USER MOD reduce.3.24.130724 H: found=0, std=0, add=740, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 741 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 163 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.168) USER MOD Set 1.2: A 167 THR OG1 : rot 119:sc= 1.12 USER MOD Set 2.1: A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 133 TYR OH : rot -81:sc= 0.128 USER MOD Single : A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 CYS SG : rot 180:sc= -4.15! USER MOD Single : A 107 ASN : amide:sc= -4.85! C(o=-4.8!,f=-5.5!) USER MOD Single : A 113 LYS NZ :NH3+ -128:sc= -0.886 (180deg=-1.04) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 170:sc=-0.000456 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl -118:sc= -0.0549 (180deg=-0.449) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= -0.236 USER MOD Single : A 144 SER OG : rot -39:sc= -0.154 USER MOD Single : A 146 LYS NZ :NH3+ -153:sc= -0.0739 (180deg=-0.829) USER MOD Single : A 149 LYS NZ :NH3+ -159:sc= -2.01 (180deg=-2.99!) USER MOD Single : A 150 ASN : amide:sc= -1.79! K(o=-1.8!,f=-0.021) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.423) USER MOD Single : A 155 ASN : amide:sc= -1.15 K(o=-1.1,f=-4.2!) USER MOD Single : A 157 SER OG : rot 180:sc= 0.0992 USER MOD Single : A 168 CYS SG : rot 92:sc= 0.285 USER MOD Single : A 171 ASN : amide:sc= -0.269 X(o=-0.27,f=0) USER MOD ----------------------------------------------------------------- ATOM 11 N ALA A 90 8.626 9.013 10.412 1.00 0.96 N ATOM 12 CA ALA A 90 7.488 8.366 9.697 1.00 0.72 C ATOM 13 C ALA A 90 6.345 8.168 10.689 1.00 0.58 C ATOM 14 O ALA A 90 6.469 8.568 11.832 1.00 1.23 O ATOM 15 CB ALA A 90 8.039 7.025 9.203 1.00 1.03 C ATOM 0 HA ALA A 90 7.102 8.955 8.865 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.259 6.487 8.665 1.00 1.03 H new ATOM 0 HB2 ALA A 90 8.883 7.202 8.537 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.368 6.430 10.055 1.00 1.03 H new ATOM 21 N PRO A 91 5.258 7.571 10.250 1.00 0.79 N ATOM 22 CA PRO A 91 4.124 7.367 11.176 1.00 1.10 C ATOM 23 C PRO A 91 4.554 6.415 12.299 1.00 0.60 C ATOM 24 O PRO A 91 4.811 5.254 12.051 1.00 0.91 O ATOM 25 CB PRO A 91 3.034 6.769 10.294 1.00 1.98 C ATOM 26 CG PRO A 91 3.767 6.154 9.150 1.00 2.18 C ATOM 27 CD PRO A 91 4.971 7.025 8.910 1.00 1.62 C ATOM 0 HA PRO A 91 3.778 8.276 11.667 1.00 1.10 H new ATOM 0 HB2 PRO A 91 2.450 6.025 10.836 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.337 7.534 9.952 1.00 1.98 H new ATOM 0 HG2 PRO A 91 4.065 5.132 9.383 1.00 2.18 H new ATOM 0 HG3 PRO A 91 3.136 6.108 8.262 1.00 2.18 H new ATOM 0 HD2 PRO A 91 5.812 6.452 8.519 1.00 1.62 H new ATOM 0 HD3 PRO A 91 4.760 7.815 8.189 1.00 1.62 H new ATOM 35 N PRO A 92 4.641 6.935 13.507 1.00 0.59 N ATOM 36 CA PRO A 92 5.073 6.098 14.651 1.00 0.84 C ATOM 37 C PRO A 92 4.134 4.901 14.836 1.00 0.71 C ATOM 38 O PRO A 92 4.530 3.879 15.363 1.00 0.83 O ATOM 39 CB PRO A 92 5.061 7.067 15.837 1.00 1.49 C ATOM 40 CG PRO A 92 4.141 8.162 15.418 1.00 1.64 C ATOM 41 CD PRO A 92 4.343 8.311 13.932 1.00 1.21 C ATOM 0 HA PRO A 92 6.057 5.649 14.518 1.00 0.84 H new ATOM 0 HB2 PRO A 92 4.708 6.578 16.745 1.00 1.49 H new ATOM 0 HB3 PRO A 92 6.060 7.448 16.048 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.105 7.915 15.650 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.372 9.090 15.941 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.453 8.703 13.440 1.00 1.21 H new ATOM 0 HD3 PRO A 92 5.162 8.993 13.701 1.00 1.21 H new ATOM 49 N GLY A 93 2.906 5.002 14.374 1.00 0.65 N ATOM 50 CA GLY A 93 1.962 3.842 14.492 1.00 0.71 C ATOM 51 C GLY A 93 2.099 2.891 13.287 1.00 0.58 C ATOM 52 O GLY A 93 1.125 2.322 12.829 1.00 0.58 O ATOM 0 H GLY A 93 2.520 5.832 13.924 1.00 0.65 H new ATOM 0 HA2 GLY A 93 2.164 3.297 15.414 1.00 0.71 H new ATOM 0 HA3 GLY A 93 0.937 4.208 14.556 1.00 0.71 H new ATOM 56 N GLU A 94 3.291 2.716 12.770 1.00 0.56 N ATOM 57 CA GLU A 94 3.490 1.806 11.594 1.00 0.55 C ATOM 58 C GLU A 94 3.123 0.362 11.949 1.00 0.49 C ATOM 59 O GLU A 94 2.815 -0.428 11.080 1.00 0.53 O ATOM 60 CB GLU A 94 4.986 1.899 11.267 1.00 0.66 C ATOM 61 CG GLU A 94 5.317 1.001 10.067 1.00 1.09 C ATOM 62 CD GLU A 94 6.828 1.015 9.787 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.526 1.828 10.373 1.00 1.62 O ATOM 64 OE2 GLU A 94 7.262 0.201 8.987 1.00 1.44 O ATOM 0 H GLU A 94 4.140 3.166 13.113 1.00 0.56 H new ATOM 0 HA GLU A 94 2.859 2.095 10.754 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.255 2.932 11.044 1.00 0.66 H new ATOM 0 HB3 GLU A 94 5.576 1.596 12.132 1.00 0.66 H new ATOM 0 HG2 GLU A 94 4.987 -0.019 10.266 1.00 1.09 H new ATOM 0 HG3 GLU A 94 4.774 1.345 9.187 1.00 1.09 H new ATOM 71 N ALA A 95 3.187 0.000 13.204 1.00 0.49 N ATOM 72 CA ALA A 95 2.871 -1.411 13.586 1.00 0.50 C ATOM 73 C ALA A 95 1.459 -1.796 13.147 1.00 0.38 C ATOM 74 O ALA A 95 1.270 -2.789 12.468 1.00 0.36 O ATOM 75 CB ALA A 95 2.989 -1.460 15.112 1.00 0.61 C ATOM 0 H ALA A 95 3.442 0.615 13.977 1.00 0.49 H new ATOM 0 HA ALA A 95 3.549 -2.114 13.102 1.00 0.50 H new ATOM 0 HB1 ALA A 95 2.770 -2.469 15.462 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.002 -1.186 15.408 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.280 -0.760 15.554 1.00 0.61 H new ATOM 81 N TYR A 96 0.469 -1.020 13.510 1.00 0.38 N ATOM 82 CA TYR A 96 -0.925 -1.355 13.089 1.00 0.35 C ATOM 83 C TYR A 96 -1.023 -1.297 11.567 1.00 0.28 C ATOM 84 O TYR A 96 -1.543 -2.191 10.923 1.00 0.29 O ATOM 85 CB TYR A 96 -1.826 -0.296 13.725 1.00 0.42 C ATOM 86 CG TYR A 96 -3.263 -0.744 13.605 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.899 -0.733 12.357 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.959 -1.177 14.741 1.00 1.54 C ATOM 89 CE1 TYR A 96 -5.228 -1.157 12.246 1.00 1.85 C ATOM 90 CE2 TYR A 96 -5.288 -1.599 14.629 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.923 -1.590 13.381 1.00 1.77 C ATOM 92 OH TYR A 96 -7.233 -2.007 13.271 1.00 2.32 O ATOM 0 H TYR A 96 0.564 -0.176 14.075 1.00 0.38 H new ATOM 0 HA TYR A 96 -1.218 -2.357 13.403 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.561 -0.155 14.773 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -1.687 0.665 13.229 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -3.364 -0.397 11.481 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -3.469 -1.185 15.704 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.718 -1.150 11.284 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -5.824 -1.932 15.505 1.00 1.93 H new ATOM 0 HH TYR A 96 -7.566 -2.276 14.153 1.00 2.32 H new ATOM 102 N LEU A 97 -0.519 -0.235 10.996 1.00 0.42 N ATOM 103 CA LEU A 97 -0.564 -0.073 9.516 1.00 0.55 C ATOM 104 C LEU A 97 0.184 -1.223 8.840 1.00 0.43 C ATOM 105 O LEU A 97 -0.236 -1.726 7.816 1.00 0.35 O ATOM 106 CB LEU A 97 0.123 1.266 9.231 1.00 0.90 C ATOM 107 CG LEU A 97 0.056 1.571 7.733 1.00 0.94 C ATOM 108 CD1 LEU A 97 -1.410 1.705 7.301 1.00 1.33 C ATOM 109 CD2 LEU A 97 0.790 2.884 7.446 1.00 1.75 C ATOM 0 H LEU A 97 -0.074 0.533 11.498 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.584 -0.087 9.131 1.00 0.55 H new ATOM 0 HB2 LEU A 97 -0.362 2.062 9.796 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.162 1.230 9.559 1.00 0.90 H new ATOM 0 HG LEU A 97 0.527 0.760 7.178 1.00 0.94 H new ATOM 0 HD11 LEU A 97 -1.456 1.922 6.234 1.00 1.33 H new ATOM 0 HD12 LEU A 97 -1.936 0.772 7.505 1.00 1.33 H new ATOM 0 HD13 LEU A 97 -1.881 2.516 7.857 1.00 1.33 H new ATOM 0 HD21 LEU A 97 0.743 3.102 6.379 1.00 1.75 H new ATOM 0 HD22 LEU A 97 0.318 3.694 8.003 1.00 1.75 H new ATOM 0 HD23 LEU A 97 1.832 2.792 7.752 1.00 1.75 H new ATOM 121 N GLN A 98 1.295 -1.642 9.402 1.00 0.47 N ATOM 122 CA GLN A 98 2.068 -2.762 8.780 1.00 0.49 C ATOM 123 C GLN A 98 1.199 -4.023 8.710 1.00 0.38 C ATOM 124 O GLN A 98 1.217 -4.737 7.724 1.00 0.39 O ATOM 125 CB GLN A 98 3.271 -2.990 9.697 1.00 0.63 C ATOM 126 CG GLN A 98 4.232 -3.984 9.040 1.00 0.57 C ATOM 127 CD GLN A 98 5.515 -4.083 9.871 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.611 -4.897 10.769 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.511 -3.283 9.605 1.00 2.04 N ATOM 0 H GLN A 98 1.696 -1.259 10.258 1.00 0.47 H new ATOM 0 HA GLN A 98 2.380 -2.528 7.762 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.781 -2.046 9.887 1.00 0.63 H new ATOM 0 HB3 GLN A 98 2.939 -3.373 10.662 1.00 0.63 H new ATOM 0 HG2 GLN A 98 3.761 -4.964 8.962 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.467 -3.662 8.026 1.00 0.57 H new ATOM 0 HE21 GLN A 98 6.430 -2.600 8.851 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.371 -3.340 10.151 1.00 2.04 H new ATOM 138 N VAL A 99 0.422 -4.298 9.737 1.00 0.33 N ATOM 139 CA VAL A 99 -0.458 -5.511 9.700 1.00 0.31 C ATOM 140 C VAL A 99 -1.426 -5.391 8.516 1.00 0.24 C ATOM 141 O VAL A 99 -1.568 -6.305 7.722 1.00 0.30 O ATOM 142 CB VAL A 99 -1.207 -5.512 11.039 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.264 -6.623 11.052 1.00 0.43 C ATOM 144 CG2 VAL A 99 -0.207 -5.753 12.170 1.00 0.43 C ATOM 0 H VAL A 99 0.361 -3.740 10.589 1.00 0.33 H new ATOM 0 HA VAL A 99 0.099 -6.439 9.569 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.701 -4.550 11.175 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.789 -6.614 12.007 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.977 -6.457 10.244 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.778 -7.589 10.914 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.732 -5.755 13.125 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.283 -6.715 12.023 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.541 -4.961 12.169 1.00 0.43 H new ATOM 154 N ALA A 100 -2.074 -4.257 8.382 1.00 0.18 N ATOM 155 CA ALA A 100 -3.010 -4.066 7.234 1.00 0.18 C ATOM 156 C ALA A 100 -2.220 -4.148 5.930 1.00 0.14 C ATOM 157 O ALA A 100 -2.594 -4.847 5.016 1.00 0.14 O ATOM 158 CB ALA A 100 -3.609 -2.671 7.421 1.00 0.24 C ATOM 0 H ALA A 100 -1.994 -3.461 9.015 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.792 -4.825 7.196 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.308 -2.464 6.611 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.135 -2.626 8.375 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.811 -1.928 7.411 1.00 0.24 H new ATOM 164 N PHE A 101 -1.107 -3.460 5.865 1.00 0.15 N ATOM 165 CA PHE A 101 -0.244 -3.504 4.639 1.00 0.16 C ATOM 166 C PHE A 101 0.165 -4.940 4.322 1.00 0.17 C ATOM 167 O PHE A 101 0.552 -5.234 3.222 1.00 0.20 O ATOM 168 CB PHE A 101 1.006 -2.681 4.996 1.00 0.19 C ATOM 169 CG PHE A 101 0.768 -1.173 4.898 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.510 -0.629 4.650 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.859 -0.310 5.073 1.00 1.10 C ATOM 172 CE1 PHE A 101 -0.680 0.756 4.581 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.682 1.076 5.003 1.00 1.10 C ATOM 174 CZ PHE A 101 0.414 1.608 4.760 1.00 0.43 C ATOM 0 H PHE A 101 -0.755 -2.864 6.614 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.768 -3.114 3.766 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.323 -2.930 6.009 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.822 -2.960 4.330 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.358 -1.284 4.513 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.841 -0.717 5.263 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -1.659 1.170 4.389 1.00 1.26 H new ATOM 0 HE2 PHE A 101 2.527 1.735 5.137 1.00 1.10 H new ATOM 0 HZ PHE A 101 0.278 2.678 4.710 1.00 0.43 H new ATOM 184 N ASP A 102 0.099 -5.830 5.274 1.00 0.18 N ATOM 185 CA ASP A 102 0.508 -7.239 5.003 1.00 0.21 C ATOM 186 C ASP A 102 -0.609 -8.018 4.316 1.00 0.20 C ATOM 187 O ASP A 102 -0.405 -8.601 3.267 1.00 0.22 O ATOM 188 CB ASP A 102 0.797 -7.830 6.374 1.00 0.25 C ATOM 189 CG ASP A 102 1.466 -9.201 6.225 1.00 0.32 C ATOM 190 OD1 ASP A 102 1.228 -9.853 5.221 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.207 -9.574 7.120 1.00 1.13 O ATOM 0 H ASP A 102 -0.219 -5.644 6.225 1.00 0.18 H new ATOM 0 HA ASP A 102 1.369 -7.286 4.336 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.445 -7.160 6.939 1.00 0.25 H new ATOM 0 HB3 ASP A 102 -0.130 -7.928 6.939 1.00 0.25 H new ATOM 196 N ILE A 103 -1.786 -8.043 4.898 1.00 0.18 N ATOM 197 CA ILE A 103 -2.901 -8.806 4.259 1.00 0.18 C ATOM 198 C ILE A 103 -3.252 -8.176 2.917 1.00 0.17 C ATOM 199 O ILE A 103 -3.498 -8.855 1.932 1.00 0.18 O ATOM 200 CB ILE A 103 -4.090 -8.720 5.240 1.00 0.18 C ATOM 201 CG1 ILE A 103 -5.202 -9.661 4.771 1.00 0.94 C ATOM 202 CG2 ILE A 103 -4.644 -7.293 5.333 1.00 0.94 C ATOM 203 CD1 ILE A 103 -6.270 -9.769 5.861 1.00 0.87 C ATOM 0 H ILE A 103 -2.018 -7.575 5.774 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.631 -9.844 4.066 1.00 0.18 H new ATOM 0 HB ILE A 103 -3.734 -9.011 6.228 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -5.645 -9.287 3.848 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.791 -10.646 4.550 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -5.480 -7.272 6.033 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.861 -6.621 5.683 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -4.986 -6.971 4.350 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -7.063 -10.439 5.528 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -5.821 -10.163 6.773 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -6.688 -8.782 6.060 1.00 0.87 H new ATOM 215 N VAL A 104 -3.276 -6.877 2.881 1.00 0.16 N ATOM 216 CA VAL A 104 -3.625 -6.179 1.615 1.00 0.16 C ATOM 217 C VAL A 104 -2.520 -6.366 0.563 1.00 0.17 C ATOM 218 O VAL A 104 -2.795 -6.531 -0.611 1.00 0.18 O ATOM 219 CB VAL A 104 -3.831 -4.702 1.984 1.00 0.16 C ATOM 220 CG1 VAL A 104 -4.871 -4.565 3.103 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.519 -4.066 2.430 1.00 0.14 C ATOM 0 H VAL A 104 -3.069 -6.267 3.672 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.530 -6.588 1.166 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.191 -4.185 1.095 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.003 -3.512 3.350 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -5.822 -4.981 2.769 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.529 -5.105 3.986 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.690 -3.020 2.686 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.136 -4.595 3.303 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.791 -4.127 1.621 1.00 0.14 H new ATOM 231 N CYS A 105 -1.275 -6.340 0.975 1.00 0.18 N ATOM 232 CA CYS A 105 -0.147 -6.512 -0.007 1.00 0.19 C ATOM 233 C CYS A 105 -0.251 -7.860 -0.704 1.00 0.20 C ATOM 234 O CYS A 105 -0.169 -7.953 -1.913 1.00 0.21 O ATOM 235 CB CYS A 105 1.132 -6.425 0.821 1.00 0.22 C ATOM 236 SG CYS A 105 2.589 -6.616 -0.235 1.00 0.29 S ATOM 0 H CYS A 105 -0.987 -6.208 1.945 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.169 -5.753 -0.789 1.00 0.19 H new ATOM 0 HB2 CYS A 105 1.173 -5.466 1.337 1.00 0.22 H new ATOM 0 HB3 CYS A 105 1.128 -7.199 1.588 1.00 0.22 H new ATOM 0 HG CYS A 105 3.665 -6.536 0.491 1.00 0.29 H new ATOM 242 N ASP A 106 -0.419 -8.900 0.052 1.00 0.21 N ATOM 243 CA ASP A 106 -0.524 -10.250 -0.566 1.00 0.24 C ATOM 244 C ASP A 106 -1.848 -10.381 -1.329 1.00 0.25 C ATOM 245 O ASP A 106 -2.032 -11.308 -2.098 1.00 0.28 O ATOM 246 CB ASP A 106 -0.459 -11.235 0.596 1.00 0.25 C ATOM 247 CG ASP A 106 0.926 -11.176 1.256 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.857 -10.710 0.615 1.00 1.05 O ATOM 249 OD2 ASP A 106 1.030 -11.594 2.397 1.00 1.05 O ATOM 0 H ASP A 106 -0.489 -8.878 1.069 1.00 0.21 H new ATOM 0 HA ASP A 106 0.272 -10.436 -1.287 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.231 -10.998 1.328 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.658 -12.245 0.239 1.00 0.25 H new ATOM 254 N ASN A 107 -2.772 -9.464 -1.130 1.00 0.24 N ATOM 255 CA ASN A 107 -4.070 -9.548 -1.850 1.00 0.26 C ATOM 256 C ASN A 107 -4.006 -8.721 -3.141 1.00 0.26 C ATOM 257 O ASN A 107 -3.944 -9.266 -4.227 1.00 0.29 O ATOM 258 CB ASN A 107 -5.095 -8.966 -0.873 1.00 0.25 C ATOM 259 CG ASN A 107 -6.449 -9.637 -1.098 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.368 -9.023 -1.601 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.612 -10.881 -0.740 1.00 1.23 N ATOM 0 H ASN A 107 -2.675 -8.667 -0.501 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.326 -10.566 -2.143 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.765 -9.123 0.154 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.182 -7.889 -1.018 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.512 -11.339 -0.883 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -5.839 -11.396 -0.318 1.00 1.23 H new ATOM 268 N VAL A 108 -4.017 -7.414 -3.035 1.00 0.23 N ATOM 269 CA VAL A 108 -3.953 -6.561 -4.255 1.00 0.24 C ATOM 270 C VAL A 108 -2.535 -6.010 -4.466 1.00 0.25 C ATOM 271 O VAL A 108 -2.362 -4.967 -5.047 1.00 0.42 O ATOM 272 CB VAL A 108 -5.002 -5.458 -4.008 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.424 -4.278 -3.211 1.00 0.27 C ATOM 274 CG2 VAL A 108 -5.539 -4.964 -5.355 1.00 0.27 C ATOM 0 H VAL A 108 -4.068 -6.904 -2.153 1.00 0.23 H new ATOM 0 HA VAL A 108 -4.171 -7.108 -5.172 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.808 -5.887 -3.413 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.199 -3.526 -3.061 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.070 -4.632 -2.243 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -3.593 -3.838 -3.763 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -6.281 -4.184 -5.187 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.718 -4.562 -5.949 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -6.000 -5.794 -5.889 1.00 0.27 H new ATOM 284 N GLY A 109 -1.544 -6.688 -3.940 1.00 0.24 N ATOM 285 CA GLY A 109 -0.110 -6.235 -4.024 1.00 0.22 C ATOM 286 C GLY A 109 0.214 -5.365 -5.272 1.00 0.23 C ATOM 287 O GLY A 109 0.830 -4.323 -5.170 1.00 0.21 O ATOM 0 H GLY A 109 -1.670 -7.567 -3.438 1.00 0.24 H new ATOM 0 HA2 GLY A 109 0.132 -5.666 -3.126 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.536 -7.113 -4.030 1.00 0.22 H new ATOM 291 N ARG A 110 -0.172 -5.805 -6.441 1.00 0.27 N ATOM 292 CA ARG A 110 0.140 -5.034 -7.700 1.00 0.28 C ATOM 293 C ARG A 110 -0.569 -3.659 -7.729 1.00 0.27 C ATOM 294 O ARG A 110 -0.123 -2.718 -8.385 1.00 0.27 O ATOM 295 CB ARG A 110 -0.360 -5.925 -8.846 1.00 0.36 C ATOM 296 CG ARG A 110 0.358 -7.289 -8.812 1.00 0.55 C ATOM 297 CD ARG A 110 1.821 -7.141 -9.249 1.00 0.72 C ATOM 298 NE ARG A 110 1.803 -7.391 -10.718 1.00 1.08 N ATOM 299 CZ ARG A 110 1.391 -6.462 -11.537 1.00 1.39 C ATOM 300 NH1 ARG A 110 2.170 -5.459 -11.829 1.00 1.68 N ATOM 301 NH2 ARG A 110 0.201 -6.540 -12.070 1.00 2.06 N ATOM 0 H ARG A 110 -0.693 -6.669 -6.587 1.00 0.27 H new ATOM 0 HA ARG A 110 1.205 -4.816 -7.774 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -1.437 -6.070 -8.760 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.180 -5.435 -9.803 1.00 0.36 H new ATOM 0 HG2 ARG A 110 0.314 -7.704 -7.805 1.00 0.55 H new ATOM 0 HG3 ARG A 110 -0.154 -7.992 -9.469 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.204 -6.146 -9.021 1.00 0.72 H new ATOM 0 HD3 ARG A 110 2.463 -7.855 -8.733 1.00 0.72 H new ATOM 0 HE ARG A 110 2.114 -8.291 -11.085 1.00 1.08 H new ATOM 0 HH11 ARG A 110 3.101 -5.400 -11.418 1.00 1.68 H new ATOM 0 HH12 ARG A 110 1.848 -4.733 -12.469 1.00 1.68 H new ATOM 0 HH21 ARG A 110 -0.407 -7.328 -11.846 1.00 2.06 H new ATOM 0 HH22 ARG A 110 -0.120 -5.813 -12.710 1.00 2.06 H new ATOM 315 N ASP A 111 -1.676 -3.535 -7.045 1.00 0.27 N ATOM 316 CA ASP A 111 -2.429 -2.241 -7.059 1.00 0.30 C ATOM 317 C ASP A 111 -1.691 -1.157 -6.261 1.00 0.31 C ATOM 318 O ASP A 111 -1.990 0.014 -6.392 1.00 0.39 O ATOM 319 CB ASP A 111 -3.794 -2.564 -6.437 1.00 0.30 C ATOM 320 CG ASP A 111 -4.759 -3.035 -7.530 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.293 -3.608 -8.502 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.949 -2.819 -7.372 1.00 0.82 O ATOM 0 H ASP A 111 -2.093 -4.272 -6.477 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.531 -1.843 -8.069 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.685 -3.337 -5.677 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.196 -1.682 -5.939 1.00 0.30 H new ATOM 327 N TRP A 112 -0.715 -1.518 -5.462 1.00 0.27 N ATOM 328 CA TRP A 112 0.045 -0.465 -4.712 1.00 0.29 C ATOM 329 C TRP A 112 0.911 0.281 -5.713 1.00 0.32 C ATOM 330 O TRP A 112 1.046 1.480 -5.647 1.00 0.31 O ATOM 331 CB TRP A 112 0.884 -1.178 -3.656 1.00 0.29 C ATOM 332 CG TRP A 112 -0.037 -1.994 -2.827 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.087 -3.313 -2.632 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.242 -1.582 -2.119 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.975 -3.750 -1.875 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.807 -2.723 -1.522 1.00 0.20 C ATOM 337 CE3 TRP A 112 -1.897 -0.349 -1.936 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -2.967 -2.664 -0.778 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.081 -0.283 -1.175 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.613 -1.446 -0.597 1.00 0.27 C ATOM 0 H TRP A 112 -0.415 -2.479 -5.298 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.606 0.255 -4.216 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.636 -1.810 -4.128 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.417 -0.455 -3.038 1.00 0.29 H new ATOM 0 HD1 TRP A 112 0.889 -3.932 -3.007 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -1.124 -4.723 -1.609 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -1.491 0.548 -2.380 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.373 -3.562 -0.337 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -3.580 0.665 -1.036 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.521 -1.395 -0.014 1.00 0.27 H new ATOM 351 N LYS A 113 1.458 -0.423 -6.681 1.00 0.37 N ATOM 352 CA LYS A 113 2.264 0.261 -7.739 1.00 0.40 C ATOM 353 C LYS A 113 1.334 1.227 -8.468 1.00 0.34 C ATOM 354 O LYS A 113 1.689 2.352 -8.766 1.00 0.30 O ATOM 355 CB LYS A 113 2.753 -0.849 -8.670 1.00 0.50 C ATOM 356 CG LYS A 113 3.839 -1.662 -7.960 1.00 0.72 C ATOM 357 CD LYS A 113 4.326 -2.783 -8.880 1.00 0.89 C ATOM 358 CE LYS A 113 3.358 -3.964 -8.796 1.00 1.51 C ATOM 359 NZ LYS A 113 3.732 -4.681 -7.543 1.00 1.66 N ATOM 0 H LYS A 113 1.380 -1.435 -6.781 1.00 0.37 H new ATOM 0 HA LYS A 113 3.112 0.825 -7.351 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.922 -1.497 -8.950 1.00 0.50 H new ATOM 0 HB3 LYS A 113 3.147 -0.420 -9.591 1.00 0.50 H new ATOM 0 HG2 LYS A 113 4.672 -1.014 -7.687 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.446 -2.083 -7.034 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.391 -2.424 -9.907 1.00 0.89 H new ATOM 0 HD3 LYS A 113 5.328 -3.098 -8.589 1.00 0.89 H new ATOM 0 HE2 LYS A 113 2.323 -3.624 -8.762 1.00 1.51 H new ATOM 0 HE3 LYS A 113 3.452 -4.614 -9.666 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 3.881 -5.689 -7.751 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 4.608 -4.274 -7.158 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 2.968 -4.581 -6.845 1.00 1.66 H new ATOM 373 N ARG A 114 0.116 0.796 -8.705 1.00 0.35 N ATOM 374 CA ARG A 114 -0.887 1.699 -9.361 1.00 0.33 C ATOM 375 C ARG A 114 -1.113 2.927 -8.460 1.00 0.28 C ATOM 376 O ARG A 114 -1.096 4.063 -8.906 1.00 0.29 O ATOM 377 CB ARG A 114 -2.171 0.858 -9.452 1.00 0.37 C ATOM 378 CG ARG A 114 -3.326 1.693 -10.017 1.00 0.38 C ATOM 379 CD ARG A 114 -4.633 1.306 -9.307 1.00 0.43 C ATOM 380 NE ARG A 114 -5.651 2.239 -9.858 1.00 0.57 N ATOM 381 CZ ARG A 114 -6.155 2.024 -11.041 1.00 1.04 C ATOM 382 NH1 ARG A 114 -6.764 0.899 -11.294 1.00 1.77 N ATOM 383 NH2 ARG A 114 -6.044 2.932 -11.972 1.00 1.62 N ATOM 0 H ARG A 114 -0.226 -0.137 -8.474 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.568 2.056 -10.340 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -1.999 -0.011 -10.088 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.437 0.482 -8.464 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.124 2.755 -9.877 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.419 1.525 -11.090 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -4.899 0.268 -9.505 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.543 1.411 -8.226 1.00 0.43 H new ATOM 0 HE ARG A 114 -5.954 3.045 -9.312 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -6.846 0.188 -10.567 1.00 1.77 H new ATOM 0 HH12 ARG A 114 -7.159 0.730 -12.219 1.00 1.77 H new ATOM 0 HH21 ARG A 114 -5.563 3.809 -11.774 1.00 1.62 H new ATOM 0 HH22 ARG A 114 -6.438 2.764 -12.898 1.00 1.62 H new ATOM 397 N LEU A 115 -1.318 2.688 -7.190 1.00 0.26 N ATOM 398 CA LEU A 115 -1.550 3.810 -6.227 1.00 0.25 C ATOM 399 C LEU A 115 -0.260 4.607 -6.026 1.00 0.25 C ATOM 400 O LEU A 115 -0.287 5.798 -5.794 1.00 0.26 O ATOM 401 CB LEU A 115 -1.957 3.130 -4.917 1.00 0.26 C ATOM 402 CG LEU A 115 -3.349 2.511 -5.062 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.612 1.573 -3.882 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.405 3.620 -5.072 1.00 0.23 C ATOM 0 H LEU A 115 -1.335 1.757 -6.774 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.309 4.507 -6.583 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.232 2.359 -4.657 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -1.955 3.856 -4.104 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.401 1.951 -5.996 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.603 1.131 -3.983 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -2.861 0.783 -3.871 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.559 2.137 -2.950 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.396 3.178 -5.175 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.353 4.180 -4.138 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.219 4.292 -5.909 1.00 0.23 H new ATOM 416 N ALA A 116 0.871 3.956 -6.119 1.00 0.26 N ATOM 417 CA ALA A 116 2.173 4.669 -5.937 1.00 0.28 C ATOM 418 C ALA A 116 2.298 5.771 -6.989 1.00 0.26 C ATOM 419 O ALA A 116 2.608 6.913 -6.683 1.00 0.27 O ATOM 420 CB ALA A 116 3.248 3.600 -6.140 1.00 0.31 C ATOM 0 H ALA A 116 0.950 2.958 -6.314 1.00 0.26 H new ATOM 0 HA ALA A 116 2.262 5.141 -4.959 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.234 4.049 -6.022 1.00 0.31 H new ATOM 0 HB2 ALA A 116 3.118 2.809 -5.402 1.00 0.31 H new ATOM 0 HB3 ALA A 116 3.159 3.180 -7.142 1.00 0.31 H new ATOM 426 N ARG A 117 2.026 5.441 -8.227 1.00 0.27 N ATOM 427 CA ARG A 117 2.096 6.471 -9.304 1.00 0.30 C ATOM 428 C ARG A 117 1.100 7.592 -8.984 1.00 0.32 C ATOM 429 O ARG A 117 1.387 8.762 -9.155 1.00 0.33 O ATOM 430 CB ARG A 117 1.687 5.746 -10.585 1.00 0.35 C ATOM 431 CG ARG A 117 2.785 4.758 -10.983 1.00 0.37 C ATOM 432 CD ARG A 117 2.374 4.036 -12.267 1.00 1.31 C ATOM 433 NE ARG A 117 3.479 3.078 -12.540 1.00 1.53 N ATOM 434 CZ ARG A 117 3.793 2.781 -13.771 1.00 1.93 C ATOM 435 NH1 ARG A 117 2.994 2.037 -14.485 1.00 2.61 N ATOM 436 NH2 ARG A 117 4.904 3.229 -14.289 1.00 2.24 N ATOM 0 H ARG A 117 1.760 4.506 -8.536 1.00 0.27 H new ATOM 0 HA ARG A 117 3.086 6.917 -9.399 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.746 5.218 -10.432 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.522 6.466 -11.387 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.727 5.285 -11.134 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.948 4.036 -10.183 1.00 0.37 H new ATOM 0 HD2 ARG A 117 1.424 3.517 -12.141 1.00 1.31 H new ATOM 0 HD3 ARG A 117 2.247 4.738 -13.091 1.00 1.31 H new ATOM 0 HE ARG A 117 3.990 2.654 -11.766 1.00 1.53 H new ATOM 0 HH11 ARG A 117 2.125 1.688 -14.081 1.00 2.61 H new ATOM 0 HH12 ARG A 117 3.238 1.804 -15.448 1.00 2.61 H new ATOM 0 HH21 ARG A 117 5.528 3.812 -13.731 1.00 2.24 H new ATOM 0 HH22 ARG A 117 5.148 2.996 -15.252 1.00 2.24 H new ATOM 450 N GLU A 118 -0.064 7.229 -8.496 1.00 0.34 N ATOM 451 CA GLU A 118 -1.083 8.261 -8.133 1.00 0.39 C ATOM 452 C GLU A 118 -0.542 9.116 -6.984 1.00 0.39 C ATOM 453 O GLU A 118 -0.709 10.321 -6.954 1.00 0.41 O ATOM 454 CB GLU A 118 -2.309 7.470 -7.673 1.00 0.43 C ATOM 455 CG GLU A 118 -2.946 6.768 -8.875 1.00 0.47 C ATOM 456 CD GLU A 118 -3.524 7.808 -9.838 1.00 0.53 C ATOM 457 OE1 GLU A 118 -3.938 8.857 -9.372 1.00 1.45 O ATOM 458 OE2 GLU A 118 -3.545 7.536 -11.027 1.00 0.76 O ATOM 0 H GLU A 118 -0.350 6.263 -8.334 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.323 8.927 -8.962 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.020 6.736 -6.921 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -3.031 8.139 -7.204 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -2.202 6.158 -9.388 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.733 6.094 -8.538 1.00 0.47 H new ATOM 465 N LEU A 119 0.116 8.487 -6.043 1.00 0.37 N ATOM 466 CA LEU A 119 0.695 9.230 -4.885 1.00 0.38 C ATOM 467 C LEU A 119 1.985 9.964 -5.279 1.00 0.36 C ATOM 468 O LEU A 119 2.588 10.633 -4.463 1.00 0.39 O ATOM 469 CB LEU A 119 0.964 8.150 -3.838 1.00 0.38 C ATOM 470 CG LEU A 119 -0.287 7.911 -2.965 1.00 0.56 C ATOM 471 CD1 LEU A 119 -0.391 9.015 -1.914 1.00 1.33 C ATOM 472 CD2 LEU A 119 -1.581 7.897 -3.802 1.00 0.58 C ATOM 0 H LEU A 119 0.278 7.480 -6.029 1.00 0.37 H new ATOM 0 HA LEU A 119 0.025 10.005 -4.514 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.252 7.222 -4.332 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.802 8.448 -3.208 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.177 6.935 -2.492 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -1.274 8.848 -1.297 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.499 9.004 -1.285 1.00 1.33 H new ATOM 0 HD13 LEU A 119 -0.473 9.982 -2.409 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -2.436 7.726 -3.148 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -1.697 8.855 -4.308 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -1.526 7.100 -4.543 1.00 0.58 H new ATOM 484 N LYS A 120 2.417 9.842 -6.519 1.00 0.34 N ATOM 485 CA LYS A 120 3.668 10.535 -6.968 1.00 0.35 C ATOM 486 C LYS A 120 4.859 10.098 -6.120 1.00 0.30 C ATOM 487 O LYS A 120 5.599 10.914 -5.603 1.00 0.33 O ATOM 488 CB LYS A 120 3.416 12.043 -6.820 1.00 0.48 C ATOM 489 CG LYS A 120 2.432 12.513 -7.893 1.00 1.05 C ATOM 490 CD LYS A 120 2.150 14.002 -7.693 1.00 1.11 C ATOM 491 CE LYS A 120 1.314 14.537 -8.858 1.00 2.02 C ATOM 492 NZ LYS A 120 0.761 15.830 -8.366 1.00 2.16 N ATOM 0 H LYS A 120 1.952 9.289 -7.239 1.00 0.34 H new ATOM 0 HA LYS A 120 3.905 10.282 -8.001 1.00 0.35 H new ATOM 0 HB2 LYS A 120 3.017 12.259 -5.829 1.00 0.48 H new ATOM 0 HB3 LYS A 120 4.355 12.588 -6.911 1.00 0.48 H new ATOM 0 HG2 LYS A 120 2.846 12.339 -8.886 1.00 1.05 H new ATOM 0 HG3 LYS A 120 1.505 11.943 -7.830 1.00 1.05 H new ATOM 0 HD2 LYS A 120 1.620 14.157 -6.753 1.00 1.11 H new ATOM 0 HD3 LYS A 120 3.088 14.552 -7.625 1.00 1.11 H new ATOM 0 HE2 LYS A 120 1.924 14.681 -9.750 1.00 2.02 H new ATOM 0 HE3 LYS A 120 0.518 13.842 -9.126 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 0.174 16.262 -9.108 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 0.180 15.660 -7.521 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 1.542 16.473 -8.125 1.00 2.16 H new ATOM 506 N VAL A 121 5.054 8.813 -5.990 1.00 0.29 N ATOM 507 CA VAL A 121 6.210 8.306 -5.192 1.00 0.33 C ATOM 508 C VAL A 121 7.502 8.569 -5.965 1.00 0.37 C ATOM 509 O VAL A 121 7.476 8.822 -7.155 1.00 0.42 O ATOM 510 CB VAL A 121 5.978 6.799 -5.022 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.700 6.569 -4.214 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.839 6.122 -6.393 1.00 1.29 C ATOM 0 H VAL A 121 4.463 8.091 -6.402 1.00 0.29 H new ATOM 0 HA VAL A 121 6.293 8.797 -4.222 1.00 0.33 H new ATOM 0 HB VAL A 121 6.832 6.368 -4.498 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.534 5.499 -4.093 1.00 1.65 H new ATOM 0 HG12 VAL A 121 4.801 7.034 -3.233 1.00 1.65 H new ATOM 0 HG13 VAL A 121 3.853 7.010 -4.739 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.675 5.053 -6.256 1.00 1.29 H new ATOM 0 HG22 VAL A 121 4.993 6.553 -6.928 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.751 6.278 -6.970 1.00 1.29 H new ATOM 522 N SER A 122 8.632 8.531 -5.300 1.00 0.45 N ATOM 523 CA SER A 122 9.935 8.798 -5.996 1.00 0.52 C ATOM 524 C SER A 122 10.062 7.957 -7.266 1.00 0.44 C ATOM 525 O SER A 122 10.090 6.741 -7.226 1.00 0.35 O ATOM 526 CB SER A 122 11.015 8.401 -4.989 1.00 0.63 C ATOM 527 OG SER A 122 12.297 8.636 -5.559 1.00 1.10 O ATOM 0 H SER A 122 8.710 8.326 -4.304 1.00 0.45 H new ATOM 0 HA SER A 122 10.018 9.840 -6.303 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.901 8.977 -4.070 1.00 0.63 H new ATOM 0 HB3 SER A 122 10.910 7.350 -4.721 1.00 0.63 H new ATOM 0 HG SER A 122 12.985 8.538 -4.868 1.00 1.10 H new ATOM 533 N GLU A 123 10.153 8.614 -8.392 1.00 0.55 N ATOM 534 CA GLU A 123 10.297 7.887 -9.687 1.00 0.58 C ATOM 535 C GLU A 123 11.572 7.047 -9.647 1.00 0.52 C ATOM 536 O GLU A 123 11.615 5.933 -10.133 1.00 0.53 O ATOM 537 CB GLU A 123 10.390 8.981 -10.757 1.00 0.77 C ATOM 538 CG GLU A 123 9.028 9.667 -10.900 1.00 1.44 C ATOM 539 CD GLU A 123 9.113 10.767 -11.959 1.00 1.61 C ATOM 540 OE1 GLU A 123 9.599 11.838 -11.635 1.00 2.15 O ATOM 541 OE2 GLU A 123 8.689 10.520 -13.077 1.00 1.75 O ATOM 0 H GLU A 123 10.134 9.631 -8.470 1.00 0.55 H new ATOM 0 HA GLU A 123 9.467 7.211 -9.891 1.00 0.58 H new ATOM 0 HB2 GLU A 123 11.151 9.711 -10.481 1.00 0.77 H new ATOM 0 HB3 GLU A 123 10.694 8.548 -11.710 1.00 0.77 H new ATOM 0 HG2 GLU A 123 8.270 8.936 -11.181 1.00 1.44 H new ATOM 0 HG3 GLU A 123 8.722 10.092 -9.944 1.00 1.44 H new ATOM 548 N ALA A 124 12.602 7.581 -9.045 1.00 0.50 N ATOM 549 CA ALA A 124 13.892 6.831 -8.938 1.00 0.50 C ATOM 550 C ALA A 124 13.673 5.503 -8.206 1.00 0.39 C ATOM 551 O ALA A 124 14.154 4.467 -8.627 1.00 0.45 O ATOM 552 CB ALA A 124 14.817 7.739 -8.123 1.00 0.56 C ATOM 0 H ALA A 124 12.607 8.508 -8.620 1.00 0.50 H new ATOM 0 HA ALA A 124 14.310 6.594 -9.916 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.786 7.256 -8.001 1.00 0.56 H new ATOM 0 HB2 ALA A 124 14.947 8.688 -8.644 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.377 7.921 -7.143 1.00 0.56 H new ATOM 558 N LYS A 125 12.951 5.530 -7.113 1.00 0.31 N ATOM 559 CA LYS A 125 12.698 4.270 -6.343 1.00 0.34 C ATOM 560 C LYS A 125 11.973 3.249 -7.219 1.00 0.34 C ATOM 561 O LYS A 125 12.354 2.097 -7.288 1.00 0.39 O ATOM 562 CB LYS A 125 11.798 4.684 -5.178 1.00 0.42 C ATOM 563 CG LYS A 125 12.583 5.557 -4.200 1.00 0.54 C ATOM 564 CD LYS A 125 13.596 4.699 -3.443 1.00 0.75 C ATOM 565 CE LYS A 125 14.141 5.495 -2.255 1.00 0.75 C ATOM 566 NZ LYS A 125 14.889 4.502 -1.435 1.00 1.56 N ATOM 0 H LYS A 125 12.525 6.369 -6.720 1.00 0.31 H new ATOM 0 HA LYS A 125 13.626 3.809 -6.005 1.00 0.34 H new ATOM 0 HB2 LYS A 125 10.932 5.230 -5.552 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.420 3.799 -4.666 1.00 0.42 H new ATOM 0 HG2 LYS A 125 13.097 6.353 -4.739 1.00 0.54 H new ATOM 0 HG3 LYS A 125 11.901 6.037 -3.498 1.00 0.54 H new ATOM 0 HD2 LYS A 125 13.124 3.780 -3.095 1.00 0.75 H new ATOM 0 HD3 LYS A 125 14.411 4.408 -4.106 1.00 0.75 H new ATOM 0 HE2 LYS A 125 14.793 6.303 -2.587 1.00 0.75 H new ATOM 0 HE3 LYS A 125 13.334 5.951 -1.682 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 15.293 4.974 -0.601 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 14.242 3.748 -1.127 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 15.656 4.089 -2.004 1.00 1.56 H new ATOM 580 N MET A 126 10.935 3.668 -7.899 1.00 0.42 N ATOM 581 CA MET A 126 10.184 2.721 -8.780 1.00 0.56 C ATOM 582 C MET A 126 11.126 2.164 -9.851 1.00 0.57 C ATOM 583 O MET A 126 11.068 1.000 -10.198 1.00 0.66 O ATOM 584 CB MET A 126 9.063 3.554 -9.419 1.00 0.70 C ATOM 585 CG MET A 126 8.050 3.969 -8.346 1.00 1.10 C ATOM 586 SD MET A 126 7.180 2.503 -7.733 1.00 1.90 S ATOM 587 CE MET A 126 6.052 2.303 -9.134 1.00 2.03 C ATOM 0 H MET A 126 10.576 4.622 -7.883 1.00 0.42 H new ATOM 0 HA MET A 126 9.779 1.872 -8.229 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.482 4.439 -9.898 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.566 2.975 -10.198 1.00 0.70 H new ATOM 0 HG2 MET A 126 8.560 4.471 -7.524 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.336 4.681 -8.761 1.00 1.10 H new ATOM 0 HE1 MET A 126 5.023 2.409 -8.791 1.00 2.03 H new ATOM 0 HE2 MET A 126 6.265 3.065 -9.884 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.188 1.314 -9.572 1.00 2.03 H new ATOM 597 N ASP A 127 11.992 2.994 -10.373 1.00 0.55 N ATOM 598 CA ASP A 127 12.949 2.532 -11.428 1.00 0.62 C ATOM 599 C ASP A 127 13.808 1.373 -10.910 1.00 0.54 C ATOM 600 O ASP A 127 14.044 0.410 -11.617 1.00 0.59 O ATOM 601 CB ASP A 127 13.830 3.746 -11.729 1.00 0.71 C ATOM 602 CG ASP A 127 14.669 3.476 -12.979 1.00 1.04 C ATOM 603 OD1 ASP A 127 15.554 2.639 -12.907 1.00 1.60 O ATOM 604 OD2 ASP A 127 14.412 4.112 -13.988 1.00 1.71 O ATOM 0 H ASP A 127 12.079 3.977 -10.114 1.00 0.55 H new ATOM 0 HA ASP A 127 12.428 2.170 -12.314 1.00 0.62 H new ATOM 0 HB2 ASP A 127 13.210 4.629 -11.879 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.481 3.955 -10.880 1.00 0.71 H new ATOM 609 N GLY A 128 14.268 1.449 -9.681 1.00 0.46 N ATOM 610 CA GLY A 128 15.100 0.337 -9.134 1.00 0.46 C ATOM 611 C GLY A 128 14.237 -0.854 -8.720 1.00 0.48 C ATOM 612 O GLY A 128 14.540 -1.985 -9.057 1.00 0.51 O ATOM 0 H GLY A 128 14.103 2.227 -9.042 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.825 0.020 -9.884 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.667 0.694 -8.274 1.00 0.46 H new ATOM 616 N ILE A 129 13.179 -0.626 -7.978 1.00 0.54 N ATOM 617 CA ILE A 129 12.328 -1.773 -7.536 1.00 0.68 C ATOM 618 C ILE A 129 11.741 -2.504 -8.762 1.00 0.68 C ATOM 619 O ILE A 129 11.834 -3.712 -8.873 1.00 0.72 O ATOM 620 CB ILE A 129 11.254 -1.143 -6.596 1.00 0.86 C ATOM 621 CG1 ILE A 129 11.037 -2.078 -5.407 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.902 -0.899 -7.294 1.00 1.77 C ATOM 623 CD1 ILE A 129 12.251 -2.008 -4.484 1.00 2.01 C ATOM 0 H ILE A 129 12.872 0.294 -7.663 1.00 0.54 H new ATOM 0 HA ILE A 129 12.880 -2.543 -6.997 1.00 0.68 H new ATOM 0 HB ILE A 129 11.630 -0.170 -6.281 1.00 0.86 H new ATOM 0 HG12 ILE A 129 10.136 -1.792 -4.864 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.889 -3.100 -5.755 1.00 1.04 H new ATOM 0 HG21 ILE A 129 9.200 -0.460 -6.585 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.044 -0.218 -8.133 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.504 -1.846 -7.658 1.00 1.77 H new ATOM 0 HD11 ILE A 129 12.101 -2.674 -3.634 1.00 2.01 H new ATOM 0 HD12 ILE A 129 13.142 -2.314 -5.031 1.00 2.01 H new ATOM 0 HD13 ILE A 129 12.378 -0.986 -4.127 1.00 2.01 H new ATOM 635 N GLU A 130 11.146 -1.778 -9.675 1.00 0.70 N ATOM 636 CA GLU A 130 10.554 -2.423 -10.891 1.00 0.77 C ATOM 637 C GLU A 130 11.623 -3.156 -11.710 1.00 0.65 C ATOM 638 O GLU A 130 11.451 -4.302 -12.082 1.00 0.68 O ATOM 639 CB GLU A 130 9.962 -1.268 -11.704 1.00 0.85 C ATOM 640 CG GLU A 130 8.746 -0.689 -10.971 1.00 1.41 C ATOM 641 CD GLU A 130 7.530 -1.606 -11.151 1.00 1.66 C ATOM 642 OE1 GLU A 130 7.723 -2.790 -11.374 1.00 2.01 O ATOM 643 OE2 GLU A 130 6.421 -1.104 -11.063 1.00 2.14 O ATOM 0 H GLU A 130 11.044 -0.764 -9.632 1.00 0.70 H new ATOM 0 HA GLU A 130 9.807 -3.170 -10.623 1.00 0.77 H new ATOM 0 HB2 GLU A 130 10.713 -0.492 -11.851 1.00 0.85 H new ATOM 0 HB3 GLU A 130 9.669 -1.620 -12.693 1.00 0.85 H new ATOM 0 HG2 GLU A 130 8.972 -0.577 -9.911 1.00 1.41 H new ATOM 0 HG3 GLU A 130 8.520 0.305 -11.356 1.00 1.41 H new ATOM 650 N GLU A 131 12.718 -2.499 -12.007 1.00 0.59 N ATOM 651 CA GLU A 131 13.789 -3.155 -12.822 1.00 0.55 C ATOM 652 C GLU A 131 14.430 -4.313 -12.051 1.00 0.47 C ATOM 653 O GLU A 131 14.667 -5.374 -12.596 1.00 0.45 O ATOM 654 CB GLU A 131 14.820 -2.054 -13.092 1.00 0.63 C ATOM 655 CG GLU A 131 14.227 -1.027 -14.066 1.00 1.38 C ATOM 656 CD GLU A 131 15.244 0.089 -14.352 1.00 1.89 C ATOM 657 OE1 GLU A 131 16.264 0.137 -13.680 1.00 2.50 O ATOM 658 OE2 GLU A 131 14.983 0.877 -15.246 1.00 2.30 O ATOM 0 H GLU A 131 12.916 -1.540 -11.722 1.00 0.59 H new ATOM 0 HA GLU A 131 13.391 -3.579 -13.744 1.00 0.55 H new ATOM 0 HB2 GLU A 131 15.100 -1.566 -12.158 1.00 0.63 H new ATOM 0 HB3 GLU A 131 15.729 -2.486 -13.511 1.00 0.63 H new ATOM 0 HG2 GLU A 131 13.946 -1.519 -14.997 1.00 1.38 H new ATOM 0 HG3 GLU A 131 13.317 -0.600 -13.644 1.00 1.38 H new ATOM 665 N LYS A 132 14.718 -4.109 -10.793 1.00 0.51 N ATOM 666 CA LYS A 132 15.354 -5.191 -9.977 1.00 0.53 C ATOM 667 C LYS A 132 14.372 -6.337 -9.711 1.00 0.54 C ATOM 668 O LYS A 132 14.739 -7.497 -9.734 1.00 0.63 O ATOM 669 CB LYS A 132 15.767 -4.519 -8.669 1.00 0.68 C ATOM 670 CG LYS A 132 16.648 -5.474 -7.865 1.00 1.39 C ATOM 671 CD LYS A 132 17.102 -4.787 -6.578 1.00 1.91 C ATOM 672 CE LYS A 132 18.106 -5.684 -5.851 1.00 2.62 C ATOM 673 NZ LYS A 132 18.450 -4.945 -4.605 1.00 2.69 N ATOM 0 H LYS A 132 14.541 -3.238 -10.292 1.00 0.51 H new ATOM 0 HA LYS A 132 16.204 -5.635 -10.495 1.00 0.53 H new ATOM 0 HB2 LYS A 132 16.307 -3.595 -8.876 1.00 0.68 H new ATOM 0 HB3 LYS A 132 14.883 -4.248 -8.091 1.00 0.68 H new ATOM 0 HG2 LYS A 132 16.096 -6.384 -7.629 1.00 1.39 H new ATOM 0 HG3 LYS A 132 17.514 -5.771 -8.456 1.00 1.39 H new ATOM 0 HD2 LYS A 132 17.558 -3.824 -6.808 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.244 -4.588 -5.936 1.00 1.91 H new ATOM 0 HE2 LYS A 132 17.673 -6.659 -5.625 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.991 -5.862 -6.462 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 19.136 -5.498 -4.052 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 18.866 -4.024 -4.851 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 17.589 -4.796 -4.041 1.00 2.69 H new ATOM 687 N TYR A 133 13.134 -6.017 -9.440 1.00 0.55 N ATOM 688 CA TYR A 133 12.121 -7.075 -9.152 1.00 0.65 C ATOM 689 C TYR A 133 11.097 -7.150 -10.294 1.00 0.54 C ATOM 690 O TYR A 133 10.222 -6.311 -10.382 1.00 0.66 O ATOM 691 CB TYR A 133 11.450 -6.622 -7.857 1.00 0.89 C ATOM 692 CG TYR A 133 12.474 -6.577 -6.748 1.00 1.14 C ATOM 693 CD1 TYR A 133 12.967 -7.766 -6.197 1.00 2.20 C ATOM 694 CD2 TYR A 133 12.933 -5.343 -6.272 1.00 0.98 C ATOM 695 CE1 TYR A 133 13.918 -7.721 -5.171 1.00 2.44 C ATOM 696 CE2 TYR A 133 13.884 -5.297 -5.246 1.00 1.14 C ATOM 697 CZ TYR A 133 14.377 -6.486 -4.695 1.00 1.67 C ATOM 698 OH TYR A 133 15.314 -6.441 -3.683 1.00 1.95 O ATOM 0 H TYR A 133 12.779 -5.061 -9.406 1.00 0.55 H new ATOM 0 HA TYR A 133 12.564 -8.067 -9.060 1.00 0.65 H new ATOM 0 HB2 TYR A 133 11.001 -5.638 -7.992 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.643 -7.306 -7.594 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.613 -8.718 -6.564 1.00 2.20 H new ATOM 0 HD2 TYR A 133 12.553 -4.426 -6.697 1.00 0.98 H new ATOM 0 HE1 TYR A 133 14.298 -8.638 -4.746 1.00 2.44 H new ATOM 0 HE2 TYR A 133 14.237 -4.345 -4.879 1.00 1.14 H new ATOM 0 HH TYR A 133 14.869 -6.570 -2.819 1.00 1.95 H new ATOM 708 N PRO A 134 11.237 -8.141 -11.149 1.00 0.51 N ATOM 709 CA PRO A 134 10.307 -8.280 -12.287 1.00 0.53 C ATOM 710 C PRO A 134 9.023 -9.021 -11.891 1.00 0.47 C ATOM 711 O PRO A 134 8.041 -8.967 -12.611 1.00 0.54 O ATOM 712 CB PRO A 134 11.102 -9.099 -13.296 1.00 0.70 C ATOM 713 CG PRO A 134 12.102 -9.877 -12.494 1.00 0.76 C ATOM 714 CD PRO A 134 12.255 -9.204 -11.150 1.00 0.66 C ATOM 0 HA PRO A 134 9.978 -7.314 -12.669 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.449 -9.766 -13.860 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.599 -8.453 -14.019 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.769 -10.907 -12.368 1.00 0.76 H new ATOM 0 HG3 PRO A 134 13.060 -9.913 -13.013 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.094 -9.908 -10.334 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.257 -8.794 -11.024 1.00 0.66 H new ATOM 722 N ARG A 135 9.009 -9.725 -10.778 1.00 0.43 N ATOM 723 CA ARG A 135 7.761 -10.465 -10.404 1.00 0.48 C ATOM 724 C ARG A 135 7.590 -10.609 -8.883 1.00 0.43 C ATOM 725 O ARG A 135 6.816 -11.430 -8.427 1.00 0.60 O ATOM 726 CB ARG A 135 7.916 -11.837 -11.059 1.00 0.70 C ATOM 727 CG ARG A 135 6.544 -12.503 -11.187 1.00 0.91 C ATOM 728 CD ARG A 135 5.715 -11.761 -12.239 1.00 1.17 C ATOM 729 NE ARG A 135 4.479 -12.575 -12.401 1.00 1.44 N ATOM 730 CZ ARG A 135 4.065 -12.905 -13.596 1.00 2.17 C ATOM 731 NH1 ARG A 135 4.125 -12.040 -14.572 1.00 3.07 N ATOM 732 NH2 ARG A 135 3.589 -14.100 -13.814 1.00 2.61 N ATOM 0 H ARG A 135 9.790 -9.817 -10.128 1.00 0.43 H new ATOM 0 HA ARG A 135 6.873 -9.929 -10.739 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.374 -11.732 -12.043 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.581 -12.462 -10.463 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.660 -13.549 -11.471 1.00 0.91 H new ATOM 0 HG3 ARG A 135 6.029 -12.489 -10.226 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.480 -10.748 -11.913 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.257 -11.676 -13.181 1.00 1.17 H new ATOM 0 HE ARG A 135 3.955 -12.875 -11.579 1.00 1.44 H new ATOM 0 HH11 ARG A 135 4.495 -11.105 -14.403 1.00 3.07 H new ATOM 0 HH12 ARG A 135 3.801 -12.299 -15.504 1.00 3.07 H new ATOM 0 HH21 ARG A 135 3.540 -14.776 -13.052 1.00 2.61 H new ATOM 0 HH22 ARG A 135 3.266 -14.358 -14.746 1.00 2.61 H new ATOM 746 N SER A 136 8.276 -9.819 -8.094 1.00 0.51 N ATOM 747 CA SER A 136 8.107 -9.924 -6.611 1.00 0.44 C ATOM 748 C SER A 136 7.088 -8.907 -6.137 1.00 0.33 C ATOM 749 O SER A 136 7.324 -7.713 -6.145 1.00 0.30 O ATOM 750 CB SER A 136 9.484 -9.643 -6.015 1.00 0.50 C ATOM 751 OG SER A 136 10.270 -10.826 -6.076 1.00 0.90 O ATOM 0 H SER A 136 8.940 -9.112 -8.409 1.00 0.51 H new ATOM 0 HA SER A 136 7.744 -10.905 -6.306 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.973 -8.838 -6.563 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.385 -9.311 -4.982 1.00 0.50 H new ATOM 0 HG SER A 136 11.156 -10.650 -5.696 1.00 0.90 H new ATOM 757 N LEU A 137 5.948 -9.386 -5.722 1.00 0.31 N ATOM 758 CA LEU A 137 4.882 -8.472 -5.233 1.00 0.24 C ATOM 759 C LEU A 137 5.392 -7.738 -4.000 1.00 0.20 C ATOM 760 O LEU A 137 5.250 -6.544 -3.870 1.00 0.21 O ATOM 761 CB LEU A 137 3.705 -9.397 -4.867 1.00 0.23 C ATOM 762 CG LEU A 137 2.450 -8.575 -4.554 1.00 0.21 C ATOM 763 CD1 LEU A 137 2.095 -7.698 -5.770 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.293 -9.541 -4.275 1.00 0.27 C ATOM 0 H LEU A 137 5.709 -10.377 -5.701 1.00 0.31 H new ATOM 0 HA LEU A 137 4.587 -7.722 -5.968 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.502 -10.080 -5.692 1.00 0.23 H new ATOM 0 HB3 LEU A 137 3.970 -10.008 -4.004 1.00 0.23 H new ATOM 0 HG LEU A 137 2.628 -7.937 -3.688 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.202 -7.113 -5.548 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.925 -7.026 -5.988 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.906 -8.334 -6.635 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.391 -8.973 -4.050 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.120 -10.164 -5.152 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.545 -10.174 -3.424 1.00 0.27 H new ATOM 776 N SER A 138 5.994 -8.468 -3.106 1.00 0.24 N ATOM 777 CA SER A 138 6.536 -7.861 -1.849 1.00 0.26 C ATOM 778 C SER A 138 7.651 -6.839 -2.120 1.00 0.20 C ATOM 779 O SER A 138 7.707 -5.797 -1.495 1.00 0.22 O ATOM 780 CB SER A 138 7.096 -9.043 -1.058 1.00 0.38 C ATOM 781 OG SER A 138 7.664 -8.570 0.156 1.00 1.01 O ATOM 0 H SER A 138 6.138 -9.474 -3.189 1.00 0.24 H new ATOM 0 HA SER A 138 5.758 -7.313 -1.318 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.304 -9.762 -0.847 1.00 0.38 H new ATOM 0 HB3 SER A 138 7.851 -9.564 -1.647 1.00 0.38 H new ATOM 0 HG SER A 138 8.022 -9.326 0.666 1.00 1.01 H new ATOM 787 N GLU A 139 8.567 -7.151 -3.001 1.00 0.24 N ATOM 788 CA GLU A 139 9.716 -6.218 -3.259 1.00 0.25 C ATOM 789 C GLU A 139 9.274 -4.889 -3.884 1.00 0.21 C ATOM 790 O GLU A 139 9.761 -3.838 -3.508 1.00 0.21 O ATOM 791 CB GLU A 139 10.630 -6.957 -4.238 1.00 0.39 C ATOM 792 CG GLU A 139 11.140 -8.252 -3.599 1.00 1.09 C ATOM 793 CD GLU A 139 12.068 -7.920 -2.426 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.718 -6.888 -2.479 1.00 2.24 O ATOM 795 OE2 GLU A 139 12.113 -8.705 -1.493 1.00 2.92 O ATOM 0 H GLU A 139 8.573 -8.008 -3.554 1.00 0.24 H new ATOM 0 HA GLU A 139 10.205 -5.963 -2.319 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.087 -7.183 -5.156 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.471 -6.321 -4.514 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.299 -8.853 -3.251 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.673 -8.848 -4.339 1.00 1.09 H new ATOM 802 N ARG A 140 8.395 -4.922 -4.853 1.00 0.26 N ATOM 803 CA ARG A 140 7.975 -3.649 -5.520 1.00 0.33 C ATOM 804 C ARG A 140 7.068 -2.789 -4.630 1.00 0.29 C ATOM 805 O ARG A 140 7.263 -1.594 -4.511 1.00 0.35 O ATOM 806 CB ARG A 140 7.235 -4.088 -6.788 1.00 0.42 C ATOM 807 CG ARG A 140 8.239 -4.684 -7.779 1.00 1.07 C ATOM 808 CD ARG A 140 7.521 -5.083 -9.072 1.00 1.17 C ATOM 809 NE ARG A 140 6.674 -6.253 -8.708 1.00 0.98 N ATOM 810 CZ ARG A 140 6.176 -7.011 -9.648 1.00 1.13 C ATOM 811 NH1 ARG A 140 6.936 -7.425 -10.625 1.00 1.55 N ATOM 812 NH2 ARG A 140 4.917 -7.353 -9.612 1.00 1.60 N ATOM 0 H ARG A 140 7.952 -5.768 -5.210 1.00 0.26 H new ATOM 0 HA ARG A 140 8.840 -3.021 -5.736 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.470 -4.824 -6.540 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.724 -3.237 -7.238 1.00 0.42 H new ATOM 0 HG2 ARG A 140 9.023 -3.958 -7.997 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.725 -5.555 -7.339 1.00 1.07 H new ATOM 0 HD2 ARG A 140 6.914 -4.262 -9.454 1.00 1.17 H new ATOM 0 HD3 ARG A 140 8.235 -5.342 -9.854 1.00 1.17 H new ATOM 0 HE ARG A 140 6.484 -6.462 -7.728 1.00 0.98 H new ATOM 0 HH11 ARG A 140 7.920 -7.157 -10.655 1.00 1.55 H new ATOM 0 HH12 ARG A 140 6.546 -8.017 -11.359 1.00 1.55 H new ATOM 0 HH21 ARG A 140 4.322 -7.028 -8.850 1.00 1.60 H new ATOM 0 HH22 ARG A 140 4.528 -7.945 -10.346 1.00 1.60 H new ATOM 826 N VAL A 141 6.068 -3.377 -4.036 1.00 0.24 N ATOM 827 CA VAL A 141 5.122 -2.589 -3.178 1.00 0.27 C ATOM 828 C VAL A 141 5.786 -2.026 -1.906 1.00 0.25 C ATOM 829 O VAL A 141 5.484 -0.930 -1.484 1.00 0.29 O ATOM 830 CB VAL A 141 3.999 -3.559 -2.807 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.318 -4.080 -4.075 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.564 -4.737 -2.020 1.00 0.23 C ATOM 0 H VAL A 141 5.859 -4.373 -4.104 1.00 0.24 H new ATOM 0 HA VAL A 141 4.763 -1.716 -3.723 1.00 0.27 H new ATOM 0 HB VAL A 141 3.270 -3.030 -2.194 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.520 -4.770 -3.802 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.899 -3.243 -4.633 1.00 0.33 H new ATOM 0 HG13 VAL A 141 4.050 -4.599 -4.694 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.757 -5.422 -1.761 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.302 -5.260 -2.628 1.00 0.23 H new ATOM 0 HG23 VAL A 141 5.037 -4.372 -1.108 1.00 0.23 H new ATOM 842 N ARG A 142 6.642 -2.780 -1.268 1.00 0.21 N ATOM 843 CA ARG A 142 7.271 -2.301 0.012 1.00 0.22 C ATOM 844 C ARG A 142 7.989 -0.955 -0.146 1.00 0.24 C ATOM 845 O ARG A 142 7.775 -0.051 0.642 1.00 0.25 O ATOM 846 CB ARG A 142 8.266 -3.393 0.404 1.00 0.27 C ATOM 847 CG ARG A 142 7.510 -4.588 0.990 1.00 0.28 C ATOM 848 CD ARG A 142 8.490 -5.735 1.251 1.00 1.02 C ATOM 849 NE ARG A 142 9.394 -5.239 2.327 1.00 0.94 N ATOM 850 CZ ARG A 142 10.545 -5.820 2.530 1.00 1.48 C ATOM 851 NH1 ARG A 142 10.619 -6.870 3.302 1.00 2.10 N ATOM 852 NH2 ARG A 142 11.622 -5.352 1.960 1.00 2.24 N ATOM 0 H ARG A 142 6.937 -3.708 -1.573 1.00 0.21 H new ATOM 0 HA ARG A 142 6.508 -2.132 0.771 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.841 -3.705 -0.468 1.00 0.27 H new ATOM 0 HB3 ARG A 142 8.978 -3.006 1.134 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.016 -4.300 1.918 1.00 0.28 H new ATOM 0 HG3 ARG A 142 6.730 -4.912 0.301 1.00 0.28 H new ATOM 0 HD2 ARG A 142 7.965 -6.638 1.563 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.050 -5.987 0.351 1.00 1.02 H new ATOM 0 HE ARG A 142 9.113 -4.446 2.904 1.00 0.94 H new ATOM 0 HH11 ARG A 142 9.777 -7.236 3.747 1.00 2.10 H new ATOM 0 HH12 ARG A 142 11.519 -7.324 3.461 1.00 2.10 H new ATOM 0 HH21 ARG A 142 11.564 -4.532 1.356 1.00 2.24 H new ATOM 0 HH22 ARG A 142 12.521 -5.806 2.119 1.00 2.24 H new ATOM 866 N GLU A 143 8.838 -0.804 -1.131 1.00 0.26 N ATOM 867 CA GLU A 143 9.552 0.504 -1.289 1.00 0.31 C ATOM 868 C GLU A 143 8.544 1.612 -1.610 1.00 0.30 C ATOM 869 O GLU A 143 8.550 2.668 -1.002 1.00 0.31 O ATOM 870 CB GLU A 143 10.538 0.300 -2.439 1.00 0.36 C ATOM 871 CG GLU A 143 11.350 1.582 -2.644 1.00 0.44 C ATOM 872 CD GLU A 143 12.384 1.361 -3.748 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.049 1.589 -4.896 1.00 1.62 O ATOM 874 OE2 GLU A 143 13.492 0.964 -3.426 1.00 1.84 O ATOM 0 H GLU A 143 9.067 -1.517 -1.824 1.00 0.26 H new ATOM 0 HA GLU A 143 10.072 0.805 -0.379 1.00 0.31 H new ATOM 0 HB2 GLU A 143 11.204 -0.534 -2.218 1.00 0.36 H new ATOM 0 HB3 GLU A 143 10.001 0.046 -3.353 1.00 0.36 H new ATOM 0 HG2 GLU A 143 10.688 2.405 -2.911 1.00 0.44 H new ATOM 0 HG3 GLU A 143 11.848 1.862 -1.716 1.00 0.44 H new ATOM 881 N SER A 144 7.674 1.368 -2.553 1.00 0.29 N ATOM 882 CA SER A 144 6.647 2.393 -2.920 1.00 0.29 C ATOM 883 C SER A 144 5.713 2.642 -1.731 1.00 0.28 C ATOM 884 O SER A 144 5.325 3.764 -1.455 1.00 0.28 O ATOM 885 CB SER A 144 5.879 1.783 -4.092 1.00 0.29 C ATOM 886 OG SER A 144 5.158 0.645 -3.637 1.00 1.34 O ATOM 0 H SER A 144 7.628 0.501 -3.088 1.00 0.29 H new ATOM 0 HA SER A 144 7.091 3.353 -3.185 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.194 2.517 -4.515 1.00 0.29 H new ATOM 0 HB3 SER A 144 6.569 1.498 -4.886 1.00 0.29 H new ATOM 0 HG SER A 144 5.704 0.148 -2.992 1.00 1.34 H new ATOM 892 N LEU A 145 5.361 1.602 -1.020 1.00 0.27 N ATOM 893 CA LEU A 145 4.465 1.766 0.165 1.00 0.28 C ATOM 894 C LEU A 145 5.215 2.484 1.291 1.00 0.30 C ATOM 895 O LEU A 145 4.638 3.247 2.043 1.00 0.30 O ATOM 896 CB LEU A 145 4.086 0.345 0.603 1.00 0.29 C ATOM 897 CG LEU A 145 3.075 -0.270 -0.374 1.00 0.37 C ATOM 898 CD1 LEU A 145 2.930 -1.764 -0.081 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.710 0.404 -0.200 1.00 0.67 C ATOM 0 H LEU A 145 5.656 0.644 -1.209 1.00 0.27 H new ATOM 0 HA LEU A 145 3.583 2.360 -0.074 1.00 0.28 H new ATOM 0 HB2 LEU A 145 4.980 -0.277 0.650 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.662 0.369 1.607 1.00 0.29 H new ATOM 0 HG LEU A 145 3.429 -0.122 -1.394 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.212 -2.203 -0.774 1.00 0.73 H new ATOM 0 HD12 LEU A 145 3.896 -2.254 -0.201 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.578 -1.902 0.941 1.00 0.73 H new ATOM 0 HD21 LEU A 145 0.996 -0.036 -0.896 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.359 0.257 0.822 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.803 1.471 -0.402 1.00 0.67 H new ATOM 911 N LYS A 146 6.494 2.230 1.419 1.00 0.33 N ATOM 912 CA LYS A 146 7.285 2.882 2.511 1.00 0.35 C ATOM 913 C LYS A 146 7.249 4.408 2.375 1.00 0.34 C ATOM 914 O LYS A 146 6.923 5.111 3.314 1.00 0.35 O ATOM 915 CB LYS A 146 8.719 2.373 2.325 1.00 0.41 C ATOM 916 CG LYS A 146 9.616 2.953 3.423 1.00 1.01 C ATOM 917 CD LYS A 146 11.048 2.449 3.237 1.00 1.15 C ATOM 918 CE LYS A 146 11.953 3.086 4.295 1.00 1.96 C ATOM 919 NZ LYS A 146 12.042 4.526 3.915 1.00 2.32 N ATOM 0 H LYS A 146 7.025 1.601 0.816 1.00 0.33 H new ATOM 0 HA LYS A 146 6.883 2.643 3.495 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.737 1.284 2.364 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.094 2.663 1.344 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.596 4.042 3.385 1.00 1.01 H new ATOM 0 HG3 LYS A 146 9.242 2.661 4.404 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.077 1.363 3.324 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.406 2.699 2.238 1.00 1.15 H new ATOM 0 HE2 LYS A 146 11.535 2.967 5.295 1.00 1.96 H new ATOM 0 HE3 LYS A 146 12.938 2.619 4.304 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 12.940 4.921 4.260 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 12.000 4.615 2.880 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 11.248 5.047 4.340 1.00 2.32 H new ATOM 933 N VAL A 147 7.590 4.925 1.221 1.00 0.32 N ATOM 934 CA VAL A 147 7.582 6.410 1.038 1.00 0.33 C ATOM 935 C VAL A 147 6.169 6.970 1.227 1.00 0.31 C ATOM 936 O VAL A 147 5.979 7.967 1.898 1.00 0.31 O ATOM 937 CB VAL A 147 8.111 6.672 -0.376 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.548 6.161 -0.470 1.00 0.40 C ATOM 939 CG2 VAL A 147 7.247 5.963 -1.425 1.00 0.36 C ATOM 0 H VAL A 147 7.872 4.387 0.402 1.00 0.32 H new ATOM 0 HA VAL A 147 8.207 6.909 1.778 1.00 0.33 H new ATOM 0 HB VAL A 147 8.076 7.744 -0.572 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.934 6.343 -1.473 1.00 0.40 H new ATOM 0 HG12 VAL A 147 10.168 6.684 0.258 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.568 5.091 -0.262 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.644 6.165 -2.420 1.00 0.36 H new ATOM 0 HG22 VAL A 147 7.259 4.889 -1.241 1.00 0.36 H new ATOM 0 HG23 VAL A 147 6.223 6.330 -1.361 1.00 0.36 H new ATOM 949 N TRP A 148 5.174 6.332 0.659 1.00 0.32 N ATOM 950 CA TRP A 148 3.769 6.830 0.827 1.00 0.33 C ATOM 951 C TRP A 148 3.401 6.835 2.327 1.00 0.32 C ATOM 952 O TRP A 148 2.818 7.778 2.826 1.00 0.32 O ATOM 953 CB TRP A 148 2.900 5.843 0.005 1.00 0.36 C ATOM 954 CG TRP A 148 1.485 5.803 0.517 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.617 6.844 0.535 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.784 4.673 1.101 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.571 6.420 1.116 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.516 5.085 1.478 1.00 0.18 C ATOM 959 CE3 TRP A 148 1.155 3.340 1.339 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.416 4.195 2.079 1.00 0.17 C ATOM 961 CZ3 TRP A 148 0.255 2.449 1.933 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.024 2.876 2.304 1.00 0.27 C ATOM 0 H TRP A 148 5.271 5.492 0.089 1.00 0.32 H new ATOM 0 HA TRP A 148 3.623 7.852 0.478 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.901 6.140 -1.044 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.335 4.845 0.054 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.816 7.837 0.160 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.384 7.019 1.259 1.00 0.23 H new ATOM 0 HE3 TRP A 148 2.142 3.000 1.062 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.403 4.527 2.365 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.550 1.425 2.106 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -1.710 2.182 2.766 1.00 0.27 H new ATOM 973 N LYS A 149 3.736 5.786 3.033 1.00 0.36 N ATOM 974 CA LYS A 149 3.404 5.717 4.492 1.00 0.38 C ATOM 975 C LYS A 149 4.070 6.877 5.255 1.00 0.34 C ATOM 976 O LYS A 149 3.459 7.491 6.110 1.00 0.33 O ATOM 977 CB LYS A 149 3.945 4.350 4.951 1.00 0.52 C ATOM 978 CG LYS A 149 3.857 4.220 6.479 1.00 1.36 C ATOM 979 CD LYS A 149 4.380 2.847 6.913 1.00 2.07 C ATOM 980 CE LYS A 149 5.853 2.955 7.331 1.00 2.80 C ATOM 981 NZ LYS A 149 6.577 3.452 6.130 1.00 3.70 N ATOM 0 H LYS A 149 4.226 4.971 2.663 1.00 0.36 H new ATOM 0 HA LYS A 149 2.335 5.811 4.684 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.375 3.550 4.479 1.00 0.52 H new ATOM 0 HB3 LYS A 149 4.980 4.236 4.630 1.00 0.52 H new ATOM 0 HG2 LYS A 149 4.440 5.009 6.955 1.00 1.36 H new ATOM 0 HG3 LYS A 149 2.825 4.346 6.805 1.00 1.36 H new ATOM 0 HD2 LYS A 149 3.785 2.468 7.743 1.00 2.07 H new ATOM 0 HD3 LYS A 149 4.277 2.134 6.095 1.00 2.07 H new ATOM 0 HE2 LYS A 149 5.972 3.639 8.171 1.00 2.80 H new ATOM 0 HE3 LYS A 149 6.241 1.988 7.650 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 7.587 3.218 6.212 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 6.185 3.003 5.278 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 6.466 4.484 6.060 1.00 3.70 H new ATOM 995 N ASN A 150 5.309 7.177 4.955 1.00 0.37 N ATOM 996 CA ASN A 150 6.009 8.298 5.667 1.00 0.41 C ATOM 997 C ASN A 150 5.297 9.636 5.417 1.00 0.39 C ATOM 998 O ASN A 150 5.079 10.409 6.331 1.00 0.46 O ATOM 999 CB ASN A 150 7.431 8.314 5.086 1.00 0.50 C ATOM 1000 CG ASN A 150 8.245 9.456 5.708 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.317 10.534 5.154 1.00 1.86 O ATOM 1002 ND2 ASN A 150 8.866 9.264 6.840 1.00 1.27 N ATOM 0 H ASN A 150 5.868 6.697 4.250 1.00 0.37 H new ATOM 0 HA ASN A 150 6.013 8.155 6.748 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.922 7.360 5.280 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.388 8.436 4.004 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.410 10.019 7.257 1.00 1.27 H new ATOM 0 HD22 ASN A 150 8.807 8.359 7.307 1.00 1.27 H new ATOM 1009 N ALA A 151 4.949 9.915 4.188 1.00 0.38 N ATOM 1010 CA ALA A 151 4.268 11.212 3.871 1.00 0.49 C ATOM 1011 C ALA A 151 2.839 11.244 4.432 1.00 0.53 C ATOM 1012 O ALA A 151 2.284 12.303 4.656 1.00 0.72 O ATOM 1013 CB ALA A 151 4.244 11.291 2.341 1.00 0.57 C ATOM 0 H ALA A 151 5.106 9.302 3.388 1.00 0.38 H new ATOM 0 HA ALA A 151 4.792 12.056 4.320 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.759 12.217 2.032 1.00 0.57 H new ATOM 0 HB2 ALA A 151 5.265 11.272 1.960 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.691 10.441 1.941 1.00 0.57 H new ATOM 1019 N GLU A 152 2.236 10.101 4.645 1.00 0.40 N ATOM 1020 CA GLU A 152 0.833 10.074 5.175 1.00 0.50 C ATOM 1021 C GLU A 152 0.732 10.678 6.583 1.00 0.60 C ATOM 1022 O GLU A 152 -0.223 11.364 6.897 1.00 1.48 O ATOM 1023 CB GLU A 152 0.442 8.595 5.214 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.129 8.177 3.859 1.00 0.77 C ATOM 1025 CD GLU A 152 -0.705 6.764 3.959 1.00 1.10 C ATOM 1026 OE1 GLU A 152 0.008 5.885 4.415 1.00 1.66 O ATOM 1027 OE2 GLU A 152 -1.851 6.585 3.582 1.00 1.81 O ATOM 0 H GLU A 152 2.652 9.185 4.476 1.00 0.40 H new ATOM 0 HA GLU A 152 0.174 10.670 4.543 1.00 0.50 H new ATOM 0 HB2 GLU A 152 1.312 7.985 5.456 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.295 8.424 5.998 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -0.906 8.876 3.549 1.00 0.77 H new ATOM 0 HG3 GLU A 152 0.651 8.210 3.099 1.00 0.77 H new ATOM 1034 N LYS A 153 1.689 10.412 7.443 1.00 0.76 N ATOM 1035 CA LYS A 153 1.628 10.952 8.847 1.00 0.67 C ATOM 1036 C LYS A 153 0.284 10.531 9.504 1.00 0.64 C ATOM 1037 O LYS A 153 0.118 9.383 9.869 1.00 0.57 O ATOM 1038 CB LYS A 153 1.759 12.481 8.711 1.00 0.86 C ATOM 1039 CG LYS A 153 3.132 12.844 8.134 1.00 1.17 C ATOM 1040 CD LYS A 153 3.244 14.368 8.006 1.00 1.57 C ATOM 1041 CE LYS A 153 4.614 14.743 7.429 1.00 2.22 C ATOM 1042 NZ LYS A 153 4.683 16.229 7.531 1.00 2.51 N ATOM 0 H LYS A 153 2.511 9.845 7.236 1.00 0.76 H new ATOM 0 HA LYS A 153 2.420 10.563 9.488 1.00 0.67 H new ATOM 0 HB2 LYS A 153 0.971 12.865 8.063 1.00 0.86 H new ATOM 0 HB3 LYS A 153 1.629 12.953 9.685 1.00 0.86 H new ATOM 0 HG2 LYS A 153 3.923 12.463 8.781 1.00 1.17 H new ATOM 0 HG3 LYS A 153 3.264 12.375 7.159 1.00 1.17 H new ATOM 0 HD2 LYS A 153 2.452 14.747 7.360 1.00 1.57 H new ATOM 0 HD3 LYS A 153 3.110 14.835 8.982 1.00 1.57 H new ATOM 0 HE2 LYS A 153 5.421 14.271 7.990 1.00 2.22 H new ATOM 0 HE3 LYS A 153 4.710 14.414 6.394 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 5.594 16.561 7.155 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 3.907 16.651 6.982 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 4.596 16.513 8.528 1.00 2.51 H new ATOM 1056 N LYS A 154 -0.682 11.425 9.634 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.001 11.033 10.238 1.00 0.77 C ATOM 1058 C LYS A 154 -2.717 10.050 9.306 1.00 0.62 C ATOM 1059 O LYS A 154 -3.418 9.141 9.735 1.00 0.60 O ATOM 1060 CB LYS A 154 -2.798 12.338 10.359 1.00 0.95 C ATOM 1061 CG LYS A 154 -2.185 13.228 11.450 1.00 1.29 C ATOM 1062 CD LYS A 154 -1.495 14.439 10.813 1.00 1.34 C ATOM 1063 CE LYS A 154 -1.409 15.579 11.834 1.00 2.02 C ATOM 1064 NZ LYS A 154 -0.606 15.032 12.966 1.00 2.51 N ATOM 0 H LYS A 154 -0.611 12.402 9.349 1.00 0.73 H new ATOM 0 HA LYS A 154 -1.888 10.545 11.206 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -2.796 12.865 9.405 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -3.838 12.118 10.600 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -2.962 13.562 12.137 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -1.466 12.656 12.036 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -0.496 14.164 10.475 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -2.051 14.766 9.934 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -0.932 16.459 11.402 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -2.401 15.885 12.167 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -0.248 15.816 13.548 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -1.205 14.413 13.549 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 0.195 14.485 12.591 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.516 10.213 8.025 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.162 9.301 7.037 1.00 0.47 C ATOM 1080 C ASN A 155 -2.467 7.931 7.029 1.00 0.37 C ATOM 1081 O ASN A 155 -2.852 7.044 6.289 1.00 0.34 O ATOM 1082 CB ASN A 155 -2.997 9.999 5.687 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.128 9.576 4.748 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -5.228 9.299 5.186 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -3.902 9.514 3.465 1.00 1.03 N ATOM 0 H ASN A 155 -1.929 10.942 7.619 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.209 9.115 7.275 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -3.008 11.081 5.822 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -2.032 9.742 5.249 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -4.648 9.233 2.829 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -2.979 9.746 3.098 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.463 7.734 7.867 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.779 6.411 7.919 1.00 0.33 C ATOM 1094 C ALA A 156 -1.727 5.359 8.497 1.00 0.28 C ATOM 1095 O ALA A 156 -1.414 4.181 8.493 1.00 0.28 O ATOM 1096 CB ALA A 156 0.402 6.588 8.872 1.00 0.41 C ATOM 0 H ALA A 156 -1.097 8.436 8.510 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.465 6.087 6.927 1.00 0.33 H new ATOM 0 HB1 ALA A 156 0.948 5.648 8.954 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.067 7.361 8.487 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.035 6.881 9.856 1.00 0.41 H new ATOM 1102 N SER A 157 -2.884 5.758 8.994 1.00 0.28 N ATOM 1103 CA SER A 157 -3.812 4.743 9.552 1.00 0.28 C ATOM 1104 C SER A 157 -4.606 4.104 8.420 1.00 0.22 C ATOM 1105 O SER A 157 -4.692 4.627 7.308 1.00 0.21 O ATOM 1106 CB SER A 157 -4.741 5.497 10.505 1.00 0.34 C ATOM 1107 OG SER A 157 -5.018 6.791 9.982 1.00 1.05 O ATOM 0 H SER A 157 -3.209 6.724 9.032 1.00 0.28 H new ATOM 0 HA SER A 157 -3.282 3.946 10.074 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.669 4.942 10.638 1.00 0.34 H new ATOM 0 HB3 SER A 157 -4.277 5.583 11.488 1.00 0.34 H new ATOM 0 HG SER A 157 -5.614 7.270 10.594 1.00 1.05 H new ATOM 1113 N VAL A 158 -5.175 2.963 8.687 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.954 2.262 7.636 1.00 0.22 C ATOM 1115 C VAL A 158 -7.105 3.144 7.173 1.00 0.18 C ATOM 1116 O VAL A 158 -7.351 3.256 5.997 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.468 0.972 8.272 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.282 0.109 8.710 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.347 1.288 9.488 1.00 0.27 C ATOM 0 H VAL A 158 -5.133 2.487 9.588 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.347 2.040 6.758 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.065 0.432 7.537 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.650 -0.811 9.164 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.669 -0.134 7.842 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.682 0.657 9.436 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.705 0.358 9.930 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.763 1.839 10.226 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -8.198 1.892 9.174 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.790 3.797 8.094 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.928 4.705 7.715 1.00 0.13 C ATOM 1131 C ALA A 159 -8.521 5.602 6.550 1.00 0.13 C ATOM 1132 O ALA A 159 -9.321 5.935 5.694 1.00 0.15 O ATOM 1133 CB ALA A 159 -9.212 5.544 8.962 1.00 0.12 C ATOM 0 H ALA A 159 -7.607 3.738 9.096 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.807 4.145 7.396 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -10.033 6.231 8.759 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.484 4.887 9.788 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -8.321 6.112 9.229 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.262 5.950 6.497 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.774 6.783 5.370 1.00 0.15 C ATOM 1141 C GLY A 160 -6.771 5.939 4.102 1.00 0.16 C ATOM 1142 O GLY A 160 -7.521 6.194 3.177 1.00 0.18 O ATOM 0 H GLY A 160 -6.556 5.692 7.186 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.414 7.656 5.241 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.770 7.152 5.580 1.00 0.15 H new ATOM 1146 N LEU A 161 -5.919 4.946 4.044 1.00 0.16 N ATOM 1147 CA LEU A 161 -5.857 4.094 2.816 1.00 0.18 C ATOM 1148 C LEU A 161 -7.192 3.372 2.526 1.00 0.20 C ATOM 1149 O LEU A 161 -7.616 3.316 1.387 1.00 0.28 O ATOM 1150 CB LEU A 161 -4.759 3.070 3.078 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.567 2.218 1.817 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -3.826 3.027 0.744 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -3.781 0.945 2.168 1.00 0.27 C ATOM 0 H LEU A 161 -5.269 4.690 4.787 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.656 4.713 1.941 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -3.828 3.573 3.339 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.027 2.437 3.924 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.542 1.933 1.423 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -3.694 2.414 -0.148 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.407 3.914 0.492 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -2.850 3.328 1.125 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -3.646 0.342 1.270 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -2.806 1.219 2.571 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.333 0.370 2.912 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.838 2.781 3.516 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.109 2.035 3.223 1.00 0.26 C ATOM 1167 C VAL A 162 -10.143 2.971 2.621 1.00 0.29 C ATOM 1168 O VAL A 162 -10.837 2.621 1.684 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.601 1.445 4.553 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.521 0.532 5.134 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -9.944 2.544 5.565 1.00 0.31 C ATOM 0 H VAL A 162 -7.545 2.784 4.493 1.00 0.22 H new ATOM 0 HA VAL A 162 -8.940 1.240 2.497 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.509 0.875 4.356 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.869 0.112 6.078 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.312 -0.276 4.433 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.612 1.108 5.306 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.288 2.089 6.494 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.057 3.146 5.763 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.731 3.180 5.159 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.228 4.163 3.128 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.195 5.144 2.563 1.00 0.34 C ATOM 1183 C LYS A 163 -10.849 5.413 1.097 1.00 0.36 C ATOM 1184 O LYS A 163 -11.681 5.325 0.221 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.018 6.410 3.405 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.016 7.475 2.949 1.00 0.39 C ATOM 1187 CD LYS A 163 -13.434 7.030 3.316 1.00 1.30 C ATOM 1188 CE LYS A 163 -14.430 8.132 2.948 1.00 1.51 C ATOM 1189 NZ LYS A 163 -14.608 8.010 1.474 1.00 2.30 N ATOM 0 H LYS A 163 -9.670 4.504 3.911 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.224 4.787 2.593 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.172 6.182 4.460 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.000 6.785 3.305 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.788 8.430 3.423 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -11.937 7.626 1.872 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -13.685 6.109 2.790 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -13.493 6.814 4.383 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -15.376 8.001 3.473 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -14.049 9.116 3.220 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -14.435 8.932 1.026 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -13.935 7.311 1.100 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -15.579 7.701 1.266 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.610 5.740 0.841 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.168 6.033 -0.557 1.00 0.39 C ATOM 1205 C ALA A 164 -9.234 4.801 -1.470 1.00 0.39 C ATOM 1206 O ALA A 164 -9.801 4.856 -2.545 1.00 0.33 O ATOM 1207 CB ALA A 164 -7.719 6.508 -0.429 1.00 0.44 C ATOM 0 H ALA A 164 -8.877 5.818 1.546 1.00 0.36 H new ATOM 0 HA ALA A 164 -9.823 6.775 -1.014 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -7.324 6.743 -1.418 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -7.682 7.399 0.197 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.117 5.721 0.024 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.607 3.713 -1.083 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.580 2.511 -1.976 1.00 0.55 C ATOM 1215 C LEU A 165 -9.986 1.990 -2.325 1.00 0.45 C ATOM 1216 O LEU A 165 -10.263 1.703 -3.475 1.00 0.42 O ATOM 1217 CB LEU A 165 -7.714 1.446 -1.250 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.382 0.900 0.029 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -9.365 -0.226 -0.316 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -7.291 0.334 0.958 1.00 1.24 C ATOM 0 H LEU A 165 -8.117 3.607 -0.195 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.148 2.767 -2.943 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.516 0.619 -1.932 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -6.750 1.884 -0.992 1.00 0.80 H new ATOM 0 HG LEU A 165 -8.924 1.710 0.518 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -9.827 -0.599 0.598 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -10.138 0.157 -0.982 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -8.830 -1.037 -0.809 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -7.752 -0.055 1.866 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -6.760 -0.470 0.448 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -6.588 1.126 1.218 1.00 1.24 H new ATOM 1232 N ARG A 166 -10.860 1.837 -1.366 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.226 1.296 -1.673 1.00 0.45 C ATOM 1234 C ARG A 166 -13.074 2.299 -2.464 1.00 0.41 C ATOM 1235 O ARG A 166 -13.805 1.919 -3.362 1.00 0.52 O ATOM 1236 CB ARG A 166 -12.851 0.968 -0.307 1.00 0.52 C ATOM 1237 CG ARG A 166 -14.290 0.475 -0.494 1.00 1.19 C ATOM 1238 CD ARG A 166 -14.882 0.095 0.863 1.00 1.53 C ATOM 1239 NE ARG A 166 -16.307 -0.227 0.581 1.00 2.29 N ATOM 1240 CZ ARG A 166 -16.970 -1.003 1.390 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -17.000 -0.738 2.668 1.00 3.60 N ATOM 1242 NH2 ARG A 166 -17.603 -2.042 0.923 1.00 3.25 N ATOM 0 H ARG A 166 -10.692 2.061 -0.385 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.171 0.413 -2.309 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -12.259 0.205 0.199 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -12.841 1.853 0.329 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -14.894 1.253 -0.961 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.306 -0.385 -1.163 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -14.362 -0.759 1.296 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -14.796 0.915 1.576 1.00 1.53 H new ATOM 0 HE ARG A 166 -16.764 0.160 -0.245 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -16.505 0.076 3.032 1.00 3.60 H new ATOM 0 HH12 ARG A 166 -17.519 -1.345 3.303 1.00 3.60 H new ATOM 0 HH21 ARG A 166 -17.579 -2.247 -0.076 1.00 3.25 H new ATOM 0 HH22 ARG A 166 -18.122 -2.650 1.556 1.00 3.25 H new ATOM 1256 N THR A 167 -12.999 3.562 -2.139 1.00 0.33 N ATOM 1257 CA THR A 167 -13.823 4.571 -2.877 1.00 0.36 C ATOM 1258 C THR A 167 -13.468 4.565 -4.359 1.00 0.35 C ATOM 1259 O THR A 167 -14.330 4.675 -5.212 1.00 0.41 O ATOM 1260 CB THR A 167 -13.460 5.920 -2.249 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.781 5.898 -0.867 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.234 7.052 -2.934 1.00 0.47 C ATOM 0 H THR A 167 -12.407 3.940 -1.399 1.00 0.33 H new ATOM 0 HA THR A 167 -14.890 4.359 -2.804 1.00 0.36 H new ATOM 0 HB THR A 167 -12.392 6.094 -2.378 1.00 0.42 H new ATOM 0 HG1 THR A 167 -12.967 6.038 -0.340 1.00 0.44 H new ATOM 0 HG21 THR A 167 -13.966 8.005 -2.477 1.00 0.47 H new ATOM 0 HG22 THR A 167 -13.983 7.075 -3.994 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.305 6.883 -2.818 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.209 4.441 -4.668 1.00 0.32 N ATOM 1271 CA CYS A 168 -11.793 4.440 -6.097 1.00 0.36 C ATOM 1272 C CYS A 168 -12.098 3.094 -6.761 1.00 0.31 C ATOM 1273 O CYS A 168 -12.799 3.045 -7.754 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.283 4.687 -6.069 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.950 6.336 -5.402 1.00 1.38 S ATOM 0 H CYS A 168 -11.450 4.340 -3.994 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.329 5.196 -6.671 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -9.792 3.930 -5.457 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -9.871 4.600 -7.075 1.00 0.40 H new ATOM 0 HG CYS A 168 -9.776 6.257 -4.116 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.587 2.001 -6.227 1.00 0.30 N ATOM 1282 CA ARG A 169 -11.865 0.652 -6.866 1.00 0.31 C ATOM 1283 C ARG A 169 -11.256 -0.538 -6.100 1.00 0.26 C ATOM 1284 O ARG A 169 -11.543 -1.678 -6.415 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.228 0.710 -8.266 1.00 0.44 C ATOM 1286 CG ARG A 169 -11.708 -0.485 -9.097 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.078 -0.433 -10.491 1.00 0.84 C ATOM 1288 NE ARG A 169 -11.751 -1.520 -11.257 1.00 1.56 N ATOM 1289 CZ ARG A 169 -11.117 -2.128 -12.223 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -11.179 -1.664 -13.441 1.00 2.73 N ATOM 1291 NH2 ARG A 169 -10.421 -3.203 -11.970 1.00 2.74 N ATOM 0 H ARG A 169 -11.000 1.977 -5.393 1.00 0.30 H new ATOM 0 HA ARG A 169 -12.942 0.485 -6.875 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.498 1.643 -8.761 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.141 0.696 -8.183 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.438 -1.417 -8.600 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -12.795 -0.470 -9.178 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -11.237 0.538 -10.960 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -10.001 -0.592 -10.444 1.00 0.84 H new ATOM 0 HE ARG A 169 -12.707 -1.789 -11.026 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -11.724 -0.825 -13.640 1.00 2.73 H new ATOM 0 HH12 ARG A 169 -10.683 -2.141 -14.194 1.00 2.73 H new ATOM 0 HH21 ARG A 169 -10.373 -3.567 -11.018 1.00 2.74 H new ATOM 0 HH22 ARG A 169 -9.925 -3.679 -12.724 1.00 2.74 H new ATOM 1305 N LEU A 170 -10.396 -0.306 -5.146 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.743 -1.447 -4.428 1.00 0.17 C ATOM 1307 C LEU A 170 -10.658 -2.055 -3.358 1.00 0.19 C ATOM 1308 O LEU A 170 -10.286 -2.190 -2.208 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.500 -0.826 -3.795 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.521 -0.385 -4.894 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.469 1.146 -4.970 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.118 -0.904 -4.561 1.00 0.25 C ATOM 0 H LEU A 170 -10.115 0.622 -4.830 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.510 -2.270 -5.103 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.782 0.030 -3.182 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.019 -1.547 -3.134 1.00 0.18 H new ATOM 0 HG LEU A 170 -7.859 -0.788 -5.849 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -6.772 1.448 -5.752 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.462 1.533 -5.199 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.136 1.547 -4.013 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.421 -0.593 -5.339 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.797 -0.497 -3.602 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.137 -1.992 -4.505 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.843 -2.451 -3.736 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.779 -3.079 -2.754 1.00 0.30 C ATOM 1326 C ASN A 171 -12.122 -4.313 -2.121 1.00 0.24 C ATOM 1327 O ASN A 171 -12.434 -4.698 -1.011 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.992 -3.494 -3.585 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.248 -3.385 -2.730 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.845 -4.378 -2.362 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.672 -2.200 -2.396 1.00 0.59 N ATOM 0 H ASN A 171 -12.206 -2.367 -4.685 1.00 0.24 H new ATOM 0 HA ASN A 171 -13.047 -2.403 -1.942 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.080 -2.856 -4.465 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.869 -4.516 -3.943 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.510 -2.101 -1.822 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.167 -1.371 -2.708 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.224 -4.940 -2.841 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.542 -6.168 -2.318 1.00 0.21 C ATOM 1340 C LEU A 172 -9.873 -5.908 -0.968 1.00 0.17 C ATOM 1341 O LEU A 172 -10.234 -6.496 0.031 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.460 -6.477 -3.355 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.083 -7.172 -4.560 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -9.129 -7.066 -5.750 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -10.320 -8.645 -4.226 1.00 0.85 C ATOM 0 H LEU A 172 -10.931 -4.653 -3.775 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.253 -6.980 -2.170 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -8.970 -5.555 -3.668 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.692 -7.112 -2.914 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.032 -6.698 -4.810 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -9.570 -7.562 -6.615 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -8.954 -6.016 -5.984 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -8.182 -7.545 -5.501 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -10.766 -9.146 -5.085 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -9.370 -9.120 -3.982 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -10.994 -8.721 -3.372 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.901 -5.034 -0.939 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.189 -4.741 0.348 1.00 0.21 C ATOM 1359 C VAL A 173 -9.139 -4.134 1.367 1.00 0.22 C ATOM 1360 O VAL A 173 -9.000 -4.359 2.555 1.00 0.25 O ATOM 1361 CB VAL A 173 -7.041 -3.777 0.030 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.913 -4.559 -0.626 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.488 -2.645 -0.905 1.00 0.34 C ATOM 0 H VAL A 173 -8.567 -4.509 -1.748 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.801 -5.662 0.785 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.706 -3.323 0.963 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.089 -3.884 -0.858 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.565 -5.336 0.055 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.275 -5.018 -1.546 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.645 -1.984 -1.105 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.848 -3.068 -1.843 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.289 -2.077 -0.432 1.00 0.34 H new ATOM 1373 N ALA A 174 -10.115 -3.383 0.926 1.00 0.27 N ATOM 1374 CA ALA A 174 -11.087 -2.787 1.898 1.00 0.34 C ATOM 1375 C ALA A 174 -11.748 -3.908 2.701 1.00 0.29 C ATOM 1376 O ALA A 174 -11.844 -3.857 3.911 1.00 0.32 O ATOM 1377 CB ALA A 174 -12.126 -2.079 1.039 1.00 0.43 C ATOM 0 H ALA A 174 -10.282 -3.157 -0.054 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.610 -2.105 2.602 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.875 -1.616 1.682 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.639 -1.311 0.438 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.609 -2.802 0.382 1.00 0.43 H new ATOM 1383 N ASP A 175 -12.183 -4.931 2.021 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.818 -6.090 2.711 1.00 0.23 C ATOM 1385 C ASP A 175 -11.822 -6.712 3.694 1.00 0.17 C ATOM 1386 O ASP A 175 -12.191 -7.156 4.761 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.169 -7.075 1.589 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.293 -6.499 0.717 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -15.055 -5.687 1.216 1.00 0.80 O ATOM 1390 OD2 ASP A 175 -14.367 -6.878 -0.442 1.00 0.99 O ATOM 0 H ASP A 175 -12.126 -5.015 1.006 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.700 -5.808 3.286 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.288 -7.272 0.978 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.481 -8.029 2.015 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.562 -6.763 3.326 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.537 -7.381 4.236 1.00 0.20 C ATOM 1397 C LEU A 176 -9.391 -6.586 5.531 1.00 0.25 C ATOM 1398 O LEU A 176 -9.604 -7.098 6.614 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.200 -7.324 3.478 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.318 -7.972 2.099 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -6.972 -7.896 1.379 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -8.743 -9.427 2.248 1.00 1.09 C ATOM 0 H LEU A 176 -10.199 -6.407 2.442 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.834 -8.397 4.498 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.885 -6.286 3.369 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.429 -7.832 4.057 1.00 0.28 H new ATOM 0 HG LEU A 176 -9.068 -7.440 1.514 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -7.059 -8.359 0.396 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -6.679 -6.852 1.264 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -6.217 -8.423 1.963 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -8.826 -9.885 1.262 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -8.000 -9.965 2.836 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -9.708 -9.474 2.752 1.00 1.09 H new ATOM 1414 N VAL A 177 -9.022 -5.339 5.424 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.850 -4.502 6.646 1.00 0.41 C ATOM 1416 C VAL A 177 -10.194 -4.357 7.360 1.00 0.37 C ATOM 1417 O VAL A 177 -10.253 -4.244 8.570 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.317 -3.150 6.150 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.966 -3.364 5.458 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.302 -2.524 5.158 1.00 0.52 C ATOM 0 H VAL A 177 -8.832 -4.863 4.542 1.00 0.33 H new ATOM 0 HA VAL A 177 -8.160 -4.943 7.366 1.00 0.41 H new ATOM 0 HB VAL A 177 -8.198 -2.480 7.001 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.583 -2.407 5.104 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.260 -3.798 6.165 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -7.093 -4.039 4.612 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.912 -1.566 4.814 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.432 -3.190 4.305 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.263 -2.370 5.648 1.00 0.52 H new ATOM 1430 N GLU A 178 -11.272 -4.374 6.618 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.622 -4.250 7.247 1.00 0.39 C ATOM 1432 C GLU A 178 -12.893 -5.432 8.195 1.00 0.31 C ATOM 1433 O GLU A 178 -13.135 -5.247 9.375 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.591 -4.261 6.056 1.00 0.45 C ATOM 1435 CG GLU A 178 -15.042 -4.380 6.535 1.00 0.51 C ATOM 1436 CD GLU A 178 -16.017 -4.133 5.372 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -15.559 -3.851 4.274 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -17.211 -4.226 5.604 1.00 1.85 O ATOM 0 H GLU A 178 -11.276 -4.469 5.602 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.723 -3.351 7.855 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.469 -3.347 5.474 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.352 -5.094 5.395 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -15.212 -5.371 6.955 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -15.228 -3.660 7.332 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.865 -6.637 7.682 1.00 0.25 N ATOM 1446 CA GLU A 179 -13.144 -7.826 8.544 1.00 0.24 C ATOM 1447 C GLU A 179 -12.108 -7.926 9.666 1.00 0.25 C ATOM 1448 O GLU A 179 -12.393 -8.420 10.741 1.00 0.39 O ATOM 1449 CB GLU A 179 -13.085 -9.041 7.605 1.00 0.31 C ATOM 1450 CG GLU A 179 -11.670 -9.230 7.052 1.00 1.03 C ATOM 1451 CD GLU A 179 -11.624 -10.505 6.207 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -11.862 -11.567 6.759 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -11.351 -10.398 5.023 1.00 1.92 O ATOM 0 H GLU A 179 -12.661 -6.848 6.705 1.00 0.25 H new ATOM 0 HA GLU A 179 -14.116 -7.761 9.034 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -13.393 -9.938 8.143 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -13.787 -8.905 6.782 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -11.385 -8.369 6.448 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -10.953 -9.296 7.870 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.916 -7.453 9.424 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.861 -7.508 10.479 1.00 0.38 C ATOM 1462 C ALA A 180 -10.255 -6.618 11.662 1.00 0.44 C ATOM 1463 O ALA A 180 -10.070 -6.980 12.809 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.596 -6.974 9.805 1.00 0.50 C ATOM 0 H ALA A 180 -10.626 -7.031 8.542 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.718 -8.516 10.870 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.772 -6.983 10.519 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.344 -7.605 8.952 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.769 -5.954 9.463 1.00 0.50 H new