USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 908 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 86 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 61 THR OG1 : rot 53:sc= 0.834 USER MOD Set 2.2: A 62 HIS : no HD1:sc= -3.86! K(o=-3!,f=-5.3) USER MOD Set 3.1: A 42 MET CE :methyl -177:sc= -3.23! (180deg=-2.62!) USER MOD Set 3.2: A 54 ASN : amide:sc= -0.0879 K(o=-3.3,f=-6!) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 45:sc= 0.195 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 MET CE :methyl -172:sc= -0.195 (180deg=-0.238) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0.0201 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.0157 X(o=-0.016,f=-0.063) USER MOD Single : A 68 ASN : amide:sc= -2.68 K(o=-2.7,f=-3.7!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= -0.163 USER MOD Single : A 78 GLN : amide:sc= -0.0291 X(o=-0.029,f=-0.16) USER MOD Single : A 80 GLN :FLIP amide:sc= -1.75 F(o=-3.2!,f=-1.7) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.016) USER MOD Single : A 87 GLN : amide:sc= -0.291 X(o=-0.29,f=-0.38) USER MOD Single : A 94 SER OG : rot 180:sc= 0.0079 USER MOD Single : A 99 CYS SG : rot 155:sc= -4.51! USER MOD Single : A 104 LYS NZ :NH3+ -170:sc= 0.482 (180deg=0.419) USER MOD Single : A 108 MET CE :methyl 151:sc= 0 (180deg=-1.5!) USER MOD Single : A 109 THR OG1 : rot 180:sc= -0.0985 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 HIS : no HE2:sc= -4.36! C(o=-4.4!,f=-6.4!) USER MOD Single : A 113 GLN : amide:sc= -1.19 K(o=-1.2,f=-2.7!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -10.363 -0.731 -19.475 1.00 0.00 N ATOM 2 CA GLY A 1 -10.435 -0.822 -20.923 1.00 0.00 C ATOM 3 C GLY A 1 -11.546 0.075 -21.474 1.00 0.00 C ATOM 4 O GLY A 1 -12.712 -0.083 -21.114 1.00 0.00 O ATOM 0 H1 GLY A 1 -9.602 -1.348 -19.126 1.00 0.00 H new ATOM 0 H2 GLY A 1 -10.166 0.252 -19.198 1.00 0.00 H new ATOM 0 H3 GLY A 1 -11.269 -1.032 -19.063 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.479 -0.531 -21.357 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.617 -1.856 -21.217 1.00 0.00 H new ATOM 8 N SER A 2 -11.146 0.996 -22.338 1.00 0.00 N ATOM 9 CA SER A 2 -12.093 1.918 -22.941 1.00 0.00 C ATOM 10 C SER A 2 -13.209 1.138 -23.641 1.00 0.00 C ATOM 11 O SER A 2 -12.945 0.342 -24.541 1.00 0.00 O ATOM 12 CB SER A 2 -11.397 2.853 -23.933 1.00 0.00 C ATOM 13 OG SER A 2 -10.650 3.870 -23.272 1.00 0.00 O ATOM 0 H SER A 2 -10.179 1.124 -22.635 1.00 0.00 H new ATOM 0 HA SER A 2 -12.526 2.530 -22.149 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.732 2.273 -24.573 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.142 3.314 -24.581 1.00 0.00 H new ATOM 0 HG SER A 2 -10.219 4.445 -23.939 1.00 0.00 H new ATOM 19 N SER A 3 -14.432 1.395 -23.200 1.00 0.00 N ATOM 20 CA SER A 3 -15.588 0.727 -23.773 1.00 0.00 C ATOM 21 C SER A 3 -16.745 1.718 -23.920 1.00 0.00 C ATOM 22 O SER A 3 -17.368 2.101 -22.931 1.00 0.00 O ATOM 23 CB SER A 3 -16.017 -0.465 -22.915 1.00 0.00 C ATOM 24 OG SER A 3 -16.127 -0.119 -21.537 1.00 0.00 O ATOM 0 H SER A 3 -14.647 2.056 -22.453 1.00 0.00 H new ATOM 0 HA SER A 3 -15.312 0.351 -24.758 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.975 -0.842 -23.272 1.00 0.00 H new ATOM 0 HB3 SER A 3 -15.294 -1.273 -23.029 1.00 0.00 H new ATOM 0 HG SER A 3 -16.605 0.732 -21.451 1.00 0.00 H new ATOM 30 N GLY A 4 -16.997 2.104 -25.162 1.00 0.00 N ATOM 31 CA GLY A 4 -18.067 3.043 -25.451 1.00 0.00 C ATOM 32 C GLY A 4 -18.520 2.927 -26.908 1.00 0.00 C ATOM 33 O GLY A 4 -19.342 2.074 -27.241 1.00 0.00 O ATOM 0 H GLY A 4 -16.478 1.783 -25.980 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.911 2.853 -24.788 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.727 4.059 -25.252 1.00 0.00 H new ATOM 37 N SER A 5 -17.963 3.796 -27.739 1.00 0.00 N ATOM 38 CA SER A 5 -18.298 3.802 -29.152 1.00 0.00 C ATOM 39 C SER A 5 -17.317 4.689 -29.920 1.00 0.00 C ATOM 40 O SER A 5 -16.903 5.737 -29.425 1.00 0.00 O ATOM 41 CB SER A 5 -19.734 4.282 -29.375 1.00 0.00 C ATOM 42 OG SER A 5 -20.353 3.620 -30.475 1.00 0.00 O ATOM 0 H SER A 5 -17.281 4.501 -27.460 1.00 0.00 H new ATOM 0 HA SER A 5 -18.222 2.781 -29.525 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.319 4.108 -28.472 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.733 5.357 -29.553 1.00 0.00 H new ATOM 0 HG SER A 5 -21.268 3.952 -30.584 1.00 0.00 H new ATOM 48 N SER A 6 -16.971 4.237 -31.117 1.00 0.00 N ATOM 49 CA SER A 6 -16.046 4.978 -31.958 1.00 0.00 C ATOM 50 C SER A 6 -16.821 5.872 -32.927 1.00 0.00 C ATOM 51 O SER A 6 -17.174 5.444 -34.025 1.00 0.00 O ATOM 52 CB SER A 6 -15.125 4.030 -32.729 1.00 0.00 C ATOM 53 OG SER A 6 -14.511 4.673 -33.843 1.00 0.00 O ATOM 0 H SER A 6 -17.315 3.367 -31.524 1.00 0.00 H new ATOM 0 HA SER A 6 -15.425 5.603 -31.317 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.354 3.649 -32.060 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.698 3.170 -33.077 1.00 0.00 H new ATOM 0 HG SER A 6 -13.930 4.036 -34.309 1.00 0.00 H new ATOM 59 N GLY A 7 -17.062 7.098 -32.487 1.00 0.00 N ATOM 60 CA GLY A 7 -17.788 8.057 -33.302 1.00 0.00 C ATOM 61 C GLY A 7 -16.942 8.518 -34.491 1.00 0.00 C ATOM 62 O GLY A 7 -15.719 8.390 -34.473 1.00 0.00 O ATOM 0 H GLY A 7 -16.767 7.450 -31.576 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -18.713 7.607 -33.662 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.068 8.918 -32.695 1.00 0.00 H new ATOM 66 N THR A 8 -17.627 9.047 -35.494 1.00 0.00 N ATOM 67 CA THR A 8 -16.954 9.528 -36.688 1.00 0.00 C ATOM 68 C THR A 8 -16.222 10.840 -36.396 1.00 0.00 C ATOM 69 O THR A 8 -16.660 11.907 -36.823 1.00 0.00 O ATOM 70 CB THR A 8 -17.995 9.649 -37.802 1.00 0.00 C ATOM 71 OG1 THR A 8 -18.320 8.299 -38.121 1.00 0.00 O ATOM 72 CG2 THR A 8 -17.404 10.206 -39.099 1.00 0.00 C ATOM 0 H THR A 8 -18.641 9.153 -35.504 1.00 0.00 H new ATOM 0 HA THR A 8 -16.185 8.829 -37.017 1.00 0.00 H new ATOM 0 HB THR A 8 -18.809 10.292 -37.469 1.00 0.00 H new ATOM 0 HG1 THR A 8 -18.991 8.284 -38.835 1.00 0.00 H new ATOM 0 HG21 THR A 8 -18.185 10.271 -39.856 1.00 0.00 H new ATOM 0 HG22 THR A 8 -16.993 11.199 -38.915 1.00 0.00 H new ATOM 0 HG23 THR A 8 -16.612 9.545 -39.451 1.00 0.00 H new ATOM 80 N GLY A 9 -15.121 10.717 -35.670 1.00 0.00 N ATOM 81 CA GLY A 9 -14.325 11.879 -35.315 1.00 0.00 C ATOM 82 C GLY A 9 -14.617 12.327 -33.882 1.00 0.00 C ATOM 83 O GLY A 9 -15.706 12.819 -33.591 1.00 0.00 O ATOM 0 H GLY A 9 -14.761 9.830 -35.318 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.266 11.644 -35.417 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -14.538 12.695 -36.005 1.00 0.00 H new ATOM 87 N ALA A 10 -13.624 12.142 -33.024 1.00 0.00 N ATOM 88 CA ALA A 10 -13.761 12.522 -31.628 1.00 0.00 C ATOM 89 C ALA A 10 -12.987 13.818 -31.378 1.00 0.00 C ATOM 90 O ALA A 10 -11.891 14.002 -31.905 1.00 0.00 O ATOM 91 CB ALA A 10 -13.280 11.374 -30.737 1.00 0.00 C ATOM 0 H ALA A 10 -12.722 11.734 -33.269 1.00 0.00 H new ATOM 0 HA ALA A 10 -14.806 12.710 -31.382 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -13.383 11.659 -29.690 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -13.881 10.486 -30.932 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -12.234 11.159 -30.954 1.00 0.00 H new ATOM 97 N LEU A 11 -13.588 14.682 -30.573 1.00 0.00 N ATOM 98 CA LEU A 11 -12.969 15.956 -30.247 1.00 0.00 C ATOM 99 C LEU A 11 -12.226 15.830 -28.915 1.00 0.00 C ATOM 100 O LEU A 11 -11.003 15.949 -28.869 1.00 0.00 O ATOM 101 CB LEU A 11 -14.009 17.078 -30.268 1.00 0.00 C ATOM 102 CG LEU A 11 -14.191 17.799 -31.605 1.00 0.00 C ATOM 103 CD1 LEU A 11 -15.659 17.790 -32.037 1.00 0.00 C ATOM 104 CD2 LEU A 11 -13.619 19.217 -31.546 1.00 0.00 C ATOM 0 H LEU A 11 -14.497 14.525 -30.137 1.00 0.00 H new ATOM 0 HA LEU A 11 -12.229 16.225 -31.001 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -14.971 16.661 -29.969 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -13.734 17.816 -29.514 1.00 0.00 H new ATOM 0 HG LEU A 11 -13.628 17.257 -32.365 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -15.761 18.309 -32.990 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -16.000 16.760 -32.146 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -16.263 18.294 -31.283 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -13.761 19.707 -32.509 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -14.133 19.785 -30.770 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -12.554 19.171 -31.316 1.00 0.00 H new ATOM 116 N MET A 12 -12.997 15.592 -27.864 1.00 0.00 N ATOM 117 CA MET A 12 -12.428 15.449 -26.535 1.00 0.00 C ATOM 118 C MET A 12 -11.296 16.454 -26.313 1.00 0.00 C ATOM 119 O MET A 12 -10.132 16.153 -26.575 1.00 0.00 O ATOM 120 CB MET A 12 -11.890 14.027 -26.360 1.00 0.00 C ATOM 121 CG MET A 12 -11.832 13.641 -24.881 1.00 0.00 C ATOM 122 SD MET A 12 -12.000 11.873 -24.704 1.00 0.00 S ATOM 123 CE MET A 12 -11.401 11.670 -23.035 1.00 0.00 C ATOM 0 H MET A 12 -14.011 15.495 -27.906 1.00 0.00 H new ATOM 0 HA MET A 12 -13.211 15.643 -25.802 1.00 0.00 H new ATOM 0 HB2 MET A 12 -12.527 13.325 -26.898 1.00 0.00 H new ATOM 0 HB3 MET A 12 -10.894 13.955 -26.798 1.00 0.00 H new ATOM 0 HG2 MET A 12 -10.887 13.970 -24.448 1.00 0.00 H new ATOM 0 HG3 MET A 12 -12.627 14.147 -24.333 1.00 0.00 H new ATOM 0 HE1 MET A 12 -11.438 10.616 -22.761 1.00 0.00 H new ATOM 0 HE2 MET A 12 -10.373 12.026 -22.972 1.00 0.00 H new ATOM 0 HE3 MET A 12 -12.026 12.245 -22.352 1.00 0.00 H new ATOM 133 N ALA A 13 -11.677 17.629 -25.833 1.00 0.00 N ATOM 134 CA ALA A 13 -10.708 18.681 -25.572 1.00 0.00 C ATOM 135 C ALA A 13 -11.386 19.810 -24.794 1.00 0.00 C ATOM 136 O ALA A 13 -11.890 20.763 -25.388 1.00 0.00 O ATOM 137 CB ALA A 13 -10.109 19.161 -26.895 1.00 0.00 C ATOM 0 H ALA A 13 -12.643 17.876 -25.618 1.00 0.00 H new ATOM 0 HA ALA A 13 -9.888 18.306 -24.960 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -9.382 19.950 -26.700 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -9.615 18.328 -27.394 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -10.902 19.548 -27.534 1.00 0.00 H new ATOM 143 N SER A 14 -11.376 19.668 -23.477 1.00 0.00 N ATOM 144 CA SER A 14 -11.984 20.664 -22.612 1.00 0.00 C ATOM 145 C SER A 14 -11.719 20.316 -21.146 1.00 0.00 C ATOM 146 O SER A 14 -11.162 21.122 -20.403 1.00 0.00 O ATOM 147 CB SER A 14 -13.488 20.773 -22.868 1.00 0.00 C ATOM 148 OG SER A 14 -14.005 22.045 -22.485 1.00 0.00 O ATOM 0 H SER A 14 -10.956 18.878 -22.988 1.00 0.00 H new ATOM 0 HA SER A 14 -11.534 21.631 -22.836 1.00 0.00 H new ATOM 0 HB2 SER A 14 -13.689 20.604 -23.926 1.00 0.00 H new ATOM 0 HB3 SER A 14 -14.007 19.990 -22.316 1.00 0.00 H new ATOM 0 HG SER A 14 -14.968 22.075 -22.666 1.00 0.00 H new ATOM 154 N SER A 15 -12.131 19.113 -20.773 1.00 0.00 N ATOM 155 CA SER A 15 -11.946 18.648 -19.409 1.00 0.00 C ATOM 156 C SER A 15 -10.533 18.087 -19.235 1.00 0.00 C ATOM 157 O SER A 15 -10.033 17.375 -20.104 1.00 0.00 O ATOM 158 CB SER A 15 -12.986 17.588 -19.042 1.00 0.00 C ATOM 159 OG SER A 15 -12.871 16.423 -19.854 1.00 0.00 O ATOM 0 H SER A 15 -12.592 18.446 -21.392 1.00 0.00 H new ATOM 0 HA SER A 15 -12.079 19.496 -18.738 1.00 0.00 H new ATOM 0 HB2 SER A 15 -12.868 17.312 -17.994 1.00 0.00 H new ATOM 0 HB3 SER A 15 -13.986 18.008 -19.151 1.00 0.00 H new ATOM 0 HG SER A 15 -13.551 15.770 -19.587 1.00 0.00 H new ATOM 165 N PRO A 16 -9.914 18.439 -18.076 1.00 0.00 N ATOM 166 CA PRO A 16 -8.568 17.979 -17.777 1.00 0.00 C ATOM 167 C PRO A 16 -8.571 16.504 -17.368 1.00 0.00 C ATOM 168 O PRO A 16 -8.103 16.156 -16.286 1.00 0.00 O ATOM 169 CB PRO A 16 -8.073 18.900 -16.674 1.00 0.00 C ATOM 170 CG PRO A 16 -9.316 19.539 -16.076 1.00 0.00 C ATOM 171 CD PRO A 16 -10.475 19.281 -17.024 1.00 0.00 C ATOM 0 HA PRO A 16 -7.906 18.024 -18.642 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -7.519 18.342 -15.919 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -7.397 19.657 -17.071 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -9.526 19.118 -15.093 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -9.166 20.610 -15.939 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -11.299 18.782 -16.515 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -10.869 20.213 -17.430 1.00 0.00 H new ATOM 179 N GLN A 17 -9.105 15.678 -18.256 1.00 0.00 N ATOM 180 CA GLN A 17 -9.175 14.249 -18.001 1.00 0.00 C ATOM 181 C GLN A 17 -7.876 13.568 -18.436 1.00 0.00 C ATOM 182 O GLN A 17 -7.884 12.719 -19.326 1.00 0.00 O ATOM 183 CB GLN A 17 -10.383 13.626 -18.704 1.00 0.00 C ATOM 184 CG GLN A 17 -11.494 13.305 -17.702 1.00 0.00 C ATOM 185 CD GLN A 17 -11.656 11.794 -17.528 1.00 0.00 C ATOM 186 OE1 GLN A 17 -11.178 11.198 -16.577 1.00 0.00 O ATOM 187 NE2 GLN A 17 -12.356 11.210 -18.496 1.00 0.00 N ATOM 0 H GLN A 17 -9.493 15.971 -19.153 1.00 0.00 H new ATOM 0 HA GLN A 17 -9.301 14.096 -16.929 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -10.760 14.311 -19.463 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -10.079 12.715 -19.219 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -11.264 13.763 -16.740 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -12.434 13.738 -18.045 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -12.728 11.768 -19.264 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -12.521 10.204 -18.470 1.00 0.00 H new ATOM 196 N ASP A 18 -6.791 13.966 -17.788 1.00 0.00 N ATOM 197 CA ASP A 18 -5.487 13.404 -18.097 1.00 0.00 C ATOM 198 C ASP A 18 -4.719 13.163 -16.796 1.00 0.00 C ATOM 199 O ASP A 18 -4.066 14.068 -16.279 1.00 0.00 O ATOM 200 CB ASP A 18 -4.665 14.363 -18.960 1.00 0.00 C ATOM 201 CG ASP A 18 -4.518 13.949 -20.426 1.00 0.00 C ATOM 202 OD1 ASP A 18 -4.219 12.757 -20.652 1.00 0.00 O ATOM 203 OD2 ASP A 18 -4.708 14.835 -21.287 1.00 0.00 O ATOM 0 H ASP A 18 -6.788 14.671 -17.051 1.00 0.00 H new ATOM 0 HA ASP A 18 -5.642 12.472 -18.640 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -5.127 15.350 -18.921 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -3.671 14.459 -18.524 1.00 0.00 H new ATOM 208 N ILE A 19 -4.824 11.937 -16.303 1.00 0.00 N ATOM 209 CA ILE A 19 -4.147 11.566 -15.072 1.00 0.00 C ATOM 210 C ILE A 19 -2.701 12.062 -15.120 1.00 0.00 C ATOM 211 O ILE A 19 -1.977 11.785 -16.075 1.00 0.00 O ATOM 212 CB ILE A 19 -4.273 10.061 -14.824 1.00 0.00 C ATOM 213 CG1 ILE A 19 -5.742 9.638 -14.757 1.00 0.00 C ATOM 214 CG2 ILE A 19 -3.499 9.644 -13.572 1.00 0.00 C ATOM 215 CD1 ILE A 19 -5.886 8.259 -14.110 1.00 0.00 C ATOM 0 H ILE A 19 -5.367 11.189 -16.734 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.621 12.048 -14.217 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.825 9.537 -15.668 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.310 10.373 -14.186 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -6.165 9.618 -15.761 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.606 8.570 -13.419 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -2.445 9.890 -13.697 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -3.895 10.175 -12.706 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.940 7.982 -14.075 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -5.337 7.523 -14.697 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.484 8.289 -13.097 1.00 0.00 H new ATOM 227 N LYS A 20 -2.323 12.787 -14.077 1.00 0.00 N ATOM 228 CA LYS A 20 -0.976 13.324 -13.988 1.00 0.00 C ATOM 229 C LYS A 20 0.018 12.290 -14.522 1.00 0.00 C ATOM 230 O LYS A 20 0.731 12.551 -15.490 1.00 0.00 O ATOM 231 CB LYS A 20 -0.676 13.785 -12.561 1.00 0.00 C ATOM 232 CG LYS A 20 -0.465 15.300 -12.506 1.00 0.00 C ATOM 233 CD LYS A 20 -0.192 15.764 -11.074 1.00 0.00 C ATOM 234 CE LYS A 20 1.235 16.298 -10.934 1.00 0.00 C ATOM 235 NZ LYS A 20 1.226 17.646 -10.323 1.00 0.00 N ATOM 0 H LYS A 20 -2.926 13.015 -13.287 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.879 14.212 -14.612 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -1.499 13.505 -11.904 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.214 13.277 -12.191 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.371 15.578 -13.148 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -1.348 15.808 -12.895 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.904 16.542 -10.798 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.343 14.934 -10.384 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.826 15.618 -10.320 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.712 16.339 -11.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 2.202 17.994 -10.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 0.680 18.296 -10.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.790 17.597 -9.380 1.00 0.00 H new ATOM 249 N PHE A 21 0.033 11.138 -13.868 1.00 0.00 N ATOM 250 CA PHE A 21 0.926 10.063 -14.264 1.00 0.00 C ATOM 251 C PHE A 21 0.308 9.220 -15.381 1.00 0.00 C ATOM 252 O PHE A 21 0.923 9.021 -16.427 1.00 0.00 O ATOM 253 CB PHE A 21 1.139 9.181 -13.033 1.00 0.00 C ATOM 254 CG PHE A 21 1.354 9.964 -11.736 1.00 0.00 C ATOM 255 CD1 PHE A 21 2.519 10.636 -11.532 1.00 0.00 C ATOM 256 CD2 PHE A 21 0.380 9.989 -10.787 1.00 0.00 C ATOM 257 CE1 PHE A 21 2.719 11.362 -10.328 1.00 0.00 C ATOM 258 CE2 PHE A 21 0.579 10.716 -9.584 1.00 0.00 C ATOM 259 CZ PHE A 21 1.744 11.387 -9.380 1.00 0.00 C ATOM 0 H PHE A 21 -0.560 10.926 -13.066 1.00 0.00 H new ATOM 0 HA PHE A 21 1.864 10.477 -14.635 1.00 0.00 H new ATOM 0 HB2 PHE A 21 0.274 8.528 -12.912 1.00 0.00 H new ATOM 0 HB3 PHE A 21 2.002 8.538 -13.204 1.00 0.00 H new ATOM 0 HD1 PHE A 21 3.292 10.617 -12.286 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -0.545 9.456 -10.949 1.00 0.00 H new ATOM 0 HE1 PHE A 21 3.645 11.894 -10.165 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -0.195 10.736 -8.831 1.00 0.00 H new ATOM 0 HZ PHE A 21 1.895 11.940 -8.465 1.00 0.00 H new ATOM 269 N GLN A 22 -0.902 8.746 -15.120 1.00 0.00 N ATOM 270 CA GLN A 22 -1.610 7.928 -16.090 1.00 0.00 C ATOM 271 C GLN A 22 -1.011 6.521 -16.136 1.00 0.00 C ATOM 272 O GLN A 22 -1.383 5.712 -16.985 1.00 0.00 O ATOM 273 CB GLN A 22 -1.590 8.579 -17.475 1.00 0.00 C ATOM 274 CG GLN A 22 -3.010 8.880 -17.960 1.00 0.00 C ATOM 275 CD GLN A 22 -3.077 8.888 -19.488 1.00 0.00 C ATOM 276 OE1 GLN A 22 -3.249 7.866 -20.133 1.00 0.00 O ATOM 277 NE2 GLN A 22 -2.931 10.093 -20.030 1.00 0.00 N ATOM 0 H GLN A 22 -1.410 8.913 -14.251 1.00 0.00 H new ATOM 0 HA GLN A 22 -2.651 7.848 -15.778 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -1.011 9.502 -17.439 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -1.092 7.918 -18.184 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -3.699 8.133 -17.566 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -3.333 9.846 -17.573 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -2.790 10.907 -19.432 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -2.960 10.203 -21.044 1.00 0.00 H new ATOM 286 N ASP A 23 -0.094 6.272 -15.213 1.00 0.00 N ATOM 287 CA ASP A 23 0.560 4.977 -15.138 1.00 0.00 C ATOM 288 C ASP A 23 0.726 4.579 -13.670 1.00 0.00 C ATOM 289 O ASP A 23 1.606 3.789 -13.333 1.00 0.00 O ATOM 290 CB ASP A 23 1.950 5.024 -15.775 1.00 0.00 C ATOM 291 CG ASP A 23 1.968 4.883 -17.298 1.00 0.00 C ATOM 292 OD1 ASP A 23 1.001 4.292 -17.825 1.00 0.00 O ATOM 293 OD2 ASP A 23 2.950 5.369 -17.901 1.00 0.00 O ATOM 0 H ASP A 23 0.212 6.945 -14.511 1.00 0.00 H new ATOM 0 HA ASP A 23 -0.058 4.256 -15.673 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.424 5.968 -15.507 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.558 4.228 -15.344 1.00 0.00 H new ATOM 298 N LEU A 24 -0.135 5.143 -12.836 1.00 0.00 N ATOM 299 CA LEU A 24 -0.095 4.857 -11.412 1.00 0.00 C ATOM 300 C LEU A 24 -1.512 4.565 -10.915 1.00 0.00 C ATOM 301 O LEU A 24 -2.444 5.313 -11.210 1.00 0.00 O ATOM 302 CB LEU A 24 0.600 5.991 -10.657 1.00 0.00 C ATOM 303 CG LEU A 24 1.609 5.566 -9.587 1.00 0.00 C ATOM 304 CD1 LEU A 24 3.020 5.474 -10.170 1.00 0.00 C ATOM 305 CD2 LEU A 24 1.548 6.498 -8.375 1.00 0.00 C ATOM 0 H LEU A 24 -0.865 5.797 -13.119 1.00 0.00 H new ATOM 0 HA LEU A 24 0.501 3.965 -11.219 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.114 6.622 -11.382 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.164 6.607 -10.183 1.00 0.00 H new ATOM 0 HG LEU A 24 1.339 4.569 -9.239 1.00 0.00 H new ATOM 0 HD11 LEU A 24 3.717 5.170 -9.389 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.034 4.739 -10.975 1.00 0.00 H new ATOM 0 HD13 LEU A 24 3.316 6.447 -10.562 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.275 6.174 -7.630 1.00 0.00 H new ATOM 0 HD22 LEU A 24 1.778 7.517 -8.687 1.00 0.00 H new ATOM 0 HD23 LEU A 24 0.548 6.468 -7.943 1.00 0.00 H new ATOM 317 N VAL A 25 -1.631 3.477 -10.168 1.00 0.00 N ATOM 318 CA VAL A 25 -2.919 3.077 -9.627 1.00 0.00 C ATOM 319 C VAL A 25 -2.745 2.653 -8.168 1.00 0.00 C ATOM 320 O VAL A 25 -2.312 1.536 -7.890 1.00 0.00 O ATOM 321 CB VAL A 25 -3.536 1.981 -10.499 1.00 0.00 C ATOM 322 CG1 VAL A 25 -4.940 1.619 -10.012 1.00 0.00 C ATOM 323 CG2 VAL A 25 -3.556 2.399 -11.971 1.00 0.00 C ATOM 0 H VAL A 25 -0.856 2.860 -9.925 1.00 0.00 H new ATOM 0 HA VAL A 25 -3.616 3.915 -9.641 1.00 0.00 H new ATOM 0 HB VAL A 25 -2.912 1.091 -10.412 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.356 0.838 -10.649 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -4.887 1.260 -8.984 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -5.579 2.501 -10.055 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -3.999 1.603 -12.569 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -4.146 3.309 -12.083 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -2.537 2.584 -12.311 1.00 0.00 H new ATOM 333 N VAL A 26 -3.091 3.567 -7.274 1.00 0.00 N ATOM 334 CA VAL A 26 -2.978 3.302 -5.850 1.00 0.00 C ATOM 335 C VAL A 26 -4.309 2.754 -5.330 1.00 0.00 C ATOM 336 O VAL A 26 -5.360 3.354 -5.552 1.00 0.00 O ATOM 337 CB VAL A 26 -2.524 4.565 -5.116 1.00 0.00 C ATOM 338 CG1 VAL A 26 -2.511 4.345 -3.602 1.00 0.00 C ATOM 339 CG2 VAL A 26 -1.154 5.026 -5.615 1.00 0.00 C ATOM 0 H VAL A 26 -3.450 4.493 -7.508 1.00 0.00 H new ATOM 0 HA VAL A 26 -2.218 2.543 -5.663 1.00 0.00 H new ATOM 0 HB VAL A 26 -3.243 5.355 -5.333 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -2.185 5.258 -3.104 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -3.514 4.086 -3.263 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -1.825 3.534 -3.358 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -0.855 5.925 -5.077 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -0.420 4.239 -5.442 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -1.209 5.243 -6.682 1.00 0.00 H new ATOM 349 N PHE A 27 -4.222 1.621 -4.649 1.00 0.00 N ATOM 350 CA PHE A 27 -5.406 0.987 -4.097 1.00 0.00 C ATOM 351 C PHE A 27 -5.268 0.789 -2.586 1.00 0.00 C ATOM 352 O PHE A 27 -4.460 -0.020 -2.133 1.00 0.00 O ATOM 353 CB PHE A 27 -5.534 -0.382 -4.768 1.00 0.00 C ATOM 354 CG PHE A 27 -6.622 -1.272 -4.164 1.00 0.00 C ATOM 355 CD1 PHE A 27 -7.904 -1.175 -4.607 1.00 0.00 C ATOM 356 CD2 PHE A 27 -6.307 -2.160 -3.183 1.00 0.00 C ATOM 357 CE1 PHE A 27 -8.914 -2.001 -4.046 1.00 0.00 C ATOM 358 CE2 PHE A 27 -7.316 -2.987 -2.622 1.00 0.00 C ATOM 359 CZ PHE A 27 -8.599 -2.890 -3.065 1.00 0.00 C ATOM 0 H PHE A 27 -3.349 1.126 -4.467 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.281 1.612 -4.277 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -5.744 -0.237 -5.828 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -4.577 -0.899 -4.700 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.154 -0.470 -5.386 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -5.289 -2.236 -2.831 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -9.932 -1.924 -4.398 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -7.065 -3.693 -1.844 1.00 0.00 H new ATOM 0 HZ PHE A 27 -9.367 -3.518 -2.638 1.00 0.00 H new ATOM 369 N ILE A 28 -6.070 1.543 -1.847 1.00 0.00 N ATOM 370 CA ILE A 28 -6.047 1.461 -0.397 1.00 0.00 C ATOM 371 C ILE A 28 -6.886 0.264 0.055 1.00 0.00 C ATOM 372 O ILE A 28 -7.963 0.016 -0.486 1.00 0.00 O ATOM 373 CB ILE A 28 -6.488 2.789 0.222 1.00 0.00 C ATOM 374 CG1 ILE A 28 -5.413 3.863 0.037 1.00 0.00 C ATOM 375 CG2 ILE A 28 -6.872 2.609 1.692 1.00 0.00 C ATOM 376 CD1 ILE A 28 -5.900 5.220 0.550 1.00 0.00 C ATOM 0 H ILE A 28 -6.739 2.213 -2.226 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.031 1.292 -0.041 1.00 0.00 H new ATOM 0 HB ILE A 28 -7.380 3.131 -0.303 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -4.508 3.572 0.570 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -5.150 3.942 -1.018 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -7.181 3.568 2.107 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -7.695 1.898 1.769 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -6.014 2.232 2.249 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -5.118 5.965 0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -6.791 5.519 -0.002 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -6.139 5.144 1.611 1.00 0.00 H new ATOM 388 N LEU A 29 -6.361 -0.447 1.043 1.00 0.00 N ATOM 389 CA LEU A 29 -7.048 -1.612 1.573 1.00 0.00 C ATOM 390 C LEU A 29 -7.821 -1.213 2.832 1.00 0.00 C ATOM 391 O LEU A 29 -7.225 -0.978 3.882 1.00 0.00 O ATOM 392 CB LEU A 29 -6.062 -2.761 1.795 1.00 0.00 C ATOM 393 CG LEU A 29 -6.650 -4.044 2.386 1.00 0.00 C ATOM 394 CD1 LEU A 29 -7.370 -4.862 1.313 1.00 0.00 C ATOM 395 CD2 LEU A 29 -5.572 -4.861 3.103 1.00 0.00 C ATOM 0 H LEU A 29 -5.468 -0.238 1.490 1.00 0.00 H new ATOM 0 HA LEU A 29 -7.778 -1.984 0.854 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.597 -3.004 0.840 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.269 -2.410 2.455 1.00 0.00 H new ATOM 0 HG LEU A 29 -7.394 -3.767 3.133 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -7.779 -5.769 1.760 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -8.180 -4.270 0.887 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.665 -5.131 0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -6.016 -5.768 3.514 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.788 -5.130 2.395 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -5.144 -4.268 3.911 1.00 0.00 H new ATOM 407 N GLU A 30 -9.137 -1.149 2.685 1.00 0.00 N ATOM 408 CA GLU A 30 -9.997 -0.783 3.797 1.00 0.00 C ATOM 409 C GLU A 30 -9.497 -1.430 5.090 1.00 0.00 C ATOM 410 O GLU A 30 -9.231 -0.738 6.072 1.00 0.00 O ATOM 411 CB GLU A 30 -11.450 -1.170 3.516 1.00 0.00 C ATOM 412 CG GLU A 30 -12.355 -0.793 4.691 1.00 0.00 C ATOM 413 CD GLU A 30 -13.500 -1.796 4.845 1.00 0.00 C ATOM 414 OE1 GLU A 30 -14.153 -2.074 3.816 1.00 0.00 O ATOM 415 OE2 GLU A 30 -13.697 -2.263 5.988 1.00 0.00 O ATOM 0 H GLU A 30 -9.628 -1.345 1.813 1.00 0.00 H new ATOM 0 HA GLU A 30 -9.961 0.300 3.918 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -11.795 -0.669 2.611 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -11.515 -2.242 3.331 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -11.769 -0.760 5.610 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -12.761 0.207 4.536 1.00 0.00 H new ATOM 422 N LYS A 31 -9.385 -2.749 5.049 1.00 0.00 N ATOM 423 CA LYS A 31 -8.922 -3.497 6.206 1.00 0.00 C ATOM 424 C LYS A 31 -7.796 -2.721 6.892 1.00 0.00 C ATOM 425 O LYS A 31 -6.869 -2.253 6.233 1.00 0.00 O ATOM 426 CB LYS A 31 -8.531 -4.920 5.802 1.00 0.00 C ATOM 427 CG LYS A 31 -9.722 -5.665 5.195 1.00 0.00 C ATOM 428 CD LYS A 31 -9.528 -5.878 3.693 1.00 0.00 C ATOM 429 CE LYS A 31 -10.785 -6.473 3.056 1.00 0.00 C ATOM 430 NZ LYS A 31 -11.427 -5.488 2.157 1.00 0.00 N ATOM 0 H LYS A 31 -9.607 -3.319 4.233 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.725 -3.606 6.935 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.714 -4.886 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.165 -5.462 6.674 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.843 -6.629 5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -10.637 -5.099 5.370 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -9.289 -4.928 3.215 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -8.681 -6.542 3.523 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -10.525 -7.371 2.495 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -11.486 -6.775 3.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -12.279 -5.908 1.733 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -11.692 -4.643 2.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.762 -5.220 1.404 1.00 0.00 H new ATOM 444 N LYS A 32 -7.913 -2.610 8.207 1.00 0.00 N ATOM 445 CA LYS A 32 -6.916 -1.899 8.989 1.00 0.00 C ATOM 446 C LYS A 32 -6.970 -0.409 8.644 1.00 0.00 C ATOM 447 O LYS A 32 -5.935 0.222 8.437 1.00 0.00 O ATOM 448 CB LYS A 32 -5.534 -2.525 8.793 1.00 0.00 C ATOM 449 CG LYS A 32 -5.456 -3.901 9.458 1.00 0.00 C ATOM 450 CD LYS A 32 -4.050 -4.170 9.998 1.00 0.00 C ATOM 451 CE LYS A 32 -3.908 -5.623 10.457 1.00 0.00 C ATOM 452 NZ LYS A 32 -3.361 -5.681 11.831 1.00 0.00 N ATOM 0 H LYS A 32 -8.683 -3.000 8.751 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.133 -1.989 10.053 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -5.321 -2.619 7.728 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -4.771 -1.870 9.214 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -6.179 -3.957 10.272 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.727 -4.673 8.738 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -3.312 -3.955 9.225 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.842 -3.499 10.832 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -4.879 -6.117 10.425 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -3.252 -6.164 9.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -3.271 -6.674 12.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.425 -5.227 11.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -4.002 -5.183 12.481 1.00 0.00 H new ATOM 466 N MET A 33 -8.188 0.110 8.593 1.00 0.00 N ATOM 467 CA MET A 33 -8.391 1.513 8.277 1.00 0.00 C ATOM 468 C MET A 33 -9.873 1.886 8.362 1.00 0.00 C ATOM 469 O MET A 33 -10.279 2.631 9.253 1.00 0.00 O ATOM 470 CB MET A 33 -7.873 1.799 6.866 1.00 0.00 C ATOM 471 CG MET A 33 -7.489 3.272 6.711 1.00 0.00 C ATOM 472 SD MET A 33 -5.718 3.426 6.545 1.00 0.00 S ATOM 473 CE MET A 33 -5.521 2.922 4.844 1.00 0.00 C ATOM 0 H MET A 33 -9.044 -0.417 8.765 1.00 0.00 H new ATOM 0 HA MET A 33 -7.843 2.112 9.004 1.00 0.00 H new ATOM 0 HB2 MET A 33 -7.007 1.170 6.658 1.00 0.00 H new ATOM 0 HB3 MET A 33 -8.638 1.540 6.134 1.00 0.00 H new ATOM 0 HG2 MET A 33 -7.983 3.695 5.836 1.00 0.00 H new ATOM 0 HG3 MET A 33 -7.832 3.839 7.576 1.00 0.00 H new ATOM 0 HE1 MET A 33 -4.460 2.823 4.614 1.00 0.00 H new ATOM 0 HE2 MET A 33 -6.017 1.964 4.689 1.00 0.00 H new ATOM 0 HE3 MET A 33 -5.966 3.671 4.189 1.00 0.00 H new ATOM 483 N GLY A 34 -10.640 1.351 7.424 1.00 0.00 N ATOM 484 CA GLY A 34 -12.067 1.618 7.382 1.00 0.00 C ATOM 485 C GLY A 34 -12.474 2.215 6.033 1.00 0.00 C ATOM 486 O GLY A 34 -11.740 2.100 5.052 1.00 0.00 O ATOM 0 H GLY A 34 -10.300 0.734 6.687 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -12.619 0.694 7.556 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -12.336 2.306 8.184 1.00 0.00 H new ATOM 490 N THR A 35 -13.642 2.841 6.027 1.00 0.00 N ATOM 491 CA THR A 35 -14.155 3.457 4.815 1.00 0.00 C ATOM 492 C THR A 35 -13.693 4.912 4.720 1.00 0.00 C ATOM 493 O THR A 35 -12.944 5.272 3.813 1.00 0.00 O ATOM 494 CB THR A 35 -15.677 3.301 4.813 1.00 0.00 C ATOM 495 OG1 THR A 35 -15.881 1.891 4.786 1.00 0.00 O ATOM 496 CG2 THR A 35 -16.314 3.795 3.512 1.00 0.00 C ATOM 0 H THR A 35 -14.248 2.935 6.842 1.00 0.00 H new ATOM 0 HA THR A 35 -13.763 2.966 3.925 1.00 0.00 H new ATOM 0 HB THR A 35 -16.100 3.849 5.655 1.00 0.00 H new ATOM 0 HG1 THR A 35 -16.842 1.699 4.785 1.00 0.00 H new ATOM 0 HG21 THR A 35 -17.395 3.662 3.563 1.00 0.00 H new ATOM 0 HG22 THR A 35 -16.085 4.851 3.373 1.00 0.00 H new ATOM 0 HG23 THR A 35 -15.917 3.224 2.673 1.00 0.00 H new ATOM 504 N THR A 36 -14.160 5.711 5.668 1.00 0.00 N ATOM 505 CA THR A 36 -13.804 7.119 5.703 1.00 0.00 C ATOM 506 C THR A 36 -12.344 7.311 5.288 1.00 0.00 C ATOM 507 O THR A 36 -12.064 7.835 4.211 1.00 0.00 O ATOM 508 CB THR A 36 -14.113 7.651 7.104 1.00 0.00 C ATOM 509 OG1 THR A 36 -15.503 7.388 7.276 1.00 0.00 O ATOM 510 CG2 THR A 36 -14.008 9.175 7.188 1.00 0.00 C ATOM 0 H THR A 36 -14.782 5.410 6.418 1.00 0.00 H new ATOM 0 HA THR A 36 -14.391 7.693 4.986 1.00 0.00 H new ATOM 0 HB THR A 36 -13.428 7.200 7.823 1.00 0.00 H new ATOM 0 HG1 THR A 36 -15.788 7.700 8.160 1.00 0.00 H new ATOM 0 HG21 THR A 36 -14.237 9.500 8.203 1.00 0.00 H new ATOM 0 HG22 THR A 36 -12.996 9.485 6.927 1.00 0.00 H new ATOM 0 HG23 THR A 36 -14.716 9.627 6.494 1.00 0.00 H new ATOM 518 N ARG A 37 -11.451 6.877 6.166 1.00 0.00 N ATOM 519 CA ARG A 37 -10.026 6.994 5.905 1.00 0.00 C ATOM 520 C ARG A 37 -9.693 6.433 4.521 1.00 0.00 C ATOM 521 O ARG A 37 -9.089 7.120 3.698 1.00 0.00 O ATOM 522 CB ARG A 37 -9.210 6.247 6.961 1.00 0.00 C ATOM 523 CG ARG A 37 -8.665 7.211 8.016 1.00 0.00 C ATOM 524 CD ARG A 37 -7.136 7.171 8.058 1.00 0.00 C ATOM 525 NE ARG A 37 -6.621 8.315 8.843 1.00 0.00 N ATOM 526 CZ ARG A 37 -5.420 8.340 9.436 1.00 0.00 C ATOM 527 NH1 ARG A 37 -4.602 7.283 9.337 1.00 0.00 N ATOM 528 NH2 ARG A 37 -5.036 9.421 10.128 1.00 0.00 N ATOM 0 H ARG A 37 -11.687 6.444 7.059 1.00 0.00 H new ATOM 0 HA ARG A 37 -9.767 8.052 5.944 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -9.833 5.492 7.440 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -8.384 5.721 6.482 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -9.000 8.225 7.795 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -9.066 6.949 8.995 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -6.801 6.234 8.503 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -6.735 7.205 7.045 1.00 0.00 H new ATOM 0 HE ARG A 37 -7.218 9.136 8.939 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -4.894 6.460 8.810 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -3.688 7.302 9.788 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -5.658 10.226 10.204 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -4.121 9.439 10.579 1.00 0.00 H new ATOM 542 N ARG A 38 -10.100 5.190 4.307 1.00 0.00 N ATOM 543 CA ARG A 38 -9.851 4.530 3.037 1.00 0.00 C ATOM 544 C ARG A 38 -10.217 5.456 1.876 1.00 0.00 C ATOM 545 O ARG A 38 -9.358 5.826 1.077 1.00 0.00 O ATOM 546 CB ARG A 38 -10.659 3.236 2.922 1.00 0.00 C ATOM 547 CG ARG A 38 -10.715 2.751 1.472 1.00 0.00 C ATOM 548 CD ARG A 38 -11.268 1.327 1.391 1.00 0.00 C ATOM 549 NE ARG A 38 -11.605 0.994 -0.011 1.00 0.00 N ATOM 550 CZ ARG A 38 -12.770 1.301 -0.598 1.00 0.00 C ATOM 551 NH1 ARG A 38 -13.717 1.950 0.093 1.00 0.00 N ATOM 552 NH2 ARG A 38 -12.988 0.959 -1.875 1.00 0.00 N ATOM 0 H ARG A 38 -10.600 4.623 4.992 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.789 4.288 2.992 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -10.210 2.466 3.550 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -11.670 3.401 3.293 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -11.341 3.422 0.884 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -9.717 2.783 1.035 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.532 0.620 1.775 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.155 1.236 2.018 1.00 0.00 H new ATOM 0 HE ARG A 38 -10.906 0.499 -0.566 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -13.551 2.210 1.065 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -14.604 2.184 -0.353 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -12.267 0.465 -2.401 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.875 1.193 -2.321 1.00 0.00 H new ATOM 566 N ALA A 39 -11.494 5.806 1.819 1.00 0.00 N ATOM 567 CA ALA A 39 -11.985 6.682 0.770 1.00 0.00 C ATOM 568 C ALA A 39 -11.217 8.005 0.816 1.00 0.00 C ATOM 569 O ALA A 39 -10.691 8.457 -0.200 1.00 0.00 O ATOM 570 CB ALA A 39 -13.493 6.878 0.931 1.00 0.00 C ATOM 0 H ALA A 39 -12.204 5.498 2.484 1.00 0.00 H new ATOM 0 HA ALA A 39 -11.818 6.237 -0.211 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -13.861 7.536 0.143 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -13.995 5.913 0.862 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -13.700 7.325 1.903 1.00 0.00 H new ATOM 576 N LEU A 40 -11.178 8.589 2.004 1.00 0.00 N ATOM 577 CA LEU A 40 -10.484 9.851 2.196 1.00 0.00 C ATOM 578 C LEU A 40 -9.113 9.782 1.520 1.00 0.00 C ATOM 579 O LEU A 40 -8.904 10.388 0.471 1.00 0.00 O ATOM 580 CB LEU A 40 -10.419 10.206 3.683 1.00 0.00 C ATOM 581 CG LEU A 40 -9.832 11.578 4.020 1.00 0.00 C ATOM 582 CD1 LEU A 40 -10.025 12.557 2.860 1.00 0.00 C ATOM 583 CD2 LEU A 40 -10.414 12.118 5.328 1.00 0.00 C ATOM 0 H LEU A 40 -11.616 8.211 2.844 1.00 0.00 H new ATOM 0 HA LEU A 40 -11.034 10.664 1.722 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -11.428 10.154 4.093 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -9.828 9.445 4.192 1.00 0.00 H new ATOM 0 HG LEU A 40 -8.758 11.462 4.169 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -9.599 13.524 3.126 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -9.525 12.172 1.972 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -11.089 12.673 2.655 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.980 13.094 5.544 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -11.495 12.215 5.232 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.182 11.430 6.141 1.00 0.00 H new ATOM 595 N LEU A 41 -8.216 9.037 2.149 1.00 0.00 N ATOM 596 CA LEU A 41 -6.871 8.881 1.621 1.00 0.00 C ATOM 597 C LEU A 41 -6.942 8.680 0.106 1.00 0.00 C ATOM 598 O LEU A 41 -6.255 9.367 -0.648 1.00 0.00 O ATOM 599 CB LEU A 41 -6.134 7.760 2.356 1.00 0.00 C ATOM 600 CG LEU A 41 -5.806 8.024 3.827 1.00 0.00 C ATOM 601 CD1 LEU A 41 -5.321 6.748 4.518 1.00 0.00 C ATOM 602 CD2 LEU A 41 -4.801 9.169 3.968 1.00 0.00 C ATOM 0 H LEU A 41 -8.394 8.535 3.019 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.286 9.784 1.796 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.738 6.855 2.296 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.203 7.557 1.827 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.721 8.335 4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -5.095 6.963 5.562 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -6.100 5.987 4.465 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -4.423 6.383 4.020 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.585 9.336 5.023 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -3.880 8.911 3.446 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -5.221 10.077 3.536 1.00 0.00 H new ATOM 614 N MET A 42 -7.781 7.735 -0.295 1.00 0.00 N ATOM 615 CA MET A 42 -7.951 7.436 -1.706 1.00 0.00 C ATOM 616 C MET A 42 -8.313 8.696 -2.495 1.00 0.00 C ATOM 617 O MET A 42 -7.838 8.891 -3.612 1.00 0.00 O ATOM 618 CB MET A 42 -9.056 6.391 -1.877 1.00 0.00 C ATOM 619 CG MET A 42 -8.536 4.986 -1.567 1.00 0.00 C ATOM 620 SD MET A 42 -9.904 3.883 -1.256 1.00 0.00 S ATOM 621 CE MET A 42 -11.121 4.580 -2.361 1.00 0.00 C ATOM 0 H MET A 42 -8.350 7.167 0.333 1.00 0.00 H new ATOM 0 HA MET A 42 -7.008 7.048 -2.092 1.00 0.00 H new ATOM 0 HB2 MET A 42 -9.890 6.628 -1.217 1.00 0.00 H new ATOM 0 HB3 MET A 42 -9.438 6.424 -2.897 1.00 0.00 H new ATOM 0 HG2 MET A 42 -7.943 4.616 -2.403 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.878 5.016 -0.699 1.00 0.00 H new ATOM 0 HE1 MET A 42 -12.062 4.040 -2.253 1.00 0.00 H new ATOM 0 HE2 MET A 42 -11.276 5.631 -2.116 1.00 0.00 H new ATOM 0 HE3 MET A 42 -10.770 4.495 -3.389 1.00 0.00 H new ATOM 631 N GLU A 43 -9.150 9.519 -1.881 1.00 0.00 N ATOM 632 CA GLU A 43 -9.581 10.755 -2.512 1.00 0.00 C ATOM 633 C GLU A 43 -8.451 11.786 -2.487 1.00 0.00 C ATOM 634 O GLU A 43 -8.292 12.561 -3.428 1.00 0.00 O ATOM 635 CB GLU A 43 -10.840 11.305 -1.838 1.00 0.00 C ATOM 636 CG GLU A 43 -10.911 12.827 -1.968 1.00 0.00 C ATOM 637 CD GLU A 43 -12.298 13.346 -1.583 1.00 0.00 C ATOM 638 OE1 GLU A 43 -12.565 13.403 -0.364 1.00 0.00 O ATOM 639 OE2 GLU A 43 -13.060 13.675 -2.518 1.00 0.00 O ATOM 0 H GLU A 43 -9.541 9.354 -0.953 1.00 0.00 H new ATOM 0 HA GLU A 43 -9.829 10.542 -3.552 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -11.724 10.856 -2.290 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -10.844 11.026 -0.784 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -10.157 13.286 -1.329 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -10.681 13.119 -2.993 1.00 0.00 H new ATOM 646 N LEU A 44 -7.695 11.761 -1.399 1.00 0.00 N ATOM 647 CA LEU A 44 -6.584 12.684 -1.238 1.00 0.00 C ATOM 648 C LEU A 44 -5.537 12.408 -2.319 1.00 0.00 C ATOM 649 O LEU A 44 -5.014 13.336 -2.933 1.00 0.00 O ATOM 650 CB LEU A 44 -6.031 12.614 0.186 1.00 0.00 C ATOM 651 CG LEU A 44 -6.992 13.034 1.301 1.00 0.00 C ATOM 652 CD1 LEU A 44 -6.251 13.786 2.408 1.00 0.00 C ATOM 653 CD2 LEU A 44 -8.161 13.845 0.739 1.00 0.00 C ATOM 0 H LEU A 44 -7.830 11.116 -0.620 1.00 0.00 H new ATOM 0 HA LEU A 44 -6.920 13.712 -1.374 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.707 11.591 0.379 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -5.144 13.245 0.241 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.411 12.133 1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.956 14.073 3.188 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -5.482 13.142 2.834 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.786 14.680 1.992 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -8.829 14.131 1.551 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -7.780 14.741 0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -8.708 13.241 0.015 1.00 0.00 H new ATOM 665 N ALA A 45 -5.263 11.127 -2.519 1.00 0.00 N ATOM 666 CA ALA A 45 -4.288 10.717 -3.515 1.00 0.00 C ATOM 667 C ALA A 45 -4.692 11.279 -4.879 1.00 0.00 C ATOM 668 O ALA A 45 -3.950 12.056 -5.479 1.00 0.00 O ATOM 669 CB ALA A 45 -4.177 9.191 -3.522 1.00 0.00 C ATOM 0 H ALA A 45 -5.699 10.360 -2.008 1.00 0.00 H new ATOM 0 HA ALA A 45 -3.302 11.114 -3.274 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.446 8.883 -4.269 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -3.859 8.845 -2.539 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -5.147 8.757 -3.763 1.00 0.00 H new ATOM 675 N ARG A 46 -5.867 10.864 -5.330 1.00 0.00 N ATOM 676 CA ARG A 46 -6.378 11.316 -6.613 1.00 0.00 C ATOM 677 C ARG A 46 -6.089 12.807 -6.804 1.00 0.00 C ATOM 678 O ARG A 46 -5.535 13.209 -7.826 1.00 0.00 O ATOM 679 CB ARG A 46 -7.886 11.079 -6.720 1.00 0.00 C ATOM 680 CG ARG A 46 -8.183 9.660 -7.210 1.00 0.00 C ATOM 681 CD ARG A 46 -9.690 9.431 -7.343 1.00 0.00 C ATOM 682 NE ARG A 46 -10.023 9.045 -8.732 1.00 0.00 N ATOM 683 CZ ARG A 46 -10.219 9.919 -9.729 1.00 0.00 C ATOM 684 NH1 ARG A 46 -10.118 11.235 -9.495 1.00 0.00 N ATOM 685 NH2 ARG A 46 -10.517 9.477 -10.958 1.00 0.00 N ATOM 0 H ARG A 46 -6.480 10.220 -4.830 1.00 0.00 H new ATOM 0 HA ARG A 46 -5.875 10.742 -7.391 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -8.353 11.237 -5.748 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -8.324 11.804 -7.406 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -7.700 9.495 -8.173 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -7.761 8.935 -6.514 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -10.010 8.650 -6.653 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -10.229 10.338 -7.070 1.00 0.00 H new ATOM 0 HE ARG A 46 -10.109 8.051 -8.944 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -9.892 11.571 -8.559 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -10.267 11.901 -10.253 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -10.595 8.475 -11.135 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -10.666 10.142 -11.717 1.00 0.00 H new ATOM 699 N ARG A 47 -6.477 13.585 -5.804 1.00 0.00 N ATOM 700 CA ARG A 47 -6.267 15.022 -5.849 1.00 0.00 C ATOM 701 C ARG A 47 -4.823 15.335 -6.249 1.00 0.00 C ATOM 702 O ARG A 47 -4.574 16.264 -7.015 1.00 0.00 O ATOM 703 CB ARG A 47 -6.564 15.665 -4.493 1.00 0.00 C ATOM 704 CG ARG A 47 -8.069 15.687 -4.216 1.00 0.00 C ATOM 705 CD ARG A 47 -8.357 16.188 -2.799 1.00 0.00 C ATOM 706 NE ARG A 47 -9.181 17.416 -2.854 1.00 0.00 N ATOM 707 CZ ARG A 47 -9.318 18.275 -1.834 1.00 0.00 C ATOM 708 NH1 ARG A 47 -8.687 18.045 -0.675 1.00 0.00 N ATOM 709 NH2 ARG A 47 -10.086 19.364 -1.974 1.00 0.00 N ATOM 0 H ARG A 47 -6.936 13.247 -4.958 1.00 0.00 H new ATOM 0 HA ARG A 47 -6.951 15.434 -6.591 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -6.053 15.112 -3.704 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -6.172 16.682 -4.475 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -8.567 16.330 -4.942 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -8.481 14.686 -4.343 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -8.877 15.417 -2.230 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -7.421 16.391 -2.279 1.00 0.00 H new ATOM 0 HE ARG A 47 -9.676 17.622 -3.722 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.102 17.216 -0.568 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.791 18.699 0.101 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -10.566 19.539 -2.857 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -10.190 20.018 -1.198 1.00 0.00 H new ATOM 723 N LYS A 48 -3.909 14.540 -5.711 1.00 0.00 N ATOM 724 CA LYS A 48 -2.497 14.721 -6.001 1.00 0.00 C ATOM 725 C LYS A 48 -2.229 14.349 -7.461 1.00 0.00 C ATOM 726 O LYS A 48 -1.303 14.872 -8.079 1.00 0.00 O ATOM 727 CB LYS A 48 -1.640 13.941 -5.002 1.00 0.00 C ATOM 728 CG LYS A 48 -1.929 14.388 -3.567 1.00 0.00 C ATOM 729 CD LYS A 48 -1.355 15.781 -3.300 1.00 0.00 C ATOM 730 CE LYS A 48 -1.833 16.321 -1.951 1.00 0.00 C ATOM 731 NZ LYS A 48 -2.258 17.733 -2.079 1.00 0.00 N ATOM 0 H LYS A 48 -4.119 13.770 -5.076 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.215 15.767 -5.880 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.839 12.874 -5.102 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -0.584 14.091 -5.228 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.005 14.395 -3.394 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -1.498 13.673 -2.866 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -0.266 15.738 -3.313 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.657 16.462 -4.096 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.663 15.717 -1.584 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.032 16.241 -1.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.579 18.084 -1.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -1.457 18.308 -2.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.037 17.800 -2.765 1.00 0.00 H new ATOM 745 N GLY A 49 -3.057 13.449 -7.971 1.00 0.00 N ATOM 746 CA GLY A 49 -2.921 13.001 -9.346 1.00 0.00 C ATOM 747 C GLY A 49 -2.618 11.503 -9.408 1.00 0.00 C ATOM 748 O GLY A 49 -1.889 11.049 -10.289 1.00 0.00 O ATOM 0 H GLY A 49 -3.825 13.018 -7.456 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -3.839 13.213 -9.894 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -2.122 13.558 -9.836 1.00 0.00 H new ATOM 752 N PHE A 50 -3.192 10.776 -8.461 1.00 0.00 N ATOM 753 CA PHE A 50 -2.992 9.338 -8.396 1.00 0.00 C ATOM 754 C PHE A 50 -4.300 8.590 -8.661 1.00 0.00 C ATOM 755 O PHE A 50 -5.232 8.659 -7.861 1.00 0.00 O ATOM 756 CB PHE A 50 -2.512 9.016 -6.979 1.00 0.00 C ATOM 757 CG PHE A 50 -1.096 9.509 -6.674 1.00 0.00 C ATOM 758 CD1 PHE A 50 -0.031 8.956 -7.314 1.00 0.00 C ATOM 759 CD2 PHE A 50 -0.903 10.501 -5.764 1.00 0.00 C ATOM 760 CE1 PHE A 50 1.283 9.413 -7.030 1.00 0.00 C ATOM 761 CE2 PHE A 50 0.411 10.958 -5.481 1.00 0.00 C ATOM 762 CZ PHE A 50 1.476 10.405 -6.120 1.00 0.00 C ATOM 0 H PHE A 50 -3.796 11.156 -7.732 1.00 0.00 H new ATOM 0 HA PHE A 50 -2.269 9.029 -9.150 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -3.203 9.461 -6.263 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -2.550 7.937 -6.830 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -0.185 8.170 -8.038 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.749 10.941 -5.257 1.00 0.00 H new ATOM 0 HE1 PHE A 50 2.129 8.973 -7.537 1.00 0.00 H new ATOM 0 HE2 PHE A 50 0.565 11.745 -4.758 1.00 0.00 H new ATOM 0 HZ PHE A 50 2.475 10.754 -5.905 1.00 0.00 H new ATOM 772 N ARG A 51 -4.327 7.893 -9.788 1.00 0.00 N ATOM 773 CA ARG A 51 -5.506 7.133 -10.169 1.00 0.00 C ATOM 774 C ARG A 51 -5.828 6.083 -9.103 1.00 0.00 C ATOM 775 O ARG A 51 -5.388 4.939 -9.200 1.00 0.00 O ATOM 776 CB ARG A 51 -5.300 6.436 -11.515 1.00 0.00 C ATOM 777 CG ARG A 51 -6.615 5.851 -12.036 1.00 0.00 C ATOM 778 CD ARG A 51 -6.357 4.813 -13.131 1.00 0.00 C ATOM 779 NE ARG A 51 -7.170 5.128 -14.327 1.00 0.00 N ATOM 780 CZ ARG A 51 -7.348 4.288 -15.356 1.00 0.00 C ATOM 781 NH1 ARG A 51 -6.772 3.078 -15.341 1.00 0.00 N ATOM 782 NH2 ARG A 51 -8.102 4.658 -16.400 1.00 0.00 N ATOM 0 H ARG A 51 -3.552 7.839 -10.449 1.00 0.00 H new ATOM 0 HA ARG A 51 -6.337 7.832 -10.258 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -4.901 7.146 -12.239 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -4.561 5.642 -11.408 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -7.163 5.390 -11.214 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -7.243 6.651 -12.429 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -5.299 4.803 -13.392 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -6.604 3.817 -12.765 1.00 0.00 H new ATOM 0 HE ARG A 51 -7.623 6.041 -14.371 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -6.198 2.796 -14.546 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -6.908 2.439 -16.124 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -8.540 5.579 -16.412 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -8.238 4.019 -17.183 1.00 0.00 H new ATOM 796 N VAL A 52 -6.594 6.511 -8.109 1.00 0.00 N ATOM 797 CA VAL A 52 -6.980 5.622 -7.026 1.00 0.00 C ATOM 798 C VAL A 52 -8.226 4.836 -7.437 1.00 0.00 C ATOM 799 O VAL A 52 -9.070 5.344 -8.175 1.00 0.00 O ATOM 800 CB VAL A 52 -7.175 6.423 -5.737 1.00 0.00 C ATOM 801 CG1 VAL A 52 -7.492 5.498 -4.560 1.00 0.00 C ATOM 802 CG2 VAL A 52 -5.951 7.290 -5.439 1.00 0.00 C ATOM 0 H VAL A 52 -6.957 7.461 -8.031 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.191 4.897 -6.826 1.00 0.00 H new ATOM 0 HB VAL A 52 -8.028 7.087 -5.881 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -7.626 6.092 -3.656 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -8.407 4.944 -4.769 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -6.669 4.798 -4.415 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -6.116 7.849 -4.518 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -5.073 6.654 -5.325 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -5.790 7.987 -6.262 1.00 0.00 H new ATOM 812 N GLU A 53 -8.304 3.610 -6.942 1.00 0.00 N ATOM 813 CA GLU A 53 -9.433 2.749 -7.248 1.00 0.00 C ATOM 814 C GLU A 53 -10.128 2.305 -5.959 1.00 0.00 C ATOM 815 O GLU A 53 -9.496 2.222 -4.907 1.00 0.00 O ATOM 816 CB GLU A 53 -8.993 1.541 -8.077 1.00 0.00 C ATOM 817 CG GLU A 53 -8.417 1.981 -9.425 1.00 0.00 C ATOM 818 CD GLU A 53 -9.528 2.173 -10.459 1.00 0.00 C ATOM 819 OE1 GLU A 53 -10.505 2.875 -10.119 1.00 0.00 O ATOM 820 OE2 GLU A 53 -9.375 1.615 -11.567 1.00 0.00 O ATOM 0 H GLU A 53 -7.603 3.192 -6.330 1.00 0.00 H new ATOM 0 HA GLU A 53 -10.146 3.318 -7.845 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -8.245 0.971 -7.526 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -9.843 0.878 -8.240 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -7.865 2.913 -9.302 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -7.707 1.235 -9.782 1.00 0.00 H new ATOM 827 N ASN A 54 -11.418 2.033 -6.083 1.00 0.00 N ATOM 828 CA ASN A 54 -12.205 1.600 -4.941 1.00 0.00 C ATOM 829 C ASN A 54 -12.109 0.079 -4.807 1.00 0.00 C ATOM 830 O ASN A 54 -12.014 -0.445 -3.699 1.00 0.00 O ATOM 831 CB ASN A 54 -13.680 1.966 -5.118 1.00 0.00 C ATOM 832 CG ASN A 54 -14.141 2.932 -4.024 1.00 0.00 C ATOM 833 OD1 ASN A 54 -14.881 2.580 -3.121 1.00 0.00 O ATOM 834 ND2 ASN A 54 -13.662 4.166 -4.156 1.00 0.00 N ATOM 0 H ASN A 54 -11.939 2.104 -6.957 1.00 0.00 H new ATOM 0 HA ASN A 54 -11.813 2.098 -4.054 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -13.830 2.421 -6.097 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -14.288 1.062 -5.090 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -13.910 4.885 -3.476 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -13.046 4.393 -4.937 1.00 0.00 H new ATOM 841 N GLU A 55 -12.136 -0.587 -5.953 1.00 0.00 N ATOM 842 CA GLU A 55 -12.052 -2.037 -5.977 1.00 0.00 C ATOM 843 C GLU A 55 -10.719 -2.482 -6.582 1.00 0.00 C ATOM 844 O GLU A 55 -10.196 -1.832 -7.487 1.00 0.00 O ATOM 845 CB GLU A 55 -13.231 -2.641 -6.743 1.00 0.00 C ATOM 846 CG GLU A 55 -14.557 -2.321 -6.050 1.00 0.00 C ATOM 847 CD GLU A 55 -15.667 -3.257 -6.532 1.00 0.00 C ATOM 848 OE1 GLU A 55 -15.674 -3.551 -7.747 1.00 0.00 O ATOM 849 OE2 GLU A 55 -16.483 -3.657 -5.674 1.00 0.00 O ATOM 0 H GLU A 55 -12.215 -0.149 -6.871 1.00 0.00 H new ATOM 0 HA GLU A 55 -12.102 -2.402 -4.951 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -13.245 -2.252 -7.761 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -13.106 -3.721 -6.816 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -14.440 -2.416 -4.971 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -14.836 -1.287 -6.251 1.00 0.00 H new ATOM 856 N LEU A 56 -10.207 -3.586 -6.060 1.00 0.00 N ATOM 857 CA LEU A 56 -8.945 -4.125 -6.537 1.00 0.00 C ATOM 858 C LEU A 56 -9.105 -4.573 -7.992 1.00 0.00 C ATOM 859 O LEU A 56 -9.960 -5.401 -8.300 1.00 0.00 O ATOM 860 CB LEU A 56 -8.448 -5.231 -5.604 1.00 0.00 C ATOM 861 CG LEU A 56 -7.061 -5.797 -5.915 1.00 0.00 C ATOM 862 CD1 LEU A 56 -7.090 -7.326 -5.966 1.00 0.00 C ATOM 863 CD2 LEU A 56 -6.496 -5.191 -7.201 1.00 0.00 C ATOM 0 H LEU A 56 -10.644 -4.123 -5.311 1.00 0.00 H new ATOM 0 HA LEU A 56 -8.172 -3.357 -6.522 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -8.441 -4.844 -4.585 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -9.167 -6.050 -5.628 1.00 0.00 H new ATOM 0 HG LEU A 56 -6.389 -5.515 -5.104 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -6.091 -7.702 -6.189 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -7.418 -7.716 -5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -7.782 -7.651 -6.743 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -5.510 -5.611 -7.398 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -7.161 -5.420 -8.034 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -6.414 -4.110 -7.088 1.00 0.00 H new ATOM 875 N SER A 57 -8.268 -4.004 -8.847 1.00 0.00 N ATOM 876 CA SER A 57 -8.305 -4.334 -10.262 1.00 0.00 C ATOM 877 C SER A 57 -6.905 -4.715 -10.747 1.00 0.00 C ATOM 878 O SER A 57 -5.954 -4.721 -9.967 1.00 0.00 O ATOM 879 CB SER A 57 -8.852 -3.166 -11.085 1.00 0.00 C ATOM 880 OG SER A 57 -10.199 -2.855 -10.741 1.00 0.00 O ATOM 0 H SER A 57 -7.560 -3.317 -8.587 1.00 0.00 H new ATOM 0 HA SER A 57 -8.974 -5.184 -10.398 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.226 -2.288 -10.928 1.00 0.00 H new ATOM 0 HB3 SER A 57 -8.796 -3.412 -12.145 1.00 0.00 H new ATOM 0 HG SER A 57 -10.511 -2.103 -11.287 1.00 0.00 H new ATOM 886 N ASP A 58 -6.823 -5.025 -12.033 1.00 0.00 N ATOM 887 CA ASP A 58 -5.555 -5.407 -12.631 1.00 0.00 C ATOM 888 C ASP A 58 -4.698 -4.157 -12.840 1.00 0.00 C ATOM 889 O ASP A 58 -3.472 -4.222 -12.767 1.00 0.00 O ATOM 890 CB ASP A 58 -5.767 -6.069 -13.994 1.00 0.00 C ATOM 891 CG ASP A 58 -4.605 -5.911 -14.977 1.00 0.00 C ATOM 892 OD1 ASP A 58 -3.452 -5.892 -14.494 1.00 0.00 O ATOM 893 OD2 ASP A 58 -4.895 -5.814 -16.189 1.00 0.00 O ATOM 0 H ASP A 58 -7.614 -5.019 -12.677 1.00 0.00 H new ATOM 0 HA ASP A 58 -5.064 -6.112 -11.960 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -5.951 -7.132 -13.840 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -6.666 -5.652 -14.448 1.00 0.00 H new ATOM 898 N SER A 59 -5.377 -3.049 -13.096 1.00 0.00 N ATOM 899 CA SER A 59 -4.693 -1.786 -13.316 1.00 0.00 C ATOM 900 C SER A 59 -3.959 -1.359 -12.043 1.00 0.00 C ATOM 901 O SER A 59 -3.062 -0.519 -12.091 1.00 0.00 O ATOM 902 CB SER A 59 -5.674 -0.696 -13.753 1.00 0.00 C ATOM 903 OG SER A 59 -5.608 -0.449 -15.154 1.00 0.00 O ATOM 0 H SER A 59 -6.394 -2.999 -13.156 1.00 0.00 H new ATOM 0 HA SER A 59 -3.967 -1.926 -14.117 1.00 0.00 H new ATOM 0 HB2 SER A 59 -6.688 -0.992 -13.485 1.00 0.00 H new ATOM 0 HB3 SER A 59 -5.457 0.225 -13.212 1.00 0.00 H new ATOM 0 HG SER A 59 -6.250 0.252 -15.393 1.00 0.00 H new ATOM 909 N VAL A 60 -4.367 -1.958 -10.934 1.00 0.00 N ATOM 910 CA VAL A 60 -3.760 -1.651 -9.650 1.00 0.00 C ATOM 911 C VAL A 60 -2.286 -2.061 -9.677 1.00 0.00 C ATOM 912 O VAL A 60 -1.969 -3.247 -9.755 1.00 0.00 O ATOM 913 CB VAL A 60 -4.547 -2.324 -8.524 1.00 0.00 C ATOM 914 CG1 VAL A 60 -3.771 -2.274 -7.206 1.00 0.00 C ATOM 915 CG2 VAL A 60 -5.932 -1.693 -8.369 1.00 0.00 C ATOM 0 H VAL A 60 -5.111 -2.655 -10.898 1.00 0.00 H new ATOM 0 HA VAL A 60 -3.796 -0.579 -9.457 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.685 -3.372 -8.792 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -4.353 -2.759 -6.422 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -2.819 -2.792 -7.324 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -3.587 -1.235 -6.931 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -6.470 -2.190 -7.562 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -5.825 -0.634 -8.135 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.489 -1.805 -9.299 1.00 0.00 H new ATOM 925 N THR A 61 -1.424 -1.057 -9.611 1.00 0.00 N ATOM 926 CA THR A 61 0.009 -1.298 -9.627 1.00 0.00 C ATOM 927 C THR A 61 0.605 -1.060 -8.238 1.00 0.00 C ATOM 928 O THR A 61 1.719 -1.497 -7.954 1.00 0.00 O ATOM 929 CB THR A 61 0.625 -0.413 -10.713 1.00 0.00 C ATOM 930 OG1 THR A 61 0.152 0.895 -10.404 1.00 0.00 O ATOM 931 CG2 THR A 61 0.047 -0.701 -12.100 1.00 0.00 C ATOM 0 H THR A 61 -1.690 -0.075 -9.546 1.00 0.00 H new ATOM 0 HA THR A 61 0.233 -2.337 -9.869 1.00 0.00 H new ATOM 0 HB THR A 61 1.705 -0.560 -10.732 1.00 0.00 H new ATOM 0 HG1 THR A 61 0.358 1.105 -9.469 1.00 0.00 H new ATOM 0 HG21 THR A 61 0.518 -0.046 -12.833 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.239 -1.741 -12.365 1.00 0.00 H new ATOM 0 HG23 THR A 61 -1.028 -0.521 -12.091 1.00 0.00 H new ATOM 939 N HIS A 62 -0.163 -0.367 -7.410 1.00 0.00 N ATOM 940 CA HIS A 62 0.275 -0.065 -6.058 1.00 0.00 C ATOM 941 C HIS A 62 -0.897 -0.232 -5.090 1.00 0.00 C ATOM 942 O HIS A 62 -1.918 0.442 -5.223 1.00 0.00 O ATOM 943 CB HIS A 62 0.908 1.327 -5.990 1.00 0.00 C ATOM 944 CG HIS A 62 1.806 1.651 -7.160 1.00 0.00 C ATOM 945 ND1 HIS A 62 1.352 2.296 -8.297 1.00 0.00 N ATOM 946 CD2 HIS A 62 3.135 1.414 -7.356 1.00 0.00 C ATOM 947 CE1 HIS A 62 2.370 2.435 -9.134 1.00 0.00 C ATOM 948 NE2 HIS A 62 3.474 1.887 -8.549 1.00 0.00 N ATOM 0 H HIS A 62 -1.086 -0.006 -7.650 1.00 0.00 H new ATOM 0 HA HIS A 62 1.052 -0.768 -5.758 1.00 0.00 H new ATOM 0 HB2 HIS A 62 0.115 2.073 -5.936 1.00 0.00 H new ATOM 0 HB3 HIS A 62 1.485 1.408 -5.069 1.00 0.00 H new ATOM 0 HD2 HIS A 62 3.799 0.925 -6.659 1.00 0.00 H new ATOM 0 HE1 HIS A 62 2.332 2.900 -10.108 1.00 0.00 H new ATOM 0 HE2 HIS A 62 4.406 1.847 -8.961 1.00 0.00 H new ATOM 956 N ILE A 63 -0.712 -1.133 -4.136 1.00 0.00 N ATOM 957 CA ILE A 63 -1.741 -1.397 -3.145 1.00 0.00 C ATOM 958 C ILE A 63 -1.282 -0.867 -1.786 1.00 0.00 C ATOM 959 O ILE A 63 -0.231 -1.264 -1.283 1.00 0.00 O ATOM 960 CB ILE A 63 -2.107 -2.882 -3.135 1.00 0.00 C ATOM 961 CG1 ILE A 63 -2.986 -3.239 -4.336 1.00 0.00 C ATOM 962 CG2 ILE A 63 -2.760 -3.277 -1.809 1.00 0.00 C ATOM 963 CD1 ILE A 63 -3.182 -4.753 -4.441 1.00 0.00 C ATOM 0 H ILE A 63 0.136 -1.690 -4.029 1.00 0.00 H new ATOM 0 HA ILE A 63 -2.660 -0.868 -3.400 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.188 -3.461 -3.226 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -3.955 -2.749 -4.241 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.528 -2.864 -5.251 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.010 -4.338 -1.828 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -2.067 -3.083 -0.990 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -3.668 -2.693 -1.662 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.810 -4.980 -5.302 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.213 -5.238 -4.561 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -3.663 -5.121 -3.535 1.00 0.00 H new ATOM 975 N VAL A 64 -2.091 0.022 -1.228 1.00 0.00 N ATOM 976 CA VAL A 64 -1.780 0.610 0.064 1.00 0.00 C ATOM 977 C VAL A 64 -2.474 -0.194 1.165 1.00 0.00 C ATOM 978 O VAL A 64 -3.598 -0.660 0.985 1.00 0.00 O ATOM 979 CB VAL A 64 -2.167 2.090 0.071 1.00 0.00 C ATOM 980 CG1 VAL A 64 -1.729 2.765 1.373 1.00 0.00 C ATOM 981 CG2 VAL A 64 -1.586 2.815 -1.145 1.00 0.00 C ATOM 0 H VAL A 64 -2.961 0.349 -1.647 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.708 0.567 0.256 1.00 0.00 H new ATOM 0 HB VAL A 64 -3.254 2.152 0.010 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -2.016 3.816 1.352 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.212 2.274 2.218 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.647 2.686 1.477 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.876 3.865 -1.115 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.499 2.738 -1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -1.969 2.358 -2.058 1.00 0.00 H new ATOM 991 N ALA A 65 -1.774 -0.334 2.282 1.00 0.00 N ATOM 992 CA ALA A 65 -2.308 -1.074 3.412 1.00 0.00 C ATOM 993 C ALA A 65 -1.580 -0.644 4.687 1.00 0.00 C ATOM 994 O ALA A 65 -0.357 -0.516 4.695 1.00 0.00 O ATOM 995 CB ALA A 65 -2.180 -2.575 3.146 1.00 0.00 C ATOM 0 H ALA A 65 -0.842 0.053 2.428 1.00 0.00 H new ATOM 0 HA ALA A 65 -3.367 -0.856 3.547 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -2.581 -3.130 3.994 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -2.738 -2.834 2.246 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.130 -2.832 3.008 1.00 0.00 H new ATOM 1001 N GLU A 66 -2.363 -0.433 5.735 1.00 0.00 N ATOM 1002 CA GLU A 66 -1.809 -0.020 7.013 1.00 0.00 C ATOM 1003 C GLU A 66 -1.661 -1.226 7.942 1.00 0.00 C ATOM 1004 O GLU A 66 -2.564 -2.056 8.036 1.00 0.00 O ATOM 1005 CB GLU A 66 -2.670 1.068 7.659 1.00 0.00 C ATOM 1006 CG GLU A 66 -1.903 1.785 8.771 1.00 0.00 C ATOM 1007 CD GLU A 66 -2.830 2.701 9.573 1.00 0.00 C ATOM 1008 OE1 GLU A 66 -3.597 2.155 10.394 1.00 0.00 O ATOM 1009 OE2 GLU A 66 -2.750 3.928 9.346 1.00 0.00 O ATOM 0 H GLU A 66 -3.377 -0.540 5.725 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.820 0.403 6.838 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -2.979 1.789 6.902 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -3.578 0.624 8.067 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -1.447 1.051 9.435 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -1.092 2.371 8.339 1.00 0.00 H new ATOM 1016 N ASN A 67 -0.515 -1.286 8.605 1.00 0.00 N ATOM 1017 CA ASN A 67 -0.238 -2.377 9.523 1.00 0.00 C ATOM 1018 C ASN A 67 -0.024 -3.666 8.727 1.00 0.00 C ATOM 1019 O ASN A 67 1.043 -4.275 8.801 1.00 0.00 O ATOM 1020 CB ASN A 67 -1.409 -2.602 10.481 1.00 0.00 C ATOM 1021 CG ASN A 67 -1.006 -2.289 11.924 1.00 0.00 C ATOM 1022 OD1 ASN A 67 -0.054 -2.831 12.461 1.00 0.00 O ATOM 1023 ND2 ASN A 67 -1.781 -1.387 12.518 1.00 0.00 N ATOM 0 H ASN A 67 0.232 -0.596 8.524 1.00 0.00 H new ATOM 0 HA ASN A 67 0.652 -2.117 10.096 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -2.248 -1.971 10.189 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -1.748 -3.636 10.410 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -1.594 -1.110 13.482 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -2.562 -0.972 12.010 1.00 0.00 H new ATOM 1030 N ASN A 68 -1.054 -4.043 7.985 1.00 0.00 N ATOM 1031 CA ASN A 68 -0.992 -5.249 7.176 1.00 0.00 C ATOM 1032 C ASN A 68 0.347 -5.294 6.438 1.00 0.00 C ATOM 1033 O ASN A 68 0.791 -4.287 5.887 1.00 0.00 O ATOM 1034 CB ASN A 68 -2.109 -5.269 6.131 1.00 0.00 C ATOM 1035 CG ASN A 68 -3.484 -5.323 6.799 1.00 0.00 C ATOM 1036 OD1 ASN A 68 -3.769 -6.176 7.623 1.00 0.00 O ATOM 1037 ND2 ASN A 68 -4.318 -4.367 6.399 1.00 0.00 N ATOM 0 H ASN A 68 -1.937 -3.535 7.927 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.104 -6.107 7.839 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -2.040 -4.381 5.503 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -1.984 -6.132 5.477 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -5.260 -4.317 6.786 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.015 -3.684 5.705 1.00 0.00 H new ATOM 1044 N SER A 69 0.954 -6.472 6.450 1.00 0.00 N ATOM 1045 CA SER A 69 2.234 -6.661 5.788 1.00 0.00 C ATOM 1046 C SER A 69 2.017 -7.205 4.375 1.00 0.00 C ATOM 1047 O SER A 69 0.976 -7.795 4.086 1.00 0.00 O ATOM 1048 CB SER A 69 3.133 -7.605 6.588 1.00 0.00 C ATOM 1049 OG SER A 69 3.463 -7.072 7.867 1.00 0.00 O ATOM 0 H SER A 69 0.583 -7.305 6.908 1.00 0.00 H new ATOM 0 HA SER A 69 2.733 -5.694 5.725 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.631 -8.564 6.714 1.00 0.00 H new ATOM 0 HB3 SER A 69 4.048 -7.796 6.028 1.00 0.00 H new ATOM 0 HG SER A 69 4.037 -7.705 8.347 1.00 0.00 H new ATOM 1055 N GLY A 70 3.015 -6.989 3.531 1.00 0.00 N ATOM 1056 CA GLY A 70 2.946 -7.450 2.155 1.00 0.00 C ATOM 1057 C GLY A 70 2.249 -8.809 2.067 1.00 0.00 C ATOM 1058 O GLY A 70 1.398 -9.019 1.204 1.00 0.00 O ATOM 0 H GLY A 70 3.877 -6.500 3.774 1.00 0.00 H new ATOM 0 HA2 GLY A 70 2.407 -6.721 1.550 1.00 0.00 H new ATOM 0 HA3 GLY A 70 3.952 -7.526 1.742 1.00 0.00 H new ATOM 1062 N SER A 71 2.636 -9.697 2.971 1.00 0.00 N ATOM 1063 CA SER A 71 2.058 -11.030 3.007 1.00 0.00 C ATOM 1064 C SER A 71 0.552 -10.941 3.259 1.00 0.00 C ATOM 1065 O SER A 71 -0.244 -11.463 2.479 1.00 0.00 O ATOM 1066 CB SER A 71 2.726 -11.891 4.080 1.00 0.00 C ATOM 1067 OG SER A 71 2.590 -11.325 5.381 1.00 0.00 O ATOM 0 H SER A 71 3.343 -9.520 3.684 1.00 0.00 H new ATOM 0 HA SER A 71 2.230 -11.504 2.041 1.00 0.00 H new ATOM 0 HB2 SER A 71 2.285 -12.888 4.071 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.784 -12.008 3.844 1.00 0.00 H new ATOM 0 HG SER A 71 3.028 -11.906 6.038 1.00 0.00 H new ATOM 1073 N ASP A 72 0.205 -10.276 4.351 1.00 0.00 N ATOM 1074 CA ASP A 72 -1.191 -10.112 4.716 1.00 0.00 C ATOM 1075 C ASP A 72 -1.988 -9.675 3.485 1.00 0.00 C ATOM 1076 O ASP A 72 -3.008 -10.278 3.155 1.00 0.00 O ATOM 1077 CB ASP A 72 -1.357 -9.037 5.793 1.00 0.00 C ATOM 1078 CG ASP A 72 -0.909 -9.452 7.195 1.00 0.00 C ATOM 1079 OD1 ASP A 72 -1.398 -10.506 7.659 1.00 0.00 O ATOM 1080 OD2 ASP A 72 -0.088 -8.707 7.773 1.00 0.00 O ATOM 0 H ASP A 72 0.868 -9.844 4.995 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.553 -11.066 5.100 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -0.792 -8.154 5.494 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.406 -8.745 5.835 1.00 0.00 H new ATOM 1085 N VAL A 73 -1.491 -8.630 2.839 1.00 0.00 N ATOM 1086 CA VAL A 73 -2.144 -8.105 1.652 1.00 0.00 C ATOM 1087 C VAL A 73 -2.217 -9.203 0.588 1.00 0.00 C ATOM 1088 O VAL A 73 -3.256 -9.392 -0.043 1.00 0.00 O ATOM 1089 CB VAL A 73 -1.416 -6.850 1.166 1.00 0.00 C ATOM 1090 CG1 VAL A 73 -2.061 -6.301 -0.108 1.00 0.00 C ATOM 1091 CG2 VAL A 73 -1.372 -5.783 2.262 1.00 0.00 C ATOM 0 H VAL A 73 -0.644 -8.133 3.115 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.166 -7.804 1.880 1.00 0.00 H new ATOM 0 HB VAL A 73 -0.389 -7.129 0.928 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.525 -5.409 -0.432 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -2.017 -7.056 -0.893 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -3.102 -6.046 0.092 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -0.849 -4.901 1.891 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -2.389 -5.510 2.545 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -0.847 -6.177 3.132 1.00 0.00 H new ATOM 1101 N LEU A 74 -1.101 -9.898 0.423 1.00 0.00 N ATOM 1102 CA LEU A 74 -1.026 -10.971 -0.553 1.00 0.00 C ATOM 1103 C LEU A 74 -2.185 -11.944 -0.326 1.00 0.00 C ATOM 1104 O LEU A 74 -3.059 -12.084 -1.179 1.00 0.00 O ATOM 1105 CB LEU A 74 0.352 -11.636 -0.514 1.00 0.00 C ATOM 1106 CG LEU A 74 1.392 -11.082 -1.489 1.00 0.00 C ATOM 1107 CD1 LEU A 74 2.775 -11.675 -1.211 1.00 0.00 C ATOM 1108 CD2 LEU A 74 0.956 -11.299 -2.939 1.00 0.00 C ATOM 0 H LEU A 74 -0.242 -9.739 0.949 1.00 0.00 H new ATOM 0 HA LEU A 74 -1.135 -10.575 -1.563 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.748 -11.547 0.498 1.00 0.00 H new ATOM 0 HB3 LEU A 74 0.226 -12.700 -0.714 1.00 0.00 H new ATOM 0 HG LEU A 74 1.466 -10.006 -1.334 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.496 -11.265 -1.918 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.081 -11.425 -0.195 1.00 0.00 H new ATOM 0 HD13 LEU A 74 2.735 -12.759 -1.321 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.714 -10.896 -3.611 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.835 -12.366 -3.127 1.00 0.00 H new ATOM 0 HD23 LEU A 74 0.008 -10.790 -3.114 1.00 0.00 H new ATOM 1120 N GLU A 75 -2.154 -12.591 0.830 1.00 0.00 N ATOM 1121 CA GLU A 75 -3.191 -13.547 1.181 1.00 0.00 C ATOM 1122 C GLU A 75 -4.564 -13.015 0.767 1.00 0.00 C ATOM 1123 O GLU A 75 -5.398 -13.765 0.261 1.00 0.00 O ATOM 1124 CB GLU A 75 -3.156 -13.870 2.676 1.00 0.00 C ATOM 1125 CG GLU A 75 -1.808 -14.475 3.074 1.00 0.00 C ATOM 1126 CD GLU A 75 -1.998 -15.816 3.787 1.00 0.00 C ATOM 1127 OE1 GLU A 75 -2.435 -15.779 4.957 1.00 0.00 O ATOM 1128 OE2 GLU A 75 -1.703 -16.847 3.144 1.00 0.00 O ATOM 0 H GLU A 75 -1.427 -12.472 1.536 1.00 0.00 H new ATOM 0 HA GLU A 75 -3.003 -14.474 0.639 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.336 -12.962 3.252 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -3.958 -14.567 2.920 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -1.192 -14.615 2.186 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -1.274 -13.784 3.727 1.00 0.00 H new ATOM 1135 N TRP A 76 -4.758 -11.725 0.998 1.00 0.00 N ATOM 1136 CA TRP A 76 -6.017 -11.084 0.655 1.00 0.00 C ATOM 1137 C TRP A 76 -6.130 -11.050 -0.870 1.00 0.00 C ATOM 1138 O TRP A 76 -7.160 -11.425 -1.428 1.00 0.00 O ATOM 1139 CB TRP A 76 -6.117 -9.697 1.293 1.00 0.00 C ATOM 1140 CG TRP A 76 -7.139 -8.776 0.623 1.00 0.00 C ATOM 1141 CD1 TRP A 76 -8.443 -8.649 0.903 1.00 0.00 C ATOM 1142 CD2 TRP A 76 -6.886 -7.854 -0.458 1.00 0.00 C ATOM 1143 NE1 TRP A 76 -9.047 -7.715 0.085 1.00 0.00 N ATOM 1144 CE2 TRP A 76 -8.070 -7.217 -0.768 1.00 0.00 C ATOM 1145 CE3 TRP A 76 -5.697 -7.567 -1.150 1.00 0.00 C ATOM 1146 CZ2 TRP A 76 -8.180 -6.253 -1.778 1.00 0.00 C ATOM 1147 CZ3 TRP A 76 -5.823 -6.602 -2.156 1.00 0.00 C ATOM 1148 CH2 TRP A 76 -7.008 -5.951 -2.481 1.00 0.00 C ATOM 0 H TRP A 76 -4.065 -11.106 1.418 1.00 0.00 H new ATOM 0 HA TRP A 76 -6.859 -11.649 1.054 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -6.380 -9.810 2.345 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -5.137 -9.221 1.259 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -8.957 -9.207 1.672 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -10.029 -7.441 0.104 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -4.760 -8.053 -0.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -9.119 -5.769 -2.002 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -4.938 -6.345 -2.719 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -7.024 -5.216 -3.272 1.00 0.00 H new ATOM 1159 N LEU A 77 -5.057 -10.596 -1.502 1.00 0.00 N ATOM 1160 CA LEU A 77 -5.023 -10.508 -2.951 1.00 0.00 C ATOM 1161 C LEU A 77 -5.529 -11.822 -3.550 1.00 0.00 C ATOM 1162 O LEU A 77 -6.392 -11.818 -4.426 1.00 0.00 O ATOM 1163 CB LEU A 77 -3.625 -10.112 -3.432 1.00 0.00 C ATOM 1164 CG LEU A 77 -3.388 -8.616 -3.646 1.00 0.00 C ATOM 1165 CD1 LEU A 77 -1.950 -8.233 -3.293 1.00 0.00 C ATOM 1166 CD2 LEU A 77 -3.760 -8.201 -5.071 1.00 0.00 C ATOM 0 H LEU A 77 -4.205 -10.285 -1.036 1.00 0.00 H new ATOM 0 HA LEU A 77 -5.690 -9.720 -3.300 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -2.897 -10.475 -2.707 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -3.425 -10.629 -4.370 1.00 0.00 H new ATOM 0 HG LEU A 77 -4.042 -8.066 -2.970 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -1.808 -7.164 -3.454 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -1.756 -8.471 -2.247 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -1.259 -8.790 -3.926 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -3.582 -7.133 -5.197 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -3.150 -8.757 -5.783 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.813 -8.417 -5.250 1.00 0.00 H new ATOM 1178 N GLN A 78 -4.971 -12.916 -3.053 1.00 0.00 N ATOM 1179 CA GLN A 78 -5.355 -14.235 -3.527 1.00 0.00 C ATOM 1180 C GLN A 78 -6.793 -14.550 -3.112 1.00 0.00 C ATOM 1181 O GLN A 78 -7.481 -15.320 -3.780 1.00 0.00 O ATOM 1182 CB GLN A 78 -4.389 -15.305 -3.014 1.00 0.00 C ATOM 1183 CG GLN A 78 -2.991 -15.109 -3.603 1.00 0.00 C ATOM 1184 CD GLN A 78 -2.278 -16.451 -3.781 1.00 0.00 C ATOM 1185 OE1 GLN A 78 -2.792 -17.382 -4.379 1.00 0.00 O ATOM 1186 NE2 GLN A 78 -1.068 -16.498 -3.229 1.00 0.00 N ATOM 0 H GLN A 78 -4.255 -12.916 -2.326 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.303 -14.238 -4.616 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.338 -15.263 -1.926 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.763 -16.294 -3.278 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -3.066 -14.602 -4.565 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.404 -14.465 -2.948 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -0.697 -15.682 -2.742 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -0.511 -17.350 -3.293 1.00 0.00 H new ATOM 1195 N ALA A 79 -7.205 -13.938 -2.011 1.00 0.00 N ATOM 1196 CA ALA A 79 -8.550 -14.144 -1.499 1.00 0.00 C ATOM 1197 C ALA A 79 -9.556 -13.479 -2.440 1.00 0.00 C ATOM 1198 O ALA A 79 -10.651 -13.999 -2.652 1.00 0.00 O ATOM 1199 CB ALA A 79 -8.641 -13.602 -0.071 1.00 0.00 C ATOM 0 H ALA A 79 -6.632 -13.300 -1.459 1.00 0.00 H new ATOM 0 HA ALA A 79 -8.788 -15.207 -1.460 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -9.649 -13.756 0.313 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -7.927 -14.127 0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -8.412 -12.536 -0.071 1.00 0.00 H new ATOM 1205 N GLN A 80 -9.150 -12.339 -2.980 1.00 0.00 N ATOM 1206 CA GLN A 80 -10.003 -11.598 -3.894 1.00 0.00 C ATOM 1207 C GLN A 80 -10.180 -12.373 -5.201 1.00 0.00 C ATOM 1208 O GLN A 80 -9.265 -13.063 -5.647 1.00 0.00 O ATOM 1209 CB GLN A 80 -9.440 -10.200 -4.157 1.00 0.00 C ATOM 1210 CG GLN A 80 -9.147 -9.471 -2.844 1.00 0.00 C ATOM 1211 CD GLN A 80 -10.235 -9.752 -1.805 1.00 0.00 C ATOM 1212 OE1 GLN A 80 -9.833 -10.515 -0.793 1.00 0.00 O flip ATOM 1213 NE2 GLN A 80 -11.365 -9.305 -1.916 1.00 0.00 N flip ATOM 0 H GLN A 80 -8.242 -11.910 -2.802 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.982 -11.478 -3.430 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.526 -10.277 -4.746 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.152 -9.622 -4.747 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -8.179 -9.788 -2.456 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.082 -8.398 -3.026 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -11.607 -8.725 -2.719 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.067 -9.511 -1.205 1.00 0.00 H new ATOM 1222 N LYS A 81 -11.364 -12.232 -5.779 1.00 0.00 N ATOM 1223 CA LYS A 81 -11.673 -12.910 -7.027 1.00 0.00 C ATOM 1224 C LYS A 81 -11.052 -12.134 -8.191 1.00 0.00 C ATOM 1225 O LYS A 81 -11.144 -12.557 -9.342 1.00 0.00 O ATOM 1226 CB LYS A 81 -13.182 -13.120 -7.163 1.00 0.00 C ATOM 1227 CG LYS A 81 -13.529 -13.740 -8.518 1.00 0.00 C ATOM 1228 CD LYS A 81 -14.604 -14.819 -8.368 1.00 0.00 C ATOM 1229 CE LYS A 81 -14.740 -15.640 -9.652 1.00 0.00 C ATOM 1230 NZ LYS A 81 -16.166 -15.886 -9.962 1.00 0.00 N ATOM 0 H LYS A 81 -12.121 -11.658 -5.406 1.00 0.00 H new ATOM 0 HA LYS A 81 -11.234 -13.908 -7.038 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -13.536 -13.768 -6.361 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -13.697 -12.166 -7.053 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -13.880 -12.964 -9.198 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -12.634 -14.173 -8.964 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -14.350 -15.477 -7.537 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -15.560 -14.354 -8.127 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.268 -15.112 -10.480 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -14.217 -16.590 -9.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -16.240 -16.444 -10.836 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -16.606 -16.409 -9.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -16.655 -14.977 -10.089 1.00 0.00 H new ATOM 1244 N VAL A 82 -10.434 -11.013 -7.850 1.00 0.00 N ATOM 1245 CA VAL A 82 -9.799 -10.175 -8.853 1.00 0.00 C ATOM 1246 C VAL A 82 -8.341 -10.607 -9.023 1.00 0.00 C ATOM 1247 O VAL A 82 -7.627 -10.796 -8.039 1.00 0.00 O ATOM 1248 CB VAL A 82 -9.945 -8.700 -8.471 1.00 0.00 C ATOM 1249 CG1 VAL A 82 -10.012 -8.532 -6.951 1.00 0.00 C ATOM 1250 CG2 VAL A 82 -8.809 -7.865 -9.065 1.00 0.00 C ATOM 0 H VAL A 82 -10.359 -10.666 -6.894 1.00 0.00 H new ATOM 0 HA VAL A 82 -10.289 -10.297 -9.819 1.00 0.00 H new ATOM 0 HB VAL A 82 -10.883 -8.336 -8.890 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.116 -7.475 -6.706 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.870 -9.081 -6.562 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.098 -8.921 -6.501 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -8.937 -6.821 -8.779 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -7.854 -8.230 -8.689 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -8.826 -7.948 -10.152 1.00 0.00 H new ATOM 1260 N GLN A 83 -7.943 -10.750 -10.278 1.00 0.00 N ATOM 1261 CA GLN A 83 -6.583 -11.156 -10.590 1.00 0.00 C ATOM 1262 C GLN A 83 -5.812 -9.993 -11.219 1.00 0.00 C ATOM 1263 O GLN A 83 -6.376 -9.211 -11.983 1.00 0.00 O ATOM 1264 CB GLN A 83 -6.573 -12.380 -11.508 1.00 0.00 C ATOM 1265 CG GLN A 83 -6.929 -11.991 -12.944 1.00 0.00 C ATOM 1266 CD GLN A 83 -7.392 -13.211 -13.744 1.00 0.00 C ATOM 1267 OE1 GLN A 83 -6.796 -13.599 -14.735 1.00 0.00 O ATOM 1268 NE2 GLN A 83 -8.486 -13.792 -13.259 1.00 0.00 N ATOM 0 H GLN A 83 -8.538 -10.592 -11.091 1.00 0.00 H new ATOM 0 HA GLN A 83 -6.086 -11.435 -9.661 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -5.588 -12.847 -11.487 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -7.284 -13.120 -11.141 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -7.716 -11.237 -12.936 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -6.062 -11.542 -13.428 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -8.936 -13.416 -12.425 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -8.875 -14.614 -13.721 1.00 0.00 H new ATOM 1277 N VAL A 84 -4.536 -9.916 -10.873 1.00 0.00 N ATOM 1278 CA VAL A 84 -3.682 -8.861 -11.394 1.00 0.00 C ATOM 1279 C VAL A 84 -2.630 -9.474 -12.321 1.00 0.00 C ATOM 1280 O VAL A 84 -1.855 -10.332 -11.904 1.00 0.00 O ATOM 1281 CB VAL A 84 -3.070 -8.065 -10.240 1.00 0.00 C ATOM 1282 CG1 VAL A 84 -3.817 -6.747 -10.027 1.00 0.00 C ATOM 1283 CG2 VAL A 84 -3.045 -8.894 -8.954 1.00 0.00 C ATOM 0 H VAL A 84 -4.072 -10.566 -10.239 1.00 0.00 H new ATOM 0 HA VAL A 84 -4.265 -8.155 -11.985 1.00 0.00 H new ATOM 0 HB VAL A 84 -2.040 -7.828 -10.506 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -3.362 -6.200 -9.201 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -3.761 -6.146 -10.935 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -4.861 -6.954 -9.793 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -2.605 -8.304 -8.150 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -4.062 -9.176 -8.683 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -2.450 -9.793 -9.112 1.00 0.00 H new ATOM 1293 N SER A 85 -2.638 -9.008 -13.562 1.00 0.00 N ATOM 1294 CA SER A 85 -1.694 -9.499 -14.551 1.00 0.00 C ATOM 1295 C SER A 85 -0.270 -9.425 -13.998 1.00 0.00 C ATOM 1296 O SER A 85 0.569 -10.266 -14.317 1.00 0.00 O ATOM 1297 CB SER A 85 -1.800 -8.705 -15.855 1.00 0.00 C ATOM 1298 OG SER A 85 -0.730 -9.001 -16.748 1.00 0.00 O ATOM 0 H SER A 85 -3.283 -8.296 -13.904 1.00 0.00 H new ATOM 0 HA SER A 85 -1.938 -10.539 -14.770 1.00 0.00 H new ATOM 0 HB2 SER A 85 -2.750 -8.930 -16.340 1.00 0.00 H new ATOM 0 HB3 SER A 85 -1.801 -7.638 -15.631 1.00 0.00 H new ATOM 0 HG SER A 85 -0.834 -8.476 -17.569 1.00 0.00 H new ATOM 1304 N SER A 86 -0.040 -8.409 -13.178 1.00 0.00 N ATOM 1305 CA SER A 86 1.269 -8.214 -12.578 1.00 0.00 C ATOM 1306 C SER A 86 1.115 -7.755 -11.127 1.00 0.00 C ATOM 1307 O SER A 86 0.631 -6.654 -10.868 1.00 0.00 O ATOM 1308 CB SER A 86 2.093 -7.198 -13.372 1.00 0.00 C ATOM 1309 OG SER A 86 2.005 -7.420 -14.777 1.00 0.00 O ATOM 0 H SER A 86 -0.738 -7.713 -12.915 1.00 0.00 H new ATOM 0 HA SER A 86 1.800 -9.166 -12.597 1.00 0.00 H new ATOM 0 HB2 SER A 86 1.746 -6.191 -13.142 1.00 0.00 H new ATOM 0 HB3 SER A 86 3.136 -7.255 -13.061 1.00 0.00 H new ATOM 0 HG SER A 86 2.543 -6.750 -15.248 1.00 0.00 H new ATOM 1315 N GLN A 87 1.538 -8.621 -10.218 1.00 0.00 N ATOM 1316 CA GLN A 87 1.453 -8.319 -8.799 1.00 0.00 C ATOM 1317 C GLN A 87 1.738 -6.835 -8.555 1.00 0.00 C ATOM 1318 O GLN A 87 2.753 -6.311 -9.012 1.00 0.00 O ATOM 1319 CB GLN A 87 2.408 -9.200 -7.992 1.00 0.00 C ATOM 1320 CG GLN A 87 1.678 -9.882 -6.833 1.00 0.00 C ATOM 1321 CD GLN A 87 2.357 -11.200 -6.457 1.00 0.00 C ATOM 1322 OE1 GLN A 87 3.546 -11.393 -6.650 1.00 0.00 O ATOM 1323 NE2 GLN A 87 1.538 -12.094 -5.909 1.00 0.00 N ATOM 0 H GLN A 87 1.941 -9.532 -10.437 1.00 0.00 H new ATOM 0 HA GLN A 87 0.439 -8.536 -8.461 1.00 0.00 H new ATOM 0 HB2 GLN A 87 2.850 -9.955 -8.643 1.00 0.00 H new ATOM 0 HB3 GLN A 87 3.227 -8.594 -7.604 1.00 0.00 H new ATOM 0 HG2 GLN A 87 1.661 -9.218 -5.969 1.00 0.00 H new ATOM 0 HG3 GLN A 87 0.641 -10.070 -7.112 1.00 0.00 H new ATOM 0 HE21 GLN A 87 0.552 -11.868 -5.776 1.00 0.00 H new ATOM 0 HE22 GLN A 87 1.896 -13.005 -5.622 1.00 0.00 H new ATOM 1332 N PRO A 88 0.801 -6.184 -7.816 1.00 0.00 N ATOM 1333 CA PRO A 88 0.942 -4.771 -7.506 1.00 0.00 C ATOM 1334 C PRO A 88 1.999 -4.550 -6.422 1.00 0.00 C ATOM 1335 O PRO A 88 2.416 -5.496 -5.755 1.00 0.00 O ATOM 1336 CB PRO A 88 -0.447 -4.322 -7.081 1.00 0.00 C ATOM 1337 CG PRO A 88 -1.204 -5.590 -6.723 1.00 0.00 C ATOM 1338 CD PRO A 88 -0.413 -6.772 -7.258 1.00 0.00 C ATOM 0 HA PRO A 88 1.293 -4.187 -8.356 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -0.395 -3.645 -6.229 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -0.947 -3.783 -7.886 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -1.326 -5.670 -5.643 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -2.204 -5.573 -7.156 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -0.180 -7.484 -6.466 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -0.976 -7.314 -8.018 1.00 0.00 H new ATOM 1346 N GLU A 89 2.402 -3.296 -6.280 1.00 0.00 N ATOM 1347 CA GLU A 89 3.403 -2.939 -5.289 1.00 0.00 C ATOM 1348 C GLU A 89 2.759 -2.813 -3.907 1.00 0.00 C ATOM 1349 O GLU A 89 1.918 -1.944 -3.687 1.00 0.00 O ATOM 1350 CB GLU A 89 4.123 -1.647 -5.678 1.00 0.00 C ATOM 1351 CG GLU A 89 5.299 -1.935 -6.614 1.00 0.00 C ATOM 1352 CD GLU A 89 5.225 -1.067 -7.872 1.00 0.00 C ATOM 1353 OE1 GLU A 89 5.563 0.131 -7.756 1.00 0.00 O ATOM 1354 OE2 GLU A 89 4.831 -1.621 -8.921 1.00 0.00 O ATOM 0 H GLU A 89 2.053 -2.514 -6.835 1.00 0.00 H new ATOM 0 HA GLU A 89 4.148 -3.734 -5.251 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.423 -0.969 -6.166 1.00 0.00 H new ATOM 0 HB3 GLU A 89 4.482 -1.143 -4.781 1.00 0.00 H new ATOM 0 HG2 GLU A 89 6.238 -1.747 -6.093 1.00 0.00 H new ATOM 0 HG3 GLU A 89 5.296 -2.988 -6.894 1.00 0.00 H new ATOM 1361 N LEU A 90 3.180 -3.695 -3.011 1.00 0.00 N ATOM 1362 CA LEU A 90 2.655 -3.693 -1.656 1.00 0.00 C ATOM 1363 C LEU A 90 3.473 -2.725 -0.798 1.00 0.00 C ATOM 1364 O LEU A 90 4.627 -3.001 -0.474 1.00 0.00 O ATOM 1365 CB LEU A 90 2.605 -5.117 -1.099 1.00 0.00 C ATOM 1366 CG LEU A 90 1.364 -5.935 -1.460 1.00 0.00 C ATOM 1367 CD1 LEU A 90 0.908 -5.639 -2.890 1.00 0.00 C ATOM 1368 CD2 LEU A 90 1.606 -7.429 -1.232 1.00 0.00 C ATOM 0 H LEU A 90 3.878 -4.415 -3.197 1.00 0.00 H new ATOM 0 HA LEU A 90 1.625 -3.335 -1.647 1.00 0.00 H new ATOM 0 HB2 LEU A 90 3.485 -5.655 -1.451 1.00 0.00 H new ATOM 0 HB3 LEU A 90 2.677 -5.064 -0.013 1.00 0.00 H new ATOM 0 HG LEU A 90 0.553 -5.636 -0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 90 0.024 -6.234 -3.121 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.667 -4.580 -2.983 1.00 0.00 H new ATOM 0 HD13 LEU A 90 1.707 -5.892 -3.587 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.708 -7.988 -1.496 1.00 0.00 H new ATOM 0 HD22 LEU A 90 2.437 -7.762 -1.854 1.00 0.00 H new ATOM 0 HD23 LEU A 90 1.846 -7.603 -0.183 1.00 0.00 H new ATOM 1380 N LEU A 91 2.843 -1.612 -0.455 1.00 0.00 N ATOM 1381 CA LEU A 91 3.498 -0.602 0.359 1.00 0.00 C ATOM 1382 C LEU A 91 2.551 -0.160 1.476 1.00 0.00 C ATOM 1383 O LEU A 91 1.338 -0.339 1.374 1.00 0.00 O ATOM 1384 CB LEU A 91 3.997 0.550 -0.515 1.00 0.00 C ATOM 1385 CG LEU A 91 4.256 0.213 -1.985 1.00 0.00 C ATOM 1386 CD1 LEU A 91 4.089 1.451 -2.869 1.00 0.00 C ATOM 1387 CD2 LEU A 91 5.628 -0.439 -2.165 1.00 0.00 C ATOM 0 H LEU A 91 1.886 -1.387 -0.726 1.00 0.00 H new ATOM 0 HA LEU A 91 4.385 -1.016 0.838 1.00 0.00 H new ATOM 0 HB2 LEU A 91 3.265 1.357 -0.471 1.00 0.00 H new ATOM 0 HB3 LEU A 91 4.921 0.934 -0.083 1.00 0.00 H new ATOM 0 HG LEU A 91 3.510 -0.514 -2.305 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.279 1.184 -3.909 1.00 0.00 H new ATOM 0 HD12 LEU A 91 3.073 1.833 -2.772 1.00 0.00 H new ATOM 0 HD13 LEU A 91 4.797 2.219 -2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 91 5.786 -0.668 -3.219 1.00 0.00 H new ATOM 0 HD22 LEU A 91 6.404 0.245 -1.822 1.00 0.00 H new ATOM 0 HD23 LEU A 91 5.673 -1.359 -1.583 1.00 0.00 H new ATOM 1399 N ASP A 92 3.140 0.408 2.518 1.00 0.00 N ATOM 1400 CA ASP A 92 2.364 0.877 3.653 1.00 0.00 C ATOM 1401 C ASP A 92 1.763 2.245 3.325 1.00 0.00 C ATOM 1402 O ASP A 92 2.187 2.901 2.375 1.00 0.00 O ATOM 1403 CB ASP A 92 3.243 1.032 4.896 1.00 0.00 C ATOM 1404 CG ASP A 92 2.487 1.052 6.225 1.00 0.00 C ATOM 1405 OD1 ASP A 92 1.262 0.806 6.185 1.00 0.00 O ATOM 1406 OD2 ASP A 92 3.150 1.313 7.252 1.00 0.00 O ATOM 0 H ASP A 92 4.146 0.554 2.600 1.00 0.00 H new ATOM 0 HA ASP A 92 1.583 0.143 3.853 1.00 0.00 H new ATOM 0 HB2 ASP A 92 3.963 0.214 4.917 1.00 0.00 H new ATOM 0 HB3 ASP A 92 3.813 1.956 4.806 1.00 0.00 H new ATOM 1411 N VAL A 93 0.786 2.635 4.130 1.00 0.00 N ATOM 1412 CA VAL A 93 0.123 3.914 3.937 1.00 0.00 C ATOM 1413 C VAL A 93 1.173 5.026 3.887 1.00 0.00 C ATOM 1414 O VAL A 93 0.919 6.100 3.344 1.00 0.00 O ATOM 1415 CB VAL A 93 -0.925 4.130 5.031 1.00 0.00 C ATOM 1416 CG1 VAL A 93 -0.281 4.116 6.418 1.00 0.00 C ATOM 1417 CG2 VAL A 93 -1.699 5.429 4.799 1.00 0.00 C ATOM 0 H VAL A 93 0.437 2.088 4.917 1.00 0.00 H new ATOM 0 HA VAL A 93 -0.410 3.928 2.987 1.00 0.00 H new ATOM 0 HB VAL A 93 -1.634 3.304 4.983 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -1.048 4.272 7.177 1.00 0.00 H new ATOM 0 HG12 VAL A 93 0.204 3.154 6.584 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.461 4.912 6.483 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -2.437 5.559 5.590 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -1.007 6.271 4.807 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -2.205 5.384 3.835 1.00 0.00 H new ATOM 1427 N SER A 94 2.330 4.729 4.460 1.00 0.00 N ATOM 1428 CA SER A 94 3.419 5.690 4.488 1.00 0.00 C ATOM 1429 C SER A 94 3.693 6.211 3.075 1.00 0.00 C ATOM 1430 O SER A 94 3.669 7.418 2.840 1.00 0.00 O ATOM 1431 CB SER A 94 4.687 5.069 5.079 1.00 0.00 C ATOM 1432 OG SER A 94 4.409 4.298 6.245 1.00 0.00 O ATOM 0 H SER A 94 2.537 3.837 4.908 1.00 0.00 H new ATOM 0 HA SER A 94 3.124 6.523 5.126 1.00 0.00 H new ATOM 0 HB2 SER A 94 5.164 4.436 4.331 1.00 0.00 H new ATOM 0 HB3 SER A 94 5.396 5.859 5.327 1.00 0.00 H new ATOM 0 HG SER A 94 5.243 3.917 6.592 1.00 0.00 H new ATOM 1438 N TRP A 95 3.947 5.275 2.173 1.00 0.00 N ATOM 1439 CA TRP A 95 4.225 5.625 0.790 1.00 0.00 C ATOM 1440 C TRP A 95 3.142 6.598 0.321 1.00 0.00 C ATOM 1441 O TRP A 95 3.436 7.744 -0.018 1.00 0.00 O ATOM 1442 CB TRP A 95 4.323 4.373 -0.083 1.00 0.00 C ATOM 1443 CG TRP A 95 4.782 4.648 -1.517 1.00 0.00 C ATOM 1444 CD1 TRP A 95 5.987 5.061 -1.932 1.00 0.00 C ATOM 1445 CD2 TRP A 95 3.989 4.511 -2.715 1.00 0.00 C ATOM 1446 NE1 TRP A 95 6.028 5.201 -3.305 1.00 0.00 N ATOM 1447 CE2 TRP A 95 4.775 4.855 -3.796 1.00 0.00 C ATOM 1448 CE3 TRP A 95 2.651 4.110 -2.880 1.00 0.00 C ATOM 1449 CZ2 TRP A 95 4.313 4.833 -5.117 1.00 0.00 C ATOM 1450 CZ3 TRP A 95 2.205 4.093 -4.207 1.00 0.00 C ATOM 1451 CH2 TRP A 95 2.984 4.437 -5.306 1.00 0.00 C ATOM 0 H TRP A 95 3.966 4.275 2.372 1.00 0.00 H new ATOM 0 HA TRP A 95 5.194 6.116 0.704 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.017 3.672 0.381 1.00 0.00 H new ATOM 0 HB3 TRP A 95 3.349 3.885 -0.112 1.00 0.00 H new ATOM 0 HD1 TRP A 95 6.821 5.259 -1.275 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.831 5.503 -3.857 1.00 0.00 H new ATOM 0 HE3 TRP A 95 2.018 3.837 -2.049 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.948 5.107 -5.946 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 1.184 3.792 -4.390 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.566 4.399 -6.301 1.00 0.00 H new ATOM 1462 N LEU A 96 1.911 6.107 0.318 1.00 0.00 N ATOM 1463 CA LEU A 96 0.783 6.919 -0.103 1.00 0.00 C ATOM 1464 C LEU A 96 0.837 8.271 0.612 1.00 0.00 C ATOM 1465 O LEU A 96 0.748 9.318 -0.026 1.00 0.00 O ATOM 1466 CB LEU A 96 -0.530 6.163 0.110 1.00 0.00 C ATOM 1467 CG LEU A 96 -1.715 6.622 -0.743 1.00 0.00 C ATOM 1468 CD1 LEU A 96 -2.560 7.656 0.003 1.00 0.00 C ATOM 1469 CD2 LEU A 96 -1.243 7.142 -2.103 1.00 0.00 C ATOM 0 H LEU A 96 1.671 5.157 0.601 1.00 0.00 H new ATOM 0 HA LEU A 96 0.838 7.122 -1.173 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.354 5.106 -0.088 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -0.809 6.249 1.160 1.00 0.00 H new ATOM 0 HG LEU A 96 -2.354 5.759 -0.932 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.395 7.965 -0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.942 7.217 0.924 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.945 8.524 0.242 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.105 7.462 -2.689 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.570 7.987 -1.956 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -0.717 6.348 -2.634 1.00 0.00 H new ATOM 1481 N ILE A 97 0.982 8.203 1.927 1.00 0.00 N ATOM 1482 CA ILE A 97 1.050 9.408 2.735 1.00 0.00 C ATOM 1483 C ILE A 97 2.075 10.368 2.129 1.00 0.00 C ATOM 1484 O ILE A 97 1.762 11.526 1.857 1.00 0.00 O ATOM 1485 CB ILE A 97 1.326 9.057 4.199 1.00 0.00 C ATOM 1486 CG1 ILE A 97 0.087 8.452 4.861 1.00 0.00 C ATOM 1487 CG2 ILE A 97 1.850 10.273 4.965 1.00 0.00 C ATOM 1488 CD1 ILE A 97 0.432 7.857 6.228 1.00 0.00 C ATOM 0 H ILE A 97 1.054 7.332 2.453 1.00 0.00 H new ATOM 0 HA ILE A 97 0.090 9.923 2.730 1.00 0.00 H new ATOM 0 HB ILE A 97 2.108 8.298 4.227 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -0.679 9.219 4.977 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -0.332 7.678 4.218 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.038 9.996 6.002 1.00 0.00 H new ATOM 0 HG22 ILE A 97 2.777 10.619 4.508 1.00 0.00 H new ATOM 0 HG23 ILE A 97 1.109 11.071 4.931 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -0.466 7.433 6.678 1.00 0.00 H new ATOM 0 HD12 ILE A 97 1.180 7.074 6.106 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.828 8.639 6.876 1.00 0.00 H new ATOM 1500 N GLU A 98 3.279 9.850 1.934 1.00 0.00 N ATOM 1501 CA GLU A 98 4.353 10.646 1.364 1.00 0.00 C ATOM 1502 C GLU A 98 4.022 11.028 -0.080 1.00 0.00 C ATOM 1503 O GLU A 98 4.170 12.185 -0.470 1.00 0.00 O ATOM 1504 CB GLU A 98 5.688 9.904 1.443 1.00 0.00 C ATOM 1505 CG GLU A 98 6.237 9.913 2.871 1.00 0.00 C ATOM 1506 CD GLU A 98 7.469 10.815 2.979 1.00 0.00 C ATOM 1507 OE1 GLU A 98 8.332 10.706 2.081 1.00 0.00 O ATOM 1508 OE2 GLU A 98 7.520 11.592 3.956 1.00 0.00 O ATOM 0 H GLU A 98 3.534 8.889 2.161 1.00 0.00 H new ATOM 0 HA GLU A 98 4.449 11.561 1.948 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.557 8.876 1.107 1.00 0.00 H new ATOM 0 HB3 GLU A 98 6.408 10.370 0.770 1.00 0.00 H new ATOM 0 HG2 GLU A 98 5.466 10.260 3.559 1.00 0.00 H new ATOM 0 HG3 GLU A 98 6.498 8.898 3.171 1.00 0.00 H new ATOM 1515 N CYS A 99 3.580 10.032 -0.835 1.00 0.00 N ATOM 1516 CA CYS A 99 3.227 10.249 -2.228 1.00 0.00 C ATOM 1517 C CYS A 99 2.341 11.493 -2.311 1.00 0.00 C ATOM 1518 O CYS A 99 2.363 12.209 -3.310 1.00 0.00 O ATOM 1519 CB CYS A 99 2.546 9.021 -2.836 1.00 0.00 C ATOM 1520 SG CYS A 99 3.744 7.644 -2.972 1.00 0.00 S ATOM 0 H CYS A 99 3.458 9.073 -0.508 1.00 0.00 H new ATOM 0 HA CYS A 99 4.132 10.409 -2.815 1.00 0.00 H new ATOM 0 HB2 CYS A 99 1.701 8.719 -2.217 1.00 0.00 H new ATOM 0 HB3 CYS A 99 2.148 9.266 -3.821 1.00 0.00 H new ATOM 0 HG CYS A 99 3.105 6.512 -2.975 1.00 0.00 H new ATOM 1526 N ILE A 100 1.581 11.711 -1.247 1.00 0.00 N ATOM 1527 CA ILE A 100 0.689 12.856 -1.188 1.00 0.00 C ATOM 1528 C ILE A 100 1.506 14.121 -0.916 1.00 0.00 C ATOM 1529 O ILE A 100 1.580 15.010 -1.763 1.00 0.00 O ATOM 1530 CB ILE A 100 -0.426 12.614 -0.168 1.00 0.00 C ATOM 1531 CG1 ILE A 100 -1.365 11.501 -0.637 1.00 0.00 C ATOM 1532 CG2 ILE A 100 -1.181 13.909 0.137 1.00 0.00 C ATOM 1533 CD1 ILE A 100 -2.360 11.123 0.462 1.00 0.00 C ATOM 0 H ILE A 100 1.565 11.114 -0.420 1.00 0.00 H new ATOM 0 HA ILE A 100 0.189 12.999 -2.146 1.00 0.00 H new ATOM 0 HB ILE A 100 0.030 12.280 0.764 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -1.906 11.827 -1.525 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -0.782 10.625 -0.922 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -1.968 13.709 0.864 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -0.489 14.646 0.544 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -1.625 14.296 -0.780 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.015 10.330 0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -1.817 10.774 1.340 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -2.958 11.995 0.727 1.00 0.00 H new ATOM 1545 N GLY A 101 2.099 14.161 0.268 1.00 0.00 N ATOM 1546 CA GLY A 101 2.908 15.301 0.662 1.00 0.00 C ATOM 1547 C GLY A 101 4.022 15.561 -0.355 1.00 0.00 C ATOM 1548 O GLY A 101 4.607 16.642 -0.377 1.00 0.00 O ATOM 0 H GLY A 101 2.035 13.421 0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 101 2.277 16.186 0.750 1.00 0.00 H new ATOM 0 HA3 GLY A 101 3.343 15.120 1.645 1.00 0.00 H new ATOM 1552 N ALA A 102 4.280 14.551 -1.172 1.00 0.00 N ATOM 1553 CA ALA A 102 5.313 14.656 -2.188 1.00 0.00 C ATOM 1554 C ALA A 102 4.664 14.963 -3.539 1.00 0.00 C ATOM 1555 O ALA A 102 5.337 15.402 -4.470 1.00 0.00 O ATOM 1556 CB ALA A 102 6.135 13.366 -2.217 1.00 0.00 C ATOM 0 H ALA A 102 3.792 13.656 -1.151 1.00 0.00 H new ATOM 0 HA ALA A 102 5.996 15.473 -1.956 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.910 13.445 -2.979 1.00 0.00 H new ATOM 0 HB2 ALA A 102 6.599 13.208 -1.243 1.00 0.00 H new ATOM 0 HB3 ALA A 102 5.483 12.524 -2.449 1.00 0.00 H new ATOM 1562 N GLY A 103 3.363 14.721 -3.603 1.00 0.00 N ATOM 1563 CA GLY A 103 2.615 14.966 -4.824 1.00 0.00 C ATOM 1564 C GLY A 103 3.176 14.143 -5.986 1.00 0.00 C ATOM 1565 O GLY A 103 2.889 14.427 -7.148 1.00 0.00 O ATOM 0 H GLY A 103 2.808 14.358 -2.828 1.00 0.00 H new ATOM 0 HA2 GLY A 103 1.566 14.714 -4.669 1.00 0.00 H new ATOM 0 HA3 GLY A 103 2.655 16.027 -5.072 1.00 0.00 H new ATOM 1569 N LYS A 104 3.964 13.139 -5.631 1.00 0.00 N ATOM 1570 CA LYS A 104 4.568 12.273 -6.629 1.00 0.00 C ATOM 1571 C LYS A 104 4.864 10.909 -6.001 1.00 0.00 C ATOM 1572 O LYS A 104 4.878 10.774 -4.779 1.00 0.00 O ATOM 1573 CB LYS A 104 5.795 12.944 -7.250 1.00 0.00 C ATOM 1574 CG LYS A 104 7.042 12.702 -6.397 1.00 0.00 C ATOM 1575 CD LYS A 104 8.021 11.768 -7.110 1.00 0.00 C ATOM 1576 CE LYS A 104 9.279 11.546 -6.268 1.00 0.00 C ATOM 1577 NZ LYS A 104 9.941 10.278 -6.649 1.00 0.00 N ATOM 0 H LYS A 104 4.198 12.906 -4.666 1.00 0.00 H new ATOM 0 HA LYS A 104 3.876 12.102 -7.454 1.00 0.00 H new ATOM 0 HB2 LYS A 104 5.957 12.555 -8.255 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.618 14.015 -7.347 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.531 13.653 -6.183 1.00 0.00 H new ATOM 0 HG3 LYS A 104 6.753 12.269 -5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 104 7.538 10.811 -7.308 1.00 0.00 H new ATOM 0 HD3 LYS A 104 8.296 12.192 -8.076 1.00 0.00 H new ATOM 0 HE2 LYS A 104 9.968 12.379 -6.407 1.00 0.00 H new ATOM 0 HE3 LYS A 104 9.016 11.522 -5.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 10.690 10.057 -5.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 9.241 9.509 -6.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 10.359 10.375 -7.597 1.00 0.00 H new ATOM 1591 N PRO A 105 5.101 9.907 -6.890 1.00 0.00 N ATOM 1592 CA PRO A 105 5.396 8.559 -6.436 1.00 0.00 C ATOM 1593 C PRO A 105 6.824 8.463 -5.895 1.00 0.00 C ATOM 1594 O PRO A 105 7.755 8.157 -6.639 1.00 0.00 O ATOM 1595 CB PRO A 105 5.160 7.674 -7.650 1.00 0.00 C ATOM 1596 CG PRO A 105 5.194 8.602 -8.854 1.00 0.00 C ATOM 1597 CD PRO A 105 5.093 10.030 -8.345 1.00 0.00 C ATOM 0 HA PRO A 105 4.764 8.248 -5.604 1.00 0.00 H new ATOM 0 HB2 PRO A 105 5.928 6.905 -7.728 1.00 0.00 H new ATOM 0 HB3 PRO A 105 4.201 7.161 -7.579 1.00 0.00 H new ATOM 0 HG2 PRO A 105 6.116 8.462 -9.418 1.00 0.00 H new ATOM 0 HG3 PRO A 105 4.370 8.379 -9.531 1.00 0.00 H new ATOM 0 HD2 PRO A 105 5.929 10.635 -8.696 1.00 0.00 H new ATOM 0 HD3 PRO A 105 4.181 10.512 -8.697 1.00 0.00 H new ATOM 1605 N VAL A 106 6.953 8.730 -4.604 1.00 0.00 N ATOM 1606 CA VAL A 106 8.252 8.677 -3.954 1.00 0.00 C ATOM 1607 C VAL A 106 8.913 7.331 -4.254 1.00 0.00 C ATOM 1608 O VAL A 106 8.232 6.360 -4.583 1.00 0.00 O ATOM 1609 CB VAL A 106 8.099 8.948 -2.456 1.00 0.00 C ATOM 1610 CG1 VAL A 106 7.682 10.398 -2.201 1.00 0.00 C ATOM 1611 CG2 VAL A 106 7.107 7.972 -1.821 1.00 0.00 C ATOM 0 H VAL A 106 6.179 8.984 -3.990 1.00 0.00 H new ATOM 0 HA VAL A 106 8.907 9.455 -4.346 1.00 0.00 H new ATOM 0 HB VAL A 106 9.070 8.791 -1.986 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.580 10.564 -1.129 1.00 0.00 H new ATOM 0 HG12 VAL A 106 8.440 11.071 -2.602 1.00 0.00 H new ATOM 0 HG13 VAL A 106 6.728 10.594 -2.691 1.00 0.00 H new ATOM 0 HG21 VAL A 106 7.017 8.186 -0.756 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.133 8.082 -2.297 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.464 6.951 -1.957 1.00 0.00 H new ATOM 1621 N GLU A 107 10.232 7.314 -4.130 1.00 0.00 N ATOM 1622 CA GLU A 107 10.993 6.103 -4.383 1.00 0.00 C ATOM 1623 C GLU A 107 10.779 5.095 -3.251 1.00 0.00 C ATOM 1624 O GLU A 107 10.551 5.482 -2.106 1.00 0.00 O ATOM 1625 CB GLU A 107 12.479 6.416 -4.565 1.00 0.00 C ATOM 1626 CG GLU A 107 13.188 6.513 -3.212 1.00 0.00 C ATOM 1627 CD GLU A 107 14.256 7.609 -3.230 1.00 0.00 C ATOM 1628 OE1 GLU A 107 15.332 7.344 -3.807 1.00 0.00 O ATOM 1629 OE2 GLU A 107 13.971 8.687 -2.665 1.00 0.00 O ATOM 0 H GLU A 107 10.793 8.121 -3.857 1.00 0.00 H new ATOM 0 HA GLU A 107 10.633 5.659 -5.311 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.947 5.639 -5.170 1.00 0.00 H new ATOM 0 HB3 GLU A 107 12.593 7.354 -5.108 1.00 0.00 H new ATOM 0 HG2 GLU A 107 12.459 6.724 -2.430 1.00 0.00 H new ATOM 0 HG3 GLU A 107 13.649 5.555 -2.969 1.00 0.00 H new ATOM 1636 N MET A 108 10.861 3.823 -3.612 1.00 0.00 N ATOM 1637 CA MET A 108 10.679 2.757 -2.641 1.00 0.00 C ATOM 1638 C MET A 108 12.015 2.352 -2.015 1.00 0.00 C ATOM 1639 O MET A 108 12.889 1.820 -2.699 1.00 0.00 O ATOM 1640 CB MET A 108 10.047 1.544 -3.326 1.00 0.00 C ATOM 1641 CG MET A 108 8.522 1.668 -3.364 1.00 0.00 C ATOM 1642 SD MET A 108 7.841 0.476 -4.503 1.00 0.00 S ATOM 1643 CE MET A 108 7.755 1.473 -5.981 1.00 0.00 C ATOM 0 H MET A 108 11.051 3.506 -4.563 1.00 0.00 H new ATOM 0 HA MET A 108 10.023 3.120 -1.849 1.00 0.00 H new ATOM 0 HB2 MET A 108 10.433 1.453 -4.341 1.00 0.00 H new ATOM 0 HB3 MET A 108 10.328 0.635 -2.795 1.00 0.00 H new ATOM 0 HG2 MET A 108 8.111 1.507 -2.367 1.00 0.00 H new ATOM 0 HG3 MET A 108 8.238 2.676 -3.667 1.00 0.00 H new ATOM 0 HE1 MET A 108 7.857 0.833 -6.858 1.00 0.00 H new ATOM 0 HE2 MET A 108 6.795 1.988 -6.017 1.00 0.00 H new ATOM 0 HE3 MET A 108 8.560 2.207 -5.972 1.00 0.00 H new ATOM 1653 N THR A 109 12.133 2.618 -0.723 1.00 0.00 N ATOM 1654 CA THR A 109 13.348 2.288 0.002 1.00 0.00 C ATOM 1655 C THR A 109 13.053 1.257 1.094 1.00 0.00 C ATOM 1656 O THR A 109 13.425 1.450 2.251 1.00 0.00 O ATOM 1657 CB THR A 109 13.946 3.589 0.540 1.00 0.00 C ATOM 1658 OG1 THR A 109 13.068 3.964 1.597 1.00 0.00 O ATOM 1659 CG2 THR A 109 13.838 4.741 -0.461 1.00 0.00 C ATOM 0 H THR A 109 11.406 3.059 -0.159 1.00 0.00 H new ATOM 0 HA THR A 109 14.085 1.821 -0.652 1.00 0.00 H new ATOM 0 HB THR A 109 14.993 3.428 0.796 1.00 0.00 H new ATOM 0 HG1 THR A 109 13.383 4.798 2.003 1.00 0.00 H new ATOM 0 HG21 THR A 109 14.277 5.640 -0.029 1.00 0.00 H new ATOM 0 HG22 THR A 109 14.371 4.480 -1.375 1.00 0.00 H new ATOM 0 HG23 THR A 109 12.789 4.925 -0.693 1.00 0.00 H new ATOM 1667 N GLY A 110 12.388 0.186 0.688 1.00 0.00 N ATOM 1668 CA GLY A 110 12.040 -0.875 1.618 1.00 0.00 C ATOM 1669 C GLY A 110 10.939 -0.422 2.579 1.00 0.00 C ATOM 1670 O GLY A 110 9.842 -0.979 2.580 1.00 0.00 O ATOM 0 H GLY A 110 12.081 0.030 -0.272 1.00 0.00 H new ATOM 0 HA2 GLY A 110 11.707 -1.753 1.065 1.00 0.00 H new ATOM 0 HA3 GLY A 110 12.923 -1.171 2.184 1.00 0.00 H new ATOM 1674 N LYS A 111 11.270 0.583 3.376 1.00 0.00 N ATOM 1675 CA LYS A 111 10.324 1.117 4.340 1.00 0.00 C ATOM 1676 C LYS A 111 8.934 1.177 3.705 1.00 0.00 C ATOM 1677 O LYS A 111 7.992 0.564 4.205 1.00 0.00 O ATOM 1678 CB LYS A 111 10.811 2.463 4.880 1.00 0.00 C ATOM 1679 CG LYS A 111 12.143 2.309 5.618 1.00 0.00 C ATOM 1680 CD LYS A 111 13.222 3.196 4.994 1.00 0.00 C ATOM 1681 CE LYS A 111 12.806 4.668 5.023 1.00 0.00 C ATOM 1682 NZ LYS A 111 13.939 5.518 5.452 1.00 0.00 N ATOM 0 H LYS A 111 12.181 1.042 3.374 1.00 0.00 H new ATOM 0 HA LYS A 111 10.251 0.459 5.206 1.00 0.00 H new ATOM 0 HB2 LYS A 111 10.927 3.169 4.057 1.00 0.00 H new ATOM 0 HB3 LYS A 111 10.063 2.880 5.555 1.00 0.00 H new ATOM 0 HG2 LYS A 111 12.014 2.572 6.668 1.00 0.00 H new ATOM 0 HG3 LYS A 111 12.461 1.267 5.587 1.00 0.00 H new ATOM 0 HD2 LYS A 111 14.160 3.069 5.535 1.00 0.00 H new ATOM 0 HD3 LYS A 111 13.403 2.886 3.965 1.00 0.00 H new ATOM 0 HE2 LYS A 111 12.467 4.976 4.034 1.00 0.00 H new ATOM 0 HE3 LYS A 111 11.965 4.801 5.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 13.640 6.514 5.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 14.244 5.234 6.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.730 5.404 4.787 1.00 0.00 H new ATOM 1696 N HIS A 112 8.849 1.921 2.611 1.00 0.00 N ATOM 1697 CA HIS A 112 7.589 2.068 1.902 1.00 0.00 C ATOM 1698 C HIS A 112 6.940 0.695 1.718 1.00 0.00 C ATOM 1699 O HIS A 112 5.737 0.541 1.920 1.00 0.00 O ATOM 1700 CB HIS A 112 7.794 2.809 0.579 1.00 0.00 C ATOM 1701 CG HIS A 112 8.411 4.179 0.732 1.00 0.00 C ATOM 1702 ND1 HIS A 112 8.888 4.910 -0.342 1.00 0.00 N ATOM 1703 CD2 HIS A 112 8.622 4.943 1.842 1.00 0.00 C ATOM 1704 CE1 HIS A 112 9.364 6.060 0.113 1.00 0.00 C ATOM 1705 NE2 HIS A 112 9.199 6.078 1.467 1.00 0.00 N ATOM 0 H HIS A 112 9.632 2.428 2.199 1.00 0.00 H new ATOM 0 HA HIS A 112 6.905 2.678 2.492 1.00 0.00 H new ATOM 0 HB2 HIS A 112 8.430 2.206 -0.069 1.00 0.00 H new ATOM 0 HB3 HIS A 112 6.831 2.909 0.077 1.00 0.00 H new ATOM 0 HD1 HIS A 112 8.875 4.614 -1.318 1.00 0.00 H new ATOM 0 HD2 HIS A 112 8.363 4.671 2.855 1.00 0.00 H new ATOM 0 HE1 HIS A 112 9.805 6.845 -0.483 1.00 0.00 H new ATOM 1713 N GLN A 113 7.766 -0.268 1.337 1.00 0.00 N ATOM 1714 CA GLN A 113 7.288 -1.623 1.124 1.00 0.00 C ATOM 1715 C GLN A 113 6.844 -2.245 2.450 1.00 0.00 C ATOM 1716 O GLN A 113 7.374 -1.905 3.507 1.00 0.00 O ATOM 1717 CB GLN A 113 8.358 -2.482 0.447 1.00 0.00 C ATOM 1718 CG GLN A 113 8.756 -1.894 -0.908 1.00 0.00 C ATOM 1719 CD GLN A 113 8.034 -2.611 -2.051 1.00 0.00 C ATOM 1720 OE1 GLN A 113 7.097 -3.365 -1.851 1.00 0.00 O ATOM 1721 NE2 GLN A 113 8.521 -2.333 -3.257 1.00 0.00 N ATOM 0 H GLN A 113 8.764 -0.137 1.170 1.00 0.00 H new ATOM 0 HA GLN A 113 6.426 -1.582 0.458 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.236 -2.550 1.090 1.00 0.00 H new ATOM 0 HB3 GLN A 113 7.983 -3.496 0.311 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.516 -0.831 -0.932 1.00 0.00 H new ATOM 0 HG3 GLN A 113 9.834 -1.980 -1.043 1.00 0.00 H new ATOM 0 HE21 GLN A 113 9.308 -1.692 -3.354 1.00 0.00 H new ATOM 0 HE22 GLN A 113 8.107 -2.761 -4.085 1.00 0.00 H new ATOM 1730 N LEU A 114 5.876 -3.144 2.350 1.00 0.00 N ATOM 1731 CA LEU A 114 5.356 -3.816 3.529 1.00 0.00 C ATOM 1732 C LEU A 114 6.197 -5.062 3.814 1.00 0.00 C ATOM 1733 O LEU A 114 6.663 -5.258 4.935 1.00 0.00 O ATOM 1734 CB LEU A 114 3.863 -4.107 3.364 1.00 0.00 C ATOM 1735 CG LEU A 114 2.965 -2.891 3.127 1.00 0.00 C ATOM 1736 CD1 LEU A 114 1.874 -3.206 2.101 1.00 0.00 C ATOM 1737 CD2 LEU A 114 2.381 -2.375 4.443 1.00 0.00 C ATOM 0 H LEU A 114 5.438 -3.423 1.472 1.00 0.00 H new ATOM 0 HA LEU A 114 5.437 -3.170 4.403 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.737 -4.795 2.528 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.513 -4.624 4.258 1.00 0.00 H new ATOM 0 HG LEU A 114 3.578 -2.091 2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.250 -2.325 1.951 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.335 -3.489 1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.259 -4.029 2.465 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.747 -1.511 4.246 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.788 -3.161 4.911 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.191 -2.085 5.112 1.00 0.00 H new ATOM 1749 N SER A 115 6.365 -5.873 2.779 1.00 0.00 N ATOM 1750 CA SER A 115 7.142 -7.094 2.905 1.00 0.00 C ATOM 1751 C SER A 115 7.668 -7.523 1.533 1.00 0.00 C ATOM 1752 O SER A 115 7.108 -7.147 0.505 1.00 0.00 O ATOM 1753 CB SER A 115 6.308 -8.216 3.527 1.00 0.00 C ATOM 1754 OG SER A 115 6.882 -8.698 4.739 1.00 0.00 O ATOM 0 H SER A 115 5.976 -5.708 1.850 1.00 0.00 H new ATOM 0 HA SER A 115 7.986 -6.896 3.566 1.00 0.00 H new ATOM 0 HB2 SER A 115 5.299 -7.852 3.723 1.00 0.00 H new ATOM 0 HB3 SER A 115 6.218 -9.038 2.816 1.00 0.00 H new ATOM 0 HG SER A 115 6.320 -9.412 5.106 1.00 0.00 H new ATOM 1760 N GLY A 116 8.738 -8.303 1.563 1.00 0.00 N ATOM 1761 CA GLY A 116 9.346 -8.787 0.335 1.00 0.00 C ATOM 1762 C GLY A 116 8.644 -10.051 -0.164 1.00 0.00 C ATOM 1763 O GLY A 116 7.839 -10.643 0.554 1.00 0.00 O ATOM 0 H GLY A 116 9.200 -8.612 2.418 1.00 0.00 H new ATOM 0 HA2 GLY A 116 9.295 -8.012 -0.430 1.00 0.00 H new ATOM 0 HA3 GLY A 116 10.402 -8.997 0.506 1.00 0.00 H new ATOM 1767 N PRO A 117 8.983 -10.439 -1.422 1.00 0.00 N ATOM 1768 CA PRO A 117 8.394 -11.622 -2.025 1.00 0.00 C ATOM 1769 C PRO A 117 8.997 -12.897 -1.433 1.00 0.00 C ATOM 1770 O PRO A 117 10.147 -12.900 -0.996 1.00 0.00 O ATOM 1771 CB PRO A 117 8.657 -11.477 -3.515 1.00 0.00 C ATOM 1772 CG PRO A 117 9.781 -10.462 -3.643 1.00 0.00 C ATOM 1773 CD PRO A 117 9.932 -9.763 -2.302 1.00 0.00 C ATOM 0 HA PRO A 117 7.325 -11.706 -1.829 1.00 0.00 H new ATOM 0 HB2 PRO A 117 8.941 -12.432 -3.956 1.00 0.00 H new ATOM 0 HB3 PRO A 117 7.763 -11.138 -4.038 1.00 0.00 H new ATOM 0 HG2 PRO A 117 10.711 -10.956 -3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.555 -9.739 -4.427 1.00 0.00 H new ATOM 0 HD2 PRO A 117 10.951 -9.847 -1.924 1.00 0.00 H new ATOM 0 HD3 PRO A 117 9.709 -8.699 -2.383 1.00 0.00 H new ATOM 1781 N SER A 118 8.194 -13.951 -1.437 1.00 0.00 N ATOM 1782 CA SER A 118 8.634 -15.230 -0.906 1.00 0.00 C ATOM 1783 C SER A 118 9.370 -15.020 0.419 1.00 0.00 C ATOM 1784 O SER A 118 10.583 -14.814 0.434 1.00 0.00 O ATOM 1785 CB SER A 118 9.535 -15.960 -1.903 1.00 0.00 C ATOM 1786 OG SER A 118 9.019 -17.244 -2.247 1.00 0.00 O ATOM 0 H SER A 118 7.241 -13.945 -1.800 1.00 0.00 H new ATOM 0 HA SER A 118 7.754 -15.849 -0.732 1.00 0.00 H new ATOM 0 HB2 SER A 118 9.640 -15.358 -2.805 1.00 0.00 H new ATOM 0 HB3 SER A 118 10.532 -16.072 -1.477 1.00 0.00 H new ATOM 0 HG SER A 118 9.621 -17.678 -2.887 1.00 0.00 H new ATOM 1792 N SER A 119 8.606 -15.080 1.500 1.00 0.00 N ATOM 1793 CA SER A 119 9.171 -14.900 2.827 1.00 0.00 C ATOM 1794 C SER A 119 8.596 -15.943 3.787 1.00 0.00 C ATOM 1795 O SER A 119 7.384 -16.153 3.828 1.00 0.00 O ATOM 1796 CB SER A 119 8.901 -13.489 3.353 1.00 0.00 C ATOM 1797 OG SER A 119 10.050 -12.653 3.253 1.00 0.00 O ATOM 0 H SER A 119 7.601 -15.251 1.484 1.00 0.00 H new ATOM 0 HA SER A 119 10.251 -15.034 2.760 1.00 0.00 H new ATOM 0 HB2 SER A 119 8.079 -13.044 2.792 1.00 0.00 H new ATOM 0 HB3 SER A 119 8.583 -13.545 4.394 1.00 0.00 H new ATOM 0 HG SER A 119 9.836 -11.761 3.597 1.00 0.00 H new ATOM 1803 N GLY A 120 9.492 -16.570 4.534 1.00 0.00 N ATOM 1804 CA GLY A 120 9.089 -17.587 5.491 1.00 0.00 C ATOM 1805 C GLY A 120 8.159 -18.613 4.841 1.00 0.00 C ATOM 1806 O GLY A 120 6.940 -18.520 4.969 1.00 0.00 O ATOM 0 H GLY A 120 10.496 -16.394 4.496 1.00 0.00 H new ATOM 0 HA2 GLY A 120 9.972 -18.090 5.886 1.00 0.00 H new ATOM 0 HA3 GLY A 120 8.585 -17.117 6.336 1.00 0.00 H new TER 1810 GLY A 120