USER MOD reduce.3.24.130724 H: found=0, std=0, add=1152, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1145 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 Single : A 4 SER OG : rot 180:sc= 0.0755 USER MOD Single : A 6 SER OG : rot 180:sc= 0.0784 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.0788 K(o=-0.079,f=-0.68) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : A 26 LYS NZ :NH3+ -152:sc= 0.351 (180deg=-0.834!) USER MOD Single : A 27 GLN : amide:sc= -0.319 K(o=-0.32,f=-1) USER MOD Single : A 31 MET CE :methyl 174:sc= 0 (180deg=-0.0467) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.0669 X(o=-0.067,f=-0.32) USER MOD Single : A 42 GLN : amide:sc= -0.392 X(o=-0.39,f=-0.39) USER MOD Single : A 56 ASN : amide:sc= 0.858 K(o=0.86,f=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -51:sc= 0.329 USER MOD Single : A 68 MET CE :methyl -177:sc= 0 (180deg=-0.00448) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 75 MET CE :methyl 166:sc= -0.186 (180deg=-0.495) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot -26:sc= 0.0565 USER MOD Single : A 80 GLN : amide:sc=-0.00232 X(o=-0.0023,f=-0.059) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0431 USER MOD Single : A 88 MET CE :methyl -178:sc= -0.17 (180deg=-0.18) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 HIS :FLIP no HD1:sc= -0.49 F(o=-1.5,f=-0.49) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 106 HIS : no HE2:sc= -0.202 K(o=-0.2,f=-1.3) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc=-0.000865 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ 157:sc= -0.0523 (180deg=-0.778) USER MOD Single : A 126 THR OG1 : rot 82:sc= 1.09 USER MOD Single : A 131 HIS : no HD1:sc= -0.286 X(o=-0.29,f=0) USER MOD Single : A 132 HIS : no HE2:sc= -0.58 X(o=-0.58,f=-0.65) USER MOD Single : A 134 HIS : no HD1:sc= -0.473 X(o=-0.47,f=-0.81) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 -35.592 -1.825 -67.343 1.00 0.00 N ATOM 2 CA PRO A 1 -35.658 -0.740 -66.348 1.00 0.00 C ATOM 3 C PRO A 1 -34.257 -0.278 -65.935 1.00 0.00 C ATOM 4 O PRO A 1 -33.295 -1.031 -66.063 1.00 0.00 O ATOM 5 CB PRO A 1 -36.419 -1.327 -65.150 1.00 0.00 C ATOM 6 CG PRO A 1 -36.050 -2.817 -65.194 1.00 0.00 C ATOM 7 CD PRO A 1 -35.934 -3.101 -66.694 1.00 0.00 C ATOM 0 H2 PRO A 1 -34.656 -1.876 -67.746 1.00 0.00 H new ATOM 0 H3 PRO A 1 -36.237 -1.637 -68.110 1.00 0.00 H new ATOM 0 HA PRO A 1 -36.158 0.141 -66.752 1.00 0.00 H new ATOM 0 HB2 PRO A 1 -36.112 -0.864 -64.212 1.00 0.00 H new ATOM 0 HB3 PRO A 1 -37.494 -1.176 -65.243 1.00 0.00 H new ATOM 0 HG2 PRO A 1 -35.114 -3.016 -64.672 1.00 0.00 H new ATOM 0 HG3 PRO A 1 -36.815 -3.436 -64.724 1.00 0.00 H new ATOM 0 HD2 PRO A 1 -35.167 -3.851 -66.887 1.00 0.00 H new ATOM 0 HD3 PRO A 1 -36.871 -3.495 -67.086 1.00 0.00 H new ATOM 15 N ALA A 2 -34.142 0.963 -65.459 1.00 0.00 N ATOM 16 CA ALA A 2 -32.906 1.584 -64.999 1.00 0.00 C ATOM 17 C ALA A 2 -33.270 2.515 -63.840 1.00 0.00 C ATOM 18 O ALA A 2 -34.447 2.842 -63.672 1.00 0.00 O ATOM 19 CB ALA A 2 -32.253 2.362 -66.148 1.00 0.00 C ATOM 0 H ALA A 2 -34.945 1.587 -65.382 1.00 0.00 H new ATOM 0 HA ALA A 2 -32.189 0.834 -64.665 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -31.330 2.823 -65.797 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -32.029 1.680 -66.968 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -32.936 3.137 -66.497 1.00 0.00 H new ATOM 25 N ALA A 3 -32.283 2.914 -63.040 1.00 0.00 N ATOM 26 CA ALA A 3 -32.427 3.803 -61.896 1.00 0.00 C ATOM 27 C ALA A 3 -31.057 4.419 -61.600 1.00 0.00 C ATOM 28 O ALA A 3 -30.054 4.013 -62.190 1.00 0.00 O ATOM 29 CB ALA A 3 -32.925 3.009 -60.679 1.00 0.00 C ATOM 0 H ALA A 3 -31.319 2.611 -63.181 1.00 0.00 H new ATOM 0 HA ALA A 3 -33.152 4.588 -62.112 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -33.031 3.679 -59.826 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -33.891 2.559 -60.909 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -32.207 2.225 -60.438 1.00 0.00 H new ATOM 35 N SER A 4 -31.020 5.418 -60.723 1.00 0.00 N ATOM 36 CA SER A 4 -29.798 6.095 -60.316 1.00 0.00 C ATOM 37 C SER A 4 -29.019 5.208 -59.329 1.00 0.00 C ATOM 38 O SER A 4 -29.634 4.374 -58.657 1.00 0.00 O ATOM 39 CB SER A 4 -30.193 7.425 -59.657 1.00 0.00 C ATOM 40 OG SER A 4 -31.314 7.264 -58.800 1.00 0.00 O ATOM 0 H SER A 4 -31.856 5.785 -60.268 1.00 0.00 H new ATOM 0 HA SER A 4 -29.156 6.286 -61.176 1.00 0.00 H new ATOM 0 HB2 SER A 4 -29.350 7.815 -59.087 1.00 0.00 H new ATOM 0 HB3 SER A 4 -30.424 8.160 -60.428 1.00 0.00 H new ATOM 0 HG SER A 4 -31.541 8.126 -58.393 1.00 0.00 H new ATOM 46 N PRO A 5 -27.692 5.380 -59.202 1.00 0.00 N ATOM 47 CA PRO A 5 -26.899 4.591 -58.271 1.00 0.00 C ATOM 48 C PRO A 5 -27.189 5.031 -56.828 1.00 0.00 C ATOM 49 O PRO A 5 -27.742 6.108 -56.586 1.00 0.00 O ATOM 50 CB PRO A 5 -25.442 4.855 -58.664 1.00 0.00 C ATOM 51 CG PRO A 5 -25.487 6.270 -59.241 1.00 0.00 C ATOM 52 CD PRO A 5 -26.850 6.317 -59.932 1.00 0.00 C ATOM 0 HA PRO A 5 -27.130 3.527 -58.317 1.00 0.00 H new ATOM 0 HB2 PRO A 5 -24.775 4.792 -57.804 1.00 0.00 H new ATOM 0 HB3 PRO A 5 -25.085 4.132 -59.398 1.00 0.00 H new ATOM 0 HG2 PRO A 5 -25.404 7.027 -58.461 1.00 0.00 H new ATOM 0 HG3 PRO A 5 -24.672 6.445 -59.943 1.00 0.00 H new ATOM 0 HD2 PRO A 5 -27.269 7.323 -59.905 1.00 0.00 H new ATOM 0 HD3 PRO A 5 -26.767 6.034 -60.981 1.00 0.00 H new ATOM 60 N SER A 6 -26.828 4.186 -55.865 1.00 0.00 N ATOM 61 CA SER A 6 -27.014 4.451 -54.448 1.00 0.00 C ATOM 62 C SER A 6 -25.918 5.403 -53.939 1.00 0.00 C ATOM 63 O SER A 6 -24.929 5.668 -54.626 1.00 0.00 O ATOM 64 CB SER A 6 -27.041 3.106 -53.704 1.00 0.00 C ATOM 65 OG SER A 6 -26.066 2.203 -54.202 1.00 0.00 O ATOM 0 H SER A 6 -26.391 3.284 -56.055 1.00 0.00 H new ATOM 0 HA SER A 6 -27.962 4.956 -54.264 1.00 0.00 H new ATOM 0 HB2 SER A 6 -26.868 3.276 -52.641 1.00 0.00 H new ATOM 0 HB3 SER A 6 -28.031 2.659 -53.799 1.00 0.00 H new ATOM 0 HG SER A 6 -26.114 1.361 -53.702 1.00 0.00 H new ATOM 71 N ALA A 7 -26.078 5.918 -52.716 1.00 0.00 N ATOM 72 CA ALA A 7 -25.140 6.829 -52.078 1.00 0.00 C ATOM 73 C ALA A 7 -24.986 6.393 -50.625 1.00 0.00 C ATOM 74 O ALA A 7 -25.982 6.263 -49.919 1.00 0.00 O ATOM 75 CB ALA A 7 -25.676 8.261 -52.165 1.00 0.00 C ATOM 0 H ALA A 7 -26.887 5.703 -52.132 1.00 0.00 H new ATOM 0 HA ALA A 7 -24.170 6.804 -52.575 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -24.973 8.943 -51.687 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -25.798 8.541 -53.211 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -26.640 8.320 -51.659 1.00 0.00 H new ATOM 81 N LEU A 8 -23.752 6.144 -50.184 1.00 0.00 N ATOM 82 CA LEU A 8 -23.402 5.712 -48.831 1.00 0.00 C ATOM 83 C LEU A 8 -22.105 6.421 -48.433 1.00 0.00 C ATOM 84 O LEU A 8 -21.507 7.110 -49.265 1.00 0.00 O ATOM 85 CB LEU A 8 -23.227 4.180 -48.798 1.00 0.00 C ATOM 86 CG LEU A 8 -24.523 3.378 -49.040 1.00 0.00 C ATOM 87 CD1 LEU A 8 -24.186 1.895 -49.226 1.00 0.00 C ATOM 88 CD2 LEU A 8 -25.513 3.524 -47.877 1.00 0.00 C ATOM 0 H LEU A 8 -22.935 6.242 -50.786 1.00 0.00 H new ATOM 0 HA LEU A 8 -24.192 5.969 -48.126 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -22.493 3.895 -49.552 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -22.815 3.896 -47.830 1.00 0.00 H new ATOM 0 HG LEU A 8 -24.993 3.778 -49.939 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -25.104 1.332 -49.397 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -23.523 1.777 -50.083 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -23.691 1.519 -48.331 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -26.411 2.944 -48.089 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -25.053 3.158 -46.959 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -25.780 4.574 -47.756 1.00 0.00 H new ATOM 100 N LYS A 9 -21.691 6.329 -47.164 1.00 0.00 N ATOM 101 CA LYS A 9 -20.466 6.944 -46.648 1.00 0.00 C ATOM 102 C LYS A 9 -19.934 6.075 -45.510 1.00 0.00 C ATOM 103 O LYS A 9 -20.725 5.520 -44.747 1.00 0.00 O ATOM 104 CB LYS A 9 -20.714 8.370 -46.106 1.00 0.00 C ATOM 105 CG LYS A 9 -21.046 9.436 -47.165 1.00 0.00 C ATOM 106 CD LYS A 9 -22.557 9.624 -47.394 1.00 0.00 C ATOM 107 CE LYS A 9 -22.857 10.262 -48.757 1.00 0.00 C ATOM 108 NZ LYS A 9 -22.312 11.635 -48.872 1.00 0.00 N ATOM 0 H LYS A 9 -22.210 5.814 -46.453 1.00 0.00 H new ATOM 0 HA LYS A 9 -19.751 7.017 -47.468 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -21.533 8.329 -45.388 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -19.827 8.691 -45.559 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -20.612 10.388 -46.860 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -20.575 9.159 -48.108 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -23.057 8.657 -47.328 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -22.969 10.250 -46.602 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -22.436 9.640 -49.547 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -23.935 10.288 -48.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -22.541 12.022 -49.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -22.733 12.238 -48.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -21.279 11.610 -48.751 1.00 0.00 H new ATOM 122 N GLY A 10 -18.613 6.025 -45.359 1.00 0.00 N ATOM 123 CA GLY A 10 -17.912 5.267 -44.337 1.00 0.00 C ATOM 124 C GLY A 10 -16.421 5.454 -44.583 1.00 0.00 C ATOM 125 O GLY A 10 -15.958 5.180 -45.688 1.00 0.00 O ATOM 0 H GLY A 10 -17.979 6.535 -45.974 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -18.185 5.618 -43.342 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -18.181 4.212 -44.388 1.00 0.00 H new ATOM 129 N VAL A 11 -15.696 6.021 -43.620 1.00 0.00 N ATOM 130 CA VAL A 11 -14.259 6.261 -43.689 1.00 0.00 C ATOM 131 C VAL A 11 -13.748 5.980 -42.276 1.00 0.00 C ATOM 132 O VAL A 11 -14.041 6.753 -41.362 1.00 0.00 O ATOM 133 CB VAL A 11 -13.934 7.700 -44.161 1.00 0.00 C ATOM 134 CG1 VAL A 11 -12.423 7.855 -44.397 1.00 0.00 C ATOM 135 CG2 VAL A 11 -14.663 8.101 -45.454 1.00 0.00 C ATOM 0 H VAL A 11 -16.108 6.336 -42.742 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.772 5.621 -44.425 1.00 0.00 H new ATOM 0 HB VAL A 11 -14.280 8.357 -43.363 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.209 8.871 -44.728 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.887 7.656 -43.469 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -12.100 7.148 -45.161 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -14.388 9.120 -45.725 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -14.378 7.422 -46.258 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -15.740 8.045 -45.297 1.00 0.00 H new ATOM 145 N SER A 12 -13.009 4.889 -42.081 1.00 0.00 N ATOM 146 CA SER A 12 -12.454 4.454 -40.801 1.00 0.00 C ATOM 147 C SER A 12 -11.281 5.312 -40.312 1.00 0.00 C ATOM 148 O SER A 12 -10.176 4.820 -40.113 1.00 0.00 O ATOM 149 CB SER A 12 -12.153 2.953 -40.894 1.00 0.00 C ATOM 150 OG SER A 12 -13.296 2.249 -41.352 1.00 0.00 O ATOM 0 H SER A 12 -12.770 4.257 -42.845 1.00 0.00 H new ATOM 0 HA SER A 12 -13.194 4.608 -40.015 1.00 0.00 H new ATOM 0 HB2 SER A 12 -11.317 2.784 -41.573 1.00 0.00 H new ATOM 0 HB3 SER A 12 -11.852 2.574 -39.917 1.00 0.00 H new ATOM 0 HG SER A 12 -13.090 1.293 -41.409 1.00 0.00 H new ATOM 156 N GLN A 13 -11.545 6.598 -40.081 1.00 0.00 N ATOM 157 CA GLN A 13 -10.603 7.602 -39.600 1.00 0.00 C ATOM 158 C GLN A 13 -9.944 7.155 -38.289 1.00 0.00 C ATOM 159 O GLN A 13 -8.724 7.247 -38.155 1.00 0.00 O ATOM 160 CB GLN A 13 -11.357 8.933 -39.431 1.00 0.00 C ATOM 161 CG GLN A 13 -11.601 9.681 -40.753 1.00 0.00 C ATOM 162 CD GLN A 13 -10.314 10.193 -41.404 1.00 0.00 C ATOM 163 OE1 GLN A 13 -9.317 10.447 -40.739 1.00 0.00 O ATOM 164 NE2 GLN A 13 -10.295 10.358 -42.716 1.00 0.00 N ATOM 0 H GLN A 13 -12.476 6.986 -40.234 1.00 0.00 H new ATOM 0 HA GLN A 13 -9.798 7.733 -40.323 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -12.317 8.738 -38.952 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -10.791 9.578 -38.759 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -12.113 9.017 -41.449 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -12.267 10.524 -40.568 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -11.126 10.146 -43.269 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -9.450 10.697 -43.175 1.00 0.00 H new ATOM 173 N ALA A 14 -10.733 6.666 -37.326 1.00 0.00 N ATOM 174 CA ALA A 14 -10.209 6.194 -36.049 1.00 0.00 C ATOM 175 C ALA A 14 -9.383 4.941 -36.268 1.00 0.00 C ATOM 176 O ALA A 14 -8.309 4.853 -35.701 1.00 0.00 O ATOM 177 CB ALA A 14 -11.353 5.933 -35.062 1.00 0.00 C ATOM 0 H ALA A 14 -11.746 6.588 -37.413 1.00 0.00 H new ATOM 0 HA ALA A 14 -9.568 6.963 -35.619 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.943 5.582 -34.115 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -11.909 6.856 -34.897 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -12.021 5.176 -35.472 1.00 0.00 H new ATOM 183 N LEU A 15 -9.811 3.991 -37.103 1.00 0.00 N ATOM 184 CA LEU A 15 -9.008 2.785 -37.301 1.00 0.00 C ATOM 185 C LEU A 15 -7.724 3.103 -38.064 1.00 0.00 C ATOM 186 O LEU A 15 -6.747 2.366 -37.919 1.00 0.00 O ATOM 187 CB LEU A 15 -9.799 1.652 -37.968 1.00 0.00 C ATOM 188 CG LEU A 15 -10.855 0.956 -37.082 1.00 0.00 C ATOM 189 CD1 LEU A 15 -10.189 0.236 -35.904 1.00 0.00 C ATOM 190 CD2 LEU A 15 -11.972 1.871 -36.571 1.00 0.00 C ATOM 0 H LEU A 15 -10.680 4.030 -37.636 1.00 0.00 H new ATOM 0 HA LEU A 15 -8.731 2.420 -36.312 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -10.300 2.054 -38.849 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -9.093 0.899 -38.318 1.00 0.00 H new ATOM 0 HG LEU A 15 -11.340 0.235 -37.740 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.952 -0.247 -35.294 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.497 -0.517 -36.282 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.643 0.959 -35.297 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -12.664 1.293 -35.959 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -11.540 2.673 -35.972 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -12.508 2.299 -37.418 1.00 0.00 H new ATOM 202 N LEU A 16 -7.679 4.178 -38.857 1.00 0.00 N ATOM 203 CA LEU A 16 -6.455 4.534 -39.581 1.00 0.00 C ATOM 204 C LEU A 16 -5.321 4.884 -38.604 1.00 0.00 C ATOM 205 O LEU A 16 -4.157 4.709 -38.961 1.00 0.00 O ATOM 206 CB LEU A 16 -6.696 5.665 -40.596 1.00 0.00 C ATOM 207 CG LEU A 16 -7.312 5.158 -41.916 1.00 0.00 C ATOM 208 CD1 LEU A 16 -7.867 6.333 -42.727 1.00 0.00 C ATOM 209 CD2 LEU A 16 -6.289 4.399 -42.776 1.00 0.00 C ATOM 0 H LEU A 16 -8.465 4.809 -39.013 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.146 3.659 -40.152 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -7.357 6.410 -40.154 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.751 6.164 -40.809 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.115 4.470 -41.650 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -8.299 5.962 -43.656 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -8.636 6.844 -42.148 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -7.061 7.031 -42.955 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.767 4.060 -43.695 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -5.458 5.060 -43.021 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.916 3.537 -42.222 1.00 0.00 H new ATOM 221 N GLU A 17 -5.613 5.281 -37.357 1.00 0.00 N ATOM 222 CA GLU A 17 -4.577 5.610 -36.369 1.00 0.00 C ATOM 223 C GLU A 17 -3.693 4.391 -36.055 1.00 0.00 C ATOM 224 O GLU A 17 -2.587 4.519 -35.526 1.00 0.00 O ATOM 225 CB GLU A 17 -5.223 6.128 -35.069 1.00 0.00 C ATOM 226 CG GLU A 17 -5.701 4.984 -34.149 1.00 0.00 C ATOM 227 CD GLU A 17 -6.514 5.399 -32.929 1.00 0.00 C ATOM 228 OE1 GLU A 17 -6.699 6.610 -32.681 1.00 0.00 O ATOM 229 OE2 GLU A 17 -6.907 4.471 -32.178 1.00 0.00 O ATOM 0 H GLU A 17 -6.566 5.382 -37.008 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.947 6.389 -36.798 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -4.504 6.746 -34.531 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -6.070 6.768 -35.318 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -6.301 4.295 -34.743 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.826 4.431 -33.806 1.00 0.00 H new ATOM 236 N ARG A 18 -4.186 3.183 -36.344 1.00 0.00 N ATOM 237 CA ARG A 18 -3.473 1.937 -36.100 1.00 0.00 C ATOM 238 C ARG A 18 -2.217 1.849 -36.958 1.00 0.00 C ATOM 239 O ARG A 18 -1.251 1.221 -36.520 1.00 0.00 O ATOM 240 CB ARG A 18 -4.399 0.748 -36.385 1.00 0.00 C ATOM 241 CG ARG A 18 -5.633 0.734 -35.464 1.00 0.00 C ATOM 242 CD ARG A 18 -6.629 -0.358 -35.867 1.00 0.00 C ATOM 243 NE ARG A 18 -6.031 -1.695 -35.779 1.00 0.00 N ATOM 244 CZ ARG A 18 -6.576 -2.854 -36.154 1.00 0.00 C ATOM 245 NH1 ARG A 18 -7.817 -2.913 -36.622 1.00 0.00 N ATOM 246 NH2 ARG A 18 -5.865 -3.963 -36.038 1.00 0.00 N ATOM 0 H ARG A 18 -5.107 3.047 -36.761 1.00 0.00 H new ATOM 0 HA ARG A 18 -3.166 1.911 -35.054 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -4.725 0.785 -37.425 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -3.843 -0.181 -36.258 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -5.316 0.575 -34.433 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -6.125 1.706 -35.500 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -7.506 -0.308 -35.221 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -6.973 -0.179 -36.886 1.00 0.00 H new ATOM 0 HE ARG A 18 -5.091 -1.744 -35.386 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -8.373 -2.062 -36.701 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -8.214 -3.810 -36.903 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -4.916 -3.924 -35.667 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -6.266 -4.858 -36.320 1.00 0.00 H new ATOM 260 N ILE A 19 -2.222 2.467 -38.145 1.00 0.00 N ATOM 261 CA ILE A 19 -1.093 2.466 -39.066 1.00 0.00 C ATOM 262 C ILE A 19 0.093 3.195 -38.417 1.00 0.00 C ATOM 263 O ILE A 19 1.236 2.763 -38.559 1.00 0.00 O ATOM 264 CB ILE A 19 -1.495 3.105 -40.418 1.00 0.00 C ATOM 265 CG1 ILE A 19 -2.788 2.521 -41.041 1.00 0.00 C ATOM 266 CG2 ILE A 19 -0.347 3.010 -41.440 1.00 0.00 C ATOM 267 CD1 ILE A 19 -2.819 1.005 -41.248 1.00 0.00 C ATOM 0 H ILE A 19 -3.027 2.989 -38.493 1.00 0.00 H new ATOM 0 HA ILE A 19 -0.790 1.440 -39.276 1.00 0.00 H new ATOM 0 HB ILE A 19 -1.704 4.148 -40.182 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.629 2.796 -40.404 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.949 3.001 -42.006 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.658 3.467 -42.380 1.00 0.00 H new ATOM 0 HG22 ILE A 19 0.528 3.533 -41.054 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -0.097 1.963 -41.611 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.773 0.717 -41.689 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -2.008 0.712 -41.915 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -2.698 0.504 -40.288 1.00 0.00 H new ATOM 279 N ARG A 20 -0.162 4.268 -37.658 1.00 0.00 N ATOM 280 CA ARG A 20 0.857 5.072 -36.982 1.00 0.00 C ATOM 281 C ARG A 20 1.818 4.207 -36.179 1.00 0.00 C ATOM 282 O ARG A 20 3.029 4.384 -36.278 1.00 0.00 O ATOM 283 CB ARG A 20 0.141 6.105 -36.101 1.00 0.00 C ATOM 284 CG ARG A 20 1.028 7.143 -35.411 1.00 0.00 C ATOM 285 CD ARG A 20 1.727 6.623 -34.146 1.00 0.00 C ATOM 286 NE ARG A 20 1.969 7.722 -33.205 1.00 0.00 N ATOM 287 CZ ARG A 20 1.100 8.184 -32.299 1.00 0.00 C ATOM 288 NH1 ARG A 20 -0.084 7.603 -32.132 1.00 0.00 N ATOM 289 NH2 ARG A 20 1.427 9.244 -31.574 1.00 0.00 N ATOM 0 H ARG A 20 -1.110 4.608 -37.494 1.00 0.00 H new ATOM 0 HA ARG A 20 1.471 5.586 -37.721 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -0.587 6.633 -36.717 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -0.419 5.570 -35.334 1.00 0.00 H new ATOM 0 HG2 ARG A 20 1.784 7.487 -36.117 1.00 0.00 H new ATOM 0 HG3 ARG A 20 0.420 8.009 -35.148 1.00 0.00 H new ATOM 0 HD2 ARG A 20 1.112 5.859 -33.671 1.00 0.00 H new ATOM 0 HD3 ARG A 20 2.672 6.151 -34.414 1.00 0.00 H new ATOM 0 HE ARG A 20 2.882 8.175 -33.245 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.340 6.794 -32.698 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -0.737 7.966 -31.437 1.00 0.00 H new ATOM 0 HH21 ARG A 20 2.331 9.696 -31.711 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.775 9.608 -30.879 1.00 0.00 H new ATOM 303 N ALA A 21 1.302 3.251 -35.408 1.00 0.00 N ATOM 304 CA ALA A 21 2.114 2.367 -34.590 1.00 0.00 C ATOM 305 C ALA A 21 3.063 1.491 -35.416 1.00 0.00 C ATOM 306 O ALA A 21 4.035 0.973 -34.874 1.00 0.00 O ATOM 307 CB ALA A 21 1.192 1.508 -33.734 1.00 0.00 C ATOM 0 H ALA A 21 0.301 3.071 -35.337 1.00 0.00 H new ATOM 0 HA ALA A 21 2.752 2.984 -33.958 1.00 0.00 H new ATOM 0 HB1 ALA A 21 1.789 0.839 -33.114 1.00 0.00 H new ATOM 0 HB2 ALA A 21 0.586 2.150 -33.095 1.00 0.00 H new ATOM 0 HB3 ALA A 21 0.540 0.919 -34.379 1.00 0.00 H new ATOM 313 N LYS A 22 2.787 1.243 -36.702 1.00 0.00 N ATOM 314 CA LYS A 22 3.687 0.438 -37.530 1.00 0.00 C ATOM 315 C LYS A 22 4.873 1.319 -37.903 1.00 0.00 C ATOM 316 O LYS A 22 5.993 0.820 -37.995 1.00 0.00 O ATOM 317 CB LYS A 22 2.984 -0.106 -38.788 1.00 0.00 C ATOM 318 CG LYS A 22 2.139 -1.371 -38.562 1.00 0.00 C ATOM 319 CD LYS A 22 0.975 -1.230 -37.569 1.00 0.00 C ATOM 320 CE LYS A 22 1.377 -1.502 -36.115 1.00 0.00 C ATOM 321 NZ LYS A 22 1.444 -2.942 -35.809 1.00 0.00 N ATOM 0 H LYS A 22 1.957 1.585 -37.186 1.00 0.00 H new ATOM 0 HA LYS A 22 4.018 -0.437 -36.970 1.00 0.00 H new ATOM 0 HB2 LYS A 22 2.341 0.675 -39.193 1.00 0.00 H new ATOM 0 HB3 LYS A 22 3.739 -0.321 -39.544 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.735 -1.692 -39.522 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.797 -2.166 -38.211 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.565 -0.223 -37.642 1.00 0.00 H new ATOM 0 HD3 LYS A 22 0.180 -1.919 -37.853 1.00 0.00 H new ATOM 0 HE2 LYS A 22 2.347 -1.046 -35.918 1.00 0.00 H new ATOM 0 HE3 LYS A 22 0.660 -1.025 -35.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 1.720 -3.073 -34.815 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 0.512 -3.375 -35.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 2.148 -3.396 -36.426 1.00 0.00 H new ATOM 335 N GLU A 23 4.653 2.619 -38.096 1.00 0.00 N ATOM 336 CA GLU A 23 5.706 3.567 -38.444 1.00 0.00 C ATOM 337 C GLU A 23 6.648 3.798 -37.257 1.00 0.00 C ATOM 338 O GLU A 23 7.805 4.152 -37.482 1.00 0.00 O ATOM 339 CB GLU A 23 5.091 4.906 -38.876 1.00 0.00 C ATOM 340 CG GLU A 23 4.435 4.870 -40.262 1.00 0.00 C ATOM 341 CD GLU A 23 5.396 5.418 -41.310 1.00 0.00 C ATOM 342 OE1 GLU A 23 5.712 6.631 -41.260 1.00 0.00 O ATOM 343 OE2 GLU A 23 5.988 4.635 -42.080 1.00 0.00 O ATOM 0 H GLU A 23 3.730 3.046 -38.014 1.00 0.00 H new ATOM 0 HA GLU A 23 6.279 3.146 -39.270 1.00 0.00 H new ATOM 0 HB2 GLU A 23 4.346 5.207 -38.140 1.00 0.00 H new ATOM 0 HB3 GLU A 23 5.869 5.670 -38.873 1.00 0.00 H new ATOM 0 HG2 GLU A 23 4.155 3.847 -40.514 1.00 0.00 H new ATOM 0 HG3 GLU A 23 3.518 5.459 -40.254 1.00 0.00 H new ATOM 350 N VAL A 24 6.201 3.527 -36.019 1.00 0.00 N ATOM 351 CA VAL A 24 6.975 3.707 -34.787 1.00 0.00 C ATOM 352 C VAL A 24 8.334 3.001 -34.826 1.00 0.00 C ATOM 353 O VAL A 24 9.232 3.388 -34.082 1.00 0.00 O ATOM 354 CB VAL A 24 6.098 3.435 -33.537 1.00 0.00 C ATOM 355 CG1 VAL A 24 6.861 3.369 -32.205 1.00 0.00 C ATOM 356 CG2 VAL A 24 5.047 4.544 -33.390 1.00 0.00 C ATOM 0 H VAL A 24 5.263 3.166 -35.847 1.00 0.00 H new ATOM 0 HA VAL A 24 7.260 4.756 -34.704 1.00 0.00 H new ATOM 0 HB VAL A 24 5.664 2.452 -33.717 1.00 0.00 H new ATOM 0 HG11 VAL A 24 6.160 3.175 -31.393 1.00 0.00 H new ATOM 0 HG12 VAL A 24 7.598 2.567 -32.247 1.00 0.00 H new ATOM 0 HG13 VAL A 24 7.367 4.318 -32.028 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.433 4.349 -32.511 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.547 5.506 -33.278 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.414 4.565 -34.277 1.00 0.00 H new ATOM 366 N GLN A 25 8.543 2.009 -35.697 1.00 0.00 N ATOM 367 CA GLN A 25 9.845 1.359 -35.803 1.00 0.00 C ATOM 368 C GLN A 25 10.910 2.412 -36.178 1.00 0.00 C ATOM 369 O GLN A 25 12.058 2.281 -35.778 1.00 0.00 O ATOM 370 CB GLN A 25 9.773 0.191 -36.796 1.00 0.00 C ATOM 371 CG GLN A 25 9.400 0.611 -38.224 1.00 0.00 C ATOM 372 CD GLN A 25 9.061 -0.617 -39.069 1.00 0.00 C ATOM 373 OE1 GLN A 25 9.927 -1.394 -39.451 1.00 0.00 O ATOM 374 NE2 GLN A 25 7.793 -0.859 -39.348 1.00 0.00 N ATOM 0 H GLN A 25 7.833 1.644 -36.331 1.00 0.00 H new ATOM 0 HA GLN A 25 10.137 0.929 -34.845 1.00 0.00 H new ATOM 0 HB2 GLN A 25 10.738 -0.315 -36.817 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.041 -0.533 -36.438 1.00 0.00 H new ATOM 0 HG2 GLN A 25 8.548 1.290 -38.199 1.00 0.00 H new ATOM 0 HG3 GLN A 25 10.228 1.155 -38.678 1.00 0.00 H new ATOM 0 HE21 GLN A 25 7.069 -0.214 -39.031 1.00 0.00 H new ATOM 0 HE22 GLN A 25 7.538 -1.691 -39.880 1.00 0.00 H new ATOM 383 N LYS A 26 10.544 3.470 -36.919 1.00 0.00 N ATOM 384 CA LYS A 26 11.459 4.545 -37.307 1.00 0.00 C ATOM 385 C LYS A 26 11.736 5.431 -36.087 1.00 0.00 C ATOM 386 O LYS A 26 12.853 5.919 -35.916 1.00 0.00 O ATOM 387 CB LYS A 26 10.871 5.353 -38.476 1.00 0.00 C ATOM 388 CG LYS A 26 10.775 4.505 -39.756 1.00 0.00 C ATOM 389 CD LYS A 26 10.276 5.298 -40.971 1.00 0.00 C ATOM 390 CE LYS A 26 8.762 5.528 -40.920 1.00 0.00 C ATOM 391 NZ LYS A 26 8.249 6.167 -42.152 1.00 0.00 N ATOM 0 H LYS A 26 9.594 3.601 -37.267 1.00 0.00 H new ATOM 0 HA LYS A 26 12.404 4.123 -37.651 1.00 0.00 H new ATOM 0 HB2 LYS A 26 9.880 5.718 -38.205 1.00 0.00 H new ATOM 0 HB3 LYS A 26 11.493 6.228 -38.664 1.00 0.00 H new ATOM 0 HG2 LYS A 26 11.756 4.087 -39.981 1.00 0.00 H new ATOM 0 HG3 LYS A 26 10.104 3.665 -39.578 1.00 0.00 H new ATOM 0 HD2 LYS A 26 10.788 6.259 -41.012 1.00 0.00 H new ATOM 0 HD3 LYS A 26 10.531 4.761 -41.885 1.00 0.00 H new ATOM 0 HE2 LYS A 26 8.257 4.574 -40.771 1.00 0.00 H new ATOM 0 HE3 LYS A 26 8.521 6.154 -40.061 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.397 6.719 -41.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 8.977 6.798 -42.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 8.013 5.434 -42.851 1.00 0.00 H new ATOM 405 N GLN A 27 10.728 5.658 -35.241 1.00 0.00 N ATOM 406 CA GLN A 27 10.831 6.445 -34.022 1.00 0.00 C ATOM 407 C GLN A 27 11.624 5.696 -32.937 1.00 0.00 C ATOM 408 O GLN A 27 11.967 6.308 -31.929 1.00 0.00 O ATOM 409 CB GLN A 27 9.421 6.782 -33.503 1.00 0.00 C ATOM 410 CG GLN A 27 8.726 7.894 -34.297 1.00 0.00 C ATOM 411 CD GLN A 27 8.257 7.512 -35.698 1.00 0.00 C ATOM 412 OE1 GLN A 27 7.211 6.894 -35.872 1.00 0.00 O ATOM 413 NE2 GLN A 27 8.985 7.902 -36.730 1.00 0.00 N ATOM 0 H GLN A 27 9.791 5.285 -35.395 1.00 0.00 H new ATOM 0 HA GLN A 27 11.367 7.365 -34.254 1.00 0.00 H new ATOM 0 HB2 GLN A 27 8.806 5.883 -33.537 1.00 0.00 H new ATOM 0 HB3 GLN A 27 9.490 7.082 -32.457 1.00 0.00 H new ATOM 0 HG2 GLN A 27 7.864 8.238 -33.726 1.00 0.00 H new ATOM 0 HG3 GLN A 27 9.411 8.738 -34.380 1.00 0.00 H new ATOM 0 HE21 GLN A 27 9.853 8.415 -36.577 1.00 0.00 H new ATOM 0 HE22 GLN A 27 8.679 7.690 -37.679 1.00 0.00 H new ATOM 422 N LEU A 28 11.933 4.401 -33.108 1.00 0.00 N ATOM 423 CA LEU A 28 12.693 3.643 -32.115 1.00 0.00 C ATOM 424 C LEU A 28 14.041 4.331 -31.894 1.00 0.00 C ATOM 425 O LEU A 28 14.416 4.600 -30.750 1.00 0.00 O ATOM 426 CB LEU A 28 12.844 2.173 -32.527 1.00 0.00 C ATOM 427 CG LEU A 28 12.671 1.195 -31.354 1.00 0.00 C ATOM 428 CD1 LEU A 28 13.632 1.451 -30.189 1.00 0.00 C ATOM 429 CD2 LEU A 28 11.216 1.157 -30.857 1.00 0.00 C ATOM 0 H LEU A 28 11.665 3.860 -33.930 1.00 0.00 H new ATOM 0 HA LEU A 28 12.151 3.631 -31.169 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.108 1.941 -33.297 1.00 0.00 H new ATOM 0 HB3 LEU A 28 13.828 2.026 -32.972 1.00 0.00 H new ATOM 0 HG LEU A 28 12.930 0.216 -31.757 1.00 0.00 H new ATOM 0 HD11 LEU A 28 13.450 0.722 -29.400 1.00 0.00 H new ATOM 0 HD12 LEU A 28 14.660 1.358 -30.538 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.471 2.456 -29.799 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.133 0.455 -30.028 1.00 0.00 H new ATOM 0 HD22 LEU A 28 10.920 2.151 -30.522 1.00 0.00 H new ATOM 0 HD23 LEU A 28 10.562 0.838 -31.669 1.00 0.00 H new ATOM 441 N ALA A 29 14.740 4.635 -32.992 1.00 0.00 N ATOM 442 CA ALA A 29 16.024 5.319 -33.008 1.00 0.00 C ATOM 443 C ALA A 29 15.739 6.820 -32.848 1.00 0.00 C ATOM 444 O ALA A 29 15.875 7.602 -33.797 1.00 0.00 O ATOM 445 CB ALA A 29 16.754 4.994 -34.319 1.00 0.00 C ATOM 0 H ALA A 29 14.408 4.399 -33.927 1.00 0.00 H new ATOM 0 HA ALA A 29 16.675 4.995 -32.196 1.00 0.00 H new ATOM 0 HB1 ALA A 29 17.717 5.505 -34.335 1.00 0.00 H new ATOM 0 HB2 ALA A 29 16.913 3.918 -34.390 1.00 0.00 H new ATOM 0 HB3 ALA A 29 16.152 5.329 -35.164 1.00 0.00 H new ATOM 451 N ARG A 30 15.242 7.221 -31.677 1.00 0.00 N ATOM 452 CA ARG A 30 14.895 8.592 -31.319 1.00 0.00 C ATOM 453 C ARG A 30 14.655 8.656 -29.812 1.00 0.00 C ATOM 454 O ARG A 30 14.830 7.659 -29.109 1.00 0.00 O ATOM 455 CB ARG A 30 13.632 9.025 -32.100 1.00 0.00 C ATOM 456 CG ARG A 30 13.623 10.493 -32.537 1.00 0.00 C ATOM 457 CD ARG A 30 14.865 10.920 -33.334 1.00 0.00 C ATOM 458 NE ARG A 30 14.632 12.193 -34.030 1.00 0.00 N ATOM 459 CZ ARG A 30 14.208 12.344 -35.290 1.00 0.00 C ATOM 460 NH1 ARG A 30 14.033 11.290 -36.091 1.00 0.00 N ATOM 461 NH2 ARG A 30 13.946 13.567 -35.743 1.00 0.00 N ATOM 0 H ARG A 30 15.063 6.564 -30.917 1.00 0.00 H new ATOM 0 HA ARG A 30 15.706 9.273 -31.579 1.00 0.00 H new ATOM 0 HB2 ARG A 30 13.535 8.396 -32.985 1.00 0.00 H new ATOM 0 HB3 ARG A 30 12.756 8.839 -31.479 1.00 0.00 H new ATOM 0 HG2 ARG A 30 12.736 10.675 -33.144 1.00 0.00 H new ATOM 0 HG3 ARG A 30 13.539 11.123 -31.652 1.00 0.00 H new ATOM 0 HD2 ARG A 30 15.717 11.020 -32.661 1.00 0.00 H new ATOM 0 HD3 ARG A 30 15.120 10.147 -34.059 1.00 0.00 H new ATOM 0 HE ARG A 30 14.811 13.046 -33.500 1.00 0.00 H new ATOM 0 HH11 ARG A 30 14.223 10.349 -35.745 1.00 0.00 H new ATOM 0 HH12 ARG A 30 13.709 11.425 -37.049 1.00 0.00 H new ATOM 0 HH21 ARG A 30 14.069 14.374 -35.132 1.00 0.00 H new ATOM 0 HH22 ARG A 30 13.622 13.697 -36.701 1.00 0.00 H new ATOM 475 N MET A 31 14.291 9.831 -29.300 1.00 0.00 N ATOM 476 CA MET A 31 14.010 10.081 -27.894 1.00 0.00 C ATOM 477 C MET A 31 12.772 10.975 -27.825 1.00 0.00 C ATOM 478 O MET A 31 12.770 12.100 -28.331 1.00 0.00 O ATOM 479 CB MET A 31 15.252 10.620 -27.149 1.00 0.00 C ATOM 480 CG MET A 31 16.171 11.608 -27.895 1.00 0.00 C ATOM 481 SD MET A 31 15.581 13.306 -28.148 1.00 0.00 S ATOM 482 CE MET A 31 15.605 13.939 -26.447 1.00 0.00 C ATOM 0 H MET A 31 14.181 10.664 -29.878 1.00 0.00 H new ATOM 0 HA MET A 31 13.783 9.157 -27.362 1.00 0.00 H new ATOM 0 HB2 MET A 31 14.909 11.107 -26.236 1.00 0.00 H new ATOM 0 HB3 MET A 31 15.857 9.765 -26.846 1.00 0.00 H new ATOM 0 HG2 MET A 31 17.114 11.661 -27.351 1.00 0.00 H new ATOM 0 HG3 MET A 31 16.391 11.183 -28.874 1.00 0.00 H new ATOM 0 HE1 MET A 31 15.370 15.003 -26.452 1.00 0.00 H new ATOM 0 HE2 MET A 31 14.865 13.406 -25.850 1.00 0.00 H new ATOM 0 HE3 MET A 31 16.595 13.788 -26.016 1.00 0.00 H new ATOM 492 N THR A 32 11.702 10.469 -27.220 1.00 0.00 N ATOM 493 CA THR A 32 10.420 11.130 -27.058 1.00 0.00 C ATOM 494 C THR A 32 9.943 10.759 -25.658 1.00 0.00 C ATOM 495 O THR A 32 9.530 9.625 -25.414 1.00 0.00 O ATOM 496 CB THR A 32 9.455 10.662 -28.162 1.00 0.00 C ATOM 497 OG1 THR A 32 10.035 10.805 -29.445 1.00 0.00 O ATOM 498 CG2 THR A 32 8.159 11.458 -28.156 1.00 0.00 C ATOM 0 H THR A 32 11.711 9.536 -26.809 1.00 0.00 H new ATOM 0 HA THR A 32 10.481 12.214 -27.154 1.00 0.00 H new ATOM 0 HB THR A 32 9.246 9.613 -27.953 1.00 0.00 H new ATOM 0 HG1 THR A 32 9.401 10.499 -30.127 1.00 0.00 H new ATOM 0 HG21 THR A 32 7.506 11.096 -28.950 1.00 0.00 H new ATOM 0 HG22 THR A 32 7.662 11.336 -27.194 1.00 0.00 H new ATOM 0 HG23 THR A 32 8.379 12.513 -28.320 1.00 0.00 H new ATOM 506 N ARG A 33 10.080 11.687 -24.714 1.00 0.00 N ATOM 507 CA ARG A 33 9.687 11.509 -23.317 1.00 0.00 C ATOM 508 C ARG A 33 8.187 11.216 -23.248 1.00 0.00 C ATOM 509 O ARG A 33 7.349 12.085 -23.496 1.00 0.00 O ATOM 510 CB ARG A 33 10.130 12.753 -22.543 1.00 0.00 C ATOM 511 CG ARG A 33 11.642 12.662 -22.277 1.00 0.00 C ATOM 512 CD ARG A 33 12.259 13.997 -21.870 1.00 0.00 C ATOM 513 NE ARG A 33 12.413 14.923 -23.009 1.00 0.00 N ATOM 514 CZ ARG A 33 13.064 16.093 -22.954 1.00 0.00 C ATOM 515 NH1 ARG A 33 13.674 16.477 -21.839 1.00 0.00 N ATOM 516 NH2 ARG A 33 13.110 16.880 -24.020 1.00 0.00 N ATOM 0 H ARG A 33 10.477 12.607 -24.903 1.00 0.00 H new ATOM 0 HA ARG A 33 10.174 10.653 -22.850 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.901 13.653 -23.113 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.585 12.825 -21.602 1.00 0.00 H new ATOM 0 HG2 ARG A 33 11.823 11.930 -21.490 1.00 0.00 H new ATOM 0 HG3 ARG A 33 12.141 12.296 -23.174 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.634 14.464 -21.109 1.00 0.00 H new ATOM 0 HD3 ARG A 33 13.234 13.819 -21.417 1.00 0.00 H new ATOM 0 HE ARG A 33 11.995 14.654 -23.900 1.00 0.00 H new ATOM 0 HH11 ARG A 33 13.650 15.879 -21.013 1.00 0.00 H new ATOM 0 HH12 ARG A 33 14.167 17.370 -21.809 1.00 0.00 H new ATOM 0 HH21 ARG A 33 12.649 16.595 -24.884 1.00 0.00 H new ATOM 0 HH22 ARG A 33 13.606 17.770 -23.976 1.00 0.00 H new ATOM 530 N CYS A 34 7.852 9.957 -22.975 1.00 0.00 N ATOM 531 CA CYS A 34 6.516 9.396 -22.882 1.00 0.00 C ATOM 532 C CYS A 34 6.604 8.083 -22.094 1.00 0.00 C ATOM 533 O CYS A 34 5.933 7.987 -21.064 1.00 0.00 O ATOM 534 CB CYS A 34 5.921 9.232 -24.293 1.00 0.00 C ATOM 535 SG CYS A 34 4.179 8.727 -24.226 1.00 0.00 S ATOM 0 H CYS A 34 8.568 9.251 -22.800 1.00 0.00 H new ATOM 0 HA CYS A 34 5.836 10.058 -22.346 1.00 0.00 H new ATOM 0 HB2 CYS A 34 6.008 10.173 -24.837 1.00 0.00 H new ATOM 0 HB3 CYS A 34 6.495 8.489 -24.847 1.00 0.00 H new ATOM 0 HG CYS A 34 3.717 8.602 -25.435 1.00 0.00 H new ATOM 541 N PRO A 35 7.431 7.091 -22.496 1.00 0.00 N ATOM 542 CA PRO A 35 7.562 5.837 -21.760 1.00 0.00 C ATOM 543 C PRO A 35 8.089 6.071 -20.343 1.00 0.00 C ATOM 544 O PRO A 35 7.790 5.268 -19.470 1.00 0.00 O ATOM 545 CB PRO A 35 8.496 4.940 -22.578 1.00 0.00 C ATOM 546 CG PRO A 35 9.298 5.938 -23.405 1.00 0.00 C ATOM 547 CD PRO A 35 8.280 7.033 -23.677 1.00 0.00 C ATOM 0 HA PRO A 35 6.591 5.358 -21.634 1.00 0.00 H new ATOM 0 HB2 PRO A 35 9.140 4.338 -21.937 1.00 0.00 H new ATOM 0 HB3 PRO A 35 7.939 4.248 -23.210 1.00 0.00 H new ATOM 0 HG2 PRO A 35 10.163 6.315 -22.859 1.00 0.00 H new ATOM 0 HG3 PRO A 35 9.672 5.493 -24.327 1.00 0.00 H new ATOM 0 HD2 PRO A 35 8.773 7.990 -23.851 1.00 0.00 H new ATOM 0 HD3 PRO A 35 7.694 6.809 -24.569 1.00 0.00 H new ATOM 555 N GLU A 36 8.766 7.198 -20.074 1.00 0.00 N ATOM 556 CA GLU A 36 9.292 7.498 -18.745 1.00 0.00 C ATOM 557 C GLU A 36 8.212 7.553 -17.657 1.00 0.00 C ATOM 558 O GLU A 36 8.550 7.523 -16.466 1.00 0.00 O ATOM 559 CB GLU A 36 10.178 8.750 -18.735 1.00 0.00 C ATOM 560 CG GLU A 36 9.458 10.092 -18.975 1.00 0.00 C ATOM 561 CD GLU A 36 10.169 11.238 -18.240 1.00 0.00 C ATOM 562 OE1 GLU A 36 11.428 11.258 -18.220 1.00 0.00 O ATOM 563 OE2 GLU A 36 9.494 12.057 -17.583 1.00 0.00 O ATOM 0 H GLU A 36 8.960 7.918 -20.770 1.00 0.00 H new ATOM 0 HA GLU A 36 9.929 6.651 -18.491 1.00 0.00 H new ATOM 0 HB2 GLU A 36 10.688 8.802 -17.773 1.00 0.00 H new ATOM 0 HB3 GLU A 36 10.947 8.632 -19.498 1.00 0.00 H new ATOM 0 HG2 GLU A 36 9.426 10.305 -20.043 1.00 0.00 H new ATOM 0 HG3 GLU A 36 8.426 10.021 -18.633 1.00 0.00 H new ATOM 570 N GLN A 37 6.931 7.651 -18.043 1.00 0.00 N ATOM 571 CA GLN A 37 5.820 7.663 -17.091 1.00 0.00 C ATOM 572 C GLN A 37 5.721 6.292 -16.386 1.00 0.00 C ATOM 573 O GLN A 37 5.071 6.191 -15.347 1.00 0.00 O ATOM 574 CB GLN A 37 4.489 8.000 -17.794 1.00 0.00 C ATOM 575 CG GLN A 37 3.429 8.584 -16.825 1.00 0.00 C ATOM 576 CD GLN A 37 2.053 7.905 -16.847 1.00 0.00 C ATOM 577 OE1 GLN A 37 1.409 7.768 -15.807 1.00 0.00 O ATOM 578 NE2 GLN A 37 1.545 7.522 -18.006 1.00 0.00 N ATOM 0 H GLN A 37 6.642 7.724 -19.018 1.00 0.00 H new ATOM 0 HA GLN A 37 6.012 8.437 -16.348 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.677 8.716 -18.594 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.091 7.099 -18.260 1.00 0.00 H new ATOM 0 HG2 GLN A 37 3.823 8.529 -15.810 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.295 9.640 -17.058 1.00 0.00 H new ATOM 0 HE21 GLN A 37 2.085 7.639 -18.863 1.00 0.00 H new ATOM 0 HE22 GLN A 37 0.613 7.110 -18.043 1.00 0.00 H new ATOM 587 N GLU A 38 6.390 5.255 -16.906 1.00 0.00 N ATOM 588 CA GLU A 38 6.427 3.887 -16.400 1.00 0.00 C ATOM 589 C GLU A 38 6.710 3.798 -14.903 1.00 0.00 C ATOM 590 O GLU A 38 6.125 2.954 -14.225 1.00 0.00 O ATOM 591 CB GLU A 38 7.484 3.076 -17.174 1.00 0.00 C ATOM 592 CG GLU A 38 8.937 3.537 -16.925 1.00 0.00 C ATOM 593 CD GLU A 38 9.934 2.837 -17.852 1.00 0.00 C ATOM 594 OE1 GLU A 38 9.893 1.587 -17.950 1.00 0.00 O ATOM 595 OE2 GLU A 38 10.810 3.521 -18.429 1.00 0.00 O ATOM 0 H GLU A 38 6.956 5.362 -17.748 1.00 0.00 H new ATOM 0 HA GLU A 38 5.431 3.472 -16.555 1.00 0.00 H new ATOM 0 HB2 GLU A 38 7.395 2.025 -16.898 1.00 0.00 H new ATOM 0 HB3 GLU A 38 7.270 3.144 -18.241 1.00 0.00 H new ATOM 0 HG2 GLU A 38 9.004 4.615 -17.070 1.00 0.00 H new ATOM 0 HG3 GLU A 38 9.207 3.338 -15.888 1.00 0.00 H new ATOM 602 N LEU A 39 7.582 4.657 -14.363 1.00 0.00 N ATOM 603 CA LEU A 39 7.918 4.613 -12.947 1.00 0.00 C ATOM 604 C LEU A 39 6.762 5.158 -12.106 1.00 0.00 C ATOM 605 O LEU A 39 6.582 4.753 -10.960 1.00 0.00 O ATOM 606 CB LEU A 39 9.257 5.331 -12.726 1.00 0.00 C ATOM 607 CG LEU A 39 9.699 5.378 -11.254 1.00 0.00 C ATOM 608 CD1 LEU A 39 9.826 3.995 -10.602 1.00 0.00 C ATOM 609 CD2 LEU A 39 11.051 6.086 -11.130 1.00 0.00 C ATOM 0 H LEU A 39 8.063 5.387 -14.889 1.00 0.00 H new ATOM 0 HA LEU A 39 8.055 3.585 -12.611 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.028 4.831 -13.312 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.179 6.350 -13.105 1.00 0.00 H new ATOM 0 HG LEU A 39 8.913 5.922 -10.731 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.141 4.109 -9.565 1.00 0.00 H new ATOM 0 HD12 LEU A 39 8.862 3.488 -10.634 1.00 0.00 H new ATOM 0 HD13 LEU A 39 10.565 3.404 -11.143 1.00 0.00 H new ATOM 0 HD21 LEU A 39 11.353 6.113 -10.083 1.00 0.00 H new ATOM 0 HD22 LEU A 39 11.799 5.546 -11.710 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.965 7.104 -11.509 1.00 0.00 H new ATOM 621 N ARG A 40 5.984 6.103 -12.639 1.00 0.00 N ATOM 622 CA ARG A 40 4.835 6.663 -11.931 1.00 0.00 C ATOM 623 C ARG A 40 3.832 5.532 -11.824 1.00 0.00 C ATOM 624 O ARG A 40 3.347 5.236 -10.738 1.00 0.00 O ATOM 625 CB ARG A 40 4.226 7.865 -12.680 1.00 0.00 C ATOM 626 CG ARG A 40 5.269 8.909 -13.104 1.00 0.00 C ATOM 627 CD ARG A 40 6.014 9.511 -11.911 1.00 0.00 C ATOM 628 NE ARG A 40 5.116 10.386 -11.148 1.00 0.00 N ATOM 629 CZ ARG A 40 5.370 11.040 -10.016 1.00 0.00 C ATOM 630 NH1 ARG A 40 6.451 10.779 -9.287 1.00 0.00 N ATOM 631 NH2 ARG A 40 4.502 11.955 -9.617 1.00 0.00 N ATOM 0 H ARG A 40 6.133 6.498 -13.568 1.00 0.00 H new ATOM 0 HA ARG A 40 5.129 7.043 -10.953 1.00 0.00 H new ATOM 0 HB2 ARG A 40 3.702 7.505 -13.565 1.00 0.00 H new ATOM 0 HB3 ARG A 40 3.483 8.343 -12.042 1.00 0.00 H new ATOM 0 HG2 ARG A 40 5.987 8.446 -13.781 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.775 9.706 -13.660 1.00 0.00 H new ATOM 0 HD2 ARG A 40 6.392 8.716 -11.269 1.00 0.00 H new ATOM 0 HD3 ARG A 40 6.878 10.077 -12.259 1.00 0.00 H new ATOM 0 HE ARG A 40 4.180 10.509 -11.533 1.00 0.00 H new ATOM 0 HH11 ARG A 40 7.110 10.063 -9.591 1.00 0.00 H new ATOM 0 HH12 ARG A 40 6.621 11.295 -8.424 1.00 0.00 H new ATOM 0 HH21 ARG A 40 3.667 12.142 -10.172 1.00 0.00 H new ATOM 0 HH22 ARG A 40 4.668 12.473 -8.754 1.00 0.00 H new ATOM 645 N LEU A 41 3.572 4.878 -12.956 1.00 0.00 N ATOM 646 CA LEU A 41 2.659 3.759 -13.067 1.00 0.00 C ATOM 647 C LEU A 41 3.112 2.652 -12.114 1.00 0.00 C ATOM 648 O LEU A 41 2.296 2.185 -11.322 1.00 0.00 O ATOM 649 CB LEU A 41 2.574 3.292 -14.532 1.00 0.00 C ATOM 650 CG LEU A 41 2.031 4.371 -15.495 1.00 0.00 C ATOM 651 CD1 LEU A 41 2.234 3.984 -16.958 1.00 0.00 C ATOM 652 CD2 LEU A 41 0.545 4.642 -15.257 1.00 0.00 C ATOM 0 H LEU A 41 4.008 5.126 -13.844 1.00 0.00 H new ATOM 0 HA LEU A 41 1.651 4.054 -12.776 1.00 0.00 H new ATOM 0 HB2 LEU A 41 3.566 2.986 -14.865 1.00 0.00 H new ATOM 0 HB3 LEU A 41 1.933 2.412 -14.587 1.00 0.00 H new ATOM 0 HG LEU A 41 2.601 5.276 -15.286 1.00 0.00 H new ATOM 0 HD11 LEU A 41 1.838 4.770 -17.601 1.00 0.00 H new ATOM 0 HD12 LEU A 41 3.298 3.855 -17.156 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.711 3.050 -17.163 1.00 0.00 H new ATOM 0 HD21 LEU A 41 0.199 5.406 -15.953 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -0.022 3.724 -15.414 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.398 4.989 -14.234 1.00 0.00 H new ATOM 664 N GLN A 42 4.402 2.300 -12.090 1.00 0.00 N ATOM 665 CA GLN A 42 4.930 1.257 -11.212 1.00 0.00 C ATOM 666 C GLN A 42 4.724 1.582 -9.734 1.00 0.00 C ATOM 667 O GLN A 42 4.561 0.666 -8.932 1.00 0.00 O ATOM 668 CB GLN A 42 6.426 1.007 -11.489 1.00 0.00 C ATOM 669 CG GLN A 42 6.881 -0.409 -11.094 1.00 0.00 C ATOM 670 CD GLN A 42 6.073 -1.479 -11.830 1.00 0.00 C ATOM 671 OE1 GLN A 42 5.948 -1.453 -13.049 1.00 0.00 O ATOM 672 NE2 GLN A 42 5.449 -2.406 -11.129 1.00 0.00 N ATOM 0 H GLN A 42 5.110 2.734 -12.682 1.00 0.00 H new ATOM 0 HA GLN A 42 4.367 0.350 -11.435 1.00 0.00 H new ATOM 0 HB2 GLN A 42 6.625 1.164 -12.549 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.019 1.739 -10.941 1.00 0.00 H new ATOM 0 HG2 GLN A 42 7.940 -0.530 -11.322 1.00 0.00 H new ATOM 0 HG3 GLN A 42 6.769 -0.542 -10.018 1.00 0.00 H new ATOM 0 HE21 GLN A 42 5.550 -2.432 -10.114 1.00 0.00 H new ATOM 0 HE22 GLN A 42 4.866 -3.097 -11.602 1.00 0.00 H new ATOM 681 N ARG A 43 4.749 2.860 -9.347 1.00 0.00 N ATOM 682 CA ARG A 43 4.543 3.266 -7.957 1.00 0.00 C ATOM 683 C ARG A 43 3.050 3.377 -7.634 1.00 0.00 C ATOM 684 O ARG A 43 2.674 3.275 -6.466 1.00 0.00 O ATOM 685 CB ARG A 43 5.305 4.576 -7.692 1.00 0.00 C ATOM 686 CG ARG A 43 6.838 4.390 -7.738 1.00 0.00 C ATOM 687 CD ARG A 43 7.408 3.541 -6.594 1.00 0.00 C ATOM 688 NE ARG A 43 7.192 4.181 -5.291 1.00 0.00 N ATOM 689 CZ ARG A 43 7.982 5.086 -4.710 1.00 0.00 C ATOM 690 NH1 ARG A 43 9.181 5.382 -5.206 1.00 0.00 N ATOM 691 NH2 ARG A 43 7.578 5.717 -3.618 1.00 0.00 N ATOM 0 H ARG A 43 4.912 3.638 -9.986 1.00 0.00 H new ATOM 0 HA ARG A 43 4.942 2.504 -7.288 1.00 0.00 H new ATOM 0 HB2 ARG A 43 5.010 5.320 -8.432 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.019 4.967 -6.716 1.00 0.00 H new ATOM 0 HG2 ARG A 43 7.107 3.927 -8.687 1.00 0.00 H new ATOM 0 HG3 ARG A 43 7.312 5.371 -7.717 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.938 2.558 -6.600 1.00 0.00 H new ATOM 0 HD3 ARG A 43 8.475 3.385 -6.752 1.00 0.00 H new ATOM 0 HE ARG A 43 6.354 3.907 -4.778 1.00 0.00 H new ATOM 0 HH11 ARG A 43 9.514 4.913 -6.048 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.767 6.078 -4.744 1.00 0.00 H new ATOM 0 HH21 ARG A 43 6.662 5.512 -3.220 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.183 6.408 -3.175 1.00 0.00 H new ATOM 705 N LEU A 44 2.198 3.576 -8.640 1.00 0.00 N ATOM 706 CA LEU A 44 0.747 3.689 -8.512 1.00 0.00 C ATOM 707 C LEU A 44 0.086 2.310 -8.545 1.00 0.00 C ATOM 708 O LEU A 44 -1.031 2.175 -8.060 1.00 0.00 O ATOM 709 CB LEU A 44 0.186 4.537 -9.671 1.00 0.00 C ATOM 710 CG LEU A 44 0.452 6.048 -9.541 1.00 0.00 C ATOM 711 CD1 LEU A 44 0.216 6.746 -10.886 1.00 0.00 C ATOM 712 CD2 LEU A 44 -0.454 6.700 -8.496 1.00 0.00 C ATOM 0 H LEU A 44 2.514 3.666 -9.606 1.00 0.00 H new ATOM 0 HA LEU A 44 0.528 4.165 -7.556 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.619 4.183 -10.607 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.890 4.374 -9.736 1.00 0.00 H new ATOM 0 HG LEU A 44 1.490 6.161 -9.227 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.407 7.814 -10.780 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.889 6.329 -11.635 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.816 6.592 -11.200 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.233 7.766 -8.437 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.497 6.561 -8.781 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -0.279 6.239 -7.524 1.00 0.00 H new ATOM 724 N GLU A 45 0.776 1.282 -9.047 1.00 0.00 N ATOM 725 CA GLU A 45 0.318 -0.100 -9.196 1.00 0.00 C ATOM 726 C GLU A 45 -0.340 -0.719 -7.963 1.00 0.00 C ATOM 727 O GLU A 45 -1.179 -1.609 -8.133 1.00 0.00 O ATOM 728 CB GLU A 45 1.502 -0.974 -9.646 1.00 0.00 C ATOM 729 CG GLU A 45 1.659 -1.099 -11.168 1.00 0.00 C ATOM 730 CD GLU A 45 0.714 -2.117 -11.812 1.00 0.00 C ATOM 731 OE1 GLU A 45 0.423 -3.177 -11.209 1.00 0.00 O ATOM 732 OE2 GLU A 45 0.272 -1.870 -12.956 1.00 0.00 O ATOM 0 H GLU A 45 1.732 1.402 -9.382 1.00 0.00 H new ATOM 0 HA GLU A 45 -0.474 -0.065 -9.944 1.00 0.00 H new ATOM 0 HB2 GLU A 45 2.421 -0.560 -9.232 1.00 0.00 H new ATOM 0 HB3 GLU A 45 1.383 -1.971 -9.223 1.00 0.00 H new ATOM 0 HG2 GLU A 45 1.488 -0.123 -11.622 1.00 0.00 H new ATOM 0 HG3 GLU A 45 2.688 -1.380 -11.395 1.00 0.00 H new ATOM 739 N ARG A 46 0.004 -0.306 -6.739 1.00 0.00 N ATOM 740 CA ARG A 46 -0.637 -0.896 -5.561 1.00 0.00 C ATOM 741 C ARG A 46 -2.106 -0.485 -5.448 1.00 0.00 C ATOM 742 O ARG A 46 -2.898 -1.296 -4.974 1.00 0.00 O ATOM 743 CB ARG A 46 0.107 -0.542 -4.264 1.00 0.00 C ATOM 744 CG ARG A 46 0.350 -1.771 -3.376 1.00 0.00 C ATOM 745 CD ARG A 46 1.604 -2.558 -3.771 1.00 0.00 C ATOM 746 NE ARG A 46 2.837 -1.812 -3.470 1.00 0.00 N ATOM 747 CZ ARG A 46 4.084 -2.289 -3.553 1.00 0.00 C ATOM 748 NH1 ARG A 46 4.317 -3.505 -4.041 1.00 0.00 N ATOM 749 NH2 ARG A 46 5.096 -1.543 -3.138 1.00 0.00 N ATOM 0 H ARG A 46 0.701 0.412 -6.541 1.00 0.00 H new ATOM 0 HA ARG A 46 -0.591 -1.976 -5.698 1.00 0.00 H new ATOM 0 HB2 ARG A 46 1.063 -0.080 -4.511 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -0.469 0.197 -3.708 1.00 0.00 H new ATOM 0 HG2 ARG A 46 0.441 -1.450 -2.338 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -0.517 -2.429 -3.431 1.00 0.00 H new ATOM 0 HD2 ARG A 46 1.617 -3.510 -3.241 1.00 0.00 H new ATOM 0 HD3 ARG A 46 1.569 -2.787 -4.836 1.00 0.00 H new ATOM 0 HE ARG A 46 2.731 -0.843 -3.171 1.00 0.00 H new ATOM 0 HH11 ARG A 46 3.540 -4.085 -4.357 1.00 0.00 H new ATOM 0 HH12 ARG A 46 5.273 -3.857 -4.099 1.00 0.00 H new ATOM 0 HH21 ARG A 46 4.922 -0.612 -2.759 1.00 0.00 H new ATOM 0 HH22 ARG A 46 6.050 -1.899 -3.198 1.00 0.00 H new ATOM 763 N LEU A 47 -2.477 0.724 -5.894 1.00 0.00 N ATOM 764 CA LEU A 47 -3.852 1.233 -5.834 1.00 0.00 C ATOM 765 C LEU A 47 -4.815 0.230 -6.478 1.00 0.00 C ATOM 766 O LEU A 47 -5.682 -0.298 -5.774 1.00 0.00 O ATOM 767 CB LEU A 47 -3.989 2.635 -6.470 1.00 0.00 C ATOM 768 CG LEU A 47 -3.470 3.808 -5.626 1.00 0.00 C ATOM 769 CD1 LEU A 47 -3.404 5.063 -6.502 1.00 0.00 C ATOM 770 CD2 LEU A 47 -4.382 4.074 -4.423 1.00 0.00 C ATOM 0 H LEU A 47 -1.820 1.383 -6.312 1.00 0.00 H new ATOM 0 HA LEU A 47 -4.117 1.347 -4.783 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.458 2.634 -7.422 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -5.042 2.810 -6.693 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.479 3.553 -5.251 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -3.036 5.901 -5.910 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -2.729 4.887 -7.340 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -4.399 5.295 -6.880 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -3.988 4.910 -3.845 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.385 4.316 -4.774 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.422 3.185 -3.793 1.00 0.00 H new ATOM 782 N PRO A 48 -4.692 -0.076 -7.787 1.00 0.00 N ATOM 783 CA PRO A 48 -5.578 -1.029 -8.420 1.00 0.00 C ATOM 784 C PRO A 48 -5.387 -2.427 -7.844 1.00 0.00 C ATOM 785 O PRO A 48 -6.359 -3.165 -7.825 1.00 0.00 O ATOM 786 CB PRO A 48 -5.265 -1.000 -9.915 1.00 0.00 C ATOM 787 CG PRO A 48 -3.833 -0.484 -9.971 1.00 0.00 C ATOM 788 CD PRO A 48 -3.751 0.441 -8.769 1.00 0.00 C ATOM 0 HA PRO A 48 -6.620 -0.764 -8.240 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -5.352 -1.990 -10.362 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -5.949 -0.345 -10.455 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -3.109 -1.296 -9.904 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -3.632 0.046 -10.902 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -2.739 0.462 -8.364 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -4.004 1.464 -9.048 1.00 0.00 H new ATOM 796 N GLU A 49 -4.194 -2.811 -7.378 1.00 0.00 N ATOM 797 CA GLU A 49 -3.975 -4.144 -6.828 1.00 0.00 C ATOM 798 C GLU A 49 -4.857 -4.378 -5.599 1.00 0.00 C ATOM 799 O GLU A 49 -5.618 -5.344 -5.583 1.00 0.00 O ATOM 800 CB GLU A 49 -2.488 -4.363 -6.519 1.00 0.00 C ATOM 801 CG GLU A 49 -2.131 -5.836 -6.305 1.00 0.00 C ATOM 802 CD GLU A 49 -2.099 -6.646 -7.611 1.00 0.00 C ATOM 803 OE1 GLU A 49 -3.182 -6.934 -8.187 1.00 0.00 O ATOM 804 OE2 GLU A 49 -1.000 -7.003 -8.094 1.00 0.00 O ATOM 0 H GLU A 49 -3.367 -2.214 -7.373 1.00 0.00 H new ATOM 0 HA GLU A 49 -4.265 -4.882 -7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -1.890 -3.966 -7.339 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -2.221 -3.797 -5.627 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.157 -5.901 -5.821 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -2.855 -6.284 -5.625 1.00 0.00 H new ATOM 811 N LEU A 50 -4.782 -3.505 -4.585 1.00 0.00 N ATOM 812 CA LEU A 50 -5.591 -3.633 -3.368 1.00 0.00 C ATOM 813 C LEU A 50 -7.070 -3.679 -3.755 1.00 0.00 C ATOM 814 O LEU A 50 -7.813 -4.563 -3.324 1.00 0.00 O ATOM 815 CB LEU A 50 -5.345 -2.461 -2.390 1.00 0.00 C ATOM 816 CG LEU A 50 -4.234 -2.620 -1.329 1.00 0.00 C ATOM 817 CD1 LEU A 50 -4.373 -3.898 -0.495 1.00 0.00 C ATOM 818 CD2 LEU A 50 -2.834 -2.575 -1.936 1.00 0.00 C ATOM 0 H LEU A 50 -4.162 -2.695 -4.586 1.00 0.00 H new ATOM 0 HA LEU A 50 -5.302 -4.553 -2.860 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -5.116 -1.575 -2.982 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -6.280 -2.262 -1.866 1.00 0.00 H new ATOM 0 HG LEU A 50 -4.365 -1.763 -0.669 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -3.562 -3.949 0.231 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -5.329 -3.888 0.029 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.328 -4.767 -1.151 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.091 -2.691 -1.147 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -2.725 -3.383 -2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -2.685 -1.618 -2.436 1.00 0.00 H new ATOM 830 N ALA A 51 -7.485 -2.724 -4.592 1.00 0.00 N ATOM 831 CA ALA A 51 -8.841 -2.588 -5.095 1.00 0.00 C ATOM 832 C ALA A 51 -9.334 -3.887 -5.744 1.00 0.00 C ATOM 833 O ALA A 51 -10.396 -4.410 -5.387 1.00 0.00 O ATOM 834 CB ALA A 51 -8.846 -1.433 -6.098 1.00 0.00 C ATOM 0 H ALA A 51 -6.858 -2.002 -4.946 1.00 0.00 H new ATOM 0 HA ALA A 51 -9.525 -2.379 -4.272 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.852 -1.302 -6.497 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -8.531 -0.516 -5.599 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.158 -1.656 -6.914 1.00 0.00 H new ATOM 840 N ARG A 52 -8.579 -4.396 -6.721 1.00 0.00 N ATOM 841 CA ARG A 52 -8.874 -5.613 -7.464 1.00 0.00 C ATOM 842 C ARG A 52 -8.982 -6.784 -6.505 1.00 0.00 C ATOM 843 O ARG A 52 -9.995 -7.479 -6.545 1.00 0.00 O ATOM 844 CB ARG A 52 -7.786 -5.881 -8.518 1.00 0.00 C ATOM 845 CG ARG A 52 -7.870 -4.959 -9.747 1.00 0.00 C ATOM 846 CD ARG A 52 -6.520 -4.937 -10.474 1.00 0.00 C ATOM 847 NE ARG A 52 -6.565 -4.169 -11.728 1.00 0.00 N ATOM 848 CZ ARG A 52 -5.784 -4.374 -12.794 1.00 0.00 C ATOM 849 NH1 ARG A 52 -4.783 -5.242 -12.756 1.00 0.00 N ATOM 850 NH2 ARG A 52 -5.994 -3.666 -13.891 1.00 0.00 N ATOM 0 H ARG A 52 -7.713 -3.951 -7.024 1.00 0.00 H new ATOM 0 HA ARG A 52 -9.825 -5.488 -7.982 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -6.807 -5.763 -8.054 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.860 -6.917 -8.847 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -8.651 -5.308 -10.422 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -8.143 -3.950 -9.438 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -5.764 -4.508 -9.816 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -6.211 -5.960 -10.690 1.00 0.00 H new ATOM 0 HE ARG A 52 -7.250 -3.416 -11.790 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -4.597 -5.768 -11.902 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -4.199 -5.384 -13.580 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -6.744 -2.975 -13.916 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -5.406 -3.811 -14.712 1.00 0.00 H new ATOM 864 N VAL A 53 -7.985 -7.004 -5.643 1.00 0.00 N ATOM 865 CA VAL A 53 -8.009 -8.111 -4.697 1.00 0.00 C ATOM 866 C VAL A 53 -9.283 -8.044 -3.861 1.00 0.00 C ATOM 867 O VAL A 53 -9.983 -9.049 -3.801 1.00 0.00 O ATOM 868 CB VAL A 53 -6.732 -8.164 -3.835 1.00 0.00 C ATOM 869 CG1 VAL A 53 -6.844 -9.254 -2.755 1.00 0.00 C ATOM 870 CG2 VAL A 53 -5.507 -8.506 -4.690 1.00 0.00 C ATOM 0 H VAL A 53 -7.149 -6.423 -5.585 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.021 -9.048 -5.254 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.620 -7.180 -3.380 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -5.931 -9.272 -2.160 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.695 -9.039 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.986 -10.224 -3.231 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.619 -8.537 -4.058 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.652 -9.478 -5.161 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -5.377 -7.746 -5.460 1.00 0.00 H new ATOM 880 N LEU A 54 -9.630 -6.898 -3.266 1.00 0.00 N ATOM 881 CA LEU A 54 -10.826 -6.755 -2.443 1.00 0.00 C ATOM 882 C LEU A 54 -12.067 -7.230 -3.204 1.00 0.00 C ATOM 883 O LEU A 54 -12.807 -8.089 -2.719 1.00 0.00 O ATOM 884 CB LEU A 54 -10.960 -5.305 -1.950 1.00 0.00 C ATOM 885 CG LEU A 54 -12.322 -5.015 -1.290 1.00 0.00 C ATOM 886 CD1 LEU A 54 -12.655 -5.993 -0.165 1.00 0.00 C ATOM 887 CD2 LEU A 54 -12.326 -3.609 -0.700 1.00 0.00 C ATOM 0 H LEU A 54 -9.083 -6.041 -3.345 1.00 0.00 H new ATOM 0 HA LEU A 54 -10.734 -7.391 -1.563 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.164 -5.096 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -10.819 -4.627 -2.792 1.00 0.00 H new ATOM 0 HG LEU A 54 -13.071 -5.121 -2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -13.625 -5.740 0.262 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -12.687 -7.007 -0.562 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -11.890 -5.931 0.609 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -13.292 -3.412 -0.236 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -11.539 -3.527 0.050 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -12.149 -2.881 -1.492 1.00 0.00 H new ATOM 899 N ARG A 55 -12.324 -6.701 -4.406 1.00 0.00 N ATOM 900 CA ARG A 55 -13.508 -7.161 -5.139 1.00 0.00 C ATOM 901 C ARG A 55 -13.416 -8.640 -5.488 1.00 0.00 C ATOM 902 O ARG A 55 -14.458 -9.283 -5.574 1.00 0.00 O ATOM 903 CB ARG A 55 -13.854 -6.294 -6.340 1.00 0.00 C ATOM 904 CG ARG A 55 -12.766 -6.099 -7.390 1.00 0.00 C ATOM 905 CD ARG A 55 -13.321 -5.472 -8.663 1.00 0.00 C ATOM 906 NE ARG A 55 -13.921 -6.436 -9.599 1.00 0.00 N ATOM 907 CZ ARG A 55 -14.397 -6.070 -10.797 1.00 0.00 C ATOM 908 NH1 ARG A 55 -14.778 -4.817 -11.026 1.00 0.00 N ATOM 909 NH2 ARG A 55 -14.467 -6.969 -11.764 1.00 0.00 N ATOM 0 H ARG A 55 -11.761 -5.990 -4.873 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.350 -7.045 -4.457 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -14.725 -6.728 -6.831 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -14.151 -5.311 -5.974 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -11.978 -5.464 -6.985 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -12.311 -7.061 -7.626 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.072 -4.731 -8.392 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -12.518 -4.940 -9.173 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.977 -7.417 -9.326 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -14.710 -4.120 -10.285 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.138 -4.553 -11.943 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -14.161 -7.927 -11.593 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -14.827 -6.705 -12.681 1.00 0.00 H new ATOM 923 N ASN A 56 -12.210 -9.173 -5.687 1.00 0.00 N ATOM 924 CA ASN A 56 -11.995 -10.584 -5.988 1.00 0.00 C ATOM 925 C ASN A 56 -12.455 -11.412 -4.778 1.00 0.00 C ATOM 926 O ASN A 56 -13.145 -12.416 -4.944 1.00 0.00 O ATOM 927 CB ASN A 56 -10.542 -10.857 -6.416 1.00 0.00 C ATOM 928 CG ASN A 56 -9.890 -12.011 -5.675 1.00 0.00 C ATOM 929 OD1 ASN A 56 -9.928 -13.153 -6.126 1.00 0.00 O ATOM 930 ND2 ASN A 56 -9.282 -11.716 -4.543 1.00 0.00 N ATOM 0 H ASN A 56 -11.348 -8.630 -5.643 1.00 0.00 H new ATOM 0 HA ASN A 56 -12.593 -10.886 -6.848 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -10.522 -11.067 -7.485 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -9.951 -9.955 -6.257 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -8.820 -12.450 -4.006 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -9.274 -10.754 -4.204 1.00 0.00 H new ATOM 937 N VAL A 57 -12.132 -10.965 -3.564 1.00 0.00 N ATOM 938 CA VAL A 57 -12.523 -11.639 -2.338 1.00 0.00 C ATOM 939 C VAL A 57 -14.050 -11.589 -2.256 1.00 0.00 C ATOM 940 O VAL A 57 -14.695 -12.630 -2.152 1.00 0.00 O ATOM 941 CB VAL A 57 -11.839 -10.976 -1.118 1.00 0.00 C ATOM 942 CG1 VAL A 57 -12.288 -11.602 0.203 1.00 0.00 C ATOM 943 CG2 VAL A 57 -10.308 -11.087 -1.162 1.00 0.00 C ATOM 0 H VAL A 57 -11.587 -10.117 -3.409 1.00 0.00 H new ATOM 0 HA VAL A 57 -12.200 -12.680 -2.336 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.140 -9.930 -1.172 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.783 -11.105 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -13.366 -11.485 0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.036 -12.662 0.207 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -9.883 -10.605 -0.282 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -10.020 -12.138 -1.175 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -9.933 -10.597 -2.061 1.00 0.00 H new ATOM 953 N PHE A 58 -14.658 -10.402 -2.392 1.00 0.00 N ATOM 954 CA PHE A 58 -16.107 -10.271 -2.295 1.00 0.00 C ATOM 955 C PHE A 58 -16.844 -11.101 -3.337 1.00 0.00 C ATOM 956 O PHE A 58 -17.879 -11.708 -3.048 1.00 0.00 O ATOM 957 CB PHE A 58 -16.557 -8.799 -2.349 1.00 0.00 C ATOM 958 CG PHE A 58 -16.660 -8.117 -0.998 1.00 0.00 C ATOM 959 CD1 PHE A 58 -15.519 -7.983 -0.190 1.00 0.00 C ATOM 960 CD2 PHE A 58 -17.913 -7.680 -0.511 1.00 0.00 C ATOM 961 CE1 PHE A 58 -15.632 -7.425 1.091 1.00 0.00 C ATOM 962 CE2 PHE A 58 -18.022 -7.143 0.784 1.00 0.00 C ATOM 963 CZ PHE A 58 -16.878 -7.019 1.586 1.00 0.00 C ATOM 0 H PHE A 58 -14.166 -9.526 -2.569 1.00 0.00 H new ATOM 0 HA PHE A 58 -16.377 -10.670 -1.317 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -15.855 -8.241 -2.970 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -17.528 -8.748 -2.841 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -14.556 -8.309 -0.555 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -18.790 -7.759 -1.136 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -14.750 -7.307 1.702 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -18.984 -6.827 1.160 1.00 0.00 H new ATOM 0 HZ PHE A 58 -16.958 -6.611 2.583 1.00 0.00 H new ATOM 973 N VAL A 59 -16.340 -11.119 -4.570 1.00 0.00 N ATOM 974 CA VAL A 59 -16.992 -11.884 -5.621 1.00 0.00 C ATOM 975 C VAL A 59 -16.884 -13.385 -5.354 1.00 0.00 C ATOM 976 O VAL A 59 -17.763 -14.123 -5.797 1.00 0.00 O ATOM 977 CB VAL A 59 -16.549 -11.418 -7.017 1.00 0.00 C ATOM 978 CG1 VAL A 59 -15.249 -12.034 -7.531 1.00 0.00 C ATOM 979 CG2 VAL A 59 -17.644 -11.729 -8.039 1.00 0.00 C ATOM 0 H VAL A 59 -15.498 -10.621 -4.858 1.00 0.00 H new ATOM 0 HA VAL A 59 -18.063 -11.681 -5.607 1.00 0.00 H new ATOM 0 HB VAL A 59 -16.369 -10.349 -6.904 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -15.026 -11.639 -8.522 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -14.435 -11.786 -6.850 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -15.357 -13.117 -7.588 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -17.325 -11.397 -9.027 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -17.828 -12.803 -8.060 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.560 -11.209 -7.760 1.00 0.00 H new ATOM 989 N SER A 60 -15.864 -13.852 -4.632 1.00 0.00 N ATOM 990 CA SER A 60 -15.720 -15.267 -4.320 1.00 0.00 C ATOM 991 C SER A 60 -16.504 -15.621 -3.048 1.00 0.00 C ATOM 992 O SER A 60 -17.052 -16.718 -2.966 1.00 0.00 O ATOM 993 CB SER A 60 -14.234 -15.620 -4.177 1.00 0.00 C ATOM 994 OG SER A 60 -14.012 -16.943 -4.636 1.00 0.00 O ATOM 0 H SER A 60 -15.123 -13.263 -4.252 1.00 0.00 H new ATOM 0 HA SER A 60 -16.135 -15.857 -5.137 1.00 0.00 H new ATOM 0 HB2 SER A 60 -13.627 -14.919 -4.750 1.00 0.00 H new ATOM 0 HB3 SER A 60 -13.927 -15.530 -3.135 1.00 0.00 H new ATOM 0 HG SER A 60 -13.062 -17.166 -4.545 1.00 0.00 H new ATOM 1000 N GLU A 61 -16.685 -14.680 -2.116 1.00 0.00 N ATOM 1001 CA GLU A 61 -17.386 -14.918 -0.854 1.00 0.00 C ATOM 1002 C GLU A 61 -18.861 -15.281 -1.044 1.00 0.00 C ATOM 1003 O GLU A 61 -19.450 -15.924 -0.178 1.00 0.00 O ATOM 1004 CB GLU A 61 -17.255 -13.675 0.040 1.00 0.00 C ATOM 1005 CG GLU A 61 -17.289 -13.935 1.554 1.00 0.00 C ATOM 1006 CD GLU A 61 -16.445 -15.104 2.055 1.00 0.00 C ATOM 1007 OE1 GLU A 61 -15.232 -14.934 2.300 1.00 0.00 O ATOM 1008 OE2 GLU A 61 -17.042 -16.193 2.234 1.00 0.00 O ATOM 0 H GLU A 61 -16.345 -13.724 -2.219 1.00 0.00 H new ATOM 0 HA GLU A 61 -16.918 -15.780 -0.379 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.318 -13.173 -0.203 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.061 -12.984 -0.209 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.959 -13.030 2.065 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -18.324 -14.108 1.849 1.00 0.00 H new ATOM 1015 N ARG A 62 -19.465 -14.888 -2.174 1.00 0.00 N ATOM 1016 CA ARG A 62 -20.868 -15.142 -2.532 1.00 0.00 C ATOM 1017 C ARG A 62 -21.867 -14.346 -1.668 1.00 0.00 C ATOM 1018 O ARG A 62 -23.078 -14.525 -1.826 1.00 0.00 O ATOM 1019 CB ARG A 62 -21.128 -16.663 -2.597 1.00 0.00 C ATOM 1020 CG ARG A 62 -22.357 -17.063 -3.434 1.00 0.00 C ATOM 1021 CD ARG A 62 -22.064 -18.198 -4.427 1.00 0.00 C ATOM 1022 NE ARG A 62 -21.469 -17.709 -5.674 1.00 0.00 N ATOM 1023 CZ ARG A 62 -20.974 -18.421 -6.694 1.00 0.00 C ATOM 1024 NH1 ARG A 62 -20.995 -19.745 -6.703 1.00 0.00 N ATOM 1025 NH2 ARG A 62 -20.434 -17.788 -7.724 1.00 0.00 N ATOM 0 H ARG A 62 -18.969 -14.362 -2.894 1.00 0.00 H new ATOM 0 HA ARG A 62 -21.050 -14.753 -3.534 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -20.247 -17.153 -3.011 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -21.256 -17.041 -1.583 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -23.160 -17.371 -2.765 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -22.715 -16.192 -3.982 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -21.389 -18.918 -3.963 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -22.989 -18.728 -4.652 1.00 0.00 H new ATOM 0 HE ARG A 62 -21.427 -16.695 -5.778 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -21.397 -20.254 -5.916 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -20.609 -20.256 -7.497 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -20.398 -16.769 -7.734 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -20.054 -18.320 -8.507 1.00 0.00 H new ATOM 1039 N LYS A 63 -21.409 -13.453 -0.775 1.00 0.00 N ATOM 1040 CA LYS A 63 -22.249 -12.612 0.090 1.00 0.00 C ATOM 1041 C LYS A 63 -21.739 -11.165 0.030 1.00 0.00 C ATOM 1042 O LYS A 63 -20.685 -10.888 0.587 1.00 0.00 O ATOM 1043 CB LYS A 63 -22.404 -13.152 1.531 1.00 0.00 C ATOM 1044 CG LYS A 63 -21.112 -13.677 2.177 1.00 0.00 C ATOM 1045 CD LYS A 63 -21.107 -13.691 3.718 1.00 0.00 C ATOM 1046 CE LYS A 63 -22.092 -14.688 4.337 1.00 0.00 C ATOM 1047 NZ LYS A 63 -21.811 -14.945 5.769 1.00 0.00 N ATOM 0 H LYS A 63 -20.412 -13.292 -0.632 1.00 0.00 H new ATOM 0 HA LYS A 63 -23.268 -12.639 -0.296 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -22.807 -12.357 2.158 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -23.140 -13.956 1.523 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -20.932 -14.691 1.820 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -20.278 -13.065 1.833 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -20.101 -13.927 4.065 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -21.343 -12.691 4.081 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -23.107 -14.305 4.232 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -22.048 -15.628 3.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -22.504 -15.625 6.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.853 -15.336 5.870 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -21.879 -14.054 6.301 1.00 0.00 H new ATOM 1061 N PRO A 64 -22.437 -10.214 -0.621 1.00 0.00 N ATOM 1062 CA PRO A 64 -22.006 -8.817 -0.743 1.00 0.00 C ATOM 1063 C PRO A 64 -21.912 -8.032 0.573 1.00 0.00 C ATOM 1064 O PRO A 64 -21.388 -6.917 0.559 1.00 0.00 O ATOM 1065 CB PRO A 64 -22.973 -8.159 -1.735 1.00 0.00 C ATOM 1066 CG PRO A 64 -24.224 -9.023 -1.639 1.00 0.00 C ATOM 1067 CD PRO A 64 -23.695 -10.411 -1.309 1.00 0.00 C ATOM 0 HA PRO A 64 -20.974 -8.803 -1.094 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -23.179 -7.123 -1.467 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -22.567 -8.152 -2.747 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -24.900 -8.660 -0.865 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -24.782 -9.022 -2.576 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -24.400 -10.957 -0.682 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -23.554 -10.999 -2.216 1.00 0.00 H new ATOM 1075 N ALA A 65 -22.414 -8.573 1.685 1.00 0.00 N ATOM 1076 CA ALA A 65 -22.377 -7.968 3.013 1.00 0.00 C ATOM 1077 C ALA A 65 -21.641 -8.948 3.916 1.00 0.00 C ATOM 1078 O ALA A 65 -22.089 -10.092 4.043 1.00 0.00 O ATOM 1079 CB ALA A 65 -23.782 -7.674 3.546 1.00 0.00 C ATOM 0 H ALA A 65 -22.876 -9.482 1.682 1.00 0.00 H new ATOM 0 HA ALA A 65 -21.866 -7.006 2.978 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -23.709 -7.225 4.536 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -24.290 -6.985 2.871 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -24.349 -8.603 3.610 1.00 0.00 H new ATOM 1085 N LEU A 66 -20.518 -8.534 4.500 1.00 0.00 N ATOM 1086 CA LEU A 66 -19.684 -9.350 5.378 1.00 0.00 C ATOM 1087 C LEU A 66 -19.609 -8.746 6.763 1.00 0.00 C ATOM 1088 O LEU A 66 -19.772 -7.537 6.910 1.00 0.00 O ATOM 1089 CB LEU A 66 -18.234 -9.389 4.853 1.00 0.00 C ATOM 1090 CG LEU A 66 -18.040 -9.946 3.440 1.00 0.00 C ATOM 1091 CD1 LEU A 66 -16.549 -10.125 3.148 1.00 0.00 C ATOM 1092 CD2 LEU A 66 -18.756 -11.281 3.282 1.00 0.00 C ATOM 0 H LEU A 66 -20.152 -7.591 4.370 1.00 0.00 H new ATOM 0 HA LEU A 66 -20.130 -10.344 5.406 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -17.833 -8.376 4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -17.637 -9.987 5.542 1.00 0.00 H new ATOM 0 HG LEU A 66 -18.466 -9.236 2.731 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -16.421 -10.522 2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -16.045 -9.162 3.226 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -16.118 -10.819 3.869 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -18.604 -11.658 2.270 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -18.354 -11.996 4.000 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -19.822 -11.146 3.463 1.00 0.00 H new ATOM 1104 N THR A 67 -19.369 -9.574 7.773 1.00 0.00 N ATOM 1105 CA THR A 67 -19.225 -9.078 9.130 1.00 0.00 C ATOM 1106 C THR A 67 -17.869 -8.350 9.159 1.00 0.00 C ATOM 1107 O THR A 67 -16.967 -8.712 8.396 1.00 0.00 O ATOM 1108 CB THR A 67 -19.252 -10.250 10.124 1.00 0.00 C ATOM 1109 OG1 THR A 67 -20.174 -11.259 9.729 1.00 0.00 O ATOM 1110 CG2 THR A 67 -19.618 -9.756 11.519 1.00 0.00 C ATOM 0 H THR A 67 -19.271 -10.585 7.676 1.00 0.00 H new ATOM 0 HA THR A 67 -20.036 -8.408 9.416 1.00 0.00 H new ATOM 0 HB THR A 67 -18.252 -10.684 10.135 1.00 0.00 H new ATOM 0 HG1 THR A 67 -21.045 -10.851 9.540 1.00 0.00 H new ATOM 0 HG21 THR A 67 -19.633 -10.598 12.211 1.00 0.00 H new ATOM 0 HG22 THR A 67 -18.880 -9.026 11.852 1.00 0.00 H new ATOM 0 HG23 THR A 67 -20.603 -9.290 11.493 1.00 0.00 H new ATOM 1118 N MET A 68 -17.697 -7.361 10.039 1.00 0.00 N ATOM 1119 CA MET A 68 -16.453 -6.604 10.162 1.00 0.00 C ATOM 1120 C MET A 68 -15.252 -7.542 10.345 1.00 0.00 C ATOM 1121 O MET A 68 -14.235 -7.368 9.679 1.00 0.00 O ATOM 1122 CB MET A 68 -16.616 -5.602 11.306 1.00 0.00 C ATOM 1123 CG MET A 68 -15.355 -4.785 11.596 1.00 0.00 C ATOM 1124 SD MET A 68 -15.706 -3.244 12.485 1.00 0.00 S ATOM 1125 CE MET A 68 -16.216 -2.223 11.077 1.00 0.00 C ATOM 0 H MET A 68 -18.423 -7.062 10.690 1.00 0.00 H new ATOM 0 HA MET A 68 -16.248 -6.050 9.246 1.00 0.00 H new ATOM 0 HB2 MET A 68 -17.432 -4.920 11.066 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.905 -6.140 12.209 1.00 0.00 H new ATOM 0 HG2 MET A 68 -14.663 -5.389 12.184 1.00 0.00 H new ATOM 0 HG3 MET A 68 -14.855 -4.551 10.656 1.00 0.00 H new ATOM 0 HE1 MET A 68 -16.424 -1.209 11.419 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.417 -2.199 10.336 1.00 0.00 H new ATOM 0 HE3 MET A 68 -17.115 -2.646 10.628 1.00 0.00 H new ATOM 1135 N GLU A 69 -15.396 -8.575 11.175 1.00 0.00 N ATOM 1136 CA GLU A 69 -14.350 -9.555 11.437 1.00 0.00 C ATOM 1137 C GLU A 69 -13.970 -10.322 10.163 1.00 0.00 C ATOM 1138 O GLU A 69 -12.790 -10.555 9.914 1.00 0.00 O ATOM 1139 CB GLU A 69 -14.873 -10.520 12.502 1.00 0.00 C ATOM 1140 CG GLU A 69 -13.838 -11.570 12.920 1.00 0.00 C ATOM 1141 CD GLU A 69 -14.362 -12.537 13.987 1.00 0.00 C ATOM 1142 OE1 GLU A 69 -15.452 -12.297 14.561 1.00 0.00 O ATOM 1143 OE2 GLU A 69 -13.705 -13.595 14.161 1.00 0.00 O ATOM 0 H GLU A 69 -16.257 -8.754 11.691 1.00 0.00 H new ATOM 0 HA GLU A 69 -13.450 -9.047 11.784 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -15.180 -9.952 13.380 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -15.761 -11.025 12.122 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -13.531 -12.138 12.042 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -12.950 -11.065 13.300 1.00 0.00 H new ATOM 1150 N VAL A 70 -14.952 -10.710 9.344 1.00 0.00 N ATOM 1151 CA VAL A 70 -14.705 -11.458 8.114 1.00 0.00 C ATOM 1152 C VAL A 70 -13.832 -10.630 7.164 1.00 0.00 C ATOM 1153 O VAL A 70 -12.783 -11.110 6.732 1.00 0.00 O ATOM 1154 CB VAL A 70 -16.036 -11.899 7.460 1.00 0.00 C ATOM 1155 CG1 VAL A 70 -15.806 -12.726 6.183 1.00 0.00 C ATOM 1156 CG2 VAL A 70 -16.911 -12.750 8.393 1.00 0.00 C ATOM 0 H VAL A 70 -15.938 -10.513 9.517 1.00 0.00 H new ATOM 0 HA VAL A 70 -14.158 -12.370 8.352 1.00 0.00 H new ATOM 0 HB VAL A 70 -16.546 -10.964 7.228 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -16.767 -13.014 5.758 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -15.253 -12.129 5.458 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -15.235 -13.622 6.427 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -17.830 -13.028 7.877 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -16.369 -13.651 8.679 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -17.156 -12.175 9.286 1.00 0.00 H new ATOM 1166 N VAL A 71 -14.243 -9.401 6.829 1.00 0.00 N ATOM 1167 CA VAL A 71 -13.486 -8.536 5.914 1.00 0.00 C ATOM 1168 C VAL A 71 -12.089 -8.213 6.480 1.00 0.00 C ATOM 1169 O VAL A 71 -11.119 -8.068 5.731 1.00 0.00 O ATOM 1170 CB VAL A 71 -14.337 -7.301 5.530 1.00 0.00 C ATOM 1171 CG1 VAL A 71 -14.775 -6.437 6.719 1.00 0.00 C ATOM 1172 CG2 VAL A 71 -13.638 -6.383 4.525 1.00 0.00 C ATOM 0 H VAL A 71 -15.103 -8.980 7.181 1.00 0.00 H new ATOM 0 HA VAL A 71 -13.286 -9.062 4.981 1.00 0.00 H new ATOM 0 HB VAL A 71 -15.222 -7.750 5.080 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -15.366 -5.595 6.359 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -15.377 -7.036 7.402 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -13.894 -6.065 7.242 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -14.284 -5.536 4.295 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -12.703 -6.021 4.952 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -13.428 -6.938 3.610 1.00 0.00 H new ATOM 1182 N CYS A 72 -11.993 -8.127 7.806 1.00 0.00 N ATOM 1183 CA CYS A 72 -10.794 -7.841 8.580 1.00 0.00 C ATOM 1184 C CYS A 72 -9.805 -8.983 8.382 1.00 0.00 C ATOM 1185 O CYS A 72 -8.679 -8.738 7.935 1.00 0.00 O ATOM 1186 CB CYS A 72 -11.176 -7.637 10.056 1.00 0.00 C ATOM 1187 SG CYS A 72 -9.750 -7.777 11.166 1.00 0.00 S ATOM 0 H CYS A 72 -12.807 -8.265 8.404 1.00 0.00 H new ATOM 0 HA CYS A 72 -10.316 -6.921 8.243 1.00 0.00 H new ATOM 0 HB2 CYS A 72 -11.632 -6.655 10.178 1.00 0.00 H new ATOM 0 HB3 CYS A 72 -11.927 -8.375 10.339 1.00 0.00 H new ATOM 0 HG CYS A 72 -10.136 -7.594 12.394 1.00 0.00 H new ATOM 1193 N ALA A 73 -10.218 -10.211 8.719 1.00 0.00 N ATOM 1194 CA ALA A 73 -9.414 -11.414 8.578 1.00 0.00 C ATOM 1195 C ALA A 73 -8.954 -11.500 7.125 1.00 0.00 C ATOM 1196 O ALA A 73 -7.765 -11.626 6.848 1.00 0.00 O ATOM 1197 CB ALA A 73 -10.233 -12.641 8.990 1.00 0.00 C ATOM 0 H ALA A 73 -11.144 -10.391 9.106 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.540 -11.381 9.229 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -9.624 -13.538 8.882 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -10.545 -12.538 10.029 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -11.114 -12.721 8.353 1.00 0.00 H new ATOM 1203 N ARG A 74 -9.892 -11.342 6.188 1.00 0.00 N ATOM 1204 CA ARG A 74 -9.648 -11.380 4.753 1.00 0.00 C ATOM 1205 C ARG A 74 -8.563 -10.392 4.333 1.00 0.00 C ATOM 1206 O ARG A 74 -7.829 -10.678 3.383 1.00 0.00 O ATOM 1207 CB ARG A 74 -10.964 -11.076 4.016 1.00 0.00 C ATOM 1208 CG ARG A 74 -11.922 -12.260 3.791 1.00 0.00 C ATOM 1209 CD ARG A 74 -11.317 -13.414 2.973 1.00 0.00 C ATOM 1210 NE ARG A 74 -10.640 -14.378 3.851 1.00 0.00 N ATOM 1211 CZ ARG A 74 -11.259 -15.249 4.649 1.00 0.00 C ATOM 1212 NH1 ARG A 74 -12.557 -15.517 4.501 1.00 0.00 N ATOM 1213 NH2 ARG A 74 -10.551 -15.803 5.619 1.00 0.00 N ATOM 0 H ARG A 74 -10.872 -11.179 6.420 1.00 0.00 H new ATOM 0 HA ARG A 74 -9.291 -12.375 4.489 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -11.498 -10.309 4.576 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -10.718 -10.648 3.044 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -12.240 -12.644 4.760 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -12.816 -11.898 3.282 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -12.103 -13.918 2.410 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -10.608 -13.018 2.246 1.00 0.00 H new ATOM 0 HE ARG A 74 -9.620 -14.381 3.850 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -13.093 -15.053 3.768 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -13.013 -16.186 5.121 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -9.567 -15.559 5.736 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -10.988 -16.474 6.250 1.00 0.00 H new ATOM 1227 N MET A 75 -8.465 -9.235 4.989 1.00 0.00 N ATOM 1228 CA MET A 75 -7.470 -8.226 4.681 1.00 0.00 C ATOM 1229 C MET A 75 -6.101 -8.654 5.189 1.00 0.00 C ATOM 1230 O MET A 75 -5.155 -8.699 4.404 1.00 0.00 O ATOM 1231 CB MET A 75 -7.896 -6.861 5.246 1.00 0.00 C ATOM 1232 CG MET A 75 -7.875 -5.775 4.171 1.00 0.00 C ATOM 1233 SD MET A 75 -8.946 -4.362 4.529 1.00 0.00 S ATOM 1234 CE MET A 75 -10.433 -5.049 3.759 1.00 0.00 C ATOM 0 H MET A 75 -9.085 -8.976 5.757 1.00 0.00 H new ATOM 0 HA MET A 75 -7.395 -8.120 3.599 1.00 0.00 H new ATOM 0 HB2 MET A 75 -8.899 -6.938 5.667 1.00 0.00 H new ATOM 0 HB3 MET A 75 -7.229 -6.580 6.061 1.00 0.00 H new ATOM 0 HG2 MET A 75 -6.852 -5.420 4.048 1.00 0.00 H new ATOM 0 HG3 MET A 75 -8.176 -6.214 3.220 1.00 0.00 H new ATOM 0 HE1 MET A 75 -11.303 -4.467 4.064 1.00 0.00 H new ATOM 0 HE2 MET A 75 -10.333 -5.009 2.674 1.00 0.00 H new ATOM 0 HE3 MET A 75 -10.560 -6.085 4.074 1.00 0.00 H new ATOM 1244 N VAL A 76 -5.978 -8.976 6.479 1.00 0.00 N ATOM 1245 CA VAL A 76 -4.689 -9.376 7.047 1.00 0.00 C ATOM 1246 C VAL A 76 -4.177 -10.663 6.390 1.00 0.00 C ATOM 1247 O VAL A 76 -2.975 -10.833 6.194 1.00 0.00 O ATOM 1248 CB VAL A 76 -4.771 -9.418 8.581 1.00 0.00 C ATOM 1249 CG1 VAL A 76 -5.728 -10.492 9.101 1.00 0.00 C ATOM 1250 CG2 VAL A 76 -3.388 -9.576 9.215 1.00 0.00 C ATOM 0 H VAL A 76 -6.750 -8.968 7.146 1.00 0.00 H new ATOM 0 HA VAL A 76 -3.932 -8.626 6.818 1.00 0.00 H new ATOM 0 HB VAL A 76 -5.182 -8.455 8.883 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -5.741 -10.471 10.191 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -6.732 -10.299 8.722 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -5.394 -11.472 8.761 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.486 -9.602 10.300 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.933 -10.504 8.870 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -2.758 -8.734 8.928 1.00 0.00 H new ATOM 1260 N ASP A 77 -5.086 -11.529 5.947 1.00 0.00 N ATOM 1261 CA ASP A 77 -4.785 -12.791 5.273 1.00 0.00 C ATOM 1262 C ASP A 77 -4.017 -12.521 3.968 1.00 0.00 C ATOM 1263 O ASP A 77 -3.304 -13.397 3.471 1.00 0.00 O ATOM 1264 CB ASP A 77 -6.091 -13.537 4.939 1.00 0.00 C ATOM 1265 CG ASP A 77 -6.744 -14.292 6.104 1.00 0.00 C ATOM 1266 OD1 ASP A 77 -6.052 -14.570 7.115 1.00 0.00 O ATOM 1267 OD2 ASP A 77 -7.942 -14.656 5.980 1.00 0.00 O ATOM 0 H ASP A 77 -6.088 -11.366 6.051 1.00 0.00 H new ATOM 0 HA ASP A 77 -4.175 -13.402 5.938 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -6.810 -12.816 4.549 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -5.887 -14.248 4.139 1.00 0.00 H new ATOM 1272 N SER A 78 -4.142 -11.315 3.406 1.00 0.00 N ATOM 1273 CA SER A 78 -3.494 -10.866 2.182 1.00 0.00 C ATOM 1274 C SER A 78 -2.090 -10.288 2.464 1.00 0.00 C ATOM 1275 O SER A 78 -1.385 -9.913 1.526 1.00 0.00 O ATOM 1276 CB SER A 78 -4.426 -9.835 1.522 1.00 0.00 C ATOM 1277 OG SER A 78 -4.252 -9.733 0.119 1.00 0.00 O ATOM 0 H SER A 78 -4.730 -10.591 3.819 1.00 0.00 H new ATOM 0 HA SER A 78 -3.333 -11.705 1.505 1.00 0.00 H new ATOM 0 HB2 SER A 78 -5.461 -10.105 1.733 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.252 -8.858 1.974 1.00 0.00 H new ATOM 0 HG SER A 78 -4.872 -9.065 -0.240 1.00 0.00 H new ATOM 1283 N CYS A 79 -1.628 -10.245 3.723 1.00 0.00 N ATOM 1284 CA CYS A 79 -0.316 -9.718 4.113 1.00 0.00 C ATOM 1285 C CYS A 79 0.826 -10.549 3.518 1.00 0.00 C ATOM 1286 O CYS A 79 1.988 -10.143 3.561 1.00 0.00 O ATOM 1287 CB CYS A 79 -0.273 -9.602 5.648 1.00 0.00 C ATOM 1288 SG CYS A 79 1.254 -8.849 6.269 1.00 0.00 S ATOM 0 H CYS A 79 -2.172 -10.585 4.516 1.00 0.00 H new ATOM 0 HA CYS A 79 -0.169 -8.720 3.699 1.00 0.00 H new ATOM 0 HB2 CYS A 79 -1.124 -9.010 5.984 1.00 0.00 H new ATOM 0 HB3 CYS A 79 -0.383 -10.595 6.083 1.00 0.00 H new ATOM 0 HG CYS A 79 2.212 -9.041 5.412 1.00 0.00 H new ATOM 1294 N GLN A 80 0.497 -11.712 2.949 1.00 0.00 N ATOM 1295 CA GLN A 80 1.422 -12.623 2.298 1.00 0.00 C ATOM 1296 C GLN A 80 1.844 -11.990 0.956 1.00 0.00 C ATOM 1297 O GLN A 80 1.449 -12.423 -0.125 1.00 0.00 O ATOM 1298 CB GLN A 80 0.813 -14.035 2.185 1.00 0.00 C ATOM 1299 CG GLN A 80 -0.567 -14.154 1.495 1.00 0.00 C ATOM 1300 CD GLN A 80 -0.500 -14.806 0.112 1.00 0.00 C ATOM 1301 OE1 GLN A 80 0.002 -15.920 -0.033 1.00 0.00 O ATOM 1302 NE2 GLN A 80 -1.025 -14.169 -0.921 1.00 0.00 N ATOM 0 H GLN A 80 -0.464 -12.052 2.933 1.00 0.00 H new ATOM 0 HA GLN A 80 2.327 -12.768 2.888 1.00 0.00 H new ATOM 0 HB2 GLN A 80 1.518 -14.665 1.643 1.00 0.00 H new ATOM 0 HB3 GLN A 80 0.725 -14.447 3.190 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -1.234 -14.736 2.131 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -1.004 -13.160 1.399 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -1.440 -13.246 -0.794 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -1.015 -14.601 -1.845 1.00 0.00 H new ATOM 1311 N THR A 81 2.585 -10.894 1.042 1.00 0.00 N ATOM 1312 CA THR A 81 3.110 -10.069 -0.040 1.00 0.00 C ATOM 1313 C THR A 81 4.354 -9.293 0.419 1.00 0.00 C ATOM 1314 O THR A 81 5.190 -8.925 -0.407 1.00 0.00 O ATOM 1315 CB THR A 81 1.964 -9.141 -0.477 1.00 0.00 C ATOM 1316 OG1 THR A 81 2.169 -8.551 -1.743 1.00 0.00 O ATOM 1317 CG2 THR A 81 1.605 -8.031 0.496 1.00 0.00 C ATOM 0 H THR A 81 2.859 -10.526 1.953 1.00 0.00 H new ATOM 0 HA THR A 81 3.440 -10.675 -0.884 1.00 0.00 H new ATOM 0 HB THR A 81 1.127 -9.839 -0.513 1.00 0.00 H new ATOM 0 HG1 THR A 81 1.407 -7.976 -1.963 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.786 -7.439 0.087 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.298 -8.466 1.447 1.00 0.00 H new ATOM 0 HG23 THR A 81 2.473 -7.390 0.653 1.00 0.00 H new ATOM 1325 N ALA A 82 4.488 -9.133 1.744 1.00 0.00 N ATOM 1326 CA ALA A 82 5.536 -8.457 2.506 1.00 0.00 C ATOM 1327 C ALA A 82 5.337 -6.946 2.458 1.00 0.00 C ATOM 1328 O ALA A 82 5.894 -6.261 1.594 1.00 0.00 O ATOM 1329 CB ALA A 82 6.947 -8.890 2.092 1.00 0.00 C ATOM 0 H ALA A 82 3.783 -9.519 2.373 1.00 0.00 H new ATOM 0 HA ALA A 82 5.444 -8.768 3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 82 7.683 -8.355 2.692 1.00 0.00 H new ATOM 0 HB2 ALA A 82 7.060 -9.962 2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.103 -8.661 1.038 1.00 0.00 H new ATOM 1335 N LEU A 83 4.487 -6.465 3.369 1.00 0.00 N ATOM 1336 CA LEU A 83 4.103 -5.076 3.569 1.00 0.00 C ATOM 1337 C LEU A 83 4.008 -4.781 5.063 1.00 0.00 C ATOM 1338 O LEU A 83 4.017 -5.695 5.894 1.00 0.00 O ATOM 1339 CB LEU A 83 2.775 -4.764 2.841 1.00 0.00 C ATOM 1340 CG LEU A 83 1.610 -5.764 3.003 1.00 0.00 C ATOM 1341 CD1 LEU A 83 0.993 -5.916 4.388 1.00 0.00 C ATOM 1342 CD2 LEU A 83 0.467 -5.380 2.056 1.00 0.00 C ATOM 0 H LEU A 83 4.019 -7.085 4.030 1.00 0.00 H new ATOM 0 HA LEU A 83 4.865 -4.427 3.139 1.00 0.00 H new ATOM 0 HB2 LEU A 83 2.428 -3.788 3.182 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.991 -4.672 1.777 1.00 0.00 H new ATOM 0 HG LEU A 83 2.084 -6.720 2.780 1.00 0.00 H new ATOM 0 HD11 LEU A 83 0.188 -6.650 4.349 1.00 0.00 H new ATOM 0 HD12 LEU A 83 1.756 -6.250 5.091 1.00 0.00 H new ATOM 0 HD13 LEU A 83 0.593 -4.956 4.715 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -0.354 -6.087 2.172 1.00 0.00 H new ATOM 0 HD22 LEU A 83 0.118 -4.376 2.296 1.00 0.00 H new ATOM 0 HD23 LEU A 83 0.824 -5.404 1.026 1.00 0.00 H new ATOM 1354 N SER A 84 3.941 -3.497 5.413 1.00 0.00 N ATOM 1355 CA SER A 84 3.812 -3.064 6.800 1.00 0.00 C ATOM 1356 C SER A 84 2.377 -3.399 7.247 1.00 0.00 C ATOM 1357 O SER A 84 1.461 -3.388 6.417 1.00 0.00 O ATOM 1358 CB SER A 84 4.082 -1.554 6.924 1.00 0.00 C ATOM 1359 OG SER A 84 4.865 -1.057 5.851 1.00 0.00 O ATOM 0 H SER A 84 3.975 -2.730 4.742 1.00 0.00 H new ATOM 0 HA SER A 84 4.540 -3.573 7.432 1.00 0.00 H new ATOM 0 HB2 SER A 84 3.133 -1.019 6.956 1.00 0.00 H new ATOM 0 HB3 SER A 84 4.593 -1.355 7.866 1.00 0.00 H new ATOM 0 HG SER A 84 5.010 -0.095 5.970 1.00 0.00 H new ATOM 1365 N PRO A 85 2.117 -3.645 8.538 1.00 0.00 N ATOM 1366 CA PRO A 85 0.770 -3.976 8.998 1.00 0.00 C ATOM 1367 C PRO A 85 -0.206 -2.820 8.748 1.00 0.00 C ATOM 1368 O PRO A 85 -1.368 -3.037 8.402 1.00 0.00 O ATOM 1369 CB PRO A 85 0.930 -4.309 10.484 1.00 0.00 C ATOM 1370 CG PRO A 85 2.218 -3.591 10.892 1.00 0.00 C ATOM 1371 CD PRO A 85 3.073 -3.675 9.632 1.00 0.00 C ATOM 0 HA PRO A 85 0.340 -4.817 8.455 1.00 0.00 H new ATOM 0 HB2 PRO A 85 0.077 -3.958 11.065 1.00 0.00 H new ATOM 0 HB3 PRO A 85 1.005 -5.384 10.646 1.00 0.00 H new ATOM 0 HG2 PRO A 85 2.029 -2.558 11.183 1.00 0.00 H new ATOM 0 HG3 PRO A 85 2.700 -4.078 11.740 1.00 0.00 H new ATOM 0 HD2 PRO A 85 3.772 -2.841 9.571 1.00 0.00 H new ATOM 0 HD3 PRO A 85 3.666 -4.589 9.615 1.00 0.00 H new ATOM 1379 N GLY A 86 0.286 -1.593 8.870 1.00 0.00 N ATOM 1380 CA GLY A 86 -0.443 -0.359 8.688 1.00 0.00 C ATOM 1381 C GLY A 86 -0.768 -0.093 7.230 1.00 0.00 C ATOM 1382 O GLY A 86 -1.636 0.735 6.980 1.00 0.00 O ATOM 0 H GLY A 86 1.263 -1.431 9.113 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -1.368 -0.398 9.263 1.00 0.00 H new ATOM 0 HA3 GLY A 86 0.144 0.469 9.084 1.00 0.00 H new ATOM 1386 N GLU A 87 -0.124 -0.760 6.260 1.00 0.00 N ATOM 1387 CA GLU A 87 -0.467 -0.520 4.859 1.00 0.00 C ATOM 1388 C GLU A 87 -1.914 -0.968 4.681 1.00 0.00 C ATOM 1389 O GLU A 87 -2.692 -0.285 4.029 1.00 0.00 O ATOM 1390 CB GLU A 87 0.428 -1.291 3.874 1.00 0.00 C ATOM 1391 CG GLU A 87 1.923 -0.993 3.993 1.00 0.00 C ATOM 1392 CD GLU A 87 2.264 0.492 3.952 1.00 0.00 C ATOM 1393 OE1 GLU A 87 2.336 1.116 5.040 1.00 0.00 O ATOM 1394 OE2 GLU A 87 2.574 1.024 2.862 1.00 0.00 O ATOM 0 H GLU A 87 0.613 -1.447 6.416 1.00 0.00 H new ATOM 0 HA GLU A 87 -0.321 0.537 4.637 1.00 0.00 H new ATOM 0 HB2 GLU A 87 0.272 -2.359 4.024 1.00 0.00 H new ATOM 0 HB3 GLU A 87 0.107 -1.062 2.858 1.00 0.00 H new ATOM 0 HG2 GLU A 87 2.294 -1.415 4.927 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.449 -1.499 3.184 1.00 0.00 H new ATOM 1401 N MET A 88 -2.274 -2.096 5.305 1.00 0.00 N ATOM 1402 CA MET A 88 -3.598 -2.697 5.276 1.00 0.00 C ATOM 1403 C MET A 88 -4.647 -1.713 5.815 1.00 0.00 C ATOM 1404 O MET A 88 -5.747 -1.595 5.267 1.00 0.00 O ATOM 1405 CB MET A 88 -3.538 -3.992 6.108 1.00 0.00 C ATOM 1406 CG MET A 88 -4.515 -5.047 5.571 1.00 0.00 C ATOM 1407 SD MET A 88 -4.171 -5.630 3.882 1.00 0.00 S ATOM 1408 CE MET A 88 -2.670 -6.607 4.158 1.00 0.00 C ATOM 0 H MET A 88 -1.614 -2.633 5.868 1.00 0.00 H new ATOM 0 HA MET A 88 -3.896 -2.936 4.255 1.00 0.00 H new ATOM 0 HB2 MET A 88 -2.524 -4.391 6.091 1.00 0.00 H new ATOM 0 HB3 MET A 88 -3.776 -3.770 7.148 1.00 0.00 H new ATOM 0 HG2 MET A 88 -4.505 -5.905 6.244 1.00 0.00 H new ATOM 0 HG3 MET A 88 -5.523 -4.633 5.597 1.00 0.00 H new ATOM 0 HE1 MET A 88 -2.314 -7.003 3.207 1.00 0.00 H new ATOM 0 HE2 MET A 88 -1.900 -5.974 4.599 1.00 0.00 H new ATOM 0 HE3 MET A 88 -2.892 -7.432 4.834 1.00 0.00 H new ATOM 1418 N GLU A 89 -4.294 -1.027 6.904 1.00 0.00 N ATOM 1419 CA GLU A 89 -5.114 -0.030 7.571 1.00 0.00 C ATOM 1420 C GLU A 89 -5.252 1.154 6.618 1.00 0.00 C ATOM 1421 O GLU A 89 -6.348 1.477 6.174 1.00 0.00 O ATOM 1422 CB GLU A 89 -4.453 0.387 8.899 1.00 0.00 C ATOM 1423 CG GLU A 89 -4.641 -0.662 9.998 1.00 0.00 C ATOM 1424 CD GLU A 89 -3.733 -0.421 11.208 1.00 0.00 C ATOM 1425 OE1 GLU A 89 -3.576 0.744 11.660 1.00 0.00 O ATOM 1426 OE2 GLU A 89 -3.116 -1.406 11.670 1.00 0.00 O ATOM 0 H GLU A 89 -3.391 -1.161 7.359 1.00 0.00 H new ATOM 0 HA GLU A 89 -6.101 -0.424 7.813 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.388 0.552 8.736 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -4.875 1.336 9.230 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -5.681 -0.659 10.323 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -4.438 -1.652 9.588 1.00 0.00 H new ATOM 1433 N LYS A 90 -4.147 1.802 6.244 1.00 0.00 N ATOM 1434 CA LYS A 90 -4.172 2.948 5.337 1.00 0.00 C ATOM 1435 C LYS A 90 -4.876 2.645 4.004 1.00 0.00 C ATOM 1436 O LYS A 90 -5.271 3.588 3.326 1.00 0.00 O ATOM 1437 CB LYS A 90 -2.744 3.458 5.094 1.00 0.00 C ATOM 1438 CG LYS A 90 -2.076 4.035 6.358 1.00 0.00 C ATOM 1439 CD LYS A 90 -0.813 4.797 5.944 1.00 0.00 C ATOM 1440 CE LYS A 90 0.140 5.210 7.074 1.00 0.00 C ATOM 1441 NZ LYS A 90 -0.540 5.915 8.176 1.00 0.00 N ATOM 0 H LYS A 90 -3.212 1.547 6.561 1.00 0.00 H new ATOM 0 HA LYS A 90 -4.759 3.727 5.823 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -2.134 2.640 4.711 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.767 4.227 4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -2.765 4.700 6.879 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.823 3.233 7.051 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -0.258 4.179 5.238 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.117 5.696 5.409 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.633 4.321 7.469 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.920 5.853 6.666 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.155 6.168 8.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.988 6.779 7.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.267 5.296 8.588 1.00 0.00 H new ATOM 1455 N HIS A 91 -5.036 1.371 3.643 1.00 0.00 N ATOM 1456 CA HIS A 91 -5.660 0.859 2.429 1.00 0.00 C ATOM 1457 C HIS A 91 -7.168 0.951 2.553 1.00 0.00 C ATOM 1458 O HIS A 91 -7.809 1.593 1.721 1.00 0.00 O ATOM 1459 CB HIS A 91 -5.185 -0.576 2.119 1.00 0.00 C ATOM 1460 CG HIS A 91 -6.237 -1.563 1.679 1.00 0.00 C ATOM 1461 ND1 HIS A 91 -7.020 -1.475 0.564 1.00 0.00 N flip ATOM 1462 CD2 HIS A 91 -6.591 -2.710 2.352 1.00 0.00 C flip ATOM 1463 CE1 HIS A 91 -7.871 -2.586 0.556 1.00 0.00 C flip ATOM 1464 NE2 HIS A 91 -7.549 -3.319 1.633 1.00 0.00 N flip ATOM 0 H HIS A 91 -4.706 0.614 4.241 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.353 1.473 1.583 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -4.425 -0.521 1.340 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -4.699 -0.973 3.011 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -6.175 -3.057 3.286 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -8.636 -2.809 -0.173 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -7.973 -4.215 1.873 1.00 0.00 H new ATOM 1472 N LEU A 92 -7.764 0.320 3.570 1.00 0.00 N ATOM 1473 CA LEU A 92 -9.218 0.406 3.708 1.00 0.00 C ATOM 1474 C LEU A 92 -9.659 1.860 3.911 1.00 0.00 C ATOM 1475 O LEU A 92 -10.798 2.220 3.580 1.00 0.00 O ATOM 1476 CB LEU A 92 -9.719 -0.543 4.807 1.00 0.00 C ATOM 1477 CG LEU A 92 -9.360 -0.138 6.251 1.00 0.00 C ATOM 1478 CD1 LEU A 92 -10.483 0.653 6.928 1.00 0.00 C ATOM 1479 CD2 LEU A 92 -8.982 -1.363 7.087 1.00 0.00 C ATOM 0 H LEU A 92 -7.286 -0.233 4.281 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.685 0.072 2.782 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.803 -0.620 4.729 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -9.314 -1.537 4.616 1.00 0.00 H new ATOM 0 HG LEU A 92 -8.494 0.520 6.188 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -10.183 0.915 7.943 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -10.680 1.563 6.361 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -11.387 0.045 6.963 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -8.733 -1.049 8.101 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -9.823 -2.056 7.118 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -8.120 -1.858 6.639 1.00 0.00 H new ATOM 1491 N VAL A 93 -8.749 2.693 4.428 1.00 0.00 N ATOM 1492 CA VAL A 93 -9.004 4.087 4.673 1.00 0.00 C ATOM 1493 C VAL A 93 -8.881 4.862 3.359 1.00 0.00 C ATOM 1494 O VAL A 93 -9.771 5.666 3.088 1.00 0.00 O ATOM 1495 CB VAL A 93 -8.047 4.552 5.776 1.00 0.00 C ATOM 1496 CG1 VAL A 93 -8.259 6.026 6.077 1.00 0.00 C ATOM 1497 CG2 VAL A 93 -8.279 3.769 7.075 1.00 0.00 C ATOM 0 H VAL A 93 -7.807 2.398 4.686 1.00 0.00 H new ATOM 0 HA VAL A 93 -10.018 4.270 5.028 1.00 0.00 H new ATOM 0 HB VAL A 93 -7.033 4.379 5.416 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -7.571 6.340 6.862 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -8.073 6.612 5.177 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -9.285 6.186 6.408 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -7.586 4.120 7.840 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -9.303 3.923 7.415 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -8.113 2.707 6.894 1.00 0.00 H new ATOM 1507 N LEU A 94 -7.845 4.621 2.535 1.00 0.00 N ATOM 1508 CA LEU A 94 -7.676 5.325 1.261 1.00 0.00 C ATOM 1509 C LEU A 94 -8.896 5.095 0.390 1.00 0.00 C ATOM 1510 O LEU A 94 -9.420 6.034 -0.195 1.00 0.00 O ATOM 1511 CB LEU A 94 -6.368 4.962 0.498 1.00 0.00 C ATOM 1512 CG LEU A 94 -6.385 3.753 -0.469 1.00 0.00 C ATOM 1513 CD1 LEU A 94 -6.861 4.104 -1.888 1.00 0.00 C ATOM 1514 CD2 LEU A 94 -5.000 3.124 -0.637 1.00 0.00 C ATOM 0 H LEU A 94 -7.112 3.940 2.734 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.578 6.384 1.500 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -6.064 5.839 -0.074 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -5.591 4.781 1.241 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.085 3.063 0.002 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -6.846 3.208 -2.509 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -7.876 4.499 -1.844 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -6.198 4.855 -2.319 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -5.064 2.280 -1.324 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -4.309 3.866 -1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -4.638 2.777 0.331 1.00 0.00 H new ATOM 1526 N LEU A 95 -9.372 3.852 0.322 1.00 0.00 N ATOM 1527 CA LEU A 95 -10.510 3.499 -0.497 1.00 0.00 C ATOM 1528 C LEU A 95 -11.731 4.258 -0.021 1.00 0.00 C ATOM 1529 O LEU A 95 -12.331 4.999 -0.793 1.00 0.00 O ATOM 1530 CB LEU A 95 -10.735 1.982 -0.453 1.00 0.00 C ATOM 1531 CG LEU A 95 -9.627 1.191 -1.181 1.00 0.00 C ATOM 1532 CD1 LEU A 95 -9.730 -0.280 -0.795 1.00 0.00 C ATOM 1533 CD2 LEU A 95 -9.675 1.345 -2.707 1.00 0.00 C ATOM 0 H LEU A 95 -8.973 3.067 0.837 1.00 0.00 H new ATOM 0 HA LEU A 95 -10.321 3.777 -1.534 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.784 1.657 0.586 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -11.699 1.749 -0.906 1.00 0.00 H new ATOM 0 HG LEU A 95 -8.669 1.604 -0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.950 -0.846 -1.305 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -9.606 -0.383 0.283 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -10.707 -0.665 -1.086 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -8.870 0.764 -3.157 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -10.634 0.985 -3.079 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -9.555 2.396 -2.971 1.00 0.00 H new ATOM 1545 N ALA A 96 -12.092 4.087 1.249 1.00 0.00 N ATOM 1546 CA ALA A 96 -13.256 4.774 1.782 1.00 0.00 C ATOM 1547 C ALA A 96 -13.151 6.305 1.718 1.00 0.00 C ATOM 1548 O ALA A 96 -14.184 6.960 1.653 1.00 0.00 O ATOM 1549 CB ALA A 96 -13.490 4.287 3.203 1.00 0.00 C ATOM 0 H ALA A 96 -11.602 3.489 1.914 1.00 0.00 H new ATOM 0 HA ALA A 96 -14.112 4.530 1.153 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -14.361 4.791 3.622 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -13.663 3.211 3.195 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -12.614 4.509 3.813 1.00 0.00 H new ATOM 1555 N GLU A 97 -11.950 6.891 1.731 1.00 0.00 N ATOM 1556 CA GLU A 97 -11.784 8.344 1.677 1.00 0.00 C ATOM 1557 C GLU A 97 -11.901 8.851 0.234 1.00 0.00 C ATOM 1558 O GLU A 97 -12.615 9.814 -0.051 1.00 0.00 O ATOM 1559 CB GLU A 97 -10.404 8.713 2.259 1.00 0.00 C ATOM 1560 CG GLU A 97 -10.152 10.222 2.408 1.00 0.00 C ATOM 1561 CD GLU A 97 -10.711 10.801 3.708 1.00 0.00 C ATOM 1562 OE1 GLU A 97 -11.936 11.076 3.780 1.00 0.00 O ATOM 1563 OE2 GLU A 97 -9.912 10.973 4.660 1.00 0.00 O ATOM 0 H GLU A 97 -11.072 6.374 1.779 1.00 0.00 H new ATOM 0 HA GLU A 97 -12.571 8.816 2.265 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -10.300 8.243 3.237 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.630 8.291 1.618 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -9.079 10.410 2.366 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.601 10.744 1.563 1.00 0.00 H new ATOM 1570 N LEU A 98 -11.181 8.224 -0.698 1.00 0.00 N ATOM 1571 CA LEU A 98 -11.152 8.598 -2.108 1.00 0.00 C ATOM 1572 C LEU A 98 -12.428 8.187 -2.844 1.00 0.00 C ATOM 1573 O LEU A 98 -12.596 8.574 -4.002 1.00 0.00 O ATOM 1574 CB LEU A 98 -9.904 7.994 -2.783 1.00 0.00 C ATOM 1575 CG LEU A 98 -8.560 8.716 -2.527 1.00 0.00 C ATOM 1576 CD1 LEU A 98 -8.179 8.979 -1.062 1.00 0.00 C ATOM 1577 CD2 LEU A 98 -7.439 7.868 -3.136 1.00 0.00 C ATOM 0 H LEU A 98 -10.588 7.422 -0.485 1.00 0.00 H new ATOM 0 HA LEU A 98 -11.099 9.685 -2.164 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.804 6.960 -2.451 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -10.077 7.968 -3.859 1.00 0.00 H new ATOM 0 HG LEU A 98 -8.689 9.699 -2.979 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.217 9.490 -1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -8.941 9.603 -0.594 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -8.109 8.031 -0.529 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -6.480 8.358 -2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.431 6.884 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -7.607 7.758 -4.207 1.00 0.00 H new ATOM 1589 N LEU A 99 -13.326 7.420 -2.221 1.00 0.00 N ATOM 1590 CA LEU A 99 -14.578 6.964 -2.817 1.00 0.00 C ATOM 1591 C LEU A 99 -15.507 6.412 -1.724 1.00 0.00 C ATOM 1592 O LEU A 99 -15.726 5.199 -1.645 1.00 0.00 O ATOM 1593 CB LEU A 99 -14.325 5.992 -3.999 1.00 0.00 C ATOM 1594 CG LEU A 99 -13.105 5.042 -3.909 1.00 0.00 C ATOM 1595 CD1 LEU A 99 -13.443 3.667 -3.329 1.00 0.00 C ATOM 1596 CD2 LEU A 99 -12.512 4.864 -5.307 1.00 0.00 C ATOM 0 H LEU A 99 -13.196 7.092 -1.264 1.00 0.00 H new ATOM 0 HA LEU A 99 -15.101 7.809 -3.265 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -15.217 5.379 -4.124 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -14.218 6.588 -4.905 1.00 0.00 H new ATOM 0 HG LEU A 99 -12.391 5.504 -3.227 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -12.542 3.055 -3.296 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -13.839 3.785 -2.320 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -14.189 3.180 -3.957 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -11.652 4.197 -5.255 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -13.264 4.436 -5.969 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -12.197 5.833 -5.694 1.00 0.00 H new ATOM 1608 N PRO A 100 -16.137 7.280 -0.910 1.00 0.00 N ATOM 1609 CA PRO A 100 -17.041 6.884 0.172 1.00 0.00 C ATOM 1610 C PRO A 100 -18.277 6.094 -0.305 1.00 0.00 C ATOM 1611 O PRO A 100 -18.932 5.438 0.502 1.00 0.00 O ATOM 1612 CB PRO A 100 -17.399 8.182 0.906 1.00 0.00 C ATOM 1613 CG PRO A 100 -17.161 9.278 -0.124 1.00 0.00 C ATOM 1614 CD PRO A 100 -15.975 8.726 -0.902 1.00 0.00 C ATOM 0 HA PRO A 100 -16.551 6.175 0.840 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -18.435 8.174 1.245 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -16.776 8.324 1.789 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -18.031 9.435 -0.762 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -16.932 10.236 0.344 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -15.956 9.122 -1.917 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -15.034 9.010 -0.432 1.00 0.00 H new ATOM 1622 N ASP A 101 -18.528 6.056 -1.610 1.00 0.00 N ATOM 1623 CA ASP A 101 -19.638 5.392 -2.292 1.00 0.00 C ATOM 1624 C ASP A 101 -19.440 3.902 -2.622 1.00 0.00 C ATOM 1625 O ASP A 101 -20.432 3.192 -2.794 1.00 0.00 O ATOM 1626 CB ASP A 101 -19.831 6.168 -3.598 1.00 0.00 C ATOM 1627 CG ASP A 101 -20.851 5.563 -4.557 1.00 0.00 C ATOM 1628 OD1 ASP A 101 -22.072 5.719 -4.352 1.00 0.00 O ATOM 1629 OD2 ASP A 101 -20.415 5.061 -5.620 1.00 0.00 O ATOM 0 H ASP A 101 -17.912 6.526 -2.273 1.00 0.00 H new ATOM 0 HA ASP A 101 -20.494 5.400 -1.617 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -20.139 7.186 -3.357 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -18.870 6.238 -4.108 1.00 0.00 H new ATOM 1634 N TRP A 102 -18.215 3.360 -2.630 1.00 0.00 N ATOM 1635 CA TRP A 102 -17.992 1.951 -2.979 1.00 0.00 C ATOM 1636 C TRP A 102 -18.158 1.057 -1.749 1.00 0.00 C ATOM 1637 O TRP A 102 -18.850 0.037 -1.828 1.00 0.00 O ATOM 1638 CB TRP A 102 -16.596 1.827 -3.611 1.00 0.00 C ATOM 1639 CG TRP A 102 -16.195 0.514 -4.229 1.00 0.00 C ATOM 1640 CD1 TRP A 102 -16.933 -0.225 -5.090 1.00 0.00 C ATOM 1641 CD2 TRP A 102 -14.956 -0.236 -4.042 1.00 0.00 C ATOM 1642 NE1 TRP A 102 -16.213 -1.341 -5.482 1.00 0.00 N ATOM 1643 CE2 TRP A 102 -14.991 -1.403 -4.863 1.00 0.00 C ATOM 1644 CE3 TRP A 102 -13.814 -0.072 -3.231 1.00 0.00 C ATOM 1645 CZ2 TRP A 102 -13.955 -2.350 -4.890 1.00 0.00 C ATOM 1646 CZ3 TRP A 102 -12.785 -1.031 -3.232 1.00 0.00 C ATOM 1647 CH2 TRP A 102 -12.858 -2.182 -4.034 1.00 0.00 C ATOM 0 H TRP A 102 -17.365 3.875 -2.399 1.00 0.00 H new ATOM 0 HA TRP A 102 -18.735 1.614 -3.702 1.00 0.00 H new ATOM 0 HB2 TRP A 102 -16.513 2.594 -4.381 1.00 0.00 H new ATOM 0 HB3 TRP A 102 -15.862 2.068 -2.841 1.00 0.00 H new ATOM 0 HD1 TRP A 102 -17.932 0.019 -5.421 1.00 0.00 H new ATOM 0 HE1 TRP A 102 -16.551 -2.033 -6.151 1.00 0.00 H new ATOM 0 HE3 TRP A 102 -13.728 0.801 -2.601 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 -14.003 -3.195 -5.560 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 -11.920 -0.879 -2.603 1.00 0.00 H new ATOM 0 HH2 TRP A 102 -12.078 -2.928 -3.992 1.00 0.00 H new ATOM 1658 N LEU A 103 -17.475 1.379 -0.650 1.00 0.00 N ATOM 1659 CA LEU A 103 -17.568 0.637 0.607 1.00 0.00 C ATOM 1660 C LEU A 103 -18.775 1.216 1.355 1.00 0.00 C ATOM 1661 O LEU A 103 -19.264 2.303 1.029 1.00 0.00 O ATOM 1662 CB LEU A 103 -16.263 0.808 1.428 1.00 0.00 C ATOM 1663 CG LEU A 103 -16.078 -0.046 2.688 1.00 0.00 C ATOM 1664 CD1 LEU A 103 -15.899 -1.509 2.300 1.00 0.00 C ATOM 1665 CD2 LEU A 103 -14.825 0.437 3.433 1.00 0.00 C ATOM 0 H LEU A 103 -16.834 2.172 -0.608 1.00 0.00 H new ATOM 0 HA LEU A 103 -17.695 -0.432 0.438 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -15.423 0.605 0.763 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -16.191 1.855 1.723 1.00 0.00 H new ATOM 0 HG LEU A 103 -16.956 0.050 3.327 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -15.768 -2.111 3.199 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -16.781 -1.852 1.759 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -15.020 -1.612 1.664 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -14.682 -0.163 4.332 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -13.954 0.333 2.786 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -14.948 1.484 3.711 1.00 0.00 H new ATOM 1677 N SER A 104 -19.270 0.494 2.347 1.00 0.00 N ATOM 1678 CA SER A 104 -20.388 0.901 3.180 1.00 0.00 C ATOM 1679 C SER A 104 -20.244 0.172 4.513 1.00 0.00 C ATOM 1680 O SER A 104 -19.702 -0.936 4.560 1.00 0.00 O ATOM 1681 CB SER A 104 -21.718 0.553 2.490 1.00 0.00 C ATOM 1682 OG SER A 104 -22.571 1.679 2.416 1.00 0.00 O ATOM 0 H SER A 104 -18.893 -0.419 2.602 1.00 0.00 H new ATOM 0 HA SER A 104 -20.387 1.979 3.343 1.00 0.00 H new ATOM 0 HB2 SER A 104 -21.521 0.177 1.486 1.00 0.00 H new ATOM 0 HB3 SER A 104 -22.216 -0.247 3.038 1.00 0.00 H new ATOM 0 HG SER A 104 -23.407 1.427 1.971 1.00 0.00 H new ATOM 1688 N LEU A 105 -20.773 0.764 5.581 1.00 0.00 N ATOM 1689 CA LEU A 105 -20.759 0.244 6.945 1.00 0.00 C ATOM 1690 C LEU A 105 -22.175 0.311 7.481 1.00 0.00 C ATOM 1691 O LEU A 105 -22.840 1.340 7.315 1.00 0.00 O ATOM 1692 CB LEU A 105 -19.895 1.127 7.863 1.00 0.00 C ATOM 1693 CG LEU A 105 -18.385 0.929 7.685 1.00 0.00 C ATOM 1694 CD1 LEU A 105 -17.632 2.143 8.237 1.00 0.00 C ATOM 1695 CD2 LEU A 105 -17.921 -0.321 8.440 1.00 0.00 C ATOM 0 H LEU A 105 -21.247 1.665 5.515 1.00 0.00 H new ATOM 0 HA LEU A 105 -20.361 -0.770 6.929 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -20.138 2.173 7.676 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -20.158 0.920 8.900 1.00 0.00 H new ATOM 0 HG LEU A 105 -18.176 0.813 6.622 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -16.560 1.996 8.107 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -17.943 3.039 7.700 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -17.857 2.259 9.297 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -16.847 -0.450 8.305 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -18.143 -0.208 9.501 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -18.443 -1.195 8.051 1.00 0.00 H new ATOM 1707 N HIS A 106 -22.648 -0.743 8.137 1.00 0.00 N ATOM 1708 CA HIS A 106 -23.971 -0.785 8.715 1.00 0.00 C ATOM 1709 C HIS A 106 -23.943 -1.656 9.968 1.00 0.00 C ATOM 1710 O HIS A 106 -23.624 -2.844 9.900 1.00 0.00 O ATOM 1711 CB HIS A 106 -25.009 -1.203 7.668 1.00 0.00 C ATOM 1712 CG HIS A 106 -24.959 -2.592 7.073 1.00 0.00 C ATOM 1713 ND1 HIS A 106 -26.077 -3.351 6.830 1.00 0.00 N ATOM 1714 CD2 HIS A 106 -23.889 -3.262 6.536 1.00 0.00 C ATOM 1715 CE1 HIS A 106 -25.701 -4.454 6.174 1.00 0.00 C ATOM 1716 NE2 HIS A 106 -24.374 -4.456 5.980 1.00 0.00 N ATOM 0 H HIS A 106 -22.111 -1.598 8.280 1.00 0.00 H new ATOM 0 HA HIS A 106 -24.285 0.209 9.035 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -25.994 -1.077 8.118 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -24.943 -0.493 6.843 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -27.031 -3.114 7.103 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -22.861 -2.931 6.540 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -26.372 -5.234 5.846 1.00 0.00 H new ATOM 1724 N ARG A 107 -24.180 -1.055 11.142 1.00 0.00 N ATOM 1725 CA ARG A 107 -24.188 -1.818 12.387 1.00 0.00 C ATOM 1726 C ARG A 107 -25.524 -2.535 12.510 1.00 0.00 C ATOM 1727 O ARG A 107 -26.561 -1.982 12.124 1.00 0.00 O ATOM 1728 CB ARG A 107 -23.867 -0.933 13.599 1.00 0.00 C ATOM 1729 CG ARG A 107 -23.565 -1.759 14.856 1.00 0.00 C ATOM 1730 CD ARG A 107 -22.955 -0.900 15.973 1.00 0.00 C ATOM 1731 NE ARG A 107 -23.967 -0.039 16.597 1.00 0.00 N ATOM 1732 CZ ARG A 107 -24.793 -0.388 17.586 1.00 0.00 C ATOM 1733 NH1 ARG A 107 -24.770 -1.611 18.118 1.00 0.00 N ATOM 1734 NH2 ARG A 107 -25.655 0.521 18.023 1.00 0.00 N ATOM 0 H ARG A 107 -24.366 -0.058 11.251 1.00 0.00 H new ATOM 0 HA ARG A 107 -23.396 -2.567 12.366 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -23.010 -0.300 13.368 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -24.709 -0.270 13.796 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -24.484 -2.222 15.215 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -22.878 -2.567 14.603 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -22.508 -1.546 16.729 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -22.153 -0.285 15.565 1.00 0.00 H new ATOM 0 HE ARG A 107 -24.046 0.914 16.242 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -24.110 -2.306 17.770 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -25.413 -1.851 18.873 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -25.671 1.451 17.605 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -26.301 0.290 18.777 1.00 0.00 H new ATOM 1748 N ILE A 108 -25.504 -3.732 13.077 1.00 0.00 N ATOM 1749 CA ILE A 108 -26.641 -4.603 13.295 1.00 0.00 C ATOM 1750 C ILE A 108 -26.598 -5.012 14.762 1.00 0.00 C ATOM 1751 O ILE A 108 -25.539 -5.079 15.389 1.00 0.00 O ATOM 1752 CB ILE A 108 -26.529 -5.857 12.381 1.00 0.00 C ATOM 1753 CG1 ILE A 108 -26.018 -5.603 10.945 1.00 0.00 C ATOM 1754 CG2 ILE A 108 -27.846 -6.646 12.328 1.00 0.00 C ATOM 1755 CD1 ILE A 108 -26.955 -4.784 10.050 1.00 0.00 C ATOM 0 H ILE A 108 -24.635 -4.144 13.418 1.00 0.00 H new ATOM 0 HA ILE A 108 -27.579 -4.101 13.057 1.00 0.00 H new ATOM 0 HB ILE A 108 -25.754 -6.448 12.868 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -25.059 -5.089 11.004 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -25.835 -6.565 10.467 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -27.725 -7.513 11.679 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -28.112 -6.978 13.332 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -28.637 -6.007 11.936 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -26.504 -4.663 9.065 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -27.909 -5.302 9.951 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -27.120 -3.803 10.497 1.00 0.00 H new ATOM 1767 N ARG A 109 -27.767 -5.379 15.277 1.00 0.00 N ATOM 1768 CA ARG A 109 -28.016 -5.851 16.639 1.00 0.00 C ATOM 1769 C ARG A 109 -27.240 -7.135 16.986 1.00 0.00 C ATOM 1770 O ARG A 109 -27.410 -7.655 18.085 1.00 0.00 O ATOM 1771 CB ARG A 109 -29.529 -6.088 16.790 1.00 0.00 C ATOM 1772 CG ARG A 109 -30.063 -7.074 15.728 1.00 0.00 C ATOM 1773 CD ARG A 109 -30.834 -6.361 14.618 1.00 0.00 C ATOM 1774 NE ARG A 109 -31.432 -7.297 13.658 1.00 0.00 N ATOM 1775 CZ ARG A 109 -32.221 -6.926 12.644 1.00 0.00 C ATOM 1776 NH1 ARG A 109 -32.324 -5.646 12.302 1.00 0.00 N ATOM 1777 NH2 ARG A 109 -32.911 -7.836 11.972 1.00 0.00 N ATOM 0 H ARG A 109 -28.622 -5.354 14.721 1.00 0.00 H new ATOM 0 HA ARG A 109 -27.662 -5.090 17.334 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -29.738 -6.478 17.786 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -30.056 -5.138 16.702 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -29.229 -7.625 15.293 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -30.713 -7.806 16.208 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -31.620 -5.749 15.061 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -30.162 -5.684 14.090 1.00 0.00 H new ATOM 0 HE ARG A 109 -31.234 -8.291 13.771 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -31.799 -4.937 12.814 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -32.928 -5.372 11.527 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -32.841 -8.821 12.228 1.00 0.00 H new ATOM 0 HH22 ARG A 109 -33.512 -7.552 11.199 1.00 0.00 H new ATOM 1791 N THR A 110 -26.477 -7.694 16.048 1.00 0.00 N ATOM 1792 CA THR A 110 -25.674 -8.889 16.231 1.00 0.00 C ATOM 1793 C THR A 110 -24.185 -8.544 16.120 1.00 0.00 C ATOM 1794 O THR A 110 -23.406 -9.228 16.773 1.00 0.00 O ATOM 1795 CB THR A 110 -26.154 -9.989 15.261 1.00 0.00 C ATOM 1796 OG1 THR A 110 -25.877 -11.285 15.747 1.00 0.00 O ATOM 1797 CG2 THR A 110 -25.618 -9.867 13.834 1.00 0.00 C ATOM 0 H THR A 110 -26.402 -7.308 15.107 1.00 0.00 H new ATOM 0 HA THR A 110 -25.804 -9.296 17.234 1.00 0.00 H new ATOM 0 HB THR A 110 -27.231 -9.831 15.211 1.00 0.00 H new ATOM 0 HG1 THR A 110 -26.198 -11.951 15.104 1.00 0.00 H new ATOM 0 HG21 THR A 110 -26.010 -10.683 13.227 1.00 0.00 H new ATOM 0 HG22 THR A 110 -25.932 -8.914 13.407 1.00 0.00 H new ATOM 0 HG23 THR A 110 -24.529 -9.916 13.849 1.00 0.00 H new ATOM 1805 N ASP A 111 -23.791 -7.540 15.310 1.00 0.00 N ATOM 1806 CA ASP A 111 -22.413 -7.074 15.079 1.00 0.00 C ATOM 1807 C ASP A 111 -22.424 -6.016 13.954 1.00 0.00 C ATOM 1808 O ASP A 111 -23.490 -5.688 13.426 1.00 0.00 O ATOM 1809 CB ASP A 111 -21.448 -8.210 14.654 1.00 0.00 C ATOM 1810 CG ASP A 111 -19.978 -7.862 14.903 1.00 0.00 C ATOM 1811 OD1 ASP A 111 -19.706 -6.756 15.434 1.00 0.00 O ATOM 1812 OD2 ASP A 111 -19.109 -8.675 14.520 1.00 0.00 O ATOM 0 H ASP A 111 -24.468 -7.003 14.769 1.00 0.00 H new ATOM 0 HA ASP A 111 -22.055 -6.667 16.025 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -21.700 -9.118 15.201 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -21.592 -8.426 13.595 1.00 0.00 H new ATOM 1817 N THR A 112 -21.276 -5.449 13.589 1.00 0.00 N ATOM 1818 CA THR A 112 -21.100 -4.464 12.535 1.00 0.00 C ATOM 1819 C THR A 112 -20.767 -5.238 11.263 1.00 0.00 C ATOM 1820 O THR A 112 -20.076 -6.260 11.306 1.00 0.00 O ATOM 1821 CB THR A 112 -20.000 -3.457 12.917 1.00 0.00 C ATOM 1822 OG1 THR A 112 -20.380 -2.769 14.098 1.00 0.00 O ATOM 1823 CG2 THR A 112 -19.787 -2.385 11.840 1.00 0.00 C ATOM 0 H THR A 112 -20.396 -5.681 14.050 1.00 0.00 H new ATOM 0 HA THR A 112 -22.003 -3.873 12.380 1.00 0.00 H new ATOM 0 HB THR A 112 -19.083 -4.032 13.045 1.00 0.00 H new ATOM 0 HG1 THR A 112 -19.680 -2.129 14.343 1.00 0.00 H new ATOM 0 HG21 THR A 112 -19.001 -1.700 12.159 1.00 0.00 H new ATOM 0 HG22 THR A 112 -19.495 -2.862 10.904 1.00 0.00 H new ATOM 0 HG23 THR A 112 -20.713 -1.830 11.691 1.00 0.00 H new ATOM 1831 N TYR A 113 -21.280 -4.758 10.132 1.00 0.00 N ATOM 1832 CA TYR A 113 -21.074 -5.372 8.838 1.00 0.00 C ATOM 1833 C TYR A 113 -20.611 -4.292 7.868 1.00 0.00 C ATOM 1834 O TYR A 113 -20.831 -3.093 8.086 1.00 0.00 O ATOM 1835 CB TYR A 113 -22.377 -6.038 8.354 1.00 0.00 C ATOM 1836 CG TYR A 113 -22.779 -7.312 9.083 1.00 0.00 C ATOM 1837 CD1 TYR A 113 -23.168 -7.260 10.433 1.00 0.00 C ATOM 1838 CD2 TYR A 113 -22.786 -8.551 8.413 1.00 0.00 C ATOM 1839 CE1 TYR A 113 -23.542 -8.418 11.126 1.00 0.00 C ATOM 1840 CE2 TYR A 113 -23.179 -9.721 9.090 1.00 0.00 C ATOM 1841 CZ TYR A 113 -23.556 -9.655 10.450 1.00 0.00 C ATOM 1842 OH TYR A 113 -23.966 -10.775 11.102 1.00 0.00 O ATOM 0 H TYR A 113 -21.858 -3.918 10.097 1.00 0.00 H new ATOM 0 HA TYR A 113 -20.314 -6.151 8.901 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -23.188 -5.316 8.448 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -22.274 -6.266 7.293 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -23.179 -6.309 10.945 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -22.489 -8.604 7.376 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -23.817 -8.364 12.169 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -23.192 -10.668 8.571 1.00 0.00 H new ATOM 0 HH TYR A 113 -23.917 -11.543 10.495 1.00 0.00 H new ATOM 1852 N VAL A 114 -19.968 -4.741 6.802 1.00 0.00 N ATOM 1853 CA VAL A 114 -19.430 -3.960 5.713 1.00 0.00 C ATOM 1854 C VAL A 114 -20.097 -4.477 4.447 1.00 0.00 C ATOM 1855 O VAL A 114 -20.388 -5.670 4.321 1.00 0.00 O ATOM 1856 CB VAL A 114 -17.889 -4.118 5.661 1.00 0.00 C ATOM 1857 CG1 VAL A 114 -17.292 -4.082 4.250 1.00 0.00 C ATOM 1858 CG2 VAL A 114 -17.187 -3.006 6.440 1.00 0.00 C ATOM 0 H VAL A 114 -19.799 -5.738 6.671 1.00 0.00 H new ATOM 0 HA VAL A 114 -19.629 -2.895 5.834 1.00 0.00 H new ATOM 0 HB VAL A 114 -17.721 -5.103 6.097 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -16.210 -4.200 4.310 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -17.713 -4.893 3.656 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -17.528 -3.128 3.779 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -16.108 -3.147 6.383 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -17.450 -2.039 6.011 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -17.502 -3.037 7.483 1.00 0.00 H new ATOM 1868 N LYS A 115 -20.324 -3.576 3.501 1.00 0.00 N ATOM 1869 CA LYS A 115 -20.905 -3.869 2.207 1.00 0.00 C ATOM 1870 C LYS A 115 -19.960 -3.298 1.172 1.00 0.00 C ATOM 1871 O LYS A 115 -19.278 -2.306 1.438 1.00 0.00 O ATOM 1872 CB LYS A 115 -22.316 -3.300 2.084 1.00 0.00 C ATOM 1873 CG LYS A 115 -23.303 -4.371 2.554 1.00 0.00 C ATOM 1874 CD LYS A 115 -24.734 -4.020 2.176 1.00 0.00 C ATOM 1875 CE LYS A 115 -24.939 -4.292 0.678 1.00 0.00 C ATOM 1876 NZ LYS A 115 -25.659 -3.198 0.008 1.00 0.00 N ATOM 0 H LYS A 115 -20.099 -2.588 3.622 1.00 0.00 H new ATOM 0 HA LYS A 115 -21.019 -4.943 2.062 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -22.417 -2.398 2.688 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -22.524 -3.017 1.052 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -23.035 -5.331 2.114 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -23.229 -4.485 3.636 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -25.435 -4.612 2.765 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -24.936 -2.972 2.399 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -23.970 -4.433 0.200 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -25.495 -5.221 0.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -25.774 -3.425 -1.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -26.595 -3.079 0.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -25.117 -2.316 0.105 1.00 0.00 H new ATOM 1890 N LEU A 116 -19.887 -3.949 0.019 1.00 0.00 N ATOM 1891 CA LEU A 116 -19.038 -3.517 -1.082 1.00 0.00 C ATOM 1892 C LEU A 116 -19.846 -3.596 -2.355 1.00 0.00 C ATOM 1893 O LEU A 116 -20.901 -4.235 -2.384 1.00 0.00 O ATOM 1894 CB LEU A 116 -17.760 -4.355 -1.136 1.00 0.00 C ATOM 1895 CG LEU A 116 -16.590 -3.787 -1.956 1.00 0.00 C ATOM 1896 CD1 LEU A 116 -16.522 -4.227 -3.425 1.00 0.00 C ATOM 1897 CD2 LEU A 116 -16.346 -2.293 -1.736 1.00 0.00 C ATOM 0 H LEU A 116 -20.418 -4.797 -0.180 1.00 0.00 H new ATOM 0 HA LEU A 116 -18.713 -2.486 -0.942 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -17.414 -4.512 -0.114 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -18.014 -5.335 -1.541 1.00 0.00 H new ATOM 0 HG LEU A 116 -15.724 -4.285 -1.521 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -15.658 -3.765 -3.903 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -16.428 -5.312 -3.476 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -17.431 -3.917 -3.940 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -15.505 -1.968 -2.349 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -17.238 -1.733 -2.017 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -16.121 -2.112 -0.685 1.00 0.00 H new ATOM 1909 N ASP A 117 -19.354 -2.952 -3.405 1.00 0.00 N ATOM 1910 CA ASP A 117 -20.052 -2.913 -4.685 1.00 0.00 C ATOM 1911 C ASP A 117 -19.220 -3.518 -5.801 1.00 0.00 C ATOM 1912 O ASP A 117 -18.349 -2.890 -6.404 1.00 0.00 O ATOM 1913 CB ASP A 117 -20.575 -1.504 -5.005 1.00 0.00 C ATOM 1914 CG ASP A 117 -22.062 -1.399 -4.678 1.00 0.00 C ATOM 1915 OD1 ASP A 117 -22.837 -2.187 -5.251 1.00 0.00 O ATOM 1916 OD2 ASP A 117 -22.408 -0.599 -3.767 1.00 0.00 O ATOM 0 H ASP A 117 -18.468 -2.446 -3.396 1.00 0.00 H new ATOM 0 HA ASP A 117 -20.935 -3.546 -4.600 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -20.017 -0.764 -4.431 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -20.412 -1.280 -6.059 1.00 0.00 H new ATOM 1921 N LYS A 118 -19.473 -4.800 -6.056 1.00 0.00 N ATOM 1922 CA LYS A 118 -18.792 -5.561 -7.101 1.00 0.00 C ATOM 1923 C LYS A 118 -19.245 -5.093 -8.488 1.00 0.00 C ATOM 1924 O LYS A 118 -18.587 -5.407 -9.480 1.00 0.00 O ATOM 1925 CB LYS A 118 -19.162 -7.045 -6.938 1.00 0.00 C ATOM 1926 CG LYS A 118 -18.710 -7.650 -5.601 1.00 0.00 C ATOM 1927 CD LYS A 118 -19.301 -9.045 -5.355 1.00 0.00 C ATOM 1928 CE LYS A 118 -20.683 -9.051 -4.686 1.00 0.00 C ATOM 1929 NZ LYS A 118 -21.791 -8.773 -5.624 1.00 0.00 N ATOM 0 H LYS A 118 -20.163 -5.345 -5.538 1.00 0.00 H new ATOM 0 HA LYS A 118 -17.716 -5.412 -7.011 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -20.243 -7.153 -7.029 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -18.715 -7.614 -7.754 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -17.622 -7.712 -5.584 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -19.004 -6.986 -4.788 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -19.373 -9.567 -6.309 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -18.609 -9.612 -4.732 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -20.848 -10.022 -4.218 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -20.696 -8.307 -3.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -22.677 -9.160 -5.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -21.889 -7.745 -5.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -21.589 -9.218 -6.542 1.00 0.00 H new ATOM 1943 N ALA A 119 -20.368 -4.376 -8.547 1.00 0.00 N ATOM 1944 CA ALA A 119 -20.981 -3.866 -9.755 1.00 0.00 C ATOM 1945 C ALA A 119 -20.228 -2.709 -10.401 1.00 0.00 C ATOM 1946 O ALA A 119 -20.211 -2.609 -11.629 1.00 0.00 O ATOM 1947 CB ALA A 119 -22.395 -3.412 -9.394 1.00 0.00 C ATOM 0 H ALA A 119 -20.893 -4.128 -7.708 1.00 0.00 H new ATOM 0 HA ALA A 119 -20.972 -4.668 -10.493 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -22.889 -3.020 -10.283 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -22.962 -4.259 -9.007 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -22.344 -2.632 -8.634 1.00 0.00 H new ATOM 1953 N VAL A 120 -19.621 -1.831 -9.605 1.00 0.00 N ATOM 1954 CA VAL A 120 -18.894 -0.675 -10.118 1.00 0.00 C ATOM 1955 C VAL A 120 -17.744 -1.145 -11.017 1.00 0.00 C ATOM 1956 O VAL A 120 -17.174 -2.214 -10.782 1.00 0.00 O ATOM 1957 CB VAL A 120 -18.421 0.189 -8.937 1.00 0.00 C ATOM 1958 CG1 VAL A 120 -17.735 1.461 -9.438 1.00 0.00 C ATOM 1959 CG2 VAL A 120 -19.570 0.625 -8.017 1.00 0.00 C ATOM 0 H VAL A 120 -19.620 -1.902 -8.587 1.00 0.00 H new ATOM 0 HA VAL A 120 -19.542 -0.053 -10.736 1.00 0.00 H new ATOM 0 HB VAL A 120 -17.731 -0.440 -8.374 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -17.408 2.058 -8.586 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -16.871 1.193 -10.046 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -18.436 2.040 -10.039 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -19.174 1.232 -7.203 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -20.291 1.210 -8.588 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -20.062 -0.257 -7.606 1.00 0.00 H new ATOM 1969 N ASP A 121 -17.396 -0.367 -12.043 1.00 0.00 N ATOM 1970 CA ASP A 121 -16.318 -0.728 -12.955 1.00 0.00 C ATOM 1971 C ASP A 121 -14.970 -0.332 -12.356 1.00 0.00 C ATOM 1972 O ASP A 121 -14.722 0.842 -12.060 1.00 0.00 O ATOM 1973 CB ASP A 121 -16.514 -0.071 -14.318 1.00 0.00 C ATOM 1974 CG ASP A 121 -15.674 -0.725 -15.417 1.00 0.00 C ATOM 1975 OD1 ASP A 121 -14.633 -1.370 -15.150 1.00 0.00 O ATOM 1976 OD2 ASP A 121 -16.103 -0.551 -16.585 1.00 0.00 O ATOM 0 H ASP A 121 -17.849 0.520 -12.261 1.00 0.00 H new ATOM 0 HA ASP A 121 -16.335 -1.808 -13.099 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -17.567 -0.122 -14.593 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -16.254 0.985 -14.248 1.00 0.00 H new ATOM 1981 N LEU A 122 -14.086 -1.311 -12.161 1.00 0.00 N ATOM 1982 CA LEU A 122 -12.759 -1.102 -11.598 1.00 0.00 C ATOM 1983 C LEU A 122 -11.937 -0.127 -12.435 1.00 0.00 C ATOM 1984 O LEU A 122 -11.100 0.583 -11.883 1.00 0.00 O ATOM 1985 CB LEU A 122 -12.025 -2.440 -11.414 1.00 0.00 C ATOM 1986 CG LEU A 122 -11.173 -2.536 -10.134 1.00 0.00 C ATOM 1987 CD1 LEU A 122 -9.939 -1.646 -10.127 1.00 0.00 C ATOM 1988 CD2 LEU A 122 -11.992 -2.290 -8.869 1.00 0.00 C ATOM 0 H LEU A 122 -14.278 -2.285 -12.395 1.00 0.00 H new ATOM 0 HA LEU A 122 -12.886 -0.650 -10.614 1.00 0.00 H new ATOM 0 HB2 LEU A 122 -12.761 -3.244 -11.406 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -11.380 -2.607 -12.277 1.00 0.00 H new ATOM 0 HG LEU A 122 -10.818 -3.567 -10.137 1.00 0.00 H new ATOM 0 HD11 LEU A 122 -9.400 -1.778 -9.189 1.00 0.00 H new ATOM 0 HD12 LEU A 122 -9.290 -1.917 -10.960 1.00 0.00 H new ATOM 0 HD13 LEU A 122 -10.242 -0.604 -10.228 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -11.345 -2.369 -7.995 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -12.430 -1.293 -8.907 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -12.787 -3.033 -8.800 1.00 0.00 H new ATOM 2000 N ALA A 123 -12.174 -0.040 -13.743 1.00 0.00 N ATOM 2001 CA ALA A 123 -11.446 0.885 -14.601 1.00 0.00 C ATOM 2002 C ALA A 123 -11.649 2.326 -14.109 1.00 0.00 C ATOM 2003 O ALA A 123 -10.687 3.098 -13.998 1.00 0.00 O ATOM 2004 CB ALA A 123 -11.919 0.717 -16.045 1.00 0.00 C ATOM 0 H ALA A 123 -12.870 -0.604 -14.231 1.00 0.00 H new ATOM 0 HA ALA A 123 -10.379 0.666 -14.561 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -11.375 1.408 -16.689 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.733 -0.306 -16.372 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -12.987 0.929 -16.105 1.00 0.00 H new ATOM 2010 N GLY A 124 -12.901 2.678 -13.804 1.00 0.00 N ATOM 2011 CA GLY A 124 -13.274 3.993 -13.316 1.00 0.00 C ATOM 2012 C GLY A 124 -12.736 4.209 -11.908 1.00 0.00 C ATOM 2013 O GLY A 124 -12.270 5.309 -11.606 1.00 0.00 O ATOM 0 H GLY A 124 -13.692 2.040 -13.894 1.00 0.00 H new ATOM 0 HA2 GLY A 124 -12.882 4.760 -13.984 1.00 0.00 H new ATOM 0 HA3 GLY A 124 -14.359 4.094 -13.317 1.00 0.00 H new ATOM 2017 N LEU A 125 -12.783 3.173 -11.057 1.00 0.00 N ATOM 2018 CA LEU A 125 -12.293 3.225 -9.679 1.00 0.00 C ATOM 2019 C LEU A 125 -10.794 3.519 -9.719 1.00 0.00 C ATOM 2020 O LEU A 125 -10.353 4.495 -9.122 1.00 0.00 O ATOM 2021 CB LEU A 125 -12.634 1.938 -8.903 1.00 0.00 C ATOM 2022 CG LEU A 125 -14.149 1.774 -8.651 1.00 0.00 C ATOM 2023 CD1 LEU A 125 -14.510 0.378 -8.138 1.00 0.00 C ATOM 2024 CD2 LEU A 125 -14.680 2.800 -7.643 1.00 0.00 C ATOM 0 H LEU A 125 -13.169 2.264 -11.314 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.794 4.024 -9.132 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -12.268 1.076 -9.460 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -12.110 1.946 -7.947 1.00 0.00 H new ATOM 0 HG LEU A 125 -14.616 1.934 -9.623 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -15.586 0.317 -7.977 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -14.210 -0.369 -8.873 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -13.992 0.191 -7.198 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -15.749 2.647 -7.497 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.162 2.677 -6.692 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -14.506 3.807 -8.023 1.00 0.00 H new ATOM 2036 N THR A 126 -10.023 2.739 -10.483 1.00 0.00 N ATOM 2037 CA THR A 126 -8.582 2.909 -10.656 1.00 0.00 C ATOM 2038 C THR A 126 -8.258 4.363 -11.019 1.00 0.00 C ATOM 2039 O THR A 126 -7.338 4.950 -10.439 1.00 0.00 O ATOM 2040 CB THR A 126 -8.085 1.974 -11.776 1.00 0.00 C ATOM 2041 OG1 THR A 126 -8.406 0.638 -11.485 1.00 0.00 O ATOM 2042 CG2 THR A 126 -6.569 2.029 -11.968 1.00 0.00 C ATOM 0 H THR A 126 -10.397 1.951 -11.012 1.00 0.00 H new ATOM 0 HA THR A 126 -8.081 2.660 -9.721 1.00 0.00 H new ATOM 0 HB THR A 126 -8.579 2.321 -12.683 1.00 0.00 H new ATOM 0 HG1 THR A 126 -9.333 0.460 -11.747 1.00 0.00 H new ATOM 0 HG21 THR A 126 -6.279 1.350 -12.770 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.272 3.045 -12.228 1.00 0.00 H new ATOM 0 HG23 THR A 126 -6.074 1.731 -11.044 1.00 0.00 H new ATOM 2050 N ALA A 127 -8.996 4.943 -11.973 1.00 0.00 N ATOM 2051 CA ALA A 127 -8.758 6.312 -12.398 1.00 0.00 C ATOM 2052 C ALA A 127 -8.983 7.311 -11.255 1.00 0.00 C ATOM 2053 O ALA A 127 -8.050 8.034 -10.878 1.00 0.00 O ATOM 2054 CB ALA A 127 -9.607 6.635 -13.631 1.00 0.00 C ATOM 0 H ALA A 127 -9.762 4.478 -12.461 1.00 0.00 H new ATOM 0 HA ALA A 127 -7.709 6.409 -12.680 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -9.421 7.663 -13.941 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -9.342 5.957 -14.443 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -10.663 6.515 -13.388 1.00 0.00 H new ATOM 2060 N ARG A 128 -10.200 7.349 -10.698 1.00 0.00 N ATOM 2061 CA ARG A 128 -10.517 8.282 -9.616 1.00 0.00 C ATOM 2062 C ARG A 128 -9.564 8.133 -8.427 1.00 0.00 C ATOM 2063 O ARG A 128 -9.241 9.138 -7.809 1.00 0.00 O ATOM 2064 CB ARG A 128 -12.006 8.269 -9.240 1.00 0.00 C ATOM 2065 CG ARG A 128 -12.455 6.994 -8.520 1.00 0.00 C ATOM 2066 CD ARG A 128 -13.909 7.085 -8.034 1.00 0.00 C ATOM 2067 NE ARG A 128 -14.896 6.935 -9.127 1.00 0.00 N ATOM 2068 CZ ARG A 128 -16.088 6.325 -9.018 1.00 0.00 C ATOM 2069 NH1 ARG A 128 -16.490 5.809 -7.856 1.00 0.00 N ATOM 2070 NH2 ARG A 128 -16.867 6.209 -10.085 1.00 0.00 N ATOM 0 H ARG A 128 -10.975 6.748 -10.978 1.00 0.00 H new ATOM 0 HA ARG A 128 -10.340 9.288 -9.998 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -12.217 9.128 -8.602 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -12.600 8.391 -10.146 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -12.351 6.143 -9.193 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -11.800 6.809 -7.669 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -14.085 6.313 -7.285 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -14.062 8.046 -7.543 1.00 0.00 H new ATOM 0 HE ARG A 128 -14.651 7.326 -10.037 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -15.890 5.874 -7.034 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -17.398 5.349 -7.789 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -16.560 6.582 -10.983 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -17.773 5.747 -10.007 1.00 0.00 H new ATOM 2084 N LEU A 129 -9.072 6.922 -8.139 1.00 0.00 N ATOM 2085 CA LEU A 129 -8.135 6.702 -7.042 1.00 0.00 C ATOM 2086 C LEU A 129 -6.854 7.477 -7.353 1.00 0.00 C ATOM 2087 O LEU A 129 -6.486 8.382 -6.610 1.00 0.00 O ATOM 2088 CB LEU A 129 -7.833 5.202 -6.841 1.00 0.00 C ATOM 2089 CG LEU A 129 -8.916 4.412 -6.091 1.00 0.00 C ATOM 2090 CD1 LEU A 129 -8.540 2.925 -6.051 1.00 0.00 C ATOM 2091 CD2 LEU A 129 -9.095 4.933 -4.663 1.00 0.00 C ATOM 0 H LEU A 129 -9.312 6.077 -8.657 1.00 0.00 H new ATOM 0 HA LEU A 129 -8.577 7.057 -6.111 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -7.683 4.744 -7.819 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -6.894 5.107 -6.297 1.00 0.00 H new ATOM 0 HG LEU A 129 -9.858 4.541 -6.623 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -9.311 2.369 -5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -8.455 2.544 -7.069 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -7.586 2.805 -5.538 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -9.868 4.354 -4.159 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -8.155 4.835 -4.119 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -9.389 5.982 -4.693 1.00 0.00 H new ATOM 2103 N ALA A 130 -6.201 7.161 -8.479 1.00 0.00 N ATOM 2104 CA ALA A 130 -4.964 7.827 -8.887 1.00 0.00 C ATOM 2105 C ALA A 130 -5.149 9.323 -9.183 1.00 0.00 C ATOM 2106 O ALA A 130 -4.154 10.023 -9.374 1.00 0.00 O ATOM 2107 CB ALA A 130 -4.340 7.101 -10.082 1.00 0.00 C ATOM 0 H ALA A 130 -6.516 6.440 -9.128 1.00 0.00 H new ATOM 0 HA ALA A 130 -4.282 7.773 -8.039 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -3.420 7.607 -10.375 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -4.115 6.071 -9.805 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -5.040 7.107 -10.918 1.00 0.00 H new ATOM 2113 N HIS A 131 -6.388 9.818 -9.275 1.00 0.00 N ATOM 2114 CA HIS A 131 -6.685 11.223 -9.517 1.00 0.00 C ATOM 2115 C HIS A 131 -6.114 12.087 -8.375 1.00 0.00 C ATOM 2116 O HIS A 131 -5.674 13.200 -8.649 1.00 0.00 O ATOM 2117 CB HIS A 131 -8.207 11.381 -9.675 1.00 0.00 C ATOM 2118 CG HIS A 131 -8.691 12.497 -10.563 1.00 0.00 C ATOM 2119 ND1 HIS A 131 -9.868 12.487 -11.275 1.00 0.00 N ATOM 2120 CD2 HIS A 131 -8.084 13.697 -10.787 1.00 0.00 C ATOM 2121 CE1 HIS A 131 -9.979 13.667 -11.904 1.00 0.00 C ATOM 2122 NE2 HIS A 131 -8.907 14.435 -11.649 1.00 0.00 N ATOM 0 H HIS A 131 -7.222 9.239 -9.181 1.00 0.00 H new ATOM 0 HA HIS A 131 -6.211 11.568 -10.436 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -8.606 10.443 -10.062 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -8.637 11.526 -8.684 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -7.140 14.021 -10.375 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -10.812 13.958 -12.527 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -8.727 15.371 -12.011 1.00 0.00 H new ATOM 2130 N HIS A 132 -6.113 11.587 -7.127 1.00 0.00 N ATOM 2131 CA HIS A 132 -5.585 12.257 -5.929 1.00 0.00 C ATOM 2132 C HIS A 132 -5.909 13.764 -5.856 1.00 0.00 C ATOM 2133 O HIS A 132 -5.018 14.582 -5.614 1.00 0.00 O ATOM 2134 CB HIS A 132 -4.070 12.011 -5.883 1.00 0.00 C ATOM 2135 CG HIS A 132 -3.634 10.570 -5.885 1.00 0.00 C ATOM 2136 ND1 HIS A 132 -2.711 10.040 -6.753 1.00 0.00 N ATOM 2137 CD2 HIS A 132 -3.969 9.598 -4.980 1.00 0.00 C ATOM 2138 CE1 HIS A 132 -2.456 8.787 -6.351 1.00 0.00 C ATOM 2139 NE2 HIS A 132 -3.181 8.479 -5.266 1.00 0.00 N ATOM 0 H HIS A 132 -6.497 10.665 -6.918 1.00 0.00 H new ATOM 0 HA HIS A 132 -6.079 11.830 -5.056 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -3.615 12.509 -6.740 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -3.672 12.489 -4.988 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -2.296 10.513 -7.556 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -4.704 9.680 -4.193 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -1.761 8.117 -6.835 1.00 0.00 H new ATOM 2147 N VAL A 133 -7.173 14.133 -6.075 1.00 0.00 N ATOM 2148 CA VAL A 133 -7.640 15.519 -6.045 1.00 0.00 C ATOM 2149 C VAL A 133 -7.580 16.067 -4.616 1.00 0.00 C ATOM 2150 O VAL A 133 -7.216 17.226 -4.413 1.00 0.00 O ATOM 2151 CB VAL A 133 -9.080 15.591 -6.601 1.00 0.00 C ATOM 2152 CG1 VAL A 133 -9.626 17.025 -6.663 1.00 0.00 C ATOM 2153 CG2 VAL A 133 -9.171 14.991 -8.011 1.00 0.00 C ATOM 0 H VAL A 133 -7.914 13.463 -6.282 1.00 0.00 H new ATOM 0 HA VAL A 133 -6.992 16.133 -6.670 1.00 0.00 H new ATOM 0 HB VAL A 133 -9.683 15.012 -5.902 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -10.640 17.011 -7.062 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -9.636 17.454 -5.661 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -8.990 17.629 -7.310 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -10.198 15.059 -8.370 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -8.514 15.542 -8.684 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -8.865 13.945 -7.982 1.00 0.00 H new ATOM 2163 N HIS A 134 -8.003 15.266 -3.633 1.00 0.00 N ATOM 2164 CA HIS A 134 -8.007 15.638 -2.220 1.00 0.00 C ATOM 2165 C HIS A 134 -7.034 14.805 -1.382 1.00 0.00 C ATOM 2166 O HIS A 134 -6.787 15.151 -0.224 1.00 0.00 O ATOM 2167 CB HIS A 134 -9.435 15.540 -1.673 1.00 0.00 C ATOM 2168 CG HIS A 134 -10.015 14.149 -1.691 1.00 0.00 C ATOM 2169 ND1 HIS A 134 -9.726 13.130 -0.812 1.00 0.00 N ATOM 2170 CD2 HIS A 134 -10.927 13.672 -2.592 1.00 0.00 C ATOM 2171 CE1 HIS A 134 -10.457 12.067 -1.170 1.00 0.00 C ATOM 2172 NE2 HIS A 134 -11.171 12.330 -2.279 1.00 0.00 N ATOM 0 H HIS A 134 -8.358 14.325 -3.803 1.00 0.00 H new ATOM 0 HA HIS A 134 -7.657 16.667 -2.145 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -9.445 15.911 -0.648 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -10.080 16.197 -2.256 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -11.377 14.230 -3.399 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -10.471 11.126 -0.640 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -11.770 11.681 -2.790 1.00 0.00 H new ATOM 2180 N ALA A 135 -6.515 13.710 -1.944 1.00 0.00 N ATOM 2181 CA ALA A 135 -5.589 12.811 -1.277 1.00 0.00 C ATOM 2182 C ALA A 135 -4.266 13.507 -0.932 1.00 0.00 C ATOM 2183 O ALA A 135 -4.025 14.657 -1.301 1.00 0.00 O ATOM 2184 CB ALA A 135 -5.350 11.597 -2.182 1.00 0.00 C ATOM 0 H ALA A 135 -6.737 13.424 -2.898 1.00 0.00 H new ATOM 0 HA ALA A 135 -6.026 12.489 -0.332 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -4.656 10.911 -1.695 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -6.296 11.087 -2.364 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -4.928 11.928 -3.131 1.00 0.00 H new ATOM 2190 N GLU A 136 -3.405 12.790 -0.212 1.00 0.00 N ATOM 2191 CA GLU A 136 -2.086 13.282 0.197 1.00 0.00 C ATOM 2192 C GLU A 136 -0.997 12.209 0.061 1.00 0.00 C ATOM 2193 O GLU A 136 0.158 12.543 -0.194 1.00 0.00 O ATOM 2194 CB GLU A 136 -2.113 13.896 1.609 1.00 0.00 C ATOM 2195 CG GLU A 136 -2.323 12.876 2.739 1.00 0.00 C ATOM 2196 CD GLU A 136 -1.974 13.448 4.115 1.00 0.00 C ATOM 2197 OE1 GLU A 136 -0.855 13.973 4.298 1.00 0.00 O ATOM 2198 OE2 GLU A 136 -2.787 13.272 5.061 1.00 0.00 O ATOM 0 H GLU A 136 -3.603 11.842 0.108 1.00 0.00 H new ATOM 0 HA GLU A 136 -1.824 14.083 -0.495 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -1.175 14.423 1.781 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -2.909 14.639 1.654 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -3.362 12.547 2.739 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -1.709 11.996 2.548 1.00 0.00 H new ATOM 2205 N GLY A 137 -1.344 10.924 0.179 1.00 0.00 N ATOM 2206 CA GLY A 137 -0.390 9.824 0.072 1.00 0.00 C ATOM 2207 C GLY A 137 -0.975 8.454 0.415 1.00 0.00 C ATOM 2208 O GLY A 137 -0.326 7.451 0.105 1.00 0.00 O ATOM 0 H GLY A 137 -2.302 10.619 0.353 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.002 9.795 -0.945 1.00 0.00 H new ATOM 0 HA3 GLY A 137 0.453 10.023 0.734 1.00 0.00 H new ATOM 2212 N LEU A 138 -2.147 8.416 1.066 1.00 0.00 N ATOM 2213 CA LEU A 138 -2.876 7.212 1.461 1.00 0.00 C ATOM 2214 C LEU A 138 -3.088 6.313 0.262 1.00 0.00 C ATOM 2215 O LEU A 138 -2.798 5.105 0.385 1.00 0.00 O ATOM 2216 CB LEU A 138 -4.188 7.472 2.223 1.00 0.00 C ATOM 2217 CG LEU A 138 -5.283 8.327 1.564 1.00 0.00 C ATOM 2218 CD1 LEU A 138 -6.364 8.559 2.623 1.00 0.00 C ATOM 2219 CD2 LEU A 138 -4.773 9.686 1.088 1.00 0.00 C ATOM 0 H LEU A 138 -2.632 9.269 1.343 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.244 6.702 2.188 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.627 6.503 2.460 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -3.929 7.945 3.170 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.653 7.799 0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -7.165 9.164 2.199 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -6.767 7.600 2.948 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -5.931 9.079 3.477 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -5.592 10.243 0.632 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -4.382 10.246 1.938 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -3.980 9.540 0.354 1.00 0.00 H new TER 2231 LEU A 138