USER MOD reduce.3.24.130724 H: found=0, std=0, add=831, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 829 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 72 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 75 GLN :FLIP amide:sc= -0.0658 F(o=-0.69,f=-0.066) USER MOD Set 2.1: A 46 CYS SG : rot 54:sc= 0.784 USER MOD Set 2.2: A 48 THR OG1 : rot 88:sc= 0.818 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.177 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 43:sc= 0.887 USER MOD Single : A 14 LYS NZ :NH3+ 142:sc= -0.157 (180deg=-1.01) USER MOD Single : A 18 HIS : no HD1:sc= -2.39 X(o=-2.4,f=-2.6) USER MOD Single : A 20 GLN : amide:sc= -0.26 X(o=-0.26,f=0) USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -1.19 K(o=-1.2,f=-5.8!) USER MOD Single : A 33 TYR OH : rot 131:sc= -0.0369 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 GLN : amide:sc= -3.52 K(o=-3.5,f=-6.3!) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 ASN : amide:sc= -0.502 X(o=-0.5,f=-0.19) USER MOD Single : A 47 ASN : amide:sc= -1.07 K(o=-1.1,f=-6.1!) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.149) USER MOD Single : A 60 GLN : amide:sc= -0.598 K(o=-0.6,f=-2!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot -130:sc= 0 USER MOD Single : A 74 SER OG : rot 180:sc= 0.0288 USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 85 LYS NZ :NH3+ -124:sc= -0.195 (180deg=-1.64!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -3.01! C(o=-3!,f=-4.4!) USER MOD Single : A 94 GLN : amide:sc= -0.042 X(o=-0.042,f=-0.087) USER MOD Single : A 98 LYS NZ :NH3+ 161:sc= -0.0604 (180deg=-0.393) USER MOD Single : A 99 LYS NZ :NH3+ -146:sc= 0 (180deg=-1.15) USER MOD Single : A 101 LYS NZ :NH3+ -160:sc= -0.0409 (180deg=-0.267) USER MOD Single : A 104 SER OG : rot 180:sc= -0.0924 USER MOD Single : A 107 SER OG : rot 180:sc= -0.0518 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.289 9.282 -18.614 1.00 0.00 N ATOM 2 CA GLY A 1 -15.235 10.280 -18.634 1.00 0.00 C ATOM 3 C GLY A 1 -14.184 10.035 -17.569 1.00 0.00 C ATOM 4 O GLY A 1 -14.510 9.861 -16.395 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.982 9.494 -19.360 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.879 8.341 -18.779 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.762 9.296 -17.688 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.760 10.283 -19.615 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.672 11.268 -18.489 1.00 0.00 H new ATOM 8 N SER A 2 -12.920 10.020 -17.980 1.00 0.00 N ATOM 9 CA SER A 2 -11.818 9.788 -17.053 1.00 0.00 C ATOM 10 C SER A 2 -10.945 11.033 -16.926 1.00 0.00 C ATOM 11 O SER A 2 -9.717 10.944 -16.918 1.00 0.00 O ATOM 12 CB SER A 2 -10.972 8.602 -17.519 1.00 0.00 C ATOM 13 OG SER A 2 -10.392 8.857 -18.787 1.00 0.00 O ATOM 0 H SER A 2 -12.634 10.166 -18.948 1.00 0.00 H new ATOM 0 HA SER A 2 -12.240 9.560 -16.074 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.187 8.402 -16.790 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.592 7.707 -17.572 1.00 0.00 H new ATOM 0 HG SER A 2 -9.855 8.085 -19.062 1.00 0.00 H new ATOM 19 N SER A 3 -11.588 12.192 -16.828 1.00 0.00 N ATOM 20 CA SER A 3 -10.871 13.456 -16.705 1.00 0.00 C ATOM 21 C SER A 3 -11.656 14.445 -15.850 1.00 0.00 C ATOM 22 O SER A 3 -12.830 14.230 -15.551 1.00 0.00 O ATOM 23 CB SER A 3 -10.610 14.055 -18.089 1.00 0.00 C ATOM 24 OG SER A 3 -9.840 15.240 -17.995 1.00 0.00 O ATOM 0 H SER A 3 -12.604 12.282 -16.831 1.00 0.00 H new ATOM 0 HA SER A 3 -9.917 13.258 -16.217 1.00 0.00 H new ATOM 0 HB2 SER A 3 -10.089 13.327 -18.711 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.559 14.272 -18.579 1.00 0.00 H new ATOM 0 HG SER A 3 -9.686 15.602 -18.893 1.00 0.00 H new ATOM 30 N GLY A 4 -10.998 15.532 -15.459 1.00 0.00 N ATOM 31 CA GLY A 4 -11.648 16.539 -14.641 1.00 0.00 C ATOM 32 C GLY A 4 -10.798 17.782 -14.467 1.00 0.00 C ATOM 33 O GLY A 4 -9.710 17.723 -13.896 1.00 0.00 O ATOM 0 H GLY A 4 -10.026 15.733 -15.694 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.599 16.814 -15.096 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -11.874 16.117 -13.662 1.00 0.00 H new ATOM 37 N SER A 5 -11.295 18.912 -14.962 1.00 0.00 N ATOM 38 CA SER A 5 -10.571 20.174 -14.863 1.00 0.00 C ATOM 39 C SER A 5 -10.748 20.794 -13.480 1.00 0.00 C ATOM 40 O SER A 5 -9.772 21.078 -12.786 1.00 0.00 O ATOM 41 CB SER A 5 -11.055 21.149 -15.938 1.00 0.00 C ATOM 42 OG SER A 5 -10.561 20.785 -17.215 1.00 0.00 O ATOM 0 H SER A 5 -12.196 18.979 -15.435 1.00 0.00 H new ATOM 0 HA SER A 5 -9.511 19.971 -15.018 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.145 21.163 -15.957 1.00 0.00 H new ATOM 0 HB3 SER A 5 -10.727 22.159 -15.692 1.00 0.00 H new ATOM 0 HG SER A 5 -10.886 21.422 -17.885 1.00 0.00 H new ATOM 48 N SER A 6 -12.001 21.002 -13.087 1.00 0.00 N ATOM 49 CA SER A 6 -12.307 21.592 -11.790 1.00 0.00 C ATOM 50 C SER A 6 -12.983 20.574 -10.876 1.00 0.00 C ATOM 51 O SER A 6 -14.207 20.456 -10.858 1.00 0.00 O ATOM 52 CB SER A 6 -13.209 22.816 -11.963 1.00 0.00 C ATOM 53 OG SER A 6 -14.433 22.464 -12.584 1.00 0.00 O ATOM 0 H SER A 6 -12.820 20.770 -13.649 1.00 0.00 H new ATOM 0 HA SER A 6 -11.369 21.902 -11.329 1.00 0.00 H new ATOM 0 HB2 SER A 6 -13.407 23.266 -10.990 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.696 23.568 -12.563 1.00 0.00 H new ATOM 0 HG SER A 6 -14.765 21.625 -12.201 1.00 0.00 H new ATOM 59 N GLY A 7 -12.173 19.841 -10.117 1.00 0.00 N ATOM 60 CA GLY A 7 -12.709 18.842 -9.211 1.00 0.00 C ATOM 61 C GLY A 7 -11.865 17.585 -9.169 1.00 0.00 C ATOM 62 O GLY A 7 -12.356 16.488 -9.442 1.00 0.00 O ATOM 0 H GLY A 7 -11.156 19.921 -10.114 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.776 19.264 -8.208 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -13.723 18.585 -9.517 1.00 0.00 H new ATOM 66 N LEU A 8 -10.590 17.741 -8.828 1.00 0.00 N ATOM 67 CA LEU A 8 -9.674 16.608 -8.753 1.00 0.00 C ATOM 68 C LEU A 8 -9.668 16.004 -7.352 1.00 0.00 C ATOM 69 O LEU A 8 -9.906 14.809 -7.180 1.00 0.00 O ATOM 70 CB LEU A 8 -8.259 17.045 -9.138 1.00 0.00 C ATOM 71 CG LEU A 8 -7.335 15.943 -9.657 1.00 0.00 C ATOM 72 CD1 LEU A 8 -7.347 14.749 -8.716 1.00 0.00 C ATOM 73 CD2 LEU A 8 -7.743 15.522 -11.062 1.00 0.00 C ATOM 0 H LEU A 8 -10.167 18.641 -8.599 1.00 0.00 H new ATOM 0 HA LEU A 8 -10.017 15.848 -9.455 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -8.334 17.818 -9.902 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.792 17.503 -8.266 1.00 0.00 H new ATOM 0 HG LEU A 8 -6.319 16.337 -9.698 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -6.684 13.975 -9.102 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.006 15.060 -7.729 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.360 14.354 -8.642 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -7.074 14.737 -11.415 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -8.766 15.147 -11.047 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -7.681 16.380 -11.731 1.00 0.00 H new ATOM 85 N ALA A 9 -9.396 16.839 -6.355 1.00 0.00 N ATOM 86 CA ALA A 9 -9.364 16.388 -4.969 1.00 0.00 C ATOM 87 C ALA A 9 -10.632 15.621 -4.611 1.00 0.00 C ATOM 88 O ALA A 9 -10.569 14.491 -4.130 1.00 0.00 O ATOM 89 CB ALA A 9 -9.179 17.573 -4.033 1.00 0.00 C ATOM 0 H ALA A 9 -9.195 17.831 -6.481 1.00 0.00 H new ATOM 0 HA ALA A 9 -8.517 15.711 -4.853 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -9.157 17.222 -3.001 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -8.241 18.077 -4.265 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -10.007 18.271 -4.161 1.00 0.00 H new ATOM 95 N GLU A 10 -11.782 16.244 -4.850 1.00 0.00 N ATOM 96 CA GLU A 10 -13.065 15.619 -4.551 1.00 0.00 C ATOM 97 C GLU A 10 -13.018 14.119 -4.828 1.00 0.00 C ATOM 98 O GLU A 10 -13.571 13.319 -4.073 1.00 0.00 O ATOM 99 CB GLU A 10 -14.178 16.267 -5.377 1.00 0.00 C ATOM 100 CG GLU A 10 -13.875 16.328 -6.865 1.00 0.00 C ATOM 101 CD GLU A 10 -15.089 16.699 -7.693 1.00 0.00 C ATOM 102 OE1 GLU A 10 -15.378 17.909 -7.812 1.00 0.00 O ATOM 103 OE2 GLU A 10 -15.750 15.782 -8.222 1.00 0.00 O ATOM 0 H GLU A 10 -11.851 17.180 -5.249 1.00 0.00 H new ATOM 0 HA GLU A 10 -13.275 15.768 -3.492 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -15.103 15.710 -5.226 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -14.351 17.278 -5.008 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -13.083 17.056 -7.041 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.497 15.360 -7.195 1.00 0.00 H new ATOM 110 N LEU A 11 -12.354 13.746 -5.917 1.00 0.00 N ATOM 111 CA LEU A 11 -12.233 12.343 -6.296 1.00 0.00 C ATOM 112 C LEU A 11 -11.228 11.622 -5.403 1.00 0.00 C ATOM 113 O LEU A 11 -11.478 10.508 -4.941 1.00 0.00 O ATOM 114 CB LEU A 11 -11.809 12.224 -7.761 1.00 0.00 C ATOM 115 CG LEU A 11 -12.939 12.241 -8.790 1.00 0.00 C ATOM 116 CD1 LEU A 11 -14.071 11.322 -8.356 1.00 0.00 C ATOM 117 CD2 LEU A 11 -13.451 13.660 -8.996 1.00 0.00 C ATOM 0 H LEU A 11 -11.891 14.396 -6.553 1.00 0.00 H new ATOM 0 HA LEU A 11 -13.208 11.873 -6.168 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -11.125 13.042 -7.988 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -11.248 11.297 -7.882 1.00 0.00 H new ATOM 0 HG LEU A 11 -12.546 11.876 -9.739 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -14.866 11.347 -9.101 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -13.696 10.303 -8.260 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -14.463 11.656 -7.395 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -14.255 13.653 -9.732 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -13.827 14.052 -8.051 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -12.638 14.292 -9.353 1.00 0.00 H new ATOM 129 N PHE A 12 -10.090 12.265 -5.163 1.00 0.00 N ATOM 130 CA PHE A 12 -9.047 11.686 -4.325 1.00 0.00 C ATOM 131 C PHE A 12 -9.622 11.206 -2.995 1.00 0.00 C ATOM 132 O PHE A 12 -9.118 10.256 -2.397 1.00 0.00 O ATOM 133 CB PHE A 12 -7.938 12.710 -4.074 1.00 0.00 C ATOM 134 CG PHE A 12 -6.933 12.267 -3.049 1.00 0.00 C ATOM 135 CD1 PHE A 12 -5.953 11.343 -3.374 1.00 0.00 C ATOM 136 CD2 PHE A 12 -6.970 12.773 -1.760 1.00 0.00 C ATOM 137 CE1 PHE A 12 -5.027 10.933 -2.433 1.00 0.00 C ATOM 138 CE2 PHE A 12 -6.047 12.367 -0.815 1.00 0.00 C ATOM 139 CZ PHE A 12 -5.075 11.446 -1.152 1.00 0.00 C ATOM 0 H PHE A 12 -9.867 13.187 -5.537 1.00 0.00 H new ATOM 0 HA PHE A 12 -8.628 10.828 -4.851 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -7.422 12.913 -5.013 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -8.388 13.648 -3.748 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -5.912 10.938 -4.374 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -7.729 13.493 -1.491 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -4.268 10.213 -2.699 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -6.086 12.770 0.186 1.00 0.00 H new ATOM 0 HZ PHE A 12 -4.353 11.127 -0.415 1.00 0.00 H new ATOM 149 N GLU A 13 -10.679 11.871 -2.540 1.00 0.00 N ATOM 150 CA GLU A 13 -11.321 11.513 -1.280 1.00 0.00 C ATOM 151 C GLU A 13 -12.163 10.250 -1.439 1.00 0.00 C ATOM 152 O GLU A 13 -12.047 9.310 -0.652 1.00 0.00 O ATOM 153 CB GLU A 13 -12.198 12.664 -0.784 1.00 0.00 C ATOM 154 CG GLU A 13 -11.420 13.933 -0.476 1.00 0.00 C ATOM 155 CD GLU A 13 -10.913 13.974 0.952 1.00 0.00 C ATOM 156 OE1 GLU A 13 -11.500 13.281 1.810 1.00 0.00 O ATOM 157 OE2 GLU A 13 -9.930 14.699 1.213 1.00 0.00 O ATOM 0 H GLU A 13 -11.109 12.659 -3.024 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.539 11.319 -0.545 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -12.954 12.885 -1.538 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -12.727 12.345 0.114 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -10.575 14.012 -1.160 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -12.058 14.798 -0.656 1.00 0.00 H new ATOM 164 N LYS A 14 -13.011 10.236 -2.461 1.00 0.00 N ATOM 165 CA LYS A 14 -13.873 9.090 -2.725 1.00 0.00 C ATOM 166 C LYS A 14 -13.046 7.843 -3.021 1.00 0.00 C ATOM 167 O LYS A 14 -13.175 6.825 -2.342 1.00 0.00 O ATOM 168 CB LYS A 14 -14.806 9.387 -3.902 1.00 0.00 C ATOM 169 CG LYS A 14 -15.995 10.256 -3.530 1.00 0.00 C ATOM 170 CD LYS A 14 -16.676 10.825 -4.764 1.00 0.00 C ATOM 171 CE LYS A 14 -16.077 12.165 -5.164 1.00 0.00 C ATOM 172 NZ LYS A 14 -16.968 12.917 -6.089 1.00 0.00 N ATOM 0 H LYS A 14 -13.120 11.006 -3.121 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.471 8.905 -1.833 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -14.238 9.881 -4.690 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -15.169 8.445 -4.314 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.711 9.668 -2.956 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.664 11.072 -2.887 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -16.580 10.121 -5.591 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -17.742 10.945 -4.570 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -15.894 12.762 -4.271 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -15.111 12.003 -5.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -16.932 13.930 -5.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -16.651 12.773 -7.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -17.944 12.573 -5.987 1.00 0.00 H new ATOM 186 N ALA A 15 -12.195 7.931 -4.039 1.00 0.00 N ATOM 187 CA ALA A 15 -11.344 6.812 -4.422 1.00 0.00 C ATOM 188 C ALA A 15 -10.739 6.137 -3.195 1.00 0.00 C ATOM 189 O ALA A 15 -10.830 4.921 -3.036 1.00 0.00 O ATOM 190 CB ALA A 15 -10.245 7.282 -5.364 1.00 0.00 C ATOM 0 H ALA A 15 -12.077 8.766 -4.613 1.00 0.00 H new ATOM 0 HA ALA A 15 -11.962 6.079 -4.940 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -9.617 6.435 -5.642 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -10.693 7.711 -6.260 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -9.637 8.037 -4.866 1.00 0.00 H new ATOM 196 N ALA A 16 -10.120 6.936 -2.332 1.00 0.00 N ATOM 197 CA ALA A 16 -9.501 6.415 -1.119 1.00 0.00 C ATOM 198 C ALA A 16 -10.421 5.425 -0.414 1.00 0.00 C ATOM 199 O ALA A 16 -9.989 4.352 0.005 1.00 0.00 O ATOM 200 CB ALA A 16 -9.135 7.557 -0.182 1.00 0.00 C ATOM 0 H ALA A 16 -10.034 7.945 -2.450 1.00 0.00 H new ATOM 0 HA ALA A 16 -8.591 5.886 -1.403 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.674 7.154 0.720 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -8.434 8.226 -0.681 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -10.035 8.110 0.087 1.00 0.00 H new ATOM 206 N ALA A 17 -11.692 5.792 -0.288 1.00 0.00 N ATOM 207 CA ALA A 17 -12.674 4.934 0.365 1.00 0.00 C ATOM 208 C ALA A 17 -12.848 3.623 -0.393 1.00 0.00 C ATOM 209 O ALA A 17 -13.091 2.575 0.206 1.00 0.00 O ATOM 210 CB ALA A 17 -14.007 5.657 0.488 1.00 0.00 C ATOM 0 H ALA A 17 -12.066 6.677 -0.629 1.00 0.00 H new ATOM 0 HA ALA A 17 -12.308 4.699 1.364 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -14.731 5.005 0.977 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -13.876 6.563 1.080 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -14.370 5.922 -0.505 1.00 0.00 H new ATOM 216 N HIS A 18 -12.722 3.688 -1.715 1.00 0.00 N ATOM 217 CA HIS A 18 -12.866 2.505 -2.556 1.00 0.00 C ATOM 218 C HIS A 18 -11.673 1.569 -2.385 1.00 0.00 C ATOM 219 O HIS A 18 -11.813 0.347 -2.460 1.00 0.00 O ATOM 220 CB HIS A 18 -13.004 2.910 -4.023 1.00 0.00 C ATOM 221 CG HIS A 18 -13.788 1.931 -4.843 1.00 0.00 C ATOM 222 ND1 HIS A 18 -14.821 1.176 -4.329 1.00 0.00 N ATOM 223 CD2 HIS A 18 -13.686 1.588 -6.148 1.00 0.00 C ATOM 224 CE1 HIS A 18 -15.319 0.409 -5.282 1.00 0.00 C ATOM 225 NE2 HIS A 18 -14.649 0.641 -6.397 1.00 0.00 N ATOM 0 H HIS A 18 -12.521 4.547 -2.227 1.00 0.00 H new ATOM 0 HA HIS A 18 -13.768 1.977 -2.246 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -13.486 3.886 -4.078 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -12.010 3.020 -4.456 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -12.979 1.985 -6.861 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -16.135 -0.289 -5.169 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -14.819 0.190 -7.296 1.00 0.00 H new ATOM 234 N LEU A 19 -10.500 2.149 -2.155 1.00 0.00 N ATOM 235 CA LEU A 19 -9.282 1.367 -1.973 1.00 0.00 C ATOM 236 C LEU A 19 -9.536 0.164 -1.070 1.00 0.00 C ATOM 237 O LEU A 19 -9.250 -0.974 -1.441 1.00 0.00 O ATOM 238 CB LEU A 19 -8.175 2.240 -1.380 1.00 0.00 C ATOM 239 CG LEU A 19 -6.744 1.863 -1.765 1.00 0.00 C ATOM 240 CD1 LEU A 19 -5.752 2.837 -1.149 1.00 0.00 C ATOM 241 CD2 LEU A 19 -6.434 0.437 -1.332 1.00 0.00 C ATOM 0 H LEU A 19 -10.367 3.158 -2.090 1.00 0.00 H new ATOM 0 HA LEU A 19 -8.965 1.003 -2.950 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -8.352 3.272 -1.684 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -8.258 2.209 -0.294 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.652 1.920 -2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -4.739 2.553 -1.434 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.961 3.845 -1.508 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -5.844 2.812 -0.063 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -5.412 0.185 -1.614 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -6.543 0.353 -0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -7.125 -0.250 -1.821 1.00 0.00 H new ATOM 253 N GLN A 20 -10.077 0.426 0.116 1.00 0.00 N ATOM 254 CA GLN A 20 -10.371 -0.636 1.071 1.00 0.00 C ATOM 255 C GLN A 20 -11.202 -1.738 0.422 1.00 0.00 C ATOM 256 O GLN A 20 -11.088 -2.909 0.782 1.00 0.00 O ATOM 257 CB GLN A 20 -11.112 -0.069 2.283 1.00 0.00 C ATOM 258 CG GLN A 20 -10.283 0.908 3.101 1.00 0.00 C ATOM 259 CD GLN A 20 -9.417 0.216 4.135 1.00 0.00 C ATOM 260 OE1 GLN A 20 -9.738 0.206 5.324 1.00 0.00 O ATOM 261 NE2 GLN A 20 -8.313 -0.369 3.687 1.00 0.00 N ATOM 0 H GLN A 20 -10.320 1.363 0.438 1.00 0.00 H new ATOM 0 HA GLN A 20 -9.425 -1.066 1.400 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -12.018 0.432 1.942 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -11.425 -0.893 2.925 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -9.649 1.489 2.432 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -10.948 1.612 3.602 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -8.086 -0.336 2.693 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -7.692 -0.851 4.337 1.00 0.00 H new ATOM 270 N GLY A 21 -12.039 -1.354 -0.537 1.00 0.00 N ATOM 271 CA GLY A 21 -12.877 -2.322 -1.221 1.00 0.00 C ATOM 272 C GLY A 21 -12.164 -2.990 -2.380 1.00 0.00 C ATOM 273 O GLY A 21 -12.639 -3.993 -2.915 1.00 0.00 O ATOM 0 H GLY A 21 -12.152 -0.391 -0.852 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -13.202 -3.083 -0.511 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -13.775 -1.825 -1.589 1.00 0.00 H new ATOM 277 N LEU A 22 -11.022 -2.434 -2.770 1.00 0.00 N ATOM 278 CA LEU A 22 -10.243 -2.982 -3.875 1.00 0.00 C ATOM 279 C LEU A 22 -8.958 -3.628 -3.367 1.00 0.00 C ATOM 280 O LEU A 22 -8.030 -3.877 -4.137 1.00 0.00 O ATOM 281 CB LEU A 22 -9.909 -1.882 -4.884 1.00 0.00 C ATOM 282 CG LEU A 22 -11.077 -0.999 -5.325 1.00 0.00 C ATOM 283 CD1 LEU A 22 -10.595 0.092 -6.268 1.00 0.00 C ATOM 284 CD2 LEU A 22 -12.159 -1.839 -5.988 1.00 0.00 C ATOM 0 H LEU A 22 -10.615 -1.605 -2.338 1.00 0.00 H new ATOM 0 HA LEU A 22 -10.844 -3.747 -4.366 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.139 -1.243 -4.453 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.477 -2.348 -5.770 1.00 0.00 H new ATOM 0 HG LEU A 22 -11.503 -0.525 -4.441 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -11.440 0.710 -6.571 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.856 0.711 -5.760 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -10.143 -0.363 -7.150 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -12.983 -1.195 -6.296 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -11.745 -2.341 -6.862 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -12.525 -2.584 -5.282 1.00 0.00 H new ATOM 296 N ILE A 23 -8.913 -3.900 -2.067 1.00 0.00 N ATOM 297 CA ILE A 23 -7.743 -4.521 -1.457 1.00 0.00 C ATOM 298 C ILE A 23 -7.543 -5.942 -1.974 1.00 0.00 C ATOM 299 O ILE A 23 -6.414 -6.418 -2.086 1.00 0.00 O ATOM 300 CB ILE A 23 -7.861 -4.557 0.078 1.00 0.00 C ATOM 301 CG1 ILE A 23 -8.076 -3.145 0.628 1.00 0.00 C ATOM 302 CG2 ILE A 23 -6.618 -5.185 0.690 1.00 0.00 C ATOM 303 CD1 ILE A 23 -6.858 -2.257 0.506 1.00 0.00 C ATOM 0 H ILE A 23 -9.673 -3.700 -1.416 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.882 -3.912 -1.733 1.00 0.00 H new ATOM 0 HB ILE A 23 -8.723 -5.167 0.347 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.908 -2.681 0.099 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.363 -3.212 1.677 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.716 -5.203 1.775 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -6.504 -6.203 0.319 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -5.741 -4.599 0.415 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.083 -1.272 0.916 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.029 -2.699 1.058 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -6.583 -2.159 -0.544 1.00 0.00 H new ATOM 315 N GLN A 24 -8.647 -6.612 -2.287 1.00 0.00 N ATOM 316 CA GLN A 24 -8.592 -7.979 -2.794 1.00 0.00 C ATOM 317 C GLN A 24 -8.128 -8.003 -4.246 1.00 0.00 C ATOM 318 O GLN A 24 -7.706 -9.041 -4.757 1.00 0.00 O ATOM 319 CB GLN A 24 -9.963 -8.645 -2.673 1.00 0.00 C ATOM 320 CG GLN A 24 -10.571 -8.539 -1.283 1.00 0.00 C ATOM 321 CD GLN A 24 -12.000 -9.044 -1.231 1.00 0.00 C ATOM 322 OE1 GLN A 24 -12.281 -10.085 -0.637 1.00 0.00 O ATOM 323 NE2 GLN A 24 -12.912 -8.306 -1.855 1.00 0.00 N ATOM 0 H GLN A 24 -9.589 -6.232 -2.199 1.00 0.00 H new ATOM 0 HA GLN A 24 -7.872 -8.534 -2.193 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -10.643 -8.191 -3.394 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.871 -9.698 -2.941 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -9.963 -9.108 -0.580 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -10.545 -7.499 -0.958 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -12.634 -7.450 -2.335 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -13.890 -8.596 -1.854 1.00 0.00 H new ATOM 332 N VAL A 25 -8.209 -6.853 -4.907 1.00 0.00 N ATOM 333 CA VAL A 25 -7.796 -6.742 -6.301 1.00 0.00 C ATOM 334 C VAL A 25 -6.489 -5.967 -6.428 1.00 0.00 C ATOM 335 O VAL A 25 -5.856 -5.966 -7.483 1.00 0.00 O ATOM 336 CB VAL A 25 -8.876 -6.048 -7.153 1.00 0.00 C ATOM 337 CG1 VAL A 25 -10.143 -6.888 -7.197 1.00 0.00 C ATOM 338 CG2 VAL A 25 -9.168 -4.656 -6.611 1.00 0.00 C ATOM 0 H VAL A 25 -8.557 -5.985 -4.500 1.00 0.00 H new ATOM 0 HA VAL A 25 -7.650 -7.758 -6.669 1.00 0.00 H new ATOM 0 HB VAL A 25 -8.501 -5.946 -8.171 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -10.894 -6.382 -7.803 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -9.919 -7.861 -7.634 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -10.525 -7.024 -6.185 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -9.933 -4.180 -7.224 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -9.523 -4.733 -5.583 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -8.258 -4.057 -6.637 1.00 0.00 H new ATOM 348 N ALA A 26 -6.091 -5.309 -5.344 1.00 0.00 N ATOM 349 CA ALA A 26 -4.857 -4.532 -5.333 1.00 0.00 C ATOM 350 C ALA A 26 -3.696 -5.355 -4.785 1.00 0.00 C ATOM 351 O ALA A 26 -3.750 -5.851 -3.660 1.00 0.00 O ATOM 352 CB ALA A 26 -5.041 -3.263 -4.514 1.00 0.00 C ATOM 0 H ALA A 26 -6.605 -5.298 -4.463 1.00 0.00 H new ATOM 0 HA ALA A 26 -4.619 -4.257 -6.361 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -4.112 -2.692 -4.514 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -5.837 -2.660 -4.951 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -5.305 -3.526 -3.490 1.00 0.00 H new ATOM 358 N SER A 27 -2.645 -5.495 -5.587 1.00 0.00 N ATOM 359 CA SER A 27 -1.472 -6.261 -5.184 1.00 0.00 C ATOM 360 C SER A 27 -0.657 -5.499 -4.144 1.00 0.00 C ATOM 361 O SER A 27 -0.674 -4.269 -4.106 1.00 0.00 O ATOM 362 CB SER A 27 -0.600 -6.577 -6.401 1.00 0.00 C ATOM 363 OG SER A 27 -1.203 -7.564 -7.219 1.00 0.00 O ATOM 0 H SER A 27 -2.582 -5.088 -6.520 1.00 0.00 H new ATOM 0 HA SER A 27 -1.814 -7.195 -4.739 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.438 -5.669 -6.982 1.00 0.00 H new ATOM 0 HB3 SER A 27 0.379 -6.923 -6.070 1.00 0.00 H new ATOM 0 HG SER A 27 -0.627 -7.746 -7.990 1.00 0.00 H new ATOM 369 N ARG A 28 0.056 -6.240 -3.301 1.00 0.00 N ATOM 370 CA ARG A 28 0.877 -5.635 -2.259 1.00 0.00 C ATOM 371 C ARG A 28 1.490 -4.324 -2.742 1.00 0.00 C ATOM 372 O ARG A 28 1.372 -3.293 -2.082 1.00 0.00 O ATOM 373 CB ARG A 28 1.983 -6.600 -1.828 1.00 0.00 C ATOM 374 CG ARG A 28 2.907 -7.013 -2.962 1.00 0.00 C ATOM 375 CD ARG A 28 3.657 -8.294 -2.631 1.00 0.00 C ATOM 376 NE ARG A 28 4.805 -8.048 -1.763 1.00 0.00 N ATOM 377 CZ ARG A 28 5.397 -8.992 -1.041 1.00 0.00 C ATOM 378 NH1 ARG A 28 4.951 -10.240 -1.083 1.00 0.00 N ATOM 379 NH2 ARG A 28 6.438 -8.690 -0.275 1.00 0.00 N ATOM 0 H ARG A 28 0.081 -7.260 -3.320 1.00 0.00 H new ATOM 0 HA ARG A 28 0.236 -5.422 -1.404 1.00 0.00 H new ATOM 0 HB2 ARG A 28 2.574 -6.133 -1.040 1.00 0.00 H new ATOM 0 HB3 ARG A 28 1.528 -7.492 -1.398 1.00 0.00 H new ATOM 0 HG2 ARG A 28 2.326 -7.155 -3.873 1.00 0.00 H new ATOM 0 HG3 ARG A 28 3.621 -6.213 -3.161 1.00 0.00 H new ATOM 0 HD2 ARG A 28 2.979 -8.996 -2.145 1.00 0.00 H new ATOM 0 HD3 ARG A 28 3.995 -8.765 -3.554 1.00 0.00 H new ATOM 0 HE ARG A 28 5.173 -7.098 -1.708 1.00 0.00 H new ATOM 0 HH11 ARG A 28 4.152 -10.476 -1.671 1.00 0.00 H new ATOM 0 HH12 ARG A 28 5.407 -10.964 -0.528 1.00 0.00 H new ATOM 0 HH21 ARG A 28 6.785 -7.731 -0.240 1.00 0.00 H new ATOM 0 HH22 ARG A 28 6.891 -9.417 0.279 1.00 0.00 H new ATOM 393 N GLU A 29 2.146 -4.374 -3.898 1.00 0.00 N ATOM 394 CA GLU A 29 2.779 -3.191 -4.468 1.00 0.00 C ATOM 395 C GLU A 29 1.752 -2.088 -4.710 1.00 0.00 C ATOM 396 O GLU A 29 1.967 -0.935 -4.338 1.00 0.00 O ATOM 397 CB GLU A 29 3.484 -3.544 -5.779 1.00 0.00 C ATOM 398 CG GLU A 29 4.871 -4.133 -5.586 1.00 0.00 C ATOM 399 CD GLU A 29 5.540 -4.493 -6.898 1.00 0.00 C ATOM 400 OE1 GLU A 29 5.269 -5.596 -7.418 1.00 0.00 O ATOM 401 OE2 GLU A 29 6.334 -3.674 -7.404 1.00 0.00 O ATOM 0 H GLU A 29 2.252 -5.220 -4.457 1.00 0.00 H new ATOM 0 HA GLU A 29 3.517 -2.826 -3.754 1.00 0.00 H new ATOM 0 HB2 GLU A 29 2.870 -4.256 -6.331 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.562 -2.647 -6.393 1.00 0.00 H new ATOM 0 HG2 GLU A 29 5.494 -3.417 -5.049 1.00 0.00 H new ATOM 0 HG3 GLU A 29 4.800 -5.024 -4.962 1.00 0.00 H new ATOM 408 N GLN A 30 0.638 -2.452 -5.336 1.00 0.00 N ATOM 409 CA GLN A 30 -0.421 -1.494 -5.629 1.00 0.00 C ATOM 410 C GLN A 30 -0.792 -0.695 -4.384 1.00 0.00 C ATOM 411 O GLN A 30 -0.945 0.526 -4.440 1.00 0.00 O ATOM 412 CB GLN A 30 -1.655 -2.216 -6.173 1.00 0.00 C ATOM 413 CG GLN A 30 -1.438 -2.848 -7.538 1.00 0.00 C ATOM 414 CD GLN A 30 -1.328 -1.820 -8.646 1.00 0.00 C ATOM 415 OE1 GLN A 30 -0.845 -0.708 -8.432 1.00 0.00 O ATOM 416 NE2 GLN A 30 -1.776 -2.188 -9.841 1.00 0.00 N ATOM 0 H GLN A 30 0.445 -3.403 -5.650 1.00 0.00 H new ATOM 0 HA GLN A 30 -0.051 -0.802 -6.386 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -1.953 -2.991 -5.467 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -2.481 -1.508 -6.237 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -0.530 -3.450 -7.515 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -2.264 -3.525 -7.756 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -2.169 -3.120 -9.974 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -1.727 -1.539 -10.626 1.00 0.00 H new ATOM 425 N LEU A 31 -0.937 -1.391 -3.262 1.00 0.00 N ATOM 426 CA LEU A 31 -1.290 -0.746 -2.002 1.00 0.00 C ATOM 427 C LEU A 31 -0.340 0.407 -1.695 1.00 0.00 C ATOM 428 O LEU A 31 -0.774 1.532 -1.441 1.00 0.00 O ATOM 429 CB LEU A 31 -1.261 -1.764 -0.860 1.00 0.00 C ATOM 430 CG LEU A 31 -2.493 -2.661 -0.729 1.00 0.00 C ATOM 431 CD1 LEU A 31 -3.724 -1.832 -0.396 1.00 0.00 C ATOM 432 CD2 LEU A 31 -2.713 -3.455 -2.008 1.00 0.00 C ATOM 0 H LEU A 31 -0.816 -2.402 -3.199 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.299 -0.345 -2.098 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -0.385 -2.400 -0.989 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.128 -1.225 0.078 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.322 -3.364 0.086 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.591 -2.487 -0.307 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.566 -1.309 0.547 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -3.899 -1.105 -1.189 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.594 -4.088 -1.897 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -2.862 -2.768 -2.841 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.841 -4.079 -2.204 1.00 0.00 H new ATOM 444 N LEU A 32 0.957 0.121 -1.721 1.00 0.00 N ATOM 445 CA LEU A 32 1.969 1.135 -1.448 1.00 0.00 C ATOM 446 C LEU A 32 1.927 2.243 -2.495 1.00 0.00 C ATOM 447 O LEU A 32 2.021 3.426 -2.167 1.00 0.00 O ATOM 448 CB LEU A 32 3.360 0.499 -1.417 1.00 0.00 C ATOM 449 CG LEU A 32 4.392 1.186 -0.522 1.00 0.00 C ATOM 450 CD1 LEU A 32 4.302 0.656 0.901 1.00 0.00 C ATOM 451 CD2 LEU A 32 5.795 0.991 -1.078 1.00 0.00 C ATOM 0 H LEU A 32 1.332 -0.804 -1.928 1.00 0.00 H new ATOM 0 HA LEU A 32 1.755 1.574 -0.474 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.257 -0.536 -1.091 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.750 0.475 -2.435 1.00 0.00 H new ATOM 0 HG LEU A 32 4.175 2.254 -0.504 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.044 1.156 1.523 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.306 0.848 1.299 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.492 -0.417 0.902 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.516 1.487 -0.428 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.022 -0.074 -1.127 1.00 0.00 H new ATOM 0 HD23 LEU A 32 5.853 1.420 -2.078 1.00 0.00 H new ATOM 463 N TYR A 33 1.784 1.852 -3.757 1.00 0.00 N ATOM 464 CA TYR A 33 1.729 2.812 -4.853 1.00 0.00 C ATOM 465 C TYR A 33 0.796 3.971 -4.516 1.00 0.00 C ATOM 466 O TYR A 33 1.073 5.124 -4.849 1.00 0.00 O ATOM 467 CB TYR A 33 1.263 2.125 -6.138 1.00 0.00 C ATOM 468 CG TYR A 33 1.176 3.057 -7.325 1.00 0.00 C ATOM 469 CD1 TYR A 33 2.291 3.316 -8.113 1.00 0.00 C ATOM 470 CD2 TYR A 33 -0.020 3.679 -7.659 1.00 0.00 C ATOM 471 CE1 TYR A 33 2.217 4.167 -9.199 1.00 0.00 C ATOM 472 CE2 TYR A 33 -0.105 4.530 -8.744 1.00 0.00 C ATOM 473 CZ TYR A 33 1.016 4.771 -9.510 1.00 0.00 C ATOM 474 OH TYR A 33 0.937 5.620 -10.591 1.00 0.00 O ATOM 0 H TYR A 33 1.704 0.877 -4.046 1.00 0.00 H new ATOM 0 HA TYR A 33 2.733 3.209 -5.005 1.00 0.00 H new ATOM 0 HB2 TYR A 33 1.949 1.312 -6.375 1.00 0.00 H new ATOM 0 HB3 TYR A 33 0.284 1.677 -5.966 1.00 0.00 H new ATOM 0 HD1 TYR A 33 3.232 2.844 -7.872 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -0.899 3.494 -7.060 1.00 0.00 H new ATOM 0 HE1 TYR A 33 3.093 4.358 -9.800 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -1.044 5.004 -8.991 1.00 0.00 H new ATOM 0 HH TYR A 33 0.166 5.374 -11.144 1.00 0.00 H new ATOM 484 N LEU A 34 -0.311 3.657 -3.852 1.00 0.00 N ATOM 485 CA LEU A 34 -1.286 4.672 -3.468 1.00 0.00 C ATOM 486 C LEU A 34 -0.875 5.358 -2.169 1.00 0.00 C ATOM 487 O LEU A 34 -1.242 6.506 -1.919 1.00 0.00 O ATOM 488 CB LEU A 34 -2.671 4.042 -3.309 1.00 0.00 C ATOM 489 CG LEU A 34 -3.076 3.033 -4.384 1.00 0.00 C ATOM 490 CD1 LEU A 34 -4.453 2.459 -4.086 1.00 0.00 C ATOM 491 CD2 LEU A 34 -3.054 3.682 -5.760 1.00 0.00 C ATOM 0 H LEU A 34 -0.556 2.708 -3.568 1.00 0.00 H new ATOM 0 HA LEU A 34 -1.323 5.422 -4.258 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -2.714 3.546 -2.339 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -3.412 4.841 -3.291 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.355 2.216 -4.378 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -4.724 1.743 -4.862 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.436 1.957 -3.119 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -5.186 3.265 -4.064 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -3.345 2.949 -6.513 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -3.753 4.518 -5.779 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -2.049 4.044 -5.976 1.00 0.00 H new ATOM 503 N TYR A 35 -0.111 4.647 -1.347 1.00 0.00 N ATOM 504 CA TYR A 35 0.350 5.188 -0.073 1.00 0.00 C ATOM 505 C TYR A 35 1.338 6.329 -0.291 1.00 0.00 C ATOM 506 O TYR A 35 1.206 7.400 0.300 1.00 0.00 O ATOM 507 CB TYR A 35 1.002 4.087 0.765 1.00 0.00 C ATOM 508 CG TYR A 35 1.762 4.609 1.964 1.00 0.00 C ATOM 509 CD1 TYR A 35 2.941 5.328 1.804 1.00 0.00 C ATOM 510 CD2 TYR A 35 1.303 4.383 3.255 1.00 0.00 C ATOM 511 CE1 TYR A 35 3.639 5.806 2.895 1.00 0.00 C ATOM 512 CE2 TYR A 35 1.995 4.859 4.352 1.00 0.00 C ATOM 513 CZ TYR A 35 3.162 5.570 4.167 1.00 0.00 C ATOM 514 OH TYR A 35 3.854 6.044 5.258 1.00 0.00 O ATOM 0 H TYR A 35 0.202 3.696 -1.540 1.00 0.00 H new ATOM 0 HA TYR A 35 -0.516 5.579 0.462 1.00 0.00 H new ATOM 0 HB2 TYR A 35 0.231 3.397 1.107 1.00 0.00 H new ATOM 0 HB3 TYR A 35 1.683 3.517 0.134 1.00 0.00 H new ATOM 0 HD1 TYR A 35 3.317 5.516 0.809 1.00 0.00 H new ATOM 0 HD2 TYR A 35 0.390 3.826 3.404 1.00 0.00 H new ATOM 0 HE1 TYR A 35 4.554 6.362 2.753 1.00 0.00 H new ATOM 0 HE2 TYR A 35 1.624 4.675 5.349 1.00 0.00 H new ATOM 0 HH TYR A 35 3.382 5.792 6.079 1.00 0.00 H new ATOM 524 N ALA A 36 2.328 6.091 -1.146 1.00 0.00 N ATOM 525 CA ALA A 36 3.338 7.099 -1.445 1.00 0.00 C ATOM 526 C ALA A 36 2.692 8.419 -1.853 1.00 0.00 C ATOM 527 O ALA A 36 2.857 9.435 -1.178 1.00 0.00 O ATOM 528 CB ALA A 36 4.268 6.604 -2.542 1.00 0.00 C ATOM 0 H ALA A 36 2.452 5.209 -1.643 1.00 0.00 H new ATOM 0 HA ALA A 36 3.921 7.274 -0.541 1.00 0.00 H new ATOM 0 HB1 ALA A 36 5.017 7.366 -2.755 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.763 5.690 -2.214 1.00 0.00 H new ATOM 0 HB3 ALA A 36 3.691 6.400 -3.444 1.00 0.00 H new ATOM 534 N ARG A 37 1.957 8.396 -2.960 1.00 0.00 N ATOM 535 CA ARG A 37 1.288 9.592 -3.458 1.00 0.00 C ATOM 536 C ARG A 37 0.408 10.212 -2.377 1.00 0.00 C ATOM 537 O ARG A 37 0.536 11.395 -2.061 1.00 0.00 O ATOM 538 CB ARG A 37 0.443 9.255 -4.688 1.00 0.00 C ATOM 539 CG ARG A 37 1.263 8.790 -5.881 1.00 0.00 C ATOM 540 CD ARG A 37 0.376 8.462 -7.072 1.00 0.00 C ATOM 541 NE ARG A 37 1.115 7.786 -8.135 1.00 0.00 N ATOM 542 CZ ARG A 37 1.998 8.394 -8.918 1.00 0.00 C ATOM 543 NH1 ARG A 37 2.252 9.686 -8.758 1.00 0.00 N ATOM 544 NH2 ARG A 37 2.630 7.711 -9.863 1.00 0.00 N ATOM 0 H ARG A 37 1.810 7.562 -3.529 1.00 0.00 H new ATOM 0 HA ARG A 37 2.053 10.316 -3.739 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -0.273 8.477 -4.424 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -0.133 10.135 -4.975 1.00 0.00 H new ATOM 0 HG2 ARG A 37 1.975 9.567 -6.159 1.00 0.00 H new ATOM 0 HG3 ARG A 37 1.843 7.910 -5.604 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -0.450 7.830 -6.746 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -0.061 9.381 -7.462 1.00 0.00 H new ATOM 0 HE ARG A 37 0.943 6.792 -8.284 1.00 0.00 H new ATOM 0 HH11 ARG A 37 1.768 10.215 -8.032 1.00 0.00 H new ATOM 0 HH12 ARG A 37 2.931 10.151 -9.361 1.00 0.00 H new ATOM 0 HH21 ARG A 37 2.438 6.717 -9.989 1.00 0.00 H new ATOM 0 HH22 ARG A 37 3.308 8.180 -10.464 1.00 0.00 H new ATOM 558 N TYR A 38 -0.486 9.406 -1.815 1.00 0.00 N ATOM 559 CA TYR A 38 -1.390 9.876 -0.772 1.00 0.00 C ATOM 560 C TYR A 38 -0.626 10.632 0.311 1.00 0.00 C ATOM 561 O TYR A 38 -1.115 11.622 0.857 1.00 0.00 O ATOM 562 CB TYR A 38 -2.144 8.698 -0.152 1.00 0.00 C ATOM 563 CG TYR A 38 -3.054 9.095 0.989 1.00 0.00 C ATOM 564 CD1 TYR A 38 -2.533 9.445 2.229 1.00 0.00 C ATOM 565 CD2 TYR A 38 -4.433 9.118 0.827 1.00 0.00 C ATOM 566 CE1 TYR A 38 -3.361 9.807 3.274 1.00 0.00 C ATOM 567 CE2 TYR A 38 -5.268 9.480 1.866 1.00 0.00 C ATOM 568 CZ TYR A 38 -4.727 9.824 3.088 1.00 0.00 C ATOM 569 OH TYR A 38 -5.556 10.184 4.126 1.00 0.00 O ATOM 0 H TYR A 38 -0.604 8.424 -2.064 1.00 0.00 H new ATOM 0 HA TYR A 38 -2.107 10.558 -1.229 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -2.737 8.209 -0.925 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -1.423 7.965 0.208 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -1.463 9.434 2.378 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -4.860 8.848 -0.128 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -2.940 10.075 4.232 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -6.338 9.494 1.723 1.00 0.00 H new ATOM 0 HH TYR A 38 -6.489 10.145 3.828 1.00 0.00 H new ATOM 579 N LYS A 39 0.578 10.160 0.616 1.00 0.00 N ATOM 580 CA LYS A 39 1.413 10.790 1.632 1.00 0.00 C ATOM 581 C LYS A 39 2.068 12.055 1.088 1.00 0.00 C ATOM 582 O LYS A 39 2.479 12.928 1.852 1.00 0.00 O ATOM 583 CB LYS A 39 2.487 9.814 2.116 1.00 0.00 C ATOM 584 CG LYS A 39 1.999 8.854 3.187 1.00 0.00 C ATOM 585 CD LYS A 39 1.780 9.564 4.513 1.00 0.00 C ATOM 586 CE LYS A 39 3.090 10.067 5.099 1.00 0.00 C ATOM 587 NZ LYS A 39 3.002 10.255 6.574 1.00 0.00 N ATOM 0 H LYS A 39 0.998 9.342 0.174 1.00 0.00 H new ATOM 0 HA LYS A 39 0.776 11.064 2.473 1.00 0.00 H new ATOM 0 HB2 LYS A 39 2.854 9.240 1.265 1.00 0.00 H new ATOM 0 HB3 LYS A 39 3.332 10.381 2.506 1.00 0.00 H new ATOM 0 HG2 LYS A 39 1.068 8.389 2.864 1.00 0.00 H new ATOM 0 HG3 LYS A 39 2.726 8.053 3.318 1.00 0.00 H new ATOM 0 HD2 LYS A 39 1.099 10.403 4.370 1.00 0.00 H new ATOM 0 HD3 LYS A 39 1.303 8.883 5.217 1.00 0.00 H new ATOM 0 HE2 LYS A 39 3.886 9.358 4.870 1.00 0.00 H new ATOM 0 HE3 LYS A 39 3.359 11.012 4.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 3.915 10.599 6.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 2.260 10.950 6.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.770 9.348 7.026 1.00 0.00 H new ATOM 601 N GLN A 40 2.161 12.147 -0.234 1.00 0.00 N ATOM 602 CA GLN A 40 2.766 13.307 -0.879 1.00 0.00 C ATOM 603 C GLN A 40 1.756 14.442 -1.017 1.00 0.00 C ATOM 604 O GLN A 40 2.109 15.617 -0.920 1.00 0.00 O ATOM 605 CB GLN A 40 3.313 12.925 -2.255 1.00 0.00 C ATOM 606 CG GLN A 40 3.940 14.089 -3.005 1.00 0.00 C ATOM 607 CD GLN A 40 5.219 14.580 -2.357 1.00 0.00 C ATOM 608 OE1 GLN A 40 5.763 13.933 -1.461 1.00 0.00 O ATOM 609 NE2 GLN A 40 5.707 15.730 -2.806 1.00 0.00 N ATOM 0 H GLN A 40 1.825 11.433 -0.880 1.00 0.00 H new ATOM 0 HA GLN A 40 3.589 13.651 -0.252 1.00 0.00 H new ATOM 0 HB2 GLN A 40 4.057 12.138 -2.135 1.00 0.00 H new ATOM 0 HB3 GLN A 40 2.504 12.510 -2.856 1.00 0.00 H new ATOM 0 HG2 GLN A 40 4.150 13.784 -4.030 1.00 0.00 H new ATOM 0 HG3 GLN A 40 3.225 14.910 -3.057 1.00 0.00 H new ATOM 0 HE21 GLN A 40 5.224 16.233 -3.550 1.00 0.00 H new ATOM 0 HE22 GLN A 40 6.565 16.110 -2.407 1.00 0.00 H new ATOM 618 N VAL A 41 0.497 14.082 -1.245 1.00 0.00 N ATOM 619 CA VAL A 41 -0.565 15.069 -1.397 1.00 0.00 C ATOM 620 C VAL A 41 -1.009 15.611 -0.042 1.00 0.00 C ATOM 621 O VAL A 41 -1.524 16.725 0.055 1.00 0.00 O ATOM 622 CB VAL A 41 -1.785 14.474 -2.125 1.00 0.00 C ATOM 623 CG1 VAL A 41 -1.344 13.664 -3.334 1.00 0.00 C ATOM 624 CG2 VAL A 41 -2.609 13.620 -1.172 1.00 0.00 C ATOM 0 H VAL A 41 0.188 13.114 -1.329 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.157 15.884 -1.995 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.411 15.294 -2.477 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -2.220 13.252 -3.835 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -0.800 14.308 -4.025 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -0.695 12.850 -3.010 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.467 13.207 -1.703 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.994 12.806 -0.788 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.957 14.234 -0.341 1.00 0.00 H new ATOM 634 N LYS A 42 -0.806 14.815 1.002 1.00 0.00 N ATOM 635 CA LYS A 42 -1.183 15.214 2.353 1.00 0.00 C ATOM 636 C LYS A 42 -0.028 15.920 3.055 1.00 0.00 C ATOM 637 O LYS A 42 -0.218 16.945 3.708 1.00 0.00 O ATOM 638 CB LYS A 42 -1.617 13.991 3.165 1.00 0.00 C ATOM 639 CG LYS A 42 -2.940 13.398 2.713 1.00 0.00 C ATOM 640 CD LYS A 42 -4.112 14.279 3.114 1.00 0.00 C ATOM 641 CE LYS A 42 -5.426 13.739 2.572 1.00 0.00 C ATOM 642 NZ LYS A 42 -6.581 14.133 3.425 1.00 0.00 N ATOM 0 H LYS A 42 -0.382 13.889 0.939 1.00 0.00 H new ATOM 0 HA LYS A 42 -2.019 15.910 2.280 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.843 13.226 3.096 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -1.694 14.272 4.215 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -2.932 13.272 1.630 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -3.063 12.406 3.149 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -4.165 14.344 4.201 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.952 15.291 2.742 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -5.580 14.109 1.558 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -5.374 12.652 2.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -7.458 13.746 3.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -6.447 13.759 4.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -6.646 15.170 3.464 1.00 0.00 H new ATOM 656 N VAL A 43 1.172 15.365 2.914 1.00 0.00 N ATOM 657 CA VAL A 43 2.359 15.943 3.532 1.00 0.00 C ATOM 658 C VAL A 43 3.153 16.771 2.528 1.00 0.00 C ATOM 659 O VAL A 43 3.254 17.991 2.656 1.00 0.00 O ATOM 660 CB VAL A 43 3.274 14.852 4.119 1.00 0.00 C ATOM 661 CG1 VAL A 43 4.397 15.477 4.933 1.00 0.00 C ATOM 662 CG2 VAL A 43 2.468 13.879 4.966 1.00 0.00 C ATOM 0 H VAL A 43 1.347 14.516 2.377 1.00 0.00 H new ATOM 0 HA VAL A 43 2.013 16.589 4.339 1.00 0.00 H new ATOM 0 HB VAL A 43 3.721 14.296 3.295 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.033 14.691 5.340 1.00 0.00 H new ATOM 0 HG12 VAL A 43 4.991 16.129 4.293 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.973 16.060 5.751 1.00 0.00 H new ATOM 0 HG21 VAL A 43 3.131 13.115 5.373 1.00 0.00 H new ATOM 0 HG22 VAL A 43 1.991 14.418 5.784 1.00 0.00 H new ATOM 0 HG23 VAL A 43 1.704 13.406 4.349 1.00 0.00 H new ATOM 672 N GLY A 44 3.716 16.100 1.528 1.00 0.00 N ATOM 673 CA GLY A 44 4.494 16.790 0.516 1.00 0.00 C ATOM 674 C GLY A 44 5.938 16.331 0.482 1.00 0.00 C ATOM 675 O GLY A 44 6.219 15.137 0.570 1.00 0.00 O ATOM 0 H GLY A 44 3.647 15.090 1.401 1.00 0.00 H new ATOM 0 HA2 GLY A 44 4.041 16.625 -0.461 1.00 0.00 H new ATOM 0 HA3 GLY A 44 4.461 17.863 0.706 1.00 0.00 H new ATOM 679 N ASN A 45 6.857 17.283 0.353 1.00 0.00 N ATOM 680 CA ASN A 45 8.281 16.970 0.306 1.00 0.00 C ATOM 681 C ASN A 45 8.695 16.137 1.515 1.00 0.00 C ATOM 682 O ASN A 45 8.756 16.640 2.637 1.00 0.00 O ATOM 683 CB ASN A 45 9.106 18.257 0.252 1.00 0.00 C ATOM 684 CG ASN A 45 10.534 18.010 -0.194 1.00 0.00 C ATOM 685 OD1 ASN A 45 11.363 17.529 0.579 1.00 0.00 O ATOM 686 ND2 ASN A 45 10.828 18.339 -1.446 1.00 0.00 N ATOM 0 H ASN A 45 6.641 18.277 0.279 1.00 0.00 H new ATOM 0 HA ASN A 45 8.470 16.388 -0.596 1.00 0.00 H new ATOM 0 HB2 ASN A 45 8.631 18.961 -0.431 1.00 0.00 H new ATOM 0 HB3 ASN A 45 9.111 18.723 1.237 1.00 0.00 H new ATOM 0 HD21 ASN A 45 11.773 18.196 -1.802 1.00 0.00 H new ATOM 0 HD22 ASN A 45 10.109 18.735 -2.052 1.00 0.00 H new ATOM 693 N CYS A 46 8.980 14.861 1.278 1.00 0.00 N ATOM 694 CA CYS A 46 9.388 13.957 2.347 1.00 0.00 C ATOM 695 C CYS A 46 10.257 14.683 3.370 1.00 0.00 C ATOM 696 O CYS A 46 11.419 14.990 3.105 1.00 0.00 O ATOM 697 CB CYS A 46 10.149 12.762 1.771 1.00 0.00 C ATOM 698 SG CYS A 46 10.060 11.270 2.788 1.00 0.00 S ATOM 0 H CYS A 46 8.936 14.429 0.355 1.00 0.00 H new ATOM 0 HA CYS A 46 8.489 13.598 2.849 1.00 0.00 H new ATOM 0 HB2 CYS A 46 9.755 12.537 0.780 1.00 0.00 H new ATOM 0 HB3 CYS A 46 11.195 13.039 1.642 1.00 0.00 H new ATOM 0 HG CYS A 46 8.815 10.984 3.031 1.00 0.00 H new ATOM 704 N ASN A 47 9.685 14.955 4.538 1.00 0.00 N ATOM 705 CA ASN A 47 10.406 15.647 5.600 1.00 0.00 C ATOM 706 C ASN A 47 10.650 14.719 6.786 1.00 0.00 C ATOM 707 O ASN A 47 10.632 15.149 7.940 1.00 0.00 O ATOM 708 CB ASN A 47 9.625 16.881 6.056 1.00 0.00 C ATOM 709 CG ASN A 47 8.274 16.524 6.646 1.00 0.00 C ATOM 710 OD1 ASN A 47 8.040 15.383 7.044 1.00 0.00 O ATOM 711 ND2 ASN A 47 7.377 17.502 6.704 1.00 0.00 N ATOM 0 H ASN A 47 8.724 14.707 4.773 1.00 0.00 H new ATOM 0 HA ASN A 47 11.371 15.963 5.203 1.00 0.00 H new ATOM 0 HB2 ASN A 47 10.210 17.425 6.798 1.00 0.00 H new ATOM 0 HB3 ASN A 47 9.483 17.551 5.208 1.00 0.00 H new ATOM 0 HD21 ASN A 47 6.450 17.322 7.090 1.00 0.00 H new ATOM 0 HD22 ASN A 47 7.615 18.433 6.362 1.00 0.00 H new ATOM 718 N THR A 48 10.879 13.442 6.494 1.00 0.00 N ATOM 719 CA THR A 48 11.126 12.452 7.535 1.00 0.00 C ATOM 720 C THR A 48 12.457 11.742 7.314 1.00 0.00 C ATOM 721 O THR A 48 12.911 11.561 6.184 1.00 0.00 O ATOM 722 CB THR A 48 10.000 11.403 7.591 1.00 0.00 C ATOM 723 OG1 THR A 48 9.785 10.846 6.290 1.00 0.00 O ATOM 724 CG2 THR A 48 8.709 12.021 8.104 1.00 0.00 C ATOM 0 H THR A 48 10.898 13.069 5.545 1.00 0.00 H new ATOM 0 HA THR A 48 11.158 12.990 8.482 1.00 0.00 H new ATOM 0 HB THR A 48 10.303 10.613 8.278 1.00 0.00 H new ATOM 0 HG1 THR A 48 10.377 10.076 6.162 1.00 0.00 H new ATOM 0 HG21 THR A 48 7.929 11.261 8.135 1.00 0.00 H new ATOM 0 HG22 THR A 48 8.869 12.418 9.107 1.00 0.00 H new ATOM 0 HG23 THR A 48 8.403 12.829 7.439 1.00 0.00 H new ATOM 732 N PRO A 49 13.099 11.330 8.417 1.00 0.00 N ATOM 733 CA PRO A 49 14.387 10.632 8.369 1.00 0.00 C ATOM 734 C PRO A 49 14.262 9.224 7.797 1.00 0.00 C ATOM 735 O PRO A 49 13.232 8.567 7.954 1.00 0.00 O ATOM 736 CB PRO A 49 14.815 10.576 9.838 1.00 0.00 C ATOM 737 CG PRO A 49 13.541 10.647 10.607 1.00 0.00 C ATOM 738 CD PRO A 49 12.616 11.513 9.797 1.00 0.00 C ATOM 0 HA PRO A 49 15.102 11.140 7.721 1.00 0.00 H new ATOM 0 HB2 PRO A 49 15.359 9.657 10.057 1.00 0.00 H new ATOM 0 HB3 PRO A 49 15.476 11.405 10.090 1.00 0.00 H new ATOM 0 HG2 PRO A 49 13.117 9.653 10.753 1.00 0.00 H new ATOM 0 HG3 PRO A 49 13.706 11.072 11.597 1.00 0.00 H new ATOM 0 HD2 PRO A 49 11.577 11.201 9.904 1.00 0.00 H new ATOM 0 HD3 PRO A 49 12.669 12.557 10.106 1.00 0.00 H new ATOM 746 N LYS A 50 15.317 8.765 7.132 1.00 0.00 N ATOM 747 CA LYS A 50 15.327 7.434 6.537 1.00 0.00 C ATOM 748 C LYS A 50 15.091 6.362 7.596 1.00 0.00 C ATOM 749 O LYS A 50 15.637 6.414 8.699 1.00 0.00 O ATOM 750 CB LYS A 50 16.659 7.180 5.827 1.00 0.00 C ATOM 751 CG LYS A 50 16.614 6.023 4.844 1.00 0.00 C ATOM 752 CD LYS A 50 17.904 5.916 4.049 1.00 0.00 C ATOM 753 CE LYS A 50 17.820 6.690 2.742 1.00 0.00 C ATOM 754 NZ LYS A 50 19.020 6.469 1.889 1.00 0.00 N ATOM 0 H LYS A 50 16.177 9.296 6.992 1.00 0.00 H new ATOM 0 HA LYS A 50 14.518 7.384 5.808 1.00 0.00 H new ATOM 0 HB2 LYS A 50 16.957 8.085 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.427 6.981 6.574 1.00 0.00 H new ATOM 0 HG2 LYS A 50 16.440 5.092 5.384 1.00 0.00 H new ATOM 0 HG3 LYS A 50 15.775 6.157 4.161 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.733 6.297 4.646 1.00 0.00 H new ATOM 0 HD3 LYS A 50 18.117 4.868 3.839 1.00 0.00 H new ATOM 0 HE2 LYS A 50 16.926 6.387 2.197 1.00 0.00 H new ATOM 0 HE3 LYS A 50 17.717 7.754 2.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 18.925 7.013 1.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 19.871 6.782 2.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 19.104 5.457 1.664 1.00 0.00 H new ATOM 768 N PRO A 51 14.259 5.366 7.257 1.00 0.00 N ATOM 769 CA PRO A 51 13.934 4.262 8.165 1.00 0.00 C ATOM 770 C PRO A 51 15.119 3.328 8.390 1.00 0.00 C ATOM 771 O PRO A 51 16.212 3.562 7.875 1.00 0.00 O ATOM 772 CB PRO A 51 12.804 3.527 7.439 1.00 0.00 C ATOM 773 CG PRO A 51 13.008 3.847 5.999 1.00 0.00 C ATOM 774 CD PRO A 51 13.573 5.240 5.960 1.00 0.00 C ATOM 0 HA PRO A 51 13.661 4.618 9.158 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.852 2.453 7.616 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.827 3.863 7.785 1.00 0.00 H new ATOM 0 HG2 PRO A 51 13.691 3.136 5.534 1.00 0.00 H new ATOM 0 HG3 PRO A 51 12.068 3.792 5.450 1.00 0.00 H new ATOM 0 HD2 PRO A 51 14.263 5.371 5.126 1.00 0.00 H new ATOM 0 HD3 PRO A 51 12.789 5.989 5.846 1.00 0.00 H new ATOM 782 N SER A 52 14.894 2.270 9.161 1.00 0.00 N ATOM 783 CA SER A 52 15.944 1.302 9.457 1.00 0.00 C ATOM 784 C SER A 52 16.036 0.248 8.358 1.00 0.00 C ATOM 785 O SER A 52 15.101 0.063 7.579 1.00 0.00 O ATOM 786 CB SER A 52 15.681 0.629 10.805 1.00 0.00 C ATOM 787 OG SER A 52 16.861 0.035 11.318 1.00 0.00 O ATOM 0 H SER A 52 13.994 2.061 9.593 1.00 0.00 H new ATOM 0 HA SER A 52 16.893 1.835 9.505 1.00 0.00 H new ATOM 0 HB2 SER A 52 15.303 1.365 11.515 1.00 0.00 H new ATOM 0 HB3 SER A 52 14.908 -0.131 10.691 1.00 0.00 H new ATOM 0 HG SER A 52 16.666 -0.387 12.181 1.00 0.00 H new ATOM 793 N PHE A 53 17.170 -0.442 8.303 1.00 0.00 N ATOM 794 CA PHE A 53 17.387 -1.478 7.300 1.00 0.00 C ATOM 795 C PHE A 53 16.473 -2.675 7.547 1.00 0.00 C ATOM 796 O PHE A 53 15.952 -3.277 6.608 1.00 0.00 O ATOM 797 CB PHE A 53 18.849 -1.929 7.309 1.00 0.00 C ATOM 798 CG PHE A 53 19.097 -3.177 6.511 1.00 0.00 C ATOM 799 CD1 PHE A 53 19.322 -3.110 5.146 1.00 0.00 C ATOM 800 CD2 PHE A 53 19.104 -4.418 7.127 1.00 0.00 C ATOM 801 CE1 PHE A 53 19.549 -4.257 4.409 1.00 0.00 C ATOM 802 CE2 PHE A 53 19.331 -5.569 6.396 1.00 0.00 C ATOM 803 CZ PHE A 53 19.555 -5.488 5.035 1.00 0.00 C ATOM 0 H PHE A 53 17.953 -0.303 8.941 1.00 0.00 H new ATOM 0 HA PHE A 53 17.150 -1.057 6.323 1.00 0.00 H new ATOM 0 HB2 PHE A 53 19.471 -1.126 6.914 1.00 0.00 H new ATOM 0 HB3 PHE A 53 19.162 -2.098 8.339 1.00 0.00 H new ATOM 0 HD1 PHE A 53 19.320 -2.150 4.652 1.00 0.00 H new ATOM 0 HD2 PHE A 53 18.930 -4.487 8.191 1.00 0.00 H new ATOM 0 HE1 PHE A 53 19.721 -4.191 3.345 1.00 0.00 H new ATOM 0 HE2 PHE A 53 19.333 -6.530 6.888 1.00 0.00 H new ATOM 0 HZ PHE A 53 19.734 -6.386 4.462 1.00 0.00 H new ATOM 813 N PHE A 54 16.283 -3.014 8.818 1.00 0.00 N ATOM 814 CA PHE A 54 15.434 -4.139 9.190 1.00 0.00 C ATOM 815 C PHE A 54 13.961 -3.800 8.984 1.00 0.00 C ATOM 816 O PHE A 54 13.172 -4.644 8.556 1.00 0.00 O ATOM 817 CB PHE A 54 15.679 -4.530 10.649 1.00 0.00 C ATOM 818 CG PHE A 54 17.128 -4.753 10.975 1.00 0.00 C ATOM 819 CD1 PHE A 54 17.930 -5.516 10.141 1.00 0.00 C ATOM 820 CD2 PHE A 54 17.689 -4.198 12.114 1.00 0.00 C ATOM 821 CE1 PHE A 54 19.263 -5.724 10.439 1.00 0.00 C ATOM 822 CE2 PHE A 54 19.023 -4.402 12.416 1.00 0.00 C ATOM 823 CZ PHE A 54 19.811 -5.165 11.577 1.00 0.00 C ATOM 0 H PHE A 54 16.706 -2.525 9.607 1.00 0.00 H new ATOM 0 HA PHE A 54 15.689 -4.982 8.547 1.00 0.00 H new ATOM 0 HB2 PHE A 54 15.285 -3.747 11.297 1.00 0.00 H new ATOM 0 HB3 PHE A 54 15.121 -5.439 10.872 1.00 0.00 H new ATOM 0 HD1 PHE A 54 17.508 -5.953 9.248 1.00 0.00 H new ATOM 0 HD2 PHE A 54 17.078 -3.600 12.773 1.00 0.00 H new ATOM 0 HE1 PHE A 54 19.876 -6.323 9.782 1.00 0.00 H new ATOM 0 HE2 PHE A 54 19.448 -3.965 13.307 1.00 0.00 H new ATOM 0 HZ PHE A 54 20.853 -5.324 11.810 1.00 0.00 H new ATOM 833 N ASP A 55 13.597 -2.560 9.290 1.00 0.00 N ATOM 834 CA ASP A 55 12.219 -2.107 9.138 1.00 0.00 C ATOM 835 C ASP A 55 11.837 -2.013 7.664 1.00 0.00 C ATOM 836 O ASP A 55 11.836 -0.929 7.081 1.00 0.00 O ATOM 837 CB ASP A 55 12.027 -0.749 9.815 1.00 0.00 C ATOM 838 CG ASP A 55 11.668 -0.880 11.282 1.00 0.00 C ATOM 839 OD1 ASP A 55 10.943 -1.834 11.633 1.00 0.00 O ATOM 840 OD2 ASP A 55 12.110 -0.026 12.080 1.00 0.00 O ATOM 0 H ASP A 55 14.237 -1.850 9.645 1.00 0.00 H new ATOM 0 HA ASP A 55 11.568 -2.838 9.618 1.00 0.00 H new ATOM 0 HB2 ASP A 55 12.943 -0.165 9.719 1.00 0.00 H new ATOM 0 HB3 ASP A 55 11.241 -0.197 9.299 1.00 0.00 H new ATOM 845 N PHE A 56 11.516 -3.156 7.067 1.00 0.00 N ATOM 846 CA PHE A 56 11.135 -3.202 5.660 1.00 0.00 C ATOM 847 C PHE A 56 9.810 -2.480 5.431 1.00 0.00 C ATOM 848 O PHE A 56 9.726 -1.558 4.621 1.00 0.00 O ATOM 849 CB PHE A 56 11.026 -4.653 5.187 1.00 0.00 C ATOM 850 CG PHE A 56 11.865 -5.609 5.986 1.00 0.00 C ATOM 851 CD1 PHE A 56 11.359 -6.209 7.127 1.00 0.00 C ATOM 852 CD2 PHE A 56 13.161 -5.906 5.595 1.00 0.00 C ATOM 853 CE1 PHE A 56 12.129 -7.089 7.864 1.00 0.00 C ATOM 854 CE2 PHE A 56 13.936 -6.785 6.328 1.00 0.00 C ATOM 855 CZ PHE A 56 13.419 -7.377 7.465 1.00 0.00 C ATOM 0 H PHE A 56 11.512 -4.062 7.535 1.00 0.00 H new ATOM 0 HA PHE A 56 11.909 -2.696 5.083 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.983 -4.966 5.239 1.00 0.00 H new ATOM 0 HB3 PHE A 56 11.324 -4.709 4.140 1.00 0.00 H new ATOM 0 HD1 PHE A 56 10.351 -5.987 7.445 1.00 0.00 H new ATOM 0 HD2 PHE A 56 13.570 -5.446 4.708 1.00 0.00 H new ATOM 0 HE1 PHE A 56 11.722 -7.551 8.751 1.00 0.00 H new ATOM 0 HE2 PHE A 56 14.944 -7.009 6.013 1.00 0.00 H new ATOM 0 HZ PHE A 56 14.023 -8.063 8.040 1.00 0.00 H new ATOM 865 N GLU A 57 8.777 -2.908 6.151 1.00 0.00 N ATOM 866 CA GLU A 57 7.457 -2.303 6.026 1.00 0.00 C ATOM 867 C GLU A 57 7.560 -0.783 5.947 1.00 0.00 C ATOM 868 O GLU A 57 6.924 -0.149 5.106 1.00 0.00 O ATOM 869 CB GLU A 57 6.573 -2.705 7.208 1.00 0.00 C ATOM 870 CG GLU A 57 6.639 -4.186 7.541 1.00 0.00 C ATOM 871 CD GLU A 57 5.599 -4.601 8.564 1.00 0.00 C ATOM 872 OE1 GLU A 57 5.541 -3.973 9.641 1.00 0.00 O ATOM 873 OE2 GLU A 57 4.842 -5.555 8.285 1.00 0.00 O ATOM 0 H GLU A 57 8.830 -3.671 6.826 1.00 0.00 H new ATOM 0 HA GLU A 57 7.005 -2.667 5.103 1.00 0.00 H new ATOM 0 HB2 GLU A 57 6.870 -2.130 8.085 1.00 0.00 H new ATOM 0 HB3 GLU A 57 5.540 -2.437 6.986 1.00 0.00 H new ATOM 0 HG2 GLU A 57 6.498 -4.766 6.629 1.00 0.00 H new ATOM 0 HG3 GLU A 57 7.632 -4.425 7.921 1.00 0.00 H new ATOM 880 N GLY A 58 8.365 -0.203 6.833 1.00 0.00 N ATOM 881 CA GLY A 58 8.537 1.238 6.848 1.00 0.00 C ATOM 882 C GLY A 58 9.541 1.713 5.817 1.00 0.00 C ATOM 883 O GLY A 58 9.583 2.896 5.479 1.00 0.00 O ATOM 0 H GLY A 58 8.901 -0.706 7.540 1.00 0.00 H new ATOM 0 HA2 GLY A 58 7.576 1.717 6.662 1.00 0.00 H new ATOM 0 HA3 GLY A 58 8.863 1.552 7.840 1.00 0.00 H new ATOM 887 N LYS A 59 10.353 0.790 5.315 1.00 0.00 N ATOM 888 CA LYS A 59 11.363 1.120 4.316 1.00 0.00 C ATOM 889 C LYS A 59 10.715 1.447 2.975 1.00 0.00 C ATOM 890 O LYS A 59 10.834 2.565 2.475 1.00 0.00 O ATOM 891 CB LYS A 59 12.345 -0.043 4.151 1.00 0.00 C ATOM 892 CG LYS A 59 13.564 0.306 3.314 1.00 0.00 C ATOM 893 CD LYS A 59 14.779 -0.503 3.736 1.00 0.00 C ATOM 894 CE LYS A 59 14.593 -1.984 3.440 1.00 0.00 C ATOM 895 NZ LYS A 59 14.555 -2.257 1.977 1.00 0.00 N ATOM 0 H LYS A 59 10.332 -0.194 5.584 1.00 0.00 H new ATOM 0 HA LYS A 59 11.906 2.000 4.661 1.00 0.00 H new ATOM 0 HB2 LYS A 59 12.673 -0.373 5.137 1.00 0.00 H new ATOM 0 HB3 LYS A 59 11.826 -0.883 3.690 1.00 0.00 H new ATOM 0 HG2 LYS A 59 13.349 0.120 2.262 1.00 0.00 H new ATOM 0 HG3 LYS A 59 13.782 1.370 3.412 1.00 0.00 H new ATOM 0 HD2 LYS A 59 15.662 -0.135 3.214 1.00 0.00 H new ATOM 0 HD3 LYS A 59 14.958 -0.364 4.802 1.00 0.00 H new ATOM 0 HE2 LYS A 59 15.406 -2.550 3.894 1.00 0.00 H new ATOM 0 HE3 LYS A 59 13.668 -2.332 3.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 14.632 -3.281 1.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 13.658 -1.909 1.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 15.349 -1.771 1.513 1.00 0.00 H new ATOM 909 N GLN A 60 10.029 0.464 2.399 1.00 0.00 N ATOM 910 CA GLN A 60 9.361 0.650 1.116 1.00 0.00 C ATOM 911 C GLN A 60 8.486 1.898 1.133 1.00 0.00 C ATOM 912 O GLN A 60 8.502 2.695 0.194 1.00 0.00 O ATOM 913 CB GLN A 60 8.514 -0.578 0.776 1.00 0.00 C ATOM 914 CG GLN A 60 7.616 -1.031 1.915 1.00 0.00 C ATOM 915 CD GLN A 60 6.831 -2.283 1.577 1.00 0.00 C ATOM 916 OE1 GLN A 60 5.609 -2.321 1.718 1.00 0.00 O ATOM 917 NE2 GLN A 60 7.533 -3.318 1.129 1.00 0.00 N ATOM 0 H GLN A 60 9.922 -0.468 2.800 1.00 0.00 H new ATOM 0 HA GLN A 60 10.127 0.777 0.351 1.00 0.00 H new ATOM 0 HB2 GLN A 60 7.898 -0.354 -0.095 1.00 0.00 H new ATOM 0 HB3 GLN A 60 9.175 -1.399 0.497 1.00 0.00 H new ATOM 0 HG2 GLN A 60 8.224 -1.216 2.800 1.00 0.00 H new ATOM 0 HG3 GLN A 60 6.922 -0.229 2.167 1.00 0.00 H new ATOM 0 HE21 GLN A 60 8.545 -3.242 1.028 1.00 0.00 H new ATOM 0 HE22 GLN A 60 7.060 -4.188 0.886 1.00 0.00 H new ATOM 926 N LYS A 61 7.720 2.063 2.207 1.00 0.00 N ATOM 927 CA LYS A 61 6.838 3.215 2.348 1.00 0.00 C ATOM 928 C LYS A 61 7.621 4.519 2.230 1.00 0.00 C ATOM 929 O LYS A 61 7.389 5.312 1.318 1.00 0.00 O ATOM 930 CB LYS A 61 6.110 3.164 3.693 1.00 0.00 C ATOM 931 CG LYS A 61 5.144 2.000 3.819 1.00 0.00 C ATOM 932 CD LYS A 61 4.488 1.964 5.190 1.00 0.00 C ATOM 933 CE LYS A 61 3.155 1.233 5.151 1.00 0.00 C ATOM 934 NZ LYS A 61 2.274 1.626 6.285 1.00 0.00 N ATOM 0 H LYS A 61 7.693 1.413 2.992 1.00 0.00 H new ATOM 0 HA LYS A 61 6.104 3.179 1.543 1.00 0.00 H new ATOM 0 HB2 LYS A 61 6.847 3.101 4.493 1.00 0.00 H new ATOM 0 HB3 LYS A 61 5.563 4.096 3.836 1.00 0.00 H new ATOM 0 HG2 LYS A 61 4.376 2.079 3.049 1.00 0.00 H new ATOM 0 HG3 LYS A 61 5.676 1.065 3.645 1.00 0.00 H new ATOM 0 HD2 LYS A 61 5.153 1.472 5.900 1.00 0.00 H new ATOM 0 HD3 LYS A 61 4.336 2.982 5.548 1.00 0.00 H new ATOM 0 HE2 LYS A 61 2.651 1.447 4.208 1.00 0.00 H new ATOM 0 HE3 LYS A 61 3.329 0.158 5.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 1.375 1.106 6.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.744 1.399 7.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 2.086 2.648 6.241 1.00 0.00 H new ATOM 948 N TRP A 62 8.548 4.732 3.156 1.00 0.00 N ATOM 949 CA TRP A 62 9.366 5.939 3.155 1.00 0.00 C ATOM 950 C TRP A 62 9.992 6.171 1.784 1.00 0.00 C ATOM 951 O TRP A 62 10.043 7.300 1.299 1.00 0.00 O ATOM 952 CB TRP A 62 10.461 5.839 4.218 1.00 0.00 C ATOM 953 CG TRP A 62 11.304 7.074 4.320 1.00 0.00 C ATOM 954 CD1 TRP A 62 11.057 8.174 5.091 1.00 0.00 C ATOM 955 CD2 TRP A 62 12.530 7.335 3.627 1.00 0.00 C ATOM 956 NE1 TRP A 62 12.054 9.103 4.918 1.00 0.00 N ATOM 957 CE2 TRP A 62 12.970 8.612 4.026 1.00 0.00 C ATOM 958 CE3 TRP A 62 13.299 6.614 2.710 1.00 0.00 C ATOM 959 CZ2 TRP A 62 14.143 9.181 3.538 1.00 0.00 C ATOM 960 CZ3 TRP A 62 14.463 7.180 2.226 1.00 0.00 C ATOM 961 CH2 TRP A 62 14.877 8.452 2.641 1.00 0.00 C ATOM 0 H TRP A 62 8.752 4.085 3.917 1.00 0.00 H new ATOM 0 HA TRP A 62 8.720 6.786 3.387 1.00 0.00 H new ATOM 0 HB2 TRP A 62 10.001 5.641 5.186 1.00 0.00 H new ATOM 0 HB3 TRP A 62 11.102 4.988 3.990 1.00 0.00 H new ATOM 0 HD1 TRP A 62 10.203 8.296 5.741 1.00 0.00 H new ATOM 0 HE1 TRP A 62 12.104 10.011 5.379 1.00 0.00 H new ATOM 0 HE3 TRP A 62 12.989 5.632 2.385 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 14.463 10.162 3.856 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 15.064 6.632 1.515 1.00 0.00 H new ATOM 0 HH2 TRP A 62 15.793 8.866 2.246 1.00 0.00 H new ATOM 972 N GLU A 63 10.466 5.094 1.164 1.00 0.00 N ATOM 973 CA GLU A 63 11.088 5.183 -0.151 1.00 0.00 C ATOM 974 C GLU A 63 10.099 5.709 -1.187 1.00 0.00 C ATOM 975 O GLU A 63 10.214 6.843 -1.651 1.00 0.00 O ATOM 976 CB GLU A 63 11.616 3.813 -0.583 1.00 0.00 C ATOM 977 CG GLU A 63 12.920 3.422 0.092 1.00 0.00 C ATOM 978 CD GLU A 63 13.744 2.460 -0.742 1.00 0.00 C ATOM 979 OE1 GLU A 63 14.441 2.924 -1.668 1.00 0.00 O ATOM 980 OE2 GLU A 63 13.690 1.243 -0.468 1.00 0.00 O ATOM 0 H GLU A 63 10.431 4.151 1.551 1.00 0.00 H new ATOM 0 HA GLU A 63 11.922 5.882 -0.084 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.862 3.057 -0.363 1.00 0.00 H new ATOM 0 HB3 GLU A 63 11.762 3.813 -1.663 1.00 0.00 H new ATOM 0 HG2 GLU A 63 13.506 4.320 0.289 1.00 0.00 H new ATOM 0 HG3 GLU A 63 12.702 2.965 1.057 1.00 0.00 H new ATOM 987 N ALA A 64 9.127 4.875 -1.545 1.00 0.00 N ATOM 988 CA ALA A 64 8.117 5.256 -2.524 1.00 0.00 C ATOM 989 C ALA A 64 7.750 6.730 -2.390 1.00 0.00 C ATOM 990 O ALA A 64 7.761 7.474 -3.371 1.00 0.00 O ATOM 991 CB ALA A 64 6.879 4.385 -2.370 1.00 0.00 C ATOM 0 H ALA A 64 9.018 3.932 -1.172 1.00 0.00 H new ATOM 0 HA ALA A 64 8.535 5.103 -3.519 1.00 0.00 H new ATOM 0 HB1 ALA A 64 6.132 4.680 -3.107 1.00 0.00 H new ATOM 0 HB2 ALA A 64 7.148 3.340 -2.524 1.00 0.00 H new ATOM 0 HB3 ALA A 64 6.469 4.510 -1.368 1.00 0.00 H new ATOM 997 N TRP A 65 7.424 7.144 -1.171 1.00 0.00 N ATOM 998 CA TRP A 65 7.053 8.530 -0.910 1.00 0.00 C ATOM 999 C TRP A 65 8.267 9.447 -1.009 1.00 0.00 C ATOM 1000 O TRP A 65 8.156 10.596 -1.437 1.00 0.00 O ATOM 1001 CB TRP A 65 6.415 8.656 0.475 1.00 0.00 C ATOM 1002 CG TRP A 65 6.164 10.075 0.887 1.00 0.00 C ATOM 1003 CD1 TRP A 65 5.741 11.098 0.087 1.00 0.00 C ATOM 1004 CD2 TRP A 65 6.323 10.628 2.198 1.00 0.00 C ATOM 1005 NE1 TRP A 65 5.627 12.254 0.822 1.00 0.00 N ATOM 1006 CE2 TRP A 65 5.978 11.991 2.120 1.00 0.00 C ATOM 1007 CE3 TRP A 65 6.722 10.104 3.430 1.00 0.00 C ATOM 1008 CZ2 TRP A 65 6.021 12.834 3.227 1.00 0.00 C ATOM 1009 CZ3 TRP A 65 6.764 10.942 4.528 1.00 0.00 C ATOM 1010 CH2 TRP A 65 6.415 12.294 4.421 1.00 0.00 C ATOM 0 H TRP A 65 7.409 6.541 -0.349 1.00 0.00 H new ATOM 0 HA TRP A 65 6.329 8.835 -1.666 1.00 0.00 H new ATOM 0 HB2 TRP A 65 5.471 8.111 0.483 1.00 0.00 H new ATOM 0 HB3 TRP A 65 7.064 8.181 1.211 1.00 0.00 H new ATOM 0 HD1 TRP A 65 5.527 11.011 -0.968 1.00 0.00 H new ATOM 0 HE1 TRP A 65 5.330 13.160 0.460 1.00 0.00 H new ATOM 0 HE3 TRP A 65 6.993 9.063 3.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 5.753 13.877 3.146 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 7.071 10.547 5.485 1.00 0.00 H new ATOM 0 HH2 TRP A 65 6.458 12.923 5.298 1.00 0.00 H new ATOM 1021 N LYS A 66 9.425 8.933 -0.611 1.00 0.00 N ATOM 1022 CA LYS A 66 10.661 9.705 -0.656 1.00 0.00 C ATOM 1023 C LYS A 66 10.980 10.139 -2.083 1.00 0.00 C ATOM 1024 O LYS A 66 11.425 11.262 -2.316 1.00 0.00 O ATOM 1025 CB LYS A 66 11.822 8.883 -0.091 1.00 0.00 C ATOM 1026 CG LYS A 66 13.187 9.487 -0.368 1.00 0.00 C ATOM 1027 CD LYS A 66 13.436 10.718 0.488 1.00 0.00 C ATOM 1028 CE LYS A 66 14.715 11.433 0.078 1.00 0.00 C ATOM 1029 NZ LYS A 66 14.954 12.655 0.894 1.00 0.00 N ATOM 0 H LYS A 66 9.534 7.984 -0.253 1.00 0.00 H new ATOM 0 HA LYS A 66 10.524 10.597 -0.045 1.00 0.00 H new ATOM 0 HB2 LYS A 66 11.692 8.779 0.986 1.00 0.00 H new ATOM 0 HB3 LYS A 66 11.785 7.879 -0.515 1.00 0.00 H new ATOM 0 HG2 LYS A 66 13.961 8.745 -0.173 1.00 0.00 H new ATOM 0 HG3 LYS A 66 13.260 9.755 -1.422 1.00 0.00 H new ATOM 0 HD2 LYS A 66 12.591 11.401 0.399 1.00 0.00 H new ATOM 0 HD3 LYS A 66 13.501 10.426 1.536 1.00 0.00 H new ATOM 0 HE2 LYS A 66 15.561 10.754 0.185 1.00 0.00 H new ATOM 0 HE3 LYS A 66 14.657 11.706 -0.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 15.835 13.113 0.584 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 14.159 13.315 0.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 15.035 12.392 1.897 1.00 0.00 H new ATOM 1043 N ALA A 67 10.747 9.242 -3.035 1.00 0.00 N ATOM 1044 CA ALA A 67 11.006 9.534 -4.440 1.00 0.00 C ATOM 1045 C ALA A 67 10.172 10.718 -4.917 1.00 0.00 C ATOM 1046 O ALA A 67 10.534 11.398 -5.878 1.00 0.00 O ATOM 1047 CB ALA A 67 10.723 8.307 -5.295 1.00 0.00 C ATOM 0 H ALA A 67 10.379 8.307 -2.859 1.00 0.00 H new ATOM 0 HA ALA A 67 12.058 9.800 -4.543 1.00 0.00 H new ATOM 0 HB1 ALA A 67 10.921 8.539 -6.341 1.00 0.00 H new ATOM 0 HB2 ALA A 67 11.366 7.486 -4.978 1.00 0.00 H new ATOM 0 HB3 ALA A 67 9.679 8.015 -5.179 1.00 0.00 H new ATOM 1053 N LEU A 68 9.054 10.958 -4.242 1.00 0.00 N ATOM 1054 CA LEU A 68 8.167 12.061 -4.597 1.00 0.00 C ATOM 1055 C LEU A 68 8.547 13.331 -3.842 1.00 0.00 C ATOM 1056 O LEU A 68 7.700 13.972 -3.221 1.00 0.00 O ATOM 1057 CB LEU A 68 6.714 11.690 -4.296 1.00 0.00 C ATOM 1058 CG LEU A 68 6.271 10.296 -4.741 1.00 0.00 C ATOM 1059 CD1 LEU A 68 4.810 10.063 -4.391 1.00 0.00 C ATOM 1060 CD2 LEU A 68 6.499 10.115 -6.235 1.00 0.00 C ATOM 0 H LEU A 68 8.740 10.404 -3.445 1.00 0.00 H new ATOM 0 HA LEU A 68 8.273 12.251 -5.665 1.00 0.00 H new ATOM 0 HB2 LEU A 68 6.554 11.774 -3.221 1.00 0.00 H new ATOM 0 HB3 LEU A 68 6.066 12.425 -4.774 1.00 0.00 H new ATOM 0 HG LEU A 68 6.873 9.558 -4.210 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.513 9.066 -4.715 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.676 10.149 -3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.192 10.807 -4.894 1.00 0.00 H new ATOM 0 HD21 LEU A 68 6.178 9.117 -6.534 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.924 10.861 -6.784 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.559 10.237 -6.459 1.00 0.00 H new ATOM 1072 N GLY A 69 9.826 13.689 -3.902 1.00 0.00 N ATOM 1073 CA GLY A 69 10.295 14.882 -3.222 1.00 0.00 C ATOM 1074 C GLY A 69 9.877 16.155 -3.929 1.00 0.00 C ATOM 1075 O GLY A 69 9.341 17.072 -3.306 1.00 0.00 O ATOM 0 H GLY A 69 10.546 13.174 -4.409 1.00 0.00 H new ATOM 0 HA2 GLY A 69 9.907 14.892 -2.203 1.00 0.00 H new ATOM 0 HA3 GLY A 69 11.382 14.851 -3.149 1.00 0.00 H new ATOM 1079 N ASP A 70 10.123 16.214 -5.233 1.00 0.00 N ATOM 1080 CA ASP A 70 9.769 17.385 -6.027 1.00 0.00 C ATOM 1081 C ASP A 70 8.474 17.148 -6.798 1.00 0.00 C ATOM 1082 O ASP A 70 8.209 17.806 -7.804 1.00 0.00 O ATOM 1083 CB ASP A 70 10.899 17.730 -6.997 1.00 0.00 C ATOM 1084 CG ASP A 70 11.506 16.499 -7.641 1.00 0.00 C ATOM 1085 OD1 ASP A 70 10.741 15.673 -8.181 1.00 0.00 O ATOM 1086 OD2 ASP A 70 12.747 16.363 -7.604 1.00 0.00 O ATOM 0 H ASP A 70 10.567 15.464 -5.763 1.00 0.00 H new ATOM 0 HA ASP A 70 9.617 18.223 -5.346 1.00 0.00 H new ATOM 0 HB2 ASP A 70 10.517 18.392 -7.774 1.00 0.00 H new ATOM 0 HB3 ASP A 70 11.676 18.278 -6.465 1.00 0.00 H new ATOM 1091 N SER A 71 7.671 16.202 -6.320 1.00 0.00 N ATOM 1092 CA SER A 71 6.406 15.875 -6.967 1.00 0.00 C ATOM 1093 C SER A 71 5.320 16.871 -6.572 1.00 0.00 C ATOM 1094 O SER A 71 5.558 17.785 -5.783 1.00 0.00 O ATOM 1095 CB SER A 71 5.971 14.456 -6.595 1.00 0.00 C ATOM 1096 OG SER A 71 6.549 13.500 -7.468 1.00 0.00 O ATOM 0 H SER A 71 7.874 15.649 -5.487 1.00 0.00 H new ATOM 0 HA SER A 71 6.553 15.932 -8.046 1.00 0.00 H new ATOM 0 HB2 SER A 71 6.265 14.240 -5.568 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.884 14.382 -6.638 1.00 0.00 H new ATOM 0 HG SER A 71 5.851 12.900 -7.805 1.00 0.00 H new ATOM 1102 N SER A 72 4.127 16.687 -7.128 1.00 0.00 N ATOM 1103 CA SER A 72 3.004 17.571 -6.838 1.00 0.00 C ATOM 1104 C SER A 72 1.819 16.782 -6.288 1.00 0.00 C ATOM 1105 O SER A 72 1.688 15.577 -6.506 1.00 0.00 O ATOM 1106 CB SER A 72 2.585 18.328 -8.100 1.00 0.00 C ATOM 1107 OG SER A 72 3.373 19.492 -8.281 1.00 0.00 O ATOM 0 H SER A 72 3.913 15.934 -7.782 1.00 0.00 H new ATOM 0 HA SER A 72 3.324 18.288 -6.082 1.00 0.00 H new ATOM 0 HB2 SER A 72 2.686 17.678 -8.969 1.00 0.00 H new ATOM 0 HB3 SER A 72 1.533 18.604 -8.030 1.00 0.00 H new ATOM 0 HG SER A 72 3.087 19.957 -9.095 1.00 0.00 H new ATOM 1113 N PRO A 73 0.935 17.477 -5.558 1.00 0.00 N ATOM 1114 CA PRO A 73 -0.255 16.863 -4.961 1.00 0.00 C ATOM 1115 C PRO A 73 -1.288 16.463 -6.009 1.00 0.00 C ATOM 1116 O PRO A 73 -1.769 15.329 -6.019 1.00 0.00 O ATOM 1117 CB PRO A 73 -0.810 17.968 -4.059 1.00 0.00 C ATOM 1118 CG PRO A 73 -0.316 19.236 -4.666 1.00 0.00 C ATOM 1119 CD PRO A 73 1.028 18.916 -5.258 1.00 0.00 C ATOM 0 HA PRO A 73 -0.015 15.941 -4.431 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.899 17.943 -4.026 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -0.458 17.856 -3.034 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -1.004 19.596 -5.431 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -0.235 20.022 -3.915 1.00 0.00 H new ATOM 0 HD2 PRO A 73 1.221 19.502 -6.156 1.00 0.00 H new ATOM 0 HD3 PRO A 73 1.836 19.129 -4.558 1.00 0.00 H new ATOM 1127 N SER A 74 -1.625 17.399 -6.890 1.00 0.00 N ATOM 1128 CA SER A 74 -2.603 17.144 -7.941 1.00 0.00 C ATOM 1129 C SER A 74 -2.115 16.049 -8.884 1.00 0.00 C ATOM 1130 O SER A 74 -2.910 15.279 -9.421 1.00 0.00 O ATOM 1131 CB SER A 74 -2.881 18.425 -8.730 1.00 0.00 C ATOM 1132 OG SER A 74 -2.831 19.564 -7.888 1.00 0.00 O ATOM 0 H SER A 74 -1.235 18.341 -6.897 1.00 0.00 H new ATOM 0 HA SER A 74 -3.526 16.808 -7.469 1.00 0.00 H new ATOM 0 HB2 SER A 74 -2.149 18.529 -9.531 1.00 0.00 H new ATOM 0 HB3 SER A 74 -3.862 18.360 -9.201 1.00 0.00 H new ATOM 0 HG SER A 74 -3.010 20.370 -8.416 1.00 0.00 H new ATOM 1138 N GLN A 75 -0.802 15.986 -9.078 1.00 0.00 N ATOM 1139 CA GLN A 75 -0.207 14.986 -9.957 1.00 0.00 C ATOM 1140 C GLN A 75 -0.187 13.616 -9.286 1.00 0.00 C ATOM 1141 O GLN A 75 -0.072 12.589 -9.954 1.00 0.00 O ATOM 1142 CB GLN A 75 1.214 15.397 -10.345 1.00 0.00 C ATOM 1143 CG GLN A 75 1.272 16.659 -11.191 1.00 0.00 C ATOM 1144 CD GLN A 75 2.652 16.914 -11.765 1.00 0.00 C ATOM 1145 OE1 GLN A 75 3.266 18.021 -11.363 1.00 0.00 O flip ATOM 1146 NE2 GLN A 75 3.161 16.125 -12.561 1.00 0.00 N flip ATOM 0 H GLN A 75 -0.130 16.615 -8.639 1.00 0.00 H new ATOM 0 HA GLN A 75 -0.817 14.921 -10.858 1.00 0.00 H new ATOM 0 HB2 GLN A 75 1.800 15.550 -9.438 1.00 0.00 H new ATOM 0 HB3 GLN A 75 1.683 14.580 -10.893 1.00 0.00 H new ATOM 0 HG2 GLN A 75 0.553 16.579 -12.006 1.00 0.00 H new ATOM 0 HG3 GLN A 75 0.972 17.513 -10.584 1.00 0.00 H new ATOM 0 HE21 GLN A 75 2.654 15.286 -12.843 1.00 0.00 H new ATOM 0 HE22 GLN A 75 4.090 16.310 -12.939 1.00 0.00 H new ATOM 1155 N ALA A 76 -0.299 13.609 -7.962 1.00 0.00 N ATOM 1156 CA ALA A 76 -0.295 12.365 -7.202 1.00 0.00 C ATOM 1157 C ALA A 76 -1.696 11.769 -7.118 1.00 0.00 C ATOM 1158 O ALA A 76 -1.858 10.570 -6.896 1.00 0.00 O ATOM 1159 CB ALA A 76 0.265 12.601 -5.807 1.00 0.00 C ATOM 0 H ALA A 76 -0.394 14.451 -7.393 1.00 0.00 H new ATOM 0 HA ALA A 76 0.344 11.652 -7.722 1.00 0.00 H new ATOM 0 HB1 ALA A 76 0.262 11.664 -5.250 1.00 0.00 H new ATOM 0 HB2 ALA A 76 1.286 12.975 -5.883 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -0.352 13.334 -5.287 1.00 0.00 H new ATOM 1165 N MET A 77 -2.706 12.615 -7.296 1.00 0.00 N ATOM 1166 CA MET A 77 -4.094 12.170 -7.240 1.00 0.00 C ATOM 1167 C MET A 77 -4.508 11.518 -8.555 1.00 0.00 C ATOM 1168 O MET A 77 -5.128 10.455 -8.562 1.00 0.00 O ATOM 1169 CB MET A 77 -5.017 13.349 -6.929 1.00 0.00 C ATOM 1170 CG MET A 77 -4.773 13.969 -5.562 1.00 0.00 C ATOM 1171 SD MET A 77 -5.864 15.365 -5.227 1.00 0.00 S ATOM 1172 CE MET A 77 -4.810 16.376 -4.190 1.00 0.00 C ATOM 0 H MET A 77 -2.589 13.611 -7.480 1.00 0.00 H new ATOM 0 HA MET A 77 -4.181 11.430 -6.444 1.00 0.00 H new ATOM 0 HB2 MET A 77 -4.886 14.114 -7.694 1.00 0.00 H new ATOM 0 HB3 MET A 77 -6.053 13.014 -6.987 1.00 0.00 H new ATOM 0 HG2 MET A 77 -4.914 13.210 -4.793 1.00 0.00 H new ATOM 0 HG3 MET A 77 -3.736 14.299 -5.497 1.00 0.00 H new ATOM 0 HE1 MET A 77 -5.345 17.280 -3.899 1.00 0.00 H new ATOM 0 HE2 MET A 77 -4.532 15.816 -3.297 1.00 0.00 H new ATOM 0 HE3 MET A 77 -3.910 16.648 -4.742 1.00 0.00 H new ATOM 1182 N GLN A 78 -4.162 12.161 -9.665 1.00 0.00 N ATOM 1183 CA GLN A 78 -4.500 11.643 -10.985 1.00 0.00 C ATOM 1184 C GLN A 78 -4.154 10.161 -11.093 1.00 0.00 C ATOM 1185 O GLN A 78 -4.967 9.357 -11.547 1.00 0.00 O ATOM 1186 CB GLN A 78 -3.764 12.431 -12.070 1.00 0.00 C ATOM 1187 CG GLN A 78 -4.098 13.914 -12.077 1.00 0.00 C ATOM 1188 CD GLN A 78 -3.971 14.535 -13.454 1.00 0.00 C ATOM 1189 OE1 GLN A 78 -2.900 14.510 -14.062 1.00 0.00 O ATOM 1190 NE2 GLN A 78 -5.066 15.096 -13.954 1.00 0.00 N ATOM 0 H GLN A 78 -3.648 13.042 -9.677 1.00 0.00 H new ATOM 0 HA GLN A 78 -5.574 11.758 -11.128 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -2.690 12.310 -11.930 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.008 12.007 -13.044 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -5.115 14.055 -11.712 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -3.436 14.435 -11.385 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -5.932 15.094 -13.415 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -5.041 15.529 -14.877 1.00 0.00 H new ATOM 1199 N GLU A 79 -2.943 9.810 -10.674 1.00 0.00 N ATOM 1200 CA GLU A 79 -2.490 8.425 -10.725 1.00 0.00 C ATOM 1201 C GLU A 79 -3.123 7.603 -9.605 1.00 0.00 C ATOM 1202 O GLU A 79 -3.605 6.493 -9.832 1.00 0.00 O ATOM 1203 CB GLU A 79 -0.964 8.359 -10.620 1.00 0.00 C ATOM 1204 CG GLU A 79 -0.246 9.190 -11.670 1.00 0.00 C ATOM 1205 CD GLU A 79 -0.396 8.620 -13.067 1.00 0.00 C ATOM 1206 OE1 GLU A 79 0.108 7.503 -13.310 1.00 0.00 O ATOM 1207 OE2 GLU A 79 -1.017 9.291 -13.918 1.00 0.00 O ATOM 0 H GLU A 79 -2.258 10.465 -10.296 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.800 8.004 -11.681 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.661 8.699 -9.630 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -0.646 7.320 -10.711 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.637 10.207 -11.653 1.00 0.00 H new ATOM 0 HG3 GLU A 79 0.813 9.251 -11.418 1.00 0.00 H new ATOM 1214 N TYR A 80 -3.117 8.156 -8.398 1.00 0.00 N ATOM 1215 CA TYR A 80 -3.687 7.475 -7.242 1.00 0.00 C ATOM 1216 C TYR A 80 -5.114 7.017 -7.529 1.00 0.00 C ATOM 1217 O TYR A 80 -5.561 5.987 -7.023 1.00 0.00 O ATOM 1218 CB TYR A 80 -3.671 8.396 -6.021 1.00 0.00 C ATOM 1219 CG TYR A 80 -4.389 7.823 -4.820 1.00 0.00 C ATOM 1220 CD1 TYR A 80 -5.772 7.690 -4.812 1.00 0.00 C ATOM 1221 CD2 TYR A 80 -3.685 7.415 -3.694 1.00 0.00 C ATOM 1222 CE1 TYR A 80 -6.433 7.167 -3.717 1.00 0.00 C ATOM 1223 CE2 TYR A 80 -4.337 6.890 -2.595 1.00 0.00 C ATOM 1224 CZ TYR A 80 -5.711 6.768 -2.612 1.00 0.00 C ATOM 1225 OH TYR A 80 -6.365 6.247 -1.518 1.00 0.00 O ATOM 0 H TYR A 80 -2.723 9.075 -8.194 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.077 6.596 -7.033 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.637 8.607 -5.749 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -4.130 9.348 -6.288 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -6.340 8.001 -5.676 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -2.609 7.510 -3.678 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -7.509 7.071 -3.727 1.00 0.00 H new ATOM 0 HE2 TYR A 80 -3.774 6.577 -1.728 1.00 0.00 H new ATOM 0 HH TYR A 80 -5.711 6.015 -0.826 1.00 0.00 H new ATOM 1235 N ILE A 81 -5.823 7.790 -8.344 1.00 0.00 N ATOM 1236 CA ILE A 81 -7.199 7.465 -8.700 1.00 0.00 C ATOM 1237 C ILE A 81 -7.247 6.482 -9.866 1.00 0.00 C ATOM 1238 O ILE A 81 -7.702 5.348 -9.716 1.00 0.00 O ATOM 1239 CB ILE A 81 -7.997 8.727 -9.075 1.00 0.00 C ATOM 1240 CG1 ILE A 81 -8.555 9.397 -7.817 1.00 0.00 C ATOM 1241 CG2 ILE A 81 -9.122 8.377 -10.038 1.00 0.00 C ATOM 1242 CD1 ILE A 81 -8.748 10.890 -7.962 1.00 0.00 C ATOM 0 H ILE A 81 -5.468 8.646 -8.770 1.00 0.00 H new ATOM 0 HA ILE A 81 -7.652 7.006 -7.821 1.00 0.00 H new ATOM 0 HB ILE A 81 -7.326 9.428 -9.571 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -9.511 8.938 -7.565 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -7.879 9.206 -6.983 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -9.677 9.280 -10.293 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -8.702 7.940 -10.944 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -9.794 7.659 -9.567 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -9.146 11.297 -7.033 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -7.790 11.361 -8.184 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -9.447 11.089 -8.774 1.00 0.00 H new ATOM 1254 N ALA A 82 -6.773 6.925 -11.026 1.00 0.00 N ATOM 1255 CA ALA A 82 -6.758 6.083 -12.216 1.00 0.00 C ATOM 1256 C ALA A 82 -6.551 4.618 -11.849 1.00 0.00 C ATOM 1257 O ALA A 82 -7.362 3.759 -12.197 1.00 0.00 O ATOM 1258 CB ALA A 82 -5.675 6.548 -13.177 1.00 0.00 C ATOM 0 H ALA A 82 -6.395 7.862 -11.167 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.727 6.173 -12.708 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.675 5.911 -14.061 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.869 7.579 -13.473 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.703 6.488 -12.687 1.00 0.00 H new ATOM 1264 N VAL A 83 -5.458 4.338 -11.146 1.00 0.00 N ATOM 1265 CA VAL A 83 -5.144 2.975 -10.731 1.00 0.00 C ATOM 1266 C VAL A 83 -6.386 2.257 -10.216 1.00 0.00 C ATOM 1267 O VAL A 83 -6.757 1.197 -10.719 1.00 0.00 O ATOM 1268 CB VAL A 83 -4.061 2.957 -9.636 1.00 0.00 C ATOM 1269 CG1 VAL A 83 -4.376 3.984 -8.558 1.00 0.00 C ATOM 1270 CG2 VAL A 83 -3.934 1.565 -9.036 1.00 0.00 C ATOM 0 H VAL A 83 -4.775 5.036 -10.852 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.767 2.455 -11.612 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.105 3.221 -10.089 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.601 3.957 -7.792 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -4.413 4.978 -9.003 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -5.340 3.753 -8.106 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -3.164 1.570 -8.264 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -4.887 1.270 -8.596 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.660 0.856 -9.817 1.00 0.00 H new ATOM 1280 N VAL A 84 -7.025 2.843 -9.208 1.00 0.00 N ATOM 1281 CA VAL A 84 -8.228 2.260 -8.624 1.00 0.00 C ATOM 1282 C VAL A 84 -9.254 1.925 -9.700 1.00 0.00 C ATOM 1283 O VAL A 84 -10.078 1.026 -9.530 1.00 0.00 O ATOM 1284 CB VAL A 84 -8.869 3.210 -7.596 1.00 0.00 C ATOM 1285 CG1 VAL A 84 -7.799 3.992 -6.851 1.00 0.00 C ATOM 1286 CG2 VAL A 84 -9.850 4.150 -8.279 1.00 0.00 C ATOM 0 H VAL A 84 -6.730 3.720 -8.779 1.00 0.00 H new ATOM 0 HA VAL A 84 -7.923 1.343 -8.119 1.00 0.00 H new ATOM 0 HB VAL A 84 -9.420 2.613 -6.869 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -8.271 4.658 -6.129 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -7.140 3.299 -6.328 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -7.218 4.580 -7.561 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -10.294 4.814 -7.537 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -9.325 4.742 -9.029 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -10.636 3.568 -8.761 1.00 0.00 H new ATOM 1296 N LYS A 85 -9.199 2.654 -10.810 1.00 0.00 N ATOM 1297 CA LYS A 85 -10.123 2.434 -11.917 1.00 0.00 C ATOM 1298 C LYS A 85 -9.791 1.141 -12.654 1.00 0.00 C ATOM 1299 O LYS A 85 -10.682 0.445 -13.141 1.00 0.00 O ATOM 1300 CB LYS A 85 -10.076 3.615 -12.889 1.00 0.00 C ATOM 1301 CG LYS A 85 -10.176 4.969 -12.208 1.00 0.00 C ATOM 1302 CD LYS A 85 -10.117 6.105 -13.214 1.00 0.00 C ATOM 1303 CE LYS A 85 -11.460 6.315 -13.897 1.00 0.00 C ATOM 1304 NZ LYS A 85 -11.597 5.478 -15.121 1.00 0.00 N ATOM 0 H LYS A 85 -8.524 3.403 -10.967 1.00 0.00 H new ATOM 0 HA LYS A 85 -11.129 2.349 -11.507 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -9.146 3.571 -13.456 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -10.891 3.517 -13.606 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.109 5.027 -11.647 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -9.364 5.076 -11.489 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -9.816 7.024 -12.710 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -9.356 5.889 -13.964 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -12.263 6.074 -13.201 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -11.572 7.366 -14.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.810 6.088 -15.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -10.708 4.967 -15.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -12.369 4.794 -14.989 1.00 0.00 H new ATOM 1318 N LYS A 86 -8.503 0.823 -12.732 1.00 0.00 N ATOM 1319 CA LYS A 86 -8.052 -0.388 -13.407 1.00 0.00 C ATOM 1320 C LYS A 86 -8.413 -1.629 -12.597 1.00 0.00 C ATOM 1321 O LYS A 86 -8.689 -2.690 -13.158 1.00 0.00 O ATOM 1322 CB LYS A 86 -6.540 -0.337 -13.635 1.00 0.00 C ATOM 1323 CG LYS A 86 -6.117 0.675 -14.686 1.00 0.00 C ATOM 1324 CD LYS A 86 -5.737 2.006 -14.058 1.00 0.00 C ATOM 1325 CE LYS A 86 -6.073 3.171 -14.976 1.00 0.00 C ATOM 1326 NZ LYS A 86 -5.112 3.279 -16.108 1.00 0.00 N ATOM 0 H LYS A 86 -7.752 1.388 -12.335 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.557 -0.445 -14.371 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -6.047 -0.098 -12.693 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.193 -1.326 -13.934 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.271 0.283 -15.250 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -6.931 0.826 -15.396 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -6.262 2.125 -13.110 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -4.670 2.013 -13.835 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -7.083 3.046 -15.367 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -6.066 4.099 -14.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -5.375 4.085 -16.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -4.152 3.424 -15.736 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -5.137 2.404 -16.669 1.00 0.00 H new ATOM 1340 N LEU A 87 -8.411 -1.489 -11.276 1.00 0.00 N ATOM 1341 CA LEU A 87 -8.741 -2.599 -10.388 1.00 0.00 C ATOM 1342 C LEU A 87 -10.239 -2.883 -10.405 1.00 0.00 C ATOM 1343 O LEU A 87 -10.662 -4.039 -10.401 1.00 0.00 O ATOM 1344 CB LEU A 87 -8.285 -2.289 -8.962 1.00 0.00 C ATOM 1345 CG LEU A 87 -6.924 -1.604 -8.826 1.00 0.00 C ATOM 1346 CD1 LEU A 87 -6.756 -1.022 -7.430 1.00 0.00 C ATOM 1347 CD2 LEU A 87 -5.801 -2.583 -9.136 1.00 0.00 C ATOM 0 H LEU A 87 -8.185 -0.618 -10.796 1.00 0.00 H new ATOM 0 HA LEU A 87 -8.218 -3.486 -10.745 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.037 -1.656 -8.491 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -8.257 -3.222 -8.400 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.876 -0.787 -9.546 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -5.782 -0.539 -7.352 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -7.541 -0.289 -7.245 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.825 -1.821 -6.692 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.840 -2.079 -9.034 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.846 -3.421 -8.440 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.911 -2.952 -10.156 1.00 0.00 H new ATOM 1359 N ASP A 88 -11.037 -1.821 -10.426 1.00 0.00 N ATOM 1360 CA ASP A 88 -12.489 -1.956 -10.447 1.00 0.00 C ATOM 1361 C ASP A 88 -13.115 -0.951 -11.409 1.00 0.00 C ATOM 1362 O ASP A 88 -13.205 0.243 -11.124 1.00 0.00 O ATOM 1363 CB ASP A 88 -13.061 -1.761 -9.042 1.00 0.00 C ATOM 1364 CG ASP A 88 -14.572 -1.880 -9.010 1.00 0.00 C ATOM 1365 OD1 ASP A 88 -15.237 -1.218 -9.835 1.00 0.00 O ATOM 1366 OD2 ASP A 88 -15.091 -2.635 -8.161 1.00 0.00 O ATOM 0 H ASP A 88 -10.703 -0.857 -10.429 1.00 0.00 H new ATOM 0 HA ASP A 88 -12.731 -2.961 -10.793 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -12.627 -2.502 -8.370 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -12.769 -0.780 -8.667 1.00 0.00 H new ATOM 1371 N PRO A 89 -13.556 -1.444 -12.576 1.00 0.00 N ATOM 1372 CA PRO A 89 -14.181 -0.605 -13.603 1.00 0.00 C ATOM 1373 C PRO A 89 -15.557 -0.101 -13.183 1.00 0.00 C ATOM 1374 O PRO A 89 -15.952 1.013 -13.524 1.00 0.00 O ATOM 1375 CB PRO A 89 -14.300 -1.546 -14.805 1.00 0.00 C ATOM 1376 CG PRO A 89 -14.342 -2.913 -14.213 1.00 0.00 C ATOM 1377 CD PRO A 89 -13.481 -2.857 -12.981 1.00 0.00 C ATOM 0 HA PRO A 89 -13.599 0.294 -13.804 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -15.200 -1.337 -15.384 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -13.453 -1.433 -15.481 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -15.364 -3.199 -13.963 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -13.967 -3.655 -14.918 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -13.854 -3.519 -12.200 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -12.456 -3.160 -13.193 1.00 0.00 H new ATOM 1385 N GLY A 90 -16.284 -0.930 -12.439 1.00 0.00 N ATOM 1386 CA GLY A 90 -17.609 -0.549 -11.984 1.00 0.00 C ATOM 1387 C GLY A 90 -17.566 0.448 -10.844 1.00 0.00 C ATOM 1388 O GLY A 90 -18.227 0.262 -9.823 1.00 0.00 O ATOM 0 H GLY A 90 -15.979 -1.858 -12.144 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -18.166 -0.120 -12.817 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -18.150 -1.440 -11.664 1.00 0.00 H new ATOM 1392 N TRP A 91 -16.785 1.509 -11.017 1.00 0.00 N ATOM 1393 CA TRP A 91 -16.658 2.539 -9.992 1.00 0.00 C ATOM 1394 C TRP A 91 -17.293 3.846 -10.453 1.00 0.00 C ATOM 1395 O TRP A 91 -16.935 4.386 -11.499 1.00 0.00 O ATOM 1396 CB TRP A 91 -15.184 2.766 -9.649 1.00 0.00 C ATOM 1397 CG TRP A 91 -14.964 3.906 -8.701 1.00 0.00 C ATOM 1398 CD1 TRP A 91 -15.705 4.205 -7.594 1.00 0.00 C ATOM 1399 CD2 TRP A 91 -13.936 4.899 -8.779 1.00 0.00 C ATOM 1400 NE1 TRP A 91 -15.199 5.324 -6.978 1.00 0.00 N ATOM 1401 CE2 TRP A 91 -14.113 5.769 -7.685 1.00 0.00 C ATOM 1402 CE3 TRP A 91 -12.882 5.137 -9.665 1.00 0.00 C ATOM 1403 CZ2 TRP A 91 -13.275 6.857 -7.457 1.00 0.00 C ATOM 1404 CZ3 TRP A 91 -12.052 6.218 -9.437 1.00 0.00 C ATOM 1405 CH2 TRP A 91 -12.251 7.067 -8.340 1.00 0.00 C ATOM 0 H TRP A 91 -16.231 1.678 -11.856 1.00 0.00 H new ATOM 0 HA TRP A 91 -17.183 2.197 -9.100 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -14.776 1.855 -9.212 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -14.629 2.955 -10.568 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -16.563 3.644 -7.253 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -15.572 5.754 -6.131 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -12.719 4.488 -10.513 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -13.428 7.513 -6.612 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -11.235 6.412 -10.116 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -11.584 7.903 -8.189 1.00 0.00 H new ATOM 1416 N ASN A 92 -18.237 4.350 -9.665 1.00 0.00 N ATOM 1417 CA ASN A 92 -18.922 5.595 -9.993 1.00 0.00 C ATOM 1418 C ASN A 92 -18.854 6.577 -8.827 1.00 0.00 C ATOM 1419 O ASN A 92 -19.675 6.549 -7.910 1.00 0.00 O ATOM 1420 CB ASN A 92 -20.382 5.318 -10.356 1.00 0.00 C ATOM 1421 CG ASN A 92 -20.994 4.228 -9.497 1.00 0.00 C ATOM 1422 OD1 ASN A 92 -21.938 4.471 -8.745 1.00 0.00 O ATOM 1423 ND2 ASN A 92 -20.457 3.018 -9.607 1.00 0.00 N ATOM 0 H ASN A 92 -18.545 3.916 -8.795 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.420 6.042 -10.851 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -20.962 6.234 -10.243 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -20.444 5.028 -11.405 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -20.826 2.244 -9.055 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -19.675 2.863 -10.244 1.00 0.00 H new ATOM 1430 N PRO A 93 -17.851 7.468 -8.862 1.00 0.00 N ATOM 1431 CA PRO A 93 -17.652 8.477 -7.817 1.00 0.00 C ATOM 1432 C PRO A 93 -18.736 9.549 -7.832 1.00 0.00 C ATOM 1433 O PRO A 93 -19.056 10.135 -6.799 1.00 0.00 O ATOM 1434 CB PRO A 93 -16.292 9.086 -8.167 1.00 0.00 C ATOM 1435 CG PRO A 93 -16.142 8.861 -9.632 1.00 0.00 C ATOM 1436 CD PRO A 93 -16.836 7.560 -9.925 1.00 0.00 C ATOM 0 HA PRO A 93 -17.696 8.043 -6.818 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -16.260 10.148 -7.924 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -15.488 8.607 -7.608 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -16.588 9.678 -10.200 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -15.090 8.814 -9.914 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -17.291 7.561 -10.916 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -16.143 6.719 -9.893 1.00 0.00 H new ATOM 1444 N GLN A 94 -19.298 9.800 -9.011 1.00 0.00 N ATOM 1445 CA GLN A 94 -20.346 10.802 -9.159 1.00 0.00 C ATOM 1446 C GLN A 94 -21.499 10.264 -10.000 1.00 0.00 C ATOM 1447 O GLN A 94 -21.297 9.804 -11.125 1.00 0.00 O ATOM 1448 CB GLN A 94 -19.781 12.071 -9.799 1.00 0.00 C ATOM 1449 CG GLN A 94 -19.049 12.973 -8.818 1.00 0.00 C ATOM 1450 CD GLN A 94 -18.062 13.898 -9.502 1.00 0.00 C ATOM 1451 OE1 GLN A 94 -18.226 15.119 -9.489 1.00 0.00 O ATOM 1452 NE2 GLN A 94 -17.028 13.322 -10.103 1.00 0.00 N ATOM 0 H GLN A 94 -19.045 9.323 -9.876 1.00 0.00 H new ATOM 0 HA GLN A 94 -20.726 11.043 -8.166 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -19.098 11.790 -10.601 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -20.596 12.631 -10.256 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -19.776 13.568 -8.265 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -18.520 12.358 -8.090 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -16.931 12.307 -10.089 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -16.331 13.895 -10.578 1.00 0.00 H new ATOM 1461 N ILE A 95 -22.706 10.325 -9.449 1.00 0.00 N ATOM 1462 CA ILE A 95 -23.891 9.844 -10.150 1.00 0.00 C ATOM 1463 C ILE A 95 -24.838 10.993 -10.479 1.00 0.00 C ATOM 1464 O ILE A 95 -25.129 11.849 -9.645 1.00 0.00 O ATOM 1465 CB ILE A 95 -24.648 8.791 -9.319 1.00 0.00 C ATOM 1466 CG1 ILE A 95 -23.796 7.531 -9.155 1.00 0.00 C ATOM 1467 CG2 ILE A 95 -25.979 8.457 -9.975 1.00 0.00 C ATOM 1468 CD1 ILE A 95 -22.731 7.655 -8.089 1.00 0.00 C ATOM 0 H ILE A 95 -22.890 10.703 -8.519 1.00 0.00 H new ATOM 0 HA ILE A 95 -23.546 9.384 -11.076 1.00 0.00 H new ATOM 0 HB ILE A 95 -24.847 9.203 -8.330 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -24.447 6.692 -8.910 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -23.320 7.298 -10.107 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -26.503 7.712 -9.377 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -26.587 9.359 -10.044 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -25.802 8.061 -10.975 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -22.166 6.725 -8.029 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -22.056 8.473 -8.342 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -23.201 7.857 -7.127 1.00 0.00 H new ATOM 1480 N PRO A 96 -25.333 11.012 -11.726 1.00 0.00 N ATOM 1481 CA PRO A 96 -26.257 12.049 -12.195 1.00 0.00 C ATOM 1482 C PRO A 96 -27.632 11.936 -11.545 1.00 0.00 C ATOM 1483 O PRO A 96 -28.208 12.934 -11.113 1.00 0.00 O ATOM 1484 CB PRO A 96 -26.353 11.784 -13.699 1.00 0.00 C ATOM 1485 CG PRO A 96 -26.029 10.338 -13.851 1.00 0.00 C ATOM 1486 CD PRO A 96 -25.029 10.023 -12.774 1.00 0.00 C ATOM 0 HA PRO A 96 -25.906 13.051 -11.947 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -27.350 12.008 -14.077 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -25.653 12.407 -14.256 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -26.924 9.724 -13.745 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -25.617 10.132 -14.839 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -25.141 9.002 -12.408 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -24.005 10.122 -13.135 1.00 0.00 H new ATOM 1494 N GLU A 97 -28.153 10.714 -11.480 1.00 0.00 N ATOM 1495 CA GLU A 97 -29.461 10.473 -10.883 1.00 0.00 C ATOM 1496 C GLU A 97 -29.566 11.140 -9.514 1.00 0.00 C ATOM 1497 O GLU A 97 -28.580 11.650 -8.982 1.00 0.00 O ATOM 1498 CB GLU A 97 -29.716 8.970 -10.751 1.00 0.00 C ATOM 1499 CG GLU A 97 -31.187 8.612 -10.620 1.00 0.00 C ATOM 1500 CD GLU A 97 -31.501 7.230 -11.158 1.00 0.00 C ATOM 1501 OE1 GLU A 97 -31.386 7.030 -12.385 1.00 0.00 O ATOM 1502 OE2 GLU A 97 -31.863 6.347 -10.352 1.00 0.00 O ATOM 0 H GLU A 97 -27.689 9.877 -11.833 1.00 0.00 H new ATOM 0 HA GLU A 97 -30.217 10.907 -11.538 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -29.303 8.462 -11.623 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -29.180 8.594 -9.879 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -31.478 8.664 -9.571 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -31.786 9.350 -11.154 1.00 0.00 H new ATOM 1509 N LYS A 98 -30.769 11.132 -8.949 1.00 0.00 N ATOM 1510 CA LYS A 98 -31.005 11.734 -7.643 1.00 0.00 C ATOM 1511 C LYS A 98 -31.712 10.754 -6.712 1.00 0.00 C ATOM 1512 O LYS A 98 -32.731 10.165 -7.071 1.00 0.00 O ATOM 1513 CB LYS A 98 -31.841 13.008 -7.790 1.00 0.00 C ATOM 1514 CG LYS A 98 -31.575 14.038 -6.705 1.00 0.00 C ATOM 1515 CD LYS A 98 -32.067 15.416 -7.112 1.00 0.00 C ATOM 1516 CE LYS A 98 -33.586 15.481 -7.139 1.00 0.00 C ATOM 1517 NZ LYS A 98 -34.175 15.251 -5.790 1.00 0.00 N ATOM 0 H LYS A 98 -31.596 10.715 -9.376 1.00 0.00 H new ATOM 0 HA LYS A 98 -30.039 11.989 -7.208 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -31.637 13.456 -8.763 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -32.898 12.743 -7.776 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -32.069 13.732 -5.783 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -30.506 14.079 -6.496 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -31.682 16.161 -6.415 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -31.674 15.667 -8.097 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -33.901 16.456 -7.512 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -33.969 14.735 -7.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -35.151 15.611 -5.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -34.178 14.232 -5.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -33.608 15.749 -5.074 1.00 0.00 H new ATOM 1531 N LYS A 99 -31.165 10.586 -5.513 1.00 0.00 N ATOM 1532 CA LYS A 99 -31.744 9.680 -4.528 1.00 0.00 C ATOM 1533 C LYS A 99 -31.646 10.268 -3.124 1.00 0.00 C ATOM 1534 O LYS A 99 -30.555 10.555 -2.635 1.00 0.00 O ATOM 1535 CB LYS A 99 -31.037 8.323 -4.574 1.00 0.00 C ATOM 1536 CG LYS A 99 -31.316 7.535 -5.842 1.00 0.00 C ATOM 1537 CD LYS A 99 -30.172 6.592 -6.176 1.00 0.00 C ATOM 1538 CE LYS A 99 -29.041 7.318 -6.888 1.00 0.00 C ATOM 1539 NZ LYS A 99 -28.126 6.372 -7.584 1.00 0.00 N ATOM 0 H LYS A 99 -30.321 11.066 -5.200 1.00 0.00 H new ATOM 0 HA LYS A 99 -32.797 9.543 -4.773 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -29.962 8.479 -4.482 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -31.348 7.731 -3.713 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -32.236 6.963 -5.721 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -31.475 8.224 -6.672 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -29.794 6.138 -5.260 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -30.539 5.782 -6.806 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -29.458 8.019 -7.612 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -28.475 7.905 -6.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -27.154 6.741 -7.551 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -28.160 5.446 -7.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -28.423 6.267 -8.575 1.00 0.00 H new ATOM 1553 N GLY A 100 -32.796 10.443 -2.479 1.00 0.00 N ATOM 1554 CA GLY A 100 -32.817 10.995 -1.137 1.00 0.00 C ATOM 1555 C GLY A 100 -32.545 9.948 -0.075 1.00 0.00 C ATOM 1556 O GLY A 100 -31.410 9.501 0.091 1.00 0.00 O ATOM 0 H GLY A 100 -33.713 10.212 -2.862 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -32.072 11.787 -1.061 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -33.789 11.453 -0.951 1.00 0.00 H new ATOM 1560 N LYS A 101 -33.589 9.555 0.647 1.00 0.00 N ATOM 1561 CA LYS A 101 -33.458 8.554 1.699 1.00 0.00 C ATOM 1562 C LYS A 101 -32.692 7.334 1.198 1.00 0.00 C ATOM 1563 O LYS A 101 -33.063 6.727 0.194 1.00 0.00 O ATOM 1564 CB LYS A 101 -34.840 8.130 2.203 1.00 0.00 C ATOM 1565 CG LYS A 101 -34.839 7.638 3.640 1.00 0.00 C ATOM 1566 CD LYS A 101 -35.974 6.660 3.895 1.00 0.00 C ATOM 1567 CE LYS A 101 -37.276 7.386 4.200 1.00 0.00 C ATOM 1568 NZ LYS A 101 -37.238 8.059 5.528 1.00 0.00 N ATOM 0 H LYS A 101 -34.535 9.915 0.523 1.00 0.00 H new ATOM 0 HA LYS A 101 -32.898 8.999 2.522 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -35.523 8.975 2.118 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -35.226 7.341 1.558 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -33.886 7.157 3.860 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -34.931 8.488 4.317 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -36.108 6.021 3.022 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -35.715 6.009 4.730 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -37.470 8.126 3.423 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -38.102 6.675 4.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -38.209 8.245 5.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -36.756 7.444 6.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -36.722 8.958 5.447 1.00 0.00 H new ATOM 1582 N GLU A 102 -31.623 6.980 1.904 1.00 0.00 N ATOM 1583 CA GLU A 102 -30.806 5.832 1.530 1.00 0.00 C ATOM 1584 C GLU A 102 -30.984 4.690 2.526 1.00 0.00 C ATOM 1585 O GLU A 102 -31.596 4.861 3.579 1.00 0.00 O ATOM 1586 CB GLU A 102 -29.331 6.231 1.453 1.00 0.00 C ATOM 1587 CG GLU A 102 -28.779 6.776 2.759 1.00 0.00 C ATOM 1588 CD GLU A 102 -27.274 6.622 2.866 1.00 0.00 C ATOM 1589 OE1 GLU A 102 -26.761 5.540 2.512 1.00 0.00 O ATOM 1590 OE2 GLU A 102 -26.609 7.584 3.305 1.00 0.00 O ATOM 0 H GLU A 102 -31.303 7.472 2.738 1.00 0.00 H new ATOM 0 HA GLU A 102 -31.134 5.489 0.549 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -28.744 5.363 1.154 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -29.207 6.983 0.674 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -29.040 7.831 2.847 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -29.254 6.259 3.593 1.00 0.00 H new ATOM 1597 N ALA A 103 -30.445 3.524 2.182 1.00 0.00 N ATOM 1598 CA ALA A 103 -30.542 2.354 3.046 1.00 0.00 C ATOM 1599 C ALA A 103 -29.306 2.218 3.929 1.00 0.00 C ATOM 1600 O ALA A 103 -28.258 2.794 3.638 1.00 0.00 O ATOM 1601 CB ALA A 103 -30.737 1.097 2.211 1.00 0.00 C ATOM 0 H ALA A 103 -29.937 3.365 1.312 1.00 0.00 H new ATOM 0 HA ALA A 103 -31.407 2.484 3.696 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -30.808 0.231 2.869 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -31.654 1.186 1.628 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -29.889 0.973 1.537 1.00 0.00 H new ATOM 1607 N SER A 104 -29.437 1.454 5.008 1.00 0.00 N ATOM 1608 CA SER A 104 -28.331 1.247 5.936 1.00 0.00 C ATOM 1609 C SER A 104 -27.801 -0.180 5.840 1.00 0.00 C ATOM 1610 O SER A 104 -26.592 -0.407 5.842 1.00 0.00 O ATOM 1611 CB SER A 104 -28.779 1.541 7.370 1.00 0.00 C ATOM 1612 OG SER A 104 -29.561 0.479 7.888 1.00 0.00 O ATOM 0 H SER A 104 -30.297 0.968 5.262 1.00 0.00 H new ATOM 0 HA SER A 104 -27.529 1.933 5.665 1.00 0.00 H new ATOM 0 HB2 SER A 104 -27.905 1.695 8.003 1.00 0.00 H new ATOM 0 HB3 SER A 104 -29.356 2.466 7.392 1.00 0.00 H new ATOM 0 HG SER A 104 -29.833 0.690 8.805 1.00 0.00 H new ATOM 1618 N GLY A 105 -28.717 -1.141 5.754 1.00 0.00 N ATOM 1619 CA GLY A 105 -28.323 -2.534 5.658 1.00 0.00 C ATOM 1620 C GLY A 105 -28.614 -3.308 6.928 1.00 0.00 C ATOM 1621 O GLY A 105 -28.530 -2.778 8.037 1.00 0.00 O ATOM 0 H GLY A 105 -29.724 -0.979 5.749 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -28.848 -3.000 4.824 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -27.257 -2.592 5.437 1.00 0.00 H new ATOM 1625 N PRO A 106 -28.969 -4.592 6.775 1.00 0.00 N ATOM 1626 CA PRO A 106 -29.282 -5.468 7.909 1.00 0.00 C ATOM 1627 C PRO A 106 -28.048 -5.805 8.739 1.00 0.00 C ATOM 1628 O PRO A 106 -27.107 -6.426 8.246 1.00 0.00 O ATOM 1629 CB PRO A 106 -29.838 -6.728 7.241 1.00 0.00 C ATOM 1630 CG PRO A 106 -29.233 -6.733 5.880 1.00 0.00 C ATOM 1631 CD PRO A 106 -29.090 -5.290 5.484 1.00 0.00 C ATOM 0 HA PRO A 106 -29.975 -4.999 8.608 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -29.566 -7.624 7.798 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -30.927 -6.702 7.190 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -28.265 -7.234 5.885 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -29.866 -7.270 5.174 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -28.213 -5.130 4.857 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -29.954 -4.941 4.918 1.00 0.00 H new ATOM 1639 N SER A 107 -28.060 -5.392 10.003 1.00 0.00 N ATOM 1640 CA SER A 107 -26.940 -5.648 10.901 1.00 0.00 C ATOM 1641 C SER A 107 -26.405 -7.064 10.712 1.00 0.00 C ATOM 1642 O SER A 107 -25.223 -7.261 10.429 1.00 0.00 O ATOM 1643 CB SER A 107 -27.368 -5.442 12.355 1.00 0.00 C ATOM 1644 OG SER A 107 -28.535 -6.187 12.654 1.00 0.00 O ATOM 0 H SER A 107 -28.833 -4.879 10.428 1.00 0.00 H new ATOM 0 HA SER A 107 -26.144 -4.943 10.660 1.00 0.00 H new ATOM 0 HB2 SER A 107 -26.560 -5.744 13.021 1.00 0.00 H new ATOM 0 HB3 SER A 107 -27.552 -4.383 12.536 1.00 0.00 H new ATOM 0 HG SER A 107 -28.787 -6.039 13.590 1.00 0.00 H new ATOM 1650 N SER A 108 -27.285 -8.048 10.871 1.00 0.00 N ATOM 1651 CA SER A 108 -26.901 -9.447 10.723 1.00 0.00 C ATOM 1652 C SER A 108 -28.129 -10.327 10.508 1.00 0.00 C ATOM 1653 O SER A 108 -29.102 -10.249 11.257 1.00 0.00 O ATOM 1654 CB SER A 108 -26.130 -9.921 11.956 1.00 0.00 C ATOM 1655 OG SER A 108 -25.838 -11.305 11.875 1.00 0.00 O ATOM 0 H SER A 108 -28.268 -7.902 11.102 1.00 0.00 H new ATOM 0 HA SER A 108 -26.257 -9.530 9.848 1.00 0.00 H new ATOM 0 HB2 SER A 108 -25.203 -9.356 12.048 1.00 0.00 H new ATOM 0 HB3 SER A 108 -26.716 -9.722 12.854 1.00 0.00 H new ATOM 0 HG SER A 108 -25.343 -11.582 12.674 1.00 0.00 H new ATOM 1661 N GLY A 109 -28.076 -11.166 9.477 1.00 0.00 N ATOM 1662 CA GLY A 109 -29.189 -12.048 9.181 1.00 0.00 C ATOM 1663 C GLY A 109 -28.750 -13.483 8.964 1.00 0.00 C ATOM 1664 O GLY A 109 -28.907 -14.029 7.873 1.00 0.00 O ATOM 0 H GLY A 109 -27.282 -11.250 8.842 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -29.906 -12.011 10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -29.705 -11.690 8.290 1.00 0.00 H new TER 1668 GLY A 109