0.00 H new ATOM 1071 N PHE A 135 2.319 7.776 1.953 1.00 0.00 N ATOM 1072 CA PHE A 135 3.617 7.378 2.480 1.00 0.00 C ATOM 1073 C PHE A 135 4.714 8.313 1.974 1.00 0.00 C ATOM 1074 O PHE A 135 5.000 8.358 0.781 1.00 0.00 O ATOM 1075 CB PHE A 135 3.919 5.929 2.086 1.00 0.00 C ATOM 1076 CG PHE A 135 5.250 5.418 2.572 1.00 0.00 C ATOM 1077 CD1 PHE A 135 5.923 6.048 3.609 1.00 0.00 C ATOM 1078 CD2 PHE A 135 5.823 4.298 1.991 1.00 0.00 C ATOM 1079 CE1 PHE A 135 7.141 5.571 4.055 1.00 0.00 C ATOM 1080 CE2 PHE A 135 7.041 3.817 2.433 1.00 0.00 C ATOM 1081 CZ PHE A 135 7.701 4.454 3.466 1.00 0.00 C ATOM 0 H PHE A 135 2.014 7.236 1.143 1.00 0.00 H new ATOM 0 HA PHE A 135 3.590 7.447 3.567 1.00 0.00 H new ATOM 0 HB2 PHE A 135 3.131 5.286 2.479 1.00 0.00 H new ATOM 0 HB3 PHE A 135 3.886 5.846 1.000 1.00 0.00 H new ATOM 0 HD1 PHE A 135 5.490 6.922 4.073 1.00 0.00 H new ATOM 0 HD2 PHE A 135 5.312 3.795 1.183 1.00 0.00 H new ATOM 0 HE1 PHE A 135 7.654 6.071 4.863 1.00 0.00 H new ATOM 0 HE2 PHE A 135 7.477 2.943 1.971 1.00 0.00 H new ATOM 0 HZ PHE A 135 8.653 4.079 3.812 1.00 0.00 H new ATOM 1091 N LYS A 136 5.305 9.072 2.895 1.00 0.00 N ATOM 1092 CA LYS A 136 6.363 10.034 2.568 1.00 0.00 C ATOM 1093 C LYS A 136 7.311 9.529 1.475 1.00 0.00 C ATOM 1094 O LYS A 136 7.859 10.324 0.710 1.00 0.00 O ATOM 1095 CB LYS A 136 7.165 10.376 3.824 1.00 0.00 C ATOM 1096 CG LYS A 136 7.646 9.152 4.588 1.00 0.00 C ATOM 1097 CD LYS A 136 7.601 9.381 6.090 1.00 0.00 C ATOM 1098 CE LYS A 136 6.322 8.828 6.699 1.00 0.00 C ATOM 1099 NZ LYS A 136 6.365 8.843 8.187 1.00 0.00 N1+ ATOM 0 H LYS A 136 5.067 9.040 3.886 1.00 0.00 H new ATOM 0 HA LYS A 136 5.869 10.925 2.181 1.00 0.00 H new ATOM 0 HB2 LYS A 136 8.027 10.980 3.542 1.00 0.00 H new ATOM 0 HB3 LYS A 136 6.549 10.987 4.484 1.00 0.00 H new ATOM 0 HG2 LYS A 136 7.025 8.294 4.331 1.00 0.00 H new ATOM 0 HG3 LYS A 136 8.665 8.910 4.286 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.463 8.906 6.558 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.673 10.448 6.299 1.00 0.00 H new ATOM 0 HE2 LYS A 136 5.472 9.416 6.354 1.00 0.00 H new ATOM 0 HE3 LYS A 136 6.166 7.807 6.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 5.475 8.458 8.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.161 8.261 8.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 6.489 9.820 8.521 1.00 0.00 H new ATOM 1113 N LYS A 137 7.508 8.215 1.400 1.00 0.00 N ATOM 1114 CA LYS A 137 8.396 7.638 0.395 1.00 0.00 C ATOM 1115 C LYS A 137 7.683 7.521 -0.946 1.00 0.00 C ATOM 1116 O LYS A 137 8.284 7.720 -2.002 1.00 0.00 O ATOM 1117 CB LYS A 137 8.892 6.264 0.846 1.00 0.00 C ATOM 1118 CG LYS A 137 10.226 6.308 1.573 1.00 0.00 C ATOM 1119 CD LYS A 137 10.164 7.205 2.798 1.00 0.00 C ATOM 1120 CE LYS A 137 11.543 7.723 3.179 1.00 0.00 C ATOM 1121 NZ LYS A 137 11.464 8.974 3.981 1.00 0.00 N1+ ATOM 0 H LYS A 137 7.068 7.534 2.019 1.00 0.00 H new ATOM 0 HA LYS A 137 9.254 8.300 0.277 1.00 0.00 H new ATOM 0 HB2 LYS A 137 8.145 5.814 1.501 1.00 0.00 H new ATOM 0 HB3 LYS A 137 8.984 5.616 -0.026 1.00 0.00 H new ATOM 0 HG2 LYS A 137 10.511 5.300 1.873 1.00 0.00 H new ATOM 0 HG3 LYS A 137 10.999 6.669 0.895 1.00 0.00 H new ATOM 0 HD2 LYS A 137 9.500 8.046 2.601 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.738 6.651 3.635 1.00 0.00 H new ATOM 0 HE2 LYS A 137 12.073 6.960 3.749 1.00 0.00 H new ATOM 0 HE3 LYS A 137 12.124 7.907 2.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 12.424 9.294 4.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.981 9.711 3.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 10.932 8.793 4.856 1.00 0.00 H new ATOM 1135 N VAL A 138 6.396 7.203 -0.893 1.00 0.00 N ATOM 1136 CA VAL A 138 5.593 7.066 -2.095 1.00 0.00 C ATOM 1137 C VAL A 138 5.147 8.440 -2.596 1.00 0.00 C ATOM 1138 O VAL A 138 5.077 8.684 -3.800 1.00 0.00 O ATOM 1139 CB VAL A 138 4.360 6.165 -1.840 1.00 0.00 C ATOM 1140 CG1 VAL A 138 3.241 6.455 -2.832 1.00 0.00 C ATOM 1141 CG2 VAL A 138 4.757 4.696 -1.894 1.00 0.00 C ATOM 0 H VAL A 138 5.887 7.035 -0.025 1.00 0.00 H new ATOM 0 HA VAL A 138 6.209 6.593 -2.860 1.00 0.00 H new ATOM 0 HB VAL A 138 3.982 6.390 -0.843 1.00 0.00 H new ATOM 0 HG11 VAL A 138 2.392 5.804 -2.623 1.00 0.00 H new ATOM 0 HG12 VAL A 138 2.932 7.496 -2.738 1.00 0.00 H new ATOM 0 HG13 VAL A 138 3.597 6.272 -3.846 1.00 0.00 H new ATOM 0 HG21 VAL A 138 3.880 4.075 -1.713 1.00 0.00 H new ATOM 0 HG22 VAL A 138 5.168 4.466 -2.877 1.00 0.00 H new ATOM 0 HG23 VAL A 138 5.508 4.494 -1.131 1.00 0.00 H new ATOM 1151 N LYS A 139 4.847 9.330 -1.656 1.00 0.00 N ATOM 1152 CA LYS A 139 4.408 10.681 -1.988 1.00 0.00 C ATOM 1153 C LYS A 139 5.455 11.407 -2.823 1.00 0.00 C ATOM 1154 O LYS A 139 5.125 12.098 -3.787 1.00 0.00 O ATOM 1155 CB LYS A 139 4.131 11.475 -0.712 1.00 0.00 C ATOM 1156 CG LYS A 139 3.083 10.841 0.188 1.00 0.00 C ATOM 1157 CD LYS A 139 2.934 11.608 1.493 1.00 0.00 C ATOM 1158 CE LYS A 139 2.560 13.061 1.249 1.00 0.00 C ATOM 1159 NZ LYS A 139 3.760 13.941 1.194 1.00 0.00 N1+ ATOM 0 H LYS A 139 4.900 9.139 -0.655 1.00 0.00 H new ATOM 0 HA LYS A 139 3.491 10.601 -2.572 1.00 0.00 H new ATOM 0 HB2 LYS A 139 5.060 11.582 -0.153 1.00 0.00 H new ATOM 0 HB3 LYS A 139 3.805 12.479 -0.983 1.00 0.00 H new ATOM 0 HG2 LYS A 139 2.125 10.813 -0.331 1.00 0.00 H new ATOM 0 HG3 LYS A 139 3.361 9.809 0.401 1.00 0.00 H new ATOM 0 HD2 LYS A 139 2.170 11.134 2.109 1.00 0.00 H new ATOM 0 HD3 LYS A 139 3.869 11.561 2.052 1.00 0.00 H new ATOM 0 HE2 LYS A 139 2.007 13.141 0.313 1.00 0.00 H new ATOM 0 HE3 LYS A 139 1.895 13.403 2.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 3.783 14.549 2.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 4.619 13.355 1.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 3.717 14.534 0.341 1.00 0.00 H new ATOM 1173 N HIS A 140 6.721 11.250 -2.447 1.00 0.00 N ATOM 1174 CA HIS A 140 7.819 11.891 -3.163 1.00 0.00 C ATOM 1175 C HIS A 140 7.790 11.529 -4.644 1.00 0.00 C ATOM 1176 O HIS A 140 8.336 12.248 -5.481 1.00 0.00 O ATOM 1177 CB HIS A 140 9.162 11.484 -2.552 1.00 0.00 C ATOM 1178 CG HIS A 140 10.276 12.430 -2.874 1.00 0.00 C ATOM 1179 ND1 HIS A 140 10.099 13.793 -2.991 1.00 0.00 N ATOM 1180 CD2 HIS A 140 11.592 12.203 -3.103 1.00 0.00 C ATOM 1181 CE1 HIS A 140 11.256 14.362 -3.278 1.00 0.00 C ATOM 1182 NE2 HIS A 140 12.177 13.420 -3.352 1.00 0.00 N ATOM 0 H HIS A 140 7.012 10.684 -1.650 1.00 0.00 H new ATOM 0 HA HIS A 140 7.698 12.970 -3.070 1.00 0.00 H new ATOM 0 HB2 HIS A 140 9.054 11.417 -1.469 1.00 0.00 H new ATOM 0 HB3 HIS A 140 9.427 10.488 -2.908 1.00 0.00 H new ATOM 0 HD2 HIS A 140 12.088 11.244 -3.092 1.00 0.00 H new ATOM 0 HE1 HIS A 140 11.420 15.419 -3.427 1.00 0.00 H new ATOM 0 HE2 HIS A 140 13.164 13.571 -3.560 1.00 0.00 H new ATOM 1191 N LEU A 141 7.149 10.409 -4.960 1.00 0.00 N ATOM 1192 CA LEU A 141 7.046 9.948 -6.338 1.00 0.00 C ATOM 1193 C LEU A 141 6.273 10.949 -7.193 1.00 0.00 C ATOM 1194 O LEU A 141 6.852 11.656 -8.017 1.00 0.00 O ATOM 1195 CB LEU A 141 6.358 8.582 -6.388 1.00 0.00 C ATOM 1196 CG LEU A 141 6.945 7.523 -5.456 1.00 0.00 C ATOM 1197 CD1 LEU A 141 6.019 6.321 -5.371 1.00 0.00 C ATOM 1198 CD2 LEU A 141 8.328 7.104 -5.930 1.00 0.00 C ATOM 0 H LEU A 141 6.692 9.803 -4.278 1.00 0.00 H new ATOM 0 HA LEU A 141 8.055 9.857 -6.741 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.304 8.715 -6.143 1.00 0.00 H new ATOM 0 HB3 LEU A 141 6.403 8.208 -7.411 1.00 0.00 H new ATOM 0 HG LEU A 141 7.042 7.953 -4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 141 6.451 5.575 -4.703 1.00 0.00 H new ATOM 0 HD12 LEU A 141 5.049 6.635 -4.985 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.892 5.889 -6.364 1.00 0.00 H new ATOM 0 HD21 LEU A 141 8.731 6.349 -5.255 1.00 0.00 H new ATOM 0 HD22 LEU A 141 8.258 6.690 -6.936 1.00 0.00 H new ATOM 0 HD23 LEU A 141 8.988 7.972 -5.940 1.00 0.00 H new ATOM 1210 N THR A 142 4.960 10.995 -6.991 1.00 0.00 N ATOM 1211 CA THR A 142 4.092 11.899 -7.739 1.00 0.00 C ATOM 1212 C THR A 142 2.690 11.888 -7.148 1.00 0.00 C ATOM 1213 O THR A 142 2.460 11.317 -6.082 1.00 0.00 O ATOM 1214 CB THR A 142 4.024 11.478 -9.214 1.00 0.00 C ATOM 1215 OG1 THR A 142 5.148 10.693 -9.571 1.00 0.00 O ATOM 1216 CG2 THR A 142 3.966 12.652 -10.169 1.00 0.00 C ATOM 0 H THR A 142 4.471 10.413 -6.311 1.00 0.00 H new ATOM 0 HA THR A 142 4.506 12.905 -7.672 1.00 0.00 H new ATOM 0 HB THR A 142 3.101 10.906 -9.304 1.00 0.00 H new ATOM 0 HG1 THR A 142 5.963 11.229 -9.481 1.00 0.00 H new ATOM 0 HG21 THR A 142 3.919 12.285 -11.194 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.080 13.250 -9.957 1.00 0.00 H new ATOM 0 HG23 THR A 142 4.857 13.267 -10.044 1.00 0.00 H new ATOM 1224 N ARG A 143 1.747 12.493 -7.861 1.00 0.00 N ATOM 1225 CA ARG A 143 0.360 12.518 -7.421 1.00 0.00 C ATOM 1226 C ARG A 143 -0.380 11.326 -8.020 1.00 0.00 C ATOM 1227 O ARG A 143 -1.570 11.401 -8.324 1.00 0.00 O ATOM 1228 CB ARG A 143 -0.313 13.825 -7.842 1.00 0.00 C ATOM 1229 CG ARG A 143 -0.288 14.897 -6.764 1.00 0.00 C ATOM 1230 CD ARG A 143 -1.180 14.526 -5.590 1.00 0.00 C ATOM 1231 NE ARG A 143 -1.034 15.459 -4.475 1.00 0.00 N ATOM 1232 CZ ARG A 143 0.047 15.524 -3.701 1.00 0.00 C ATOM 1233 NH1 ARG A 143 1.077 14.714 -3.916 1.00 0.00 N1+ ATOM 1234 NH2 ARG A 143 0.099 16.402 -2.708 1.00 0.00 N ATOM 0 H ARG A 143 1.919 12.972 -8.745 1.00 0.00 H new ATOM 0 HA ARG A 143 0.329 12.455 -6.333 1.00 0.00 H new ATOM 0 HB2 ARG A 143 0.182 14.208 -8.735 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -1.348 13.620 -8.115 1.00 0.00 H new ATOM 0 HG2 ARG A 143 0.735 15.040 -6.415 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -0.616 15.847 -7.186 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -2.220 14.510 -5.916 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -0.936 13.518 -5.254 1.00 0.00 H new ATOM 0 HE ARG A 143 -1.805 16.097 -4.278 1.00 0.00 H new ATOM 0 HH11 ARG A 143 1.043 14.037 -4.678 1.00 0.00 H new ATOM 0 HH12 ARG A 143 1.902 14.769 -3.319 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -0.689 17.027 -2.538 1.00 0.00 H new ATOM 0 HH22 ARG A 143 0.927 16.452 -2.115 1.00 0.00 H new ATOM 1248 N ASP A 144 0.355 10.230 -8.200 1.00 0.00 N ATOM 1249 CA ASP A 144 -0.189 9.012 -8.777 1.00 0.00 C ATOM 1250 C ASP A 144 -0.657 8.046 -7.694 1.00 0.00 C ATOM 1251 O ASP A 144 -0.467 6.834 -7.805 1.00 0.00 O ATOM 1252 CB ASP A 144 0.877 8.349 -9.653 1.00 0.00 C ATOM 1253 CG ASP A 144 0.765 8.757 -11.109 1.00 0.00 C ATOM 1254 OD1 ASP A 144 -0.369 9.012 -11.569 1.00 0.00 O1- ATOM 1255 OD2 ASP A 144 1.810 8.821 -11.790 1.00 0.00 O ATOM 0 H ASP A 144 1.342 10.166 -7.949 1.00 0.00 H new ATOM 0 HA ASP A 144 -1.056 9.272 -9.384 1.00 0.00 H new ATOM 0 HB2 ASP A 144 1.866 8.614 -9.280 1.00 0.00 H new ATOM 0 HB3 ASP A 144 0.786 7.266 -9.574 1.00 0.00 H new ATOM 1260 N TRP A 145 -1.275 8.585 -6.648 1.00 0.00 N ATOM 1261 CA TRP A 145 -1.773 7.767 -5.554 1.00 0.00 C ATOM 1262 C TRP A 145 -2.781 6.749 -6.074 1.00 0.00 C ATOM 1263 O TRP A 145 -2.811 5.603 -5.627 1.00 0.00 O ATOM 1264 CB TRP A 145 -2.389 8.658 -4.474 1.00 0.00 C ATOM 1265 CG TRP A 145 -1.354 9.429 -3.709 1.00 0.00 C ATOM 1266 CD1 TRP A 145 0.000 9.370 -3.884 1.00 0.00 C ATOM 1267 CD2 TRP A 145 -1.581 10.370 -2.655 1.00 0.00 C ATOM 1268 NE1 TRP A 145 0.630 10.215 -3.007 1.00 0.00 N ATOM 1269 CE2 TRP A 145 -0.319 10.843 -2.240 1.00 0.00 C ATOM 1270 CE3 TRP A 145 -2.725 10.862 -2.020 1.00 0.00 C ATOM 1271 CZ2 TRP A 145 -0.175 11.782 -1.221 1.00 0.00 C ATOM 1272 CZ3 TRP A 145 -2.579 11.794 -1.010 1.00 0.00 C ATOM 1273 CH2 TRP A 145 -1.313 12.246 -0.619 1.00 0.00 C ATOM 0 H TRP A 145 -1.442 9.585 -6.537 1.00 0.00 H new ATOM 0 HA TRP A 145 -0.943 7.218 -5.108 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -3.088 9.354 -4.937 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -2.964 8.042 -3.783 1.00 0.00 H new ATOM 0 HD1 TRP A 145 0.502 8.747 -4.609 1.00 0.00 H new ATOM 0 HE1 TRP A 145 1.638 10.354 -2.936 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -3.706 10.520 -2.314 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 0.801 12.132 -0.917 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -3.457 12.180 -0.514 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -1.233 12.975 0.173 1.00 0.00 H new ATOM 1284 N ARG A 146 -3.577 7.167 -7.051 1.00 0.00 N ATOM 1285 CA ARG A 146 -4.556 6.281 -7.670 1.00 0.00 C ATOM 1286 C ARG A 146 -3.838 5.100 -8.307 1.00 0.00 C ATOM 1287 O ARG A 146 -4.361 3.986 -8.362 1.00 0.00 O ATOM 1288 CB ARG A 146 -5.349 7.035 -8.742 1.00 0.00 C ATOM 1289 CG ARG A 146 -4.471 7.852 -9.677 1.00 0.00 C ATOM 1290 CD ARG A 146 -5.029 9.250 -9.892 1.00 0.00 C ATOM 1291 NE ARG A 146 -6.376 9.225 -10.458 1.00 0.00 N ATOM 1292 CZ ARG A 146 -7.038 10.314 -10.845 1.00 0.00 C ATOM 1293 NH1 ARG A 146 -6.482 11.513 -10.727 1.00 0.00 N1+ ATOM 1294 NH2 ARG A 146 -8.259 10.203 -11.349 1.00 0.00 N ATOM 0 H ARG A 146 -3.564 8.113 -7.432 1.00 0.00 H new ATOM 0 HA ARG A 146 -5.246 5.924 -6.905 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -5.925 6.319 -9.329 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -6.065 7.698 -8.256 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -3.465 7.921 -9.264 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -4.387 7.342 -10.637 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -5.046 9.783 -8.941 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -4.367 9.805 -10.557 1.00 0.00 H new ATOM 0 HE ARG A 146 -6.836 8.321 -10.563 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -5.543 11.604 -10.338 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -6.993 12.344 -11.025 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -8.691 9.284 -11.440 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -8.766 11.037 -11.645 1.00 0.00 H new ATOM 1308 N THR A 147 -2.625 5.364 -8.780 1.00 0.00 N ATOM 1309 CA THR A 147 -1.806 4.341 -9.411 1.00 0.00 C ATOM 1310 C THR A 147 -1.140 3.463 -8.357 1.00 0.00 C ATOM 1311 O THR A 147 -0.764 2.326 -8.634 1.00 0.00 O ATOM 1312 CB THR A 147 -0.765 4.977 -10.344 1.00 0.00 C ATOM 1313 OG1 THR A 147 0.498 5.073 -9.713 1.00 0.00 O ATOM 1314 CG2 THR A 147 -1.146 6.363 -10.824 1.00 0.00 C ATOM 0 H THR A 147 -2.187 6.284 -8.737 1.00 0.00 H new ATOM 0 HA THR A 147 -2.452 3.706 -10.017 1.00 0.00 H new ATOM 0 HB THR A 147 -0.722 4.312 -11.206 1.00 0.00 H new ATOM 0 HG1 THR A 147 0.406 5.563 -8.869 1.00 0.00 H new ATOM 0 HG21 THR A 147 -0.364 6.749 -11.478 1.00 0.00 H new ATOM 0 HG22 THR A 147 -2.086 6.312 -11.373 1.00 0.00 H new ATOM 0 HG23 THR A 147 -1.262 7.026 -9.967 1.00 0.00 H new ATOM 1322 N THR A 148 -1.020 3.990 -7.143 1.00 0.00 N ATOM 1323 CA THR A 148 -0.425 3.240 -6.043 1.00 0.00 C ATOM 1324 C THR A 148 -1.340 2.087 -5.642 1.00 0.00 C ATOM 1325 O THR A 148 -0.878 1.046 -5.173 1.00 0.00 O ATOM 1326 CB THR A 148 -0.182 4.160 -4.842 1.00 0.00 C ATOM 1327 OG1 THR A 148 0.755 5.171 -5.166 1.00 0.00 O ATOM 1328 CG2 THR A 148 0.332 3.432 -3.618 1.00 0.00 C ATOM 0 H THR A 148 -1.326 4.931 -6.896 1.00 0.00 H new ATOM 0 HA THR A 148 0.532 2.835 -6.372 1.00 0.00 H new ATOM 0 HB THR A 148 -1.157 4.585 -4.606 1.00 0.00 H new ATOM 0 HG1 THR A 148 0.425 5.691 -5.928 1.00 0.00 H new ATOM 0 HG21 THR A 148 0.482 4.145 -2.807 1.00 0.00 H new ATOM 0 HG22 THR A 148 -0.394 2.679 -3.311 1.00 0.00 H new ATOM 0 HG23 THR A 148 1.279 2.947 -3.854 1.00 0.00 H new ATOM 1336 N ALA A 149 -2.641 2.284 -5.832 1.00 0.00 N ATOM 1337 CA ALA A 149 -3.624 1.267 -5.492 1.00 0.00 C ATOM 1338 C ALA A 149 -3.670 0.170 -6.550 1.00 0.00 C ATOM 1339 O ALA A 149 -3.635 -1.017 -6.227 1.00 0.00 O ATOM 1340 CB ALA A 149 -4.994 1.904 -5.316 1.00 0.00 C ATOM 0 H ALA A 149 -3.037 3.140 -6.220 1.00 0.00 H new ATOM 0 HA ALA A 149 -3.328 0.805 -4.550 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -5.723 1.135 -5.062 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -4.952 2.643 -4.516 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.290 2.392 -6.245 1.00 0.00 H new ATOM 1346 N HIS A 150 -3.741 0.571 -7.817 1.00 0.00 N ATOM 1347 CA HIS A 150 -3.781 -0.391 -8.914 1.00 0.00 C ATOM 1348 C HIS A 150 -2.423 -1.050 -9.098 1.00 0.00 C ATOM 1349 O HIS A 150 -2.330 -2.260 -9.288 1.00 0.00 O ATOM 1350 CB HIS A 150 -4.205 0.288 -10.215 1.00 0.00 C ATOM 1351 CG HIS A 150 -5.586 -0.082 -10.658 1.00 0.00 C ATOM 1352 ND1 HIS A 150 -5.980 -0.071 -11.980 1.00 0.00 N ATOM 1353 CD2 HIS A 150 -6.669 -0.477 -9.948 1.00 0.00 C ATOM 1354 CE1 HIS A 150 -7.247 -0.441 -12.062 1.00 0.00 C ATOM 1355 NE2 HIS A 150 -7.687 -0.693 -10.845 1.00 0.00 N ATOM 0 H HIS A 150 -3.772 1.548 -8.108 1.00 0.00 H new ATOM 0 HA HIS A 150 -4.515 -1.156 -8.662 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -4.151 1.369 -10.086 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -3.497 0.025 -11.001 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -6.723 -0.599 -8.876 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -7.823 -0.523 -12.972 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -8.631 -0.999 -10.608 1.00 0.00 H new ATOM 1364 N ALA A 151 -1.365 -0.248 -9.036 1.00 0.00 N ATOM 1365 CA ALA A 151 -0.013 -0.775 -9.197 1.00 0.00 C ATOM 1366 C ALA A 151 0.200 -1.979 -8.288 1.00 0.00 C ATOM 1367 O ALA A 151 0.739 -3.002 -8.706 1.00 0.00 O ATOM 1368 CB ALA A 151 1.020 0.299 -8.898 1.00 0.00 C ATOM 0 H ALA A 151 -1.415 0.758 -8.877 1.00 0.00 H new ATOM 0 HA ALA A 151 0.109 -1.093 -10.232 1.00 0.00 H new ATOM 0 HB1 ALA A 151 2.021 -0.114 -9.024 1.00 0.00 H new ATOM 0 HB2 ALA A 151 0.884 1.136 -9.583 1.00 0.00 H new ATOM 0 HB3 ALA A 151 0.897 0.647 -7.872 1.00 0.00 H new ATOM 1374 N LEU A 152 -0.249 -1.853 -7.045 1.00 0.00 N ATOM 1375 CA LEU A 152 -0.134 -2.929 -6.079 1.00 0.00 C ATOM 1376 C LEU A 152 -1.049 -4.075 -6.464 1.00 0.00 C ATOM 1377 O LEU A 152 -0.701 -5.245 -6.322 1.00 0.00 O ATOM 1378 CB LEU A 152 -0.492 -2.406 -4.696 1.00 0.00 C ATOM 1379 CG LEU A 152 0.690 -1.918 -3.865 1.00 0.00 C ATOM 1380 CD1 LEU A 152 1.811 -1.390 -4.755 1.00 0.00 C ATOM 1381 CD2 LEU A 152 0.237 -0.846 -2.888 1.00 0.00 C ATOM 0 H LEU A 152 -0.698 -1.011 -6.685 1.00 0.00 H new ATOM 0 HA LEU A 152 0.892 -3.297 -6.067 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -1.202 -1.586 -4.807 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -1.002 -3.197 -4.146 1.00 0.00 H new ATOM 0 HG LEU A 152 1.082 -2.766 -3.303 1.00 0.00 H new ATOM 0 HD11 LEU A 152 2.639 -1.050 -4.134 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.156 -2.185 -5.416 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.440 -0.557 -5.352 1.00 0.00 H new ATOM 0 HD21 LEU A 152 1.090 -0.506 -2.300 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -0.183 -0.005 -3.440 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -0.521 -1.258 -2.222 1.00 0.00 H new ATOM 1393 N LYS A 153 -2.217 -3.718 -6.974 1.00 0.00 N ATOM 1394 CA LYS A 153 -3.193 -4.708 -7.416 1.00 0.00 C ATOM 1395 C LYS A 153 -2.538 -5.684 -8.392 1.00 0.00 C ATOM 1396 O LYS A 153 -2.972 -6.828 -8.534 1.00 0.00 O ATOM 1397 CB LYS A 153 -4.391 -4.019 -8.077 1.00 0.00 C ATOM 1398 CG LYS A 153 -5.453 -4.984 -8.584 1.00 0.00 C ATOM 1399 CD LYS A 153 -6.110 -4.472 -9.856 1.00 0.00 C ATOM 1400 CE LYS A 153 -7.475 -3.865 -9.573 1.00 0.00 C ATOM 1401 NZ LYS A 153 -8.408 -4.036 -10.720 1.00 0.00 N1+ ATOM 0 H LYS A 153 -2.515 -2.750 -7.093 1.00 0.00 H new ATOM 0 HA LYS A 153 -3.550 -5.262 -6.548 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -4.847 -3.336 -7.360 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -4.035 -3.414 -8.911 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -5.001 -5.958 -8.773 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -6.211 -5.129 -7.815 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -5.468 -3.725 -10.323 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -6.215 -5.291 -10.567 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -7.902 -4.331 -8.685 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -7.362 -2.804 -9.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -9.327 -3.609 -10.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -8.013 -3.570 -11.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -8.537 -5.049 -10.914 1.00 0.00 H new ATOM 1415 N TYR A 154 -1.474 -5.223 -9.051 1.00 0.00 N ATOM 1416 CA TYR A 154 -0.736 -6.048 -10.001 1.00 0.00 C ATOM 1417 C TYR A 154 0.604 -6.481 -9.408 1.00 0.00 C ATOM 1418 O TYR A 154 1.523 -6.860 -10.134 1.00 0.00 O ATOM 1419 CB TYR A 154 -0.497 -5.281 -11.304 1.00 0.00 C ATOM 1420 CG TYR A 154 -1.740 -4.634 -11.869 1.00 0.00 C ATOM 1421 CD1 TYR A 154 -2.693 -5.386 -12.546 1.00 0.00 C ATOM 1422 CD2 TYR A 154 -1.958 -3.271 -11.730 1.00 0.00 C ATOM 1423 CE1 TYR A 154 -3.829 -4.795 -13.066 1.00 0.00 C ATOM 1424 CE2 TYR A 154 -3.090 -2.672 -12.245 1.00 0.00 C ATOM 1425 CZ TYR A 154 -4.023 -3.437 -12.914 1.00 0.00 C ATOM 1426 OH TYR A 154 -5.152 -2.845 -13.429 1.00 0.00 O ATOM 0 H TYR A 154 -1.105 -4.278 -8.942 1.00 0.00 H new ATOM 0 HA TYR A 154 -1.333 -6.935 -10.214 1.00 0.00 H new ATOM 0 HB2 TYR A 154 0.254 -4.511 -11.129 1.00 0.00 H new ATOM 0 HB3 TYR A 154 -0.085 -5.965 -12.046 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -2.543 -6.449 -12.668 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -1.229 -2.668 -11.209 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -4.561 -5.393 -13.589 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -3.244 -1.610 -12.125 1.00 0.00 H new ATOM 0 HH TYR A 154 -5.302 -1.985 -12.984 1.00 0.00 H new ATOM 1436 N SER A 155 0.703 -6.424 -8.082 1.00 0.00 N ATOM 1437 CA SER A 155 1.919 -6.807 -7.383 1.00 0.00 C ATOM 1438 C SER A 155 1.621 -7.931 -6.405 1.00 0.00 C ATOM 1439 O SER A 155 1.139 -7.695 -5.297 1.00 0.00 O ATOM 1440 CB SER A 155 2.508 -5.609 -6.641 1.00 0.00 C ATOM 1441 OG SER A 155 3.118 -4.704 -7.544 1.00 0.00 O ATOM 0 H SER A 155 -0.052 -6.114 -7.470 1.00 0.00 H new ATOM 0 HA SER A 155 2.648 -7.154 -8.115 1.00 0.00 H new ATOM 0 HB2 SER A 155 1.722 -5.099 -6.084 1.00 0.00 H new ATOM 0 HB3 SER A 155 3.243 -5.953 -5.913 1.00 0.00 H new ATOM 0 HG SER A 155 2.431 -4.135 -7.951 1.00 0.00 H new ATOM 1447 N VAL A 156 1.900 -9.152 -6.827 1.00 0.00 N ATOM 1448 CA VAL A 156 1.652 -10.315 -5.999 1.00 0.00 C ATOM 1449 C VAL A 156 2.877 -10.677 -5.166 1.00 0.00 C ATOM 1450 O VAL A 156 2.867 -11.661 -4.426 1.00 0.00 O ATOM 1451 CB VAL A 156 1.226 -11.514 -6.863 1.00 0.00 C ATOM 1452 CG1 VAL A 156 2.386 -12.014 -7.711 1.00 0.00 C ATOM 1453 CG2 VAL A 156 0.666 -12.630 -5.994 1.00 0.00 C ATOM 0 H VAL A 156 2.300 -9.362 -7.742 1.00 0.00 H new ATOM 0 HA VAL A 156 0.840 -10.066 -5.316 1.00 0.00 H new ATOM 0 HB VAL A 156 0.438 -11.182 -7.539 1.00 0.00 H new ATOM 0 HG11 VAL A 156 2.058 -12.862 -8.312 1.00 0.00 H new ATOM 0 HG12 VAL A 156 2.728 -11.214 -8.368 1.00 0.00 H new ATOM 0 HG13 VAL A 156 3.204 -12.325 -7.061 1.00 0.00 H new ATOM 0 HG21 VAL A 156 0.371 -13.469 -6.624 1.00 0.00 H new ATOM 0 HG22 VAL A 156 1.428 -12.958 -5.287 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -0.203 -12.264 -5.447 1.00 0.00 H new ATOM 1463 N VAL A 157 3.929 -9.868 -5.278 1.00 0.00 N ATOM 1464 CA VAL A 157 5.147 -10.102 -4.519 1.00 0.00 C ATOM 1465 C VAL A 157 4.857 -10.010 -3.027 1.00 0.00 C ATOM 1466 O VAL A 157 5.455 -10.720 -2.218 1.00 0.00 O ATOM 1467 CB VAL A 157 6.247 -9.089 -4.888 1.00 0.00 C ATOM 1468 CG1 VAL A 157 7.546 -9.423 -4.170 1.00 0.00 C ATOM 1469 CG2 VAL A 157 6.453 -9.051 -6.394 1.00 0.00 C ATOM 0 H VAL A 157 3.959 -9.049 -5.885 1.00 0.00 H new ATOM 0 HA VAL A 157 5.504 -11.102 -4.767 1.00 0.00 H new ATOM 0 HB VAL A 157 5.927 -8.099 -4.564 1.00 0.00 H new ATOM 0 HG11 VAL A 157 8.310 -8.696 -4.444 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.385 -9.391 -3.092 1.00 0.00 H new ATOM 0 HG13 VAL A 157 7.875 -10.421 -4.459 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.234 -8.330 -6.636 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.750 -10.039 -6.746 1.00 0.00 H new ATOM 0 HG23 VAL A 157 5.523 -8.757 -6.881 1.00 0.00 H new ATOM 1479 N LEU A 158 3.918 -9.136 -2.677 1.00 0.00 N ATOM 1480 CA LEU A 158 3.519 -8.946 -1.291 1.00 0.00 C ATOM 1481 C LEU A 158 2.094 -9.449 -1.099 1.00 0.00 C ATOM 1482 O LEU A 158 1.409 -9.770 -2.070 1.00 0.00 O ATOM 1483 CB LEU A 158 3.597 -7.464 -0.904 1.00 0.00 C ATOM 1484 CG LEU A 158 5.000 -6.845 -0.889 1.00 0.00 C ATOM 1485 CD1 LEU A 158 5.809 -7.366 0.290 1.00 0.00 C ATOM 1486 CD2 LEU A 158 5.725 -7.117 -2.199 1.00 0.00 C ATOM 0 H LEU A 158 3.418 -8.545 -3.341 1.00 0.00 H new ATOM 0 HA LEU A 158 4.199 -9.509 -0.651 1.00 0.00 H new ATOM 0 HB2 LEU A 158 2.978 -6.895 -1.598 1.00 0.00 H new ATOM 0 HB3 LEU A 158 3.158 -7.344 0.087 1.00 0.00 H new ATOM 0 HG LEU A 158 4.891 -5.766 -0.777 1.00 0.00 H new ATOM 0 HD11 LEU A 158 6.800 -6.913 0.280 1.00 0.00 H new ATOM 0 HD12 LEU A 158 5.303 -7.110 1.220 1.00 0.00 H new ATOM 0 HD13 LEU A 158 5.904 -8.449 0.215 1.00 0.00 H new ATOM 0 HD21 LEU A 158 6.718 -6.669 -2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 158 5.818 -8.193 -2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 158 5.159 -6.685 -3.024 1.00 0.00 H new ATOM 1498 N GLU A 159 1.638 -9.498 0.146 1.00 0.00 N ATOM 1499 CA GLU A 159 0.283 -9.943 0.429 1.00 0.00 C ATOM 1500 C GLU A 159 -0.622 -8.728 0.594 1.00 0.00 C ATOM 1501 O GLU A 159 -0.496 -7.979 1.552 1.00 0.00 O ATOM 1502 CB GLU A 159 0.261 -10.820 1.688 1.00 0.00 C ATOM 1503 CG GLU A 159 -1.102 -10.909 2.358 1.00 0.00 C ATOM 1504 CD GLU A 159 -2.162 -11.497 1.448 1.00 0.00 C ATOM 1505 OE1 GLU A 159 -1.805 -12.307 0.567 1.00 0.00 O ATOM 1506 OE2 GLU A 159 -3.349 -11.150 1.618 1.00 0.00 O1- ATOM 0 H GLU A 159 2.182 -9.237 0.968 1.00 0.00 H new ATOM 0 HA GLU A 159 -0.084 -10.545 -0.402 1.00 0.00 H new ATOM 0 HB2 GLU A 159 0.591 -11.825 1.424 1.00 0.00 H new ATOM 0 HB3 GLU A 159 0.982 -10.426 2.405 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -1.021 -11.519 3.257 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -1.412 -9.913 2.675 1.00 0.00 H new ATOM 1513 N LEU A 160 -1.517 -8.531 -0.361 1.00 0.00 N ATOM 1514 CA LEU A 160 -2.430 -7.394 -0.345 1.00 0.00 C ATOM 1515 C LEU A 160 -3.796 -7.790 0.200 1.00 0.00 C ATOM 1516 O LEU A 160 -4.237 -8.921 -0.012 1.00 0.00 O ATOM 1517 CB LEU A 160 -2.614 -6.887 -1.778 1.00 0.00 C ATOM 1518 CG LEU A 160 -1.614 -5.851 -2.285 1.00 0.00 C ATOM 1519 CD1 LEU A 160 -2.262 -4.476 -2.389 1.00 0.00 C ATOM 1520 CD2 LEU A 160 -0.368 -5.823 -1.414 1.00 0.00 C ATOM 0 H LEU A 160 -1.633 -9.149 -1.165 1.00 0.00 H new ATOM 0 HA LEU A 160 -2.004 -6.622 0.296 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -2.579 -7.746 -2.448 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -3.614 -6.460 -1.860 1.00 0.00 H new ATOM 0 HG LEU A 160 -1.301 -6.141 -3.288 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -1.530 -3.755 -2.752 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -3.102 -4.521 -3.083 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -2.619 -4.167 -1.407 1.00 0.00 H new ATOM 0 HD21 LEU A 160 0.327 -5.076 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -0.645 -5.569 -0.391 1.00 0.00 H new ATOM 0 HD23 LEU A 160 0.108 -6.803 -1.428 1.00 0.00 H new ATOM 1532 N ASN A 161 -4.507 -6.856 0.848 1.00 0.00 N ATOM 1533 CA ASN A 161 -5.851 -7.194 1.317 1.00 0.00 C ATOM 1534 C ASN A 161 -6.652 -7.478 0.078 1.00 0.00 C ATOM 1535 O ASN A 161 -6.288 -6.939 -0.966 1.00 0.00 O ATOM 1536 CB ASN A 161 -6.513 -6.062 2.106 1.00 0.00 C ATOM 1537 CG ASN A 161 -7.993 -6.303 2.343 1.00 0.00 C ATOM 1538 OD1 ASN A 161 -8.842 -5.794 1.610 1.00 0.00 O ATOM 1539 ND2 ASN A 161 -8.310 -7.081 3.372 1.00 0.00 N ATOM 0 H ASN A 161 -4.192 -5.907 1.050 1.00 0.00 H new ATOM 0 HA ASN A 161 -5.800 -8.042 2.000 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -6.009 -5.950 3.066 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -6.383 -5.124 1.566 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -9.289 -7.277 3.580 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -7.574 -7.482 3.954 1.00 0.00 H new ATOM 1546 N GLU A 162 -7.704 -8.303 0.239 1.00 0.00 N ATOM 1547 CA GLU A 162 -8.597 -8.797 -0.825 1.00 0.00 C ATOM 1548 C GLU A 162 -8.898 -7.837 -1.962 1.00 0.00 C ATOM 1549 O GLU A 162 -8.700 -8.188 -3.125 1.00 0.00 O ATOM 1550 CB GLU A 162 -9.914 -9.224 -0.189 1.00 0.00 C ATOM 1551 CG GLU A 162 -10.750 -10.094 -1.097 1.00 0.00 C ATOM 1552 CD GLU A 162 -12.200 -9.654 -1.164 1.00 0.00 C ATOM 1553 OE1 GLU A 162 -12.449 -8.489 -1.539 1.00 0.00 O ATOM 1554 OE2 GLU A 162 -13.084 -10.474 -0.843 1.00 0.00 O1- ATOM 0 H GLU A 162 -7.966 -8.660 1.158 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.051 -9.618 -1.291 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.707 -9.765 0.735 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -10.485 -8.336 0.082 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -10.324 -10.078 -2.100 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.704 -11.125 -0.747 1.00 0.00 H new ATOM 1561 N ASP A 163 -9.344 -6.642 -1.662 1.00 0.00 N ATOM 1562 CA ASP A 163 -9.622 -5.682 -2.721 1.00 0.00 C ATOM 1563 C ASP A 163 -8.323 -4.989 -3.059 1.00 0.00 C ATOM 1564 O ASP A 163 -8.294 -3.835 -3.488 1.00 0.00 O ATOM 1565 CB ASP A 163 -10.676 -4.668 -2.278 1.00 0.00 C ATOM 1566 CG ASP A 163 -12.082 -5.095 -2.653 1.00 0.00 C ATOM 1567 OD1 ASP A 163 -12.412 -5.058 -3.858 1.00 0.00 O ATOM 1568 OD2 ASP A 163 -12.852 -5.466 -1.743 1.00 0.00 O1- ATOM 0 H ASP A 163 -9.522 -6.308 -0.715 1.00 0.00 H new ATOM 0 HA ASP A 163 -10.021 -6.193 -3.597 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -10.616 -4.534 -1.198 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -10.460 -3.701 -2.732 1.00 0.00 H new ATOM 1573 N HIS A 164 -7.237 -5.709 -2.783 1.00 0.00 N ATOM 1574 CA HIS A 164 -5.900 -5.214 -2.957 1.00 0.00 C ATOM 1575 C HIS A 164 -5.806 -3.823 -2.390 1.00 0.00 C ATOM 1576 O HIS A 164 -5.007 -2.991 -2.822 1.00 0.00 O ATOM 1577 CB HIS A 164 -5.445 -5.317 -4.403 1.00 0.00 C ATOM 1578 CG HIS A 164 -5.296 -6.750 -4.809 1.00 0.00 C ATOM 1579 ND1 HIS A 164 -5.017 -7.161 -6.094 1.00 0.00 N ATOM 1580 CD2 HIS A 164 -5.391 -7.883 -4.064 1.00 0.00 C ATOM 1581 CE1 HIS A 164 -4.949 -8.481 -6.127 1.00 0.00 C ATOM 1582 NE2 HIS A 164 -5.171 -8.942 -4.909 1.00 0.00 N ATOM 0 H HIS A 164 -7.277 -6.664 -2.428 1.00 0.00 H new ATOM 0 HA HIS A 164 -5.203 -5.841 -2.401 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -6.167 -4.823 -5.053 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -4.495 -4.797 -4.529 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -5.600 -7.939 -3.006 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -4.746 -9.081 -7.002 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -5.178 -9.926 -4.640 1.00 0.00 H new ATOM 1591 N ARG A 165 -6.634 -3.610 -1.372 1.00 0.00 N ATOM 1592 CA ARG A 165 -6.675 -2.367 -0.669 1.00 0.00 C ATOM 1593 C ARG A 165 -5.618 -2.368 0.398 1.00 0.00 C ATOM 1594 O ARG A 165 -5.283 -1.309 0.930 1.00 0.00 O ATOM 1595 CB ARG A 165 -8.044 -2.141 -0.033 1.00 0.00 C ATOM 1596 CG ARG A 165 -9.162 -1.934 -1.036 1.00 0.00 C ATOM 1597 CD ARG A 165 -10.520 -2.124 -0.386 1.00 0.00 C ATOM 1598 NE ARG A 165 -11.137 -0.851 -0.022 1.00 0.00 N ATOM 1599 CZ ARG A 165 -12.157 -0.737 0.825 1.00 0.00 C ATOM 1600 NH1 ARG A 165 -12.676 -1.816 1.398 1.00 0.00 N1+ ATOM 1601 NH2 ARG A 165 -12.659 0.459 1.102 1.00 0.00 N ATOM 0 H ARG A 165 -7.291 -4.308 -1.023 1.00 0.00 H new ATOM 0 HA ARG A 165 -6.491 -1.560 -1.378 1.00 0.00 H new ATOM 0 HB2 ARG A 165 -8.287 -2.998 0.596 1.00 0.00 H new ATOM 0 HB3 ARG A 165 -7.990 -1.271 0.621 1.00 0.00 H new ATOM 0 HG2 ARG A 165 -9.095 -0.932 -1.459 1.00 0.00 H new ATOM 0 HG3 ARG A 165 -9.049 -2.637 -1.862 1.00 0.00 H new ATOM 0 HD2 ARG A 165 -11.177 -2.662 -1.069 1.00 0.00 H new ATOM 0 HD3 ARG A 165 -10.412 -2.742 0.505 1.00 0.00 H new ATOM 0 HE ARG A 165 -10.764 0.001 -0.442 1.00 0.00 H new ATOM 0 HH11 ARG A 165 -12.293 -2.738 1.190 1.00 0.00 H new ATOM 0 HH12 ARG A 165 -13.458 -1.723 2.047 1.00 0.00 H new ATOM 0 HH21 ARG A 165 -12.263 1.292 0.666 1.00 0.00 H new ATOM 0 HH22 ARG A 165 -13.441 0.546 1.751 1.00 0.00 H new ATOM 1615 N LYS A 166 -5.067 -3.548 0.736 1.00 0.00 N ATOM 1616 CA LYS A 166 -4.031 -3.533 1.781 1.00 0.00 C ATOM 1617 C LYS A 166 -2.777 -4.267 1.365 1.00 0.00 C ATOM 1618 O LYS A 166 -2.699 -4.806 0.267 1.00 0.00 O ATOM 1619 CB LYS A 166 -4.553 -4.087 3.106 1.00 0.00 C ATOM 1620 CG LYS A 166 -5.906 -3.519 3.512 1.00 0.00 C ATOM 1621 CD LYS A 166 -6.451 -4.194 4.761 1.00 0.00 C ATOM 1622 CE LYS A 166 -6.019 -3.464 6.022 1.00 0.00 C ATOM 1623 NZ LYS A 166 -6.644 -4.044 7.242 1.00 0.00 N1+ ATOM 0 H LYS A 166 -5.298 -4.458 0.337 1.00 0.00 H new ATOM 0 HA LYS A 166 -3.767 -2.485 1.925 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -4.631 -5.172 3.031 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -3.828 -3.873 3.891 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -5.812 -2.448 3.690 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -6.614 -3.645 2.693 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -7.539 -4.226 4.713 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -6.103 -5.226 4.799 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -4.934 -3.509 6.114 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -6.288 -2.411 5.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -6.324 -3.518 8.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -7.679 -3.978 7.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -6.367 -5.042 7.333 1.00 0.00 H new ATOM 1637 N VAL A 167 -1.798 -4.277 2.258 1.00 0.00 N ATOM 1638 CA VAL A 167 -0.543 -4.948 1.997 1.00 0.00 C ATOM 1639 C VAL A 167 0.082 -5.432 3.294 1.00 0.00 C ATOM 1640 O VAL A 167 0.788 -4.704 3.983 1.00 0.00 O ATOM 1641 CB VAL A 167 0.441 -4.055 1.211 1.00 0.00 C ATOM 1642 CG1 VAL A 167 0.527 -2.659 1.816 1.00 0.00 C ATOM 1643 CG2 VAL A 167 1.821 -4.695 1.130 1.00 0.00 C ATOM 0 H VAL A 167 -1.854 -3.825 3.171 1.00 0.00 H new ATOM 0 HA VAL A 167 -0.760 -5.812 1.370 1.00 0.00 H new ATOM 0 HB VAL A 167 0.054 -3.957 0.197 1.00 0.00 H new ATOM 0 HG11 VAL A 167 1.228 -2.055 1.240 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -0.458 -2.192 1.794 1.00 0.00 H new ATOM 0 HG13 VAL A 167 0.872 -2.730 2.847 1.00 0.00 H new ATOM 0 HG21 VAL A 167 2.492 -4.043 0.571 1.00 0.00 H new ATOM 0 HG22 VAL A 167 2.213 -4.842 2.136 1.00 0.00 H new ATOM 0 HG23 VAL A 167 1.746 -5.658 0.625 1.00 0.00 H new ATOM 1653 N ARG A 168 -0.202 -6.682 3.607 1.00 0.00 N ATOM 1654 CA ARG A 168 0.313 -7.308 4.820 1.00 0.00 C ATOM 1655 C ARG A 168 1.463 -8.254 4.490 1.00 0.00 C ATOM 1656 O ARG A 168 1.694 -8.582 3.327 1.00 0.00 O ATOM 1657 CB ARG A 168 -0.800 -8.071 5.537 1.00 0.00 C ATOM 1658 CG ARG A 168 -0.494 -8.378 6.993 1.00 0.00 C ATOM 1659 CD ARG A 168 -0.073 -9.826 7.186 1.00 0.00 C ATOM 1660 NE ARG A 168 0.673 -10.017 8.429 1.00 0.00 N ATOM 1661 CZ ARG A 168 0.797 -11.189 9.049 1.00 0.00 C ATOM 1662 NH1 ARG A 168 0.232 -12.279 8.544 1.00 0.00 N1+ ATOM 1663 NH2 ARG A 168 1.489 -11.271 10.176 1.00 0.00 N ATOM 0 H ARG A 168 -0.790 -7.291 3.037 1.00 0.00 H new ATOM 0 HA ARG A 168 0.685 -6.523 5.478 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -1.720 -7.488 5.484 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -0.985 -9.007 5.009 1.00 0.00 H new ATOM 0 HG2 ARG A 168 0.299 -7.718 7.345 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -1.374 -8.171 7.601 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -0.957 -10.463 7.192 1.00 0.00 H new ATOM 0 HD3 ARG A 168 0.541 -10.141 6.342 1.00 0.00 H new ATOM 0 HE ARG A 168 1.126 -9.204 8.846 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -0.301 -12.222 7.676 1.00 0.00 H new ATOM 0 HH12 ARG A 168 0.331 -13.174 9.024 1.00 0.00 H new ATOM 0 HH21 ARG A 168 1.926 -10.437 10.568 1.00 0.00 H new ATOM 0 HH22 ARG A 168 1.585 -12.168 10.652 1.00 0.00 H new ATOM 1677 N ARG A 169 2.185 -8.684 5.520 1.00 0.00 N ATOM 1678 CA ARG A 169 3.312 -9.589 5.335 1.00 0.00 C ATOM 1679 C ARG A 169 2.964 -10.996 5.811 1.00 0.00 C ATOM 1680 O ARG A 169 2.552 -11.191 6.954 1.00 0.00 O ATOM 1681 CB ARG A 169 4.537 -9.071 6.088 1.00 0.00 C ATOM 1682 CG ARG A 169 4.916 -7.644 5.723 1.00 0.00 C ATOM 1683 CD ARG A 169 4.548 -6.663 6.827 1.00 0.00 C ATOM 1684 NE ARG A 169 4.966 -7.134 8.146 1.00 0.00 N ATOM 1685 CZ ARG A 169 6.236 -7.227 8.533 1.00 0.00 C ATOM 1686 NH1 ARG A 169 7.216 -6.867 7.714 1.00 0.00 N1+ ATOM 1687 NH2 ARG A 169 6.527 -7.676 9.746 1.00 0.00 N ATOM 0 H ARG A 169 2.009 -8.420 6.490 1.00 0.00 H new ATOM 0 HA ARG A 169 3.541 -9.632 4.270 1.00 0.00 H new ATOM 0 HB2 ARG A 169 4.344 -9.124 7.159 1.00 0.00 H new ATOM 0 HB3 ARG A 169 5.383 -9.727 5.883 1.00 0.00 H new ATOM 0 HG2 ARG A 169 5.988 -7.590 5.531 1.00 0.00 H new ATOM 0 HG3 ARG A 169 4.412 -7.359 4.800 1.00 0.00 H new ATOM 0 HD2 ARG A 169 5.013 -5.698 6.623 1.00 0.00 H new ATOM 0 HD3 ARG A 169 3.470 -6.504 6.825 1.00 0.00 H new ATOM 0 HE ARG A 169 4.241 -7.408 8.809 1.00 0.00 H new ATOM 0 HH11 ARG A 169 6.998 -6.516 6.781 1.00 0.00 H new ATOM 0 HH12 ARG A 169 8.187 -6.941 8.017 1.00 0.00 H new ATOM 0 HH21 ARG A 169 5.778 -7.950 10.382 1.00 0.00 H new ATOM 0 HH22 ARG A 169 7.500 -7.748 10.043 1.00 0.00 H new ATOM 1701 N THR A 170 3.135 -11.972 4.927 1.00 0.00 N ATOM 1702 CA THR A 170 2.841 -13.362 5.257 1.00 0.00 C ATOM 1703 C THR A 170 4.048 -14.039 5.900 1.00 0.00 C ATOM 1704 O THR A 170 3.902 -14.998 6.657 1.00 0.00 O ATOM 1705 CB THR A 170 2.421 -14.128 4.001 1.00 0.00 C ATOM 1706 OG1 THR A 170 3.539 -14.373 3.167 1.00 0.00 O ATOM 1707 CG2 THR A 170 1.383 -13.400 3.175 1.00 0.00 C ATOM 0 H THR A 170 3.476 -11.827 3.977 1.00 0.00 H new ATOM 0 HA THR A 170 2.019 -13.372 5.973 1.00 0.00 H new ATOM 0 HB THR A 170 1.986 -15.060 4.362 1.00 0.00 H new ATOM 0 HG1 THR A 170 3.251 -14.865 2.370 1.00 0.00 H new ATOM 0 HG21 THR A 170 1.130 -13.998 2.300 1.00 0.00 H new ATOM 0 HG22 THR A 170 0.488 -13.239 3.776 1.00 0.00 H new ATOM 0 HG23 THR A 170 1.783 -12.438 2.854 1.00 0.00 H new ATOM 1715 N THR A 171 5.239 -13.538 5.591 1.00 0.00 N ATOM 1716 CA THR A 171 6.468 -14.098 6.138 1.00 0.00 C ATOM 1717 C THR A 171 7.394 -12.996 6.651 1.00 0.00 C ATOM 1718 O THR A 171 8.474 -12.773 6.102 1.00 0.00 O ATOM 1719 CB THR A 171 7.188 -14.929 5.074 1.00 0.00 C ATOM 1720 OG1 THR A 171 8.402 -15.452 5.582 1.00 0.00 O ATOM 1721 CG2 THR A 171 7.513 -14.141 3.823 1.00 0.00 C ATOM 0 H THR A 171 5.379 -12.745 4.965 1.00 0.00 H new ATOM 0 HA THR A 171 6.202 -14.740 6.977 1.00 0.00 H new ATOM 0 HB THR A 171 6.495 -15.729 4.812 1.00 0.00 H new ATOM 0 HG1 THR A 171 8.992 -14.714 5.843 1.00 0.00 H new ATOM 0 HG21 THR A 171 8.023 -14.787 3.108 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.591 -13.766 3.380 1.00 0.00 H new ATOM 0 HG23 THR A 171 8.160 -13.302 4.079 1.00 0.00 H new ATOM 1729 N PRO A 172 6.982 -12.288 7.716 1.00 0.00 N ATOM 1730 CA PRO A 172 7.779 -11.208 8.302 1.00 0.00 C ATOM 1731 C PRO A 172 8.911 -11.733 9.175 1.00 0.00 C ATOM 1732 O PRO A 172 8.770 -12.761 9.837 1.00 0.00 O ATOM 1733 CB PRO A 172 6.762 -10.451 9.148 1.00 0.00 C ATOM 1734 CG PRO A 172 5.781 -11.491 9.569 1.00 0.00 C ATOM 1735 CD PRO A 172 5.708 -12.484 8.437 1.00 0.00 C ATOM 0 HA PRO A 172 8.267 -10.597 7.542 1.00 0.00 H new ATOM 0 HB2 PRO A 172 7.235 -9.979 10.009 1.00 0.00 H new ATOM 0 HB3 PRO A 172 6.280 -9.659 8.575 1.00 0.00 H new ATOM 0 HG2 PRO A 172 6.100 -11.976 10.492 1.00 0.00 H new ATOM 0 HG3 PRO A 172 4.804 -11.049 9.762 1.00 0.00 H new ATOM 0 HD2 PRO A 172 5.610 -13.505 8.806 1.00 0.00 H new ATOM 0 HD3 PRO A 172 4.850 -12.294 7.792 1.00 0.00 H new ATOM 1743 N VAL A 173 10.037 -11.028 9.167 1.00 0.00 N ATOM 1744 CA VAL A 173 11.190 -11.418 9.943 1.00 0.00 C ATOM 1745 C VAL A 173 11.441 -10.428 11.074 1.00 0.00 C ATOM 1746 O VAL A 173 11.140 -9.246 10.940 1.00 0.00 O ATOM 1747 CB VAL A 173 12.434 -11.508 9.051 1.00 0.00 C ATOM 1748 CG1 VAL A 173 12.572 -12.908 8.490 1.00 0.00 C ATOM 1749 CG2 VAL A 173 12.384 -10.489 7.922 1.00 0.00 C ATOM 0 H VAL A 173 10.168 -10.175 8.623 1.00 0.00 H new ATOM 0 HA VAL A 173 10.988 -12.399 10.373 1.00 0.00 H new ATOM 0 HB VAL A 173 13.305 -11.281 9.665 1.00 0.00 H new ATOM 0 HG11 VAL A 173 13.459 -12.961 7.858 1.00 0.00 H new ATOM 0 HG12 VAL A 173 12.667 -13.621 9.309 1.00 0.00 H new ATOM 0 HG13 VAL A 173 11.690 -13.151 7.898 1.00 0.00 H new ATOM 0 HG21 VAL A 173 13.281 -10.580 7.309 1.00 0.00 H new ATOM 0 HG22 VAL A 173 11.504 -10.671 7.306 1.00 0.00 H new ATOM 0 HG23 VAL A 173 12.332 -9.484 8.341 1.00 0.00 H new ATOM 1759 N PRO A 174 11.989 -10.897 12.208 1.00 0.00 N ATOM 1760 CA PRO A 174 12.264 -10.033 13.363 1.00 0.00 C ATOM 1761 C PRO A 174 13.156 -8.851 13.000 1.00 0.00 C ATOM 1762 O PRO A 174 14.016 -8.954 12.125 1.00 0.00 O ATOM 1763 CB PRO A 174 12.983 -10.962 14.346 1.00 0.00 C ATOM 1764 CG PRO A 174 12.565 -12.337 13.950 1.00 0.00 C ATOM 1765 CD PRO A 174 12.370 -12.297 12.461 1.00 0.00 C ATOM 0 HA PRO A 174 11.352 -9.592 13.766 1.00 0.00 H new ATOM 0 HB2 PRO A 174 14.065 -10.844 14.282 1.00 0.00 H new ATOM 0 HB3 PRO A 174 12.699 -10.744 15.376 1.00 0.00 H new ATOM 0 HG2 PRO A 174 13.324 -13.070 14.225 1.00 0.00 H new ATOM 0 HG3 PRO A 174 11.644 -12.626 14.457 1.00 0.00 H new ATOM 0 HD2 PRO A 174 13.281 -12.569 11.928 1.00 0.00 H new ATOM 0 HD3 PRO A 174 11.593 -12.990 12.138 1.00 0.00 H new ATOM 1773 N LEU A 175 12.939 -7.724 13.673 1.00 0.00 N ATOM 1774 CA LEU A 175 13.693 -6.529 13.435 1.00 0.00 C ATOM 1775 C LEU A 175 14.311 -6.023 14.735 1.00 0.00 C ATOM 1776 O LEU A 175 15.476 -5.631 14.781 1.00 0.00 O ATOM 1777 CB LEU A 175 12.780 -5.431 12.872 1.00 0.00 C ATOM 1778 CG LEU A 175 11.271 -5.704 12.819 1.00 0.00 C ATOM 1779 CD1 LEU A 175 10.976 -6.830 11.859 1.00 0.00 C ATOM 1780 CD2 LEU A 175 10.680 -5.984 14.198 1.00 0.00 C ATOM 0 H LEU A 175 12.229 -7.629 14.399 1.00 0.00 H new ATOM 0 HA LEU A 175 14.480 -6.763 12.719 1.00 0.00 H new ATOM 0 HB2 LEU A 175 12.935 -4.531 13.466 1.00 0.00 H new ATOM 0 HB3 LEU A 175 13.114 -5.206 11.859 1.00 0.00 H new ATOM 0 HG LEU A 175 10.788 -4.797 12.455 1.00 0.00 H new ATOM 0 HD11 LEU A 175 9.902 -7.013 11.832 1.00 0.00 H new ATOM 0 HD12 LEU A 175 11.323 -6.559 10.862 1.00 0.00 H new ATOM 0 HD13 LEU A 175 11.489 -7.733 12.189 1.00 0.00 H new ATOM 0 HD21 LEU A 175 9.610 -6.171 14.104 1.00 0.00 H new ATOM 0 HD22 LEU A 175 11.165 -6.859 14.631 1.00 0.00 H new ATOM 0 HD23 LEU A 175 10.843 -5.122 14.845 1.00 0.00 H new ATOM 1792 N PHE A 176 13.504 -6.032 15.786 1.00 0.00 N ATOM 1793 CA PHE A 176 13.920 -5.564 17.088 1.00 0.00 C ATOM 1794 C PHE A 176 13.262 -6.406 18.167 1.00 0.00 C ATOM 1795 O PHE A 176 12.080 -6.242 18.471 1.00 0.00 O ATOM 1796 CB PHE A 176 13.485 -4.105 17.233 1.00 0.00 C ATOM 1797 CG PHE A 176 12.258 -3.759 16.425 1.00 0.00 C ATOM 1798 CD1 PHE A 176 12.365 -3.345 15.104 1.00 0.00 C ATOM 1799 CD2 PHE A 176 10.993 -3.874 16.982 1.00 0.00 C ATOM 1800 CE1 PHE A 176 11.236 -3.055 14.358 1.00 0.00 C ATOM 1801 CE2 PHE A 176 9.863 -3.585 16.240 1.00 0.00 C ATOM 1802 CZ PHE A 176 9.985 -3.177 14.926 1.00 0.00 C ATOM 0 H PHE A 176 12.541 -6.366 15.753 1.00 0.00 H new ATOM 0 HA PHE A 176 15.002 -5.645 17.191 1.00 0.00 H new ATOM 0 HB2 PHE A 176 13.289 -3.896 18.285 1.00 0.00 H new ATOM 0 HB3 PHE A 176 14.306 -3.457 16.927 1.00 0.00 H new ATOM 0 HD1 PHE A 176 13.342 -3.248 14.653 1.00 0.00 H new ATOM 0 HD2 PHE A 176 10.889 -4.193 18.008 1.00 0.00 H new ATOM 0 HE1 PHE A 176 11.334 -2.733 13.332 1.00 0.00 H new ATOM 0 HE2 PHE A 176 8.885 -3.678 16.688 1.00 0.00 H new ATOM 0 HZ PHE A 176 9.103 -2.954 14.345 1.00 0.00 H new ATOM 1812 N PRO A 177 14.028 -7.322 18.754 1.00 0.00 N ATOM 1813 CA PRO A 177 13.563 -8.224 19.808 1.00 0.00 C ATOM 1814 C PRO A 177 13.416 -7.534 21.159 1.00 0.00 C ATOM 1815 O PRO A 177 12.700 -8.013 22.037 1.00 0.00 O ATOM 1816 CB PRO A 177 14.657 -9.308 19.831 1.00 0.00 C ATOM 1817 CG PRO A 177 15.416 -9.074 18.566 1.00 0.00 C ATOM 1818 CD PRO A 177 15.426 -7.597 18.431 1.00 0.00 C ATOM 0 HA PRO A 177 12.564 -8.616 19.614 1.00 0.00 H new ATOM 0 HB2 PRO A 177 15.299 -9.210 20.707 1.00 0.00 H new ATOM 0 HB3 PRO A 177 14.228 -10.309 19.861 1.00 0.00 H new ATOM 0 HG2 PRO A 177 16.427 -9.478 18.625 1.00 0.00 H new ATOM 0 HG3 PRO A 177 14.931 -9.551 17.714 1.00 0.00 H new ATOM 0 HD2 PRO A 177 16.119 -7.117 19.122 1.00 0.00 H new ATOM 0 HD3 PRO A 177 15.698 -7.269 17.428 1.00 0.00 H new ATOM 1826 N ASN A 178 14.114 -6.412 21.327 1.00 0.00 N ATOM 1827 CA ASN A 178 14.074 -5.672 22.581 1.00 0.00 C ATOM 1828 C ASN A 178 13.133 -4.484 22.487 1.00 0.00 C ATOM 1829 O ASN A 178 12.572 -4.042 23.490 1.00 0.00 O ATOM 1830 CB ASN A 178 15.477 -5.196 22.961 1.00 0.00 C ATOM 1831 CG ASN A 178 15.701 -5.198 24.460 1.00 0.00 C ATOM 1832 OD1 ASN A 178 14.920 -5.775 25.216 1.00 0.00 O ATOM 1833 ND2 ASN A 178 16.774 -4.550 24.898 1.00 0.00 N ATOM 0 H ASN A 178 14.712 -5.999 20.611 1.00 0.00 H new ATOM 0 HA ASN A 178 13.701 -6.344 23.354 1.00 0.00 H new ATOM 0 HB2 ASN A 178 16.217 -5.839 22.485 1.00 0.00 H new ATOM 0 HB3 ASN A 178 15.633 -4.189 22.574 1.00 0.00 H new ATOM 0 HD21 ASN A 178 16.977 -4.517 25.897 1.00 0.00 H new ATOM 0 HD22 ASN A 178 17.395 -4.085 24.235 1.00 0.00 H new ATOM 1840 N GLU A 179 12.966 -3.964 21.279 1.00 0.00 N ATOM 1841 CA GLU A 179 12.093 -2.818 21.069 1.00 0.00 C ATOM 1842 C GLU A 179 10.630 -3.198 21.252 1.00 0.00 C ATOM 1843 O GLU A 179 9.782 -2.346 21.519 1.00 0.00 O ATOM 1844 CB GLU A 179 12.320 -2.255 19.678 1.00 0.00 C ATOM 1845 CG GLU A 179 11.415 -1.084 19.327 1.00 0.00 C ATOM 1846 CD GLU A 179 12.170 0.063 18.683 1.00 0.00 C ATOM 1847 OE1 GLU A 179 13.028 0.665 19.362 1.00 0.00 O ATOM 1848 OE2 GLU A 179 11.903 0.360 17.500 1.00 0.00 O1- ATOM 0 H GLU A 179 13.420 -4.314 20.435 1.00 0.00 H new ATOM 0 HA GLU A 179 12.334 -2.059 21.813 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.359 -1.936 19.592 1.00 0.00 H new ATOM 0 HB3 GLU A 179 12.169 -3.049 18.947 1.00 0.00 H new ATOM 0 HG2 GLU A 179 10.632 -1.425 18.649 1.00 0.00 H new ATOM 0 HG3 GLU A 179 10.921 -0.727 20.231 1.00 0.00 H new ATOM 1855 N ASN A 180 10.347 -4.480 21.105 1.00 0.00 N ATOM 1856 CA ASN A 180 8.989 -4.990 21.251 1.00 0.00 C ATOM 1857 C ASN A 180 8.585 -5.045 22.724 1.00 0.00 C ATOM 1858 O ASN A 180 8.339 -6.119 23.274 1.00 0.00 O ATOM 1859 CB ASN A 180 8.873 -6.379 20.616 1.00 0.00 C ATOM 1860 CG ASN A 180 8.175 -6.343 19.270 1.00 0.00 C ATOM 1861 OD1 ASN A 180 7.371 -7.219 18.951 1.00 0.00 O ATOM 1862 ND2 ASN A 180 8.480 -5.326 18.471 1.00 0.00 N ATOM 0 H ASN A 180 11.042 -5.193 20.883 1.00 0.00 H new ATOM 0 HA ASN A 180 8.311 -4.310 20.736 1.00 0.00 H new ATOM 0 HB2 ASN A 180 9.869 -6.804 20.494 1.00 0.00 H new ATOM 0 HB3 ASN A 180 8.325 -7.039 21.289 1.00 0.00 H new ATOM 0 HD21 ASN A 180 8.042 -5.249 17.553 1.00 0.00 H new ATOM 0 HD22 ASN A 180 9.152 -4.622 18.776 1.00 0.00 H new ATOM 1869 N LEU A 181 8.522 -3.879 23.357 1.00 0.00 N ATOM 1870 CA LEU A 181 8.151 -3.792 24.764 1.00 0.00 C ATOM 1871 C LEU A 181 6.652 -4.034 24.959 1.00 0.00 C ATOM 1872 O LEU A 181 6.258 -4.865 25.778 1.00 0.00 O ATOM 1873 CB LEU A 181 8.546 -2.427 25.336 1.00 0.00 C ATOM 1874 CG LEU A 181 8.054 -2.148 26.758 1.00 0.00 C ATOM 1875 CD1 LEU A 181 8.980 -1.169 27.461 1.00 0.00 C ATOM 1876 CD2 LEU A 181 6.630 -1.615 26.733 1.00 0.00 C ATOM 0 H LEU A 181 8.723 -2.981 22.918 1.00 0.00 H new ATOM 0 HA LEU A 181 8.691 -4.571 25.302 1.00 0.00 H new ATOM 0 HB2 LEU A 181 9.633 -2.346 25.323 1.00 0.00 H new ATOM 0 HB3 LEU A 181 8.161 -1.649 24.676 1.00 0.00 H new ATOM 0 HG LEU A 181 8.061 -3.085 27.315 1.00 0.00 H new ATOM 0 HD11 LEU A 181 8.614 -0.983 28.471 1.00 0.00 H new ATOM 0 HD12 LEU A 181 9.984 -1.590 27.511 1.00 0.00 H new ATOM 0 HD13 LEU A 181 9.007 -0.231 26.906 1.00 0.00 H new ATOM 0 HD21 LEU A 181 6.296 -1.422 27.752 1.00 0.00 H new ATOM 0 HD22 LEU A 181 6.598 -0.689 26.159 1.00 0.00 H new ATOM 0 HD23 LEU A 181 5.974 -2.352 26.269 1.00 0.00 H new ATOM 1888 N PRO A 182 5.791 -3.316 24.212 1.00 0.00 N ATOM 1889 CA PRO A 182 4.338 -3.473 24.325 1.00 0.00 C ATOM 1890 C PRO A 182 3.838 -4.772 23.699 1.00 0.00 C ATOM 1891 O PRO A 182 2.688 -5.163 23.902 1.00 0.00 O ATOM 1892 CB PRO A 182 3.793 -2.267 23.562 1.00 0.00 C ATOM 1893 CG PRO A 182 4.845 -1.952 22.558 1.00 0.00 C ATOM 1894 CD PRO A 182 6.158 -2.298 23.206 1.00 0.00 C ATOM 0 HA PRO A 182 4.015 -3.521 25.365 1.00 0.00 H new ATOM 0 HB2 PRO A 182 2.843 -2.498 23.081 1.00 0.00 H new ATOM 0 HB3 PRO A 182 3.616 -1.423 24.229 1.00 0.00 H new ATOM 0 HG2 PRO A 182 4.697 -2.529 21.645 1.00 0.00 H new ATOM 0 HG3 PRO A 182 4.814 -0.899 22.278 1.00 0.00 H new ATOM 0 HD2 PRO A 182 6.872 -2.690 22.481 1.00 0.00 H new ATOM 0 HD3 PRO A 182 6.619 -1.425 23.668 1.00 0.00 H new ATOM 1902 N SER A 183 4.705 -5.433 22.931 1.00 0.00 N ATOM 1903 CA SER A 183 4.360 -6.682 22.266 1.00 0.00 C ATOM 1904 C SER A 183 3.544 -7.599 23.176 1.00 0.00 C ATOM 1905 O SER A 183 2.734 -8.389 22.645 1.00 0.00 O ATOM 1906 CB SER A 183 5.628 -7.403 21.806 1.00 0.00 C ATOM 1907 OG SER A 183 5.330 -8.701 21.323 1.00 0.00 O ATOM 1908 OXT SER A 183 3.724 -7.520 24.409 1.00 0.00 O ATOM 0 H SER A 183 5.659 -5.117 22.756 1.00 0.00 H new ATOM 0 HA SER A 183 3.747 -6.435 21.399 1.00 0.00 H new ATOM 0 HB2 SER A 183 6.116 -6.823 21.022 1.00 0.00 H new ATOM 0 HB3 SER A 183 6.332 -7.473 22.636 1.00 0.00 H new ATOM 0 HG SER A 183 6.157 -9.140 21.034 1.00 0.00 H new TER 1914 SER A 183