USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 765 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 122 SER OG : rot -118:sc= 0.226 USER MOD Set 1.2: A 125 LYS NZ :NH3+ -104:sc= 0.0958 (180deg=0) USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -0.466 K(o=-0.47,f=-4.1!) USER MOD Single : A 105 CYS SG : rot 180:sc= -3.43! USER MOD Single : A 107 ASN : amide:sc= -4.94! C(o=-4.9!,f=-4.5!) USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= -0.907 (180deg=-0.907) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc=-0.00409 USER MOD Single : A 144 SER OG : rot -128:sc= 0.308 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 ASN : amide:sc= -1.58! K(o=-1.6!,f=-0.059) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= -2.59 K(o=-2.6,f=-11!) USER MOD Single : A 157 SER OG : rot 180:sc= 0.00352 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 122:sc= 1.07 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc=-0.00772 X(o=-0.0077,f=0) USER MOD Single : A 181 GLN : amide:sc= -2.47 K(o=-2.5,f=-3.6!) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 89 9.353 11.069 12.046 1.00 1.92 N ATOM 2 CA ALA A 89 9.132 11.641 10.682 1.00 1.43 C ATOM 3 C ALA A 89 8.113 10.789 9.925 1.00 1.08 C ATOM 4 O ALA A 89 6.969 11.170 9.762 1.00 1.13 O ATOM 5 CB ALA A 89 10.501 11.588 9.997 1.00 1.90 C ATOM 0 HA ALA A 89 8.741 12.658 10.714 1.00 1.43 H new ATOM 0 HB1 ALA A 89 10.419 11.992 8.988 1.00 1.90 H new ATOM 0 HB2 ALA A 89 11.217 12.180 10.568 1.00 1.90 H new ATOM 0 HB3 ALA A 89 10.843 10.554 9.947 1.00 1.90 H new ATOM 11 N ALA A 90 8.518 9.627 9.486 1.00 0.96 N ATOM 12 CA ALA A 90 7.576 8.721 8.760 1.00 0.72 C ATOM 13 C ALA A 90 6.502 8.264 9.746 1.00 0.58 C ATOM 14 O ALA A 90 6.510 8.708 10.875 1.00 1.23 O ATOM 15 CB ALA A 90 8.443 7.547 8.295 1.00 1.03 C ATOM 0 H ALA A 90 9.464 9.264 9.599 1.00 0.96 H new ATOM 0 HA ALA A 90 7.072 9.190 7.915 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.826 6.832 7.751 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.234 7.915 7.641 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.887 7.057 9.161 1.00 1.03 H new ATOM 21 N PRO A 91 5.603 7.400 9.320 1.00 0.79 N ATOM 22 CA PRO A 91 4.543 6.938 10.247 1.00 1.10 C ATOM 23 C PRO A 91 5.186 6.170 11.412 1.00 0.60 C ATOM 24 O PRO A 91 5.702 5.089 11.219 1.00 0.91 O ATOM 25 CB PRO A 91 3.664 6.039 9.378 1.00 1.98 C ATOM 26 CG PRO A 91 4.556 5.605 8.265 1.00 2.18 C ATOM 27 CD PRO A 91 5.474 6.767 7.995 1.00 1.62 C ATOM 0 HA PRO A 91 3.964 7.743 10.699 1.00 1.10 H new ATOM 0 HB2 PRO A 91 3.290 5.185 9.942 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.794 6.578 9.002 1.00 1.98 H new ATOM 0 HG2 PRO A 91 5.122 4.716 8.542 1.00 2.18 H new ATOM 0 HG3 PRO A 91 3.977 5.350 7.377 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.439 6.438 7.609 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.053 7.452 7.259 1.00 1.62 H new ATOM 35 N PRO A 92 5.156 6.758 12.591 1.00 0.59 N ATOM 36 CA PRO A 92 5.771 6.099 13.769 1.00 0.84 C ATOM 37 C PRO A 92 5.046 4.788 14.088 1.00 0.71 C ATOM 38 O PRO A 92 5.666 3.803 14.445 1.00 0.83 O ATOM 39 CB PRO A 92 5.614 7.131 14.887 1.00 1.49 C ATOM 40 CG PRO A 92 4.471 7.986 14.452 1.00 1.64 C ATOM 41 CD PRO A 92 4.555 8.054 12.951 1.00 1.21 C ATOM 0 HA PRO A 92 6.814 5.822 13.616 1.00 0.84 H new ATOM 0 HB2 PRO A 92 5.408 6.651 15.844 1.00 1.49 H new ATOM 0 HB3 PRO A 92 6.523 7.719 15.014 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.520 7.559 14.771 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.538 8.981 14.892 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.572 8.182 12.498 1.00 1.21 H new ATOM 0 HD3 PRO A 92 5.171 8.890 12.619 1.00 1.21 H new ATOM 49 N GLY A 93 3.744 4.764 13.949 1.00 0.65 N ATOM 50 CA GLY A 93 2.987 3.506 14.230 1.00 0.71 C ATOM 51 C GLY A 93 2.969 2.589 13.004 1.00 0.58 C ATOM 52 O GLY A 93 1.919 2.163 12.561 1.00 0.58 O ATOM 0 H GLY A 93 3.175 5.557 13.654 1.00 0.65 H new ATOM 0 HA2 GLY A 93 3.442 2.984 15.072 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.965 3.750 14.521 1.00 0.71 H new ATOM 56 N GLU A 94 4.116 2.266 12.466 1.00 0.56 N ATOM 57 CA GLU A 94 4.156 1.354 11.280 1.00 0.55 C ATOM 58 C GLU A 94 3.639 -0.034 11.656 1.00 0.49 C ATOM 59 O GLU A 94 3.265 -0.806 10.801 1.00 0.53 O ATOM 60 CB GLU A 94 5.629 1.275 10.866 1.00 0.66 C ATOM 61 CG GLU A 94 5.890 2.230 9.697 1.00 1.09 C ATOM 62 CD GLU A 94 7.365 2.159 9.272 1.00 1.10 C ATOM 63 OE1 GLU A 94 8.163 1.617 10.023 1.00 1.62 O ATOM 64 OE2 GLU A 94 7.670 2.646 8.196 1.00 1.44 O ATOM 0 H GLU A 94 5.025 2.592 12.794 1.00 0.56 H new ATOM 0 HA GLU A 94 3.527 1.724 10.470 1.00 0.55 H new ATOM 0 HB2 GLU A 94 6.268 1.535 11.710 1.00 0.66 H new ATOM 0 HB3 GLU A 94 5.881 0.255 10.578 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.249 1.969 8.855 1.00 1.09 H new ATOM 0 HG3 GLU A 94 5.636 3.250 9.987 1.00 1.09 H new ATOM 71 N ALA A 95 3.626 -0.368 12.922 1.00 0.49 N ATOM 72 CA ALA A 95 3.147 -1.725 13.323 1.00 0.50 C ATOM 73 C ALA A 95 1.697 -1.949 12.889 1.00 0.38 C ATOM 74 O ALA A 95 1.391 -2.936 12.246 1.00 0.36 O ATOM 75 CB ALA A 95 3.261 -1.762 14.848 1.00 0.61 C ATOM 0 H ALA A 95 3.924 0.235 13.689 1.00 0.49 H new ATOM 0 HA ALA A 95 3.735 -2.511 12.849 1.00 0.50 H new ATOM 0 HB1 ALA A 95 2.925 -2.732 15.215 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.299 -1.604 15.139 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.640 -0.977 15.278 1.00 0.61 H new ATOM 81 N TYR A 96 0.804 -1.047 13.218 1.00 0.38 N ATOM 82 CA TYR A 96 -0.619 -1.231 12.798 1.00 0.35 C ATOM 83 C TYR A 96 -0.705 -1.217 11.276 1.00 0.28 C ATOM 84 O TYR A 96 -1.287 -2.092 10.661 1.00 0.29 O ATOM 85 CB TYR A 96 -1.389 -0.059 13.412 1.00 0.42 C ATOM 86 CG TYR A 96 -2.872 -0.242 13.173 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.505 -1.430 13.563 1.00 1.54 C ATOM 88 CD2 TYR A 96 -3.613 0.777 12.563 1.00 1.47 C ATOM 89 CE1 TYR A 96 -4.878 -1.597 13.342 1.00 1.93 C ATOM 90 CE2 TYR A 96 -4.986 0.610 12.342 1.00 1.85 C ATOM 91 CZ TYR A 96 -5.618 -0.577 12.731 1.00 1.77 C ATOM 92 OH TYR A 96 -6.972 -0.742 12.513 1.00 2.32 O ATOM 0 H TYR A 96 0.996 -0.200 13.753 1.00 0.38 H new ATOM 0 HA TYR A 96 -1.034 -2.181 13.133 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.188 0.000 14.482 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -1.053 0.880 12.972 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -2.934 -2.217 14.034 1.00 1.54 H new ATOM 0 HD2 TYR A 96 -3.126 1.693 12.263 1.00 1.47 H new ATOM 0 HE1 TYR A 96 -5.366 -2.512 13.643 1.00 1.93 H new ATOM 0 HE2 TYR A 96 -5.557 1.397 11.872 1.00 1.85 H new ATOM 0 HH TYR A 96 -7.334 0.060 12.081 1.00 2.32 H new ATOM 102 N LEU A 97 -0.115 -0.223 10.671 1.00 0.42 N ATOM 103 CA LEU A 97 -0.133 -0.125 9.186 1.00 0.55 C ATOM 104 C LEU A 97 0.533 -1.348 8.551 1.00 0.43 C ATOM 105 O LEU A 97 0.069 -1.858 7.549 1.00 0.35 O ATOM 106 CB LEU A 97 0.635 1.165 8.854 1.00 0.90 C ATOM 107 CG LEU A 97 0.734 1.395 7.331 1.00 0.94 C ATOM 108 CD1 LEU A 97 1.886 0.565 6.768 1.00 1.33 C ATOM 109 CD2 LEU A 97 -0.579 1.029 6.615 1.00 1.75 C ATOM 0 H LEU A 97 0.382 0.530 11.146 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.149 -0.097 8.792 1.00 0.55 H new ATOM 0 HB2 LEU A 97 0.136 2.015 9.319 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.637 1.112 9.280 1.00 0.90 H new ATOM 0 HG LEU A 97 0.919 2.455 7.157 1.00 0.94 H new ATOM 0 HD11 LEU A 97 1.958 0.725 5.692 1.00 1.33 H new ATOM 0 HD12 LEU A 97 2.819 0.868 7.244 1.00 1.33 H new ATOM 0 HD13 LEU A 97 1.704 -0.491 6.966 1.00 1.33 H new ATOM 0 HD21 LEU A 97 -0.471 1.204 5.545 1.00 1.75 H new ATOM 0 HD22 LEU A 97 -0.808 -0.022 6.789 1.00 1.75 H new ATOM 0 HD23 LEU A 97 -1.389 1.646 7.003 1.00 1.75 H new ATOM 121 N GLN A 98 1.617 -1.823 9.119 1.00 0.47 N ATOM 122 CA GLN A 98 2.306 -3.014 8.530 1.00 0.49 C ATOM 123 C GLN A 98 1.361 -4.210 8.507 1.00 0.38 C ATOM 124 O GLN A 98 1.326 -4.951 7.542 1.00 0.39 O ATOM 125 CB GLN A 98 3.511 -3.291 9.432 1.00 0.63 C ATOM 126 CG GLN A 98 4.670 -2.368 9.044 1.00 0.57 C ATOM 127 CD GLN A 98 5.767 -2.449 10.108 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.504 -2.789 11.245 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.996 -2.154 9.785 1.00 2.04 N ATOM 0 H GLN A 98 2.051 -1.440 9.959 1.00 0.47 H new ATOM 0 HA GLN A 98 2.617 -2.834 7.501 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.240 -3.132 10.476 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.816 -4.333 9.337 1.00 0.63 H new ATOM 0 HG2 GLN A 98 5.070 -2.658 8.072 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.315 -1.342 8.950 1.00 0.57 H new ATOM 0 HE21 GLN A 98 7.218 -1.869 8.831 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.735 -2.209 10.486 1.00 2.04 H new ATOM 138 N VAL A 99 0.575 -4.398 9.541 1.00 0.33 N ATOM 139 CA VAL A 99 -0.382 -5.546 9.536 1.00 0.31 C ATOM 140 C VAL A 99 -1.361 -5.360 8.373 1.00 0.24 C ATOM 141 O VAL A 99 -1.680 -6.295 7.662 1.00 0.30 O ATOM 142 CB VAL A 99 -1.096 -5.488 10.893 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.199 -6.551 10.954 1.00 0.43 C ATOM 144 CG2 VAL A 99 -0.078 -5.744 12.008 1.00 0.43 C ATOM 0 H VAL A 99 0.555 -3.814 10.377 1.00 0.33 H new ATOM 0 HA VAL A 99 0.102 -6.513 9.402 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.546 -4.503 11.021 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.699 -6.501 11.921 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.924 -6.369 10.161 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.759 -7.540 10.824 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.580 -5.704 12.975 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.370 -6.728 11.872 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.701 -4.982 11.972 1.00 0.43 H new ATOM 154 N ALA A 100 -1.806 -4.148 8.160 1.00 0.18 N ATOM 155 CA ALA A 100 -2.730 -3.885 7.021 1.00 0.18 C ATOM 156 C ALA A 100 -1.956 -4.025 5.714 1.00 0.14 C ATOM 157 O ALA A 100 -2.280 -4.851 4.890 1.00 0.14 O ATOM 158 CB ALA A 100 -3.223 -2.452 7.211 1.00 0.24 C ATOM 0 H ALA A 100 -1.569 -3.333 8.725 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.567 -4.582 6.988 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -3.909 -2.193 6.404 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -3.739 -2.369 8.167 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.373 -1.770 7.197 1.00 0.24 H new ATOM 164 N PHE A 101 -0.911 -3.242 5.531 1.00 0.15 N ATOM 165 CA PHE A 101 -0.093 -3.350 4.275 1.00 0.16 C ATOM 166 C PHE A 101 0.316 -4.797 3.986 1.00 0.17 C ATOM 167 O PHE A 101 0.662 -5.109 2.878 1.00 0.20 O ATOM 168 CB PHE A 101 1.171 -2.519 4.545 1.00 0.19 C ATOM 169 CG PHE A 101 1.033 -1.070 4.092 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.222 -0.470 3.865 1.00 1.10 C ATOM 171 CD2 PHE A 101 2.200 -0.314 3.916 1.00 1.21 C ATOM 172 CE1 PHE A 101 -0.293 0.869 3.468 1.00 1.10 C ATOM 173 CE2 PHE A 101 2.123 1.022 3.516 1.00 1.26 C ATOM 174 CZ PHE A 101 0.879 1.613 3.296 1.00 0.43 C ATOM 0 H PHE A 101 -0.592 -2.536 6.195 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.664 -3.002 3.414 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.394 -2.542 5.612 1.00 0.19 H new ATOM 0 HB3 PHE A 101 2.017 -2.976 4.032 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.127 -1.044 3.997 1.00 1.10 H new ATOM 0 HD2 PHE A 101 3.165 -0.767 4.091 1.00 1.21 H new ATOM 0 HE1 PHE A 101 -1.254 1.329 3.294 1.00 1.10 H new ATOM 0 HE2 PHE A 101 3.026 1.597 3.377 1.00 1.26 H new ATOM 0 HZ PHE A 101 0.820 2.648 2.992 1.00 0.43 H new ATOM 184 N ASP A 102 0.300 -5.677 4.954 1.00 0.18 N ATOM 185 CA ASP A 102 0.717 -7.081 4.667 1.00 0.21 C ATOM 186 C ASP A 102 -0.446 -7.892 4.110 1.00 0.20 C ATOM 187 O ASP A 102 -0.324 -8.524 3.076 1.00 0.22 O ATOM 188 CB ASP A 102 1.161 -7.644 6.004 1.00 0.25 C ATOM 189 CG ASP A 102 2.030 -8.883 5.777 1.00 0.32 C ATOM 190 OD1 ASP A 102 1.689 -9.671 4.911 1.00 1.13 O ATOM 191 OD2 ASP A 102 3.019 -9.024 6.477 1.00 1.01 O ATOM 0 H ASP A 102 0.021 -5.488 5.917 1.00 0.18 H new ATOM 0 HA ASP A 102 1.509 -7.120 3.919 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.721 -6.891 6.559 1.00 0.25 H new ATOM 0 HB3 ASP A 102 0.291 -7.903 6.608 1.00 0.25 H new ATOM 196 N ILE A 103 -1.573 -7.888 4.783 1.00 0.18 N ATOM 197 CA ILE A 103 -2.730 -8.675 4.272 1.00 0.18 C ATOM 198 C ILE A 103 -3.172 -8.122 2.925 1.00 0.17 C ATOM 199 O ILE A 103 -3.474 -8.860 2.002 1.00 0.18 O ATOM 200 CB ILE A 103 -3.854 -8.533 5.317 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.228 -7.054 5.547 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.408 -9.156 6.636 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.380 -6.956 6.559 1.00 0.87 C ATOM 0 H ILE A 103 -1.736 -7.380 5.652 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.471 -9.724 4.127 1.00 0.18 H new ATOM 0 HB ILE A 103 -4.735 -9.051 4.937 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.362 -6.504 5.915 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.521 -6.593 4.604 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.204 -9.055 7.374 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.187 -10.212 6.483 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.514 -8.647 6.995 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -5.638 -5.909 6.716 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.249 -7.490 6.174 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.071 -7.399 7.506 1.00 0.87 H new ATOM 215 N VAL A 104 -3.208 -6.827 2.809 1.00 0.16 N ATOM 216 CA VAL A 104 -3.644 -6.211 1.528 1.00 0.16 C ATOM 217 C VAL A 104 -2.597 -6.439 0.431 1.00 0.17 C ATOM 218 O VAL A 104 -2.930 -6.718 -0.705 1.00 0.18 O ATOM 219 CB VAL A 104 -3.833 -4.718 1.832 1.00 0.16 C ATOM 220 CG1 VAL A 104 -4.804 -4.533 3.004 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.488 -4.064 2.164 1.00 0.14 C ATOM 0 H VAL A 104 -2.955 -6.168 3.545 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.567 -6.654 1.155 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.249 -4.238 0.946 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -4.929 -3.470 3.209 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -5.770 -4.969 2.749 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.405 -5.028 3.889 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.641 -3.006 2.377 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.052 -4.551 3.037 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.813 -4.170 1.315 1.00 0.14 H new ATOM 231 N CYS A 105 -1.335 -6.318 0.767 1.00 0.18 N ATOM 232 CA CYS A 105 -0.263 -6.525 -0.259 1.00 0.19 C ATOM 233 C CYS A 105 -0.308 -7.951 -0.775 1.00 0.20 C ATOM 234 O CYS A 105 -0.317 -8.187 -1.963 1.00 0.21 O ATOM 235 CB CYS A 105 1.053 -6.239 0.462 1.00 0.22 C ATOM 236 SG CYS A 105 2.450 -6.448 -0.672 1.00 0.29 S ATOM 0 H CYS A 105 -1.001 -6.086 1.703 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.386 -5.874 -1.124 1.00 0.19 H new ATOM 0 HB2 CYS A 105 1.046 -5.223 0.857 1.00 0.22 H new ATOM 0 HB3 CYS A 105 1.163 -6.911 1.313 1.00 0.22 H new ATOM 0 HG CYS A 105 3.560 -6.199 -0.043 1.00 0.29 H new ATOM 242 N ASP A 106 -0.349 -8.899 0.112 1.00 0.21 N ATOM 243 CA ASP A 106 -0.402 -10.320 -0.334 1.00 0.24 C ATOM 244 C ASP A 106 -1.717 -10.577 -1.089 1.00 0.25 C ATOM 245 O ASP A 106 -1.861 -11.576 -1.768 1.00 0.28 O ATOM 246 CB ASP A 106 -0.336 -11.148 0.946 1.00 0.25 C ATOM 247 CG ASP A 106 1.029 -10.958 1.615 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.994 -10.728 0.903 1.00 1.05 O ATOM 249 OD2 ASP A 106 1.087 -11.050 2.830 1.00 1.05 O ATOM 0 H ASP A 106 -0.348 -8.757 1.122 1.00 0.21 H new ATOM 0 HA ASP A 106 0.412 -10.576 -1.013 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.131 -10.845 1.628 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.496 -12.202 0.717 1.00 0.25 H new ATOM 254 N ASN A 107 -2.675 -9.678 -0.982 1.00 0.24 N ATOM 255 CA ASN A 107 -3.970 -9.866 -1.698 1.00 0.26 C ATOM 256 C ASN A 107 -3.917 -9.223 -3.086 1.00 0.26 C ATOM 257 O ASN A 107 -4.442 -9.757 -4.045 1.00 0.29 O ATOM 258 CB ASN A 107 -4.987 -9.114 -0.845 1.00 0.25 C ATOM 259 CG ASN A 107 -6.359 -9.776 -0.980 1.00 0.29 C ATOM 260 OD1 ASN A 107 -6.522 -10.936 -0.661 1.00 1.02 O ATOM 261 ND2 ASN A 107 -7.359 -9.080 -1.447 1.00 1.23 N ATOM 0 H ASN A 107 -2.609 -8.824 -0.428 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.210 -10.921 -1.832 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.673 -9.115 0.199 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.042 -8.072 -1.161 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -8.279 -9.510 -1.544 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -7.221 -8.105 -1.715 1.00 1.23 H new ATOM 268 N VAL A 108 -3.308 -8.068 -3.193 1.00 0.23 N ATOM 269 CA VAL A 108 -3.247 -7.374 -4.513 1.00 0.24 C ATOM 270 C VAL A 108 -2.128 -6.325 -4.524 1.00 0.25 C ATOM 271 O VAL A 108 -2.255 -5.282 -5.124 1.00 0.42 O ATOM 272 CB VAL A 108 -4.638 -6.741 -4.651 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.805 -5.536 -3.712 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.853 -6.303 -6.100 1.00 0.27 C ATOM 0 H VAL A 108 -2.852 -7.578 -2.424 1.00 0.23 H new ATOM 0 HA VAL A 108 -3.017 -8.041 -5.344 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.382 -7.486 -4.371 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.802 -5.113 -3.837 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.674 -5.859 -2.679 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.057 -4.780 -3.953 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.841 -5.853 -6.201 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.092 -5.574 -6.376 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.780 -7.170 -6.757 1.00 0.27 H new ATOM 284 N GLY A 109 -1.065 -6.600 -3.816 1.00 0.24 N ATOM 285 CA GLY A 109 0.098 -5.656 -3.682 1.00 0.22 C ATOM 286 C GLY A 109 0.332 -4.792 -4.946 1.00 0.23 C ATOM 287 O GLY A 109 0.628 -3.617 -4.850 1.00 0.21 O ATOM 0 H GLY A 109 -0.946 -7.474 -3.303 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.071 -5.000 -2.828 1.00 0.22 H new ATOM 0 HA3 GLY A 109 1.000 -6.229 -3.470 1.00 0.22 H new ATOM 291 N ARG A 110 0.220 -5.372 -6.116 1.00 0.27 N ATOM 292 CA ARG A 110 0.460 -4.597 -7.383 1.00 0.28 C ATOM 293 C ARG A 110 -0.518 -3.412 -7.517 1.00 0.27 C ATOM 294 O ARG A 110 -0.251 -2.430 -8.217 1.00 0.27 O ATOM 295 CB ARG A 110 0.267 -5.615 -8.514 1.00 0.36 C ATOM 296 CG ARG A 110 1.630 -6.216 -8.906 1.00 0.55 C ATOM 297 CD ARG A 110 1.716 -7.679 -8.446 1.00 0.72 C ATOM 298 NE ARG A 110 1.266 -8.482 -9.620 1.00 1.08 N ATOM 299 CZ ARG A 110 1.410 -9.779 -9.617 1.00 1.39 C ATOM 300 NH1 ARG A 110 2.562 -10.306 -9.304 1.00 1.68 N ATOM 301 NH2 ARG A 110 0.402 -10.547 -9.926 1.00 2.06 N ATOM 0 H ARG A 110 -0.028 -6.352 -6.253 1.00 0.27 H new ATOM 0 HA ARG A 110 1.455 -4.153 -7.402 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -0.412 -6.405 -8.194 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.191 -5.132 -9.377 1.00 0.36 H new ATOM 0 HG2 ARG A 110 1.764 -6.158 -9.986 1.00 0.55 H new ATOM 0 HG3 ARG A 110 2.435 -5.637 -8.453 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.733 -7.942 -8.155 1.00 0.72 H new ATOM 0 HD3 ARG A 110 1.080 -7.858 -7.579 1.00 0.72 H new ATOM 0 HE ARG A 110 0.846 -8.017 -10.425 1.00 1.08 H new ATOM 0 HH11 ARG A 110 3.349 -9.704 -9.062 1.00 1.68 H new ATOM 0 HH12 ARG A 110 2.675 -11.320 -9.301 1.00 1.68 H new ATOM 0 HH21 ARG A 110 -0.498 -10.134 -10.170 1.00 2.06 H new ATOM 0 HH22 ARG A 110 0.514 -11.561 -9.924 1.00 2.06 H new ATOM 315 N ASP A 111 -1.629 -3.468 -6.831 1.00 0.27 N ATOM 316 CA ASP A 111 -2.594 -2.335 -6.909 1.00 0.30 C ATOM 317 C ASP A 111 -1.949 -1.102 -6.270 1.00 0.31 C ATOM 318 O ASP A 111 -2.316 0.019 -6.564 1.00 0.39 O ATOM 319 CB ASP A 111 -3.831 -2.792 -6.126 1.00 0.30 C ATOM 320 CG ASP A 111 -4.814 -3.488 -7.073 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.370 -4.029 -8.074 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.998 -3.475 -6.777 1.00 0.82 O ATOM 0 H ASP A 111 -1.907 -4.241 -6.226 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.867 -2.071 -7.931 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.537 -3.473 -5.327 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.311 -1.935 -5.653 1.00 0.30 H new ATOM 327 N TRP A 112 -0.951 -1.298 -5.436 1.00 0.27 N ATOM 328 CA TRP A 112 -0.246 -0.134 -4.833 1.00 0.29 C ATOM 329 C TRP A 112 0.556 0.560 -5.923 1.00 0.32 C ATOM 330 O TRP A 112 0.787 1.743 -5.854 1.00 0.31 O ATOM 331 CB TRP A 112 0.673 -0.690 -3.751 1.00 0.29 C ATOM 332 CG TRP A 112 -0.119 -1.518 -2.796 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.328 -2.656 -2.236 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.485 -1.323 -2.305 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.657 -3.167 -1.419 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.791 -2.388 -1.433 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.480 -0.342 -2.517 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -3.022 -2.485 -0.802 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.727 -0.443 -1.878 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.996 -1.516 -1.022 1.00 0.27 C ATOM 0 H TRP A 112 -0.601 -2.213 -5.152 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.935 0.591 -4.400 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.461 -1.293 -4.203 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.162 0.127 -3.220 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.300 -3.097 -2.400 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.557 -4.021 -0.870 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -2.280 0.491 -3.175 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.225 -3.313 -0.139 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.481 0.311 -2.048 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.956 -1.592 -0.534 1.00 0.27 H new ATOM 351 N LYS A 113 0.967 -0.162 -6.948 1.00 0.37 N ATOM 352 CA LYS A 113 1.725 0.496 -8.055 1.00 0.40 C ATOM 353 C LYS A 113 0.786 1.492 -8.717 1.00 0.34 C ATOM 354 O LYS A 113 1.161 2.601 -9.047 1.00 0.30 O ATOM 355 CB LYS A 113 2.086 -0.609 -9.041 1.00 0.50 C ATOM 356 CG LYS A 113 2.946 -1.663 -8.347 1.00 0.72 C ATOM 357 CD LYS A 113 3.491 -2.652 -9.383 1.00 0.89 C ATOM 358 CE LYS A 113 2.340 -3.321 -10.144 1.00 1.51 C ATOM 359 NZ LYS A 113 2.993 -4.346 -11.007 1.00 1.66 N ATOM 0 H LYS A 113 0.810 -1.164 -7.060 1.00 0.37 H new ATOM 0 HA LYS A 113 2.622 1.011 -7.710 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.179 -1.068 -9.434 1.00 0.50 H new ATOM 0 HB3 LYS A 113 2.625 -0.189 -9.890 1.00 0.50 H new ATOM 0 HG2 LYS A 113 3.771 -1.183 -7.820 1.00 0.72 H new ATOM 0 HG3 LYS A 113 2.355 -2.193 -7.600 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.144 -2.131 -10.084 1.00 0.89 H new ATOM 0 HD3 LYS A 113 4.096 -3.411 -8.887 1.00 0.89 H new ATOM 0 HE2 LYS A 113 1.627 -3.779 -9.458 1.00 1.51 H new ATOM 0 HE3 LYS A 113 1.788 -2.596 -10.741 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 2.268 -4.847 -11.560 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 3.661 -3.881 -11.654 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 3.505 -5.027 -10.411 1.00 1.66 H new ATOM 373 N ARG A 114 -0.457 1.102 -8.870 1.00 0.35 N ATOM 374 CA ARG A 114 -1.466 2.037 -9.470 1.00 0.33 C ATOM 375 C ARG A 114 -1.573 3.291 -8.588 1.00 0.28 C ATOM 376 O ARG A 114 -1.504 4.414 -9.058 1.00 0.29 O ATOM 377 CB ARG A 114 -2.790 1.259 -9.455 1.00 0.37 C ATOM 378 CG ARG A 114 -3.935 2.140 -9.976 1.00 0.38 C ATOM 379 CD ARG A 114 -5.153 2.002 -9.052 1.00 0.43 C ATOM 380 NE ARG A 114 -5.925 3.260 -9.246 1.00 0.57 N ATOM 381 CZ ARG A 114 -7.098 3.222 -9.814 1.00 1.04 C ATOM 382 NH1 ARG A 114 -7.251 2.605 -10.953 1.00 1.77 N ATOM 383 NH2 ARG A 114 -8.119 3.801 -9.242 1.00 1.62 N ATOM 0 H ARG A 114 -0.816 0.184 -8.608 1.00 0.35 H new ATOM 0 HA ARG A 114 -1.200 2.358 -10.477 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.701 0.365 -10.072 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -3.012 0.926 -8.441 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.615 3.181 -10.020 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -4.201 1.845 -10.991 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -5.750 1.128 -9.313 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.849 1.881 -8.012 1.00 0.43 H new ATOM 0 HE ARG A 114 -5.537 4.150 -8.935 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -6.453 2.152 -11.399 1.00 1.77 H new ATOM 0 HH12 ARG A 114 -8.169 2.575 -11.398 1.00 1.77 H new ATOM 0 HH21 ARG A 114 -7.999 4.283 -8.351 1.00 1.62 H new ATOM 0 HH22 ARG A 114 -9.037 3.771 -9.686 1.00 1.62 H new ATOM 397 N LEU A 115 -1.725 3.090 -7.305 1.00 0.26 N ATOM 398 CA LEU A 115 -1.826 4.243 -6.362 1.00 0.25 C ATOM 399 C LEU A 115 -0.459 4.915 -6.217 1.00 0.25 C ATOM 400 O LEU A 115 -0.367 6.095 -5.947 1.00 0.26 O ATOM 401 CB LEU A 115 -2.284 3.640 -5.033 1.00 0.26 C ATOM 402 CG LEU A 115 -3.735 3.165 -5.164 1.00 0.25 C ATOM 403 CD1 LEU A 115 -4.159 2.426 -3.887 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.655 4.373 -5.396 1.00 0.23 C ATOM 0 H LEU A 115 -1.784 2.171 -6.867 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.521 5.007 -6.711 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.640 2.805 -4.758 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.202 4.381 -4.237 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.814 2.485 -6.012 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -5.191 2.091 -3.986 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.511 1.563 -3.734 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -4.076 3.098 -3.033 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.686 4.032 -5.489 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.574 5.059 -4.553 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.358 4.886 -6.311 1.00 0.23 H new ATOM 416 N ALA A 116 0.604 4.168 -6.399 1.00 0.26 N ATOM 417 CA ALA A 116 1.976 4.753 -6.282 1.00 0.28 C ATOM 418 C ALA A 116 2.128 5.868 -7.313 1.00 0.26 C ATOM 419 O ALA A 116 2.518 6.982 -6.999 1.00 0.27 O ATOM 420 CB ALA A 116 2.936 3.602 -6.597 1.00 0.31 C ATOM 0 H ALA A 116 0.579 3.174 -6.625 1.00 0.26 H new ATOM 0 HA ALA A 116 2.172 5.176 -5.297 1.00 0.28 H new ATOM 0 HB1 ALA A 116 3.964 3.957 -6.530 1.00 0.31 H new ATOM 0 HB2 ALA A 116 2.784 2.795 -5.880 1.00 0.31 H new ATOM 0 HB3 ALA A 116 2.744 3.233 -7.605 1.00 0.31 H new ATOM 426 N ARG A 117 1.783 5.581 -8.544 1.00 0.27 N ATOM 427 CA ARG A 117 1.865 6.621 -9.609 1.00 0.30 C ATOM 428 C ARG A 117 0.951 7.787 -9.214 1.00 0.32 C ATOM 429 O ARG A 117 1.292 8.945 -9.365 1.00 0.33 O ATOM 430 CB ARG A 117 1.352 5.935 -10.880 1.00 0.35 C ATOM 431 CG ARG A 117 2.371 4.891 -11.340 1.00 0.37 C ATOM 432 CD ARG A 117 1.862 4.204 -12.609 1.00 1.31 C ATOM 433 NE ARG A 117 2.789 3.057 -12.822 1.00 1.53 N ATOM 434 CZ ARG A 117 3.616 3.059 -13.832 1.00 1.93 C ATOM 435 NH1 ARG A 117 3.222 3.490 -15.000 1.00 2.24 N ATOM 436 NH2 ARG A 117 4.837 2.627 -13.674 1.00 2.61 N ATOM 0 H ARG A 117 1.448 4.669 -8.855 1.00 0.27 H new ATOM 0 HA ARG A 117 2.871 7.014 -9.755 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.390 5.460 -10.687 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.191 6.673 -11.666 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.333 5.366 -11.532 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.531 4.153 -10.554 1.00 0.37 H new ATOM 0 HD2 ARG A 117 0.834 3.864 -12.489 1.00 1.31 H new ATOM 0 HD3 ARG A 117 1.875 4.886 -13.460 1.00 1.31 H new ATOM 0 HE ARG A 117 2.777 2.267 -12.176 1.00 1.53 H new ATOM 0 HH11 ARG A 117 2.267 3.826 -15.124 1.00 2.24 H new ATOM 0 HH12 ARG A 117 3.869 3.491 -15.788 1.00 2.24 H new ATOM 0 HH21 ARG A 117 5.144 2.288 -12.762 1.00 2.61 H new ATOM 0 HH22 ARG A 117 5.484 2.628 -14.462 1.00 2.61 H new ATOM 450 N GLU A 118 -0.202 7.469 -8.673 1.00 0.34 N ATOM 451 CA GLU A 118 -1.149 8.534 -8.219 1.00 0.39 C ATOM 452 C GLU A 118 -0.515 9.301 -7.051 1.00 0.39 C ATOM 453 O GLU A 118 -0.633 10.506 -6.944 1.00 0.41 O ATOM 454 CB GLU A 118 -2.408 7.790 -7.764 1.00 0.43 C ATOM 455 CG GLU A 118 -3.092 7.152 -8.977 1.00 0.47 C ATOM 456 CD GLU A 118 -3.587 8.245 -9.927 1.00 0.53 C ATOM 457 OE1 GLU A 118 -4.102 9.238 -9.440 1.00 0.76 O ATOM 458 OE2 GLU A 118 -3.442 8.070 -11.126 1.00 1.45 O ATOM 0 H GLU A 118 -0.528 6.514 -8.527 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.381 9.257 -9.001 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.146 7.023 -7.036 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -3.092 8.480 -7.269 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -2.394 6.495 -9.496 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.929 6.534 -8.651 1.00 0.47 H new ATOM 465 N LEU A 119 0.173 8.596 -6.185 1.00 0.37 N ATOM 466 CA LEU A 119 0.848 9.254 -5.019 1.00 0.38 C ATOM 467 C LEU A 119 2.099 10.015 -5.485 1.00 0.36 C ATOM 468 O LEU A 119 2.739 10.697 -4.708 1.00 0.39 O ATOM 469 CB LEU A 119 1.247 8.104 -4.096 1.00 0.38 C ATOM 470 CG LEU A 119 -0.013 7.475 -3.494 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.277 6.028 -3.065 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.450 8.297 -2.276 1.00 0.58 C ATOM 0 H LEU A 119 0.297 7.585 -6.236 1.00 0.37 H new ATOM 0 HA LEU A 119 0.199 9.977 -4.524 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.810 7.355 -4.653 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.899 8.469 -3.303 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.808 7.469 -4.239 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.624 5.588 -2.638 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.589 5.447 -3.933 1.00 1.33 H new ATOM 0 HD13 LEU A 119 1.072 6.022 -2.320 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.347 7.855 -1.842 1.00 0.58 H new ATOM 0 HD22 LEU A 119 0.348 8.301 -1.534 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -0.663 9.320 -2.585 1.00 0.58 H new ATOM 484 N LYS A 120 2.455 9.911 -6.753 1.00 0.34 N ATOM 485 CA LYS A 120 3.658 10.627 -7.277 1.00 0.35 C ATOM 486 C LYS A 120 4.907 10.170 -6.529 1.00 0.30 C ATOM 487 O LYS A 120 5.688 10.968 -6.047 1.00 0.33 O ATOM 488 CB LYS A 120 3.387 12.117 -7.052 1.00 0.48 C ATOM 489 CG LYS A 120 4.138 12.935 -8.100 1.00 1.05 C ATOM 490 CD LYS A 120 3.499 14.317 -8.197 1.00 1.11 C ATOM 491 CE LYS A 120 4.140 15.102 -9.343 1.00 2.02 C ATOM 492 NZ LYS A 120 3.136 16.141 -9.704 1.00 2.16 N ATOM 0 H LYS A 120 1.955 9.355 -7.446 1.00 0.34 H new ATOM 0 HA LYS A 120 3.832 10.419 -8.333 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.317 12.317 -7.117 1.00 0.48 H new ATOM 0 HB3 LYS A 120 3.705 12.408 -6.051 1.00 0.48 H new ATOM 0 HG2 LYS A 120 5.189 13.024 -7.827 1.00 1.05 H new ATOM 0 HG3 LYS A 120 4.101 12.434 -9.067 1.00 1.05 H new ATOM 0 HD2 LYS A 120 2.426 14.221 -8.364 1.00 1.11 H new ATOM 0 HD3 LYS A 120 3.628 14.855 -7.258 1.00 1.11 H new ATOM 0 HE2 LYS A 120 5.083 15.554 -9.034 1.00 2.02 H new ATOM 0 HE3 LYS A 120 4.360 14.454 -10.191 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 3.503 16.722 -10.485 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 2.252 15.681 -10.000 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 2.951 16.747 -8.879 1.00 2.16 H new ATOM 506 N VAL A 121 5.096 8.880 -6.441 1.00 0.29 N ATOM 507 CA VAL A 121 6.296 8.336 -5.735 1.00 0.33 C ATOM 508 C VAL A 121 7.545 8.528 -6.602 1.00 0.37 C ATOM 509 O VAL A 121 7.452 8.762 -7.793 1.00 0.42 O ATOM 510 CB VAL A 121 6.009 6.844 -5.522 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.778 6.686 -4.627 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.756 6.156 -6.873 1.00 1.29 C ATOM 0 H VAL A 121 4.469 8.176 -6.829 1.00 0.29 H new ATOM 0 HA VAL A 121 6.480 8.845 -4.789 1.00 0.33 H new ATOM 0 HB VAL A 121 6.872 6.379 -5.045 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.573 5.626 -4.475 1.00 1.65 H new ATOM 0 HG12 VAL A 121 4.965 7.162 -3.664 1.00 1.65 H new ATOM 0 HG13 VAL A 121 3.919 7.157 -5.104 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.553 5.097 -6.710 1.00 1.29 H new ATOM 0 HG22 VAL A 121 4.899 6.618 -7.362 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.636 6.263 -7.507 1.00 1.29 H new ATOM 522 N SER A 122 8.711 8.443 -6.011 1.00 0.45 N ATOM 523 CA SER A 122 9.977 8.634 -6.794 1.00 0.52 C ATOM 524 C SER A 122 10.023 7.697 -7.999 1.00 0.44 C ATOM 525 O SER A 122 10.034 6.488 -7.864 1.00 0.35 O ATOM 526 CB SER A 122 11.102 8.289 -5.818 1.00 0.63 C ATOM 527 OG SER A 122 11.335 9.397 -4.959 1.00 1.10 O ATOM 0 H SER A 122 8.844 8.249 -5.018 1.00 0.45 H new ATOM 0 HA SER A 122 10.058 9.649 -7.184 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.834 7.410 -5.232 1.00 0.63 H new ATOM 0 HB3 SER A 122 12.011 8.041 -6.366 1.00 0.63 H new ATOM 0 HG SER A 122 12.250 9.723 -5.086 1.00 1.10 H new ATOM 533 N GLU A 123 10.071 8.261 -9.178 1.00 0.55 N ATOM 534 CA GLU A 123 10.142 7.429 -10.415 1.00 0.58 C ATOM 535 C GLU A 123 11.403 6.569 -10.370 1.00 0.52 C ATOM 536 O GLU A 123 11.402 5.421 -10.772 1.00 0.53 O ATOM 537 CB GLU A 123 10.209 8.428 -11.573 1.00 0.77 C ATOM 538 CG GLU A 123 8.856 9.134 -11.713 1.00 1.44 C ATOM 539 CD GLU A 123 8.938 10.249 -12.767 1.00 1.61 C ATOM 540 OE1 GLU A 123 9.986 10.403 -13.377 1.00 2.15 O ATOM 541 OE2 GLU A 123 7.945 10.936 -12.942 1.00 1.75 O ATOM 0 H GLU A 123 10.064 9.268 -9.337 1.00 0.55 H new ATOM 0 HA GLU A 123 9.289 6.758 -10.521 1.00 0.58 H new ATOM 0 HB2 GLU A 123 10.997 9.159 -11.392 1.00 0.77 H new ATOM 0 HB3 GLU A 123 10.460 7.912 -12.500 1.00 0.77 H new ATOM 0 HG2 GLU A 123 8.090 8.412 -11.997 1.00 1.44 H new ATOM 0 HG3 GLU A 123 8.557 9.554 -10.753 1.00 1.44 H new ATOM 548 N ALA A 124 12.478 7.127 -9.872 1.00 0.50 N ATOM 549 CA ALA A 124 13.756 6.352 -9.783 1.00 0.50 C ATOM 550 C ALA A 124 13.547 5.097 -8.929 1.00 0.39 C ATOM 551 O ALA A 124 13.839 3.994 -9.349 1.00 0.45 O ATOM 552 CB ALA A 124 14.754 7.297 -9.110 1.00 0.56 C ATOM 0 H ALA A 124 12.527 8.084 -9.523 1.00 0.50 H new ATOM 0 HA ALA A 124 14.108 6.022 -10.760 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.718 6.797 -9.010 1.00 0.56 H new ATOM 0 HB2 ALA A 124 14.872 8.194 -9.717 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.384 7.573 -8.123 1.00 0.56 H new ATOM 558 N LYS A 125 13.035 5.266 -7.737 1.00 0.31 N ATOM 559 CA LYS A 125 12.790 4.089 -6.847 1.00 0.34 C ATOM 560 C LYS A 125 11.747 3.162 -7.472 1.00 0.34 C ATOM 561 O LYS A 125 11.916 1.959 -7.519 1.00 0.39 O ATOM 562 CB LYS A 125 12.248 4.679 -5.547 1.00 0.42 C ATOM 563 CG LYS A 125 13.346 5.488 -4.855 1.00 0.54 C ATOM 564 CD LYS A 125 12.802 6.078 -3.553 1.00 0.75 C ATOM 565 CE LYS A 125 13.901 6.887 -2.861 1.00 0.75 C ATOM 566 NZ LYS A 125 13.668 8.295 -3.291 1.00 1.56 N ATOM 0 H LYS A 125 12.775 6.169 -7.340 1.00 0.31 H new ATOM 0 HA LYS A 125 13.695 3.502 -6.689 1.00 0.34 H new ATOM 0 HB2 LYS A 125 11.389 5.317 -5.755 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.901 3.881 -4.890 1.00 0.42 H new ATOM 0 HG2 LYS A 125 14.205 4.851 -4.647 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.693 6.286 -5.511 1.00 0.54 H new ATOM 0 HD2 LYS A 125 11.943 6.716 -3.761 1.00 0.75 H new ATOM 0 HD3 LYS A 125 12.455 5.280 -2.897 1.00 0.75 H new ATOM 0 HE2 LYS A 125 13.840 6.790 -1.777 1.00 0.75 H new ATOM 0 HE3 LYS A 125 14.892 6.542 -3.157 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 14.370 8.559 -4.011 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 12.712 8.382 -3.691 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 13.759 8.928 -2.471 1.00 1.56 H new ATOM 580 N MET A 126 10.667 3.725 -7.951 1.00 0.42 N ATOM 581 CA MET A 126 9.592 2.895 -8.579 1.00 0.56 C ATOM 582 C MET A 126 10.163 2.134 -9.779 1.00 0.57 C ATOM 583 O MET A 126 9.949 0.947 -9.935 1.00 0.66 O ATOM 584 CB MET A 126 8.518 3.910 -9.012 1.00 0.70 C ATOM 585 CG MET A 126 7.333 3.202 -9.681 1.00 1.10 C ATOM 586 SD MET A 126 6.543 2.075 -8.504 1.00 1.90 S ATOM 587 CE MET A 126 5.999 0.840 -9.709 1.00 2.03 C ATOM 0 H MET A 126 10.482 4.728 -7.935 1.00 0.42 H new ATOM 0 HA MET A 126 9.180 2.145 -7.904 1.00 0.56 H new ATOM 0 HB2 MET A 126 8.169 4.469 -8.144 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.952 4.632 -9.703 1.00 0.70 H new ATOM 0 HG2 MET A 126 6.611 3.938 -10.034 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.676 2.648 -10.555 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.476 0.034 -9.194 1.00 2.03 H new ATOM 0 HE2 MET A 126 5.327 1.306 -10.429 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.866 0.435 -10.231 1.00 2.03 H new ATOM 597 N ASP A 127 10.902 2.813 -10.615 1.00 0.55 N ATOM 598 CA ASP A 127 11.514 2.140 -11.803 1.00 0.62 C ATOM 599 C ASP A 127 12.484 1.034 -11.367 1.00 0.54 C ATOM 600 O ASP A 127 12.539 -0.023 -11.969 1.00 0.59 O ATOM 601 CB ASP A 127 12.258 3.241 -12.561 1.00 0.71 C ATOM 602 CG ASP A 127 11.249 4.182 -13.228 1.00 1.04 C ATOM 603 OD1 ASP A 127 10.166 3.724 -13.558 1.00 1.60 O ATOM 604 OD2 ASP A 127 11.579 5.343 -13.404 1.00 1.71 O ATOM 0 H ASP A 127 11.110 3.808 -10.528 1.00 0.55 H new ATOM 0 HA ASP A 127 10.757 1.661 -12.425 1.00 0.62 H new ATOM 0 HB2 ASP A 127 12.894 3.801 -11.876 1.00 0.71 H new ATOM 0 HB3 ASP A 127 12.911 2.800 -13.314 1.00 0.71 H new ATOM 609 N GLY A 128 13.254 1.272 -10.331 1.00 0.46 N ATOM 610 CA GLY A 128 14.224 0.237 -9.865 1.00 0.46 C ATOM 611 C GLY A 128 13.520 -0.914 -9.145 1.00 0.48 C ATOM 612 O GLY A 128 13.881 -2.064 -9.318 1.00 0.51 O ATOM 0 H GLY A 128 13.251 2.137 -9.791 1.00 0.46 H new ATOM 0 HA2 GLY A 128 14.779 -0.153 -10.719 1.00 0.46 H new ATOM 0 HA3 GLY A 128 14.951 0.695 -9.195 1.00 0.46 H new ATOM 616 N ILE A 129 12.535 -0.627 -8.329 1.00 0.54 N ATOM 617 CA ILE A 129 11.839 -1.728 -7.595 1.00 0.68 C ATOM 618 C ILE A 129 11.195 -2.714 -8.591 1.00 0.68 C ATOM 619 O ILE A 129 11.363 -3.914 -8.477 1.00 0.72 O ATOM 620 CB ILE A 129 10.820 -1.015 -6.663 1.00 0.86 C ATOM 621 CG1 ILE A 129 10.739 -1.799 -5.359 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.412 -0.914 -7.276 1.00 1.77 C ATOM 623 CD1 ILE A 129 12.032 -1.601 -4.566 1.00 2.01 C ATOM 0 H ILE A 129 12.186 0.313 -8.141 1.00 0.54 H new ATOM 0 HA ILE A 129 12.513 -2.344 -7.000 1.00 0.68 H new ATOM 0 HB ILE A 129 11.171 0.005 -6.503 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.884 -1.463 -4.772 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.586 -2.858 -5.567 1.00 1.04 H new ATOM 0 HG21 ILE A 129 8.747 -0.407 -6.577 1.00 1.77 H new ATOM 0 HG22 ILE A 129 9.460 -0.349 -8.207 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.031 -1.915 -7.478 1.00 1.77 H new ATOM 0 HD11 ILE A 129 11.976 -2.161 -3.633 1.00 2.01 H new ATOM 0 HD12 ILE A 129 12.878 -1.959 -5.154 1.00 2.01 H new ATOM 0 HD13 ILE A 129 12.165 -0.542 -4.346 1.00 2.01 H new ATOM 635 N GLU A 130 10.463 -2.216 -9.556 1.00 0.70 N ATOM 636 CA GLU A 130 9.811 -3.124 -10.548 1.00 0.77 C ATOM 637 C GLU A 130 10.851 -3.911 -11.369 1.00 0.65 C ATOM 638 O GLU A 130 10.711 -5.104 -11.559 1.00 0.68 O ATOM 639 CB GLU A 130 8.952 -2.215 -11.444 1.00 0.85 C ATOM 640 CG GLU A 130 9.832 -1.230 -12.218 1.00 1.41 C ATOM 641 CD GLU A 130 8.948 -0.241 -12.980 1.00 1.66 C ATOM 642 OE1 GLU A 130 8.569 -0.554 -14.097 1.00 2.14 O ATOM 643 OE2 GLU A 130 8.665 0.813 -12.435 1.00 2.01 O ATOM 0 H GLU A 130 10.289 -1.221 -9.699 1.00 0.70 H new ATOM 0 HA GLU A 130 9.203 -3.880 -10.052 1.00 0.77 H new ATOM 0 HB2 GLU A 130 8.377 -2.823 -12.142 1.00 0.85 H new ATOM 0 HB3 GLU A 130 8.235 -1.667 -10.833 1.00 0.85 H new ATOM 0 HG2 GLU A 130 10.486 -0.694 -11.531 1.00 1.41 H new ATOM 0 HG3 GLU A 130 10.474 -1.770 -12.914 1.00 1.41 H new ATOM 650 N GLU A 131 11.880 -3.259 -11.872 1.00 0.59 N ATOM 651 CA GLU A 131 12.899 -3.990 -12.694 1.00 0.55 C ATOM 652 C GLU A 131 13.756 -4.931 -11.836 1.00 0.47 C ATOM 653 O GLU A 131 14.071 -6.034 -12.244 1.00 0.45 O ATOM 654 CB GLU A 131 13.755 -2.897 -13.357 1.00 0.63 C ATOM 655 CG GLU A 131 14.584 -2.147 -12.308 1.00 1.38 C ATOM 656 CD GLU A 131 15.369 -1.024 -12.989 1.00 1.89 C ATOM 657 OE1 GLU A 131 16.457 -1.295 -13.470 1.00 2.30 O ATOM 658 OE2 GLU A 131 14.868 0.088 -13.020 1.00 2.50 O ATOM 0 H GLU A 131 12.055 -2.262 -11.749 1.00 0.59 H new ATOM 0 HA GLU A 131 12.422 -4.631 -13.435 1.00 0.55 H new ATOM 0 HB2 GLU A 131 14.417 -3.346 -14.098 1.00 0.63 H new ATOM 0 HB3 GLU A 131 13.111 -2.196 -13.888 1.00 0.63 H new ATOM 0 HG2 GLU A 131 13.931 -1.735 -11.539 1.00 1.38 H new ATOM 0 HG3 GLU A 131 15.268 -2.834 -11.810 1.00 1.38 H new ATOM 665 N LYS A 132 14.148 -4.500 -10.663 1.00 0.51 N ATOM 666 CA LYS A 132 15.001 -5.370 -9.793 1.00 0.53 C ATOM 667 C LYS A 132 14.199 -6.557 -9.260 1.00 0.54 C ATOM 668 O LYS A 132 14.695 -7.665 -9.178 1.00 0.63 O ATOM 669 CB LYS A 132 15.453 -4.476 -8.636 1.00 0.68 C ATOM 670 CG LYS A 132 16.448 -3.432 -9.147 1.00 1.39 C ATOM 671 CD LYS A 132 16.895 -2.542 -7.985 1.00 1.91 C ATOM 672 CE LYS A 132 17.827 -3.334 -7.063 1.00 2.62 C ATOM 673 NZ LYS A 132 18.046 -2.452 -5.884 1.00 2.69 N ATOM 0 H LYS A 132 13.916 -3.588 -10.271 1.00 0.51 H new ATOM 0 HA LYS A 132 15.846 -5.781 -10.346 1.00 0.53 H new ATOM 0 HB2 LYS A 132 14.591 -3.982 -8.188 1.00 0.68 H new ATOM 0 HB3 LYS A 132 15.915 -5.081 -7.856 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.311 -3.925 -9.594 1.00 1.39 H new ATOM 0 HG3 LYS A 132 15.987 -2.826 -9.927 1.00 1.39 H new ATOM 0 HD2 LYS A 132 17.408 -1.659 -8.366 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.027 -2.191 -7.427 1.00 1.91 H new ATOM 0 HE2 LYS A 132 17.378 -4.282 -6.768 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.768 -3.568 -7.560 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 18.676 -2.928 -5.207 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 18.481 -1.560 -6.194 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 17.134 -2.252 -5.426 1.00 2.69 H new ATOM 687 N TYR A 133 12.968 -6.329 -8.890 1.00 0.55 N ATOM 688 CA TYR A 133 12.125 -7.430 -8.349 1.00 0.65 C ATOM 689 C TYR A 133 10.770 -7.457 -9.074 1.00 0.54 C ATOM 690 O TYR A 133 9.769 -7.047 -8.518 1.00 0.66 O ATOM 691 CB TYR A 133 11.955 -7.083 -6.872 1.00 0.89 C ATOM 692 CG TYR A 133 13.308 -7.082 -6.199 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.943 -8.293 -5.898 1.00 0.98 C ATOM 694 CD2 TYR A 133 13.933 -5.869 -5.889 1.00 2.20 C ATOM 695 CE1 TYR A 133 15.202 -8.290 -5.285 1.00 1.14 C ATOM 696 CE2 TYR A 133 15.191 -5.865 -5.278 1.00 2.44 C ATOM 697 CZ TYR A 133 15.826 -7.075 -4.975 1.00 1.67 C ATOM 698 OH TYR A 133 17.068 -7.072 -4.374 1.00 1.95 O ATOM 0 H TYR A 133 12.508 -5.420 -8.940 1.00 0.55 H new ATOM 0 HA TYR A 133 12.568 -8.416 -8.486 1.00 0.65 H new ATOM 0 HB2 TYR A 133 11.484 -6.105 -6.768 1.00 0.89 H new ATOM 0 HB3 TYR A 133 11.297 -7.806 -6.390 1.00 0.89 H new ATOM 0 HD1 TYR A 133 13.462 -9.229 -6.139 1.00 0.98 H new ATOM 0 HD2 TYR A 133 13.443 -4.935 -6.122 1.00 2.20 H new ATOM 0 HE1 TYR A 133 15.692 -9.224 -5.051 1.00 1.14 H new ATOM 0 HE2 TYR A 133 15.673 -4.928 -5.040 1.00 2.44 H new ATOM 0 HH TYR A 133 17.359 -6.148 -4.228 1.00 1.95 H new ATOM 708 N PRO A 134 10.776 -7.928 -10.302 1.00 0.51 N ATOM 709 CA PRO A 134 9.521 -7.980 -11.087 1.00 0.53 C ATOM 710 C PRO A 134 8.642 -9.161 -10.657 1.00 0.47 C ATOM 711 O PRO A 134 7.453 -9.177 -10.917 1.00 0.54 O ATOM 712 CB PRO A 134 10.003 -8.177 -12.521 1.00 0.70 C ATOM 713 CG PRO A 134 11.344 -8.832 -12.403 1.00 0.76 C ATOM 714 CD PRO A 134 11.925 -8.441 -11.068 1.00 0.66 C ATOM 0 HA PRO A 134 8.911 -7.087 -10.953 1.00 0.53 H new ATOM 0 HB2 PRO A 134 9.310 -8.800 -13.086 1.00 0.70 H new ATOM 0 HB3 PRO A 134 10.076 -7.224 -13.045 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.249 -9.915 -12.477 1.00 0.76 H new ATOM 0 HG3 PRO A 134 11.999 -8.513 -13.214 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.385 -9.295 -10.570 1.00 0.66 H new ATOM 0 HD3 PRO A 134 12.699 -7.682 -11.179 1.00 0.66 H new ATOM 722 N ARG A 135 9.214 -10.158 -10.027 1.00 0.43 N ATOM 723 CA ARG A 135 8.400 -11.341 -9.610 1.00 0.48 C ATOM 724 C ARG A 135 8.003 -11.263 -8.126 1.00 0.43 C ATOM 725 O ARG A 135 7.155 -12.011 -7.674 1.00 0.60 O ATOM 726 CB ARG A 135 9.310 -12.548 -9.864 1.00 0.70 C ATOM 727 CG ARG A 135 8.593 -13.849 -9.475 1.00 0.91 C ATOM 728 CD ARG A 135 7.330 -14.014 -10.329 1.00 1.17 C ATOM 729 NE ARG A 135 6.717 -15.293 -9.875 1.00 1.44 N ATOM 730 CZ ARG A 135 6.284 -16.155 -10.755 1.00 2.17 C ATOM 731 NH1 ARG A 135 5.406 -15.789 -11.649 1.00 2.61 N ATOM 732 NH2 ARG A 135 6.731 -17.381 -10.744 1.00 3.07 N ATOM 0 H ARG A 135 10.204 -10.204 -9.785 1.00 0.43 H new ATOM 0 HA ARG A 135 7.463 -11.399 -10.164 1.00 0.48 H new ATOM 0 HB2 ARG A 135 9.594 -12.582 -10.916 1.00 0.70 H new ATOM 0 HB3 ARG A 135 10.230 -12.446 -9.288 1.00 0.70 H new ATOM 0 HG2 ARG A 135 9.258 -14.700 -9.622 1.00 0.91 H new ATOM 0 HG3 ARG A 135 8.329 -13.829 -8.418 1.00 0.91 H new ATOM 0 HD2 ARG A 135 6.646 -13.177 -10.187 1.00 1.17 H new ATOM 0 HD3 ARG A 135 7.574 -14.049 -11.391 1.00 1.17 H new ATOM 0 HE ARG A 135 6.636 -15.495 -8.879 1.00 1.44 H new ATOM 0 HH11 ARG A 135 5.059 -14.830 -11.660 1.00 2.61 H new ATOM 0 HH12 ARG A 135 5.067 -16.462 -12.337 1.00 2.61 H new ATOM 0 HH21 ARG A 135 7.419 -17.667 -10.048 1.00 3.07 H new ATOM 0 HH22 ARG A 135 6.392 -18.054 -11.432 1.00 3.07 H new ATOM 746 N SER A 136 8.611 -10.386 -7.361 1.00 0.51 N ATOM 747 CA SER A 136 8.264 -10.296 -5.909 1.00 0.44 C ATOM 748 C SER A 136 7.255 -9.194 -5.645 1.00 0.33 C ATOM 749 O SER A 136 7.532 -8.019 -5.795 1.00 0.30 O ATOM 750 CB SER A 136 9.582 -9.996 -5.198 1.00 0.50 C ATOM 751 OG SER A 136 10.360 -11.183 -5.131 1.00 0.90 O ATOM 0 H SER A 136 9.328 -9.733 -7.678 1.00 0.51 H new ATOM 0 HA SER A 136 7.804 -11.219 -5.555 1.00 0.44 H new ATOM 0 HB2 SER A 136 10.128 -9.219 -5.733 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.389 -9.617 -4.194 1.00 0.50 H new ATOM 0 HG SER A 136 11.207 -10.993 -4.677 1.00 0.90 H new ATOM 757 N LEU A 137 6.089 -9.585 -5.214 1.00 0.31 N ATOM 758 CA LEU A 137 5.031 -8.594 -4.884 1.00 0.24 C ATOM 759 C LEU A 137 5.526 -7.712 -3.741 1.00 0.20 C ATOM 760 O LEU A 137 5.382 -6.511 -3.757 1.00 0.21 O ATOM 761 CB LEU A 137 3.838 -9.445 -4.427 1.00 0.23 C ATOM 762 CG LEU A 137 2.660 -8.551 -4.050 1.00 0.21 C ATOM 763 CD1 LEU A 137 2.167 -7.812 -5.292 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.530 -9.424 -3.495 1.00 0.27 C ATOM 0 H LEU A 137 5.822 -10.560 -5.075 1.00 0.31 H new ATOM 0 HA LEU A 137 4.769 -7.943 -5.718 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.544 -10.128 -5.224 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.126 -10.057 -3.573 1.00 0.23 H new ATOM 0 HG LEU A 137 2.971 -7.827 -3.297 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.325 -7.173 -5.025 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.974 -7.200 -5.695 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.849 -8.535 -6.043 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.683 -8.794 -3.223 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.219 -10.142 -4.254 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.883 -9.958 -2.613 1.00 0.27 H new ATOM 776 N SER A 138 6.113 -8.329 -2.753 1.00 0.24 N ATOM 777 CA SER A 138 6.637 -7.572 -1.571 1.00 0.26 C ATOM 778 C SER A 138 7.744 -6.575 -1.952 1.00 0.20 C ATOM 779 O SER A 138 7.729 -5.435 -1.530 1.00 0.22 O ATOM 780 CB SER A 138 7.201 -8.645 -0.638 1.00 0.38 C ATOM 781 OG SER A 138 7.812 -8.019 0.484 1.00 1.01 O ATOM 0 H SER A 138 6.256 -9.338 -2.710 1.00 0.24 H new ATOM 0 HA SER A 138 5.847 -6.975 -1.115 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.404 -9.311 -0.308 1.00 0.38 H new ATOM 0 HB3 SER A 138 7.930 -9.258 -1.168 1.00 0.38 H new ATOM 0 HG SER A 138 8.173 -8.704 1.084 1.00 1.01 H new ATOM 787 N GLU A 139 8.723 -7.009 -2.705 1.00 0.24 N ATOM 788 CA GLU A 139 9.862 -6.098 -3.065 1.00 0.25 C ATOM 789 C GLU A 139 9.410 -4.918 -3.918 1.00 0.21 C ATOM 790 O GLU A 139 9.890 -3.817 -3.753 1.00 0.21 O ATOM 791 CB GLU A 139 10.818 -6.950 -3.899 1.00 0.39 C ATOM 792 CG GLU A 139 11.358 -8.103 -3.055 1.00 1.09 C ATOM 793 CD GLU A 139 12.344 -7.565 -2.017 1.00 2.02 C ATOM 794 OE1 GLU A 139 13.148 -6.720 -2.375 1.00 2.24 O ATOM 795 OE2 GLU A 139 12.278 -8.008 -0.882 1.00 2.92 O ATOM 0 H GLU A 139 8.787 -7.952 -3.087 1.00 0.24 H new ATOM 0 HA GLU A 139 10.311 -5.690 -2.159 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.301 -7.341 -4.775 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.643 -6.337 -4.263 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.536 -8.618 -2.557 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.852 -8.834 -3.695 1.00 1.09 H new ATOM 802 N ARG A 140 8.531 -5.153 -4.850 1.00 0.26 N ATOM 803 CA ARG A 140 8.093 -4.055 -5.766 1.00 0.33 C ATOM 804 C ARG A 140 7.241 -3.007 -5.035 1.00 0.29 C ATOM 805 O ARG A 140 7.546 -1.830 -5.056 1.00 0.35 O ATOM 806 CB ARG A 140 7.276 -4.770 -6.852 1.00 0.42 C ATOM 807 CG ARG A 140 7.034 -3.824 -8.029 1.00 1.07 C ATOM 808 CD ARG A 140 6.219 -4.547 -9.107 1.00 1.17 C ATOM 809 NE ARG A 140 7.074 -5.669 -9.581 1.00 0.98 N ATOM 810 CZ ARG A 140 6.556 -6.599 -10.338 1.00 1.13 C ATOM 811 NH1 ARG A 140 5.806 -7.528 -9.810 1.00 1.60 N ATOM 812 NH2 ARG A 140 6.779 -6.596 -11.625 1.00 1.55 N ATOM 0 H ARG A 140 8.094 -6.059 -5.020 1.00 0.26 H new ATOM 0 HA ARG A 140 8.940 -3.503 -6.173 1.00 0.33 H new ATOM 0 HB2 ARG A 140 7.807 -5.659 -7.192 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.323 -5.105 -6.441 1.00 0.42 H new ATOM 0 HG2 ARG A 140 6.502 -2.935 -7.691 1.00 1.07 H new ATOM 0 HG3 ARG A 140 7.986 -3.489 -8.441 1.00 1.07 H new ATOM 0 HD2 ARG A 140 5.277 -4.918 -8.702 1.00 1.17 H new ATOM 0 HD3 ARG A 140 5.970 -3.873 -9.926 1.00 1.17 H new ATOM 0 HE ARG A 140 8.058 -5.712 -9.316 1.00 0.98 H new ATOM 0 HH11 ARG A 140 5.624 -7.528 -8.806 1.00 1.60 H new ATOM 0 HH12 ARG A 140 5.402 -8.254 -10.401 1.00 1.60 H new ATOM 0 HH21 ARG A 140 7.358 -5.867 -12.040 1.00 1.55 H new ATOM 0 HH22 ARG A 140 6.374 -7.323 -12.215 1.00 1.55 H new ATOM 826 N VAL A 141 6.170 -3.420 -4.421 1.00 0.24 N ATOM 827 CA VAL A 141 5.272 -2.445 -3.712 1.00 0.27 C ATOM 828 C VAL A 141 5.912 -1.804 -2.465 1.00 0.25 C ATOM 829 O VAL A 141 5.676 -0.646 -2.181 1.00 0.29 O ATOM 830 CB VAL A 141 4.028 -3.239 -3.325 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.362 -3.795 -4.586 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.406 -4.393 -2.396 1.00 0.23 C ATOM 0 H VAL A 141 5.869 -4.394 -4.375 1.00 0.24 H new ATOM 0 HA VAL A 141 5.052 -1.605 -4.371 1.00 0.27 H new ATOM 0 HB VAL A 141 3.334 -2.578 -2.805 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.473 -4.362 -4.308 1.00 0.33 H new ATOM 0 HG12 VAL A 141 3.077 -2.971 -5.240 1.00 0.33 H new ATOM 0 HG13 VAL A 141 4.061 -4.448 -5.109 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.510 -4.952 -2.127 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.107 -5.055 -2.904 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.871 -3.996 -1.493 1.00 0.23 H new ATOM 842 N ARG A 142 6.673 -2.548 -1.697 1.00 0.21 N ATOM 843 CA ARG A 142 7.273 -1.986 -0.432 1.00 0.22 C ATOM 844 C ARG A 142 7.914 -0.608 -0.641 1.00 0.24 C ATOM 845 O ARG A 142 7.638 0.317 0.103 1.00 0.25 O ATOM 846 CB ARG A 142 8.332 -3.001 0.003 1.00 0.27 C ATOM 847 CG ARG A 142 7.687 -4.074 0.885 1.00 0.28 C ATOM 848 CD ARG A 142 8.745 -5.101 1.301 1.00 1.02 C ATOM 849 NE ARG A 142 9.709 -4.348 2.154 1.00 0.94 N ATOM 850 CZ ARG A 142 10.887 -4.852 2.408 1.00 1.48 C ATOM 851 NH1 ARG A 142 11.785 -4.919 1.463 1.00 2.10 N ATOM 852 NH2 ARG A 142 11.168 -5.289 3.606 1.00 2.24 N ATOM 0 H ARG A 142 6.908 -3.522 -1.887 1.00 0.21 H new ATOM 0 HA ARG A 142 6.498 -1.836 0.319 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.789 -3.462 -0.873 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.129 -2.498 0.550 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.244 -3.615 1.769 1.00 0.28 H new ATOM 0 HG3 ARG A 142 6.880 -4.567 0.344 1.00 0.28 H new ATOM 0 HD2 ARG A 142 8.296 -5.928 1.851 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.241 -5.529 0.430 1.00 1.02 H new ATOM 0 HE ARG A 142 9.449 -3.440 2.539 1.00 0.94 H new ATOM 0 HH11 ARG A 142 11.567 -4.578 0.527 1.00 2.10 H new ATOM 0 HH12 ARG A 142 12.705 -5.312 1.661 1.00 2.10 H new ATOM 0 HH21 ARG A 142 10.467 -5.237 4.345 1.00 2.24 H new ATOM 0 HH22 ARG A 142 12.088 -5.682 3.803 1.00 2.24 H new ATOM 866 N GLU A 143 8.754 -0.450 -1.631 1.00 0.26 N ATOM 867 CA GLU A 143 9.389 0.889 -1.856 1.00 0.31 C ATOM 868 C GLU A 143 8.305 1.935 -2.139 1.00 0.30 C ATOM 869 O GLU A 143 8.304 3.017 -1.578 1.00 0.31 O ATOM 870 CB GLU A 143 10.297 0.710 -3.070 1.00 0.36 C ATOM 871 CG GLU A 143 11.122 1.982 -3.281 1.00 0.44 C ATOM 872 CD GLU A 143 12.105 2.164 -2.118 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.455 1.173 -1.494 1.00 1.62 O ATOM 874 OE2 GLU A 143 12.499 3.292 -1.875 1.00 1.84 O ATOM 0 H GLU A 143 9.028 -1.180 -2.289 1.00 0.26 H new ATOM 0 HA GLU A 143 9.950 1.233 -0.987 1.00 0.31 H new ATOM 0 HB2 GLU A 143 10.957 -0.144 -2.921 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.699 0.500 -3.957 1.00 0.36 H new ATOM 0 HG2 GLU A 143 11.667 1.921 -4.223 1.00 0.44 H new ATOM 0 HG3 GLU A 143 10.462 2.847 -3.350 1.00 0.44 H new ATOM 881 N SER A 144 7.378 1.604 -2.998 1.00 0.29 N ATOM 882 CA SER A 144 6.271 2.554 -3.325 1.00 0.29 C ATOM 883 C SER A 144 5.444 2.849 -2.069 1.00 0.28 C ATOM 884 O SER A 144 5.031 3.971 -1.834 1.00 0.28 O ATOM 885 CB SER A 144 5.423 1.835 -4.375 1.00 0.29 C ATOM 886 OG SER A 144 6.152 1.758 -5.594 1.00 1.34 O ATOM 0 H SER A 144 7.339 0.712 -3.491 1.00 0.29 H new ATOM 0 HA SER A 144 6.642 3.511 -3.693 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.165 0.834 -4.028 1.00 0.29 H new ATOM 0 HB3 SER A 144 4.486 2.370 -4.531 1.00 0.29 H new ATOM 0 HG SER A 144 5.604 2.111 -6.326 1.00 1.34 H new ATOM 892 N LEU A 145 5.200 1.847 -1.262 1.00 0.27 N ATOM 893 CA LEU A 145 4.402 2.061 -0.019 1.00 0.28 C ATOM 894 C LEU A 145 5.199 2.883 0.995 1.00 0.30 C ATOM 895 O LEU A 145 4.643 3.685 1.717 1.00 0.30 O ATOM 896 CB LEU A 145 4.125 0.665 0.541 1.00 0.29 C ATOM 897 CG LEU A 145 2.817 0.122 -0.035 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.091 -0.587 -1.359 1.00 0.73 C ATOM 899 CD2 LEU A 145 2.191 -0.865 0.956 1.00 0.67 C ATOM 0 H LEU A 145 5.520 0.890 -1.412 1.00 0.27 H new ATOM 0 HA LEU A 145 3.481 2.607 -0.226 1.00 0.28 H new ATOM 0 HB2 LEU A 145 4.948 -0.006 0.293 1.00 0.29 H new ATOM 0 HB3 LEU A 145 4.064 0.706 1.629 1.00 0.29 H new ATOM 0 HG LEU A 145 2.129 0.950 -0.207 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.156 -0.972 -1.766 1.00 0.73 H new ATOM 0 HD12 LEU A 145 3.531 0.118 -2.065 1.00 0.73 H new ATOM 0 HD13 LEU A 145 3.782 -1.413 -1.193 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.259 -1.252 0.545 1.00 0.67 H new ATOM 0 HD22 LEU A 145 2.880 -1.691 1.131 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.988 -0.355 1.898 1.00 0.67 H new ATOM 911 N LYS A 146 6.490 2.674 1.064 1.00 0.33 N ATOM 912 CA LYS A 146 7.327 3.426 2.053 1.00 0.35 C ATOM 913 C LYS A 146 7.241 4.938 1.809 1.00 0.34 C ATOM 914 O LYS A 146 7.003 5.703 2.727 1.00 0.35 O ATOM 915 CB LYS A 146 8.757 2.924 1.831 1.00 0.41 C ATOM 916 CG LYS A 146 9.679 3.501 2.909 1.00 1.01 C ATOM 917 CD LYS A 146 11.107 2.996 2.684 1.00 1.15 C ATOM 918 CE LYS A 146 12.040 3.586 3.751 1.00 1.96 C ATOM 919 NZ LYS A 146 12.783 2.422 4.315 1.00 2.32 N ATOM 0 H LYS A 146 7.002 2.015 0.478 1.00 0.33 H new ATOM 0 HA LYS A 146 6.989 3.261 3.076 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.780 1.835 1.864 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.107 3.220 0.842 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.658 4.590 2.876 1.00 1.01 H new ATOM 0 HG3 LYS A 146 9.329 3.205 3.898 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.129 1.907 2.730 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.451 3.280 1.689 1.00 1.15 H new ATOM 0 HE2 LYS A 146 12.724 4.315 3.316 1.00 1.96 H new ATOM 0 HE3 LYS A 146 11.474 4.103 4.525 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 13.439 2.753 5.051 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 12.109 1.748 4.730 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 13.320 1.953 3.558 1.00 2.32 H new ATOM 933 N VAL A 147 7.437 5.383 0.593 1.00 0.32 N ATOM 934 CA VAL A 147 7.357 6.855 0.331 1.00 0.33 C ATOM 935 C VAL A 147 5.931 7.368 0.584 1.00 0.31 C ATOM 936 O VAL A 147 5.738 8.390 1.223 1.00 0.31 O ATOM 937 CB VAL A 147 7.781 7.058 -1.130 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.209 6.543 -1.319 1.00 0.40 C ATOM 939 CG2 VAL A 147 6.847 6.306 -2.081 1.00 0.36 C ATOM 0 H VAL A 147 7.646 4.802 -0.219 1.00 0.32 H new ATOM 0 HA VAL A 147 8.009 7.418 0.998 1.00 0.33 H new ATOM 0 HB VAL A 147 7.729 8.122 -1.359 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.513 6.686 -2.356 1.00 0.40 H new ATOM 0 HG12 VAL A 147 9.884 7.094 -0.664 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.249 5.482 -1.072 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.169 6.466 -3.110 1.00 0.36 H new ATOM 0 HG22 VAL A 147 6.877 5.240 -1.853 1.00 0.36 H new ATOM 0 HG23 VAL A 147 5.829 6.675 -1.958 1.00 0.36 H new ATOM 949 N TRP A 148 4.930 6.667 0.102 1.00 0.32 N ATOM 950 CA TRP A 148 3.522 7.119 0.331 1.00 0.33 C ATOM 951 C TRP A 148 3.221 7.152 1.845 1.00 0.32 C ATOM 952 O TRP A 148 2.714 8.134 2.352 1.00 0.32 O ATOM 953 CB TRP A 148 2.633 6.103 -0.440 1.00 0.36 C ATOM 954 CG TRP A 148 1.256 6.015 0.166 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.496 7.070 0.543 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.487 4.822 0.480 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.678 6.592 1.109 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.731 5.209 1.088 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.735 3.453 0.304 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.666 4.257 1.515 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.201 2.501 0.721 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.394 2.901 1.329 1.00 0.27 C ATOM 0 H TRP A 148 5.028 5.806 -0.437 1.00 0.32 H new ATOM 0 HA TRP A 148 3.333 8.131 -0.028 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.555 6.404 -1.485 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.103 5.120 -0.425 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.759 8.111 0.423 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.412 7.187 1.493 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.657 3.131 -0.158 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.588 4.569 1.983 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 -0.001 1.450 0.572 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.107 2.159 1.656 1.00 0.27 H new ATOM 973 N LYS A 149 3.514 6.089 2.565 1.00 0.36 N ATOM 974 CA LYS A 149 3.215 6.087 4.032 1.00 0.38 C ATOM 975 C LYS A 149 3.975 7.223 4.738 1.00 0.34 C ATOM 976 O LYS A 149 3.480 7.812 5.681 1.00 0.33 O ATOM 977 CB LYS A 149 3.615 4.695 4.566 1.00 0.52 C ATOM 978 CG LYS A 149 5.140 4.517 4.598 1.00 1.36 C ATOM 979 CD LYS A 149 5.492 3.276 5.422 1.00 2.07 C ATOM 980 CE LYS A 149 5.258 2.017 4.584 1.00 2.80 C ATOM 981 NZ LYS A 149 6.428 1.141 4.872 1.00 3.70 N ATOM 0 H LYS A 149 3.941 5.236 2.204 1.00 0.36 H new ATOM 0 HA LYS A 149 2.158 6.267 4.226 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.212 4.560 5.570 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.171 3.923 3.938 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.526 4.415 3.584 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.611 5.400 5.031 1.00 1.36 H new ATOM 0 HD2 LYS A 149 6.533 3.323 5.742 1.00 2.07 H new ATOM 0 HD3 LYS A 149 4.882 3.242 6.325 1.00 2.07 H new ATOM 0 HE2 LYS A 149 4.322 1.529 4.857 1.00 2.80 H new ATOM 0 HE3 LYS A 149 5.195 2.255 3.522 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 6.340 0.256 4.333 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 7.304 1.629 4.596 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 6.458 0.925 5.889 1.00 3.70 H new ATOM 995 N ASN A 150 5.169 7.539 4.286 1.00 0.37 N ATOM 996 CA ASN A 150 5.949 8.643 4.933 1.00 0.41 C ATOM 997 C ASN A 150 5.174 9.959 4.844 1.00 0.39 C ATOM 998 O ASN A 150 5.136 10.727 5.788 1.00 0.46 O ATOM 999 CB ASN A 150 7.260 8.736 4.148 1.00 0.50 C ATOM 1000 CG ASN A 150 8.138 9.846 4.735 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.089 10.974 4.287 1.00 1.86 O ATOM 1002 ND2 ASN A 150 8.941 9.574 5.726 1.00 1.27 N ATOM 0 H ASN A 150 5.634 7.082 3.501 1.00 0.37 H new ATOM 0 HA ASN A 150 6.129 8.449 5.990 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.787 7.783 4.188 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.052 8.941 3.098 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.527 10.308 6.124 1.00 1.27 H new ATOM 0 HD22 ASN A 150 8.983 8.627 6.103 1.00 1.27 H new ATOM 1009 N ALA A 151 4.552 10.222 3.722 1.00 0.38 N ATOM 1010 CA ALA A 151 3.776 11.491 3.585 1.00 0.49 C ATOM 1011 C ALA A 151 2.597 11.472 4.562 1.00 0.53 C ATOM 1012 O ALA A 151 2.328 12.441 5.246 1.00 0.72 O ATOM 1013 CB ALA A 151 3.278 11.508 2.138 1.00 0.57 C ATOM 0 H ALA A 151 4.548 9.617 2.901 1.00 0.38 H new ATOM 0 HA ALA A 151 4.374 12.374 3.809 1.00 0.49 H new ATOM 0 HB1 ALA A 151 2.698 12.414 1.963 1.00 0.57 H new ATOM 0 HB2 ALA A 151 4.131 11.487 1.459 1.00 0.57 H new ATOM 0 HB3 ALA A 151 2.650 10.635 1.959 1.00 0.57 H new ATOM 1019 N GLU A 152 1.903 10.366 4.635 1.00 0.40 N ATOM 1020 CA GLU A 152 0.742 10.256 5.572 1.00 0.50 C ATOM 1021 C GLU A 152 1.217 10.081 7.019 1.00 0.60 C ATOM 1022 O GLU A 152 2.084 9.274 7.301 1.00 1.48 O ATOM 1023 CB GLU A 152 -0.025 9.016 5.114 1.00 0.44 C ATOM 1024 CG GLU A 152 -1.090 9.424 4.095 1.00 0.77 C ATOM 1025 CD GLU A 152 -0.525 9.317 2.677 1.00 1.10 C ATOM 1026 OE1 GLU A 152 0.668 9.509 2.517 1.00 1.66 O ATOM 1027 OE2 GLU A 152 -1.298 9.042 1.774 1.00 1.81 O ATOM 0 H GLU A 152 2.091 9.529 4.083 1.00 0.40 H new ATOM 0 HA GLU A 152 0.126 11.155 5.553 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.661 8.294 4.670 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.492 8.528 5.969 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -1.966 8.783 4.196 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -1.418 10.445 4.289 1.00 0.77 H new ATOM 1034 N LYS A 153 0.640 10.815 7.940 1.00 0.76 N ATOM 1035 CA LYS A 153 1.041 10.675 9.373 1.00 0.67 C ATOM 1036 C LYS A 153 -0.061 9.934 10.155 1.00 0.64 C ATOM 1037 O LYS A 153 0.037 8.745 10.391 1.00 0.57 O ATOM 1038 CB LYS A 153 1.227 12.108 9.887 1.00 0.86 C ATOM 1039 CG LYS A 153 1.708 12.074 11.342 1.00 1.17 C ATOM 1040 CD LYS A 153 1.164 13.295 12.096 1.00 1.57 C ATOM 1041 CE LYS A 153 2.259 13.898 12.987 1.00 2.22 C ATOM 1042 NZ LYS A 153 2.424 15.297 12.502 1.00 2.51 N ATOM 0 H LYS A 153 -0.090 11.504 7.760 1.00 0.76 H new ATOM 0 HA LYS A 153 1.955 10.095 9.496 1.00 0.67 H new ATOM 0 HB2 LYS A 153 1.951 12.637 9.266 1.00 0.86 H new ATOM 0 HB3 LYS A 153 0.287 12.655 9.817 1.00 0.86 H new ATOM 0 HG2 LYS A 153 1.371 11.157 11.825 1.00 1.17 H new ATOM 0 HG3 LYS A 153 2.797 12.070 11.375 1.00 1.17 H new ATOM 0 HD2 LYS A 153 0.810 14.042 11.386 1.00 1.57 H new ATOM 0 HD3 LYS A 153 0.308 13.004 12.705 1.00 1.57 H new ATOM 0 HE2 LYS A 153 1.969 13.876 14.038 1.00 2.22 H new ATOM 0 HE3 LYS A 153 3.190 13.338 12.901 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 3.157 15.775 13.064 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 2.706 15.286 11.501 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 1.524 15.808 12.602 1.00 2.51 H new ATOM 1056 N LYS A 154 -1.111 10.620 10.552 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.214 9.942 11.311 1.00 0.77 C ATOM 1058 C LYS A 154 -2.987 8.993 10.390 1.00 0.62 C ATOM 1059 O LYS A 154 -3.330 7.872 10.756 1.00 0.60 O ATOM 1060 CB LYS A 154 -3.125 11.079 11.782 1.00 0.95 C ATOM 1061 CG LYS A 154 -2.401 11.901 12.847 1.00 1.29 C ATOM 1062 CD LYS A 154 -3.307 13.038 13.321 1.00 1.34 C ATOM 1063 CE LYS A 154 -2.579 13.860 14.387 1.00 2.02 C ATOM 1064 NZ LYS A 154 -3.549 14.915 14.788 1.00 2.51 N ATOM 0 H LYS A 154 -1.251 11.616 10.384 1.00 0.73 H new ATOM 0 HA LYS A 154 -1.835 9.345 12.141 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -3.397 11.714 10.939 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -4.052 10.673 12.188 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -2.128 11.265 13.689 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -1.474 12.306 12.440 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -3.580 13.675 12.479 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -4.233 12.633 13.728 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -2.295 13.240 15.238 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -1.662 14.297 13.991 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -3.122 15.520 15.518 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -3.795 15.493 13.959 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -4.409 14.470 15.168 1.00 2.51 H new ATOM 1078 N ASN A 155 -3.234 9.416 9.177 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.973 8.539 8.231 1.00 0.47 C ATOM 1080 C ASN A 155 -3.037 7.490 7.619 1.00 0.37 C ATOM 1081 O ASN A 155 -3.429 6.752 6.734 1.00 0.34 O ATOM 1082 CB ASN A 155 -4.582 9.468 7.174 1.00 0.51 C ATOM 1083 CG ASN A 155 -3.496 10.087 6.296 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -2.321 9.980 6.587 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -3.851 10.734 5.222 1.00 1.03 N ATOM 0 H ASN A 155 -2.957 10.325 8.806 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.759 7.973 8.731 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -5.281 8.908 6.553 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -5.152 10.257 7.664 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -3.141 11.153 4.621 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -4.839 10.821 4.982 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.823 7.362 8.130 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.917 6.301 7.616 1.00 0.33 C ATOM 1094 C ALA A 156 -1.520 4.942 7.981 1.00 0.28 C ATOM 1095 O ALA A 156 -1.110 3.921 7.462 1.00 0.28 O ATOM 1096 CB ALA A 156 0.411 6.481 8.358 1.00 0.41 C ATOM 0 H ALA A 156 -1.436 7.945 8.872 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.779 6.358 6.536 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.121 5.726 8.021 1.00 0.41 H new ATOM 0 HB2 ALA A 156 0.811 7.474 8.152 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.247 6.372 9.430 1.00 0.41 H new ATOM 1102 N SER A 157 -2.505 4.920 8.867 1.00 0.28 N ATOM 1103 CA SER A 157 -3.124 3.627 9.237 1.00 0.28 C ATOM 1104 C SER A 157 -4.163 3.237 8.188 1.00 0.22 C ATOM 1105 O SER A 157 -4.291 3.865 7.136 1.00 0.21 O ATOM 1106 CB SER A 157 -3.796 3.863 10.587 1.00 0.34 C ATOM 1107 OG SER A 157 -4.791 4.869 10.448 1.00 1.05 O ATOM 0 H SER A 157 -2.891 5.740 9.335 1.00 0.28 H new ATOM 0 HA SER A 157 -2.392 2.822 9.292 1.00 0.28 H new ATOM 0 HB2 SER A 157 -4.246 2.938 10.949 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.055 4.168 11.326 1.00 0.34 H new ATOM 0 HG SER A 157 -5.225 5.021 11.313 1.00 1.05 H new ATOM 1113 N VAL A 158 -4.880 2.186 8.450 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.886 1.715 7.466 1.00 0.22 C ATOM 1115 C VAL A 158 -6.937 2.786 7.180 1.00 0.18 C ATOM 1116 O VAL A 158 -7.230 3.036 6.041 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.529 0.474 8.079 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.457 -0.589 8.314 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.200 0.816 9.412 1.00 0.27 C ATOM 0 H VAL A 158 -4.813 1.632 9.304 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.415 1.491 6.509 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.286 0.097 7.391 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.914 -1.476 8.752 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.991 -0.852 7.364 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.700 -0.198 8.994 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.652 -0.082 9.833 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.454 1.206 10.105 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.972 1.568 9.248 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.499 3.429 8.189 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.549 4.488 7.943 1.00 0.13 C ATOM 1131 C ALA A 159 -8.153 5.399 6.782 1.00 0.13 C ATOM 1132 O ALA A 159 -8.986 5.814 5.992 1.00 0.15 O ATOM 1133 CB ALA A 159 -8.632 5.284 9.245 1.00 0.12 C ATOM 0 H ALA A 159 -7.277 3.267 9.171 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.507 4.045 7.672 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.377 6.073 9.142 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -8.918 4.619 10.060 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -7.661 5.728 9.463 1.00 0.12 H new ATOM 1139 N GLY A 160 -6.883 5.662 6.647 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.426 6.500 5.509 1.00 0.15 C ATOM 1141 C GLY A 160 -6.578 5.701 4.223 1.00 0.16 C ATOM 1142 O GLY A 160 -7.387 6.026 3.373 1.00 0.18 O ATOM 0 H GLY A 160 -6.147 5.334 7.273 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.013 7.417 5.456 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.386 6.795 5.650 1.00 0.15 H new ATOM 1146 N LEU A 161 -5.793 4.665 4.064 1.00 0.16 N ATOM 1147 CA LEU A 161 -5.881 3.853 2.812 1.00 0.18 C ATOM 1148 C LEU A 161 -7.278 3.210 2.613 1.00 0.20 C ATOM 1149 O LEU A 161 -7.790 3.213 1.513 1.00 0.28 O ATOM 1150 CB LEU A 161 -4.806 2.774 2.947 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.826 1.889 1.698 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.252 2.650 0.496 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.021 0.615 1.967 1.00 0.27 C ATOM 0 H LEU A 161 -5.100 4.348 4.742 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.729 4.486 1.938 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -3.825 3.233 3.067 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -4.987 2.172 3.838 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.855 1.616 1.464 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -4.273 2.008 -0.385 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.851 3.541 0.310 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.224 2.942 0.708 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.033 -0.017 1.079 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -2.992 0.879 2.210 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.464 0.075 2.804 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.884 2.624 3.632 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.217 1.958 3.417 1.00 0.26 C ATOM 1167 C VAL A 162 -10.224 2.956 2.874 1.00 0.29 C ATOM 1168 O VAL A 162 -10.984 2.649 1.973 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.668 1.391 4.771 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.615 0.412 5.293 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -9.895 2.504 5.801 1.00 0.31 C ATOM 0 H VAL A 162 -7.520 2.579 4.584 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.138 1.155 2.684 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.616 0.874 4.622 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.936 0.010 6.254 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.493 -0.404 4.581 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.665 0.931 5.416 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.213 2.065 6.747 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -8.967 3.056 5.951 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.666 3.183 5.438 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.213 4.154 3.380 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.152 5.187 2.851 1.00 0.34 C ATOM 1183 C LYS A 163 -10.861 5.419 1.361 1.00 0.36 C ATOM 1184 O LYS A 163 -11.734 5.352 0.522 1.00 0.39 O ATOM 1185 CB LYS A 163 -10.850 6.451 3.662 1.00 0.33 C ATOM 1186 CG LYS A 163 -11.786 7.585 3.231 1.00 0.39 C ATOM 1187 CD LYS A 163 -13.200 7.311 3.750 1.00 1.30 C ATOM 1188 CE LYS A 163 -14.112 8.490 3.396 1.00 1.51 C ATOM 1189 NZ LYS A 163 -14.138 9.341 4.620 1.00 2.30 N ATOM 0 H LYS A 163 -9.600 4.465 4.133 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.198 4.894 2.940 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -10.975 6.249 4.726 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -9.812 6.749 3.514 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.423 8.537 3.620 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -11.797 7.668 2.144 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -13.588 6.392 3.310 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -13.180 7.164 4.830 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -13.727 9.043 2.539 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -15.113 8.149 3.132 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -14.744 10.170 4.454 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -14.516 8.791 5.418 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -13.173 9.657 4.844 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.621 5.690 1.044 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.223 5.943 -0.379 1.00 0.39 C ATOM 1205 C ALA A 164 -9.324 4.690 -1.265 1.00 0.39 C ATOM 1206 O ALA A 164 -9.899 4.730 -2.336 1.00 0.33 O ATOM 1207 CB ALA A 164 -7.771 6.419 -0.308 1.00 0.44 C ATOM 0 H ALA A 164 -8.856 5.748 1.717 1.00 0.36 H new ATOM 0 HA ALA A 164 -9.893 6.672 -0.834 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.406 6.626 -1.314 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -7.715 7.327 0.292 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.156 5.644 0.149 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.717 3.599 -0.857 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.722 2.370 -1.713 1.00 0.55 C ATOM 1215 C LEU A 165 -10.144 1.886 -2.049 1.00 0.45 C ATOM 1216 O LEU A 165 -10.430 1.577 -3.191 1.00 0.42 O ATOM 1217 CB LEU A 165 -7.879 1.307 -0.951 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.624 0.684 0.251 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -9.611 -0.391 -0.222 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -7.598 0.022 1.190 1.00 1.24 C ATOM 0 H LEU A 165 -8.220 3.507 0.029 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.283 2.575 -2.690 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.594 0.515 -1.643 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -6.957 1.769 -0.598 1.00 0.80 H new ATOM 0 HG LEU A 165 -9.171 1.472 0.768 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -10.125 -0.817 0.639 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -10.342 0.057 -0.896 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -9.068 -1.178 -0.746 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -8.116 -0.420 2.041 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -7.059 -0.756 0.649 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -6.892 0.773 1.545 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.027 1.792 -1.091 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.406 1.296 -1.403 1.00 0.45 C ATOM 1234 C ARG A 166 -13.196 2.322 -2.219 1.00 0.41 C ATOM 1235 O ARG A 166 -13.922 1.967 -3.129 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.059 1.016 -0.046 1.00 0.52 C ATOM 1237 CG ARG A 166 -14.480 0.489 -0.257 1.00 1.19 C ATOM 1238 CD ARG A 166 -15.097 0.132 1.097 1.00 1.53 C ATOM 1239 NE ARG A 166 -16.464 -0.365 0.778 1.00 2.29 N ATOM 1240 CZ ARG A 166 -17.386 -0.372 1.700 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -17.465 -1.372 2.535 1.00 3.60 N ATOM 1242 NH2 ARG A 166 -18.227 0.621 1.787 1.00 3.25 N ATOM 0 H ARG A 166 -10.859 2.034 -0.114 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.382 0.397 -2.019 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -12.469 0.287 0.509 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -13.084 1.927 0.552 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -15.088 1.242 -0.759 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.462 -0.389 -0.903 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -14.510 -0.630 1.610 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -15.136 1.001 1.754 1.00 1.53 H new ATOM 0 HE ARG A 166 -16.679 -0.700 -0.161 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -16.806 -2.147 2.466 1.00 3.60 H new ATOM 0 HH12 ARG A 166 -18.186 -1.378 3.257 1.00 3.60 H new ATOM 0 HH21 ARG A 166 -18.163 1.402 1.134 1.00 3.25 H new ATOM 0 HH22 ARG A 166 -18.949 0.616 2.508 1.00 3.25 H new ATOM 1256 N THR A 167 -13.067 3.583 -1.904 1.00 0.33 N ATOM 1257 CA THR A 167 -13.821 4.627 -2.666 1.00 0.36 C ATOM 1258 C THR A 167 -13.437 4.595 -4.141 1.00 0.35 C ATOM 1259 O THR A 167 -14.273 4.768 -5.010 1.00 0.41 O ATOM 1260 CB THR A 167 -13.404 5.960 -2.042 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.766 5.969 -0.669 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.093 7.126 -2.759 1.00 0.47 C ATOM 0 H THR A 167 -12.474 3.937 -1.154 1.00 0.33 H new ATOM 0 HA THR A 167 -14.898 4.467 -2.613 1.00 0.36 H new ATOM 0 HB THR A 167 -12.325 6.075 -2.143 1.00 0.42 H new ATOM 0 HG1 THR A 167 -12.966 6.109 -0.121 1.00 0.44 H new ATOM 0 HG21 THR A 167 -13.785 8.067 -2.302 1.00 0.47 H new ATOM 0 HG22 THR A 167 -13.810 7.124 -3.812 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.174 7.018 -2.674 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.182 4.405 -4.426 1.00 0.32 N ATOM 1271 CA CYS A 168 -11.742 4.394 -5.846 1.00 0.36 C ATOM 1272 C CYS A 168 -12.091 3.069 -6.525 1.00 0.31 C ATOM 1273 O CYS A 168 -12.778 3.056 -7.528 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.224 4.576 -5.790 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.836 6.325 -5.532 1.00 1.38 S ATOM 0 H CYS A 168 -11.443 4.257 -3.739 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.236 5.175 -6.424 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -9.805 3.976 -4.982 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -9.770 4.225 -6.717 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.546 6.481 -5.482 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.632 1.954 -5.990 1.00 0.30 N ATOM 1282 CA ARG A 169 -11.948 0.617 -6.641 1.00 0.31 C ATOM 1283 C ARG A 169 -11.345 -0.589 -5.896 1.00 0.26 C ATOM 1284 O ARG A 169 -11.663 -1.722 -6.205 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.329 0.672 -8.047 1.00 0.44 C ATOM 1286 CG ARG A 169 -11.835 -0.513 -8.870 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.323 -0.390 -10.307 1.00 0.84 C ATOM 1288 NE ARG A 169 -12.055 0.776 -10.883 1.00 1.56 N ATOM 1289 CZ ARG A 169 -11.934 1.062 -12.150 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -12.611 0.387 -13.039 1.00 2.73 N ATOM 1291 NH2 ARG A 169 -11.138 2.024 -12.529 1.00 2.74 N ATOM 0 H ARG A 169 -11.062 1.904 -5.146 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.029 0.474 -6.638 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.594 1.609 -8.537 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.241 0.644 -7.979 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.492 -1.449 -8.429 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -12.925 -0.537 -8.861 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -10.245 -0.229 -10.329 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -11.521 -1.299 -10.875 1.00 0.84 H new ATOM 0 HE ARG A 169 -12.650 1.350 -10.286 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -13.235 -0.364 -12.743 1.00 2.73 H new ATOM 0 HH12 ARG A 169 -12.516 0.611 -14.030 1.00 2.73 H new ATOM 0 HH21 ARG A 169 -10.610 2.553 -11.834 1.00 2.74 H new ATOM 0 HH22 ARG A 169 -11.044 2.247 -13.520 1.00 2.74 H new ATOM 1305 N LEU A 170 -10.444 -0.372 -4.977 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.774 -1.519 -4.279 1.00 0.17 C ATOM 1307 C LEU A 170 -10.664 -2.150 -3.196 1.00 0.19 C ATOM 1308 O LEU A 170 -10.268 -2.305 -2.059 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.529 -0.880 -3.661 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.616 -0.343 -4.776 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.626 1.192 -4.775 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.185 -0.827 -4.538 1.00 0.25 C ATOM 0 H LEU A 170 -10.138 0.553 -4.675 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.549 -2.338 -4.962 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.818 -0.069 -2.992 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -7.992 -1.613 -3.059 1.00 0.18 H new ATOM 0 HG LEU A 170 -7.982 -0.707 -5.736 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -6.976 1.561 -5.569 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.642 1.549 -4.943 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.267 1.558 -3.813 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.536 -0.447 -5.327 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.833 -0.462 -3.573 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.164 -1.917 -4.544 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.857 -2.540 -3.548 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.775 -3.176 -2.551 1.00 0.30 C ATOM 1326 C ASN A 171 -12.115 -4.400 -1.899 1.00 0.24 C ATOM 1327 O ASN A 171 -12.410 -4.743 -0.770 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.986 -3.614 -3.371 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.242 -3.525 -2.511 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.782 -4.527 -2.086 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.731 -2.349 -2.242 1.00 0.59 N ATOM 0 H ASN A 171 -12.242 -2.447 -4.488 1.00 0.24 H new ATOM 0 HA ASN A 171 -13.034 -2.492 -1.743 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.090 -2.981 -4.252 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.848 -4.635 -3.727 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.572 -2.265 -1.671 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.273 -1.512 -2.602 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.248 -5.075 -2.614 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.594 -6.300 -2.045 1.00 0.21 C ATOM 1340 C LEU A 172 -9.846 -5.994 -0.748 1.00 0.17 C ATOM 1341 O LEU A 172 -10.186 -6.500 0.305 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.585 -6.755 -3.101 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.287 -7.618 -4.149 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -11.122 -6.731 -5.074 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -9.238 -8.370 -4.971 1.00 0.85 C ATOM 0 H LEU A 172 -10.964 -4.834 -3.564 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.344 -7.056 -1.813 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -9.127 -5.888 -3.578 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.781 -7.321 -2.630 1.00 0.23 H new ATOM 0 HG LEU A 172 -10.942 -8.332 -3.650 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -11.621 -7.350 -5.820 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -11.869 -6.196 -4.488 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -10.472 -6.014 -5.575 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -9.736 -8.987 -5.719 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -8.583 -7.654 -5.468 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -8.647 -9.006 -4.312 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.828 -5.175 -0.814 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.045 -4.859 0.420 1.00 0.21 C ATOM 1359 C VAL A 173 -8.942 -4.219 1.477 1.00 0.22 C ATOM 1360 O VAL A 173 -8.745 -4.420 2.662 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.910 -3.917 -0.006 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.878 -4.711 -0.812 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.439 -2.759 -0.861 1.00 0.34 C ATOM 0 H VAL A 173 -8.506 -4.713 -1.664 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.636 -5.763 0.872 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.454 -3.498 0.891 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.068 -4.049 -1.119 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.476 -5.515 -0.196 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.355 -5.135 -1.696 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.611 -2.110 -1.147 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.915 -3.156 -1.758 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.168 -2.186 -0.287 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.945 -3.482 1.068 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.874 -2.870 2.073 1.00 0.34 C ATOM 1375 C ALA A 174 -11.533 -3.987 2.896 1.00 0.29 C ATOM 1376 O ALA A 174 -11.677 -3.891 4.098 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.926 -2.127 1.249 1.00 0.43 C ATOM 0 H ALA A 174 -10.161 -3.278 0.092 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.362 -2.202 2.766 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.643 -1.652 1.918 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.439 -1.366 0.639 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.446 -2.833 0.602 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.931 -5.047 2.242 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.570 -6.191 2.963 1.00 0.23 C ATOM 1385 C ASP A 175 -11.611 -6.810 3.983 1.00 0.17 C ATOM 1386 O ASP A 175 -12.016 -7.184 5.066 1.00 0.20 O ATOM 1387 CB ASP A 175 -12.915 -7.211 1.874 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.058 -6.681 1.002 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -14.830 -5.870 1.489 1.00 0.99 O ATOM 1390 OD2 ASP A 175 -14.145 -7.101 -0.140 1.00 0.80 O ATOM 0 H ASP A 175 -11.841 -5.171 1.234 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.448 -5.867 3.521 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.038 -7.408 1.258 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.204 -8.158 2.330 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.351 -6.951 3.638 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.382 -7.588 4.595 1.00 0.20 C ATOM 1397 C LEU A 176 -9.245 -6.749 5.865 1.00 0.25 C ATOM 1398 O LEU A 176 -9.490 -7.221 6.960 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.027 -7.644 3.860 1.00 0.28 C ATOM 1400 CG LEU A 176 -7.955 -8.776 2.796 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.293 -8.996 2.076 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -6.894 -8.397 1.757 1.00 1.09 C ATOM 0 H LEU A 176 -9.953 -6.657 2.746 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.724 -8.579 4.893 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.844 -6.685 3.374 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.230 -7.789 4.590 1.00 0.28 H new ATOM 0 HG LEU A 176 -7.704 -9.703 3.312 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -9.185 -9.797 1.345 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.057 -9.269 2.804 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -9.588 -8.078 1.568 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -6.829 -9.180 1.001 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -7.170 -7.456 1.282 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -5.927 -8.285 2.248 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.856 -5.509 5.725 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.702 -4.630 6.923 1.00 0.41 C ATOM 1416 C VAL A 177 -10.055 -4.463 7.621 1.00 0.37 C ATOM 1417 O VAL A 177 -10.125 -4.314 8.827 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.181 -3.285 6.394 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.805 -3.488 5.757 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.145 -2.717 5.348 1.00 0.52 C ATOM 0 H VAL A 177 -8.638 -5.066 4.832 1.00 0.33 H new ATOM 0 HA VAL A 177 -8.014 -5.051 7.657 1.00 0.41 H new ATOM 0 HB VAL A 177 -8.105 -2.584 7.225 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.434 -2.535 5.381 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.113 -3.878 6.503 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.887 -4.196 4.932 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.764 -1.764 4.981 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.233 -3.416 4.517 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.125 -2.566 5.800 1.00 0.52 H new ATOM 1430 N GLU A 178 -11.127 -4.494 6.870 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.483 -4.345 7.484 1.00 0.39 C ATOM 1432 C GLU A 178 -12.763 -5.492 8.467 1.00 0.31 C ATOM 1433 O GLU A 178 -12.979 -5.276 9.646 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.444 -4.412 6.287 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.898 -4.510 6.760 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.841 -4.357 5.564 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -15.468 -4.778 4.481 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.924 -3.828 5.754 1.00 1.85 O ATOM 0 H GLU A 178 -11.122 -4.616 5.857 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.585 -3.422 8.054 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.319 -3.526 5.664 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.200 -5.275 5.667 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -15.068 -5.469 7.249 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -15.103 -3.735 7.499 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.764 -6.705 7.978 1.00 0.25 N ATOM 1446 CA GLU A 179 -13.048 -7.874 8.863 1.00 0.24 C ATOM 1447 C GLU A 179 -11.974 -7.993 9.947 1.00 0.25 C ATOM 1448 O GLU A 179 -12.232 -8.468 11.037 1.00 0.39 O ATOM 1449 CB GLU A 179 -13.062 -9.091 7.925 1.00 0.31 C ATOM 1450 CG GLU A 179 -11.671 -9.321 7.320 1.00 1.03 C ATOM 1451 CD GLU A 179 -11.702 -10.540 6.386 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -12.607 -11.351 6.518 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -10.822 -10.636 5.547 1.00 1.92 O ATOM 0 H GLU A 179 -12.580 -6.937 7.002 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.995 -7.781 9.394 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -13.377 -9.978 8.475 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -13.790 -8.935 7.129 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -11.355 -8.436 6.767 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -10.941 -9.479 8.114 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.779 -7.553 9.655 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.685 -7.623 10.668 1.00 0.38 C ATOM 1462 C ALA A 180 -9.994 -6.684 11.839 1.00 0.44 C ATOM 1463 O ALA A 180 -9.753 -7.011 12.986 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.422 -7.168 9.934 1.00 0.50 C ATOM 0 H ALA A 180 -10.513 -7.148 8.758 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.571 -8.625 11.081 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.574 -7.194 10.618 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.230 -7.834 9.093 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.561 -6.151 9.567 1.00 0.50 H new ATOM 1470 N GLN A 181 -10.526 -5.520 11.555 1.00 0.48 N ATOM 1471 CA GLN A 181 -10.853 -4.554 12.651 1.00 0.70 C ATOM 1472 C GLN A 181 -12.032 -5.057 13.485 1.00 0.71 C ATOM 1473 O GLN A 181 -12.118 -4.792 14.668 1.00 1.08 O ATOM 1474 CB GLN A 181 -11.210 -3.239 11.951 1.00 1.25 C ATOM 1475 CG GLN A 181 -9.994 -2.308 11.956 1.00 1.59 C ATOM 1476 CD GLN A 181 -9.109 -2.602 10.744 1.00 2.23 C ATOM 1477 OE1 GLN A 181 -9.106 -1.857 9.784 1.00 2.65 O ATOM 1478 NE2 GLN A 181 -8.351 -3.664 10.748 1.00 2.46 N ATOM 0 H GLN A 181 -10.748 -5.197 10.613 1.00 0.48 H new ATOM 0 HA GLN A 181 -10.015 -4.431 13.337 1.00 0.70 H new ATOM 0 HB2 GLN A 181 -11.527 -3.435 10.927 1.00 1.25 H new ATOM 0 HB3 GLN A 181 -12.048 -2.761 12.458 1.00 1.25 H new ATOM 0 HG2 GLN A 181 -10.321 -1.268 11.935 1.00 1.59 H new ATOM 0 HG3 GLN A 181 -9.424 -2.445 12.875 1.00 1.59 H new ATOM 0 HE21 GLN A 181 -8.354 -4.289 11.554 1.00 2.46 H new ATOM 0 HE22 GLN A 181 -7.756 -3.869 9.945 1.00 2.46 H new ATOM 1487 N GLU A 182 -12.943 -5.781 12.878 1.00 0.74 N ATOM 1488 CA GLU A 182 -14.130 -6.311 13.632 1.00 1.33 C ATOM 1489 C GLU A 182 -14.865 -5.170 14.348 1.00 2.14 C ATOM 1490 O GLU A 182 -15.277 -5.302 15.485 1.00 2.63 O ATOM 1491 CB GLU A 182 -13.557 -7.304 14.650 1.00 1.79 C ATOM 1492 CG GLU A 182 -12.821 -8.426 13.914 1.00 2.06 C ATOM 1493 CD GLU A 182 -12.241 -9.410 14.931 1.00 2.67 C ATOM 1494 OE1 GLU A 182 -11.162 -9.144 15.434 1.00 3.67 O ATOM 1495 OE2 GLU A 182 -12.885 -10.413 15.189 1.00 2.49 O ATOM 0 H GLU A 182 -12.917 -6.030 11.889 1.00 0.74 H new ATOM 0 HA GLU A 182 -14.853 -6.785 12.968 1.00 1.33 H new ATOM 0 HB2 GLU A 182 -12.875 -6.792 15.329 1.00 1.79 H new ATOM 0 HB3 GLU A 182 -14.360 -7.720 15.259 1.00 1.79 H new ATOM 0 HG2 GLU A 182 -13.505 -8.943 13.241 1.00 2.06 H new ATOM 0 HG3 GLU A 182 -12.023 -8.010 13.299 1.00 2.06 H new ATOM 1502 N SER A 183 -15.026 -4.046 13.688 1.00 2.57 N ATOM 1503 CA SER A 183 -15.727 -2.876 14.313 1.00 3.70 C ATOM 1504 C SER A 183 -15.073 -2.507 15.651 1.00 4.04 C ATOM 1505 O SER A 183 -14.162 -1.696 15.637 1.00 4.36 O ATOM 1506 CB SER A 183 -17.177 -3.325 14.526 1.00 4.22 C ATOM 1507 OG SER A 183 -17.899 -3.174 13.311 1.00 4.75 O ATOM 1508 OXT SER A 183 -15.493 -3.042 16.664 1.00 4.26 O ATOM 0 H SER A 183 -14.699 -3.888 12.735 1.00 2.57 H new ATOM 0 HA SER A 183 -15.671 -1.990 13.680 1.00 3.70 H new ATOM 0 HB2 SER A 183 -17.204 -4.365 14.851 1.00 4.22 H new ATOM 0 HB3 SER A 183 -17.641 -2.732 15.314 1.00 4.22 H new ATOM 0 HG SER A 183 -18.826 -3.462 13.444 1.00 4.75 H new TER 1514 SER A 183