USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=16 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 Single : A 96 TYR OH : rot 165:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -1.13 K(o=-1.1,f=-3.4!) USER MOD Single : A 105 CYS SG : rot 180:sc= -4.78! USER MOD Single : A 107 ASN : amide:sc= -4.08! C(o=-4.1!,f=-3.9!) USER MOD Single : A 113 LYS NZ :NH3+ 144:sc= 0.00205 (180deg=-0.055) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ -176:sc= -0.0186 (180deg=-0.0383) USER MOD Single : A 126 MET CE :methyl 175:sc= -6.43 (180deg=-6.86!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot -85:sc= 0.00544 USER MOD Single : A 136 SER OG : rot 160:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot -140:sc= 0 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ 147:sc= -0.12 (180deg=-1.52!) USER MOD Single : A 150 ASN : amide:sc= -2.12! K(o=-2.1!,f=-0.37) USER MOD Single : A 153 LYS NZ :NH3+ -122:sc= 1.09 (180deg=0.242) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc= -2.28 K(o=-2.3,f=-2.8!) USER MOD Single : A 157 SER OG : rot -92:sc= 0.985 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 130:sc= 1.03 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 181 GLN : amide:sc= -0.0846 X(o=-0.085,f=-0.0088) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 89 9.958 10.563 12.044 1.00 1.92 N ATOM 2 CA ALA A 89 9.612 11.306 10.794 1.00 1.43 C ATOM 3 C ALA A 89 8.491 10.575 10.058 1.00 1.08 C ATOM 4 O ALA A 89 7.406 11.095 9.882 1.00 1.13 O ATOM 5 CB ALA A 89 10.895 11.308 9.962 1.00 1.90 C ATOM 0 HA ALA A 89 9.262 12.319 10.991 1.00 1.43 H new ATOM 0 HB1 ALA A 89 10.720 11.837 9.025 1.00 1.90 H new ATOM 0 HB2 ALA A 89 11.689 11.807 10.518 1.00 1.90 H new ATOM 0 HB3 ALA A 89 11.192 10.281 9.749 1.00 1.90 H new ATOM 11 N ALA A 90 8.747 9.363 9.651 1.00 0.96 N ATOM 12 CA ALA A 90 7.699 8.564 8.947 1.00 0.72 C ATOM 13 C ALA A 90 6.571 8.274 9.938 1.00 0.58 C ATOM 14 O ALA A 90 6.636 8.730 11.064 1.00 1.23 O ATOM 15 CB ALA A 90 8.410 7.276 8.519 1.00 1.03 C ATOM 0 H ALA A 90 9.641 8.887 9.775 1.00 0.96 H new ATOM 0 HA ALA A 90 7.261 9.071 8.087 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.707 6.630 7.993 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.242 7.522 7.859 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.788 6.759 9.401 1.00 1.03 H new ATOM 21 N PRO A 91 5.564 7.538 9.520 1.00 0.79 N ATOM 22 CA PRO A 91 4.449 7.238 10.445 1.00 1.10 C ATOM 23 C PRO A 91 4.975 6.410 11.625 1.00 0.60 C ATOM 24 O PRO A 91 5.358 5.271 11.449 1.00 0.91 O ATOM 25 CB PRO A 91 3.462 6.451 9.586 1.00 1.98 C ATOM 26 CG PRO A 91 4.294 5.884 8.489 1.00 2.18 C ATOM 27 CD PRO A 91 5.353 6.913 8.205 1.00 1.62 C ATOM 0 HA PRO A 91 3.982 8.122 10.879 1.00 1.10 H new ATOM 0 HB2 PRO A 91 2.974 5.664 10.161 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.674 7.095 9.195 1.00 1.98 H new ATOM 0 HG2 PRO A 91 4.740 4.935 8.787 1.00 2.18 H new ATOM 0 HG3 PRO A 91 3.691 5.688 7.602 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.267 6.458 7.823 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.023 7.638 7.461 1.00 1.62 H new ATOM 35 N PRO A 92 4.997 7.010 12.798 1.00 0.59 N ATOM 36 CA PRO A 92 5.508 6.295 13.994 1.00 0.84 C ATOM 37 C PRO A 92 4.677 5.037 14.261 1.00 0.71 C ATOM 38 O PRO A 92 5.180 4.057 14.779 1.00 0.83 O ATOM 39 CB PRO A 92 5.399 7.334 15.113 1.00 1.49 C ATOM 40 CG PRO A 92 4.368 8.298 14.630 1.00 1.64 C ATOM 41 CD PRO A 92 4.552 8.371 13.137 1.00 1.21 C ATOM 0 HA PRO A 92 6.531 5.933 13.888 1.00 0.84 H new ATOM 0 HB2 PRO A 92 5.101 6.873 16.055 1.00 1.49 H new ATOM 0 HB3 PRO A 92 6.354 7.829 15.289 1.00 1.49 H new ATOM 0 HG2 PRO A 92 3.364 7.959 14.885 1.00 1.64 H new ATOM 0 HG3 PRO A 92 4.501 9.277 15.090 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.625 8.632 12.627 1.00 1.21 H new ATOM 0 HD3 PRO A 92 5.292 9.120 12.857 1.00 1.21 H new ATOM 49 N GLY A 93 3.419 5.039 13.884 1.00 0.65 N ATOM 50 CA GLY A 93 2.575 3.819 14.086 1.00 0.71 C ATOM 51 C GLY A 93 2.689 2.877 12.881 1.00 0.58 C ATOM 52 O GLY A 93 1.697 2.364 12.395 1.00 0.58 O ATOM 0 H GLY A 93 2.943 5.829 13.448 1.00 0.65 H new ATOM 0 HA2 GLY A 93 2.889 3.299 14.991 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.534 4.110 14.230 1.00 0.71 H new ATOM 56 N GLU A 94 3.881 2.643 12.396 1.00 0.56 N ATOM 57 CA GLU A 94 4.058 1.732 11.222 1.00 0.55 C ATOM 58 C GLU A 94 3.632 0.307 11.579 1.00 0.49 C ATOM 59 O GLU A 94 3.309 -0.481 10.712 1.00 0.53 O ATOM 60 CB GLU A 94 5.551 1.787 10.890 1.00 0.66 C ATOM 61 CG GLU A 94 5.827 0.965 9.627 1.00 1.09 C ATOM 62 CD GLU A 94 7.320 1.026 9.266 1.00 1.10 C ATOM 63 OE1 GLU A 94 8.033 1.821 9.861 1.00 1.62 O ATOM 64 OE2 GLU A 94 7.723 0.275 8.394 1.00 1.44 O ATOM 0 H GLU A 94 4.744 3.045 12.763 1.00 0.56 H new ATOM 0 HA GLU A 94 3.445 2.036 10.374 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.862 2.821 10.739 1.00 0.66 H new ATOM 0 HB3 GLU A 94 6.134 1.397 11.724 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.526 -0.071 9.786 1.00 1.09 H new ATOM 0 HG3 GLU A 94 5.230 1.347 8.799 1.00 1.09 H new ATOM 71 N ALA A 95 3.632 -0.036 12.845 1.00 0.49 N ATOM 72 CA ALA A 95 3.230 -1.421 13.242 1.00 0.50 C ATOM 73 C ALA A 95 1.804 -1.719 12.776 1.00 0.38 C ATOM 74 O ALA A 95 1.556 -2.729 12.142 1.00 0.36 O ATOM 75 CB ALA A 95 3.314 -1.451 14.770 1.00 0.61 C ATOM 0 H ALA A 95 3.891 0.580 13.616 1.00 0.49 H new ATOM 0 HA ALA A 95 3.874 -2.174 12.789 1.00 0.50 H new ATOM 0 HB1 ALA A 95 3.032 -2.440 15.131 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.334 -1.228 15.083 1.00 0.61 H new ATOM 0 HB3 ALA A 95 2.636 -0.706 15.186 1.00 0.61 H new ATOM 81 N TYR A 96 0.871 -0.846 13.062 1.00 0.38 N ATOM 82 CA TYR A 96 -0.529 -1.084 12.604 1.00 0.35 C ATOM 83 C TYR A 96 -0.562 -1.026 11.080 1.00 0.28 C ATOM 84 O TYR A 96 -1.230 -1.800 10.422 1.00 0.29 O ATOM 85 CB TYR A 96 -1.376 0.028 13.219 1.00 0.42 C ATOM 86 CG TYR A 96 -2.834 -0.294 12.998 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.515 -1.101 13.917 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.502 0.205 11.874 1.00 1.54 C ATOM 89 CE1 TYR A 96 -4.864 -1.410 13.712 1.00 1.85 C ATOM 90 CE2 TYR A 96 -4.853 -0.103 11.671 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.534 -0.911 12.589 1.00 1.77 C ATOM 92 OH TYR A 96 -6.864 -1.215 12.387 1.00 2.32 O ATOM 0 H TYR A 96 1.018 0.015 13.589 1.00 0.38 H new ATOM 0 HA TYR A 96 -0.910 -2.059 12.909 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.166 0.117 14.285 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -1.128 0.987 12.764 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -2.999 -1.485 14.784 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.976 0.827 11.164 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.389 -2.034 14.421 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -5.370 0.283 10.805 1.00 1.93 H new ATOM 0 HH TYR A 96 -7.239 -0.611 11.713 1.00 2.32 H new ATOM 102 N LEU A 97 0.173 -0.100 10.527 1.00 0.42 N ATOM 103 CA LEU A 97 0.228 0.052 9.043 1.00 0.55 C ATOM 104 C LEU A 97 0.751 -1.235 8.401 1.00 0.43 C ATOM 105 O LEU A 97 0.185 -1.730 7.443 1.00 0.35 O ATOM 106 CB LEU A 97 1.199 1.223 8.812 1.00 0.90 C ATOM 107 CG LEU A 97 1.465 1.420 7.308 1.00 0.94 C ATOM 108 CD1 LEU A 97 0.927 2.778 6.854 1.00 1.33 C ATOM 109 CD2 LEU A 97 2.973 1.363 7.035 1.00 1.75 C ATOM 0 H LEU A 97 0.745 0.566 11.046 1.00 0.42 H new ATOM 0 HA LEU A 97 -0.750 0.242 8.600 1.00 0.55 H new ATOM 0 HB2 LEU A 97 0.782 2.137 9.236 1.00 0.90 H new ATOM 0 HB3 LEU A 97 2.138 1.031 9.331 1.00 0.90 H new ATOM 0 HG LEU A 97 0.961 0.626 6.757 1.00 0.94 H new ATOM 0 HD11 LEU A 97 1.120 2.908 5.789 1.00 1.33 H new ATOM 0 HD12 LEU A 97 -0.147 2.824 7.037 1.00 1.33 H new ATOM 0 HD13 LEU A 97 1.424 3.571 7.412 1.00 1.33 H new ATOM 0 HD21 LEU A 97 3.155 1.503 5.970 1.00 1.75 H new ATOM 0 HD22 LEU A 97 3.474 2.152 7.596 1.00 1.75 H new ATOM 0 HD23 LEU A 97 3.363 0.394 7.346 1.00 1.75 H new ATOM 121 N GLN A 98 1.824 -1.779 8.916 1.00 0.47 N ATOM 122 CA GLN A 98 2.376 -3.037 8.324 1.00 0.49 C ATOM 123 C GLN A 98 1.351 -4.169 8.428 1.00 0.38 C ATOM 124 O GLN A 98 1.229 -4.982 7.532 1.00 0.39 O ATOM 125 CB GLN A 98 3.623 -3.371 9.143 1.00 0.63 C ATOM 126 CG GLN A 98 4.722 -2.349 8.843 1.00 0.57 C ATOM 127 CD GLN A 98 5.878 -2.527 9.833 1.00 1.24 C ATOM 128 OE1 GLN A 98 5.723 -3.145 10.869 1.00 2.00 O ATOM 129 NE2 GLN A 98 7.040 -2.000 9.559 1.00 2.04 N ATOM 0 H GLN A 98 2.339 -1.410 9.715 1.00 0.47 H new ATOM 0 HA GLN A 98 2.612 -2.913 7.267 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.385 -3.363 10.207 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.971 -4.376 8.902 1.00 0.63 H new ATOM 0 HG2 GLN A 98 5.082 -2.477 7.822 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.321 -1.338 8.915 1.00 0.57 H new ATOM 0 HE21 GLN A 98 7.173 -1.481 8.691 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.815 -2.107 10.213 1.00 2.04 H new ATOM 138 N VAL A 99 0.622 -4.236 9.516 1.00 0.33 N ATOM 139 CA VAL A 99 -0.385 -5.332 9.673 1.00 0.31 C ATOM 140 C VAL A 99 -1.424 -5.262 8.548 1.00 0.24 C ATOM 141 O VAL A 99 -1.694 -6.254 7.891 1.00 0.30 O ATOM 142 CB VAL A 99 -1.038 -5.092 11.042 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.141 -6.128 11.285 1.00 0.43 C ATOM 144 CG2 VAL A 99 0.024 -5.216 12.136 1.00 0.43 C ATOM 0 H VAL A 99 0.680 -3.583 10.298 1.00 0.33 H new ATOM 0 HA VAL A 99 0.070 -6.321 9.617 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.475 -4.094 11.061 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.599 -5.951 12.258 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.899 -6.042 10.506 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.711 -7.129 11.264 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.435 -5.046 13.110 1.00 0.43 H new ATOM 0 HG22 VAL A 99 0.459 -6.215 12.109 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.806 -4.475 11.970 1.00 0.43 H new ATOM 154 N ALA A 100 -1.997 -4.106 8.306 1.00 0.18 N ATOM 155 CA ALA A 100 -3.000 -4.007 7.206 1.00 0.18 C ATOM 156 C ALA A 100 -2.283 -4.158 5.871 1.00 0.14 C ATOM 157 O ALA A 100 -2.708 -4.904 5.019 1.00 0.14 O ATOM 158 CB ALA A 100 -3.625 -2.618 7.340 1.00 0.24 C ATOM 0 H ALA A 100 -1.815 -3.241 8.816 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.765 -4.781 7.260 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.373 -2.479 6.560 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.098 -2.525 8.317 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.850 -1.859 7.239 1.00 0.24 H new ATOM 164 N PHE A 101 -1.176 -3.481 5.707 1.00 0.15 N ATOM 165 CA PHE A 101 -0.392 -3.601 4.439 1.00 0.16 C ATOM 166 C PHE A 101 0.052 -5.048 4.223 1.00 0.17 C ATOM 167 O PHE A 101 0.424 -5.410 3.141 1.00 0.20 O ATOM 168 CB PHE A 101 0.842 -2.701 4.635 1.00 0.19 C ATOM 169 CG PHE A 101 0.519 -1.210 4.499 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.807 -0.725 4.446 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.582 -0.299 4.446 1.00 1.10 C ATOM 172 CE1 PHE A 101 -1.047 0.649 4.340 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.335 1.073 4.342 1.00 1.10 C ATOM 174 CZ PHE A 101 0.023 1.546 4.291 1.00 0.43 C ATOM 0 H PHE A 101 -0.779 -2.847 6.400 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.983 -3.308 3.571 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.268 -2.887 5.621 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.603 -2.971 3.903 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.636 -1.416 4.487 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.599 -0.659 4.486 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -2.061 1.017 4.296 1.00 1.26 H new ATOM 0 HE2 PHE A 101 2.161 1.768 4.301 1.00 1.10 H new ATOM 0 HZ PHE A 101 -0.165 2.607 4.214 1.00 0.43 H new ATOM 184 N ASP A 102 0.034 -5.874 5.240 1.00 0.18 N ATOM 185 CA ASP A 102 0.483 -7.287 5.054 1.00 0.21 C ATOM 186 C ASP A 102 -0.645 -8.161 4.518 1.00 0.20 C ATOM 187 O ASP A 102 -0.479 -8.847 3.525 1.00 0.22 O ATOM 188 CB ASP A 102 0.899 -7.751 6.438 1.00 0.25 C ATOM 189 CG ASP A 102 1.510 -9.152 6.352 1.00 0.32 C ATOM 190 OD1 ASP A 102 0.841 -10.039 5.849 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.636 -9.313 6.791 1.00 1.13 O ATOM 0 H ASP A 102 -0.270 -5.633 6.183 1.00 0.18 H new ATOM 0 HA ASP A 102 1.294 -7.357 4.329 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.621 -7.054 6.863 1.00 0.25 H new ATOM 0 HB3 ASP A 102 0.036 -7.761 7.103 1.00 0.25 H new ATOM 196 N ILE A 103 -1.789 -8.156 5.164 1.00 0.18 N ATOM 197 CA ILE A 103 -2.910 -9.009 4.670 1.00 0.18 C ATOM 198 C ILE A 103 -3.306 -8.570 3.266 1.00 0.17 C ATOM 199 O ILE A 103 -3.543 -9.380 2.383 1.00 0.18 O ATOM 200 CB ILE A 103 -4.078 -8.811 5.659 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.496 -7.329 5.750 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.667 -9.312 7.042 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.663 -7.172 6.735 1.00 0.87 C ATOM 0 H ILE A 103 -1.990 -7.606 5.999 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.627 -10.060 4.617 1.00 0.18 H new ATOM 0 HB ILE A 103 -4.932 -9.381 5.293 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.650 -6.723 6.076 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.789 -6.964 4.765 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.492 -9.172 7.740 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.416 -10.371 6.985 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.799 -8.751 7.389 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -5.952 -6.122 6.793 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.512 -7.763 6.391 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.356 -7.519 7.722 1.00 0.87 H new ATOM 215 N VAL A 104 -3.374 -7.291 3.061 1.00 0.16 N ATOM 216 CA VAL A 104 -3.766 -6.772 1.727 1.00 0.16 C ATOM 217 C VAL A 104 -2.670 -7.026 0.685 1.00 0.17 C ATOM 218 O VAL A 104 -2.951 -7.352 -0.453 1.00 0.18 O ATOM 219 CB VAL A 104 -4.019 -5.278 1.924 1.00 0.16 C ATOM 220 CG1 VAL A 104 -5.085 -5.060 3.003 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.723 -4.558 2.315 1.00 0.14 C ATOM 0 H VAL A 104 -3.174 -6.578 3.762 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.654 -7.277 1.347 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.377 -4.863 0.982 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.257 -3.992 3.134 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -6.014 -5.542 2.699 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.744 -5.491 3.944 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.924 -3.495 2.451 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.341 -4.977 3.246 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.982 -4.689 1.527 1.00 0.14 H new ATOM 231 N CYS A 105 -1.426 -6.861 1.062 1.00 0.18 N ATOM 232 CA CYS A 105 -0.308 -7.075 0.084 1.00 0.19 C ATOM 233 C CYS A 105 -0.327 -8.496 -0.438 1.00 0.20 C ATOM 234 O CYS A 105 -0.307 -8.728 -1.634 1.00 0.21 O ATOM 235 CB CYS A 105 0.967 -6.800 0.885 1.00 0.22 C ATOM 236 SG CYS A 105 2.446 -7.132 -0.107 1.00 0.29 S ATOM 0 H CYS A 105 -1.134 -6.588 2.001 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.387 -6.427 -0.789 1.00 0.19 H new ATOM 0 HB2 CYS A 105 0.974 -5.762 1.218 1.00 0.22 H new ATOM 0 HB3 CYS A 105 0.979 -7.422 1.780 1.00 0.22 H new ATOM 0 HG CYS A 105 3.508 -6.887 0.602 1.00 0.29 H new ATOM 242 N ASP A 106 -0.383 -9.443 0.445 1.00 0.21 N ATOM 243 CA ASP A 106 -0.418 -10.858 -0.005 1.00 0.24 C ATOM 244 C ASP A 106 -1.734 -11.114 -0.763 1.00 0.25 C ATOM 245 O ASP A 106 -1.875 -12.103 -1.456 1.00 0.28 O ATOM 246 CB ASP A 106 -0.347 -11.689 1.270 1.00 0.25 C ATOM 247 CG ASP A 106 0.967 -11.405 2.008 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.929 -11.031 1.355 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.988 -11.567 3.217 1.00 1.05 O ATOM 0 H ASP A 106 -0.406 -9.303 1.455 1.00 0.21 H new ATOM 0 HA ASP A 106 0.400 -11.109 -0.680 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.194 -11.454 1.915 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.416 -12.749 1.027 1.00 0.25 H new ATOM 254 N ASN A 107 -2.697 -10.215 -0.644 1.00 0.24 N ATOM 255 CA ASN A 107 -3.992 -10.394 -1.362 1.00 0.26 C ATOM 256 C ASN A 107 -3.910 -9.766 -2.754 1.00 0.26 C ATOM 257 O ASN A 107 -4.398 -10.317 -3.723 1.00 0.29 O ATOM 258 CB ASN A 107 -5.003 -9.613 -0.523 1.00 0.25 C ATOM 259 CG ASN A 107 -6.380 -10.267 -0.643 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.303 -9.676 -1.168 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.558 -11.474 -0.181 1.00 1.23 N ATOM 0 H ASN A 107 -2.632 -9.369 -0.078 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.255 -11.445 -1.483 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.688 -9.594 0.520 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.050 -8.578 -0.861 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.471 -11.921 -0.261 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -5.784 -11.971 0.260 1.00 1.23 H new ATOM 268 N VAL A 108 -3.306 -8.609 -2.855 1.00 0.23 N ATOM 269 CA VAL A 108 -3.200 -7.927 -4.178 1.00 0.24 C ATOM 270 C VAL A 108 -2.149 -6.812 -4.115 1.00 0.25 C ATOM 271 O VAL A 108 -2.376 -5.704 -4.557 1.00 0.42 O ATOM 272 CB VAL A 108 -4.613 -7.383 -4.428 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.892 -6.131 -3.584 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.765 -7.053 -5.912 1.00 0.27 C ATOM 0 H VAL A 108 -2.881 -8.107 -2.075 1.00 0.23 H new ATOM 0 HA VAL A 108 -2.877 -8.585 -4.984 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.334 -8.146 -4.136 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.901 -5.773 -3.787 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.800 -6.377 -2.526 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.173 -5.353 -3.839 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.767 -6.666 -6.098 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.027 -6.302 -6.195 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.609 -7.955 -6.503 1.00 0.27 H new ATOM 284 N GLY A 109 -1.032 -7.103 -3.509 1.00 0.24 N ATOM 285 CA GLY A 109 0.062 -6.099 -3.314 1.00 0.22 C ATOM 286 C GLY A 109 0.256 -5.209 -4.562 1.00 0.23 C ATOM 287 O GLY A 109 0.427 -4.011 -4.452 1.00 0.21 O ATOM 0 H GLY A 109 -0.822 -8.025 -3.127 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.170 -5.472 -2.453 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.994 -6.617 -3.089 1.00 0.22 H new ATOM 291 N ARG A 110 0.236 -5.785 -5.740 1.00 0.27 N ATOM 292 CA ARG A 110 0.441 -4.974 -6.990 1.00 0.28 C ATOM 293 C ARG A 110 -0.520 -3.775 -7.062 1.00 0.27 C ATOM 294 O ARG A 110 -0.269 -2.809 -7.777 1.00 0.27 O ATOM 295 CB ARG A 110 0.182 -5.939 -8.151 1.00 0.36 C ATOM 296 CG ARG A 110 1.516 -6.430 -8.725 1.00 0.55 C ATOM 297 CD ARG A 110 1.878 -7.781 -8.106 1.00 0.72 C ATOM 298 NE ARG A 110 0.863 -8.730 -8.642 1.00 1.08 N ATOM 299 CZ ARG A 110 1.037 -9.281 -9.812 1.00 1.39 C ATOM 300 NH1 ARG A 110 1.724 -10.386 -9.917 1.00 2.06 N ATOM 301 NH2 ARG A 110 0.525 -8.727 -10.877 1.00 1.68 N ATOM 0 H ARG A 110 0.087 -6.782 -5.894 1.00 0.27 H new ATOM 0 HA ARG A 110 1.446 -4.553 -7.018 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -0.410 -6.787 -7.806 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.397 -5.440 -8.928 1.00 0.36 H new ATOM 0 HG2 ARG A 110 1.444 -6.523 -9.809 1.00 0.55 H new ATOM 0 HG3 ARG A 110 2.301 -5.703 -8.519 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.888 -8.085 -8.382 1.00 0.72 H new ATOM 0 HD3 ARG A 110 1.844 -7.739 -7.017 1.00 0.72 H new ATOM 0 HE ARG A 110 0.031 -8.949 -8.094 1.00 1.08 H new ATOM 0 HH11 ARG A 110 2.125 -10.819 -9.085 1.00 2.06 H new ATOM 0 HH12 ARG A 110 1.860 -10.817 -10.831 1.00 2.06 H new ATOM 0 HH21 ARG A 110 -0.011 -7.863 -10.795 1.00 1.68 H new ATOM 0 HH22 ARG A 110 0.661 -9.158 -11.791 1.00 1.68 H new ATOM 315 N ASP A 111 -1.600 -3.810 -6.328 1.00 0.27 N ATOM 316 CA ASP A 111 -2.551 -2.662 -6.363 1.00 0.30 C ATOM 317 C ASP A 111 -1.884 -1.431 -5.738 1.00 0.31 C ATOM 318 O ASP A 111 -2.247 -0.308 -6.032 1.00 0.39 O ATOM 319 CB ASP A 111 -3.763 -3.116 -5.537 1.00 0.30 C ATOM 320 CG ASP A 111 -4.732 -3.926 -6.409 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.524 -3.990 -7.612 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.672 -4.471 -5.856 1.00 0.82 O ATOM 0 H ASP A 111 -1.863 -4.578 -5.710 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.847 -2.388 -7.375 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.430 -3.721 -4.694 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.275 -2.247 -5.124 1.00 0.30 H new ATOM 327 N TRP A 112 -0.894 -1.633 -4.901 1.00 0.27 N ATOM 328 CA TRP A 112 -0.180 -0.471 -4.284 1.00 0.29 C ATOM 329 C TRP A 112 0.669 0.205 -5.350 1.00 0.32 C ATOM 330 O TRP A 112 0.789 1.409 -5.375 1.00 0.31 O ATOM 331 CB TRP A 112 0.682 -1.034 -3.150 1.00 0.29 C ATOM 332 CG TRP A 112 -0.165 -1.916 -2.297 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.208 -3.124 -1.834 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.538 -1.704 -1.844 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.834 -3.663 -1.114 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.928 -2.830 -1.094 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.475 -0.659 -1.999 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -3.185 -2.927 -0.527 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.752 -0.760 -1.421 1.00 0.32 C ATOM 340 CH2 TRP A 112 -4.104 -1.898 -0.687 1.00 0.27 C ATOM 0 H TRP A 112 -0.550 -2.551 -4.619 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.867 0.276 -3.886 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.522 -1.596 -3.558 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.101 -0.222 -2.555 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.167 -3.593 -2.000 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.799 -4.571 -0.651 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -2.209 0.222 -2.564 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.453 -3.805 0.042 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.464 0.043 -1.544 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -5.087 -1.976 -0.246 1.00 0.27 H new ATOM 351 N LYS A 113 1.239 -0.561 -6.255 1.00 0.37 N ATOM 352 CA LYS A 113 2.051 0.055 -7.351 1.00 0.40 C ATOM 353 C LYS A 113 1.149 0.984 -8.160 1.00 0.34 C ATOM 354 O LYS A 113 1.534 2.076 -8.533 1.00 0.30 O ATOM 355 CB LYS A 113 2.556 -1.109 -8.205 1.00 0.50 C ATOM 356 CG LYS A 113 3.734 -1.780 -7.498 1.00 0.72 C ATOM 357 CD LYS A 113 4.974 -0.891 -7.626 1.00 0.89 C ATOM 358 CE LYS A 113 5.577 -1.049 -9.023 1.00 1.51 C ATOM 359 NZ LYS A 113 6.078 0.307 -9.381 1.00 1.66 N ATOM 0 H LYS A 113 1.176 -1.579 -6.280 1.00 0.37 H new ATOM 0 HA LYS A 113 2.889 0.644 -6.979 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.755 -1.831 -8.367 1.00 0.50 H new ATOM 0 HB3 LYS A 113 2.864 -0.748 -9.187 1.00 0.50 H new ATOM 0 HG2 LYS A 113 3.497 -1.944 -6.447 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.927 -2.759 -7.937 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.707 0.151 -7.450 1.00 0.89 H new ATOM 0 HD3 LYS A 113 5.709 -1.164 -6.869 1.00 0.89 H new ATOM 0 HE2 LYS A 113 6.384 -1.781 -9.024 1.00 1.51 H new ATOM 0 HE3 LYS A 113 4.831 -1.396 -9.738 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 6.958 0.219 -9.928 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 5.363 0.802 -9.952 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 6.263 0.849 -8.513 1.00 1.66 H new ATOM 373 N ARG A 114 -0.070 0.563 -8.394 1.00 0.35 N ATOM 374 CA ARG A 114 -1.039 1.432 -9.140 1.00 0.33 C ATOM 375 C ARG A 114 -1.233 2.738 -8.355 1.00 0.28 C ATOM 376 O ARG A 114 -1.147 3.832 -8.891 1.00 0.29 O ATOM 377 CB ARG A 114 -2.341 0.619 -9.163 1.00 0.37 C ATOM 378 CG ARG A 114 -3.470 1.426 -9.811 1.00 0.38 C ATOM 379 CD ARG A 114 -4.804 0.997 -9.196 1.00 0.43 C ATOM 380 NE ARG A 114 -5.829 1.831 -9.880 1.00 0.57 N ATOM 381 CZ ARG A 114 -7.030 1.361 -10.070 1.00 1.04 C ATOM 382 NH1 ARG A 114 -7.848 1.235 -9.062 1.00 1.62 N ATOM 383 NH2 ARG A 114 -7.413 1.015 -11.269 1.00 1.77 N ATOM 0 H ARG A 114 -0.437 -0.343 -8.102 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.707 1.694 -10.145 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.187 -0.309 -9.714 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.621 0.343 -8.147 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.309 2.493 -9.654 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.481 1.260 -10.888 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -4.989 -0.065 -9.356 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -4.814 1.164 -8.119 1.00 0.43 H new ATOM 0 HE ARG A 114 -5.592 2.770 -10.200 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -7.548 1.504 -8.125 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -8.788 0.867 -9.211 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -6.773 1.112 -12.057 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -8.353 0.647 -11.418 1.00 1.77 H new ATOM 397 N LEU A 115 -1.476 2.613 -7.079 1.00 0.26 N ATOM 398 CA LEU A 115 -1.667 3.815 -6.216 1.00 0.25 C ATOM 399 C LEU A 115 -0.329 4.544 -6.059 1.00 0.25 C ATOM 400 O LEU A 115 -0.283 5.746 -5.888 1.00 0.26 O ATOM 401 CB LEU A 115 -2.144 3.265 -4.868 1.00 0.26 C ATOM 402 CG LEU A 115 -3.550 2.677 -5.019 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.894 1.855 -3.775 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.567 3.812 -5.169 1.00 0.23 C ATOM 0 H LEU A 115 -1.551 1.720 -6.592 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.380 4.526 -6.633 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.455 2.499 -4.513 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.150 4.059 -4.122 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.582 2.039 -5.902 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.895 1.436 -3.881 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.172 1.046 -3.662 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.861 2.497 -2.894 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.567 3.392 -5.276 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.534 4.449 -4.285 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.325 4.403 -6.052 1.00 0.23 H new ATOM 416 N ALA A 116 0.764 3.819 -6.122 1.00 0.26 N ATOM 417 CA ALA A 116 2.110 4.457 -5.982 1.00 0.28 C ATOM 418 C ALA A 116 2.291 5.501 -7.088 1.00 0.26 C ATOM 419 O ALA A 116 2.655 6.642 -6.836 1.00 0.27 O ATOM 420 CB ALA A 116 3.117 3.313 -6.150 1.00 0.31 C ATOM 0 H ALA A 116 0.780 2.809 -6.265 1.00 0.26 H new ATOM 0 HA ALA A 116 2.239 4.964 -5.026 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.130 3.704 -6.060 1.00 0.31 H new ATOM 0 HB2 ALA A 116 2.947 2.563 -5.378 1.00 0.31 H new ATOM 0 HB3 ALA A 116 2.990 2.858 -7.132 1.00 0.31 H new ATOM 426 N ARG A 117 2.001 5.127 -8.313 1.00 0.27 N ATOM 427 CA ARG A 117 2.113 6.100 -9.441 1.00 0.30 C ATOM 428 C ARG A 117 1.169 7.274 -9.162 1.00 0.32 C ATOM 429 O ARG A 117 1.504 8.424 -9.371 1.00 0.33 O ATOM 430 CB ARG A 117 1.670 5.328 -10.687 1.00 0.35 C ATOM 431 CG ARG A 117 2.722 4.272 -11.039 1.00 0.37 C ATOM 432 CD ARG A 117 3.955 4.948 -11.645 1.00 1.31 C ATOM 433 NE ARG A 117 3.560 5.288 -13.039 1.00 1.53 N ATOM 434 CZ ARG A 117 4.460 5.318 -13.983 1.00 1.93 C ATOM 435 NH1 ARG A 117 5.357 6.266 -13.998 1.00 2.24 N ATOM 436 NH2 ARG A 117 4.463 4.401 -14.911 1.00 2.61 N ATOM 0 H ARG A 117 1.692 4.191 -8.577 1.00 0.27 H new ATOM 0 HA ARG A 117 3.119 6.499 -9.568 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.707 4.850 -10.508 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.535 6.014 -11.523 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.004 3.715 -10.146 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.306 3.553 -11.745 1.00 0.37 H new ATOM 0 HD2 ARG A 117 4.232 5.841 -11.084 1.00 1.31 H new ATOM 0 HD3 ARG A 117 4.818 4.282 -11.630 1.00 1.31 H new ATOM 0 HE ARG A 117 2.586 5.498 -13.256 1.00 1.53 H new ATOM 0 HH11 ARG A 117 5.354 6.983 -13.272 1.00 2.24 H new ATOM 0 HH12 ARG A 117 6.061 6.290 -14.736 1.00 2.24 H new ATOM 0 HH21 ARG A 117 3.762 3.661 -14.899 1.00 2.61 H new ATOM 0 HH22 ARG A 117 5.167 4.425 -15.649 1.00 2.61 H new ATOM 450 N GLU A 118 -0.003 6.976 -8.650 1.00 0.34 N ATOM 451 CA GLU A 118 -0.977 8.057 -8.303 1.00 0.39 C ATOM 452 C GLU A 118 -0.415 8.901 -7.154 1.00 0.39 C ATOM 453 O GLU A 118 -0.576 10.106 -7.118 1.00 0.41 O ATOM 454 CB GLU A 118 -2.257 7.336 -7.874 1.00 0.43 C ATOM 455 CG GLU A 118 -2.910 6.677 -9.092 1.00 0.47 C ATOM 456 CD GLU A 118 -3.691 7.727 -9.888 1.00 0.53 C ATOM 457 OE1 GLU A 118 -3.264 8.870 -9.909 1.00 1.45 O ATOM 458 OE2 GLU A 118 -4.707 7.370 -10.462 1.00 0.76 O ATOM 0 H GLU A 118 -0.326 6.028 -8.458 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.167 8.730 -9.139 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.027 6.583 -7.121 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -2.949 8.043 -7.417 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -2.148 6.220 -9.723 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.578 5.878 -8.771 1.00 0.47 H new ATOM 465 N LEU A 119 0.255 8.269 -6.219 1.00 0.37 N ATOM 466 CA LEU A 119 0.850 9.022 -5.067 1.00 0.38 C ATOM 467 C LEU A 119 2.081 9.819 -5.522 1.00 0.36 C ATOM 468 O LEU A 119 2.640 10.590 -4.766 1.00 0.39 O ATOM 469 CB LEU A 119 1.241 7.951 -4.053 1.00 0.38 C ATOM 470 CG LEU A 119 -0.029 7.307 -3.493 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.305 5.930 -2.920 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.600 8.193 -2.384 1.00 0.58 C ATOM 0 H LEU A 119 0.416 7.262 -6.204 1.00 0.37 H new ATOM 0 HA LEU A 119 0.152 9.745 -4.645 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.869 7.196 -4.526 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.826 8.392 -3.246 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.764 7.199 -4.291 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.600 5.472 -2.521 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.715 5.298 -3.708 1.00 1.33 H new ATOM 0 HD13 LEU A 119 1.039 6.037 -2.122 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.505 7.736 -1.983 1.00 0.58 H new ATOM 0 HD22 LEU A 119 0.136 8.299 -1.587 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -0.839 9.176 -2.790 1.00 0.58 H new ATOM 484 N LYS A 120 2.505 9.650 -6.759 1.00 0.34 N ATOM 485 CA LYS A 120 3.691 10.402 -7.283 1.00 0.35 C ATOM 486 C LYS A 120 4.959 10.001 -6.535 1.00 0.30 C ATOM 487 O LYS A 120 5.719 10.838 -6.085 1.00 0.33 O ATOM 488 CB LYS A 120 3.389 11.895 -7.077 1.00 0.48 C ATOM 489 CG LYS A 120 4.268 12.728 -8.013 1.00 1.05 C ATOM 490 CD LYS A 120 3.557 12.913 -9.358 1.00 1.11 C ATOM 491 CE LYS A 120 2.881 14.286 -9.399 1.00 2.02 C ATOM 492 NZ LYS A 120 2.272 14.373 -10.755 1.00 2.16 N ATOM 0 H LYS A 120 2.073 9.016 -7.431 1.00 0.34 H new ATOM 0 HA LYS A 120 3.860 10.178 -8.336 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.336 12.095 -7.276 1.00 0.48 H new ATOM 0 HB3 LYS A 120 3.576 12.175 -6.040 1.00 0.48 H new ATOM 0 HG2 LYS A 120 4.476 13.699 -7.564 1.00 1.05 H new ATOM 0 HG3 LYS A 120 5.228 12.233 -8.163 1.00 1.05 H new ATOM 0 HD2 LYS A 120 4.274 12.825 -10.174 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.815 12.127 -9.499 1.00 1.11 H new ATOM 0 HE2 LYS A 120 2.125 14.377 -8.620 1.00 2.02 H new ATOM 0 HE3 LYS A 120 3.603 15.087 -9.238 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 1.789 15.288 -10.861 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 3.017 14.290 -11.476 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 1.584 13.602 -10.877 1.00 2.16 H new ATOM 506 N VAL A 121 5.201 8.722 -6.422 1.00 0.29 N ATOM 507 CA VAL A 121 6.438 8.251 -5.725 1.00 0.33 C ATOM 508 C VAL A 121 7.658 8.554 -6.603 1.00 0.37 C ATOM 509 O VAL A 121 7.536 8.743 -7.799 1.00 0.42 O ATOM 510 CB VAL A 121 6.264 6.739 -5.534 1.00 0.36 C ATOM 511 CG1 VAL A 121 5.068 6.476 -4.618 1.00 1.65 C ATOM 512 CG2 VAL A 121 6.027 6.059 -6.887 1.00 1.29 C ATOM 0 H VAL A 121 4.598 7.982 -6.781 1.00 0.29 H new ATOM 0 HA VAL A 121 6.590 8.747 -4.766 1.00 0.33 H new ATOM 0 HB VAL A 121 7.170 6.332 -5.085 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.943 5.402 -4.482 1.00 1.65 H new ATOM 0 HG12 VAL A 121 5.240 6.947 -3.650 1.00 1.65 H new ATOM 0 HG13 VAL A 121 4.167 6.891 -5.068 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.905 4.986 -6.739 1.00 1.29 H new ATOM 0 HG22 VAL A 121 5.126 6.467 -7.346 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.881 6.240 -7.540 1.00 1.29 H new ATOM 522 N SER A 122 8.829 8.630 -6.018 1.00 0.45 N ATOM 523 CA SER A 122 10.061 8.955 -6.815 1.00 0.52 C ATOM 524 C SER A 122 10.200 8.036 -8.031 1.00 0.44 C ATOM 525 O SER A 122 10.179 6.826 -7.921 1.00 0.35 O ATOM 526 CB SER A 122 11.226 8.731 -5.851 1.00 0.63 C ATOM 527 OG SER A 122 12.449 9.015 -6.517 1.00 1.10 O ATOM 0 H SER A 122 8.988 8.481 -5.022 1.00 0.45 H new ATOM 0 HA SER A 122 10.026 9.973 -7.202 1.00 0.52 H new ATOM 0 HB2 SER A 122 11.118 9.372 -4.976 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.224 7.701 -5.493 1.00 0.63 H new ATOM 0 HG SER A 122 13.198 8.874 -5.901 1.00 1.10 H new ATOM 533 N GLU A 123 10.357 8.623 -9.190 1.00 0.55 N ATOM 534 CA GLU A 123 10.518 7.820 -10.438 1.00 0.58 C ATOM 535 C GLU A 123 11.756 6.932 -10.318 1.00 0.52 C ATOM 536 O GLU A 123 11.810 5.846 -10.862 1.00 0.53 O ATOM 537 CB GLU A 123 10.691 8.842 -11.562 1.00 0.77 C ATOM 538 CG GLU A 123 9.366 9.581 -11.782 1.00 1.44 C ATOM 539 CD GLU A 123 9.509 10.617 -12.908 1.00 1.61 C ATOM 540 OE1 GLU A 123 10.624 10.843 -13.356 1.00 1.75 O ATOM 541 OE2 GLU A 123 8.495 11.166 -13.305 1.00 2.15 O ATOM 0 H GLU A 123 10.381 9.634 -9.325 1.00 0.55 H new ATOM 0 HA GLU A 123 9.666 7.167 -10.626 1.00 0.58 H new ATOM 0 HB2 GLU A 123 11.478 9.551 -11.306 1.00 0.77 H new ATOM 0 HB3 GLU A 123 10.999 8.342 -12.480 1.00 0.77 H new ATOM 0 HG2 GLU A 123 8.582 8.867 -12.034 1.00 1.44 H new ATOM 0 HG3 GLU A 123 9.062 10.077 -10.860 1.00 1.44 H new ATOM 548 N ALA A 124 12.752 7.396 -9.601 1.00 0.50 N ATOM 549 CA ALA A 124 14.002 6.585 -9.432 1.00 0.50 C ATOM 550 C ALA A 124 13.657 5.225 -8.820 1.00 0.39 C ATOM 551 O ALA A 124 14.076 4.189 -9.302 1.00 0.45 O ATOM 552 CB ALA A 124 14.883 7.395 -8.477 1.00 0.56 C ATOM 0 H ALA A 124 12.754 8.299 -9.126 1.00 0.50 H new ATOM 0 HA ALA A 124 14.505 6.396 -10.380 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.819 6.863 -8.305 1.00 0.56 H new ATOM 0 HB2 ALA A 124 15.095 8.370 -8.916 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.363 7.530 -7.529 1.00 0.56 H new ATOM 558 N LYS A 125 12.878 5.231 -7.770 1.00 0.31 N ATOM 559 CA LYS A 125 12.474 3.947 -7.120 1.00 0.34 C ATOM 560 C LYS A 125 11.704 3.078 -8.116 1.00 0.34 C ATOM 561 O LYS A 125 11.887 1.877 -8.180 1.00 0.39 O ATOM 562 CB LYS A 125 11.563 4.362 -5.967 1.00 0.42 C ATOM 563 CG LYS A 125 12.395 5.052 -4.886 1.00 0.54 C ATOM 564 CD LYS A 125 11.486 5.470 -3.729 1.00 0.75 C ATOM 565 CE LYS A 125 12.327 6.125 -2.631 1.00 0.75 C ATOM 566 NZ LYS A 125 12.572 5.036 -1.646 1.00 1.56 N ATOM 0 H LYS A 125 12.502 6.072 -7.333 1.00 0.31 H new ATOM 0 HA LYS A 125 13.331 3.366 -6.778 1.00 0.34 H new ATOM 0 HB2 LYS A 125 10.785 5.035 -6.328 1.00 0.42 H new ATOM 0 HB3 LYS A 125 11.061 3.488 -5.553 1.00 0.42 H new ATOM 0 HG2 LYS A 125 13.173 4.378 -4.526 1.00 0.54 H new ATOM 0 HG3 LYS A 125 12.897 5.926 -5.301 1.00 0.54 H new ATOM 0 HD2 LYS A 125 10.725 6.166 -4.083 1.00 0.75 H new ATOM 0 HD3 LYS A 125 10.963 4.601 -3.331 1.00 0.75 H new ATOM 0 HE2 LYS A 125 13.263 6.517 -3.029 1.00 0.75 H new ATOM 0 HE3 LYS A 125 11.799 6.962 -2.174 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 13.085 5.418 -0.826 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 11.663 4.641 -1.332 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 13.139 4.287 -2.091 1.00 1.56 H new ATOM 580 N MET A 126 10.849 3.687 -8.897 1.00 0.42 N ATOM 581 CA MET A 126 10.061 2.915 -9.906 1.00 0.56 C ATOM 582 C MET A 126 11.014 2.222 -10.890 1.00 0.57 C ATOM 583 O MET A 126 10.790 1.099 -11.298 1.00 0.66 O ATOM 584 CB MET A 126 9.170 3.949 -10.615 1.00 0.70 C ATOM 585 CG MET A 126 7.699 3.506 -10.550 1.00 1.10 C ATOM 586 SD MET A 126 7.145 3.463 -8.825 1.00 1.90 S ATOM 587 CE MET A 126 5.465 4.075 -9.106 1.00 2.03 C ATOM 0 H MET A 126 10.662 4.690 -8.880 1.00 0.42 H new ATOM 0 HA MET A 126 9.456 2.130 -9.452 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.286 4.925 -10.144 1.00 0.70 H new ATOM 0 HB3 MET A 126 9.480 4.058 -11.654 1.00 0.70 H new ATOM 0 HG2 MET A 126 7.077 4.193 -11.124 1.00 1.10 H new ATOM 0 HG3 MET A 126 7.586 2.521 -11.002 1.00 1.10 H new ATOM 0 HE1 MET A 126 4.906 4.045 -8.171 1.00 2.03 H new ATOM 0 HE2 MET A 126 5.508 5.101 -9.470 1.00 2.03 H new ATOM 0 HE3 MET A 126 4.968 3.448 -9.846 1.00 2.03 H new ATOM 597 N ASP A 127 12.072 2.887 -11.270 1.00 0.55 N ATOM 598 CA ASP A 127 13.053 2.266 -12.216 1.00 0.62 C ATOM 599 C ASP A 127 13.719 1.034 -11.583 1.00 0.54 C ATOM 600 O ASP A 127 13.939 0.031 -12.242 1.00 0.59 O ATOM 601 CB ASP A 127 14.088 3.354 -12.506 1.00 0.71 C ATOM 602 CG ASP A 127 13.450 4.456 -13.357 1.00 1.04 C ATOM 603 OD1 ASP A 127 12.553 4.144 -14.125 1.00 1.71 O ATOM 604 OD2 ASP A 127 13.868 5.594 -13.226 1.00 1.60 O ATOM 0 H ASP A 127 12.302 3.834 -10.968 1.00 0.55 H new ATOM 0 HA ASP A 127 12.567 1.919 -13.128 1.00 0.62 H new ATOM 0 HB2 ASP A 127 14.462 3.773 -11.572 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.944 2.926 -13.029 1.00 0.71 H new ATOM 609 N GLY A 128 14.048 1.102 -10.313 1.00 0.46 N ATOM 610 CA GLY A 128 14.708 -0.065 -9.646 1.00 0.46 C ATOM 611 C GLY A 128 13.710 -1.173 -9.307 1.00 0.48 C ATOM 612 O GLY A 128 13.994 -2.339 -9.505 1.00 0.51 O ATOM 0 H GLY A 128 13.889 1.911 -9.713 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.484 -0.464 -10.299 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.201 0.270 -8.733 1.00 0.46 H new ATOM 616 N ILE A 129 12.554 -0.836 -8.789 1.00 0.54 N ATOM 617 CA ILE A 129 11.565 -1.903 -8.429 1.00 0.68 C ATOM 618 C ILE A 129 11.181 -2.713 -9.673 1.00 0.68 C ATOM 619 O ILE A 129 11.137 -3.929 -9.635 1.00 0.72 O ATOM 620 CB ILE A 129 10.352 -1.156 -7.853 1.00 0.86 C ATOM 621 CG1 ILE A 129 9.294 -2.158 -7.427 1.00 1.04 C ATOM 622 CG2 ILE A 129 9.751 -0.205 -8.881 1.00 1.77 C ATOM 623 CD1 ILE A 129 8.184 -1.420 -6.682 1.00 2.01 C ATOM 0 H ILE A 129 12.253 0.120 -8.601 1.00 0.54 H new ATOM 0 HA ILE A 129 11.969 -2.615 -7.710 1.00 0.68 H new ATOM 0 HB ILE A 129 10.689 -0.574 -6.995 1.00 0.86 H new ATOM 0 HG12 ILE A 129 8.887 -2.670 -8.299 1.00 1.04 H new ATOM 0 HG13 ILE A 129 9.735 -2.922 -6.786 1.00 1.04 H new ATOM 0 HG21 ILE A 129 8.895 0.309 -8.444 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.500 0.528 -9.180 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.428 -0.771 -9.755 1.00 1.77 H new ATOM 0 HD11 ILE A 129 7.419 -2.131 -6.372 1.00 2.01 H new ATOM 0 HD12 ILE A 129 8.600 -0.928 -5.803 1.00 2.01 H new ATOM 0 HD13 ILE A 129 7.739 -0.673 -7.339 1.00 2.01 H new ATOM 635 N GLU A 130 10.912 -2.054 -10.769 1.00 0.70 N ATOM 636 CA GLU A 130 10.540 -2.795 -12.012 1.00 0.77 C ATOM 637 C GLU A 130 11.717 -3.654 -12.507 1.00 0.65 C ATOM 638 O GLU A 130 11.542 -4.807 -12.856 1.00 0.68 O ATOM 639 CB GLU A 130 10.137 -1.720 -13.038 1.00 0.85 C ATOM 640 CG GLU A 130 11.335 -0.840 -13.402 1.00 1.41 C ATOM 641 CD GLU A 130 10.863 0.344 -14.249 1.00 1.66 C ATOM 642 OE1 GLU A 130 9.860 0.939 -13.893 1.00 2.01 O ATOM 643 OE2 GLU A 130 11.517 0.638 -15.237 1.00 2.14 O ATOM 0 H GLU A 130 10.933 -1.038 -10.858 1.00 0.70 H new ATOM 0 HA GLU A 130 9.718 -3.490 -11.841 1.00 0.77 H new ATOM 0 HB2 GLU A 130 9.744 -2.197 -13.936 1.00 0.85 H new ATOM 0 HB3 GLU A 130 9.337 -1.102 -12.629 1.00 0.85 H new ATOM 0 HG2 GLU A 130 11.824 -0.481 -12.496 1.00 1.41 H new ATOM 0 HG3 GLU A 130 12.073 -1.423 -13.953 1.00 1.41 H new ATOM 650 N GLU A 131 12.910 -3.104 -12.544 1.00 0.59 N ATOM 651 CA GLU A 131 14.093 -3.893 -13.021 1.00 0.55 C ATOM 652 C GLU A 131 14.512 -4.966 -12.008 1.00 0.47 C ATOM 653 O GLU A 131 14.599 -6.136 -12.330 1.00 0.45 O ATOM 654 CB GLU A 131 15.215 -2.867 -13.204 1.00 0.63 C ATOM 655 CG GLU A 131 14.941 -2.024 -14.455 1.00 1.38 C ATOM 656 CD GLU A 131 16.058 -0.989 -14.654 1.00 1.89 C ATOM 657 OE1 GLU A 131 16.826 -0.774 -13.728 1.00 2.30 O ATOM 658 OE2 GLU A 131 16.131 -0.433 -15.738 1.00 2.50 O ATOM 0 H GLU A 131 13.115 -2.145 -12.265 1.00 0.59 H new ATOM 0 HA GLU A 131 13.860 -4.426 -13.943 1.00 0.55 H new ATOM 0 HB2 GLU A 131 15.280 -2.224 -12.327 1.00 0.63 H new ATOM 0 HB3 GLU A 131 16.175 -3.375 -13.298 1.00 0.63 H new ATOM 0 HG2 GLU A 131 14.874 -2.670 -15.330 1.00 1.38 H new ATOM 0 HG3 GLU A 131 13.980 -1.518 -14.358 1.00 1.38 H new ATOM 665 N LYS A 132 14.804 -4.566 -10.798 1.00 0.51 N ATOM 666 CA LYS A 132 15.261 -5.546 -9.759 1.00 0.53 C ATOM 667 C LYS A 132 14.129 -6.478 -9.314 1.00 0.54 C ATOM 668 O LYS A 132 14.344 -7.654 -9.085 1.00 0.63 O ATOM 669 CB LYS A 132 15.734 -4.695 -8.580 1.00 0.68 C ATOM 670 CG LYS A 132 17.028 -3.969 -8.955 1.00 1.39 C ATOM 671 CD LYS A 132 17.496 -3.119 -7.772 1.00 1.91 C ATOM 672 CE LYS A 132 18.790 -2.391 -8.143 1.00 2.62 C ATOM 673 NZ LYS A 132 19.207 -1.685 -6.899 1.00 2.69 N ATOM 0 H LYS A 132 14.746 -3.599 -10.480 1.00 0.51 H new ATOM 0 HA LYS A 132 16.047 -6.190 -10.154 1.00 0.53 H new ATOM 0 HB2 LYS A 132 14.965 -3.972 -8.309 1.00 0.68 H new ATOM 0 HB3 LYS A 132 15.899 -5.326 -7.707 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.798 -4.692 -9.225 1.00 1.39 H new ATOM 0 HG3 LYS A 132 16.864 -3.337 -9.828 1.00 1.39 H new ATOM 0 HD2 LYS A 132 16.725 -2.397 -7.502 1.00 1.91 H new ATOM 0 HD3 LYS A 132 17.660 -3.751 -6.899 1.00 1.91 H new ATOM 0 HE2 LYS A 132 19.556 -3.092 -8.474 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.627 -1.688 -8.960 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 20.089 -1.162 -7.075 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 18.462 -1.019 -6.611 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 19.362 -2.380 -6.141 1.00 2.69 H new ATOM 687 N TYR A 133 12.940 -5.960 -9.159 1.00 0.55 N ATOM 688 CA TYR A 133 11.805 -6.810 -8.692 1.00 0.65 C ATOM 689 C TYR A 133 10.716 -6.898 -9.772 1.00 0.54 C ATOM 690 O TYR A 133 9.770 -6.136 -9.751 1.00 0.66 O ATOM 691 CB TYR A 133 11.270 -6.091 -7.451 1.00 0.89 C ATOM 692 CG TYR A 133 12.362 -5.961 -6.408 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.142 -7.072 -6.053 1.00 2.20 C ATOM 694 CD2 TYR A 133 12.592 -4.723 -5.794 1.00 0.98 C ATOM 695 CE1 TYR A 133 14.148 -6.942 -5.088 1.00 2.44 C ATOM 696 CE2 TYR A 133 13.597 -4.595 -4.828 1.00 1.14 C ATOM 697 CZ TYR A 133 14.376 -5.704 -4.476 1.00 1.67 C ATOM 698 OH TYR A 133 15.367 -5.576 -3.524 1.00 1.95 O ATOM 0 H TYR A 133 12.705 -4.983 -9.336 1.00 0.55 H new ATOM 0 HA TYR A 133 12.116 -7.833 -8.478 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.900 -5.103 -7.726 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.426 -6.643 -7.037 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.966 -8.028 -6.524 1.00 2.20 H new ATOM 0 HD2 TYR A 133 11.993 -3.866 -6.066 1.00 0.98 H new ATOM 0 HE1 TYR A 133 14.748 -7.797 -4.816 1.00 2.44 H new ATOM 0 HE2 TYR A 133 13.772 -3.640 -4.354 1.00 1.14 H new ATOM 0 HH TYR A 133 15.015 -5.838 -2.648 1.00 1.95 H new ATOM 708 N PRO A 134 10.886 -7.822 -10.694 1.00 0.51 N ATOM 709 CA PRO A 134 9.900 -7.981 -11.784 1.00 0.53 C ATOM 710 C PRO A 134 8.707 -8.845 -11.349 1.00 0.47 C ATOM 711 O PRO A 134 7.676 -8.840 -11.997 1.00 0.54 O ATOM 712 CB PRO A 134 10.692 -8.692 -12.876 1.00 0.70 C ATOM 713 CG PRO A 134 11.789 -9.429 -12.168 1.00 0.76 C ATOM 714 CD PRO A 134 11.992 -8.785 -10.817 1.00 0.66 C ATOM 0 HA PRO A 134 9.476 -7.028 -12.099 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.057 -9.379 -13.436 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.099 -7.978 -13.592 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.528 -10.481 -12.053 1.00 0.76 H new ATOM 0 HG3 PRO A 134 12.710 -9.391 -12.750 1.00 0.76 H new ATOM 0 HD2 PRO A 134 11.964 -9.525 -10.017 1.00 0.66 H new ATOM 0 HD3 PRO A 134 12.960 -8.287 -10.757 1.00 0.66 H new ATOM 722 N ARG A 135 8.833 -9.601 -10.279 1.00 0.43 N ATOM 723 CA ARG A 135 7.688 -10.469 -9.854 1.00 0.48 C ATOM 724 C ARG A 135 7.616 -10.632 -8.327 1.00 0.43 C ATOM 725 O ARG A 135 6.942 -11.517 -7.834 1.00 0.60 O ATOM 726 CB ARG A 135 7.961 -11.818 -10.519 1.00 0.70 C ATOM 727 CG ARG A 135 6.645 -12.573 -10.716 1.00 0.91 C ATOM 728 CD ARG A 135 5.984 -12.112 -12.017 1.00 1.17 C ATOM 729 NE ARG A 135 5.137 -13.259 -12.447 1.00 1.44 N ATOM 730 CZ ARG A 135 3.869 -13.287 -12.142 1.00 2.17 C ATOM 731 NH1 ARG A 135 3.496 -13.588 -10.928 1.00 2.61 N ATOM 732 NH2 ARG A 135 2.973 -13.015 -13.052 1.00 3.07 N ATOM 0 H ARG A 135 9.665 -9.653 -9.692 1.00 0.43 H new ATOM 0 HA ARG A 135 6.733 -10.033 -10.147 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.452 -11.667 -11.480 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.640 -12.407 -9.903 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.831 -13.647 -10.750 1.00 0.91 H new ATOM 0 HG3 ARG A 135 5.979 -12.391 -9.873 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.384 -11.216 -11.859 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.730 -11.867 -12.773 1.00 1.17 H new ATOM 0 HE ARG A 135 5.549 -14.024 -12.981 1.00 1.44 H new ATOM 0 HH11 ARG A 135 4.196 -13.801 -10.218 1.00 2.61 H new ATOM 0 HH12 ARG A 135 2.504 -13.610 -10.690 1.00 2.61 H new ATOM 0 HH21 ARG A 135 3.265 -12.781 -14.001 1.00 3.07 H new ATOM 0 HH22 ARG A 135 1.981 -13.037 -12.814 1.00 3.07 H new ATOM 746 N SER A 136 8.288 -9.794 -7.575 1.00 0.51 N ATOM 747 CA SER A 136 8.233 -9.918 -6.085 1.00 0.44 C ATOM 748 C SER A 136 7.137 -9.023 -5.522 1.00 0.33 C ATOM 749 O SER A 136 7.261 -7.815 -5.484 1.00 0.30 O ATOM 750 CB SER A 136 9.603 -9.457 -5.598 1.00 0.50 C ATOM 751 OG SER A 136 10.529 -10.530 -5.709 1.00 0.90 O ATOM 0 H SER A 136 8.869 -9.033 -7.927 1.00 0.51 H new ATOM 0 HA SER A 136 8.008 -10.935 -5.764 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.943 -8.606 -6.188 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.540 -9.122 -4.563 1.00 0.50 H new ATOM 0 HG SER A 136 11.442 -10.175 -5.712 1.00 0.90 H new ATOM 757 N LEU A 137 6.070 -9.622 -5.057 1.00 0.31 N ATOM 758 CA LEU A 137 4.954 -8.829 -4.460 1.00 0.24 C ATOM 759 C LEU A 137 5.495 -8.047 -3.265 1.00 0.20 C ATOM 760 O LEU A 137 5.250 -6.870 -3.107 1.00 0.21 O ATOM 761 CB LEU A 137 3.930 -9.883 -3.994 1.00 0.23 C ATOM 762 CG LEU A 137 2.760 -9.214 -3.250 1.00 0.21 C ATOM 763 CD1 LEU A 137 1.494 -9.280 -4.111 1.00 0.23 C ATOM 764 CD2 LEU A 137 2.518 -9.954 -1.930 1.00 0.27 C ATOM 0 H LEU A 137 5.924 -10.631 -5.066 1.00 0.31 H new ATOM 0 HA LEU A 137 4.510 -8.116 -5.155 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.552 -10.435 -4.854 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.417 -10.606 -3.340 1.00 0.23 H new ATOM 0 HG LEU A 137 3.003 -8.170 -3.050 1.00 0.21 H new ATOM 0 HD11 LEU A 137 0.668 -8.805 -3.581 1.00 0.23 H new ATOM 0 HD12 LEU A 137 1.667 -8.760 -5.053 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.245 -10.322 -4.312 1.00 0.23 H new ATOM 0 HD21 LEU A 137 1.690 -9.486 -1.397 1.00 0.27 H new ATOM 0 HD22 LEU A 137 2.274 -10.996 -2.137 1.00 0.27 H new ATOM 0 HD23 LEU A 137 3.418 -9.907 -1.316 1.00 0.27 H new ATOM 776 N SER A 138 6.234 -8.719 -2.433 1.00 0.24 N ATOM 777 CA SER A 138 6.820 -8.065 -1.223 1.00 0.26 C ATOM 778 C SER A 138 7.835 -6.966 -1.590 1.00 0.20 C ATOM 779 O SER A 138 7.800 -5.878 -1.049 1.00 0.22 O ATOM 780 CB SER A 138 7.501 -9.202 -0.466 1.00 0.38 C ATOM 781 OG SER A 138 8.106 -8.688 0.714 1.00 1.01 O ATOM 0 H SER A 138 6.463 -9.708 -2.537 1.00 0.24 H new ATOM 0 HA SER A 138 6.055 -7.562 -0.631 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.772 -9.970 -0.209 1.00 0.38 H new ATOM 0 HB3 SER A 138 8.253 -9.675 -1.097 1.00 0.38 H new ATOM 0 HG SER A 138 8.542 -9.417 1.202 1.00 1.01 H new ATOM 787 N GLU A 139 8.754 -7.253 -2.480 1.00 0.24 N ATOM 788 CA GLU A 139 9.797 -6.237 -2.856 1.00 0.25 C ATOM 789 C GLU A 139 9.177 -5.055 -3.590 1.00 0.21 C ATOM 790 O GLU A 139 9.633 -3.931 -3.478 1.00 0.21 O ATOM 791 CB GLU A 139 10.747 -6.944 -3.823 1.00 0.39 C ATOM 792 CG GLU A 139 11.355 -8.189 -3.168 1.00 1.09 C ATOM 793 CD GLU A 139 12.602 -7.816 -2.353 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.845 -6.633 -2.164 1.00 2.24 O ATOM 795 OE2 GLU A 139 13.297 -8.726 -1.931 1.00 2.92 O ATOM 0 H GLU A 139 8.830 -8.147 -2.965 1.00 0.24 H new ATOM 0 HA GLU A 139 10.293 -5.862 -1.961 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.209 -7.228 -4.727 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.541 -6.261 -4.126 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.618 -8.662 -2.519 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.619 -8.918 -3.934 1.00 1.09 H new ATOM 802 N ARG A 140 8.186 -5.318 -4.391 1.00 0.26 N ATOM 803 CA ARG A 140 7.572 -4.230 -5.206 1.00 0.33 C ATOM 804 C ARG A 140 6.785 -3.242 -4.341 1.00 0.29 C ATOM 805 O ARG A 140 7.074 -2.060 -4.305 1.00 0.35 O ATOM 806 CB ARG A 140 6.627 -4.976 -6.160 1.00 0.42 C ATOM 807 CG ARG A 140 6.223 -4.080 -7.331 1.00 1.07 C ATOM 808 CD ARG A 140 5.284 -4.858 -8.256 1.00 1.17 C ATOM 809 NE ARG A 140 5.314 -4.120 -9.549 1.00 0.98 N ATOM 810 CZ ARG A 140 6.128 -4.503 -10.495 1.00 1.13 C ATOM 811 NH1 ARG A 140 5.895 -5.608 -11.148 1.00 1.60 N ATOM 812 NH2 ARG A 140 7.178 -3.784 -10.784 1.00 1.55 N ATOM 0 H ARG A 140 7.772 -6.241 -4.519 1.00 0.26 H new ATOM 0 HA ARG A 140 8.325 -3.632 -5.720 1.00 0.33 H new ATOM 0 HB2 ARG A 140 7.116 -5.875 -6.535 1.00 0.42 H new ATOM 0 HB3 ARG A 140 5.737 -5.299 -5.619 1.00 0.42 H new ATOM 0 HG2 ARG A 140 5.729 -3.181 -6.963 1.00 1.07 H new ATOM 0 HG3 ARG A 140 7.108 -3.756 -7.879 1.00 1.07 H new ATOM 0 HD2 ARG A 140 5.619 -5.888 -8.382 1.00 1.17 H new ATOM 0 HD3 ARG A 140 4.274 -4.899 -7.849 1.00 1.17 H new ATOM 0 HE ARG A 140 4.701 -3.318 -9.695 1.00 0.98 H new ATOM 0 HH11 ARG A 140 5.077 -6.173 -10.919 1.00 1.60 H new ATOM 0 HH12 ARG A 140 6.531 -5.907 -11.887 1.00 1.60 H new ATOM 0 HH21 ARG A 140 7.363 -2.922 -10.271 1.00 1.55 H new ATOM 0 HH22 ARG A 140 7.814 -4.084 -11.523 1.00 1.55 H new ATOM 826 N VAL A 141 5.790 -3.710 -3.665 1.00 0.24 N ATOM 827 CA VAL A 141 4.954 -2.798 -2.823 1.00 0.27 C ATOM 828 C VAL A 141 5.711 -2.193 -1.638 1.00 0.25 C ATOM 829 O VAL A 141 5.491 -1.054 -1.295 1.00 0.29 O ATOM 830 CB VAL A 141 3.785 -3.643 -2.349 1.00 0.28 C ATOM 831 CG1 VAL A 141 2.998 -4.119 -3.566 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.287 -4.855 -1.566 1.00 0.23 C ATOM 0 H VAL A 141 5.508 -4.690 -3.651 1.00 0.24 H new ATOM 0 HA VAL A 141 4.637 -1.935 -3.409 1.00 0.27 H new ATOM 0 HB VAL A 141 3.149 -3.044 -1.697 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.155 -4.728 -3.239 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.629 -3.256 -4.121 1.00 0.33 H new ATOM 0 HG13 VAL A 141 3.647 -4.714 -4.209 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.437 -5.451 -1.233 1.00 0.23 H new ATOM 0 HG22 VAL A 141 4.927 -5.462 -2.206 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.856 -4.518 -0.699 1.00 0.23 H new ATOM 842 N ARG A 142 6.568 -2.935 -0.985 1.00 0.21 N ATOM 843 CA ARG A 142 7.282 -2.370 0.207 1.00 0.22 C ATOM 844 C ARG A 142 8.007 -1.060 -0.130 1.00 0.24 C ATOM 845 O ARG A 142 7.862 -0.084 0.578 1.00 0.25 O ATOM 846 CB ARG A 142 8.273 -3.450 0.646 1.00 0.27 C ATOM 847 CG ARG A 142 7.517 -4.586 1.343 1.00 0.28 C ATOM 848 CD ARG A 142 7.060 -4.120 2.729 1.00 1.02 C ATOM 849 NE ARG A 142 6.366 -5.296 3.323 1.00 0.94 N ATOM 850 CZ ARG A 142 6.716 -5.732 4.502 1.00 1.48 C ATOM 851 NH1 ARG A 142 7.733 -6.540 4.622 1.00 2.10 N ATOM 852 NH2 ARG A 142 6.049 -5.359 5.560 1.00 2.24 N ATOM 0 H ARG A 142 6.805 -3.899 -1.220 1.00 0.21 H new ATOM 0 HA ARG A 142 6.579 -2.120 1.001 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.813 -3.836 -0.219 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.015 -3.025 1.322 1.00 0.27 H new ATOM 0 HG2 ARG A 142 6.656 -4.884 0.745 1.00 0.28 H new ATOM 0 HG3 ARG A 142 8.159 -5.462 1.435 1.00 0.28 H new ATOM 0 HD2 ARG A 142 7.908 -3.812 3.341 1.00 1.02 H new ATOM 0 HD3 ARG A 142 6.391 -3.263 2.656 1.00 1.02 H new ATOM 0 HE ARG A 142 5.618 -5.760 2.809 1.00 0.94 H new ATOM 0 HH11 ARG A 142 8.254 -6.830 3.795 1.00 2.10 H new ATOM 0 HH12 ARG A 142 8.007 -6.881 5.543 1.00 2.10 H new ATOM 0 HH21 ARG A 142 5.254 -4.727 5.465 1.00 2.24 H new ATOM 0 HH22 ARG A 142 6.322 -5.700 6.482 1.00 2.24 H new ATOM 866 N GLU A 143 8.769 -1.013 -1.195 1.00 0.26 N ATOM 867 CA GLU A 143 9.477 0.265 -1.539 1.00 0.31 C ATOM 868 C GLU A 143 8.447 1.374 -1.792 1.00 0.30 C ATOM 869 O GLU A 143 8.512 2.453 -1.222 1.00 0.31 O ATOM 870 CB GLU A 143 10.259 -0.041 -2.817 1.00 0.36 C ATOM 871 CG GLU A 143 11.086 1.186 -3.216 1.00 0.44 C ATOM 872 CD GLU A 143 11.882 0.901 -4.499 1.00 0.97 C ATOM 873 OE1 GLU A 143 11.846 -0.226 -4.972 1.00 1.84 O ATOM 874 OE2 GLU A 143 12.522 1.819 -4.985 1.00 1.62 O ATOM 0 H GLU A 143 8.932 -1.791 -1.835 1.00 0.26 H new ATOM 0 HA GLU A 143 10.133 0.606 -0.738 1.00 0.31 H new ATOM 0 HB2 GLU A 143 10.913 -0.898 -2.659 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.573 -0.308 -3.621 1.00 0.36 H new ATOM 0 HG2 GLU A 143 10.428 2.041 -3.371 1.00 0.44 H new ATOM 0 HG3 GLU A 143 11.768 1.451 -2.408 1.00 0.44 H new ATOM 881 N SER A 144 7.485 1.094 -2.628 1.00 0.29 N ATOM 882 CA SER A 144 6.417 2.097 -2.929 1.00 0.29 C ATOM 883 C SER A 144 5.635 2.435 -1.653 1.00 0.28 C ATOM 884 O SER A 144 5.241 3.565 -1.435 1.00 0.28 O ATOM 885 CB SER A 144 5.507 1.421 -3.957 1.00 0.29 C ATOM 886 OG SER A 144 6.207 1.291 -5.188 1.00 1.34 O ATOM 0 H SER A 144 7.390 0.206 -3.121 1.00 0.29 H new ATOM 0 HA SER A 144 6.827 3.033 -3.308 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.197 0.440 -3.596 1.00 0.29 H new ATOM 0 HB3 SER A 144 4.601 2.009 -4.101 1.00 0.29 H new ATOM 0 HG SER A 144 5.599 1.483 -5.932 1.00 1.34 H new ATOM 892 N LEU A 145 5.399 1.455 -0.819 1.00 0.27 N ATOM 893 CA LEU A 145 4.632 1.699 0.443 1.00 0.28 C ATOM 894 C LEU A 145 5.426 2.585 1.401 1.00 0.30 C ATOM 895 O LEU A 145 4.871 3.450 2.044 1.00 0.30 O ATOM 896 CB LEU A 145 4.447 0.322 1.083 1.00 0.29 C ATOM 897 CG LEU A 145 3.372 -0.474 0.346 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.486 -1.950 0.733 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.997 0.043 0.755 1.00 0.67 C ATOM 0 H LEU A 145 5.705 0.492 -0.957 1.00 0.27 H new ATOM 0 HA LEU A 145 3.687 2.200 0.233 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.390 -0.224 1.062 1.00 0.29 H new ATOM 0 HB3 LEU A 145 4.168 0.436 2.131 1.00 0.29 H new ATOM 0 HG LEU A 145 3.504 -0.362 -0.730 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.721 -2.523 0.210 1.00 0.73 H new ATOM 0 HD12 LEU A 145 4.472 -2.324 0.456 1.00 0.73 H new ATOM 0 HD13 LEU A 145 3.347 -2.056 1.809 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.225 -0.522 0.232 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.868 -0.077 1.831 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.913 1.098 0.495 1.00 0.67 H new ATOM 911 N LYS A 146 6.715 2.372 1.504 1.00 0.33 N ATOM 912 CA LYS A 146 7.540 3.200 2.440 1.00 0.35 C ATOM 913 C LYS A 146 7.461 4.679 2.067 1.00 0.34 C ATOM 914 O LYS A 146 7.264 5.525 2.922 1.00 0.35 O ATOM 915 CB LYS A 146 8.971 2.674 2.291 1.00 0.41 C ATOM 916 CG LYS A 146 9.102 1.325 3.007 1.00 1.01 C ATOM 917 CD LYS A 146 10.530 0.797 2.847 1.00 1.15 C ATOM 918 CE LYS A 146 10.663 -0.548 3.566 1.00 1.96 C ATOM 919 NZ LYS A 146 12.024 -1.042 3.212 1.00 2.32 N ATOM 0 H LYS A 146 7.231 1.663 0.983 1.00 0.33 H new ATOM 0 HA LYS A 146 7.187 3.123 3.468 1.00 0.35 H new ATOM 0 HB2 LYS A 146 9.220 2.562 1.236 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.678 3.390 2.711 1.00 0.41 H new ATOM 0 HG2 LYS A 146 8.861 1.438 4.064 1.00 1.01 H new ATOM 0 HG3 LYS A 146 8.391 0.611 2.592 1.00 1.01 H new ATOM 0 HD2 LYS A 146 10.769 0.681 1.790 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.242 1.513 3.258 1.00 1.15 H new ATOM 0 HE2 LYS A 146 10.554 -0.432 4.644 1.00 1.96 H new ATOM 0 HE3 LYS A 146 9.892 -1.247 3.241 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 12.189 -1.962 3.669 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 12.097 -1.150 2.180 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 12.737 -0.360 3.540 1.00 2.32 H new ATOM 933 N VAL A 147 7.610 5.006 0.810 1.00 0.32 N ATOM 934 CA VAL A 147 7.527 6.447 0.416 1.00 0.33 C ATOM 935 C VAL A 147 6.104 6.986 0.613 1.00 0.31 C ATOM 936 O VAL A 147 5.916 8.091 1.091 1.00 0.31 O ATOM 937 CB VAL A 147 7.965 6.523 -1.053 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.420 6.064 -1.168 1.00 0.40 C ATOM 939 CG2 VAL A 147 7.081 5.634 -1.938 1.00 0.36 C ATOM 0 H VAL A 147 7.783 4.350 0.048 1.00 0.32 H new ATOM 0 HA VAL A 147 8.173 7.066 1.039 1.00 0.33 H new ATOM 0 HB VAL A 147 7.866 7.554 -1.392 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.737 6.116 -2.210 1.00 0.40 H new ATOM 0 HG12 VAL A 147 10.055 6.712 -0.563 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.507 5.037 -0.813 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.413 5.707 -2.974 1.00 0.36 H new ATOM 0 HG22 VAL A 147 7.156 4.599 -1.604 1.00 0.36 H new ATOM 0 HG23 VAL A 147 6.045 5.964 -1.865 1.00 0.36 H new ATOM 949 N TRP A 148 5.103 6.216 0.264 1.00 0.32 N ATOM 950 CA TRP A 148 3.692 6.689 0.445 1.00 0.33 C ATOM 951 C TRP A 148 3.380 6.832 1.945 1.00 0.32 C ATOM 952 O TRP A 148 2.967 7.882 2.398 1.00 0.32 O ATOM 953 CB TRP A 148 2.807 5.612 -0.235 1.00 0.36 C ATOM 954 CG TRP A 148 1.397 5.647 0.304 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.628 6.757 0.429 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.597 4.538 0.806 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.584 6.398 1.005 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.652 5.038 1.252 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.837 3.160 0.922 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.625 4.188 1.802 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.139 2.313 1.463 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.360 2.826 1.905 1.00 0.27 C ATOM 0 H TRP A 148 5.199 5.283 -0.137 1.00 0.32 H new ATOM 0 HA TRP A 148 3.513 7.668 0.001 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.792 5.777 -1.312 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.238 4.625 -0.069 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.911 7.755 0.130 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.333 7.057 1.220 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.780 2.750 0.592 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.569 4.587 2.142 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.055 1.253 1.539 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.101 2.164 2.328 1.00 0.27 H new ATOM 973 N LYS A 149 3.557 5.782 2.708 1.00 0.36 N ATOM 974 CA LYS A 149 3.245 5.863 4.166 1.00 0.38 C ATOM 975 C LYS A 149 4.100 6.942 4.849 1.00 0.34 C ATOM 976 O LYS A 149 3.641 7.602 5.762 1.00 0.33 O ATOM 977 CB LYS A 149 3.513 4.460 4.736 1.00 0.52 C ATOM 978 CG LYS A 149 5.000 4.114 4.644 1.00 1.36 C ATOM 979 CD LYS A 149 5.694 4.453 5.961 1.00 2.07 C ATOM 980 CE LYS A 149 6.951 3.594 6.108 1.00 2.80 C ATOM 981 NZ LYS A 149 7.584 4.056 7.373 1.00 3.70 N ATOM 0 H LYS A 149 3.902 4.878 2.386 1.00 0.36 H new ATOM 0 HA LYS A 149 2.210 6.154 4.344 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.188 4.416 5.775 1.00 0.52 H new ATOM 0 HB3 LYS A 149 2.928 3.721 4.188 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.123 3.054 4.420 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.461 4.668 3.826 1.00 1.36 H new ATOM 0 HD2 LYS A 149 5.958 5.510 5.984 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.018 4.275 6.797 1.00 2.07 H new ATOM 0 HE2 LYS A 149 6.702 2.534 6.155 1.00 2.80 H new ATOM 0 HE3 LYS A 149 7.622 3.727 5.259 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 8.058 3.255 7.837 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 8.283 4.796 7.161 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 6.854 4.441 8.006 1.00 3.70 H new ATOM 995 N ASN A 150 5.325 7.143 4.411 1.00 0.37 N ATOM 996 CA ASN A 150 6.181 8.200 5.045 1.00 0.41 C ATOM 997 C ASN A 150 5.552 9.583 4.855 1.00 0.39 C ATOM 998 O ASN A 150 5.550 10.399 5.758 1.00 0.46 O ATOM 999 CB ASN A 150 7.533 8.116 4.329 1.00 0.50 C ATOM 1000 CG ASN A 150 8.490 9.177 4.886 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.510 10.298 4.416 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.295 8.869 5.864 1.00 1.27 N ATOM 0 H ASN A 150 5.764 6.626 3.650 1.00 0.37 H new ATOM 0 HA ASN A 150 6.286 8.047 6.119 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.962 7.123 4.461 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.396 8.265 3.258 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.940 9.568 6.233 1.00 1.27 H new ATOM 0 HD22 ASN A 150 9.280 7.929 6.260 1.00 1.27 H new ATOM 1009 N ALA A 151 5.028 9.855 3.686 1.00 0.38 N ATOM 1010 CA ALA A 151 4.410 11.193 3.437 1.00 0.49 C ATOM 1011 C ALA A 151 3.128 11.355 4.261 1.00 0.53 C ATOM 1012 O ALA A 151 2.904 12.383 4.873 1.00 0.72 O ATOM 1013 CB ALA A 151 4.093 11.220 1.940 1.00 0.57 C ATOM 0 H ALA A 151 5.001 9.211 2.896 1.00 0.38 H new ATOM 0 HA ALA A 151 5.075 12.007 3.726 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.635 12.175 1.682 1.00 0.57 H new ATOM 0 HB2 ALA A 151 5.014 11.093 1.371 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.404 10.411 1.699 1.00 0.57 H new ATOM 1019 N GLU A 152 2.287 10.351 4.279 1.00 0.40 N ATOM 1020 CA GLU A 152 1.018 10.446 5.062 1.00 0.50 C ATOM 1021 C GLU A 152 1.279 10.268 6.562 1.00 0.60 C ATOM 1022 O GLU A 152 1.801 9.257 6.993 1.00 1.48 O ATOM 1023 CB GLU A 152 0.138 9.315 4.527 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.693 9.830 3.348 1.00 0.77 C ATOM 1025 CD GLU A 152 0.221 10.133 2.160 1.00 1.10 C ATOM 1026 OE1 GLU A 152 1.012 9.275 1.812 1.00 1.81 O ATOM 1027 OE2 GLU A 152 0.109 11.218 1.614 1.00 1.66 O ATOM 0 H GLU A 152 2.425 9.469 3.785 1.00 0.40 H new ATOM 0 HA GLU A 152 0.546 11.422 4.951 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.758 8.476 4.210 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.518 8.946 5.315 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -1.438 9.086 3.065 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -1.235 10.729 3.639 1.00 0.77 H new ATOM 1034 N LYS A 153 0.891 11.233 7.360 1.00 0.76 N ATOM 1035 CA LYS A 153 1.081 11.114 8.838 1.00 0.67 C ATOM 1036 C LYS A 153 -0.159 10.451 9.454 1.00 0.64 C ATOM 1037 O LYS A 153 -0.168 9.262 9.712 1.00 0.57 O ATOM 1038 CB LYS A 153 1.249 12.551 9.344 1.00 0.86 C ATOM 1039 CG LYS A 153 2.594 13.115 8.881 1.00 1.17 C ATOM 1040 CD LYS A 153 3.705 12.578 9.786 1.00 1.57 C ATOM 1041 CE LYS A 153 5.008 13.332 9.508 1.00 2.22 C ATOM 1042 NZ LYS A 153 5.871 13.048 10.689 1.00 2.51 N ATOM 0 H LYS A 153 0.450 12.099 7.050 1.00 0.76 H new ATOM 0 HA LYS A 153 1.943 10.503 9.107 1.00 0.67 H new ATOM 0 HB2 LYS A 153 0.436 13.174 8.971 1.00 0.86 H new ATOM 0 HB3 LYS A 153 1.192 12.571 10.432 1.00 0.86 H new ATOM 0 HG2 LYS A 153 2.783 12.832 7.846 1.00 1.17 H new ATOM 0 HG3 LYS A 153 2.576 14.204 8.915 1.00 1.17 H new ATOM 0 HD2 LYS A 153 3.423 12.694 10.832 1.00 1.57 H new ATOM 0 HD3 LYS A 153 3.846 11.512 9.611 1.00 1.57 H new ATOM 0 HE2 LYS A 153 5.475 12.988 8.585 1.00 2.22 H new ATOM 0 HE3 LYS A 153 4.830 14.402 9.396 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 6.144 13.943 11.143 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 5.347 12.461 11.369 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 6.725 12.541 10.381 1.00 2.51 H new ATOM 1056 N LYS A 154 -1.216 11.202 9.661 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.467 10.605 10.223 1.00 0.77 C ATOM 1058 C LYS A 154 -3.088 9.676 9.176 1.00 0.62 C ATOM 1059 O LYS A 154 -3.725 8.684 9.493 1.00 0.60 O ATOM 1060 CB LYS A 154 -3.394 11.788 10.513 1.00 0.95 C ATOM 1061 CG LYS A 154 -2.727 12.730 11.519 1.00 1.29 C ATOM 1062 CD LYS A 154 -2.671 12.055 12.891 1.00 1.34 C ATOM 1063 CE LYS A 154 -2.135 13.046 13.927 1.00 2.02 C ATOM 1064 NZ LYS A 154 -2.223 12.326 15.228 1.00 2.51 N ATOM 0 H LYS A 154 -1.265 12.202 9.465 1.00 0.73 H new ATOM 0 HA LYS A 154 -2.286 10.019 11.124 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -3.616 12.324 9.590 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -4.344 11.430 10.910 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -1.721 12.983 11.185 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -3.285 13.664 11.584 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -3.665 11.712 13.180 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -2.030 11.175 12.849 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -1.108 13.334 13.704 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -2.727 13.961 13.941 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -1.873 12.941 15.990 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -3.213 12.070 15.417 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -1.644 11.463 15.187 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.879 9.986 7.920 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.433 9.138 6.827 1.00 0.47 C ATOM 1080 C ASN A 155 -2.620 7.839 6.698 1.00 0.37 C ATOM 1081 O ASN A 155 -2.963 6.965 5.924 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.299 9.994 5.564 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.165 9.419 4.439 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -4.393 8.229 4.373 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -4.663 10.226 3.542 1.00 1.03 N ATOM 0 H ASN A 155 -2.344 10.796 7.606 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.466 8.842 7.010 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -3.601 11.019 5.777 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -2.256 10.028 5.248 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -5.242 9.856 2.788 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -4.473 11.227 3.595 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.565 7.682 7.476 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.775 6.419 7.406 1.00 0.33 C ATOM 1094 C ALA A 156 -1.614 5.258 7.954 1.00 0.28 C ATOM 1095 O ALA A 156 -1.244 4.109 7.815 1.00 0.28 O ATOM 1096 CB ALA A 156 0.438 6.631 8.316 1.00 0.41 C ATOM 0 H ALA A 156 -1.227 8.372 8.147 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.483 6.185 6.382 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.060 5.736 8.308 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.019 7.480 7.956 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.100 6.828 9.333 1.00 0.41 H new ATOM 1102 N SER A 157 -2.741 5.541 8.582 1.00 0.28 N ATOM 1103 CA SER A 157 -3.571 4.434 9.129 1.00 0.28 C ATOM 1104 C SER A 157 -4.515 3.897 8.057 1.00 0.22 C ATOM 1105 O SER A 157 -4.684 4.480 6.989 1.00 0.21 O ATOM 1106 CB SER A 157 -4.369 5.050 10.277 1.00 0.34 C ATOM 1107 OG SER A 157 -4.810 6.349 9.904 1.00 1.05 O ATOM 0 H SER A 157 -3.109 6.480 8.732 1.00 0.28 H new ATOM 0 HA SER A 157 -2.958 3.598 9.464 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.225 4.419 10.519 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.752 5.107 11.174 1.00 0.34 H new ATOM 0 HG SER A 157 -4.152 7.014 10.195 1.00 1.05 H new ATOM 1113 N VAL A 158 -5.118 2.775 8.334 1.00 0.23 N ATOM 1114 CA VAL A 158 -6.040 2.164 7.343 1.00 0.22 C ATOM 1115 C VAL A 158 -7.197 3.106 7.020 1.00 0.18 C ATOM 1116 O VAL A 158 -7.499 3.309 5.871 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.551 0.866 7.970 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.376 -0.086 8.201 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.253 1.144 9.305 1.00 0.27 C ATOM 0 H VAL A 158 -5.011 2.256 9.205 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.527 1.968 6.401 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.270 0.411 7.288 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.740 -1.011 8.648 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.895 -0.308 7.248 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.655 0.382 8.871 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.608 0.206 9.732 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.551 1.614 9.994 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -8.100 1.810 9.139 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.834 3.698 8.014 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.983 4.640 7.746 1.00 0.13 C ATOM 1131 C ALA A 159 -8.651 5.590 6.599 1.00 0.13 C ATOM 1132 O ALA A 159 -9.504 5.944 5.802 1.00 0.15 O ATOM 1133 CB ALA A 159 -9.177 5.418 9.048 1.00 0.12 C ATOM 0 H ALA A 159 -7.608 3.569 9.000 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.885 4.103 7.452 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.998 6.125 8.930 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.409 4.724 9.856 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -8.262 5.961 9.287 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.405 5.957 6.484 1.00 0.13 N ATOM 1140 CA GLY A 160 -7.002 6.840 5.362 1.00 0.15 C ATOM 1141 C GLY A 160 -7.060 6.040 4.068 1.00 0.16 C ATOM 1142 O GLY A 160 -7.886 6.298 3.204 1.00 0.18 O ATOM 0 H GLY A 160 -6.653 5.683 7.117 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.665 7.703 5.303 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.995 7.223 5.525 1.00 0.15 H new ATOM 1146 N LEU A 161 -6.185 5.075 3.918 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.192 4.272 2.666 1.00 0.18 C ATOM 1148 C LEU A 161 -7.529 3.556 2.461 1.00 0.20 C ATOM 1149 O LEU A 161 -8.081 3.633 1.397 1.00 0.28 O ATOM 1150 CB LEU A 161 -5.078 3.237 2.826 1.00 0.19 C ATOM 1151 CG LEU A 161 -5.008 2.352 1.569 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.275 3.097 0.446 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.274 1.045 1.902 1.00 0.27 C ATOM 0 H LEU A 161 -5.476 4.814 4.603 1.00 0.16 H new ATOM 0 HA LEU A 161 -6.042 4.917 1.800 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -4.123 3.738 2.983 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.264 2.621 3.706 1.00 0.19 H new ATOM 0 HG LEU A 161 -6.019 2.119 1.234 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -4.229 2.465 -0.441 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.811 4.016 0.209 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.263 3.340 0.771 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.225 0.418 1.011 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.264 1.272 2.243 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.812 0.516 2.689 1.00 0.27 H new ATOM 1165 N VAL A 162 -8.048 2.841 3.443 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.330 2.094 3.211 1.00 0.26 C ATOM 1167 C VAL A 162 -10.412 3.029 2.693 1.00 0.29 C ATOM 1168 O VAL A 162 -11.194 2.658 1.840 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.740 1.456 4.545 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.610 0.564 5.063 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -10.084 2.521 5.595 1.00 0.31 C ATOM 0 H VAL A 162 -7.646 2.745 4.376 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.192 1.322 2.454 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.632 0.855 4.370 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.907 0.114 6.010 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.405 -0.222 4.336 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.712 1.164 5.212 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.370 2.034 6.527 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.214 3.155 5.769 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.912 3.132 5.236 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.445 4.242 3.169 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.467 5.203 2.658 1.00 0.34 C ATOM 1183 C LYS A 163 -11.292 5.382 1.141 1.00 0.36 C ATOM 1184 O LYS A 163 -12.178 5.087 0.363 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.187 6.522 3.385 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.205 7.577 2.941 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.931 8.897 3.665 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.952 9.944 3.215 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.713 11.121 4.097 1.00 2.30 N ATOM 0 H LYS A 163 -9.816 4.609 3.883 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.485 4.857 2.834 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.247 6.375 4.463 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.175 6.863 3.165 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -12.144 7.723 1.863 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.216 7.235 3.160 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -11.993 8.753 4.744 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -10.920 9.241 3.447 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -12.815 10.203 2.165 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -13.971 9.572 3.321 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -13.377 11.882 3.848 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -12.858 10.846 5.090 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.737 11.458 3.970 1.00 2.30 H new ATOM 1203 N ALA A 164 -10.138 5.839 0.725 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.883 6.028 -0.744 1.00 0.39 C ATOM 1205 C ALA A 164 -9.848 4.675 -1.468 1.00 0.39 C ATOM 1206 O ALA A 164 -10.313 4.523 -2.580 1.00 0.33 O ATOM 1207 CB ALA A 164 -8.515 6.710 -0.821 1.00 0.44 C ATOM 0 H ALA A 164 -9.360 6.090 1.335 1.00 0.36 H new ATOM 0 HA ALA A 164 -10.666 6.617 -1.222 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -8.253 6.884 -1.865 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -8.553 7.663 -0.293 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.763 6.070 -0.360 1.00 0.44 H new ATOM 1213 N LEU A 165 -9.249 3.716 -0.834 1.00 0.50 N ATOM 1214 CA LEU A 165 -9.085 2.347 -1.420 1.00 0.55 C ATOM 1215 C LEU A 165 -10.398 1.754 -1.959 1.00 0.45 C ATOM 1216 O LEU A 165 -10.531 1.502 -3.142 1.00 0.42 O ATOM 1217 CB LEU A 165 -8.598 1.531 -0.216 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.356 0.083 -0.584 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -6.991 -0.020 -1.272 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -8.365 -0.755 0.697 1.00 1.24 C ATOM 0 H LEU A 165 -8.850 3.820 0.099 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.414 2.351 -2.279 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.677 1.967 0.171 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -9.337 1.585 0.583 1.00 0.80 H new ATOM 0 HG LEU A 165 -9.131 -0.282 -1.258 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.799 -1.058 -1.545 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -6.989 0.598 -2.170 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -6.213 0.326 -0.591 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -8.192 -1.802 0.448 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -7.578 -0.406 1.366 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -9.332 -0.655 1.191 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.346 1.493 -1.097 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.632 0.872 -1.549 1.00 0.45 C ATOM 1234 C ARG A 166 -13.480 1.851 -2.362 1.00 0.41 C ATOM 1235 O ARG A 166 -14.203 1.455 -3.257 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.342 0.439 -0.256 1.00 0.52 C ATOM 1237 CG ARG A 166 -13.784 1.667 0.550 1.00 1.19 C ATOM 1238 CD ARG A 166 -14.179 1.236 1.965 1.00 1.53 C ATOM 1239 NE ARG A 166 -14.568 2.496 2.658 1.00 2.29 N ATOM 1240 CZ ARG A 166 -15.321 2.451 3.722 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -14.983 1.694 4.731 1.00 3.25 N ATOM 1242 NH2 ARG A 166 -16.413 3.163 3.779 1.00 3.60 N ATOM 0 H ARG A 166 -11.287 1.683 -0.097 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.460 0.028 -2.216 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -14.209 -0.176 -0.498 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -12.673 -0.176 0.345 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -12.975 2.397 0.593 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.626 2.154 0.058 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -15.005 0.525 1.945 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -13.349 0.746 2.474 1.00 1.53 H new ATOM 0 HE ARG A 166 -14.245 3.395 2.300 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -14.129 1.137 4.687 1.00 3.25 H new ATOM 0 HH12 ARG A 166 -15.573 1.660 5.563 1.00 3.25 H new ATOM 0 HH21 ARG A 166 -16.678 3.755 2.991 1.00 3.60 H new ATOM 0 HH22 ARG A 166 -17.002 3.128 4.611 1.00 3.60 H new ATOM 1256 N THR A 167 -13.405 3.119 -2.055 1.00 0.33 N ATOM 1257 CA THR A 167 -14.222 4.116 -2.817 1.00 0.36 C ATOM 1258 C THR A 167 -13.858 4.085 -4.298 1.00 0.35 C ATOM 1259 O THR A 167 -14.715 4.188 -5.157 1.00 0.41 O ATOM 1260 CB THR A 167 -13.886 5.475 -2.204 1.00 0.42 C ATOM 1261 OG1 THR A 167 -14.256 5.472 -0.834 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.646 6.589 -2.932 1.00 0.47 C ATOM 0 H THR A 167 -12.819 3.508 -1.316 1.00 0.33 H new ATOM 0 HA THR A 167 -15.288 3.900 -2.752 1.00 0.36 H new ATOM 0 HB THR A 167 -12.815 5.655 -2.302 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.506 5.795 -0.292 1.00 0.44 H new ATOM 0 HG21 THR A 167 -14.397 7.551 -2.485 1.00 0.47 H new ATOM 0 HG22 THR A 167 -14.364 6.594 -3.985 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.718 6.415 -2.845 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.598 3.953 -4.600 1.00 0.32 N ATOM 1271 CA CYS A 168 -12.180 3.927 -6.026 1.00 0.36 C ATOM 1272 C CYS A 168 -12.421 2.547 -6.638 1.00 0.31 C ATOM 1273 O CYS A 168 -13.111 2.423 -7.630 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.685 4.250 -6.009 1.00 0.40 C ATOM 1275 SG CYS A 168 -10.455 6.040 -5.861 1.00 1.38 S ATOM 0 H CYS A 168 -11.841 3.862 -3.922 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.748 4.637 -6.627 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -10.202 3.740 -5.175 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -10.213 3.886 -6.922 1.00 0.40 H new ATOM 0 HG CYS A 168 -9.184 6.314 -5.844 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.862 1.508 -6.053 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.065 0.117 -6.625 1.00 0.31 C ATOM 1283 C ARG A 169 -11.385 -0.995 -5.808 1.00 0.26 C ATOM 1284 O ARG A 169 -11.614 -2.165 -6.056 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.439 0.142 -8.028 1.00 0.44 C ATOM 1286 CG ARG A 169 -11.817 -1.140 -8.771 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.412 -1.016 -10.241 1.00 0.84 C ATOM 1288 NE ARG A 169 -12.348 -0.008 -10.810 1.00 1.56 N ATOM 1289 CZ ARG A 169 -11.921 0.859 -11.687 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -11.696 0.486 -12.917 1.00 2.74 N ATOM 1291 NH2 ARG A 169 -11.719 2.099 -11.334 1.00 2.73 N ATOM 0 H ARG A 169 -11.281 1.553 -5.216 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.131 -0.111 -6.619 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.790 1.014 -8.580 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.355 0.227 -7.954 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.319 -1.997 -8.317 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -12.890 -1.316 -8.692 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -10.376 -0.693 -10.340 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -11.499 -1.972 -10.757 1.00 0.84 H new ATOM 0 HE ARG A 169 -13.324 0.005 -10.514 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -11.854 -0.483 -13.193 1.00 2.74 H new ATOM 0 HH12 ARG A 169 -11.362 1.164 -13.602 1.00 2.74 H new ATOM 0 HH21 ARG A 169 -11.895 2.391 -10.373 1.00 2.73 H new ATOM 0 HH22 ARG A 169 -11.385 2.777 -12.020 1.00 2.73 H new ATOM 1305 N LEU A 170 -10.518 -0.661 -4.894 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.782 -1.715 -4.126 1.00 0.17 C ATOM 1307 C LEU A 170 -10.614 -2.296 -2.971 1.00 0.19 C ATOM 1308 O LEU A 170 -10.181 -2.339 -1.832 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.556 -0.976 -3.607 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.660 -0.570 -4.784 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.716 0.949 -4.992 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.220 -0.972 -4.476 1.00 0.25 C ATOM 0 H LEU A 170 -10.283 0.299 -4.642 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.539 -2.580 -4.743 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.862 -0.091 -3.049 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.001 -1.612 -2.917 1.00 0.18 H new ATOM 0 HG LEU A 170 -8.010 -1.071 -5.687 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.076 1.225 -5.830 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.742 1.250 -5.204 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.370 1.453 -4.090 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.577 -0.687 -5.308 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.887 -0.466 -3.570 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.167 -2.051 -4.330 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.799 -2.754 -3.270 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.683 -3.351 -2.224 1.00 0.30 C ATOM 1326 C ASN A 171 -12.042 -4.596 -1.591 1.00 0.24 C ATOM 1327 O ASN A 171 -12.215 -4.858 -0.416 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.956 -3.744 -2.974 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.155 -3.598 -2.047 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.691 -4.570 -1.554 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.600 -2.401 -1.796 1.00 0.59 N ATOM 0 H ASN A 171 -12.199 -2.740 -4.208 1.00 0.24 H new ATOM 0 HA ASN A 171 -12.868 -2.652 -1.408 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.083 -3.112 -3.853 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.880 -4.772 -3.329 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.404 -2.274 -1.181 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.145 -1.590 -2.214 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.338 -5.388 -2.370 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.726 -6.650 -1.820 1.00 0.21 C ATOM 1340 C LEU A 172 -9.924 -6.391 -0.547 1.00 0.17 C ATOM 1341 O LEU A 172 -10.279 -6.844 0.524 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.766 -7.136 -2.908 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.557 -7.669 -4.103 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -9.608 -7.889 -5.281 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -11.209 -9.001 -3.724 1.00 0.85 C ATOM 0 H LEU A 172 -11.160 -5.218 -3.360 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.505 -7.370 -1.567 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -9.119 -6.318 -3.225 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -9.119 -7.919 -2.511 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.327 -6.950 -4.382 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -10.169 -8.269 -6.134 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -9.136 -6.944 -5.549 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -8.841 -8.611 -5.001 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -11.774 -9.384 -4.574 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -10.436 -9.719 -3.448 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -11.881 -8.850 -2.880 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.847 -5.669 -0.660 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.007 -5.390 0.539 1.00 0.21 C ATOM 1359 C VAL A 173 -8.799 -4.591 1.569 1.00 0.22 C ATOM 1360 O VAL A 173 -8.616 -4.760 2.761 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.791 -4.612 0.039 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.912 -5.546 -0.793 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.213 -3.408 -0.815 1.00 0.34 C ATOM 0 H VAL A 173 -8.510 -5.259 -1.531 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.695 -6.309 1.035 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.238 -4.238 0.901 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.041 -5.000 -1.155 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.585 -6.383 -0.176 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.483 -5.922 -1.642 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.326 -2.875 -1.156 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.781 -3.755 -1.678 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -7.832 -2.738 -0.219 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.698 -3.746 1.130 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.527 -2.965 2.103 1.00 0.34 C ATOM 1375 C ALA A 174 -11.297 -3.946 2.997 1.00 0.29 C ATOM 1376 O ALA A 174 -11.372 -3.785 4.200 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.492 -2.149 1.242 1.00 0.43 C ATOM 0 H ALA A 174 -9.894 -3.563 0.146 1.00 0.27 H new ATOM 0 HA ALA A 174 -9.932 -2.321 2.750 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.135 -1.549 1.886 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -10.925 -1.493 0.582 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.105 -2.823 0.644 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.854 -4.973 2.404 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.600 -5.993 3.200 1.00 0.23 C ATOM 1385 C ASP A 175 -11.685 -6.659 4.232 1.00 0.17 C ATOM 1386 O ASP A 175 -12.080 -6.883 5.361 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.097 -7.024 2.181 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.215 -6.415 1.329 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -14.907 -5.540 1.825 1.00 0.80 O ATOM 1390 OD2 ASP A 175 -14.361 -6.836 0.193 1.00 0.99 O ATOM 0 H ASP A 175 -11.823 -5.148 1.400 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.421 -5.542 3.757 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.274 -7.344 1.542 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.463 -7.912 2.697 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.474 -6.995 3.851 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.550 -7.669 4.820 1.00 0.20 C ATOM 1397 C LEU A 176 -9.253 -6.746 6.000 1.00 0.25 C ATOM 1398 O LEU A 176 -9.446 -7.112 7.145 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.250 -7.964 4.042 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.369 -9.197 3.103 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.775 -9.352 2.504 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -7.356 -9.048 1.962 1.00 1.09 C ATOM 0 H LEU A 176 -10.088 -6.834 2.921 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.994 -8.581 5.219 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.981 -7.089 3.451 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.439 -8.131 4.751 1.00 0.28 H new ATOM 0 HG LEU A 176 -8.169 -10.086 3.700 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -9.800 -10.229 1.857 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.501 -9.473 3.308 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -10.022 -8.464 1.922 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -7.429 -9.907 1.296 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -7.569 -8.136 1.403 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -6.349 -8.994 2.375 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.793 -5.550 5.730 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.493 -4.602 6.843 1.00 0.41 C ATOM 1416 C VAL A 177 -9.791 -4.269 7.583 1.00 0.37 C ATOM 1417 O VAL A 177 -9.827 -4.216 8.798 1.00 0.39 O ATOM 1418 CB VAL A 177 -7.882 -3.354 6.186 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.603 -3.742 5.440 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -8.874 -2.729 5.197 1.00 0.52 C ATOM 0 H VAL A 177 -8.613 -5.192 4.792 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.802 -5.020 7.575 1.00 0.41 H new ATOM 0 HB VAL A 177 -7.651 -2.627 6.965 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.170 -2.856 4.974 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -5.887 -4.169 6.143 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.839 -4.477 4.671 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.426 -1.846 4.741 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.119 -3.454 4.421 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -9.783 -2.442 5.726 1.00 0.52 H new ATOM 1430 N GLU A 178 -10.863 -4.076 6.854 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.175 -3.783 7.508 1.00 0.39 C ATOM 1432 C GLU A 178 -12.585 -4.956 8.410 1.00 0.31 C ATOM 1433 O GLU A 178 -12.917 -4.778 9.567 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.152 -3.607 6.338 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.598 -3.556 6.844 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.549 -3.135 5.713 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -15.073 -2.842 4.626 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.745 -3.116 5.955 1.00 1.85 O ATOM 0 H GLU A 178 -10.886 -4.109 5.835 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.148 -2.901 8.147 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -12.918 -2.690 5.797 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.036 -4.431 5.634 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -14.890 -4.534 7.228 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.675 -2.852 7.673 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.549 -6.153 7.885 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.929 -7.346 8.701 1.00 0.24 C ATOM 1447 C GLU A 179 -12.005 -7.457 9.914 1.00 0.25 C ATOM 1448 O GLU A 179 -12.410 -7.885 10.978 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.771 -8.545 7.760 1.00 0.31 C ATOM 1450 CG GLU A 179 -13.969 -8.602 6.806 1.00 1.03 C ATOM 1451 CD GLU A 179 -13.816 -9.782 5.840 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -13.139 -10.735 6.192 1.00 1.76 O ATOM 1453 OE2 GLU A 179 -14.378 -9.710 4.759 1.00 1.92 O ATOM 0 H GLU A 179 -12.272 -6.357 6.925 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.946 -7.286 9.089 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.844 -8.457 7.193 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.706 -9.468 8.336 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -14.893 -8.705 7.375 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -14.042 -7.670 6.246 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.770 -7.064 9.754 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.806 -7.129 10.892 1.00 0.38 C ATOM 1462 C ALA A 180 -10.191 -6.132 11.992 1.00 0.44 C ATOM 1463 O ALA A 180 -10.085 -6.432 13.167 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.448 -6.758 10.291 1.00 0.50 C ATOM 0 H ALA A 180 -10.386 -6.700 8.882 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.796 -8.116 11.354 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.686 -6.784 11.070 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.190 -7.470 9.507 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.499 -5.755 9.867 1.00 0.50 H new ATOM 1470 N GLN A 181 -10.625 -4.947 11.627 1.00 0.48 N ATOM 1471 CA GLN A 181 -11.000 -3.937 12.672 1.00 0.70 C ATOM 1472 C GLN A 181 -12.388 -4.230 13.257 1.00 0.71 C ATOM 1473 O GLN A 181 -12.749 -3.705 14.294 1.00 1.08 O ATOM 1474 CB GLN A 181 -10.981 -2.567 11.982 1.00 1.25 C ATOM 1475 CG GLN A 181 -11.931 -2.554 10.784 1.00 1.59 C ATOM 1476 CD GLN A 181 -12.181 -1.108 10.351 1.00 2.23 C ATOM 1477 OE1 GLN A 181 -12.969 -0.408 10.956 1.00 2.65 O ATOM 1478 NE2 GLN A 181 -11.537 -0.627 9.324 1.00 2.46 N ATOM 0 H GLN A 181 -10.735 -4.637 10.661 1.00 0.48 H new ATOM 0 HA GLN A 181 -10.299 -3.969 13.506 1.00 0.70 H new ATOM 0 HB2 GLN A 181 -11.272 -1.792 12.692 1.00 1.25 H new ATOM 0 HB3 GLN A 181 -9.968 -2.334 11.653 1.00 1.25 H new ATOM 0 HG2 GLN A 181 -11.502 -3.123 9.959 1.00 1.59 H new ATOM 0 HG3 GLN A 181 -12.873 -3.035 11.047 1.00 1.59 H new ATOM 0 HE21 GLN A 181 -10.876 -1.214 8.816 1.00 2.46 H new ATOM 0 HE22 GLN A 181 -11.695 0.337 9.029 1.00 2.46 H new ATOM 1487 N GLU A 182 -13.169 -5.069 12.614 1.00 0.74 N ATOM 1488 CA GLU A 182 -14.535 -5.405 13.143 1.00 1.33 C ATOM 1489 C GLU A 182 -15.336 -4.135 13.470 1.00 2.14 C ATOM 1490 O GLU A 182 -16.029 -4.070 14.467 1.00 2.63 O ATOM 1491 CB GLU A 182 -14.276 -6.215 14.415 1.00 1.79 C ATOM 1492 CG GLU A 182 -13.691 -7.581 14.039 1.00 2.06 C ATOM 1493 CD GLU A 182 -13.423 -8.412 15.302 1.00 2.67 C ATOM 1494 OE1 GLU A 182 -13.509 -7.865 16.392 1.00 2.49 O ATOM 1495 OE2 GLU A 182 -13.128 -9.587 15.156 1.00 3.67 O ATOM 0 H GLU A 182 -12.919 -5.537 11.743 1.00 0.74 H new ATOM 0 HA GLU A 182 -15.125 -5.956 12.410 1.00 1.33 H new ATOM 0 HB2 GLU A 182 -13.586 -5.679 15.067 1.00 1.79 H new ATOM 0 HB3 GLU A 182 -15.204 -6.345 14.972 1.00 1.79 H new ATOM 0 HG2 GLU A 182 -14.382 -8.113 13.385 1.00 2.06 H new ATOM 0 HG3 GLU A 182 -12.765 -7.446 13.481 1.00 2.06 H new ATOM 1502 N SER A 183 -15.247 -3.125 12.635 1.00 2.57 N ATOM 1503 CA SER A 183 -16.000 -1.849 12.886 1.00 3.70 C ATOM 1504 C SER A 183 -15.697 -1.306 14.290 1.00 4.04 C ATOM 1505 O SER A 183 -14.551 -1.390 14.700 1.00 4.36 O ATOM 1506 CB SER A 183 -17.482 -2.219 12.757 1.00 4.22 C ATOM 1507 OG SER A 183 -17.715 -2.787 11.475 1.00 4.75 O ATOM 1508 OXT SER A 183 -16.614 -0.815 14.929 1.00 4.26 O ATOM 0 H SER A 183 -14.682 -3.128 11.785 1.00 2.57 H new ATOM 0 HA SER A 183 -15.715 -1.067 12.182 1.00 3.70 H new ATOM 0 HB2 SER A 183 -17.761 -2.927 13.537 1.00 4.22 H new ATOM 0 HB3 SER A 183 -18.103 -1.334 12.893 1.00 4.22 H new ATOM 0 HG SER A 183 -18.662 -3.026 11.390 1.00 4.75 H new TER 1514 SER A 183