USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1080 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 NoAdj-H: A 46 HIS HD1 : A 46 HIS ND1 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD NoAdj-H: A 63 HIS HD1 : A 63 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 71 HIS HD1 : A 71 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HD1 : A 80 HIS ND1 : A 154 ZNZN :(H bumps) USER MOD NoAdj-H: A 120 HIS HE2 : A 120 HIS NE2 : A 155 CU1CU :(H bumps) USER MOD Set 1.1: A 133 GLN : amide:sc= 1.1 K(o=3.5,f=-2.4!) USER MOD Set 1.2: A 137 THR OG1 : rot -60:sc= 2.11 USER MOD Set 1.3: A 139 ASN : amide:sc= 0.331 K(o=3.5,f=-3.6!) USER MOD Set 2.1: A 22 GLN : amide:sc= -1.07! C(o=0.064!,f=-6.4!) USER MOD Set 2.2: A 105 SER OG : rot 50:sc= 1.13 USER MOD Set 3.1: A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 98 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 39 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 43 HIS : +bothHN:sc= -2.24 K(o=-2.2,f=-7.2!) USER MOD Set 5.1: A 3 LYS NZ :NH3+ 152:sc= -0.876 (180deg=-0.761) USER MOD Set 5.2: A 153 GLN : amide:sc= -0.757 K(o=-1.6,f=-7.7!) USER MOD Single : A 1 ALA N :NH3+ 145:sc= 0.112 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 27:sc= 0.862 USER MOD Single : A 9 LYS NZ :NH3+ 135:sc= 2.02 (180deg=0.341) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.552 X(o=-0.55,f=-0.36) USER MOD Single : A 23 LYS NZ :NH3+ -146:sc= -0.431 (180deg=-1.87) USER MOD Single : A 25 SER OG : rot 180:sc= 0.0682 USER MOD Single : A 26 ASN : amide:sc=-0.00294 X(o=-0.0029,f=-0.0029) USER MOD Single : A 34 SER OG : rot -55:sc= -0.0588 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN :FLIP amide:sc= -0.123 F(o=-0.89!,f=-0.12) USER MOD Single : A 54 THR OG1 : rot 50:sc= 1.05 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 76:sc= 0.0345 USER MOD Single : A 65 ASN : amide:sc= 0.00958 X(o=0.0096,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ -153:sc= 0.274 (180deg=-2.27!) USER MOD Single : A 75 LYS NZ :NH3+ 174:sc=-0.00221 (180deg=-0.0467) USER MOD Single : A 86 ASN : amide:sc= -2.08! C(o=-2.1!,f=-2.4!) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -0.0035 X(o=-0.0035,f=-0.11) USER MOD Single : A 111 SER OG : rot 180:sc= -0.0685 USER MOD Single : A 116 THR OG1 : rot -72:sc= -0.0843 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 168:sc= -1.9! (180deg=-2!) USER MOD Single : A 131 ASN :FLIP amide:sc= -0.628 F(o=-4.7!,f=-0.63) USER MOD Single : A 134 SER OG : rot 120:sc= 0.264 USER MOD Single : A 135 THR OG1 : rot 4:sc= -0.0778 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 SER OG : rot 180:sc= 0.00372 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 16.916 10.786 5.215 1.00 0.00 N ATOM 2 CA ALA A 1 16.556 10.149 6.492 1.00 0.00 C ATOM 3 C ALA A 1 15.058 9.874 6.477 1.00 0.00 C ATOM 4 O ALA A 1 14.336 10.659 5.867 1.00 0.00 O ATOM 5 CB ALA A 1 16.933 11.006 7.704 1.00 0.00 C ATOM 0 H1 ALA A 1 17.672 11.482 5.375 1.00 0.00 H new ATOM 0 H2 ALA A 1 17.248 10.061 4.547 1.00 0.00 H new ATOM 0 H3 ALA A 1 16.083 11.266 4.819 1.00 0.00 H new ATOM 0 HA ALA A 1 17.119 9.221 6.590 1.00 0.00 H new ATOM 0 HB1 ALA A 1 16.645 10.489 8.619 1.00 0.00 H new ATOM 0 HB2 ALA A 1 18.009 11.178 7.708 1.00 0.00 H new ATOM 0 HB3 ALA A 1 16.413 11.963 7.649 1.00 0.00 H new ATOM 13 N THR A 2 14.599 8.782 7.093 1.00 0.00 N ATOM 14 CA THR A 2 13.205 8.360 7.093 1.00 0.00 C ATOM 15 C THR A 2 13.060 7.288 8.166 1.00 0.00 C ATOM 16 O THR A 2 13.912 6.408 8.257 1.00 0.00 O ATOM 17 CB THR A 2 12.831 7.821 5.701 1.00 0.00 C ATOM 18 OG1 THR A 2 12.562 8.882 4.813 1.00 0.00 O ATOM 19 CG2 THR A 2 11.673 6.815 5.660 1.00 0.00 C ATOM 0 H THR A 2 15.207 8.153 7.618 1.00 0.00 H new ATOM 0 HA THR A 2 12.533 9.190 7.311 1.00 0.00 H new ATOM 0 HB THR A 2 13.712 7.260 5.390 1.00 0.00 H new ATOM 0 HG1 THR A 2 13.055 9.680 5.098 1.00 0.00 H new ATOM 0 HG21 THR A 2 11.498 6.504 4.630 1.00 0.00 H new ATOM 0 HG22 THR A 2 11.926 5.944 6.264 1.00 0.00 H new ATOM 0 HG23 THR A 2 10.771 7.282 6.056 1.00 0.00 H new ATOM 27 N LYS A 3 11.990 7.386 8.959 1.00 0.00 N ATOM 28 CA LYS A 3 11.571 6.390 9.930 1.00 0.00 C ATOM 29 C LYS A 3 10.104 6.663 10.283 1.00 0.00 C ATOM 30 O LYS A 3 9.808 7.375 11.247 1.00 0.00 O ATOM 31 CB LYS A 3 12.497 6.373 11.153 1.00 0.00 C ATOM 32 CG LYS A 3 12.757 7.747 11.793 1.00 0.00 C ATOM 33 CD LYS A 3 12.397 7.672 13.279 1.00 0.00 C ATOM 34 CE LYS A 3 12.945 8.850 14.088 1.00 0.00 C ATOM 35 NZ LYS A 3 12.500 8.716 15.485 1.00 0.00 N ATOM 0 H LYS A 3 11.372 8.197 8.936 1.00 0.00 H new ATOM 0 HA LYS A 3 11.647 5.388 9.508 1.00 0.00 H new ATOM 0 HB2 LYS A 3 12.066 5.714 11.907 1.00 0.00 H new ATOM 0 HB3 LYS A 3 13.453 5.939 10.860 1.00 0.00 H new ATOM 0 HG2 LYS A 3 13.803 8.029 11.671 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.161 8.513 11.298 1.00 0.00 H new ATOM 0 HD2 LYS A 3 11.312 7.640 13.383 1.00 0.00 H new ATOM 0 HD3 LYS A 3 12.784 6.742 13.694 1.00 0.00 H new ATOM 0 HE2 LYS A 3 14.034 8.867 14.039 1.00 0.00 H new ATOM 0 HE3 LYS A 3 12.592 9.792 13.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 13.191 9.172 16.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 11.573 9.173 15.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 12.422 7.708 15.729 1.00 0.00 H new ATOM 49 N ALA A 4 9.188 6.146 9.461 1.00 0.00 N ATOM 50 CA ALA A 4 7.752 6.338 9.643 1.00 0.00 C ATOM 51 C ALA A 4 7.071 5.000 9.887 1.00 0.00 C ATOM 52 O ALA A 4 7.668 3.956 9.636 1.00 0.00 O ATOM 53 CB ALA A 4 7.150 7.039 8.427 1.00 0.00 C ATOM 0 H ALA A 4 9.426 5.580 8.647 1.00 0.00 H new ATOM 0 HA ALA A 4 7.590 6.971 10.515 1.00 0.00 H new ATOM 0 HB1 ALA A 4 6.079 7.175 8.578 1.00 0.00 H new ATOM 0 HB2 ALA A 4 7.624 8.012 8.296 1.00 0.00 H new ATOM 0 HB3 ALA A 4 7.317 6.432 7.537 1.00 0.00 H new ATOM 59 N VAL A 5 5.826 5.041 10.354 1.00 0.00 N ATOM 60 CA VAL A 5 4.983 3.896 10.643 1.00 0.00 C ATOM 61 C VAL A 5 3.576 4.236 10.151 1.00 0.00 C ATOM 62 O VAL A 5 3.185 5.402 10.236 1.00 0.00 O ATOM 63 CB VAL A 5 5.051 3.581 12.155 1.00 0.00 C ATOM 64 CG1 VAL A 5 4.544 4.741 13.024 1.00 0.00 C ATOM 65 CG2 VAL A 5 4.306 2.299 12.546 1.00 0.00 C ATOM 0 H VAL A 5 5.357 5.925 10.550 1.00 0.00 H new ATOM 0 HA VAL A 5 5.314 2.992 10.132 1.00 0.00 H new ATOM 0 HB VAL A 5 6.113 3.429 12.349 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.614 4.465 14.076 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.152 5.627 12.840 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.505 4.956 12.774 1.00 0.00 H new ATOM 0 HG21 VAL A 5 4.395 2.140 13.621 1.00 0.00 H new ATOM 0 HG22 VAL A 5 3.253 2.394 12.280 1.00 0.00 H new ATOM 0 HG23 VAL A 5 4.739 1.451 12.016 1.00 0.00 H new ATOM 75 N ALA A 6 2.822 3.261 9.624 1.00 0.00 N ATOM 76 CA ALA A 6 1.386 3.431 9.431 1.00 0.00 C ATOM 77 C ALA A 6 0.664 2.244 10.053 1.00 0.00 C ATOM 78 O ALA A 6 0.753 1.130 9.543 1.00 0.00 O ATOM 79 CB ALA A 6 1.030 3.621 7.953 1.00 0.00 C ATOM 0 H ALA A 6 3.185 2.355 9.328 1.00 0.00 H new ATOM 0 HA ALA A 6 1.058 4.342 9.931 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.048 3.744 7.851 1.00 0.00 H new ATOM 0 HB2 ALA A 6 1.534 4.507 7.568 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.350 2.747 7.386 1.00 0.00 H new ATOM 85 N VAL A 7 -0.020 2.469 11.175 1.00 0.00 N ATOM 86 CA VAL A 7 -0.764 1.441 11.865 1.00 0.00 C ATOM 87 C VAL A 7 -2.140 1.292 11.208 1.00 0.00 C ATOM 88 O VAL A 7 -3.100 1.971 11.559 1.00 0.00 O ATOM 89 CB VAL A 7 -0.778 1.727 13.378 1.00 0.00 C ATOM 90 CG1 VAL A 7 0.661 1.831 13.904 1.00 0.00 C ATOM 91 CG2 VAL A 7 -1.551 2.980 13.820 1.00 0.00 C ATOM 0 H VAL A 7 -0.067 3.382 11.627 1.00 0.00 H new ATOM 0 HA VAL A 7 -0.286 0.466 11.772 1.00 0.00 H new ATOM 0 HB VAL A 7 -1.316 0.881 13.806 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.643 2.033 14.975 1.00 0.00 H new ATOM 0 HG12 VAL A 7 1.184 0.892 13.721 1.00 0.00 H new ATOM 0 HG13 VAL A 7 1.179 2.641 13.390 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -1.492 3.080 14.904 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -1.115 3.861 13.350 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -2.595 2.888 13.520 1.00 0.00 H new ATOM 101 N LEU A 8 -2.233 0.403 10.220 1.00 0.00 N ATOM 102 CA LEU A 8 -3.498 -0.017 9.658 1.00 0.00 C ATOM 103 C LEU A 8 -4.368 -0.613 10.763 1.00 0.00 C ATOM 104 O LEU A 8 -3.859 -1.372 11.587 1.00 0.00 O ATOM 105 CB LEU A 8 -3.250 -1.021 8.519 1.00 0.00 C ATOM 106 CG LEU A 8 -3.138 -0.315 7.161 1.00 0.00 C ATOM 107 CD1 LEU A 8 -1.847 0.506 7.068 1.00 0.00 C ATOM 108 CD2 LEU A 8 -3.156 -1.378 6.062 1.00 0.00 C ATOM 0 H LEU A 8 -1.423 -0.044 9.790 1.00 0.00 H new ATOM 0 HA LEU A 8 -4.027 0.837 9.236 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -2.334 -1.578 8.717 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -4.064 -1.745 8.488 1.00 0.00 H new ATOM 0 HG LEU A 8 -3.977 0.371 7.044 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -1.796 0.994 6.095 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.839 1.261 7.854 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.987 -0.153 7.189 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.077 -0.895 5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -2.315 -2.058 6.199 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -4.089 -1.940 6.114 1.00 0.00 H new ATOM 120 N LYS A 9 -5.666 -0.295 10.761 1.00 0.00 N ATOM 121 CA LYS A 9 -6.692 -0.946 11.563 1.00 0.00 C ATOM 122 C LYS A 9 -7.982 -0.912 10.728 1.00 0.00 C ATOM 123 O LYS A 9 -8.221 0.063 10.014 1.00 0.00 O ATOM 124 CB LYS A 9 -6.851 -0.273 12.936 1.00 0.00 C ATOM 125 CG LYS A 9 -6.660 -1.264 14.091 1.00 0.00 C ATOM 126 CD LYS A 9 -7.792 -2.309 14.238 1.00 0.00 C ATOM 127 CE LYS A 9 -9.055 -1.732 14.909 1.00 0.00 C ATOM 128 NZ LYS A 9 -10.229 -2.614 14.763 1.00 0.00 N ATOM 0 H LYS A 9 -6.040 0.453 10.176 1.00 0.00 H new ATOM 0 HA LYS A 9 -6.422 -1.977 11.791 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -6.126 0.535 13.029 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -7.841 0.178 13.006 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -5.715 -1.789 13.949 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.577 -0.704 15.023 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -8.054 -2.695 13.253 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.428 -3.152 14.825 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -8.857 -1.570 15.968 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.280 -0.758 14.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -10.723 -2.689 15.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -10.875 -2.217 14.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.918 -3.559 14.460 1.00 0.00 H new ATOM 142 N GLY A 10 -8.790 -1.974 10.756 1.00 0.00 N ATOM 143 CA GLY A 10 -10.074 -2.006 10.079 1.00 0.00 C ATOM 144 C GLY A 10 -11.195 -2.121 11.082 1.00 0.00 C ATOM 145 O GLY A 10 -10.976 -2.027 12.289 1.00 0.00 O ATOM 0 H GLY A 10 -8.565 -2.836 11.253 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -10.201 -1.102 9.484 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -10.107 -2.849 9.389 1.00 0.00 H new ATOM 149 N ASP A 11 -12.398 -2.363 10.576 1.00 0.00 N ATOM 150 CA ASP A 11 -13.573 -2.586 11.397 1.00 0.00 C ATOM 151 C ASP A 11 -13.312 -3.762 12.355 1.00 0.00 C ATOM 152 O ASP A 11 -13.561 -3.682 13.561 1.00 0.00 O ATOM 153 CB ASP A 11 -14.780 -2.842 10.483 1.00 0.00 C ATOM 154 CG ASP A 11 -16.082 -2.463 11.169 1.00 0.00 C ATOM 155 OD1 ASP A 11 -16.377 -3.083 12.209 1.00 0.00 O ATOM 156 OD2 ASP A 11 -16.750 -1.554 10.636 1.00 0.00 O ATOM 0 H ASP A 11 -12.583 -2.410 9.574 1.00 0.00 H new ATOM 0 HA ASP A 11 -13.792 -1.708 12.005 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -14.671 -2.268 9.563 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -14.808 -3.894 10.200 1.00 0.00 H new ATOM 161 N GLY A 12 -12.711 -4.840 11.826 1.00 0.00 N ATOM 162 CA GLY A 12 -12.499 -6.062 12.569 1.00 0.00 C ATOM 163 C GLY A 12 -11.160 -5.999 13.293 1.00 0.00 C ATOM 164 O GLY A 12 -10.659 -4.922 13.625 1.00 0.00 O ATOM 0 H GLY A 12 -12.363 -4.874 10.868 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -13.305 -6.206 13.288 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -12.518 -6.917 11.894 1.00 0.00 H new ATOM 168 N PRO A 13 -10.534 -7.157 13.525 1.00 0.00 N ATOM 169 CA PRO A 13 -9.239 -7.218 14.167 1.00 0.00 C ATOM 170 C PRO A 13 -8.115 -6.885 13.180 1.00 0.00 C ATOM 171 O PRO A 13 -6.988 -6.670 13.618 1.00 0.00 O ATOM 172 CB PRO A 13 -9.135 -8.639 14.720 1.00 0.00 C ATOM 173 CG PRO A 13 -9.963 -9.464 13.736 1.00 0.00 C ATOM 174 CD PRO A 13 -11.025 -8.486 13.213 1.00 0.00 C ATOM 0 HA PRO A 13 -9.136 -6.482 14.964 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -8.100 -8.980 14.759 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -9.531 -8.706 15.733 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.346 -9.851 12.925 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -10.421 -10.323 14.226 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.171 -8.606 12.139 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.989 -8.667 13.688 1.00 0.00 H new ATOM 182 N VAL A 14 -8.425 -6.831 11.873 1.00 0.00 N ATOM 183 CA VAL A 14 -7.494 -6.478 10.811 1.00 0.00 C ATOM 184 C VAL A 14 -6.656 -5.278 11.225 1.00 0.00 C ATOM 185 O VAL A 14 -7.189 -4.175 11.343 1.00 0.00 O ATOM 186 CB VAL A 14 -8.224 -6.209 9.481 1.00 0.00 C ATOM 187 CG1 VAL A 14 -7.185 -6.196 8.349 1.00 0.00 C ATOM 188 CG2 VAL A 14 -9.308 -7.247 9.160 1.00 0.00 C ATOM 0 H VAL A 14 -9.361 -7.040 11.526 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.831 -7.328 10.648 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.730 -5.248 9.575 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -7.684 -6.007 7.399 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -6.452 -5.411 8.537 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -6.680 -7.161 8.307 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.781 -6.997 8.211 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.855 -8.236 9.090 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.058 -7.246 9.951 1.00 0.00 H new ATOM 198 N GLN A 15 -5.362 -5.509 11.444 1.00 0.00 N ATOM 199 CA GLN A 15 -4.385 -4.498 11.799 1.00 0.00 C ATOM 200 C GLN A 15 -3.186 -4.661 10.870 1.00 0.00 C ATOM 201 O GLN A 15 -2.957 -5.767 10.395 1.00 0.00 O ATOM 202 CB GLN A 15 -4.012 -4.674 13.280 1.00 0.00 C ATOM 203 CG GLN A 15 -2.691 -3.983 13.629 1.00 0.00 C ATOM 204 CD GLN A 15 -2.479 -3.862 15.132 1.00 0.00 C ATOM 205 OE1 GLN A 15 -2.101 -4.828 15.789 1.00 0.00 O ATOM 206 NE2 GLN A 15 -2.707 -2.669 15.677 1.00 0.00 N ATOM 0 H GLN A 15 -4.957 -6.443 11.375 1.00 0.00 H new ATOM 0 HA GLN A 15 -4.775 -3.487 11.678 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -4.808 -4.269 13.904 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -3.936 -5.737 13.510 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -1.864 -4.543 13.192 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -2.674 -2.989 13.181 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.020 -1.893 15.094 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -2.568 -2.531 16.678 1.00 0.00 H new ATOM 215 N GLY A 16 -2.408 -3.603 10.618 1.00 0.00 N ATOM 216 CA GLY A 16 -1.134 -3.736 9.918 1.00 0.00 C ATOM 217 C GLY A 16 -0.121 -2.665 10.289 1.00 0.00 C ATOM 218 O GLY A 16 -0.289 -1.500 9.955 1.00 0.00 O ATOM 0 H GLY A 16 -2.641 -2.648 10.890 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -0.710 -4.716 10.136 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.314 -3.698 8.844 1.00 0.00 H new ATOM 222 N ILE A 17 0.954 -3.059 10.963 1.00 0.00 N ATOM 223 CA ILE A 17 1.994 -2.148 11.407 1.00 0.00 C ATOM 224 C ILE A 17 2.967 -1.945 10.238 1.00 0.00 C ATOM 225 O ILE A 17 3.950 -2.676 10.124 1.00 0.00 O ATOM 226 CB ILE A 17 2.639 -2.742 12.676 1.00 0.00 C ATOM 227 CG1 ILE A 17 1.580 -2.915 13.790 1.00 0.00 C ATOM 228 CG2 ILE A 17 3.775 -1.849 13.195 1.00 0.00 C ATOM 229 CD1 ILE A 17 1.940 -4.051 14.751 1.00 0.00 C ATOM 0 H ILE A 17 1.126 -4.032 11.218 1.00 0.00 H new ATOM 0 HA ILE A 17 1.618 -1.162 11.681 1.00 0.00 H new ATOM 0 HB ILE A 17 3.052 -3.715 12.408 1.00 0.00 H new ATOM 0 HG12 ILE A 17 1.486 -1.984 14.348 1.00 0.00 H new ATOM 0 HG13 ILE A 17 0.608 -3.116 13.339 1.00 0.00 H new ATOM 0 HG21 ILE A 17 4.209 -2.295 14.090 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.543 -1.755 12.428 1.00 0.00 H new ATOM 0 HG23 ILE A 17 3.381 -0.862 13.437 1.00 0.00 H new ATOM 0 HD11 ILE A 17 1.170 -4.137 15.517 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.008 -4.988 14.198 1.00 0.00 H new ATOM 0 HD13 ILE A 17 2.899 -3.838 15.223 1.00 0.00 H new ATOM 241 N ILE A 18 2.672 -0.989 9.347 1.00 0.00 N ATOM 242 CA ILE A 18 3.560 -0.621 8.247 1.00 0.00 C ATOM 243 C ILE A 18 4.670 0.252 8.802 1.00 0.00 C ATOM 244 O ILE A 18 4.447 0.943 9.789 1.00 0.00 O ATOM 245 CB ILE A 18 2.798 0.151 7.155 1.00 0.00 C ATOM 246 CG1 ILE A 18 1.671 -0.685 6.537 1.00 0.00 C ATOM 247 CG2 ILE A 18 3.725 0.683 6.050 1.00 0.00 C ATOM 248 CD1 ILE A 18 2.250 -1.675 5.534 1.00 0.00 C ATOM 0 H ILE A 18 1.807 -0.450 9.373 1.00 0.00 H new ATOM 0 HA ILE A 18 3.968 -1.527 7.798 1.00 0.00 H new ATOM 0 HB ILE A 18 2.354 1.009 7.660 1.00 0.00 H new ATOM 0 HG12 ILE A 18 1.132 -1.220 7.319 1.00 0.00 H new ATOM 0 HG13 ILE A 18 0.951 -0.032 6.043 1.00 0.00 H new ATOM 0 HG21 ILE A 18 3.135 1.219 5.307 1.00 0.00 H new ATOM 0 HG22 ILE A 18 4.460 1.359 6.486 1.00 0.00 H new ATOM 0 HG23 ILE A 18 4.238 -0.152 5.573 1.00 0.00 H new ATOM 0 HD11 ILE A 18 1.444 -2.266 5.099 1.00 0.00 H new ATOM 0 HD12 ILE A 18 2.769 -1.132 4.744 1.00 0.00 H new ATOM 0 HD13 ILE A 18 2.952 -2.337 6.040 1.00 0.00 H new ATOM 260 N ASN A 19 5.834 0.241 8.153 1.00 0.00 N ATOM 261 CA ASN A 19 7.059 0.900 8.557 1.00 0.00 C ATOM 262 C ASN A 19 7.753 1.348 7.272 1.00 0.00 C ATOM 263 O ASN A 19 7.825 0.580 6.309 1.00 0.00 O ATOM 264 CB ASN A 19 7.967 -0.045 9.357 1.00 0.00 C ATOM 265 CG ASN A 19 7.197 -0.958 10.308 1.00 0.00 C ATOM 266 OD1 ASN A 19 7.081 -0.687 11.498 1.00 0.00 O ATOM 267 ND2 ASN A 19 6.628 -2.032 9.765 1.00 0.00 N ATOM 0 H ASN A 19 5.945 -0.264 7.274 1.00 0.00 H new ATOM 0 HA ASN A 19 6.841 1.746 9.209 1.00 0.00 H new ATOM 0 HB2 ASN A 19 8.544 -0.657 8.664 1.00 0.00 H new ATOM 0 HB3 ASN A 19 8.681 0.547 9.930 1.00 0.00 H new ATOM 0 HD21 ASN A 19 6.073 -2.662 10.343 1.00 0.00 H new ATOM 0 HD22 ASN A 19 6.747 -2.224 8.770 1.00 0.00 H new ATOM 274 N PHE A 20 8.237 2.588 7.247 1.00 0.00 N ATOM 275 CA PHE A 20 8.962 3.165 6.128 1.00 0.00 C ATOM 276 C PHE A 20 10.355 3.534 6.627 1.00 0.00 C ATOM 277 O PHE A 20 10.454 4.327 7.566 1.00 0.00 O ATOM 278 CB PHE A 20 8.244 4.418 5.617 1.00 0.00 C ATOM 279 CG PHE A 20 6.830 4.203 5.101 1.00 0.00 C ATOM 280 CD1 PHE A 20 5.741 4.108 5.988 1.00 0.00 C ATOM 281 CD2 PHE A 20 6.599 4.143 3.716 1.00 0.00 C ATOM 282 CE1 PHE A 20 4.435 3.961 5.487 1.00 0.00 C ATOM 283 CE2 PHE A 20 5.293 4.017 3.214 1.00 0.00 C ATOM 284 CZ PHE A 20 4.209 3.920 4.100 1.00 0.00 C ATOM 0 H PHE A 20 8.130 3.234 8.029 1.00 0.00 H new ATOM 0 HA PHE A 20 9.020 2.452 5.306 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.209 5.149 6.425 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.841 4.855 4.817 1.00 0.00 H new ATOM 0 HD1 PHE A 20 5.909 4.148 7.054 1.00 0.00 H new ATOM 0 HD2 PHE A 20 7.433 4.194 3.032 1.00 0.00 H new ATOM 0 HE1 PHE A 20 3.603 3.879 6.170 1.00 0.00 H new ATOM 0 HE2 PHE A 20 5.123 3.995 2.148 1.00 0.00 H new ATOM 0 HZ PHE A 20 3.205 3.814 3.718 1.00 0.00 H new ATOM 294 N GLU A 21 11.400 2.996 5.988 1.00 0.00 N ATOM 295 CA GLU A 21 12.799 3.359 6.226 1.00 0.00 C ATOM 296 C GLU A 21 13.442 3.748 4.892 1.00 0.00 C ATOM 297 O GLU A 21 13.192 3.128 3.859 1.00 0.00 O ATOM 298 CB GLU A 21 13.617 2.271 6.957 1.00 0.00 C ATOM 299 CG GLU A 21 15.028 2.814 7.309 1.00 0.00 C ATOM 300 CD GLU A 21 15.936 1.867 8.094 1.00 0.00 C ATOM 301 OE1 GLU A 21 15.428 0.807 8.517 1.00 0.00 O ATOM 302 OE2 GLU A 21 17.128 2.235 8.260 1.00 0.00 O ATOM 0 H GLU A 21 11.292 2.277 5.272 1.00 0.00 H new ATOM 0 HA GLU A 21 12.806 4.209 6.909 1.00 0.00 H new ATOM 0 HB2 GLU A 21 13.099 1.964 7.866 1.00 0.00 H new ATOM 0 HB3 GLU A 21 13.706 1.386 6.327 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.533 3.084 6.382 1.00 0.00 H new ATOM 0 HG3 GLU A 21 14.909 3.731 7.885 1.00 0.00 H new ATOM 309 N GLN A 22 14.237 4.817 4.942 1.00 0.00 N ATOM 310 CA GLN A 22 15.109 5.303 3.892 1.00 0.00 C ATOM 311 C GLN A 22 16.119 6.232 4.570 1.00 0.00 C ATOM 312 O GLN A 22 15.959 7.459 4.605 1.00 0.00 O ATOM 313 CB GLN A 22 14.317 6.067 2.832 1.00 0.00 C ATOM 314 CG GLN A 22 15.158 6.175 1.558 1.00 0.00 C ATOM 315 CD GLN A 22 14.581 7.223 0.622 1.00 0.00 C ATOM 316 OE1 GLN A 22 13.624 6.977 -0.090 1.00 0.00 O ATOM 317 NE2 GLN A 22 15.143 8.421 0.635 1.00 0.00 N ATOM 0 H GLN A 22 14.286 5.400 5.777 1.00 0.00 H new ATOM 0 HA GLN A 22 15.603 4.475 3.383 1.00 0.00 H new ATOM 0 HB2 GLN A 22 13.379 5.553 2.621 1.00 0.00 H new ATOM 0 HB3 GLN A 22 14.060 7.061 3.198 1.00 0.00 H new ATOM 0 HG2 GLN A 22 16.185 6.435 1.815 1.00 0.00 H new ATOM 0 HG3 GLN A 22 15.191 5.209 1.055 1.00 0.00 H new ATOM 0 HE21 GLN A 22 15.944 8.602 1.240 1.00 0.00 H new ATOM 0 HE22 GLN A 22 14.775 9.163 0.040 1.00 0.00 H new ATOM 326 N LYS A 23 17.150 5.662 5.178 1.00 0.00 N ATOM 327 CA LYS A 23 18.168 6.478 5.809 1.00 0.00 C ATOM 328 C LYS A 23 18.946 7.235 4.721 1.00 0.00 C ATOM 329 O LYS A 23 19.403 8.355 4.944 1.00 0.00 O ATOM 330 CB LYS A 23 19.013 5.615 6.761 1.00 0.00 C ATOM 331 CG LYS A 23 19.050 6.213 8.179 1.00 0.00 C ATOM 332 CD LYS A 23 19.227 5.174 9.296 1.00 0.00 C ATOM 333 CE LYS A 23 20.488 4.307 9.179 1.00 0.00 C ATOM 334 NZ LYS A 23 20.328 3.240 8.170 1.00 0.00 N ATOM 0 H LYS A 23 17.300 4.655 5.246 1.00 0.00 H new ATOM 0 HA LYS A 23 17.737 7.248 6.448 1.00 0.00 H new ATOM 0 HB2 LYS A 23 18.602 4.606 6.801 1.00 0.00 H new ATOM 0 HB3 LYS A 23 20.028 5.531 6.374 1.00 0.00 H new ATOM 0 HG2 LYS A 23 19.866 6.934 8.236 1.00 0.00 H new ATOM 0 HG3 LYS A 23 18.125 6.763 8.353 1.00 0.00 H new ATOM 0 HD2 LYS A 23 19.248 5.693 10.254 1.00 0.00 H new ATOM 0 HD3 LYS A 23 18.354 4.521 9.306 1.00 0.00 H new ATOM 0 HE2 LYS A 23 21.338 4.935 8.912 1.00 0.00 H new ATOM 0 HE3 LYS A 23 20.713 3.861 10.148 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 20.849 2.393 8.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 19.320 3.007 8.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 20.702 3.567 7.257 1.00 0.00 H new ATOM 348 N GLU A 24 19.014 6.635 3.532 1.00 0.00 N ATOM 349 CA GLU A 24 19.661 7.105 2.337 1.00 0.00 C ATOM 350 C GLU A 24 19.064 8.442 1.910 1.00 0.00 C ATOM 351 O GLU A 24 17.855 8.551 1.682 1.00 0.00 O ATOM 352 CB GLU A 24 19.442 6.062 1.233 1.00 0.00 C ATOM 353 CG GLU A 24 19.718 4.606 1.647 1.00 0.00 C ATOM 354 CD GLU A 24 18.470 3.924 2.197 1.00 0.00 C ATOM 355 OE1 GLU A 24 17.711 3.384 1.371 1.00 0.00 O ATOM 356 OE2 GLU A 24 18.256 4.046 3.426 1.00 0.00 O ATOM 0 H GLU A 24 18.574 5.727 3.383 1.00 0.00 H new ATOM 0 HA GLU A 24 20.726 7.246 2.519 1.00 0.00 H new ATOM 0 HB2 GLU A 24 18.412 6.135 0.885 1.00 0.00 H new ATOM 0 HB3 GLU A 24 20.083 6.311 0.387 1.00 0.00 H new ATOM 0 HG2 GLU A 24 20.087 4.048 0.787 1.00 0.00 H new ATOM 0 HG3 GLU A 24 20.505 4.586 2.401 1.00 0.00 H new ATOM 363 N SER A 25 19.923 9.450 1.764 1.00 0.00 N ATOM 364 CA SER A 25 19.557 10.791 1.358 1.00 0.00 C ATOM 365 C SER A 25 18.692 10.801 0.099 1.00 0.00 C ATOM 366 O SER A 25 17.731 11.559 0.024 1.00 0.00 O ATOM 367 CB SER A 25 20.850 11.591 1.172 1.00 0.00 C ATOM 368 OG SER A 25 21.745 11.253 2.218 1.00 0.00 O ATOM 0 H SER A 25 20.923 9.344 1.932 1.00 0.00 H new ATOM 0 HA SER A 25 18.941 11.252 2.130 1.00 0.00 H new ATOM 0 HB2 SER A 25 21.298 11.367 0.204 1.00 0.00 H new ATOM 0 HB3 SER A 25 20.639 12.660 1.186 1.00 0.00 H new ATOM 0 HG SER A 25 22.579 11.757 2.111 1.00 0.00 H new ATOM 374 N ASN A 26 19.045 9.962 -0.880 1.00 0.00 N ATOM 375 CA ASN A 26 18.279 9.795 -2.109 1.00 0.00 C ATOM 376 C ASN A 26 18.247 8.315 -2.489 1.00 0.00 C ATOM 377 O ASN A 26 18.414 7.980 -3.660 1.00 0.00 O ATOM 378 CB ASN A 26 18.877 10.654 -3.239 1.00 0.00 C ATOM 379 CG ASN A 26 18.708 12.152 -3.002 1.00 0.00 C ATOM 380 OD1 ASN A 26 17.709 12.742 -3.399 1.00 0.00 O ATOM 381 ND2 ASN A 26 19.692 12.794 -2.375 1.00 0.00 N ATOM 0 H ASN A 26 19.879 9.376 -0.837 1.00 0.00 H new ATOM 0 HA ASN A 26 17.256 10.134 -1.949 1.00 0.00 H new ATOM 0 HB2 ASN A 26 19.938 10.425 -3.339 1.00 0.00 H new ATOM 0 HB3 ASN A 26 18.402 10.385 -4.183 1.00 0.00 H new ATOM 0 HD21 ASN A 26 19.625 13.799 -2.215 1.00 0.00 H new ATOM 0 HD22 ASN A 26 20.513 12.281 -2.054 1.00 0.00 H new ATOM 388 N GLY A 27 18.056 7.416 -1.514 1.00 0.00 N ATOM 389 CA GLY A 27 17.778 6.020 -1.854 1.00 0.00 C ATOM 390 C GLY A 27 16.296 5.844 -2.194 1.00 0.00 C ATOM 391 O GLY A 27 15.552 6.821 -2.177 1.00 0.00 O ATOM 0 H GLY A 27 18.088 7.623 -0.516 1.00 0.00 H new ATOM 0 HA2 GLY A 27 18.392 5.715 -2.702 1.00 0.00 H new ATOM 0 HA3 GLY A 27 18.046 5.374 -1.018 1.00 0.00 H new ATOM 395 N PRO A 28 15.853 4.615 -2.496 1.00 0.00 N ATOM 396 CA PRO A 28 14.445 4.281 -2.637 1.00 0.00 C ATOM 397 C PRO A 28 13.855 4.002 -1.251 1.00 0.00 C ATOM 398 O PRO A 28 14.502 3.358 -0.428 1.00 0.00 O ATOM 399 CB PRO A 28 14.444 3.023 -3.508 1.00 0.00 C ATOM 400 CG PRO A 28 15.732 2.306 -3.089 1.00 0.00 C ATOM 401 CD PRO A 28 16.689 3.448 -2.731 1.00 0.00 C ATOM 0 HA PRO A 28 13.847 5.076 -3.081 1.00 0.00 H new ATOM 0 HB2 PRO A 28 13.563 2.408 -3.326 1.00 0.00 H new ATOM 0 HB3 PRO A 28 14.447 3.268 -4.570 1.00 0.00 H new ATOM 0 HG2 PRO A 28 15.563 1.645 -2.239 1.00 0.00 H new ATOM 0 HG3 PRO A 28 16.128 1.691 -3.897 1.00 0.00 H new ATOM 0 HD2 PRO A 28 17.274 3.203 -1.845 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.397 3.632 -3.540 1.00 0.00 H new ATOM 409 N VAL A 29 12.629 4.453 -0.974 1.00 0.00 N ATOM 410 CA VAL A 29 11.972 4.175 0.285 1.00 0.00 C ATOM 411 C VAL A 29 11.737 2.686 0.352 1.00 0.00 C ATOM 412 O VAL A 29 11.084 2.143 -0.537 1.00 0.00 O ATOM 413 CB VAL A 29 10.632 4.919 0.385 1.00 0.00 C ATOM 414 CG1 VAL A 29 9.706 4.304 1.431 1.00 0.00 C ATOM 415 CG2 VAL A 29 10.849 6.368 0.799 1.00 0.00 C ATOM 0 H VAL A 29 12.075 5.017 -1.618 1.00 0.00 H new ATOM 0 HA VAL A 29 12.596 4.512 1.112 1.00 0.00 H new ATOM 0 HB VAL A 29 10.179 4.848 -0.604 1.00 0.00 H new ATOM 0 HG11 VAL A 29 8.772 4.865 1.465 1.00 0.00 H new ATOM 0 HG12 VAL A 29 9.498 3.267 1.168 1.00 0.00 H new ATOM 0 HG13 VAL A 29 10.186 4.341 2.409 1.00 0.00 H new ATOM 0 HG21 VAL A 29 9.887 6.876 0.864 1.00 0.00 H new ATOM 0 HG22 VAL A 29 11.342 6.399 1.771 1.00 0.00 H new ATOM 0 HG23 VAL A 29 11.474 6.868 0.059 1.00 0.00 H new ATOM 425 N LYS A 30 12.206 2.072 1.437 1.00 0.00 N ATOM 426 CA LYS A 30 11.861 0.709 1.772 1.00 0.00 C ATOM 427 C LYS A 30 10.548 0.743 2.544 1.00 0.00 C ATOM 428 O LYS A 30 10.480 1.286 3.649 1.00 0.00 O ATOM 429 CB LYS A 30 12.984 -0.005 2.542 1.00 0.00 C ATOM 430 CG LYS A 30 13.006 -1.454 2.046 1.00 0.00 C ATOM 431 CD LYS A 30 13.783 -2.421 2.946 1.00 0.00 C ATOM 432 CE LYS A 30 13.582 -3.845 2.395 1.00 0.00 C ATOM 433 NZ LYS A 30 14.179 -4.886 3.253 1.00 0.00 N ATOM 0 H LYS A 30 12.837 2.515 2.105 1.00 0.00 H new ATOM 0 HA LYS A 30 11.735 0.122 0.862 1.00 0.00 H new ATOM 0 HB2 LYS A 30 13.944 0.480 2.364 1.00 0.00 H new ATOM 0 HB3 LYS A 30 12.802 0.034 3.616 1.00 0.00 H new ATOM 0 HG2 LYS A 30 11.980 -1.809 1.953 1.00 0.00 H new ATOM 0 HG3 LYS A 30 13.442 -1.477 1.047 1.00 0.00 H new ATOM 0 HD2 LYS A 30 14.842 -2.163 2.959 1.00 0.00 H new ATOM 0 HD3 LYS A 30 13.426 -2.356 3.974 1.00 0.00 H new ATOM 0 HE2 LYS A 30 12.515 -4.039 2.287 1.00 0.00 H new ATOM 0 HE3 LYS A 30 14.020 -3.908 1.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 14.012 -5.822 2.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 15.203 -4.722 3.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 13.744 -4.849 4.197 1.00 0.00 H new ATOM 447 N VAL A 31 9.512 0.178 1.930 1.00 0.00 N ATOM 448 CA VAL A 31 8.190 -0.011 2.483 1.00 0.00 C ATOM 449 C VAL A 31 8.166 -1.415 3.055 1.00 0.00 C ATOM 450 O VAL A 31 8.307 -2.368 2.292 1.00 0.00 O ATOM 451 CB VAL A 31 7.173 0.097 1.336 1.00 0.00 C ATOM 452 CG1 VAL A 31 5.754 -0.276 1.775 1.00 0.00 C ATOM 453 CG2 VAL A 31 7.212 1.509 0.762 1.00 0.00 C ATOM 0 H VAL A 31 9.586 -0.178 0.977 1.00 0.00 H new ATOM 0 HA VAL A 31 7.949 0.727 3.248 1.00 0.00 H new ATOM 0 HB VAL A 31 7.454 -0.621 0.566 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.075 -0.183 0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 31 5.744 -1.304 2.137 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.432 0.393 2.573 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.492 1.591 -0.052 1.00 0.00 H new ATOM 0 HG22 VAL A 31 6.960 2.226 1.543 1.00 0.00 H new ATOM 0 HG23 VAL A 31 8.212 1.721 0.384 1.00 0.00 H new ATOM 463 N TRP A 32 7.959 -1.564 4.363 1.00 0.00 N ATOM 464 CA TRP A 32 7.758 -2.893 4.932 1.00 0.00 C ATOM 465 C TRP A 32 6.633 -2.886 5.959 1.00 0.00 C ATOM 466 O TRP A 32 6.311 -1.848 6.524 1.00 0.00 O ATOM 467 CB TRP A 32 9.076 -3.492 5.456 1.00 0.00 C ATOM 468 CG TRP A 32 9.266 -3.535 6.941 1.00 0.00 C ATOM 469 CD1 TRP A 32 8.733 -4.461 7.770 1.00 0.00 C ATOM 470 CD2 TRP A 32 10.043 -2.639 7.788 1.00 0.00 C ATOM 471 NE1 TRP A 32 9.074 -4.167 9.072 1.00 0.00 N ATOM 472 CE2 TRP A 32 9.889 -3.057 9.145 1.00 0.00 C ATOM 473 CE3 TRP A 32 10.848 -1.504 7.553 1.00 0.00 C ATOM 474 CZ2 TRP A 32 10.490 -2.376 10.213 1.00 0.00 C ATOM 475 CZ3 TRP A 32 11.474 -0.827 8.618 1.00 0.00 C ATOM 476 CH2 TRP A 32 11.290 -1.255 9.945 1.00 0.00 C ATOM 0 H TRP A 32 7.927 -0.798 5.035 1.00 0.00 H new ATOM 0 HA TRP A 32 7.433 -3.563 4.136 1.00 0.00 H new ATOM 0 HB2 TRP A 32 9.159 -4.510 5.075 1.00 0.00 H new ATOM 0 HB3 TRP A 32 9.900 -2.923 5.026 1.00 0.00 H new ATOM 0 HD1 TRP A 32 8.132 -5.303 7.459 1.00 0.00 H new ATOM 0 HE1 TRP A 32 8.762 -4.704 9.881 1.00 0.00 H new ATOM 0 HE3 TRP A 32 10.986 -1.149 6.542 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 10.339 -2.710 11.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 12.101 0.028 8.414 1.00 0.00 H new ATOM 0 HH2 TRP A 32 11.764 -0.722 10.756 1.00 0.00 H new ATOM 487 N GLY A 33 6.011 -4.032 6.210 1.00 0.00 N ATOM 488 CA GLY A 33 4.890 -4.097 7.131 1.00 0.00 C ATOM 489 C GLY A 33 4.514 -5.524 7.442 1.00 0.00 C ATOM 490 O GLY A 33 5.164 -6.433 6.938 1.00 0.00 O ATOM 0 H GLY A 33 6.265 -4.925 5.788 1.00 0.00 H new ATOM 0 HA2 GLY A 33 5.145 -3.577 8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 33 4.033 -3.579 6.700 1.00 0.00 H new ATOM 494 N SER A 34 3.449 -5.721 8.226 1.00 0.00 N ATOM 495 CA SER A 34 3.041 -7.046 8.649 1.00 0.00 C ATOM 496 C SER A 34 1.574 -6.941 9.048 1.00 0.00 C ATOM 497 O SER A 34 1.275 -6.462 10.143 1.00 0.00 O ATOM 498 CB SER A 34 3.928 -7.557 9.795 1.00 0.00 C ATOM 499 OG SER A 34 5.314 -7.438 9.513 1.00 0.00 O ATOM 0 H SER A 34 2.857 -4.968 8.577 1.00 0.00 H new ATOM 0 HA SER A 34 3.157 -7.775 7.847 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.697 -7.000 10.703 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.691 -8.602 9.994 1.00 0.00 H new ATOM 0 HG SER A 34 5.517 -7.897 8.671 1.00 0.00 H new ATOM 505 N ILE A 35 0.650 -7.299 8.147 1.00 0.00 N ATOM 506 CA ILE A 35 -0.767 -7.267 8.485 1.00 0.00 C ATOM 507 C ILE A 35 -1.077 -8.398 9.459 1.00 0.00 C ATOM 508 O ILE A 35 -0.290 -9.325 9.614 1.00 0.00 O ATOM 509 CB ILE A 35 -1.656 -7.221 7.221 1.00 0.00 C ATOM 510 CG1 ILE A 35 -2.736 -6.117 7.299 1.00 0.00 C ATOM 511 CG2 ILE A 35 -2.321 -8.566 6.892 1.00 0.00 C ATOM 512 CD1 ILE A 35 -2.937 -5.402 5.964 1.00 0.00 C ATOM 0 H ILE A 35 0.858 -7.608 7.197 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.012 -6.340 9.003 1.00 0.00 H new ATOM 0 HB ILE A 35 -0.967 -6.984 6.411 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.680 -6.559 7.617 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.453 -5.389 8.059 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -2.930 -8.461 5.994 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -1.552 -9.320 6.723 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.954 -8.873 7.725 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -3.705 -4.637 6.073 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.001 -4.935 5.657 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -3.248 -6.123 5.208 1.00 0.00 H new ATOM 524 N LYS A 36 -2.232 -8.330 10.102 1.00 0.00 N ATOM 525 CA LYS A 36 -2.828 -9.398 10.866 1.00 0.00 C ATOM 526 C LYS A 36 -4.329 -9.218 10.702 1.00 0.00 C ATOM 527 O LYS A 36 -4.932 -8.440 11.439 1.00 0.00 O ATOM 528 CB LYS A 36 -2.428 -9.310 12.345 1.00 0.00 C ATOM 529 CG LYS A 36 -0.990 -9.784 12.598 1.00 0.00 C ATOM 530 CD LYS A 36 -0.705 -9.899 14.100 1.00 0.00 C ATOM 531 CE LYS A 36 -0.457 -8.516 14.725 1.00 0.00 C ATOM 532 NZ LYS A 36 -0.923 -8.443 16.124 1.00 0.00 N ATOM 0 H LYS A 36 -2.802 -7.484 10.101 1.00 0.00 H new ATOM 0 HA LYS A 36 -2.494 -10.375 10.518 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.532 -8.279 12.685 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -3.115 -9.912 12.940 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -0.833 -10.751 12.119 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -0.288 -9.085 12.144 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.547 -10.380 14.597 1.00 0.00 H new ATOM 0 HD3 LYS A 36 0.165 -10.535 14.260 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.608 -8.288 14.687 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -0.967 -7.756 14.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -0.735 -7.493 16.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -1.945 -8.634 16.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -0.418 -9.150 16.695 1.00 0.00 H new ATOM 546 N GLY A 37 -4.908 -9.899 9.713 1.00 0.00 N ATOM 547 CA GLY A 37 -6.349 -10.028 9.548 1.00 0.00 C ATOM 548 C GLY A 37 -6.807 -10.262 8.109 1.00 0.00 C ATOM 549 O GLY A 37 -8.004 -10.403 7.869 1.00 0.00 O ATOM 0 H GLY A 37 -4.375 -10.385 8.992 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -6.699 -10.855 10.166 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -6.827 -9.124 9.925 1.00 0.00 H new ATOM 553 N LEU A 38 -5.887 -10.260 7.141 1.00 0.00 N ATOM 554 CA LEU A 38 -6.190 -10.593 5.763 1.00 0.00 C ATOM 555 C LEU A 38 -6.445 -12.097 5.636 1.00 0.00 C ATOM 556 O LEU A 38 -6.560 -12.816 6.623 1.00 0.00 O ATOM 557 CB LEU A 38 -5.027 -10.091 4.884 1.00 0.00 C ATOM 558 CG LEU A 38 -5.324 -8.707 4.295 1.00 0.00 C ATOM 559 CD1 LEU A 38 -5.785 -7.651 5.309 1.00 0.00 C ATOM 560 CD2 LEU A 38 -4.135 -8.182 3.488 1.00 0.00 C ATOM 0 H LEU A 38 -4.908 -10.025 7.301 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.102 -10.104 5.422 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -4.114 -10.047 5.478 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.848 -10.800 4.076 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.177 -8.870 3.637 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.969 -6.708 4.794 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.703 -7.986 5.792 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.011 -7.508 6.063 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.376 -7.199 3.083 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.262 -8.104 4.136 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.919 -8.869 2.669 1.00 0.00 H new ATOM 572 N THR A 39 -6.552 -12.562 4.397 1.00 0.00 N ATOM 573 CA THR A 39 -6.759 -13.943 4.017 1.00 0.00 C ATOM 574 C THR A 39 -5.775 -14.254 2.910 1.00 0.00 C ATOM 575 O THR A 39 -5.420 -13.339 2.156 1.00 0.00 O ATOM 576 CB THR A 39 -8.185 -14.101 3.489 1.00 0.00 C ATOM 577 OG1 THR A 39 -8.521 -12.980 2.675 1.00 0.00 O ATOM 578 CG2 THR A 39 -9.142 -14.213 4.672 1.00 0.00 C ATOM 0 H THR A 39 -6.492 -11.944 3.588 1.00 0.00 H new ATOM 0 HA THR A 39 -6.614 -14.614 4.864 1.00 0.00 H new ATOM 0 HB THR A 39 -8.262 -15.003 2.882 1.00 0.00 H new ATOM 0 HG1 THR A 39 -9.435 -13.084 2.336 1.00 0.00 H new ATOM 0 HG21 THR A 39 -10.162 -14.326 4.305 1.00 0.00 H new ATOM 0 HG22 THR A 39 -8.875 -15.081 5.275 1.00 0.00 H new ATOM 0 HG23 THR A 39 -9.073 -13.312 5.282 1.00 0.00 H new ATOM 586 N GLU A 40 -5.354 -15.519 2.843 1.00 0.00 N ATOM 587 CA GLU A 40 -4.308 -15.974 1.955 1.00 0.00 C ATOM 588 C GLU A 40 -4.537 -15.548 0.513 1.00 0.00 C ATOM 589 O GLU A 40 -5.671 -15.493 0.035 1.00 0.00 O ATOM 590 CB GLU A 40 -4.157 -17.492 2.049 1.00 0.00 C ATOM 591 CG GLU A 40 -5.470 -18.262 1.834 1.00 0.00 C ATOM 592 CD GLU A 40 -5.811 -19.095 3.058 1.00 0.00 C ATOM 593 OE1 GLU A 40 -5.190 -20.170 3.202 1.00 0.00 O ATOM 594 OE2 GLU A 40 -6.654 -18.605 3.840 1.00 0.00 O ATOM 0 H GLU A 40 -5.746 -16.263 3.421 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.383 -15.499 2.280 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.428 -17.822 1.308 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.753 -17.747 3.029 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -6.279 -17.561 1.628 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.379 -18.909 0.961 1.00 0.00 H new ATOM 601 N GLY A 41 -3.440 -15.250 -0.178 1.00 0.00 N ATOM 602 CA GLY A 41 -3.487 -14.833 -1.560 1.00 0.00 C ATOM 603 C GLY A 41 -2.879 -13.458 -1.553 1.00 0.00 C ATOM 604 O GLY A 41 -1.711 -13.347 -1.204 1.00 0.00 O ATOM 0 H GLY A 41 -2.498 -15.293 0.212 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -2.925 -15.513 -2.200 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -4.510 -14.814 -1.935 1.00 0.00 H new ATOM 608 N LEU A 42 -3.645 -12.415 -1.879 1.00 0.00 N ATOM 609 CA LEU A 42 -3.065 -11.102 -2.058 1.00 0.00 C ATOM 610 C LEU A 42 -4.118 -9.994 -1.999 1.00 0.00 C ATOM 611 O LEU A 42 -5.303 -10.249 -2.212 1.00 0.00 O ATOM 612 CB LEU A 42 -2.208 -11.065 -3.340 1.00 0.00 C ATOM 613 CG LEU A 42 -3.032 -11.241 -4.620 1.00 0.00 C ATOM 614 CD1 LEU A 42 -2.180 -10.906 -5.851 1.00 0.00 C ATOM 615 CD2 LEU A 42 -3.621 -12.645 -4.833 1.00 0.00 C ATOM 0 H LEU A 42 -4.654 -12.462 -2.021 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.397 -10.902 -1.220 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.675 -10.115 -3.386 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.455 -11.851 -3.289 1.00 0.00 H new ATOM 0 HG LEU A 42 -3.871 -10.556 -4.495 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.778 -11.035 -6.753 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.838 -9.873 -5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -1.318 -11.572 -5.889 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -4.186 -12.665 -5.765 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -2.813 -13.375 -4.882 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.283 -12.892 -4.003 1.00 0.00 H new ATOM 627 N HIS A 43 -3.682 -8.783 -1.633 1.00 0.00 N ATOM 628 CA HIS A 43 -4.537 -7.653 -1.285 1.00 0.00 C ATOM 629 C HIS A 43 -3.904 -6.325 -1.714 1.00 0.00 C ATOM 630 O HIS A 43 -2.710 -6.142 -1.511 1.00 0.00 O ATOM 631 CB HIS A 43 -4.748 -7.667 0.230 1.00 0.00 C ATOM 632 CG HIS A 43 -5.674 -8.758 0.722 1.00 0.00 C ATOM 633 ND1 HIS A 43 -6.990 -8.568 1.085 1.00 0.00 N ATOM 634 CD2 HIS A 43 -5.363 -10.074 0.951 1.00 0.00 C ATOM 635 CE1 HIS A 43 -7.480 -9.746 1.513 1.00 0.00 C ATOM 636 NE2 HIS A 43 -6.511 -10.675 1.435 1.00 0.00 N ATOM 0 H HIS A 43 -2.689 -8.560 -1.570 1.00 0.00 H new ATOM 0 HA HIS A 43 -5.489 -7.745 -1.807 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.780 -7.781 0.718 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -5.148 -6.701 0.538 1.00 0.00 H new ATOM 0 HD1 HIS A 43 -7.503 -7.688 1.037 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.407 -10.549 0.786 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.487 -9.917 1.862 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.606 -11.658 1.690 1.00 0.00 H new ATOM 645 N GLY A 44 -4.681 -5.406 -2.300 1.00 0.00 N ATOM 646 CA GLY A 44 -4.207 -4.123 -2.812 1.00 0.00 C ATOM 647 C GLY A 44 -3.766 -3.212 -1.670 1.00 0.00 C ATOM 648 O GLY A 44 -4.372 -3.268 -0.600 1.00 0.00 O ATOM 0 H GLY A 44 -5.683 -5.542 -2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -3.374 -4.285 -3.496 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -4.999 -3.639 -3.383 1.00 0.00 H new ATOM 652 N PHE A 45 -2.733 -2.390 -1.895 1.00 0.00 N ATOM 653 CA PHE A 45 -2.038 -1.637 -0.856 1.00 0.00 C ATOM 654 C PHE A 45 -1.648 -0.255 -1.378 1.00 0.00 C ATOM 655 O PHE A 45 -0.798 -0.172 -2.266 1.00 0.00 O ATOM 656 CB PHE A 45 -0.779 -2.425 -0.466 1.00 0.00 C ATOM 657 CG PHE A 45 -0.669 -2.639 1.020 1.00 0.00 C ATOM 658 CD1 PHE A 45 -1.430 -3.649 1.629 1.00 0.00 C ATOM 659 CD2 PHE A 45 0.051 -1.729 1.808 1.00 0.00 C ATOM 660 CE1 PHE A 45 -1.427 -3.782 3.026 1.00 0.00 C ATOM 661 CE2 PHE A 45 -0.067 -1.776 3.205 1.00 0.00 C ATOM 662 CZ PHE A 45 -0.756 -2.837 3.816 1.00 0.00 C ATOM 0 H PHE A 45 -2.352 -2.230 -2.828 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.686 -1.502 0.010 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -0.789 -3.392 -0.969 1.00 0.00 H new ATOM 0 HB3 PHE A 45 0.103 -1.891 -0.819 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -2.017 -4.323 1.023 1.00 0.00 H new ATOM 0 HD2 PHE A 45 0.693 -0.996 1.342 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -1.940 -4.610 3.492 1.00 0.00 H new ATOM 0 HE2 PHE A 45 0.372 -0.997 3.811 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.769 -2.925 4.892 1.00 0.00 H new ATOM 672 N HIS A 46 -2.269 0.833 -0.891 1.00 0.00 N ATOM 673 CA HIS A 46 -2.051 2.129 -1.539 1.00 0.00 C ATOM 674 C HIS A 46 -2.281 3.332 -0.630 1.00 0.00 C ATOM 675 O HIS A 46 -3.038 3.260 0.338 1.00 0.00 O ATOM 676 CB HIS A 46 -2.917 2.288 -2.805 1.00 0.00 C ATOM 677 CG HIS A 46 -3.443 1.009 -3.395 1.00 0.00 C ATOM 678 ND1 HIS A 46 -4.714 0.470 -3.191 1.00 0.00 N ATOM 679 CD2 HIS A 46 -2.824 0.242 -4.335 1.00 0.00 C ATOM 680 CE1 HIS A 46 -4.826 -0.618 -3.983 1.00 0.00 C ATOM 681 NE2 HIS A 46 -3.705 -0.723 -4.702 1.00 0.00 N ATOM 0 H HIS A 46 -2.897 0.842 -0.088 1.00 0.00 H new ATOM 0 HA HIS A 46 -0.994 2.120 -1.806 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -3.763 2.932 -2.567 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -2.328 2.803 -3.564 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -1.822 0.376 -4.716 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -5.673 -1.286 -4.027 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -3.536 -1.426 -5.422 1.00 0.00 H new ATOM 689 N VAL A 47 -1.660 4.457 -0.999 1.00 0.00 N ATOM 690 CA VAL A 47 -1.867 5.746 -0.348 1.00 0.00 C ATOM 691 C VAL A 47 -3.109 6.412 -0.943 1.00 0.00 C ATOM 692 O VAL A 47 -3.142 6.721 -2.136 1.00 0.00 O ATOM 693 CB VAL A 47 -0.638 6.657 -0.501 1.00 0.00 C ATOM 694 CG1 VAL A 47 -0.855 7.947 0.297 1.00 0.00 C ATOM 695 CG2 VAL A 47 0.640 5.998 0.034 1.00 0.00 C ATOM 0 H VAL A 47 -0.992 4.494 -1.769 1.00 0.00 H new ATOM 0 HA VAL A 47 -2.015 5.581 0.719 1.00 0.00 H new ATOM 0 HB VAL A 47 -0.519 6.855 -1.566 1.00 0.00 H new ATOM 0 HG11 VAL A 47 0.016 8.593 0.189 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.738 8.463 -0.079 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.998 7.704 1.350 1.00 0.00 H new ATOM 0 HG21 VAL A 47 1.482 6.678 -0.095 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.516 5.771 1.093 1.00 0.00 H new ATOM 0 HG23 VAL A 47 0.831 5.076 -0.515 1.00 0.00 H new ATOM 705 N HIS A 48 -4.138 6.610 -0.120 1.00 0.00 N ATOM 706 CA HIS A 48 -5.378 7.261 -0.489 1.00 0.00 C ATOM 707 C HIS A 48 -5.339 8.758 -0.189 1.00 0.00 C ATOM 708 O HIS A 48 -4.627 9.208 0.707 1.00 0.00 O ATOM 709 CB HIS A 48 -6.515 6.596 0.281 1.00 0.00 C ATOM 710 CG HIS A 48 -6.826 5.193 -0.175 1.00 0.00 C ATOM 711 ND1 HIS A 48 -8.086 4.698 -0.228 1.00 0.00 N ATOM 712 CD2 HIS A 48 -5.966 4.293 -0.743 1.00 0.00 C ATOM 713 CE1 HIS A 48 -8.040 3.504 -0.802 1.00 0.00 C ATOM 714 NE2 HIS A 48 -6.776 3.240 -1.165 1.00 0.00 N ATOM 0 H HIS A 48 -4.123 6.308 0.854 1.00 0.00 H new ATOM 0 HA HIS A 48 -5.531 7.154 -1.563 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -6.259 6.574 1.340 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -7.413 7.206 0.182 1.00 0.00 H new ATOM 0 HD1 HIS A 48 -8.926 5.164 0.115 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -4.894 4.380 -0.843 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -8.885 2.849 -0.953 1.00 0.00 H new ATOM 722 N GLU A 49 -6.143 9.514 -0.938 1.00 0.00 N ATOM 723 CA GLU A 49 -6.321 10.950 -0.766 1.00 0.00 C ATOM 724 C GLU A 49 -7.171 11.232 0.480 1.00 0.00 C ATOM 725 O GLU A 49 -8.322 11.646 0.369 1.00 0.00 O ATOM 726 CB GLU A 49 -6.965 11.537 -2.035 1.00 0.00 C ATOM 727 CG GLU A 49 -6.891 13.072 -2.071 1.00 0.00 C ATOM 728 CD GLU A 49 -7.769 13.662 -3.167 1.00 0.00 C ATOM 729 OE1 GLU A 49 -8.066 12.917 -4.126 1.00 0.00 O ATOM 730 OE2 GLU A 49 -8.122 14.851 -3.027 1.00 0.00 O ATOM 0 H GLU A 49 -6.702 9.131 -1.700 1.00 0.00 H new ATOM 0 HA GLU A 49 -5.353 11.429 -0.618 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -6.465 11.131 -2.914 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -8.008 11.225 -2.088 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -7.199 13.472 -1.105 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -5.858 13.381 -2.229 1.00 0.00 H new ATOM 737 N GLU A 50 -6.596 10.996 1.657 1.00 0.00 N ATOM 738 CA GLU A 50 -7.076 11.450 2.956 1.00 0.00 C ATOM 739 C GLU A 50 -5.830 11.651 3.818 1.00 0.00 C ATOM 740 O GLU A 50 -4.716 11.344 3.379 1.00 0.00 O ATOM 741 CB GLU A 50 -7.994 10.398 3.613 1.00 0.00 C ATOM 742 CG GLU A 50 -9.473 10.420 3.207 1.00 0.00 C ATOM 743 CD GLU A 50 -10.324 11.180 4.217 1.00 0.00 C ATOM 744 OE1 GLU A 50 -10.029 12.375 4.424 1.00 0.00 O ATOM 745 OE2 GLU A 50 -11.226 10.532 4.796 1.00 0.00 O ATOM 0 H GLU A 50 -5.736 10.453 1.732 1.00 0.00 H new ATOM 0 HA GLU A 50 -7.659 12.365 2.852 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -7.594 9.410 3.386 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -7.937 10.525 4.694 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -9.574 10.882 2.225 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -9.841 9.398 3.117 1.00 0.00 H new ATOM 752 N GLU A 51 -6.055 12.112 5.048 1.00 0.00 N ATOM 753 CA GLU A 51 -5.065 12.157 6.112 1.00 0.00 C ATOM 754 C GLU A 51 -5.675 11.558 7.383 1.00 0.00 C ATOM 755 O GLU A 51 -5.949 10.356 7.409 1.00 0.00 O ATOM 756 CB GLU A 51 -4.507 13.582 6.283 1.00 0.00 C ATOM 757 CG GLU A 51 -3.790 14.018 4.997 1.00 0.00 C ATOM 758 CD GLU A 51 -2.937 15.264 5.151 1.00 0.00 C ATOM 759 OE1 GLU A 51 -2.427 15.509 6.263 1.00 0.00 O ATOM 760 OE2 GLU A 51 -2.713 15.905 4.101 1.00 0.00 O ATOM 0 H GLU A 51 -6.963 12.476 5.336 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.197 11.548 5.859 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.317 14.275 6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -3.815 13.613 7.124 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.158 13.200 4.651 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.535 14.195 4.221 1.00 0.00 H new ATOM 767 N ASP A 52 -5.912 12.372 8.418 1.00 0.00 N ATOM 768 CA ASP A 52 -6.525 11.947 9.671 1.00 0.00 C ATOM 769 C ASP A 52 -7.974 12.441 9.701 1.00 0.00 C ATOM 770 O ASP A 52 -8.221 13.633 9.880 1.00 0.00 O ATOM 771 CB ASP A 52 -5.706 12.474 10.855 1.00 0.00 C ATOM 772 CG ASP A 52 -6.130 11.826 12.167 1.00 0.00 C ATOM 773 OD1 ASP A 52 -7.246 11.264 12.203 1.00 0.00 O ATOM 774 OD2 ASP A 52 -5.312 11.886 13.110 1.00 0.00 O ATOM 0 H ASP A 52 -5.676 13.364 8.402 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.534 10.860 9.747 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -4.648 12.282 10.680 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -5.826 13.555 10.928 1.00 0.00 H new ATOM 779 N ASN A 53 -8.923 11.534 9.460 1.00 0.00 N ATOM 780 CA ASN A 53 -10.354 11.826 9.432 1.00 0.00 C ATOM 781 C ASN A 53 -11.146 10.525 9.478 1.00 0.00 C ATOM 782 O ASN A 53 -12.178 10.453 10.143 1.00 0.00 O ATOM 783 CB ASN A 53 -10.739 12.631 8.177 1.00 0.00 C ATOM 784 CG ASN A 53 -12.130 13.271 8.256 1.00 0.00 C ATOM 785 OD1 ASN A 53 -13.184 12.528 8.592 1.00 0.00 O flip ATOM 786 ND2 ASN A 53 -12.276 14.466 8.018 1.00 0.00 N flip ATOM 0 H ASN A 53 -8.711 10.554 9.275 1.00 0.00 H new ATOM 0 HA ASN A 53 -10.594 12.432 10.306 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -9.998 13.414 8.017 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -10.701 11.973 7.309 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -11.471 15.037 7.761 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -13.203 14.888 8.078 1.00 0.00 H new ATOM 793 N THR A 54 -10.707 9.501 8.742 1.00 0.00 N ATOM 794 CA THR A 54 -11.412 8.227 8.648 1.00 0.00 C ATOM 795 C THR A 54 -11.171 7.385 9.920 1.00 0.00 C ATOM 796 O THR A 54 -10.664 6.273 9.867 1.00 0.00 O ATOM 797 CB THR A 54 -11.066 7.570 7.293 1.00 0.00 C ATOM 798 OG1 THR A 54 -11.980 6.548 6.959 1.00 0.00 O ATOM 799 CG2 THR A 54 -9.638 7.028 7.163 1.00 0.00 C ATOM 0 H THR A 54 -9.848 9.536 8.193 1.00 0.00 H new ATOM 0 HA THR A 54 -12.495 8.349 8.634 1.00 0.00 H new ATOM 0 HB THR A 54 -11.142 8.398 6.588 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.896 6.885 7.050 1.00 0.00 H new ATOM 0 HG21 THR A 54 -9.504 6.589 6.174 1.00 0.00 H new ATOM 0 HG22 THR A 54 -8.926 7.842 7.298 1.00 0.00 H new ATOM 0 HG23 THR A 54 -9.467 6.267 7.924 1.00 0.00 H new ATOM 807 N ALA A 55 -11.552 7.935 11.080 1.00 0.00 N ATOM 808 CA ALA A 55 -11.312 7.358 12.399 1.00 0.00 C ATOM 809 C ALA A 55 -11.826 5.921 12.515 1.00 0.00 C ATOM 810 O ALA A 55 -11.182 5.083 13.141 1.00 0.00 O ATOM 811 CB ALA A 55 -11.956 8.242 13.469 1.00 0.00 C ATOM 0 H ALA A 55 -12.052 8.823 11.122 1.00 0.00 H new ATOM 0 HA ALA A 55 -10.233 7.318 12.550 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -11.776 7.811 14.454 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -11.522 9.241 13.426 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -13.029 8.305 13.291 1.00 0.00 H new ATOM 817 N GLY A 56 -13.001 5.653 11.936 1.00 0.00 N ATOM 818 CA GLY A 56 -13.510 4.295 11.799 1.00 0.00 C ATOM 819 C GLY A 56 -12.837 3.658 10.588 1.00 0.00 C ATOM 820 O GLY A 56 -11.681 3.251 10.663 1.00 0.00 O ATOM 0 H GLY A 56 -13.618 6.369 11.553 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -13.300 3.717 12.699 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -14.592 4.305 11.672 1.00 0.00 H new ATOM 824 N CYS A 57 -13.550 3.604 9.459 1.00 0.00 N ATOM 825 CA CYS A 57 -12.947 3.306 8.160 1.00 0.00 C ATOM 826 C CYS A 57 -13.892 3.717 7.027 1.00 0.00 C ATOM 827 O CYS A 57 -13.980 3.067 5.985 1.00 0.00 O ATOM 828 CB CYS A 57 -12.518 1.828 8.081 1.00 0.00 C ATOM 829 SG CYS A 57 -10.977 1.556 7.174 1.00 0.00 S ATOM 0 H CYS A 57 -14.557 3.765 9.421 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.038 3.896 8.043 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -12.405 1.439 9.093 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -13.314 1.254 7.605 1.00 0.00 H new ATOM 834 N THR A 58 -14.629 4.808 7.257 1.00 0.00 N ATOM 835 CA THR A 58 -15.593 5.403 6.343 1.00 0.00 C ATOM 836 C THR A 58 -15.111 6.830 6.063 1.00 0.00 C ATOM 837 O THR A 58 -14.548 7.447 6.965 1.00 0.00 O ATOM 838 CB THR A 58 -17.006 5.317 6.956 1.00 0.00 C ATOM 839 OG1 THR A 58 -17.942 5.977 6.125 1.00 0.00 O ATOM 840 CG2 THR A 58 -17.106 5.890 8.375 1.00 0.00 C ATOM 0 H THR A 58 -14.561 5.323 8.135 1.00 0.00 H new ATOM 0 HA THR A 58 -15.662 4.876 5.392 1.00 0.00 H new ATOM 0 HB THR A 58 -17.231 4.253 7.027 1.00 0.00 H new ATOM 0 HG1 THR A 58 -18.835 5.914 6.524 1.00 0.00 H new ATOM 0 HG21 THR A 58 -18.130 5.792 8.735 1.00 0.00 H new ATOM 0 HG22 THR A 58 -16.435 5.343 9.037 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.824 6.943 8.363 1.00 0.00 H new ATOM 848 N SER A 59 -15.228 7.261 4.803 1.00 0.00 N ATOM 849 CA SER A 59 -14.685 8.468 4.177 1.00 0.00 C ATOM 850 C SER A 59 -13.552 8.130 3.210 1.00 0.00 C ATOM 851 O SER A 59 -13.569 8.637 2.092 1.00 0.00 O ATOM 852 CB SER A 59 -14.271 9.595 5.133 1.00 0.00 C ATOM 853 OG SER A 59 -15.407 10.065 5.837 1.00 0.00 O ATOM 0 H SER A 59 -15.762 6.715 4.127 1.00 0.00 H new ATOM 0 HA SER A 59 -15.531 8.879 3.626 1.00 0.00 H new ATOM 0 HB2 SER A 59 -13.520 9.232 5.835 1.00 0.00 H new ATOM 0 HB3 SER A 59 -13.815 10.411 4.573 1.00 0.00 H new ATOM 0 HG SER A 59 -15.651 9.420 6.533 1.00 0.00 H new ATOM 859 N ALA A 60 -12.617 7.252 3.619 1.00 0.00 N ATOM 860 CA ALA A 60 -11.418 6.850 2.872 1.00 0.00 C ATOM 861 C ALA A 60 -11.565 7.031 1.354 1.00 0.00 C ATOM 862 O ALA A 60 -12.219 6.213 0.705 1.00 0.00 O ATOM 863 CB ALA A 60 -11.034 5.409 3.223 1.00 0.00 C ATOM 0 H ALA A 60 -12.683 6.783 4.523 1.00 0.00 H new ATOM 0 HA ALA A 60 -10.613 7.518 3.177 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -10.144 5.123 2.663 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -10.829 5.337 4.291 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -11.855 4.740 2.965 1.00 0.00 H new ATOM 869 N GLY A 61 -10.973 8.093 0.794 1.00 0.00 N ATOM 870 CA GLY A 61 -11.123 8.457 -0.605 1.00 0.00 C ATOM 871 C GLY A 61 -10.432 7.433 -1.495 1.00 0.00 C ATOM 872 O GLY A 61 -9.927 6.423 -1.004 1.00 0.00 O ATOM 0 H GLY A 61 -10.369 8.728 1.315 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -12.181 8.516 -0.861 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -10.697 9.445 -0.778 1.00 0.00 H new ATOM 876 N PRO A 62 -10.402 7.644 -2.816 1.00 0.00 N ATOM 877 CA PRO A 62 -9.697 6.746 -3.708 1.00 0.00 C ATOM 878 C PRO A 62 -8.179 6.914 -3.563 1.00 0.00 C ATOM 879 O PRO A 62 -7.696 7.644 -2.692 1.00 0.00 O ATOM 880 CB PRO A 62 -10.224 7.082 -5.110 1.00 0.00 C ATOM 881 CG PRO A 62 -10.603 8.559 -5.001 1.00 0.00 C ATOM 882 CD PRO A 62 -11.052 8.720 -3.547 1.00 0.00 C ATOM 0 HA PRO A 62 -9.874 5.694 -3.483 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -9.465 6.917 -5.875 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -11.083 6.465 -5.375 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -9.757 9.206 -5.231 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -11.401 8.819 -5.696 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -10.761 9.694 -3.152 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -12.137 8.653 -3.462 1.00 0.00 H new ATOM 890 N HIS A 63 -7.426 6.210 -4.417 1.00 0.00 N ATOM 891 CA HIS A 63 -5.979 6.339 -4.475 1.00 0.00 C ATOM 892 C HIS A 63 -5.613 7.802 -4.705 1.00 0.00 C ATOM 893 O HIS A 63 -6.316 8.508 -5.424 1.00 0.00 O ATOM 894 CB HIS A 63 -5.399 5.521 -5.630 1.00 0.00 C ATOM 895 CG HIS A 63 -5.512 4.019 -5.522 1.00 0.00 C ATOM 896 ND1 HIS A 63 -4.803 3.087 -6.292 1.00 0.00 N ATOM 897 CD2 HIS A 63 -6.338 3.313 -4.695 1.00 0.00 C ATOM 898 CE1 HIS A 63 -5.227 1.850 -5.944 1.00 0.00 C ATOM 899 NE2 HIS A 63 -6.170 1.999 -5.000 1.00 0.00 N ATOM 0 H HIS A 63 -7.809 5.539 -5.083 1.00 0.00 H new ATOM 0 HA HIS A 63 -5.570 5.974 -3.533 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -5.893 5.834 -6.550 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -4.344 5.776 -5.732 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -6.998 3.720 -3.943 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -4.872 0.915 -6.351 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -6.689 1.232 -4.571 1.00 0.00 H new ATOM 907 N PHE A 64 -4.501 8.238 -4.112 1.00 0.00 N ATOM 908 CA PHE A 64 -3.984 9.584 -4.304 1.00 0.00 C ATOM 909 C PHE A 64 -3.441 9.733 -5.736 1.00 0.00 C ATOM 910 O PHE A 64 -3.539 8.804 -6.536 1.00 0.00 O ATOM 911 CB PHE A 64 -2.926 9.826 -3.215 1.00 0.00 C ATOM 912 CG PHE A 64 -2.564 11.251 -2.832 1.00 0.00 C ATOM 913 CD1 PHE A 64 -3.350 12.362 -3.212 1.00 0.00 C ATOM 914 CD2 PHE A 64 -1.528 11.433 -1.896 1.00 0.00 C ATOM 915 CE1 PHE A 64 -3.075 13.635 -2.685 1.00 0.00 C ATOM 916 CE2 PHE A 64 -1.274 12.702 -1.349 1.00 0.00 C ATOM 917 CZ PHE A 64 -2.053 13.802 -1.737 1.00 0.00 C ATOM 0 H PHE A 64 -3.937 7.664 -3.486 1.00 0.00 H new ATOM 0 HA PHE A 64 -4.760 10.343 -4.202 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -3.265 9.320 -2.311 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -2.009 9.330 -3.533 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -4.164 12.232 -3.909 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -0.923 10.590 -1.596 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -3.652 14.488 -3.010 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.479 12.830 -0.630 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.867 14.775 -1.307 1.00 0.00 H new ATOM 927 N ASN A 65 -2.841 10.878 -6.074 1.00 0.00 N ATOM 928 CA ASN A 65 -2.320 11.165 -7.411 1.00 0.00 C ATOM 929 C ASN A 65 -1.014 11.953 -7.266 1.00 0.00 C ATOM 930 O ASN A 65 -0.953 12.811 -6.391 1.00 0.00 O ATOM 931 CB ASN A 65 -3.329 12.004 -8.207 1.00 0.00 C ATOM 932 CG ASN A 65 -4.576 11.223 -8.614 1.00 0.00 C ATOM 933 OD1 ASN A 65 -5.599 11.298 -7.946 1.00 0.00 O ATOM 934 ND2 ASN A 65 -4.535 10.489 -9.726 1.00 0.00 N ATOM 0 H ASN A 65 -2.702 11.643 -5.414 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.146 10.229 -7.941 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.627 12.865 -7.609 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.843 12.391 -9.102 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -5.364 9.979 -10.032 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -3.675 10.437 -10.271 1.00 0.00 H new ATOM 941 N PRO A 66 0.024 11.697 -8.089 1.00 0.00 N ATOM 942 CA PRO A 66 1.256 12.468 -8.067 1.00 0.00 C ATOM 943 C PRO A 66 1.096 13.682 -8.977 1.00 0.00 C ATOM 944 O PRO A 66 0.987 14.809 -8.509 1.00 0.00 O ATOM 945 CB PRO A 66 2.351 11.516 -8.562 1.00 0.00 C ATOM 946 CG PRO A 66 1.619 10.450 -9.384 1.00 0.00 C ATOM 947 CD PRO A 66 0.127 10.627 -9.066 1.00 0.00 C ATOM 0 HA PRO A 66 1.509 12.845 -7.076 1.00 0.00 H new ATOM 0 HB2 PRO A 66 3.086 12.044 -9.169 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.889 11.068 -7.727 1.00 0.00 H new ATOM 0 HG2 PRO A 66 1.810 10.579 -10.449 1.00 0.00 H new ATOM 0 HG3 PRO A 66 1.959 9.449 -9.118 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.433 10.874 -9.968 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.295 9.703 -8.671 1.00 0.00 H new ATOM 955 N LEU A 67 1.053 13.429 -10.288 1.00 0.00 N ATOM 956 CA LEU A 67 0.782 14.415 -11.321 1.00 0.00 C ATOM 957 C LEU A 67 -0.430 13.942 -12.126 1.00 0.00 C ATOM 958 O LEU A 67 -0.423 13.952 -13.353 1.00 0.00 O ATOM 959 CB LEU A 67 2.041 14.652 -12.176 1.00 0.00 C ATOM 960 CG LEU A 67 2.570 13.387 -12.884 1.00 0.00 C ATOM 961 CD1 LEU A 67 2.765 13.645 -14.382 1.00 0.00 C ATOM 962 CD2 LEU A 67 3.900 12.924 -12.279 1.00 0.00 C ATOM 0 H LEU A 67 1.213 12.495 -10.666 1.00 0.00 H new ATOM 0 HA LEU A 67 0.536 15.385 -10.890 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.819 15.410 -12.927 1.00 0.00 H new ATOM 0 HB3 LEU A 67 2.829 15.055 -11.539 1.00 0.00 H new ATOM 0 HG LEU A 67 1.825 12.604 -12.742 1.00 0.00 H new ATOM 0 HD11 LEU A 67 3.138 12.740 -14.861 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.812 13.926 -14.830 1.00 0.00 H new ATOM 0 HD13 LEU A 67 3.484 14.453 -14.522 1.00 0.00 H new ATOM 0 HD21 LEU A 67 4.245 12.031 -12.800 1.00 0.00 H new ATOM 0 HD22 LEU A 67 4.642 13.715 -12.384 1.00 0.00 H new ATOM 0 HD23 LEU A 67 3.759 12.696 -11.222 1.00 0.00 H new ATOM 974 N SER A 68 -1.468 13.488 -11.415 1.00 0.00 N ATOM 975 CA SER A 68 -2.769 13.189 -12.008 1.00 0.00 C ATOM 976 C SER A 68 -2.695 12.045 -13.025 1.00 0.00 C ATOM 977 O SER A 68 -3.303 12.111 -14.091 1.00 0.00 O ATOM 978 CB SER A 68 -3.371 14.463 -12.618 1.00 0.00 C ATOM 979 OG SER A 68 -3.297 15.526 -11.684 1.00 0.00 O ATOM 0 H SER A 68 -1.426 13.318 -10.410 1.00 0.00 H new ATOM 0 HA SER A 68 -3.431 12.840 -11.215 1.00 0.00 H new ATOM 0 HB2 SER A 68 -2.834 14.729 -13.529 1.00 0.00 H new ATOM 0 HB3 SER A 68 -4.409 14.286 -12.900 1.00 0.00 H new ATOM 0 HG SER A 68 -3.681 16.336 -12.080 1.00 0.00 H new ATOM 985 N ARG A 69 -1.970 10.981 -12.673 1.00 0.00 N ATOM 986 CA ARG A 69 -1.852 9.777 -13.487 1.00 0.00 C ATOM 987 C ARG A 69 -2.982 8.808 -13.136 1.00 0.00 C ATOM 988 O ARG A 69 -3.663 8.993 -12.125 1.00 0.00 O ATOM 989 CB ARG A 69 -0.483 9.117 -13.261 1.00 0.00 C ATOM 990 CG ARG A 69 0.648 10.153 -13.238 1.00 0.00 C ATOM 991 CD ARG A 69 2.031 9.490 -13.260 1.00 0.00 C ATOM 992 NE ARG A 69 2.507 9.287 -14.638 1.00 0.00 N ATOM 993 CZ ARG A 69 3.690 8.743 -14.965 1.00 0.00 C ATOM 994 NH1 ARG A 69 4.488 8.265 -14.005 1.00 0.00 N ATOM 995 NH2 ARG A 69 4.077 8.683 -16.243 1.00 0.00 N ATOM 0 H ARG A 69 -1.442 10.934 -11.801 1.00 0.00 H new ATOM 0 HA ARG A 69 -1.932 10.045 -14.541 1.00 0.00 H new ATOM 0 HB2 ARG A 69 -0.494 8.569 -12.319 1.00 0.00 H new ATOM 0 HB3 ARG A 69 -0.295 8.390 -14.051 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.550 10.817 -14.097 1.00 0.00 H new ATOM 0 HG3 ARG A 69 0.556 10.771 -12.345 1.00 0.00 H new ATOM 0 HD2 ARG A 69 2.742 10.111 -12.715 1.00 0.00 H new ATOM 0 HD3 ARG A 69 1.985 8.531 -12.744 1.00 0.00 H new ATOM 0 HE ARG A 69 1.894 9.581 -15.399 1.00 0.00 H new ATOM 0 HH11 ARG A 69 4.197 8.314 -13.029 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.388 7.851 -14.249 1.00 0.00 H new ATOM 0 HH21 ARG A 69 3.472 9.052 -16.977 1.00 0.00 H new ATOM 0 HH22 ARG A 69 4.977 8.268 -16.484 1.00 0.00 H new ATOM 1009 N LYS A 70 -3.159 7.758 -13.942 1.00 0.00 N ATOM 1010 CA LYS A 70 -4.038 6.652 -13.621 1.00 0.00 C ATOM 1011 C LYS A 70 -3.326 5.669 -12.683 1.00 0.00 C ATOM 1012 O LYS A 70 -2.152 5.829 -12.345 1.00 0.00 O ATOM 1013 CB LYS A 70 -4.471 5.970 -14.923 1.00 0.00 C ATOM 1014 CG LYS A 70 -5.798 6.516 -15.464 1.00 0.00 C ATOM 1015 CD LYS A 70 -5.983 6.125 -16.941 1.00 0.00 C ATOM 1016 CE LYS A 70 -5.130 7.024 -17.854 1.00 0.00 C ATOM 1017 NZ LYS A 70 -4.112 6.282 -18.624 1.00 0.00 N ATOM 0 H LYS A 70 -2.688 7.659 -14.841 1.00 0.00 H new ATOM 0 HA LYS A 70 -4.926 7.015 -13.103 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -3.694 6.105 -15.675 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -4.567 4.898 -14.752 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.626 6.126 -14.872 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -5.819 7.601 -15.364 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.701 5.082 -17.084 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.034 6.212 -17.216 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -5.786 7.551 -18.547 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.634 7.781 -17.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -3.314 6.912 -18.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -3.773 5.475 -18.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.531 5.936 -19.510 1.00 0.00 H new ATOM 1031 N HIS A 71 -4.091 4.675 -12.237 1.00 0.00 N ATOM 1032 CA HIS A 71 -3.661 3.614 -11.351 1.00 0.00 C ATOM 1033 C HIS A 71 -2.722 2.652 -12.075 1.00 0.00 C ATOM 1034 O HIS A 71 -2.872 2.437 -13.275 1.00 0.00 O ATOM 1035 CB HIS A 71 -4.908 2.862 -10.863 1.00 0.00 C ATOM 1036 CG HIS A 71 -4.597 1.800 -9.849 1.00 0.00 C ATOM 1037 ND1 HIS A 71 -3.759 1.932 -8.752 1.00 0.00 N ATOM 1038 CD2 HIS A 71 -4.971 0.494 -9.880 1.00 0.00 C ATOM 1039 CE1 HIS A 71 -3.422 0.704 -8.334 1.00 0.00 C ATOM 1040 NE2 HIS A 71 -4.258 -0.149 -8.918 1.00 0.00 N ATOM 0 H HIS A 71 -5.073 4.590 -12.500 1.00 0.00 H new ATOM 0 HA HIS A 71 -3.118 4.039 -10.507 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -5.609 3.576 -10.429 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.407 2.405 -11.718 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -5.698 0.050 -10.544 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -2.623 0.455 -7.652 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -4.350 -1.137 -8.680 1.00 0.00 H new ATOM 1048 N GLY A 72 -1.809 2.033 -11.328 1.00 0.00 N ATOM 1049 CA GLY A 72 -0.960 0.961 -11.817 1.00 0.00 C ATOM 1050 C GLY A 72 -0.224 0.350 -10.634 1.00 0.00 C ATOM 1051 O GLY A 72 -0.696 0.474 -9.505 1.00 0.00 O ATOM 0 H GLY A 72 -1.640 2.270 -10.351 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.559 0.204 -12.322 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -0.249 1.345 -12.548 1.00 0.00 H new ATOM 1055 N GLY A 73 0.928 -0.273 -10.874 1.00 0.00 N ATOM 1056 CA GLY A 73 1.793 -0.822 -9.838 1.00 0.00 C ATOM 1057 C GLY A 73 3.188 -0.206 -9.913 1.00 0.00 C ATOM 1058 O GLY A 73 3.476 0.584 -10.813 1.00 0.00 O ATOM 0 H GLY A 73 1.292 -0.412 -11.817 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.359 -0.631 -8.857 1.00 0.00 H new ATOM 0 HA3 GLY A 73 1.862 -1.904 -9.951 1.00 0.00 H new ATOM 1062 N PRO A 74 4.105 -0.610 -9.022 1.00 0.00 N ATOM 1063 CA PRO A 74 5.477 -0.125 -9.019 1.00 0.00 C ATOM 1064 C PRO A 74 6.244 -0.545 -10.279 1.00 0.00 C ATOM 1065 O PRO A 74 7.288 0.031 -10.578 1.00 0.00 O ATOM 1066 CB PRO A 74 6.106 -0.684 -7.741 1.00 0.00 C ATOM 1067 CG PRO A 74 5.306 -1.953 -7.473 1.00 0.00 C ATOM 1068 CD PRO A 74 3.905 -1.583 -7.962 1.00 0.00 C ATOM 0 HA PRO A 74 5.512 0.964 -9.032 1.00 0.00 H new ATOM 0 HB2 PRO A 74 7.166 -0.899 -7.877 1.00 0.00 H new ATOM 0 HB3 PRO A 74 6.028 0.022 -6.914 1.00 0.00 H new ATOM 0 HG2 PRO A 74 5.711 -2.808 -8.015 1.00 0.00 H new ATOM 0 HG3 PRO A 74 5.308 -2.216 -6.415 1.00 0.00 H new ATOM 0 HD2 PRO A 74 3.374 -2.461 -8.331 1.00 0.00 H new ATOM 0 HD3 PRO A 74 3.306 -1.164 -7.154 1.00 0.00 H new ATOM 1076 N LYS A 75 5.749 -1.538 -11.024 1.00 0.00 N ATOM 1077 CA LYS A 75 6.302 -1.924 -12.294 1.00 0.00 C ATOM 1078 C LYS A 75 5.692 -1.113 -13.436 1.00 0.00 C ATOM 1079 O LYS A 75 6.306 -1.034 -14.494 1.00 0.00 O ATOM 1080 CB LYS A 75 6.108 -3.448 -12.384 1.00 0.00 C ATOM 1081 CG LYS A 75 6.305 -4.053 -13.783 1.00 0.00 C ATOM 1082 CD LYS A 75 7.041 -5.401 -13.772 1.00 0.00 C ATOM 1083 CE LYS A 75 8.550 -5.234 -13.968 1.00 0.00 C ATOM 1084 NZ LYS A 75 9.163 -4.306 -12.985 1.00 0.00 N ATOM 0 H LYS A 75 4.941 -2.095 -10.744 1.00 0.00 H new ATOM 0 HA LYS A 75 7.365 -1.701 -12.384 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.805 -3.928 -11.697 1.00 0.00 H new ATOM 0 HB3 LYS A 75 5.103 -3.691 -12.039 1.00 0.00 H new ATOM 0 HG2 LYS A 75 5.331 -4.184 -14.253 1.00 0.00 H new ATOM 0 HG3 LYS A 75 6.864 -3.348 -14.399 1.00 0.00 H new ATOM 0 HD2 LYS A 75 6.853 -5.909 -12.826 1.00 0.00 H new ATOM 0 HD3 LYS A 75 6.642 -6.038 -14.561 1.00 0.00 H new ATOM 0 HE2 LYS A 75 9.031 -6.209 -13.888 1.00 0.00 H new ATOM 0 HE3 LYS A 75 8.741 -4.865 -14.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.197 -4.311 -13.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.801 -3.344 -13.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 8.922 -4.612 -12.021 1.00 0.00 H new ATOM 1098 N ASP A 76 4.540 -0.464 -13.248 1.00 0.00 N ATOM 1099 CA ASP A 76 3.952 0.339 -14.303 1.00 0.00 C ATOM 1100 C ASP A 76 4.687 1.687 -14.389 1.00 0.00 C ATOM 1101 O ASP A 76 5.270 2.194 -13.414 1.00 0.00 O ATOM 1102 CB ASP A 76 2.453 0.604 -14.113 1.00 0.00 C ATOM 1103 CG ASP A 76 1.625 -0.622 -14.359 1.00 0.00 C ATOM 1104 OD1 ASP A 76 1.377 -0.914 -15.565 1.00 0.00 O ATOM 1105 OD2 ASP A 76 1.209 -1.220 -13.381 1.00 0.00 O ATOM 0 H ASP A 76 4.006 -0.483 -12.379 1.00 0.00 H new ATOM 0 HA ASP A 76 4.061 -0.235 -15.223 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.275 0.963 -13.099 1.00 0.00 H new ATOM 0 HB3 ASP A 76 2.137 1.396 -14.792 1.00 0.00 H new ATOM 1110 N GLU A 77 4.557 2.277 -15.584 1.00 0.00 N ATOM 1111 CA GLU A 77 4.977 3.627 -15.918 1.00 0.00 C ATOM 1112 C GLU A 77 3.921 4.610 -15.431 1.00 0.00 C ATOM 1113 O GLU A 77 4.242 5.743 -15.083 1.00 0.00 O ATOM 1114 CB GLU A 77 5.157 3.676 -17.435 1.00 0.00 C ATOM 1115 CG GLU A 77 5.958 4.900 -17.894 1.00 0.00 C ATOM 1116 CD GLU A 77 7.449 4.842 -17.520 1.00 0.00 C ATOM 1117 OE1 GLU A 77 7.872 3.784 -16.994 1.00 0.00 O ATOM 1118 OE2 GLU A 77 8.123 5.873 -17.764 1.00 0.00 O ATOM 0 H GLU A 77 4.134 1.795 -16.377 1.00 0.00 H new ATOM 0 HA GLU A 77 5.916 3.900 -15.437 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.664 2.770 -17.767 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.178 3.687 -17.913 1.00 0.00 H new ATOM 0 HG2 GLU A 77 5.868 4.997 -18.976 1.00 0.00 H new ATOM 0 HG3 GLU A 77 5.518 5.796 -17.456 1.00 0.00 H new ATOM 1125 N GLU A 78 2.656 4.177 -15.432 1.00 0.00 N ATOM 1126 CA GLU A 78 1.500 4.964 -15.040 1.00 0.00 C ATOM 1127 C GLU A 78 0.987 4.343 -13.741 1.00 0.00 C ATOM 1128 O GLU A 78 0.299 3.331 -13.771 1.00 0.00 O ATOM 1129 CB GLU A 78 0.456 4.959 -16.176 1.00 0.00 C ATOM 1130 CG GLU A 78 -0.587 6.066 -15.977 1.00 0.00 C ATOM 1131 CD GLU A 78 -1.575 6.140 -17.127 1.00 0.00 C ATOM 1132 OE1 GLU A 78 -2.084 5.084 -17.558 1.00 0.00 O ATOM 1133 OE2 GLU A 78 -1.941 7.263 -17.535 1.00 0.00 O ATOM 0 H GLU A 78 2.408 3.230 -15.719 1.00 0.00 H new ATOM 0 HA GLU A 78 1.739 6.013 -14.868 1.00 0.00 H new ATOM 0 HB2 GLU A 78 0.957 5.096 -17.134 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.041 3.990 -16.212 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -1.128 5.890 -15.047 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -0.080 7.025 -15.874 1.00 0.00 H new ATOM 1140 N ARG A 79 1.414 4.908 -12.612 1.00 0.00 N ATOM 1141 CA ARG A 79 1.104 4.456 -11.266 1.00 0.00 C ATOM 1142 C ARG A 79 0.798 5.721 -10.470 1.00 0.00 C ATOM 1143 O ARG A 79 1.354 6.780 -10.782 1.00 0.00 O ATOM 1144 CB ARG A 79 2.292 3.662 -10.691 1.00 0.00 C ATOM 1145 CG ARG A 79 3.442 4.539 -10.160 1.00 0.00 C ATOM 1146 CD ARG A 79 4.584 3.706 -9.562 1.00 0.00 C ATOM 1147 NE ARG A 79 5.403 3.107 -10.621 1.00 0.00 N ATOM 1148 CZ ARG A 79 6.729 2.902 -10.578 1.00 0.00 C ATOM 1149 NH1 ARG A 79 7.447 2.972 -9.440 1.00 0.00 N ATOM 1150 NH2 ARG A 79 7.335 2.618 -11.736 1.00 0.00 N ATOM 0 H ARG A 79 2.014 5.733 -12.617 1.00 0.00 H new ATOM 0 HA ARG A 79 0.252 3.777 -11.232 1.00 0.00 H new ATOM 0 HB2 ARG A 79 1.932 3.026 -9.882 1.00 0.00 H new ATOM 0 HB3 ARG A 79 2.682 3.002 -11.466 1.00 0.00 H new ATOM 0 HG2 ARG A 79 3.831 5.154 -10.971 1.00 0.00 H new ATOM 0 HG3 ARG A 79 3.056 5.219 -9.401 1.00 0.00 H new ATOM 0 HD2 ARG A 79 5.207 4.337 -8.928 1.00 0.00 H new ATOM 0 HD3 ARG A 79 4.173 2.922 -8.926 1.00 0.00 H new ATOM 0 HE ARG A 79 4.919 2.819 -11.471 1.00 0.00 H new ATOM 0 HH11 ARG A 79 6.984 3.189 -8.557 1.00 0.00 H new ATOM 0 HH12 ARG A 79 8.453 2.808 -9.461 1.00 0.00 H new ATOM 0 HH21 ARG A 79 6.791 2.566 -12.597 1.00 0.00 H new ATOM 0 HH22 ARG A 79 8.341 2.454 -11.758 1.00 0.00 H new ATOM 1164 N HIS A 80 -0.055 5.642 -9.448 1.00 0.00 N ATOM 1165 CA HIS A 80 -0.256 6.769 -8.553 1.00 0.00 C ATOM 1166 C HIS A 80 0.911 6.898 -7.572 1.00 0.00 C ATOM 1167 O HIS A 80 1.680 5.955 -7.383 1.00 0.00 O ATOM 1168 CB HIS A 80 -1.555 6.648 -7.762 1.00 0.00 C ATOM 1169 CG HIS A 80 -2.812 6.453 -8.569 1.00 0.00 C ATOM 1170 ND1 HIS A 80 -3.760 5.445 -8.406 1.00 0.00 N ATOM 1171 CD2 HIS A 80 -3.260 7.245 -9.585 1.00 0.00 C ATOM 1172 CE1 HIS A 80 -4.823 5.768 -9.160 1.00 0.00 C ATOM 1173 NE2 HIS A 80 -4.476 6.761 -9.977 1.00 0.00 N ATOM 0 H HIS A 80 -0.610 4.816 -9.225 1.00 0.00 H new ATOM 0 HA HIS A 80 -0.313 7.658 -9.181 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -1.458 5.810 -7.071 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -1.673 7.547 -7.158 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -2.747 8.099 -10.003 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -5.796 5.301 -9.112 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -5.027 7.103 -10.764 1.00 0.00 H new ATOM 1181 N VAL A 81 0.998 8.057 -6.905 1.00 0.00 N ATOM 1182 CA VAL A 81 2.106 8.424 -6.030 1.00 0.00 C ATOM 1183 C VAL A 81 2.422 7.329 -5.011 1.00 0.00 C ATOM 1184 O VAL A 81 3.587 7.090 -4.720 1.00 0.00 O ATOM 1185 CB VAL A 81 1.834 9.793 -5.373 1.00 0.00 C ATOM 1186 CG1 VAL A 81 0.772 9.745 -4.270 1.00 0.00 C ATOM 1187 CG2 VAL A 81 3.123 10.428 -4.834 1.00 0.00 C ATOM 0 H VAL A 81 0.280 8.779 -6.964 1.00 0.00 H new ATOM 0 HA VAL A 81 3.005 8.523 -6.638 1.00 0.00 H new ATOM 0 HB VAL A 81 1.434 10.418 -6.172 1.00 0.00 H new ATOM 0 HG11 VAL A 81 0.634 10.743 -3.854 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -0.171 9.392 -4.688 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.096 9.065 -3.482 1.00 0.00 H new ATOM 0 HG21 VAL A 81 2.891 11.391 -4.379 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.568 9.771 -4.087 1.00 0.00 H new ATOM 0 HG23 VAL A 81 3.827 10.574 -5.653 1.00 0.00 H new ATOM 1197 N GLY A 82 1.389 6.654 -4.496 1.00 0.00 N ATOM 1198 CA GLY A 82 1.555 5.532 -3.592 1.00 0.00 C ATOM 1199 C GLY A 82 0.778 4.312 -4.066 1.00 0.00 C ATOM 1200 O GLY A 82 0.012 3.746 -3.288 1.00 0.00 O ATOM 0 H GLY A 82 0.415 6.878 -4.700 1.00 0.00 H new ATOM 0 HA2 GLY A 82 2.613 5.282 -3.512 1.00 0.00 H new ATOM 0 HA3 GLY A 82 1.218 5.814 -2.595 1.00 0.00 H new ATOM 1204 N ASP A 83 0.968 3.901 -5.324 1.00 0.00 N ATOM 1205 CA ASP A 83 0.516 2.603 -5.817 1.00 0.00 C ATOM 1206 C ASP A 83 1.582 1.550 -5.580 1.00 0.00 C ATOM 1207 O ASP A 83 2.345 1.201 -6.477 1.00 0.00 O ATOM 1208 CB ASP A 83 0.180 2.724 -7.299 1.00 0.00 C ATOM 1209 CG ASP A 83 -1.206 3.288 -7.483 1.00 0.00 C ATOM 1210 OD1 ASP A 83 -1.918 3.480 -6.474 1.00 0.00 O ATOM 1211 OD2 ASP A 83 -1.591 3.524 -8.644 1.00 0.00 O ATOM 0 H ASP A 83 1.442 4.465 -6.029 1.00 0.00 H new ATOM 0 HA ASP A 83 -0.379 2.293 -5.277 1.00 0.00 H new ATOM 0 HB2 ASP A 83 0.909 3.367 -7.792 1.00 0.00 H new ATOM 0 HB3 ASP A 83 0.246 1.745 -7.774 1.00 0.00 H new ATOM 1216 N LEU A 84 1.553 0.973 -4.386 1.00 0.00 N ATOM 1217 CA LEU A 84 2.485 -0.052 -3.958 1.00 0.00 C ATOM 1218 C LEU A 84 1.913 -1.429 -4.308 1.00 0.00 C ATOM 1219 O LEU A 84 2.010 -2.370 -3.523 1.00 0.00 O ATOM 1220 CB LEU A 84 2.731 0.131 -2.453 1.00 0.00 C ATOM 1221 CG LEU A 84 2.901 1.609 -2.050 1.00 0.00 C ATOM 1222 CD1 LEU A 84 3.184 1.705 -0.555 1.00 0.00 C ATOM 1223 CD2 LEU A 84 4.021 2.295 -2.844 1.00 0.00 C ATOM 0 H LEU A 84 0.863 1.213 -3.674 1.00 0.00 H new ATOM 0 HA LEU A 84 3.444 0.030 -4.469 1.00 0.00 H new ATOM 0 HB2 LEU A 84 1.897 -0.298 -1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.624 -0.424 -2.165 1.00 0.00 H new ATOM 0 HG LEU A 84 1.971 2.128 -2.283 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.304 2.751 -0.274 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.352 1.273 0.001 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.099 1.160 -0.322 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.106 3.335 -2.528 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.965 1.781 -2.660 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.788 2.257 -3.908 1.00 0.00 H new ATOM 1235 N GLY A 85 1.300 -1.519 -5.496 1.00 0.00 N ATOM 1236 CA GLY A 85 0.536 -2.658 -5.977 1.00 0.00 C ATOM 1237 C GLY A 85 -0.272 -3.346 -4.867 1.00 0.00 C ATOM 1238 O GLY A 85 -1.095 -2.723 -4.188 1.00 0.00 O ATOM 0 H GLY A 85 1.330 -0.758 -6.174 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -0.143 -2.328 -6.763 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.216 -3.382 -6.427 1.00 0.00 H new ATOM 1242 N ASN A 86 0.000 -4.641 -4.679 1.00 0.00 N ATOM 1243 CA ASN A 86 -0.671 -5.520 -3.735 1.00 0.00 C ATOM 1244 C ASN A 86 0.349 -6.267 -2.882 1.00 0.00 C ATOM 1245 O ASN A 86 1.525 -6.307 -3.235 1.00 0.00 O ATOM 1246 CB ASN A 86 -1.590 -6.495 -4.486 1.00 0.00 C ATOM 1247 CG ASN A 86 -0.913 -7.282 -5.611 1.00 0.00 C ATOM 1248 OD1 ASN A 86 -1.476 -7.399 -6.693 1.00 0.00 O ATOM 1249 ND2 ASN A 86 0.272 -7.853 -5.399 1.00 0.00 N ATOM 0 H ASN A 86 0.728 -5.120 -5.208 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.286 -4.919 -3.066 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.009 -7.201 -3.769 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.425 -5.934 -4.906 1.00 0.00 H new ATOM 0 HD21 ASN A 86 0.718 -8.393 -6.141 1.00 0.00 H new ATOM 0 HD22 ASN A 86 0.733 -7.750 -4.495 1.00 0.00 H new ATOM 1256 N VAL A 87 -0.110 -6.920 -1.813 1.00 0.00 N ATOM 1257 CA VAL A 87 0.714 -7.653 -0.856 1.00 0.00 C ATOM 1258 C VAL A 87 0.180 -9.069 -0.803 1.00 0.00 C ATOM 1259 O VAL A 87 -0.939 -9.282 -1.255 1.00 0.00 O ATOM 1260 CB VAL A 87 0.649 -7.025 0.546 1.00 0.00 C ATOM 1261 CG1 VAL A 87 1.098 -5.568 0.488 1.00 0.00 C ATOM 1262 CG2 VAL A 87 -0.739 -7.136 1.195 1.00 0.00 C ATOM 0 H VAL A 87 -1.103 -6.953 -1.583 1.00 0.00 H new ATOM 0 HA VAL A 87 1.757 -7.626 -1.173 1.00 0.00 H new ATOM 0 HB VAL A 87 1.330 -7.594 1.179 1.00 0.00 H new ATOM 0 HG11 VAL A 87 1.048 -5.132 1.486 1.00 0.00 H new ATOM 0 HG12 VAL A 87 2.123 -5.517 0.120 1.00 0.00 H new ATOM 0 HG13 VAL A 87 0.444 -5.012 -0.184 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -0.717 -6.674 2.182 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.474 -6.626 0.572 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -1.012 -8.187 1.292 1.00 0.00 H new ATOM 1272 N THR A 88 0.931 -9.991 -0.210 1.00 0.00 N ATOM 1273 CA THR A 88 0.650 -11.422 -0.241 1.00 0.00 C ATOM 1274 C THR A 88 0.447 -11.934 1.182 1.00 0.00 C ATOM 1275 O THR A 88 1.422 -12.127 1.904 1.00 0.00 O ATOM 1276 CB THR A 88 1.810 -12.141 -0.953 1.00 0.00 C ATOM 1277 OG1 THR A 88 2.210 -11.390 -2.086 1.00 0.00 O ATOM 1278 CG2 THR A 88 1.396 -13.539 -1.417 1.00 0.00 C ATOM 0 H THR A 88 1.772 -9.758 0.318 1.00 0.00 H new ATOM 0 HA THR A 88 -0.267 -11.623 -0.795 1.00 0.00 H new ATOM 0 HB THR A 88 2.632 -12.233 -0.243 1.00 0.00 H new ATOM 0 HG1 THR A 88 2.950 -11.848 -2.537 1.00 0.00 H new ATOM 0 HG21 THR A 88 2.237 -14.021 -1.916 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.096 -14.135 -0.555 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.560 -13.459 -2.111 1.00 0.00 H new ATOM 1286 N ALA A 89 -0.807 -12.121 1.610 1.00 0.00 N ATOM 1287 CA ALA A 89 -1.080 -12.695 2.916 1.00 0.00 C ATOM 1288 C ALA A 89 -0.822 -14.204 2.941 1.00 0.00 C ATOM 1289 O ALA A 89 -1.112 -14.905 1.970 1.00 0.00 O ATOM 1290 CB ALA A 89 -2.505 -12.367 3.350 1.00 0.00 C ATOM 0 H ALA A 89 -1.638 -11.882 1.069 1.00 0.00 H new ATOM 0 HA ALA A 89 -0.390 -12.247 3.631 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -2.696 -12.803 4.330 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -2.629 -11.285 3.404 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.209 -12.778 2.627 1.00 0.00 H new ATOM 1296 N ASP A 90 -0.311 -14.671 4.084 1.00 0.00 N ATOM 1297 CA ASP A 90 -0.168 -16.067 4.461 1.00 0.00 C ATOM 1298 C ASP A 90 -1.530 -16.680 4.768 1.00 0.00 C ATOM 1299 O ASP A 90 -2.531 -15.984 4.938 1.00 0.00 O ATOM 1300 CB ASP A 90 0.714 -16.182 5.721 1.00 0.00 C ATOM 1301 CG ASP A 90 2.197 -15.993 5.443 1.00 0.00 C ATOM 1302 OD1 ASP A 90 2.683 -16.674 4.515 1.00 0.00 O ATOM 1303 OD2 ASP A 90 2.821 -15.220 6.199 1.00 0.00 O ATOM 0 H ASP A 90 0.032 -14.041 4.809 1.00 0.00 H new ATOM 0 HA ASP A 90 0.293 -16.598 3.628 1.00 0.00 H new ATOM 0 HB2 ASP A 90 0.391 -15.438 6.450 1.00 0.00 H new ATOM 0 HB3 ASP A 90 0.559 -17.161 6.175 1.00 0.00 H new ATOM 1308 N LYS A 91 -1.514 -17.998 4.968 1.00 0.00 N ATOM 1309 CA LYS A 91 -2.595 -18.804 5.503 1.00 0.00 C ATOM 1310 C LYS A 91 -3.090 -18.284 6.858 1.00 0.00 C ATOM 1311 O LYS A 91 -4.224 -18.540 7.252 1.00 0.00 O ATOM 1312 CB LYS A 91 -2.094 -20.249 5.616 1.00 0.00 C ATOM 1313 CG LYS A 91 -0.885 -20.420 6.554 1.00 0.00 C ATOM 1314 CD LYS A 91 -0.663 -21.901 6.871 1.00 0.00 C ATOM 1315 CE LYS A 91 0.493 -22.043 7.872 1.00 0.00 C ATOM 1316 NZ LYS A 91 0.634 -23.427 8.360 1.00 0.00 N ATOM 0 H LYS A 91 -0.692 -18.559 4.745 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.451 -18.750 4.830 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -2.909 -20.879 5.972 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -1.824 -20.608 4.623 1.00 0.00 H new ATOM 0 HG2 LYS A 91 0.008 -20.003 6.087 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.051 -19.865 7.477 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -1.573 -22.335 7.286 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -0.436 -22.449 5.957 1.00 0.00 H new ATOM 0 HE2 LYS A 91 1.423 -21.729 7.399 1.00 0.00 H new ATOM 0 HE3 LYS A 91 0.325 -21.376 8.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.425 -23.479 9.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -0.244 -23.719 8.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.820 -24.061 7.557 1.00 0.00 H new ATOM 1330 N ASP A 92 -2.223 -17.572 7.584 1.00 0.00 N ATOM 1331 CA ASP A 92 -2.491 -17.035 8.901 1.00 0.00 C ATOM 1332 C ASP A 92 -3.059 -15.618 8.772 1.00 0.00 C ATOM 1333 O ASP A 92 -3.378 -14.974 9.768 1.00 0.00 O ATOM 1334 CB ASP A 92 -1.174 -17.066 9.685 1.00 0.00 C ATOM 1335 CG ASP A 92 -1.103 -18.272 10.614 1.00 0.00 C ATOM 1336 OD1 ASP A 92 -0.739 -19.359 10.108 1.00 0.00 O ATOM 1337 OD2 ASP A 92 -1.415 -18.087 11.810 1.00 0.00 O ATOM 0 H ASP A 92 -1.285 -17.352 7.250 1.00 0.00 H new ATOM 0 HA ASP A 92 -3.236 -17.625 9.435 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -0.336 -17.092 8.989 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -1.075 -16.150 10.268 1.00 0.00 H new ATOM 1342 N GLY A 93 -3.184 -15.117 7.539 1.00 0.00 N ATOM 1343 CA GLY A 93 -3.768 -13.819 7.272 1.00 0.00 C ATOM 1344 C GLY A 93 -2.812 -12.677 7.613 1.00 0.00 C ATOM 1345 O GLY A 93 -3.247 -11.571 7.960 1.00 0.00 O ATOM 0 H GLY A 93 -2.878 -15.611 6.701 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.046 -13.757 6.220 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.685 -13.709 7.851 1.00 0.00 H new ATOM 1349 N VAL A 94 -1.510 -12.962 7.484 1.00 0.00 N ATOM 1350 CA VAL A 94 -0.402 -12.048 7.704 1.00 0.00 C ATOM 1351 C VAL A 94 0.235 -11.770 6.352 1.00 0.00 C ATOM 1352 O VAL A 94 0.747 -12.693 5.733 1.00 0.00 O ATOM 1353 CB VAL A 94 0.610 -12.670 8.684 1.00 0.00 C ATOM 1354 CG1 VAL A 94 1.852 -11.776 8.864 1.00 0.00 C ATOM 1355 CG2 VAL A 94 -0.072 -12.911 10.033 1.00 0.00 C ATOM 0 H VAL A 94 -1.193 -13.891 7.207 1.00 0.00 H new ATOM 0 HA VAL A 94 -0.747 -11.114 8.148 1.00 0.00 H new ATOM 0 HB VAL A 94 0.950 -13.619 8.269 1.00 0.00 H new ATOM 0 HG11 VAL A 94 2.542 -12.249 9.563 1.00 0.00 H new ATOM 0 HG12 VAL A 94 2.345 -11.641 7.902 1.00 0.00 H new ATOM 0 HG13 VAL A 94 1.548 -10.805 9.255 1.00 0.00 H new ATOM 0 HG21 VAL A 94 0.643 -13.351 10.728 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -0.431 -11.963 10.434 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.914 -13.590 9.899 1.00 0.00 H new ATOM 1365 N ALA A 95 0.194 -10.526 5.879 1.00 0.00 N ATOM 1366 CA ALA A 95 0.927 -10.107 4.702 1.00 0.00 C ATOM 1367 C ALA A 95 2.123 -9.334 5.211 1.00 0.00 C ATOM 1368 O ALA A 95 1.955 -8.213 5.699 1.00 0.00 O ATOM 1369 CB ALA A 95 0.060 -9.242 3.782 1.00 0.00 C ATOM 0 H ALA A 95 -0.354 -9.781 6.309 1.00 0.00 H new ATOM 0 HA ALA A 95 1.234 -10.965 4.104 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.641 -8.945 2.909 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.812 -9.812 3.461 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -0.267 -8.352 4.320 1.00 0.00 H new ATOM 1375 N ASP A 96 3.302 -9.951 5.132 1.00 0.00 N ATOM 1376 CA ASP A 96 4.542 -9.239 5.347 1.00 0.00 C ATOM 1377 C ASP A 96 4.830 -8.440 4.082 1.00 0.00 C ATOM 1378 O ASP A 96 4.885 -9.008 2.990 1.00 0.00 O ATOM 1379 CB ASP A 96 5.694 -10.176 5.700 1.00 0.00 C ATOM 1380 CG ASP A 96 6.878 -9.331 6.145 1.00 0.00 C ATOM 1381 OD1 ASP A 96 6.855 -8.922 7.328 1.00 0.00 O ATOM 1382 OD2 ASP A 96 7.753 -9.079 5.288 1.00 0.00 O ATOM 0 H ASP A 96 3.415 -10.942 4.920 1.00 0.00 H new ATOM 0 HA ASP A 96 4.443 -8.572 6.204 1.00 0.00 H new ATOM 0 HB2 ASP A 96 5.397 -10.861 6.494 1.00 0.00 H new ATOM 0 HB3 ASP A 96 5.965 -10.786 4.838 1.00 0.00 H new ATOM 1387 N VAL A 97 4.936 -7.122 4.212 1.00 0.00 N ATOM 1388 CA VAL A 97 5.299 -6.249 3.112 1.00 0.00 C ATOM 1389 C VAL A 97 6.795 -6.009 3.246 1.00 0.00 C ATOM 1390 O VAL A 97 7.278 -5.843 4.365 1.00 0.00 O ATOM 1391 CB VAL A 97 4.508 -4.928 3.158 1.00 0.00 C ATOM 1392 CG1 VAL A 97 4.588 -4.209 1.806 1.00 0.00 C ATOM 1393 CG2 VAL A 97 3.044 -5.179 3.531 1.00 0.00 C ATOM 0 H VAL A 97 4.771 -6.631 5.090 1.00 0.00 H new ATOM 0 HA VAL A 97 5.058 -6.703 2.151 1.00 0.00 H new ATOM 0 HB VAL A 97 4.955 -4.294 3.924 1.00 0.00 H new ATOM 0 HG11 VAL A 97 4.024 -3.278 1.855 1.00 0.00 H new ATOM 0 HG12 VAL A 97 5.630 -3.990 1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 97 4.167 -4.847 1.029 1.00 0.00 H new ATOM 0 HG21 VAL A 97 2.507 -4.231 3.557 1.00 0.00 H new ATOM 0 HG22 VAL A 97 2.587 -5.835 2.790 1.00 0.00 H new ATOM 0 HG23 VAL A 97 2.994 -5.651 4.512 1.00 0.00 H new ATOM 1403 N SER A 98 7.506 -5.961 2.119 1.00 0.00 N ATOM 1404 CA SER A 98 8.910 -5.576 2.039 1.00 0.00 C ATOM 1405 C SER A 98 9.212 -5.269 0.567 1.00 0.00 C ATOM 1406 O SER A 98 9.681 -6.141 -0.160 1.00 0.00 O ATOM 1407 CB SER A 98 9.823 -6.661 2.646 1.00 0.00 C ATOM 1408 OG SER A 98 10.992 -6.065 3.192 1.00 0.00 O ATOM 0 H SER A 98 7.106 -6.197 1.211 1.00 0.00 H new ATOM 0 HA SER A 98 9.112 -4.685 2.633 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.287 -7.206 3.423 1.00 0.00 H new ATOM 0 HB3 SER A 98 10.099 -7.386 1.880 1.00 0.00 H new ATOM 0 HG SER A 98 11.565 -6.761 3.577 1.00 0.00 H new ATOM 1414 N ILE A 99 8.879 -4.055 0.123 1.00 0.00 N ATOM 1415 CA ILE A 99 9.081 -3.570 -1.240 1.00 0.00 C ATOM 1416 C ILE A 99 9.780 -2.207 -1.162 1.00 0.00 C ATOM 1417 O ILE A 99 9.987 -1.680 -0.068 1.00 0.00 O ATOM 1418 CB ILE A 99 7.725 -3.546 -1.984 1.00 0.00 C ATOM 1419 CG1 ILE A 99 7.892 -3.498 -3.514 1.00 0.00 C ATOM 1420 CG2 ILE A 99 6.804 -2.418 -1.496 1.00 0.00 C ATOM 1421 CD1 ILE A 99 6.617 -3.886 -4.273 1.00 0.00 C ATOM 0 H ILE A 99 8.445 -3.358 0.728 1.00 0.00 H new ATOM 0 HA ILE A 99 9.726 -4.230 -1.820 1.00 0.00 H new ATOM 0 HB ILE A 99 7.240 -4.491 -1.739 1.00 0.00 H new ATOM 0 HG12 ILE A 99 8.191 -2.492 -3.809 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.700 -4.169 -3.806 1.00 0.00 H new ATOM 0 HG21 ILE A 99 5.867 -2.448 -2.052 1.00 0.00 H new ATOM 0 HG22 ILE A 99 6.600 -2.549 -0.433 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.291 -1.456 -1.656 1.00 0.00 H new ATOM 0 HD11 ILE A 99 6.802 -3.832 -5.346 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.329 -4.903 -4.005 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.813 -3.200 -4.008 1.00 0.00 H new ATOM 1433 N GLU A 100 10.166 -1.642 -2.302 1.00 0.00 N ATOM 1434 CA GLU A 100 10.983 -0.452 -2.437 1.00 0.00 C ATOM 1435 C GLU A 100 10.424 0.370 -3.600 1.00 0.00 C ATOM 1436 O GLU A 100 10.132 -0.195 -4.652 1.00 0.00 O ATOM 1437 CB GLU A 100 12.462 -0.851 -2.628 1.00 0.00 C ATOM 1438 CG GLU A 100 12.759 -1.850 -3.764 1.00 0.00 C ATOM 1439 CD GLU A 100 12.231 -3.251 -3.475 1.00 0.00 C ATOM 1440 OE1 GLU A 100 12.926 -3.989 -2.745 1.00 0.00 O ATOM 1441 OE2 GLU A 100 11.115 -3.540 -3.961 1.00 0.00 O ATOM 0 H GLU A 100 9.898 -2.030 -3.207 1.00 0.00 H new ATOM 0 HA GLU A 100 10.950 0.164 -1.538 1.00 0.00 H new ATOM 0 HB2 GLU A 100 13.040 0.055 -2.810 1.00 0.00 H new ATOM 0 HB3 GLU A 100 12.824 -1.278 -1.693 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.314 -1.483 -4.689 1.00 0.00 H new ATOM 0 HG3 GLU A 100 13.836 -1.899 -3.926 1.00 0.00 H new ATOM 1448 N ASP A 101 10.253 1.687 -3.422 1.00 0.00 N ATOM 1449 CA ASP A 101 9.893 2.586 -4.521 1.00 0.00 C ATOM 1450 C ASP A 101 10.824 3.792 -4.498 1.00 0.00 C ATOM 1451 O ASP A 101 11.326 4.184 -3.443 1.00 0.00 O ATOM 1452 CB ASP A 101 8.423 3.052 -4.471 1.00 0.00 C ATOM 1453 CG ASP A 101 7.588 2.603 -5.674 1.00 0.00 C ATOM 1454 OD1 ASP A 101 7.827 3.117 -6.797 1.00 0.00 O ATOM 1455 OD2 ASP A 101 6.678 1.783 -5.445 1.00 0.00 O ATOM 0 H ASP A 101 10.360 2.153 -2.521 1.00 0.00 H new ATOM 0 HA ASP A 101 10.005 2.027 -5.450 1.00 0.00 H new ATOM 0 HB2 ASP A 101 7.962 2.672 -3.559 1.00 0.00 H new ATOM 0 HB3 ASP A 101 8.399 4.140 -4.410 1.00 0.00 H new ATOM 1460 N SER A 102 11.031 4.383 -5.678 1.00 0.00 N ATOM 1461 CA SER A 102 11.932 5.504 -5.905 1.00 0.00 C ATOM 1462 C SER A 102 11.153 6.804 -6.156 1.00 0.00 C ATOM 1463 O SER A 102 11.731 7.807 -6.564 1.00 0.00 O ATOM 1464 CB SER A 102 12.866 5.142 -7.073 1.00 0.00 C ATOM 1465 OG SER A 102 14.086 5.852 -6.994 1.00 0.00 O ATOM 0 H SER A 102 10.556 4.079 -6.528 1.00 0.00 H new ATOM 0 HA SER A 102 12.534 5.688 -5.015 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.065 4.070 -7.064 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.373 5.366 -8.019 1.00 0.00 H new ATOM 0 HG SER A 102 14.660 5.601 -7.748 1.00 0.00 H new ATOM 1471 N VAL A 103 9.831 6.782 -5.950 1.00 0.00 N ATOM 1472 CA VAL A 103 8.949 7.922 -6.180 1.00 0.00 C ATOM 1473 C VAL A 103 8.629 8.601 -4.844 1.00 0.00 C ATOM 1474 O VAL A 103 8.813 9.808 -4.697 1.00 0.00 O ATOM 1475 CB VAL A 103 7.692 7.452 -6.940 1.00 0.00 C ATOM 1476 CG1 VAL A 103 6.679 8.592 -7.113 1.00 0.00 C ATOM 1477 CG2 VAL A 103 8.084 6.927 -8.330 1.00 0.00 C ATOM 0 H VAL A 103 9.340 5.954 -5.613 1.00 0.00 H new ATOM 0 HA VAL A 103 9.437 8.670 -6.805 1.00 0.00 H new ATOM 0 HB VAL A 103 7.231 6.659 -6.351 1.00 0.00 H new ATOM 0 HG11 VAL A 103 5.806 8.224 -7.653 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.372 8.958 -6.133 1.00 0.00 H new ATOM 0 HG13 VAL A 103 7.138 9.404 -7.676 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.190 6.597 -8.860 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.569 7.723 -8.896 1.00 0.00 H new ATOM 0 HG23 VAL A 103 8.772 6.088 -8.222 1.00 0.00 H new ATOM 1487 N ILE A 104 8.144 7.834 -3.866 1.00 0.00 N ATOM 1488 CA ILE A 104 7.911 8.317 -2.521 1.00 0.00 C ATOM 1489 C ILE A 104 9.243 8.600 -1.818 1.00 0.00 C ATOM 1490 O ILE A 104 10.284 8.082 -2.218 1.00 0.00 O ATOM 1491 CB ILE A 104 7.069 7.277 -1.780 1.00 0.00 C ATOM 1492 CG1 ILE A 104 7.647 5.869 -1.993 1.00 0.00 C ATOM 1493 CG2 ILE A 104 5.620 7.337 -2.278 1.00 0.00 C ATOM 1494 CD1 ILE A 104 7.031 4.875 -1.039 1.00 0.00 C ATOM 0 H ILE A 104 7.902 6.852 -3.996 1.00 0.00 H new ATOM 0 HA ILE A 104 7.365 9.260 -2.537 1.00 0.00 H new ATOM 0 HB ILE A 104 7.090 7.499 -0.713 1.00 0.00 H new ATOM 0 HG12 ILE A 104 7.467 5.551 -3.020 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.727 5.891 -1.851 1.00 0.00 H new ATOM 0 HG21 ILE A 104 5.022 6.595 -1.749 1.00 0.00 H new ATOM 0 HG22 ILE A 104 5.212 8.331 -2.093 1.00 0.00 H new ATOM 0 HG23 ILE A 104 5.594 7.128 -3.347 1.00 0.00 H new ATOM 0 HD11 ILE A 104 7.460 3.888 -1.214 1.00 0.00 H new ATOM 0 HD12 ILE A 104 7.234 5.182 -0.013 1.00 0.00 H new ATOM 0 HD13 ILE A 104 5.954 4.836 -1.200 1.00 0.00 H new ATOM 1506 N SER A 105 9.209 9.440 -0.779 1.00 0.00 N ATOM 1507 CA SER A 105 10.373 9.976 -0.080 1.00 0.00 C ATOM 1508 C SER A 105 9.780 10.935 0.931 1.00 0.00 C ATOM 1509 O SER A 105 8.998 11.801 0.549 1.00 0.00 O ATOM 1510 CB SER A 105 11.317 10.716 -1.037 1.00 0.00 C ATOM 1511 OG SER A 105 12.265 9.816 -1.572 1.00 0.00 O ATOM 0 H SER A 105 8.329 9.777 -0.388 1.00 0.00 H new ATOM 0 HA SER A 105 10.975 9.191 0.377 1.00 0.00 H new ATOM 0 HB2 SER A 105 10.744 11.176 -1.843 1.00 0.00 H new ATOM 0 HB3 SER A 105 11.826 11.522 -0.508 1.00 0.00 H new ATOM 0 HG SER A 105 11.804 9.027 -1.926 1.00 0.00 H new ATOM 1517 N LEU A 106 10.135 10.798 2.208 1.00 0.00 N ATOM 1518 CA LEU A 106 9.638 11.613 3.305 1.00 0.00 C ATOM 1519 C LEU A 106 10.308 12.988 3.297 1.00 0.00 C ATOM 1520 O LEU A 106 10.648 13.534 4.344 1.00 0.00 O ATOM 1521 CB LEU A 106 9.837 10.884 4.641 1.00 0.00 C ATOM 1522 CG LEU A 106 9.518 9.377 4.616 1.00 0.00 C ATOM 1523 CD1 LEU A 106 9.482 8.871 6.057 1.00 0.00 C ATOM 1524 CD2 LEU A 106 8.191 8.973 3.989 1.00 0.00 C ATOM 0 H LEU A 106 10.801 10.089 2.513 1.00 0.00 H new ATOM 0 HA LEU A 106 8.568 11.774 3.175 1.00 0.00 H new ATOM 0 HB2 LEU A 106 10.871 11.016 4.959 1.00 0.00 H new ATOM 0 HB3 LEU A 106 9.209 11.360 5.394 1.00 0.00 H new ATOM 0 HG LEU A 106 10.300 8.943 3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.257 7.804 6.063 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.451 9.040 6.526 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.712 9.407 6.612 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.083 7.889 4.032 1.00 0.00 H new ATOM 0 HD22 LEU A 106 7.373 9.441 4.536 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.166 9.299 2.949 1.00 0.00 H new ATOM 1536 N SER A 107 10.518 13.541 2.104 1.00 0.00 N ATOM 1537 CA SER A 107 11.233 14.775 1.879 1.00 0.00 C ATOM 1538 C SER A 107 10.771 15.370 0.555 1.00 0.00 C ATOM 1539 O SER A 107 10.420 14.634 -0.369 1.00 0.00 O ATOM 1540 CB SER A 107 12.741 14.499 1.880 1.00 0.00 C ATOM 1541 OG SER A 107 13.045 13.385 1.059 1.00 0.00 O ATOM 0 H SER A 107 10.178 13.118 1.241 1.00 0.00 H new ATOM 0 HA SER A 107 11.027 15.493 2.673 1.00 0.00 H new ATOM 0 HB2 SER A 107 13.277 15.378 1.522 1.00 0.00 H new ATOM 0 HB3 SER A 107 13.081 14.311 2.898 1.00 0.00 H new ATOM 0 HG SER A 107 14.012 13.225 1.070 1.00 0.00 H new ATOM 1547 N GLY A 108 10.737 16.703 0.486 1.00 0.00 N ATOM 1548 CA GLY A 108 9.973 17.389 -0.536 1.00 0.00 C ATOM 1549 C GLY A 108 8.486 17.060 -0.385 1.00 0.00 C ATOM 1550 O GLY A 108 8.067 16.327 0.518 1.00 0.00 O ATOM 0 H GLY A 108 11.232 17.321 1.129 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.126 18.465 -0.456 1.00 0.00 H new ATOM 0 HA3 GLY A 108 10.322 17.090 -1.525 1.00 0.00 H new ATOM 1554 N ASP A 109 7.678 17.596 -1.293 1.00 0.00 N ATOM 1555 CA ASP A 109 6.225 17.541 -1.228 1.00 0.00 C ATOM 1556 C ASP A 109 5.679 16.109 -1.315 1.00 0.00 C ATOM 1557 O ASP A 109 4.516 15.862 -0.999 1.00 0.00 O ATOM 1558 CB ASP A 109 5.660 18.437 -2.336 1.00 0.00 C ATOM 1559 CG ASP A 109 6.285 19.828 -2.277 1.00 0.00 C ATOM 1560 OD1 ASP A 109 7.482 19.897 -2.644 1.00 0.00 O ATOM 1561 OD2 ASP A 109 5.591 20.760 -1.819 1.00 0.00 O ATOM 0 H ASP A 109 8.025 18.092 -2.114 1.00 0.00 H new ATOM 0 HA ASP A 109 5.901 17.908 -0.254 1.00 0.00 H new ATOM 0 HB2 ASP A 109 5.855 17.987 -3.309 1.00 0.00 H new ATOM 0 HB3 ASP A 109 4.578 18.515 -2.231 1.00 0.00 H new ATOM 1566 N HIS A 110 6.514 15.150 -1.735 1.00 0.00 N ATOM 1567 CA HIS A 110 6.137 13.753 -1.918 1.00 0.00 C ATOM 1568 C HIS A 110 5.921 13.021 -0.593 1.00 0.00 C ATOM 1569 O HIS A 110 5.319 11.950 -0.600 1.00 0.00 O ATOM 1570 CB HIS A 110 7.200 13.042 -2.763 1.00 0.00 C ATOM 1571 CG HIS A 110 7.477 13.748 -4.064 1.00 0.00 C ATOM 1572 ND1 HIS A 110 8.456 14.693 -4.279 1.00 0.00 N ATOM 1573 CD2 HIS A 110 6.713 13.677 -5.199 1.00 0.00 C ATOM 1574 CE1 HIS A 110 8.285 15.175 -5.521 1.00 0.00 C ATOM 1575 NE2 HIS A 110 7.239 14.585 -6.124 1.00 0.00 N ATOM 0 H HIS A 110 7.492 15.334 -1.961 1.00 0.00 H new ATOM 0 HA HIS A 110 5.179 13.735 -2.439 1.00 0.00 H new ATOM 0 HB2 HIS A 110 8.124 12.969 -2.190 1.00 0.00 H new ATOM 0 HB3 HIS A 110 6.872 12.023 -2.970 1.00 0.00 H new ATOM 0 HD2 HIS A 110 5.858 13.035 -5.352 1.00 0.00 H new ATOM 0 HE1 HIS A 110 8.905 15.935 -5.974 1.00 0.00 H new ATOM 0 HE2 HIS A 110 6.897 14.764 -7.068 1.00 0.00 H new ATOM 1583 N SER A 111 6.425 13.560 0.524 1.00 0.00 N ATOM 1584 CA SER A 111 6.291 12.946 1.839 1.00 0.00 C ATOM 1585 C SER A 111 4.870 12.416 2.113 1.00 0.00 C ATOM 1586 O SER A 111 3.925 13.183 2.338 1.00 0.00 O ATOM 1587 CB SER A 111 6.717 13.956 2.911 1.00 0.00 C ATOM 1588 OG SER A 111 6.868 13.300 4.155 1.00 0.00 O ATOM 0 H SER A 111 6.940 14.441 0.534 1.00 0.00 H new ATOM 0 HA SER A 111 6.945 12.074 1.869 1.00 0.00 H new ATOM 0 HB2 SER A 111 7.655 14.431 2.624 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.972 14.747 2.995 1.00 0.00 H new ATOM 0 HG SER A 111 7.142 13.949 4.836 1.00 0.00 H new ATOM 1594 N ILE A 112 4.729 11.082 2.147 1.00 0.00 N ATOM 1595 CA ILE A 112 3.469 10.433 2.490 1.00 0.00 C ATOM 1596 C ILE A 112 3.174 10.543 3.989 1.00 0.00 C ATOM 1597 O ILE A 112 2.083 10.179 4.418 1.00 0.00 O ATOM 1598 CB ILE A 112 3.363 8.990 1.947 1.00 0.00 C ATOM 1599 CG1 ILE A 112 3.906 7.878 2.863 1.00 0.00 C ATOM 1600 CG2 ILE A 112 3.946 8.878 0.533 1.00 0.00 C ATOM 1601 CD1 ILE A 112 5.388 8.006 3.183 1.00 0.00 C ATOM 0 H ILE A 112 5.486 10.431 1.937 1.00 0.00 H new ATOM 0 HA ILE A 112 2.678 10.980 1.976 1.00 0.00 H new ATOM 0 HB ILE A 112 2.289 8.805 1.914 1.00 0.00 H new ATOM 0 HG12 ILE A 112 3.342 7.883 3.796 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.730 6.913 2.389 1.00 0.00 H new ATOM 0 HG21 ILE A 112 3.855 7.850 0.182 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.400 9.540 -0.139 1.00 0.00 H new ATOM 0 HG23 ILE A 112 4.998 9.164 0.549 1.00 0.00 H new ATOM 0 HD11 ILE A 112 5.692 7.185 3.833 1.00 0.00 H new ATOM 0 HD12 ILE A 112 5.964 7.970 2.259 1.00 0.00 H new ATOM 0 HD13 ILE A 112 5.571 8.955 3.688 1.00 0.00 H new ATOM 1613 N ILE A 113 4.113 11.075 4.785 1.00 0.00 N ATOM 1614 CA ILE A 113 3.856 11.453 6.164 1.00 0.00 C ATOM 1615 C ILE A 113 2.602 12.317 6.166 1.00 0.00 C ATOM 1616 O ILE A 113 2.558 13.361 5.515 1.00 0.00 O ATOM 1617 CB ILE A 113 5.051 12.217 6.768 1.00 0.00 C ATOM 1618 CG1 ILE A 113 6.345 11.387 6.787 1.00 0.00 C ATOM 1619 CG2 ILE A 113 4.742 12.718 8.186 1.00 0.00 C ATOM 1620 CD1 ILE A 113 6.222 10.077 7.570 1.00 0.00 C ATOM 0 H ILE A 113 5.070 11.252 4.481 1.00 0.00 H new ATOM 0 HA ILE A 113 3.714 10.565 6.779 1.00 0.00 H new ATOM 0 HB ILE A 113 5.214 13.072 6.112 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.637 11.161 5.761 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.145 11.987 7.222 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.607 13.252 8.580 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.884 13.390 8.156 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.515 11.869 8.831 1.00 0.00 H new ATOM 0 HD11 ILE A 113 7.173 9.545 7.540 1.00 0.00 H new ATOM 0 HD12 ILE A 113 5.961 10.295 8.605 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.445 9.457 7.123 1.00 0.00 H new ATOM 1632 N GLY A 114 1.573 11.835 6.853 1.00 0.00 N ATOM 1633 CA GLY A 114 0.300 12.495 6.980 1.00 0.00 C ATOM 1634 C GLY A 114 -0.818 11.714 6.292 1.00 0.00 C ATOM 1635 O GLY A 114 -1.937 11.672 6.793 1.00 0.00 O ATOM 0 H GLY A 114 1.613 10.945 7.349 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.059 12.619 8.036 1.00 0.00 H new ATOM 0 HA3 GLY A 114 0.364 13.494 6.548 1.00 0.00 H new ATOM 1639 N ARG A 115 -0.523 11.107 5.138 1.00 0.00 N ATOM 1640 CA ARG A 115 -1.540 10.529 4.268 1.00 0.00 C ATOM 1641 C ARG A 115 -2.165 9.272 4.880 1.00 0.00 C ATOM 1642 O ARG A 115 -1.643 8.718 5.851 1.00 0.00 O ATOM 1643 CB ARG A 115 -0.941 10.205 2.892 1.00 0.00 C ATOM 1644 CG ARG A 115 -0.721 11.404 1.960 1.00 0.00 C ATOM 1645 CD ARG A 115 0.338 12.421 2.409 1.00 0.00 C ATOM 1646 NE ARG A 115 -0.242 13.663 2.940 1.00 0.00 N ATOM 1647 CZ ARG A 115 0.458 14.802 3.089 1.00 0.00 C ATOM 1648 NH1 ARG A 115 1.788 14.823 2.913 1.00 0.00 N ATOM 1649 NH2 ARG A 115 -0.175 15.937 3.390 1.00 0.00 N ATOM 0 H ARG A 115 0.429 11.005 4.785 1.00 0.00 H new ATOM 0 HA ARG A 115 -2.332 11.269 4.151 1.00 0.00 H new ATOM 0 HB2 ARG A 115 0.016 9.705 3.042 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -1.597 9.494 2.390 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -0.440 11.027 0.976 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -1.670 11.926 1.842 1.00 0.00 H new ATOM 0 HD2 ARG A 115 0.969 11.966 3.173 1.00 0.00 H new ATOM 0 HD3 ARG A 115 0.984 12.661 1.564 1.00 0.00 H new ATOM 0 HE ARG A 115 -1.226 13.661 3.209 1.00 0.00 H new ATOM 0 HH11 ARG A 115 2.283 13.967 2.662 1.00 0.00 H new ATOM 0 HH12 ARG A 115 2.304 15.695 3.030 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -1.188 15.940 3.507 1.00 0.00 H new ATOM 0 HH22 ARG A 115 0.354 16.802 3.503 1.00 0.00 H new ATOM 1663 N THR A 116 -3.258 8.795 4.275 1.00 0.00 N ATOM 1664 CA THR A 116 -3.936 7.573 4.670 1.00 0.00 C ATOM 1665 C THR A 116 -3.469 6.392 3.805 1.00 0.00 C ATOM 1666 O THR A 116 -3.729 6.381 2.603 1.00 0.00 O ATOM 1667 CB THR A 116 -5.452 7.779 4.566 1.00 0.00 C ATOM 1668 OG1 THR A 116 -5.806 9.052 5.055 1.00 0.00 O ATOM 1669 CG2 THR A 116 -6.246 6.733 5.350 1.00 0.00 C ATOM 0 H THR A 116 -3.698 9.263 3.483 1.00 0.00 H new ATOM 0 HA THR A 116 -3.686 7.336 5.704 1.00 0.00 H new ATOM 0 HB THR A 116 -5.701 7.682 3.509 1.00 0.00 H new ATOM 0 HG1 THR A 116 -5.713 9.065 6.030 1.00 0.00 H new ATOM 0 HG21 THR A 116 -7.313 6.928 5.240 1.00 0.00 H new ATOM 0 HG22 THR A 116 -6.018 5.739 4.965 1.00 0.00 H new ATOM 0 HG23 THR A 116 -5.974 6.785 6.404 1.00 0.00 H new ATOM 1677 N LEU A 117 -2.814 5.384 4.391 1.00 0.00 N ATOM 1678 CA LEU A 117 -2.501 4.130 3.707 1.00 0.00 C ATOM 1679 C LEU A 117 -3.663 3.173 3.978 1.00 0.00 C ATOM 1680 O LEU A 117 -4.004 2.937 5.138 1.00 0.00 O ATOM 1681 CB LEU A 117 -1.162 3.552 4.205 1.00 0.00 C ATOM 1682 CG LEU A 117 -0.493 2.522 3.268 1.00 0.00 C ATOM 1683 CD1 LEU A 117 -1.412 1.405 2.774 1.00 0.00 C ATOM 1684 CD2 LEU A 117 0.181 3.196 2.069 1.00 0.00 C ATOM 0 H LEU A 117 -2.486 5.418 5.356 1.00 0.00 H new ATOM 0 HA LEU A 117 -2.385 4.289 2.635 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -0.467 4.377 4.365 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -1.327 3.082 5.174 1.00 0.00 H new ATOM 0 HG LEU A 117 0.258 2.047 3.899 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -0.851 0.734 2.124 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -1.797 0.846 3.627 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -2.244 1.837 2.218 1.00 0.00 H new ATOM 0 HD21 LEU A 117 0.639 2.437 1.435 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.564 3.747 1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 117 0.948 3.885 2.423 1.00 0.00 H new ATOM 1696 N VAL A 118 -4.297 2.649 2.927 1.00 0.00 N ATOM 1697 CA VAL A 118 -5.465 1.789 3.053 1.00 0.00 C ATOM 1698 C VAL A 118 -5.229 0.492 2.264 1.00 0.00 C ATOM 1699 O VAL A 118 -4.614 0.526 1.194 1.00 0.00 O ATOM 1700 CB VAL A 118 -6.703 2.592 2.613 1.00 0.00 C ATOM 1701 CG1 VAL A 118 -8.005 1.848 2.899 1.00 0.00 C ATOM 1702 CG2 VAL A 118 -6.786 3.939 3.346 1.00 0.00 C ATOM 0 H VAL A 118 -4.010 2.813 1.962 1.00 0.00 H new ATOM 0 HA VAL A 118 -5.641 1.478 4.083 1.00 0.00 H new ATOM 0 HB VAL A 118 -6.587 2.741 1.539 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -8.850 2.454 2.571 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -8.008 0.900 2.361 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -8.088 1.658 3.969 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -7.671 4.481 3.012 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -6.850 3.765 4.420 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -5.896 4.528 3.126 1.00 0.00 H new ATOM 1712 N VAL A 119 -5.676 -0.646 2.817 1.00 0.00 N ATOM 1713 CA VAL A 119 -5.565 -1.965 2.196 1.00 0.00 C ATOM 1714 C VAL A 119 -6.918 -2.344 1.586 1.00 0.00 C ATOM 1715 O VAL A 119 -7.945 -1.833 2.029 1.00 0.00 O ATOM 1716 CB VAL A 119 -5.086 -3.008 3.223 1.00 0.00 C ATOM 1717 CG1 VAL A 119 -6.080 -3.198 4.366 1.00 0.00 C ATOM 1718 CG2 VAL A 119 -4.857 -4.385 2.597 1.00 0.00 C ATOM 0 H VAL A 119 -6.134 -0.670 3.728 1.00 0.00 H new ATOM 0 HA VAL A 119 -4.821 -1.939 1.400 1.00 0.00 H new ATOM 0 HB VAL A 119 -4.146 -2.606 3.602 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -5.696 -3.943 5.062 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -6.219 -2.251 4.888 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -7.036 -3.535 3.965 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -4.520 -5.082 3.364 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -5.789 -4.746 2.162 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -4.098 -4.309 1.818 1.00 0.00 H new ATOM 1728 N HIS A 120 -6.936 -3.255 0.606 1.00 0.00 N ATOM 1729 CA HIS A 120 -8.143 -3.709 -0.076 1.00 0.00 C ATOM 1730 C HIS A 120 -8.433 -5.183 0.148 1.00 0.00 C ATOM 1731 O HIS A 120 -7.562 -5.973 0.507 1.00 0.00 O ATOM 1732 CB HIS A 120 -8.069 -3.414 -1.575 1.00 0.00 C ATOM 1733 CG HIS A 120 -8.215 -1.955 -1.837 1.00 0.00 C ATOM 1734 ND1 HIS A 120 -9.375 -1.271 -2.071 1.00 0.00 N ATOM 1735 CD2 HIS A 120 -7.150 -1.119 -1.829 1.00 0.00 C ATOM 1736 CE1 HIS A 120 -9.024 0.001 -2.310 1.00 0.00 C ATOM 1737 NE2 HIS A 120 -7.677 0.113 -2.192 1.00 0.00 N ATOM 0 H HIS A 120 -6.088 -3.705 0.260 1.00 0.00 H new ATOM 0 HA HIS A 120 -8.967 -3.148 0.363 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.117 -3.765 -1.972 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.854 -3.962 -2.097 1.00 0.00 H new ATOM 0 HD1 HIS A 120 -10.321 -1.653 -2.065 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.123 -1.357 -1.594 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.702 0.805 -2.556 1.00 0.00 H new ATOM 1745 N GLU A 121 -9.693 -5.543 -0.086 1.00 0.00 N ATOM 1746 CA GLU A 121 -10.224 -6.874 0.095 1.00 0.00 C ATOM 1747 C GLU A 121 -9.587 -7.880 -0.854 1.00 0.00 C ATOM 1748 O GLU A 121 -9.328 -9.014 -0.461 1.00 0.00 O ATOM 1749 CB GLU A 121 -11.741 -6.802 -0.108 1.00 0.00 C ATOM 1750 CG GLU A 121 -12.448 -8.153 0.039 1.00 0.00 C ATOM 1751 CD GLU A 121 -13.961 -7.978 0.013 1.00 0.00 C ATOM 1752 OE1 GLU A 121 -14.404 -6.896 -0.441 1.00 0.00 O ATOM 1753 OE2 GLU A 121 -14.634 -8.937 0.442 1.00 0.00 O ATOM 0 H GLU A 121 -10.393 -4.881 -0.420 1.00 0.00 H new ATOM 0 HA GLU A 121 -9.991 -7.225 1.100 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -12.162 -6.101 0.613 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -11.947 -6.400 -1.100 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -12.141 -8.819 -0.767 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -12.148 -8.625 0.974 1.00 0.00 H new ATOM 1760 N LYS A 122 -9.326 -7.475 -2.094 1.00 0.00 N ATOM 1761 CA LYS A 122 -8.593 -8.292 -3.055 1.00 0.00 C ATOM 1762 C LYS A 122 -7.362 -7.527 -3.535 1.00 0.00 C ATOM 1763 O LYS A 122 -7.145 -6.382 -3.127 1.00 0.00 O ATOM 1764 CB LYS A 122 -9.512 -8.692 -4.212 1.00 0.00 C ATOM 1765 CG LYS A 122 -10.837 -9.276 -3.695 1.00 0.00 C ATOM 1766 CD LYS A 122 -11.338 -10.387 -4.627 1.00 0.00 C ATOM 1767 CE LYS A 122 -10.618 -11.715 -4.326 1.00 0.00 C ATOM 1768 NZ LYS A 122 -11.191 -12.401 -3.150 1.00 0.00 N ATOM 0 H LYS A 122 -9.618 -6.569 -2.461 1.00 0.00 H new ATOM 0 HA LYS A 122 -8.252 -9.213 -2.581 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.714 -7.822 -4.836 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -9.009 -9.426 -4.842 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.698 -9.673 -2.689 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -11.586 -8.487 -3.626 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.413 -10.515 -4.504 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -11.168 -10.102 -5.665 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.685 -12.369 -5.195 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.559 -11.522 -4.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -10.678 -13.290 -2.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -11.104 -11.788 -2.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.195 -12.609 -3.324 1.00 0.00 H new ATOM 1782 N ALA A 123 -6.535 -8.155 -4.377 1.00 0.00 N ATOM 1783 CA ALA A 123 -5.472 -7.439 -5.064 1.00 0.00 C ATOM 1784 C ALA A 123 -6.065 -6.392 -5.987 1.00 0.00 C ATOM 1785 O ALA A 123 -7.191 -6.519 -6.460 1.00 0.00 O ATOM 1786 CB ALA A 123 -4.551 -8.368 -5.851 1.00 0.00 C ATOM 0 H ALA A 123 -6.586 -9.150 -4.594 1.00 0.00 H new ATOM 0 HA ALA A 123 -4.863 -6.957 -4.299 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -3.776 -7.780 -6.344 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -4.087 -9.082 -5.171 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -5.131 -8.905 -6.601 1.00 0.00 H new ATOM 1792 N ASP A 124 -5.266 -5.362 -6.226 1.00 0.00 N ATOM 1793 CA ASP A 124 -5.563 -4.342 -7.202 1.00 0.00 C ATOM 1794 C ASP A 124 -5.164 -4.888 -8.581 1.00 0.00 C ATOM 1795 O ASP A 124 -4.166 -5.596 -8.705 1.00 0.00 O ATOM 1796 CB ASP A 124 -4.813 -3.071 -6.784 1.00 0.00 C ATOM 1797 CG ASP A 124 -3.464 -2.960 -7.458 1.00 0.00 C ATOM 1798 OD1 ASP A 124 -3.482 -2.647 -8.666 1.00 0.00 O ATOM 1799 OD2 ASP A 124 -2.468 -3.080 -6.724 1.00 0.00 O ATOM 0 H ASP A 124 -4.383 -5.216 -5.737 1.00 0.00 H new ATOM 0 HA ASP A 124 -6.620 -4.083 -7.259 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -5.415 -2.197 -7.032 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.679 -3.069 -5.702 1.00 0.00 H new ATOM 1804 N ASP A 125 -5.951 -4.578 -9.611 1.00 0.00 N ATOM 1805 CA ASP A 125 -5.778 -5.087 -10.965 1.00 0.00 C ATOM 1806 C ASP A 125 -4.717 -4.305 -11.762 1.00 0.00 C ATOM 1807 O ASP A 125 -4.857 -4.130 -12.973 1.00 0.00 O ATOM 1808 CB ASP A 125 -7.166 -5.018 -11.613 1.00 0.00 C ATOM 1809 CG ASP A 125 -7.245 -5.622 -13.003 1.00 0.00 C ATOM 1810 OD1 ASP A 125 -6.699 -6.730 -13.190 1.00 0.00 O ATOM 1811 OD2 ASP A 125 -7.909 -4.958 -13.831 1.00 0.00 O ATOM 0 H ASP A 125 -6.748 -3.948 -9.521 1.00 0.00 H new ATOM 0 HA ASP A 125 -5.398 -6.109 -10.953 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -7.880 -5.530 -10.968 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.476 -3.974 -11.666 1.00 0.00 H new ATOM 1816 N LEU A 126 -3.665 -3.778 -11.110 1.00 0.00 N ATOM 1817 CA LEU A 126 -2.577 -3.051 -11.765 1.00 0.00 C ATOM 1818 C LEU A 126 -3.124 -1.963 -12.698 1.00 0.00 C ATOM 1819 O LEU A 126 -2.538 -1.642 -13.728 1.00 0.00 O ATOM 1820 CB LEU A 126 -1.634 -4.059 -12.455 1.00 0.00 C ATOM 1821 CG LEU A 126 -0.519 -4.615 -11.544 1.00 0.00 C ATOM 1822 CD1 LEU A 126 0.678 -3.679 -11.579 1.00 0.00 C ATOM 1823 CD2 LEU A 126 -0.909 -4.858 -10.076 1.00 0.00 C ATOM 0 H LEU A 126 -3.551 -3.849 -10.099 1.00 0.00 H new ATOM 0 HA LEU A 126 -1.982 -2.515 -11.026 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.226 -4.892 -12.833 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.175 -3.577 -13.318 1.00 0.00 H new ATOM 0 HG LEU A 126 -0.292 -5.599 -11.954 1.00 0.00 H new ATOM 0 HD11 LEU A 126 1.466 -4.071 -10.936 1.00 0.00 H new ATOM 0 HD12 LEU A 126 1.049 -3.601 -12.601 1.00 0.00 H new ATOM 0 HD13 LEU A 126 0.379 -2.692 -11.226 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -0.049 -5.248 -9.531 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -1.229 -3.919 -9.624 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.725 -5.579 -10.031 1.00 0.00 H new ATOM 1835 N GLY A 127 -4.271 -1.395 -12.308 1.00 0.00 N ATOM 1836 CA GLY A 127 -5.060 -0.442 -13.074 1.00 0.00 C ATOM 1837 C GLY A 127 -5.137 -0.769 -14.558 1.00 0.00 C ATOM 1838 O GLY A 127 -5.015 0.132 -15.387 1.00 0.00 O ATOM 0 H GLY A 127 -4.690 -1.603 -11.401 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -6.070 -0.407 -12.665 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -4.632 0.553 -12.951 1.00 0.00 H new ATOM 1842 N LYS A 128 -5.343 -2.043 -14.900 1.00 0.00 N ATOM 1843 CA LYS A 128 -5.357 -2.497 -16.285 1.00 0.00 C ATOM 1844 C LYS A 128 -6.709 -3.074 -16.694 1.00 0.00 C ATOM 1845 O LYS A 128 -6.862 -3.506 -17.833 1.00 0.00 O ATOM 1846 CB LYS A 128 -4.171 -3.451 -16.498 1.00 0.00 C ATOM 1847 CG LYS A 128 -2.867 -2.630 -16.595 1.00 0.00 C ATOM 1848 CD LYS A 128 -2.455 -2.389 -18.052 1.00 0.00 C ATOM 1849 CE LYS A 128 -1.612 -1.118 -18.206 1.00 0.00 C ATOM 1850 NZ LYS A 128 -0.514 -1.018 -17.218 1.00 0.00 N ATOM 0 H LYS A 128 -5.505 -2.787 -14.221 1.00 0.00 H new ATOM 0 HA LYS A 128 -5.228 -1.648 -16.956 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -4.107 -4.160 -15.673 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -4.316 -4.033 -17.408 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -3.002 -1.672 -16.092 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -2.067 -3.155 -16.073 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -1.888 -3.246 -18.415 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -3.347 -2.310 -18.673 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -1.190 -1.090 -19.211 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -2.260 -0.247 -18.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 0.135 -0.254 -17.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -0.910 -0.811 -16.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 0.005 -1.918 -17.184 1.00 0.00 H new ATOM 1864 N GLY A 129 -7.737 -2.959 -15.849 1.00 0.00 N ATOM 1865 CA GLY A 129 -9.074 -3.449 -16.166 1.00 0.00 C ATOM 1866 C GLY A 129 -9.868 -2.505 -17.076 1.00 0.00 C ATOM 1867 O GLY A 129 -11.091 -2.608 -17.132 1.00 0.00 O ATOM 0 H GLY A 129 -7.663 -2.524 -14.929 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -8.991 -4.423 -16.649 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -9.627 -3.599 -15.239 1.00 0.00 H new ATOM 1871 N GLY A 130 -9.192 -1.583 -17.773 1.00 0.00 N ATOM 1872 CA GLY A 130 -9.754 -0.725 -18.810 1.00 0.00 C ATOM 1873 C GLY A 130 -11.078 -0.059 -18.431 1.00 0.00 C ATOM 1874 O GLY A 130 -12.010 -0.034 -19.232 1.00 0.00 O ATOM 0 H GLY A 130 -8.198 -1.412 -17.619 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -9.028 0.051 -19.055 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -9.905 -1.317 -19.712 1.00 0.00 H new ATOM 1878 N ASN A 131 -11.165 0.491 -17.218 1.00 0.00 N ATOM 1879 CA ASN A 131 -12.387 1.066 -16.678 1.00 0.00 C ATOM 1880 C ASN A 131 -11.983 1.987 -15.542 1.00 0.00 C ATOM 1881 O ASN A 131 -11.126 1.579 -14.764 1.00 0.00 O ATOM 1882 CB ASN A 131 -13.334 -0.086 -16.285 1.00 0.00 C ATOM 1883 CG ASN A 131 -14.142 0.194 -15.030 1.00 0.00 C ATOM 1884 OD1 ASN A 131 -13.429 0.299 -13.919 1.00 0.00 O flip ATOM 1885 ND2 ASN A 131 -15.359 0.317 -15.043 1.00 0.00 N flip ATOM 0 H ASN A 131 -10.373 0.548 -16.578 1.00 0.00 H new ATOM 0 HA ASN A 131 -12.944 1.671 -17.393 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -14.017 -0.282 -17.111 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -12.748 -0.992 -16.135 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -15.871 0.229 -15.921 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -15.862 0.508 -14.176 1.00 0.00 H new ATOM 1892 N GLU A 132 -12.591 3.167 -15.407 1.00 0.00 N ATOM 1893 CA GLU A 132 -12.335 4.146 -14.359 1.00 0.00 C ATOM 1894 C GLU A 132 -12.071 3.487 -13.008 1.00 0.00 C ATOM 1895 O GLU A 132 -10.979 3.617 -12.478 1.00 0.00 O ATOM 1896 CB GLU A 132 -13.482 5.164 -14.272 1.00 0.00 C ATOM 1897 CG GLU A 132 -13.473 6.169 -15.436 1.00 0.00 C ATOM 1898 CD GLU A 132 -14.207 5.674 -16.679 1.00 0.00 C ATOM 1899 OE1 GLU A 132 -13.757 4.652 -17.242 1.00 0.00 O ATOM 1900 OE2 GLU A 132 -15.215 6.318 -17.030 1.00 0.00 O ATOM 0 H GLU A 132 -13.310 3.477 -16.060 1.00 0.00 H new ATOM 0 HA GLU A 132 -11.425 4.682 -14.629 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -14.434 4.633 -14.263 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.411 5.706 -13.329 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.929 7.101 -15.103 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.440 6.396 -15.701 1.00 0.00 H new ATOM 1907 N GLN A 133 -13.046 2.767 -12.450 1.00 0.00 N ATOM 1908 CA GLN A 133 -12.924 2.125 -11.150 1.00 0.00 C ATOM 1909 C GLN A 133 -11.581 1.373 -10.988 1.00 0.00 C ATOM 1910 O GLN A 133 -10.779 1.770 -10.157 1.00 0.00 O ATOM 1911 CB GLN A 133 -14.183 1.290 -10.859 1.00 0.00 C ATOM 1912 CG GLN A 133 -14.692 1.505 -9.430 1.00 0.00 C ATOM 1913 CD GLN A 133 -13.605 1.320 -8.400 1.00 0.00 C ATOM 1914 OE1 GLN A 133 -13.234 2.255 -7.696 1.00 0.00 O ATOM 1915 NE2 GLN A 133 -13.042 0.128 -8.374 1.00 0.00 N ATOM 0 H GLN A 133 -13.950 2.615 -12.897 1.00 0.00 H new ATOM 0 HA GLN A 133 -12.879 2.887 -10.372 1.00 0.00 H new ATOM 0 HB2 GLN A 133 -14.967 1.556 -11.568 1.00 0.00 H new ATOM 0 HB3 GLN A 133 -13.961 0.234 -11.011 1.00 0.00 H new ATOM 0 HG2 GLN A 133 -15.106 2.510 -9.342 1.00 0.00 H new ATOM 0 HG3 GLN A 133 -15.504 0.807 -9.227 1.00 0.00 H new ATOM 0 HE21 GLN A 133 -13.391 -0.614 -8.981 1.00 0.00 H new ATOM 0 HE22 GLN A 133 -12.258 -0.052 -7.747 1.00 0.00 H new ATOM 1924 N SER A 134 -11.292 0.335 -11.779 1.00 0.00 N ATOM 1925 CA SER A 134 -9.981 -0.293 -11.943 1.00 0.00 C ATOM 1926 C SER A 134 -8.861 0.739 -12.106 1.00 0.00 C ATOM 1927 O SER A 134 -7.937 0.786 -11.303 1.00 0.00 O ATOM 1928 CB SER A 134 -9.978 -1.288 -13.121 1.00 0.00 C ATOM 1929 OG SER A 134 -8.728 -1.964 -13.188 1.00 0.00 O ATOM 0 H SER A 134 -12.007 -0.113 -12.353 1.00 0.00 H new ATOM 0 HA SER A 134 -9.784 -0.847 -11.025 1.00 0.00 H new ATOM 0 HB2 SER A 134 -10.785 -2.011 -12.999 1.00 0.00 H new ATOM 0 HB3 SER A 134 -10.164 -0.758 -14.055 1.00 0.00 H new ATOM 0 HG SER A 134 -8.872 -2.928 -13.087 1.00 0.00 H new ATOM 1935 N THR A 135 -8.933 1.597 -13.116 1.00 0.00 N ATOM 1936 CA THR A 135 -7.853 2.519 -13.444 1.00 0.00 C ATOM 1937 C THR A 135 -7.725 3.652 -12.409 1.00 0.00 C ATOM 1938 O THR A 135 -6.830 4.488 -12.518 1.00 0.00 O ATOM 1939 CB THR A 135 -8.014 3.027 -14.883 1.00 0.00 C ATOM 1940 OG1 THR A 135 -9.244 3.693 -15.027 1.00 0.00 O ATOM 1941 CG2 THR A 135 -7.963 1.888 -15.908 1.00 0.00 C ATOM 0 H THR A 135 -9.743 1.673 -13.731 1.00 0.00 H new ATOM 0 HA THR A 135 -6.907 1.980 -13.394 1.00 0.00 H new ATOM 0 HB THR A 135 -7.182 3.705 -15.071 1.00 0.00 H new ATOM 0 HG1 THR A 135 -9.699 3.731 -14.160 1.00 0.00 H new ATOM 0 HG21 THR A 135 -8.081 2.296 -16.912 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.004 1.376 -15.835 1.00 0.00 H new ATOM 0 HG23 THR A 135 -8.768 1.181 -15.707 1.00 0.00 H new ATOM 1949 N LYS A 136 -8.576 3.650 -11.380 1.00 0.00 N ATOM 1950 CA LYS A 136 -8.557 4.513 -10.217 1.00 0.00 C ATOM 1951 C LYS A 136 -8.187 3.711 -8.962 1.00 0.00 C ATOM 1952 O LYS A 136 -7.589 4.287 -8.055 1.00 0.00 O ATOM 1953 CB LYS A 136 -9.954 5.129 -10.081 1.00 0.00 C ATOM 1954 CG LYS A 136 -10.101 6.086 -8.895 1.00 0.00 C ATOM 1955 CD LYS A 136 -11.500 6.721 -8.863 1.00 0.00 C ATOM 1956 CE LYS A 136 -12.628 5.671 -8.820 1.00 0.00 C ATOM 1957 NZ LYS A 136 -13.944 6.286 -8.551 1.00 0.00 N ATOM 0 H LYS A 136 -9.353 2.990 -11.345 1.00 0.00 H new ATOM 0 HA LYS A 136 -7.809 5.298 -10.330 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -10.194 5.665 -10.999 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -10.685 4.327 -9.980 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -9.922 5.547 -7.965 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -9.345 6.869 -8.960 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -11.580 7.370 -7.991 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -11.629 7.351 -9.743 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -12.664 5.138 -9.770 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -12.408 4.933 -8.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -14.675 5.547 -8.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -13.918 6.773 -7.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -14.167 6.972 -9.301 1.00 0.00 H new ATOM 1971 N THR A 137 -8.563 2.424 -8.867 1.00 0.00 N ATOM 1972 CA THR A 137 -8.370 1.675 -7.609 1.00 0.00 C ATOM 1973 C THR A 137 -7.724 0.302 -7.771 1.00 0.00 C ATOM 1974 O THR A 137 -7.104 -0.210 -6.839 1.00 0.00 O ATOM 1975 CB THR A 137 -9.691 1.481 -6.866 1.00 0.00 C ATOM 1976 OG1 THR A 137 -10.534 0.684 -7.664 1.00 0.00 O ATOM 1977 CG2 THR A 137 -10.364 2.812 -6.522 1.00 0.00 C ATOM 0 H THR A 137 -8.991 1.890 -9.623 1.00 0.00 H new ATOM 0 HA THR A 137 -7.681 2.301 -7.041 1.00 0.00 H new ATOM 0 HB THR A 137 -9.491 0.987 -5.915 1.00 0.00 H new ATOM 0 HG1 THR A 137 -10.692 1.132 -8.521 1.00 0.00 H new ATOM 0 HG21 THR A 137 -11.299 2.621 -5.995 1.00 0.00 H new ATOM 0 HG22 THR A 137 -9.702 3.401 -5.886 1.00 0.00 H new ATOM 0 HG23 THR A 137 -10.571 3.363 -7.439 1.00 0.00 H new ATOM 1985 N GLY A 138 -7.958 -0.326 -8.914 1.00 0.00 N ATOM 1986 CA GLY A 138 -7.608 -1.692 -9.211 1.00 0.00 C ATOM 1987 C GLY A 138 -8.825 -2.592 -9.081 1.00 0.00 C ATOM 1988 O GLY A 138 -8.673 -3.797 -9.227 1.00 0.00 O ATOM 0 H GLY A 138 -8.423 0.136 -9.696 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -7.205 -1.759 -10.221 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.825 -2.029 -8.532 1.00 0.00 H new ATOM 1992 N ASN A 139 -10.022 -2.049 -8.801 1.00 0.00 N ATOM 1993 CA ASN A 139 -11.243 -2.842 -8.806 1.00 0.00 C ATOM 1994 C ASN A 139 -11.217 -3.984 -7.793 1.00 0.00 C ATOM 1995 O ASN A 139 -12.009 -4.916 -7.884 1.00 0.00 O ATOM 1996 CB ASN A 139 -11.566 -3.338 -10.231 1.00 0.00 C ATOM 1997 CG ASN A 139 -12.956 -2.930 -10.713 1.00 0.00 C ATOM 1998 OD1 ASN A 139 -13.572 -2.007 -10.184 1.00 0.00 O ATOM 1999 ND2 ASN A 139 -13.448 -3.579 -11.764 1.00 0.00 N ATOM 0 H ASN A 139 -10.160 -1.065 -8.570 1.00 0.00 H new ATOM 0 HA ASN A 139 -12.052 -2.185 -8.485 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -10.820 -2.946 -10.922 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -11.485 -4.425 -10.257 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -14.355 -3.314 -12.148 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -12.918 -4.342 -12.186 1.00 0.00 H new ATOM 2006 N ALA A 140 -10.315 -3.892 -6.814 1.00 0.00 N ATOM 2007 CA ALA A 140 -10.081 -4.927 -5.827 1.00 0.00 C ATOM 2008 C ALA A 140 -11.376 -5.216 -5.075 1.00 0.00 C ATOM 2009 O ALA A 140 -11.770 -6.366 -4.907 1.00 0.00 O ATOM 2010 CB ALA A 140 -9.029 -4.416 -4.845 1.00 0.00 C ATOM 0 H ALA A 140 -9.718 -3.074 -6.690 1.00 0.00 H new ATOM 0 HA ALA A 140 -9.739 -5.842 -6.311 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -8.835 -5.178 -4.091 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -8.107 -4.194 -5.382 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.393 -3.510 -4.360 1.00 0.00 H new ATOM 2016 N GLY A 141 -11.996 -4.148 -4.575 1.00 0.00 N ATOM 2017 CA GLY A 141 -13.131 -4.236 -3.683 1.00 0.00 C ATOM 2018 C GLY A 141 -12.882 -3.357 -2.469 1.00 0.00 C ATOM 2019 O GLY A 141 -12.026 -2.460 -2.486 1.00 0.00 O ATOM 0 H GLY A 141 -11.714 -3.191 -4.786 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -14.038 -3.918 -4.197 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -13.286 -5.269 -3.373 1.00 0.00 H new ATOM 2023 N SER A 142 -13.663 -3.612 -1.417 1.00 0.00 N ATOM 2024 CA SER A 142 -13.735 -2.730 -0.270 1.00 0.00 C ATOM 2025 C SER A 142 -12.415 -2.706 0.496 1.00 0.00 C ATOM 2026 O SER A 142 -11.505 -3.497 0.247 1.00 0.00 O ATOM 2027 CB SER A 142 -14.898 -3.137 0.637 1.00 0.00 C ATOM 2028 OG SER A 142 -15.254 -2.023 1.435 1.00 0.00 O ATOM 0 H SER A 142 -14.259 -4.437 -1.345 1.00 0.00 H new ATOM 0 HA SER A 142 -13.917 -1.716 -0.627 1.00 0.00 H new ATOM 0 HB2 SER A 142 -15.749 -3.463 0.039 1.00 0.00 H new ATOM 0 HB3 SER A 142 -14.611 -3.979 1.267 1.00 0.00 H new ATOM 0 HG SER A 142 -16.000 -2.266 2.022 1.00 0.00 H new ATOM 2034 N ARG A 143 -12.320 -1.761 1.422 1.00 0.00 N ATOM 2035 CA ARG A 143 -11.148 -1.546 2.244 1.00 0.00 C ATOM 2036 C ARG A 143 -11.243 -2.401 3.510 1.00 0.00 C ATOM 2037 O ARG A 143 -12.067 -2.115 4.374 1.00 0.00 O ATOM 2038 CB ARG A 143 -11.019 -0.060 2.600 1.00 0.00 C ATOM 2039 CG ARG A 143 -11.173 0.876 1.384 1.00 0.00 C ATOM 2040 CD ARG A 143 -12.372 1.803 1.620 1.00 0.00 C ATOM 2041 NE ARG A 143 -12.610 2.705 0.484 1.00 0.00 N ATOM 2042 CZ ARG A 143 -13.600 3.613 0.440 1.00 0.00 C ATOM 2043 NH1 ARG A 143 -14.397 3.778 1.502 1.00 0.00 N ATOM 2044 NH2 ARG A 143 -13.798 4.337 -0.667 1.00 0.00 N ATOM 0 H ARG A 143 -13.078 -1.109 1.623 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.258 -1.842 1.689 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.774 0.195 3.343 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -10.047 0.113 3.061 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -10.265 1.462 1.242 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -11.321 0.292 0.475 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -13.264 1.202 1.797 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -12.201 2.393 2.520 1.00 0.00 H new ATOM 0 HE ARG A 143 -11.986 2.638 -0.320 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -14.252 3.216 2.341 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -15.150 4.466 1.473 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -13.197 4.201 -1.480 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -14.550 5.026 -0.698 1.00 0.00 H new ATOM 2058 N LEU A 144 -10.409 -3.438 3.645 1.00 0.00 N ATOM 2059 CA LEU A 144 -10.385 -4.236 4.875 1.00 0.00 C ATOM 2060 C LEU A 144 -9.953 -3.370 6.063 1.00 0.00 C ATOM 2061 O LEU A 144 -10.463 -3.561 7.164 1.00 0.00 O ATOM 2062 CB LEU A 144 -9.456 -5.466 4.758 1.00 0.00 C ATOM 2063 CG LEU A 144 -10.045 -6.783 4.196 1.00 0.00 C ATOM 2064 CD1 LEU A 144 -10.394 -7.738 5.343 1.00 0.00 C ATOM 2065 CD2 LEU A 144 -11.309 -6.565 3.359 1.00 0.00 C ATOM 0 H LEU A 144 -9.750 -3.741 2.928 1.00 0.00 H new ATOM 0 HA LEU A 144 -11.398 -4.603 5.038 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -8.611 -5.185 4.129 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.058 -5.677 5.751 1.00 0.00 H new ATOM 0 HG LEU A 144 -9.276 -7.206 3.550 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -10.807 -8.661 4.935 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.494 -7.965 5.914 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -11.129 -7.269 5.996 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -11.673 -7.525 2.994 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -12.077 -6.096 3.975 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -11.078 -5.919 2.512 1.00 0.00 H new ATOM 2077 N ALA A 145 -8.989 -2.463 5.864 1.00 0.00 N ATOM 2078 CA ALA A 145 -8.412 -1.663 6.935 1.00 0.00 C ATOM 2079 C ALA A 145 -7.775 -0.392 6.380 1.00 0.00 C ATOM 2080 O ALA A 145 -7.435 -0.331 5.197 1.00 0.00 O ATOM 2081 CB ALA A 145 -7.404 -2.497 7.737 1.00 0.00 C ATOM 0 H ALA A 145 -8.589 -2.267 4.946 1.00 0.00 H new ATOM 0 HA ALA A 145 -9.209 -1.357 7.613 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -6.980 -1.887 8.535 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -7.909 -3.360 8.170 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -6.606 -2.837 7.077 1.00 0.00 H new ATOM 2087 N CYS A 146 -7.634 0.615 7.245 1.00 0.00 N ATOM 2088 CA CYS A 146 -7.128 1.945 6.950 1.00 0.00 C ATOM 2089 C CYS A 146 -6.159 2.334 8.062 1.00 0.00 C ATOM 2090 O CYS A 146 -6.352 1.962 9.214 1.00 0.00 O ATOM 2091 CB CYS A 146 -8.277 2.961 6.869 1.00 0.00 C ATOM 2092 SG CYS A 146 -9.585 2.789 8.103 1.00 0.00 S ATOM 0 H CYS A 146 -7.887 0.511 8.228 1.00 0.00 H new ATOM 0 HA CYS A 146 -6.622 1.944 5.985 1.00 0.00 H new ATOM 0 HB2 CYS A 146 -7.855 3.962 6.955 1.00 0.00 H new ATOM 0 HB3 CYS A 146 -8.728 2.889 5.879 1.00 0.00 H new ATOM 2097 N GLY A 147 -5.091 3.051 7.721 1.00 0.00 N ATOM 2098 CA GLY A 147 -4.145 3.613 8.671 1.00 0.00 C ATOM 2099 C GLY A 147 -3.624 4.931 8.119 1.00 0.00 C ATOM 2100 O GLY A 147 -3.827 5.222 6.941 1.00 0.00 O ATOM 0 H GLY A 147 -4.857 3.260 6.751 1.00 0.00 H new ATOM 0 HA2 GLY A 147 -4.627 3.772 9.636 1.00 0.00 H new ATOM 0 HA3 GLY A 147 -3.320 2.920 8.837 1.00 0.00 H new ATOM 2104 N VAL A 148 -2.949 5.726 8.952 1.00 0.00 N ATOM 2105 CA VAL A 148 -2.360 6.997 8.548 1.00 0.00 C ATOM 2106 C VAL A 148 -0.862 6.932 8.810 1.00 0.00 C ATOM 2107 O VAL A 148 -0.451 6.296 9.781 1.00 0.00 O ATOM 2108 CB VAL A 148 -3.056 8.180 9.247 1.00 0.00 C ATOM 2109 CG1 VAL A 148 -4.582 8.048 9.154 1.00 0.00 C ATOM 2110 CG2 VAL A 148 -2.656 8.332 10.720 1.00 0.00 C ATOM 0 H VAL A 148 -2.796 5.500 9.935 1.00 0.00 H new ATOM 0 HA VAL A 148 -2.511 7.170 7.482 1.00 0.00 H new ATOM 0 HB VAL A 148 -2.722 9.074 8.719 1.00 0.00 H new ATOM 0 HG11 VAL A 148 -5.052 8.895 9.655 1.00 0.00 H new ATOM 0 HG12 VAL A 148 -4.883 8.033 8.106 1.00 0.00 H new ATOM 0 HG13 VAL A 148 -4.897 7.122 9.635 1.00 0.00 H new ATOM 0 HG21 VAL A 148 -3.181 9.183 11.154 1.00 0.00 H new ATOM 0 HG22 VAL A 148 -2.922 7.426 11.265 1.00 0.00 H new ATOM 0 HG23 VAL A 148 -1.581 8.495 10.790 1.00 0.00 H new ATOM 2120 N ILE A 149 -0.044 7.521 7.933 1.00 0.00 N ATOM 2121 CA ILE A 149 1.405 7.390 8.035 1.00 0.00 C ATOM 2122 C ILE A 149 1.945 8.524 8.908 1.00 0.00 C ATOM 2123 O ILE A 149 1.664 9.687 8.625 1.00 0.00 O ATOM 2124 CB ILE A 149 2.068 7.370 6.643 1.00 0.00 C ATOM 2125 CG1 ILE A 149 1.354 6.408 5.662 1.00 0.00 C ATOM 2126 CG2 ILE A 149 3.542 6.972 6.804 1.00 0.00 C ATOM 2127 CD1 ILE A 149 0.660 7.140 4.508 1.00 0.00 C ATOM 0 H ILE A 149 -0.363 8.090 7.149 1.00 0.00 H new ATOM 0 HA ILE A 149 1.650 6.437 8.503 1.00 0.00 H new ATOM 0 HB ILE A 149 1.989 8.368 6.213 1.00 0.00 H new ATOM 0 HG12 ILE A 149 2.082 5.706 5.255 1.00 0.00 H new ATOM 0 HG13 ILE A 149 0.616 5.821 6.209 1.00 0.00 H new ATOM 0 HG21 ILE A 149 4.023 6.954 5.826 1.00 0.00 H new ATOM 0 HG22 ILE A 149 4.047 7.696 7.443 1.00 0.00 H new ATOM 0 HG23 ILE A 149 3.604 5.983 7.257 1.00 0.00 H new ATOM 0 HD11 ILE A 149 0.177 6.414 3.854 1.00 0.00 H new ATOM 0 HD12 ILE A 149 -0.090 7.822 4.908 1.00 0.00 H new ATOM 0 HD13 ILE A 149 1.398 7.706 3.940 1.00 0.00 H new ATOM 2139 N GLY A 150 2.722 8.210 9.947 1.00 0.00 N ATOM 2140 CA GLY A 150 3.286 9.191 10.859 1.00 0.00 C ATOM 2141 C GLY A 150 4.674 8.749 11.310 1.00 0.00 C ATOM 2142 O GLY A 150 5.133 7.664 10.965 1.00 0.00 O ATOM 0 H GLY A 150 2.977 7.250 10.177 1.00 0.00 H new ATOM 0 HA2 GLY A 150 3.347 10.163 10.369 1.00 0.00 H new ATOM 0 HA3 GLY A 150 2.635 9.311 11.725 1.00 0.00 H new ATOM 2146 N ILE A 151 5.355 9.612 12.061 1.00 0.00 N ATOM 2147 CA ILE A 151 6.689 9.393 12.588 1.00 0.00 C ATOM 2148 C ILE A 151 6.712 8.135 13.456 1.00 0.00 C ATOM 2149 O ILE A 151 5.837 7.942 14.296 1.00 0.00 O ATOM 2150 CB ILE A 151 7.109 10.625 13.409 1.00 0.00 C ATOM 2151 CG1 ILE A 151 7.011 11.916 12.572 1.00 0.00 C ATOM 2152 CG2 ILE A 151 8.533 10.465 13.965 1.00 0.00 C ATOM 2153 CD1 ILE A 151 5.876 12.830 13.046 1.00 0.00 C ATOM 0 H ILE A 151 4.971 10.519 12.327 1.00 0.00 H new ATOM 0 HA ILE A 151 7.391 9.250 11.767 1.00 0.00 H new ATOM 0 HB ILE A 151 6.417 10.704 14.247 1.00 0.00 H new ATOM 0 HG12 ILE A 151 7.957 12.455 12.628 1.00 0.00 H new ATOM 0 HG13 ILE A 151 6.853 11.657 11.525 1.00 0.00 H new ATOM 0 HG21 ILE A 151 8.801 11.351 14.540 1.00 0.00 H new ATOM 0 HG22 ILE A 151 8.575 9.587 14.610 1.00 0.00 H new ATOM 0 HG23 ILE A 151 9.234 10.343 13.140 1.00 0.00 H new ATOM 0 HD11 ILE A 151 5.847 13.726 12.426 1.00 0.00 H new ATOM 0 HD12 ILE A 151 4.926 12.302 12.965 1.00 0.00 H new ATOM 0 HD13 ILE A 151 6.046 13.113 14.085 1.00 0.00 H new ATOM 2165 N ALA A 152 7.737 7.304 13.273 1.00 0.00 N ATOM 2166 CA ALA A 152 7.985 6.157 14.133 1.00 0.00 C ATOM 2167 C ALA A 152 8.835 6.586 15.334 1.00 0.00 C ATOM 2168 O ALA A 152 10.068 6.512 15.288 1.00 0.00 O ATOM 2169 CB ALA A 152 8.651 5.034 13.332 1.00 0.00 C ATOM 0 H ALA A 152 8.418 7.411 12.521 1.00 0.00 H new ATOM 0 HA ALA A 152 7.040 5.770 14.514 1.00 0.00 H new ATOM 0 HB1 ALA A 152 8.833 4.180 13.985 1.00 0.00 H new ATOM 0 HB2 ALA A 152 7.996 4.733 12.514 1.00 0.00 H new ATOM 0 HB3 ALA A 152 9.599 5.389 12.927 1.00 0.00 H new ATOM 2175 N GLN A 153 8.186 7.043 16.407 1.00 0.00 N ATOM 2176 CA GLN A 153 8.736 7.129 17.748 1.00 0.00 C ATOM 2177 C GLN A 153 7.570 7.447 18.678 1.00 0.00 C ATOM 2178 O GLN A 153 6.443 7.531 18.137 1.00 0.00 O ATOM 2179 CB GLN A 153 9.859 8.175 17.861 1.00 0.00 C ATOM 2180 CG GLN A 153 11.004 7.609 18.714 1.00 0.00 C ATOM 2181 CD GLN A 153 12.253 8.484 18.722 1.00 0.00 C ATOM 2182 OE1 GLN A 153 12.363 9.456 17.978 1.00 0.00 O ATOM 2183 NE2 GLN A 153 13.260 8.092 19.496 1.00 0.00 N ATOM 2184 OXT GLN A 153 7.831 7.600 19.890 1.00 0.00 O ATOM 0 H GLN A 153 7.223 7.375 16.356 1.00 0.00 H new ATOM 0 HA GLN A 153 9.207 6.185 18.022 1.00 0.00 H new ATOM 0 HB2 GLN A 153 10.226 8.438 16.869 1.00 0.00 H new ATOM 0 HB3 GLN A 153 9.474 9.090 18.311 1.00 0.00 H new ATOM 0 HG2 GLN A 153 10.654 7.482 19.738 1.00 0.00 H new ATOM 0 HG3 GLN A 153 11.267 6.619 18.342 1.00 0.00 H new ATOM 0 HE21 GLN A 153 13.149 7.283 20.107 1.00 0.00 H new ATOM 0 HE22 GLN A 153 14.144 8.601 19.479 1.00 0.00 H new TER 2193 GLN A 153 HETATM 2194 ZN ZN A 154 -3.361 3.558 -7.707 1.00 0.00 ZN HETATM 2195 CU CU1 A 155 -6.316 1.650 -2.394 1.00 0.00 CU