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 Set 1.1: A 122 SER OG : rot 140:sc= 0.0299 USER MOD Set 1.2: A 125 LYS NZ :NH3+ -174:sc= -0.257 (180deg=-0.357) USER MOD Set 2.1: A 96 TYR OH : rot -18:sc= 1.15 USER MOD Set 2.2: A 181 GLN : amide:sc= 0.671 K(o=1.8,f=0.17!) USER MOD Single : A 98 GLN : amide:sc= -0.0116 K(o=-0.012,f=-1.6!) USER MOD Single : A 105 CYS SG : rot 180:sc= -4.09! USER MOD Single : A 107 ASN : amide:sc= -5.66! C(o=-5.7!,f=-4.5!) USER MOD Single : A 113 LYS NZ :NH3+ 153:sc= -0.171 (180deg=-1.15!) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl -151:sc= -0.236 (180deg=-1.61!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 170:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot -51:sc= -0.266 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ -152:sc= -0.71 (180deg=-1.96!) USER MOD Single : A 150 ASN : amide:sc= -1.41 K(o=-1.4,f=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0384) USER MOD Single : A 155 ASN : amide:sc= -0.0347 X(o=-0.035,f=0) USER MOD Single : A 157 SER OG : rot -91:sc= 1.19 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 88:sc= 1.16 USER MOD Single : A 168 CYS SG : rot 89:sc= -0.403 USER MOD Single : A 171 ASN : amide:sc= -0.657 X(o=-0.66,f=-1) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 89 8.651 11.203 12.494 1.00 1.92 N ATOM 2 CA ALA A 89 8.573 11.623 11.061 1.00 1.43 C ATOM 3 C ALA A 89 7.782 10.588 10.260 1.00 1.08 C ATOM 4 O ALA A 89 6.641 10.808 9.899 1.00 1.13 O ATOM 5 CB ALA A 89 10.026 11.682 10.586 1.00 1.90 C ATOM 0 HA ALA A 89 8.068 12.580 10.932 1.00 1.43 H new ATOM 0 HB1 ALA A 89 10.055 11.984 9.539 1.00 1.90 H new ATOM 0 HB2 ALA A 89 10.576 12.405 11.188 1.00 1.90 H new ATOM 0 HB3 ALA A 89 10.484 10.699 10.692 1.00 1.90 H new ATOM 11 N ALA A 90 8.375 9.452 10.001 1.00 0.96 N ATOM 12 CA ALA A 90 7.657 8.382 9.243 1.00 0.72 C ATOM 13 C ALA A 90 6.487 7.890 10.095 1.00 0.58 C ATOM 14 O ALA A 90 6.275 8.408 11.175 1.00 1.23 O ATOM 15 CB ALA A 90 8.703 7.278 9.028 1.00 1.03 C ATOM 0 H ALA A 90 9.327 9.218 10.282 1.00 0.96 H new ATOM 0 HA ALA A 90 7.249 8.717 8.290 1.00 0.72 H new ATOM 0 HB1 ALA A 90 8.253 6.453 8.476 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.543 7.678 8.461 1.00 1.03 H new ATOM 0 HB3 ALA A 90 9.056 6.918 9.994 1.00 1.03 H new ATOM 21 N PRO A 91 5.746 6.918 9.608 1.00 0.79 N ATOM 22 CA PRO A 91 4.591 6.414 10.389 1.00 1.10 C ATOM 23 C PRO A 91 5.064 5.868 11.746 1.00 0.60 C ATOM 24 O PRO A 91 5.733 4.856 11.800 1.00 0.91 O ATOM 25 CB PRO A 91 4.003 5.319 9.495 1.00 1.98 C ATOM 26 CG PRO A 91 5.133 4.919 8.613 1.00 2.18 C ATOM 27 CD PRO A 91 5.885 6.190 8.337 1.00 1.62 C ATOM 0 HA PRO A 91 3.854 7.180 10.628 1.00 1.10 H new ATOM 0 HB2 PRO A 91 3.640 4.477 10.084 1.00 1.98 H new ATOM 0 HB3 PRO A 91 3.158 5.690 8.915 1.00 1.98 H new ATOM 0 HG2 PRO A 91 5.771 4.182 9.100 1.00 2.18 H new ATOM 0 HG3 PRO A 91 4.771 4.467 7.690 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.929 5.999 8.090 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.456 6.744 7.502 1.00 1.62 H new ATOM 35 N PRO A 92 4.704 6.560 12.815 1.00 0.59 N ATOM 36 CA PRO A 92 5.116 6.118 14.172 1.00 0.84 C ATOM 37 C PRO A 92 4.528 4.730 14.447 1.00 0.71 C ATOM 38 O PRO A 92 5.228 3.817 14.851 1.00 0.83 O ATOM 39 CB PRO A 92 4.545 7.204 15.094 1.00 1.49 C ATOM 40 CG PRO A 92 3.431 7.809 14.309 1.00 1.64 C ATOM 41 CD PRO A 92 3.888 7.784 12.876 1.00 1.21 C ATOM 0 HA PRO A 92 6.192 6.015 14.311 1.00 0.84 H new ATOM 0 HB2 PRO A 92 4.186 6.780 16.032 1.00 1.49 H new ATOM 0 HB3 PRO A 92 5.301 7.947 15.349 1.00 1.49 H new ATOM 0 HG2 PRO A 92 2.509 7.243 14.436 1.00 1.64 H new ATOM 0 HG3 PRO A 92 3.227 8.828 14.638 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.047 7.744 12.184 1.00 1.21 H new ATOM 0 HD3 PRO A 92 4.469 8.670 12.621 1.00 1.21 H new ATOM 49 N GLY A 93 3.256 4.552 14.185 1.00 0.65 N ATOM 50 CA GLY A 93 2.635 3.206 14.374 1.00 0.71 C ATOM 51 C GLY A 93 2.800 2.376 13.098 1.00 0.58 C ATOM 52 O GLY A 93 1.837 1.912 12.519 1.00 0.58 O ATOM 0 H GLY A 93 2.624 5.279 13.850 1.00 0.65 H new ATOM 0 HA2 GLY A 93 3.103 2.694 15.215 1.00 0.71 H new ATOM 0 HA3 GLY A 93 1.577 3.314 14.615 1.00 0.71 H new ATOM 56 N GLU A 94 4.014 2.199 12.653 1.00 0.56 N ATOM 57 CA GLU A 94 4.261 1.407 11.405 1.00 0.55 C ATOM 58 C GLU A 94 3.752 -0.013 11.566 1.00 0.49 C ATOM 59 O GLU A 94 3.229 -0.600 10.639 1.00 0.53 O ATOM 60 CB GLU A 94 5.777 1.422 11.213 1.00 0.66 C ATOM 61 CG GLU A 94 6.145 0.709 9.908 1.00 1.09 C ATOM 62 CD GLU A 94 7.670 0.725 9.715 1.00 1.10 C ATOM 63 OE1 GLU A 94 8.368 1.194 10.602 1.00 1.62 O ATOM 64 OE2 GLU A 94 8.116 0.273 8.673 1.00 1.44 O ATOM 0 H GLU A 94 4.853 2.569 13.100 1.00 0.56 H new ATOM 0 HA GLU A 94 3.741 1.828 10.545 1.00 0.55 H new ATOM 0 HB2 GLU A 94 6.139 2.450 11.190 1.00 0.66 H new ATOM 0 HB3 GLU A 94 6.264 0.931 12.056 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.783 -0.319 9.931 1.00 1.09 H new ATOM 0 HG3 GLU A 94 5.658 1.200 9.065 1.00 1.09 H new ATOM 71 N ALA A 95 3.905 -0.578 12.732 1.00 0.49 N ATOM 72 CA ALA A 95 3.433 -1.973 12.947 1.00 0.50 C ATOM 73 C ALA A 95 1.938 -2.081 12.630 1.00 0.38 C ATOM 74 O ALA A 95 1.474 -3.122 12.198 1.00 0.36 O ATOM 75 CB ALA A 95 3.717 -2.274 14.426 1.00 0.61 C ATOM 0 H ALA A 95 4.336 -0.134 13.543 1.00 0.49 H new ATOM 0 HA ALA A 95 3.937 -2.687 12.296 1.00 0.50 H new ATOM 0 HB1 ALA A 95 3.394 -3.289 14.659 1.00 0.61 H new ATOM 0 HB2 ALA A 95 4.786 -2.180 14.618 1.00 0.61 H new ATOM 0 HB3 ALA A 95 3.173 -1.567 15.052 1.00 0.61 H new ATOM 81 N TYR A 96 1.178 -1.022 12.818 1.00 0.38 N ATOM 82 CA TYR A 96 -0.276 -1.103 12.489 1.00 0.35 C ATOM 83 C TYR A 96 -0.480 -1.148 10.972 1.00 0.28 C ATOM 84 O TYR A 96 -1.005 -2.111 10.446 1.00 0.29 O ATOM 85 CB TYR A 96 -0.932 0.135 13.104 1.00 0.42 C ATOM 86 CG TYR A 96 -2.444 0.021 13.002 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.092 -1.191 13.307 1.00 1.47 C ATOM 88 CD2 TYR A 96 -3.200 1.131 12.606 1.00 1.54 C ATOM 89 CE1 TYR A 96 -4.483 -1.285 13.211 1.00 1.85 C ATOM 90 CE2 TYR A 96 -4.594 1.033 12.512 1.00 1.93 C ATOM 91 CZ TYR A 96 -5.234 -0.173 12.815 1.00 1.77 C ATOM 92 OH TYR A 96 -6.608 -0.267 12.723 1.00 2.32 O ATOM 0 H TYR A 96 1.499 -0.123 13.178 1.00 0.38 H new ATOM 0 HA TYR A 96 -0.725 -2.012 12.890 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -0.635 0.234 14.148 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -0.590 1.033 12.589 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -2.513 -2.049 13.616 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.708 2.064 12.373 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -4.978 -2.216 13.443 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -5.175 1.890 12.205 1.00 1.93 H new ATOM 0 HH TYR A 96 -6.869 -1.211 12.681 1.00 2.32 H new ATOM 102 N LEU A 97 -0.062 -0.120 10.260 1.00 0.42 N ATOM 103 CA LEU A 97 -0.230 -0.134 8.775 1.00 0.55 C ATOM 104 C LEU A 97 0.593 -1.281 8.182 1.00 0.43 C ATOM 105 O LEU A 97 0.254 -1.817 7.149 1.00 0.35 O ATOM 106 CB LEU A 97 0.235 1.244 8.270 1.00 0.90 C ATOM 107 CG LEU A 97 1.753 1.399 8.439 1.00 0.94 C ATOM 108 CD1 LEU A 97 2.440 1.287 7.076 1.00 1.33 C ATOM 109 CD2 LEU A 97 2.066 2.769 9.048 1.00 1.75 C ATOM 0 H LEU A 97 0.382 0.715 10.642 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.264 -0.303 8.473 1.00 0.55 H new ATOM 0 HB2 LEU A 97 -0.033 1.362 7.220 1.00 0.90 H new ATOM 0 HB3 LEU A 97 -0.280 2.031 8.821 1.00 0.90 H new ATOM 0 HG LEU A 97 2.120 0.612 9.098 1.00 0.94 H new ATOM 0 HD11 LEU A 97 3.517 1.398 7.201 1.00 1.33 H new ATOM 0 HD12 LEU A 97 2.224 0.312 6.639 1.00 1.33 H new ATOM 0 HD13 LEU A 97 2.069 2.071 6.416 1.00 1.33 H new ATOM 0 HD21 LEU A 97 3.144 2.877 9.167 1.00 1.75 H new ATOM 0 HD22 LEU A 97 1.694 3.554 8.389 1.00 1.75 H new ATOM 0 HD23 LEU A 97 1.583 2.853 10.022 1.00 1.75 H new ATOM 121 N GLN A 98 1.666 -1.671 8.839 1.00 0.47 N ATOM 122 CA GLN A 98 2.484 -2.801 8.306 1.00 0.49 C ATOM 123 C GLN A 98 1.652 -4.087 8.329 1.00 0.38 C ATOM 124 O GLN A 98 1.653 -4.847 7.376 1.00 0.39 O ATOM 125 CB GLN A 98 3.691 -2.915 9.242 1.00 0.63 C ATOM 126 CG GLN A 98 4.598 -4.059 8.775 1.00 0.57 C ATOM 127 CD GLN A 98 5.887 -4.071 9.604 1.00 1.24 C ATOM 128 OE1 GLN A 98 6.190 -3.122 10.302 1.00 2.00 O ATOM 129 NE2 GLN A 98 6.663 -5.120 9.563 1.00 2.04 N ATOM 0 H GLN A 98 2.003 -1.259 9.709 1.00 0.47 H new ATOM 0 HA GLN A 98 2.801 -2.636 7.276 1.00 0.49 H new ATOM 0 HB2 GLN A 98 4.247 -1.977 9.251 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.356 -3.097 10.263 1.00 0.63 H new ATOM 0 HG2 GLN A 98 4.079 -5.012 8.879 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.836 -3.939 7.718 1.00 0.57 H new ATOM 0 HE21 GLN A 98 6.412 -5.918 8.979 1.00 2.04 H new ATOM 0 HE22 GLN A 98 7.520 -5.142 10.115 1.00 2.04 H new ATOM 138 N VAL A 99 0.923 -4.329 9.398 1.00 0.33 N ATOM 139 CA VAL A 99 0.075 -5.563 9.456 1.00 0.31 C ATOM 140 C VAL A 99 -0.969 -5.486 8.341 1.00 0.24 C ATOM 141 O VAL A 99 -1.155 -6.417 7.578 1.00 0.30 O ATOM 142 CB VAL A 99 -0.591 -5.547 10.842 1.00 0.32 C ATOM 143 CG1 VAL A 99 -1.578 -6.714 10.960 1.00 0.43 C ATOM 144 CG2 VAL A 99 0.483 -5.683 11.924 1.00 0.43 C ATOM 0 H VAL A 99 0.880 -3.731 10.223 1.00 0.33 H new ATOM 0 HA VAL A 99 0.646 -6.481 9.317 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.127 -4.607 10.970 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -2.046 -6.697 11.944 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -2.345 -6.621 10.192 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -1.045 -7.656 10.828 1.00 0.43 H new ATOM 0 HG21 VAL A 99 0.012 -5.672 12.907 1.00 0.43 H new ATOM 0 HG22 VAL A 99 1.019 -6.623 11.789 1.00 0.43 H new ATOM 0 HG23 VAL A 99 1.184 -4.852 11.848 1.00 0.43 H new ATOM 154 N ALA A 100 -1.630 -4.362 8.233 1.00 0.18 N ATOM 155 CA ALA A 100 -2.645 -4.187 7.154 1.00 0.18 C ATOM 156 C ALA A 100 -1.948 -4.269 5.801 1.00 0.14 C ATOM 157 O ALA A 100 -2.365 -4.991 4.927 1.00 0.14 O ATOM 158 CB ALA A 100 -3.231 -2.791 7.376 1.00 0.24 C ATOM 0 H ALA A 100 -1.509 -3.557 8.847 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.423 -4.951 7.174 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -3.988 -2.589 6.618 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -3.686 -2.740 8.365 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -2.437 -2.047 7.303 1.00 0.24 H new ATOM 164 N PHE A 101 -0.867 -3.548 5.645 1.00 0.15 N ATOM 165 CA PHE A 101 -0.098 -3.583 4.360 1.00 0.16 C ATOM 166 C PHE A 101 0.317 -5.013 4.020 1.00 0.17 C ATOM 167 O PHE A 101 0.629 -5.300 2.899 1.00 0.20 O ATOM 168 CB PHE A 101 1.157 -2.727 4.617 1.00 0.19 C ATOM 169 CG PHE A 101 0.885 -1.228 4.479 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.417 -0.694 4.562 1.00 1.21 C ATOM 171 CD2 PHE A 101 1.971 -0.362 4.282 1.00 1.10 C ATOM 172 CE1 PHE A 101 -0.618 0.687 4.446 1.00 1.26 C ATOM 173 CE2 PHE A 101 1.764 1.017 4.170 1.00 1.10 C ATOM 174 CZ PHE A 101 0.472 1.541 4.251 1.00 0.43 C ATOM 0 H PHE A 101 -0.479 -2.930 6.358 1.00 0.15 H new ATOM 0 HA PHE A 101 -0.694 -3.211 3.526 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.534 -2.933 5.619 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.940 -3.017 3.916 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.261 -1.351 4.715 1.00 1.21 H new ATOM 0 HD2 PHE A 101 2.972 -0.762 4.216 1.00 1.10 H new ATOM 0 HE1 PHE A 101 -1.617 1.093 4.507 1.00 1.26 H new ATOM 0 HE2 PHE A 101 2.605 1.678 4.021 1.00 1.10 H new ATOM 0 HZ PHE A 101 0.315 2.606 4.163 1.00 0.43 H new ATOM 184 N ASP A 102 0.337 -5.906 4.974 1.00 0.18 N ATOM 185 CA ASP A 102 0.755 -7.309 4.670 1.00 0.21 C ATOM 186 C ASP A 102 -0.408 -8.118 4.110 1.00 0.20 C ATOM 187 O ASP A 102 -0.301 -8.716 3.054 1.00 0.22 O ATOM 188 CB ASP A 102 1.197 -7.882 6.004 1.00 0.25 C ATOM 189 CG ASP A 102 1.961 -9.187 5.775 1.00 0.32 C ATOM 190 OD1 ASP A 102 2.681 -9.265 4.793 1.00 1.01 O ATOM 191 OD2 ASP A 102 1.814 -10.086 6.586 1.00 1.13 O ATOM 0 H ASP A 102 0.084 -5.728 5.946 1.00 0.18 H new ATOM 0 HA ASP A 102 1.545 -7.340 3.919 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.830 -7.165 6.527 1.00 0.25 H new ATOM 0 HB3 ASP A 102 0.329 -8.063 6.639 1.00 0.25 H new ATOM 196 N ILE A 103 -1.520 -8.152 4.808 1.00 0.18 N ATOM 197 CA ILE A 103 -2.683 -8.938 4.301 1.00 0.18 C ATOM 198 C ILE A 103 -3.133 -8.377 2.958 1.00 0.17 C ATOM 199 O ILE A 103 -3.417 -9.112 2.029 1.00 0.18 O ATOM 200 CB ILE A 103 -3.802 -8.804 5.356 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.126 -7.325 5.650 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.375 -9.501 6.646 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.259 -7.232 6.680 1.00 0.87 C ATOM 0 H ILE A 103 -1.669 -7.674 5.697 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.426 -9.986 4.150 1.00 0.18 H new ATOM 0 HB ILE A 103 -4.701 -9.274 4.958 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.238 -6.817 6.027 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.417 -6.818 4.730 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.166 -9.406 7.390 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.191 -10.556 6.445 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -2.463 -9.039 7.025 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -5.482 -6.184 6.882 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.149 -7.723 6.287 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -4.952 -7.722 7.604 1.00 0.87 H new ATOM 215 N VAL A 104 -3.191 -7.080 2.850 1.00 0.16 N ATOM 216 CA VAL A 104 -3.629 -6.463 1.568 1.00 0.16 C ATOM 217 C VAL A 104 -2.579 -6.691 0.472 1.00 0.17 C ATOM 218 O VAL A 104 -2.910 -6.967 -0.666 1.00 0.18 O ATOM 219 CB VAL A 104 -3.810 -4.971 1.873 1.00 0.16 C ATOM 220 CG1 VAL A 104 -4.816 -4.787 3.014 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.464 -4.337 2.259 1.00 0.14 C ATOM 0 H VAL A 104 -2.955 -6.421 3.592 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.554 -6.904 1.196 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.189 -4.477 0.978 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -4.938 -3.724 3.224 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -5.777 -5.212 2.724 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.450 -5.293 3.907 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.609 -3.278 2.473 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.068 -4.835 3.144 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -1.760 -4.448 1.434 1.00 0.14 H new ATOM 231 N CYS A 105 -1.321 -6.581 0.815 1.00 0.18 N ATOM 232 CA CYS A 105 -0.238 -6.789 -0.199 1.00 0.19 C ATOM 233 C CYS A 105 -0.286 -8.203 -0.740 1.00 0.20 C ATOM 234 O CYS A 105 -0.273 -8.419 -1.936 1.00 0.21 O ATOM 235 CB CYS A 105 1.066 -6.527 0.554 1.00 0.22 C ATOM 236 SG CYS A 105 2.495 -6.822 -0.517 1.00 0.29 S ATOM 0 H CYS A 105 -0.994 -6.356 1.755 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.342 -6.129 -1.060 1.00 0.19 H new ATOM 0 HB2 CYS A 105 1.083 -5.499 0.915 1.00 0.22 H new ATOM 0 HB3 CYS A 105 1.122 -7.174 1.430 1.00 0.22 H new ATOM 0 HG CYS A 105 3.589 -6.591 0.146 1.00 0.29 H new ATOM 242 N ASP A 106 -0.354 -9.162 0.129 1.00 0.21 N ATOM 243 CA ASP A 106 -0.418 -10.571 -0.343 1.00 0.24 C ATOM 244 C ASP A 106 -1.741 -10.793 -1.096 1.00 0.25 C ATOM 245 O ASP A 106 -1.904 -11.771 -1.802 1.00 0.28 O ATOM 246 CB ASP A 106 -0.357 -11.426 0.918 1.00 0.25 C ATOM 247 CG ASP A 106 0.948 -11.152 1.673 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.957 -10.947 1.018 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.914 -11.153 2.892 1.00 1.05 O ATOM 0 H ASP A 106 -0.368 -9.037 1.141 1.00 0.21 H new ATOM 0 HA ASP A 106 0.393 -10.824 -1.026 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.211 -11.206 1.559 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.420 -12.482 0.655 1.00 0.25 H new ATOM 254 N ASN A 107 -2.688 -9.884 -0.955 1.00 0.24 N ATOM 255 CA ASN A 107 -3.992 -10.034 -1.663 1.00 0.26 C ATOM 256 C ASN A 107 -3.929 -9.359 -3.035 1.00 0.26 C ATOM 257 O ASN A 107 -4.418 -9.886 -4.017 1.00 0.29 O ATOM 258 CB ASN A 107 -4.995 -9.286 -0.784 1.00 0.25 C ATOM 259 CG ASN A 107 -6.371 -9.941 -0.913 1.00 0.29 C ATOM 260 OD1 ASN A 107 -6.512 -11.131 -0.714 1.00 1.02 O ATOM 261 ND2 ASN A 107 -7.398 -9.210 -1.245 1.00 1.23 N ATOM 0 H ASN A 107 -2.605 -9.047 -0.378 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.255 -11.080 -1.818 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.668 -9.303 0.256 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.049 -8.239 -1.084 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -8.320 -9.637 -1.338 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -7.280 -8.211 -1.412 1.00 1.23 H new ATOM 268 N VAL A 108 -3.348 -8.188 -3.104 1.00 0.23 N ATOM 269 CA VAL A 108 -3.267 -7.462 -4.406 1.00 0.24 C ATOM 270 C VAL A 108 -2.160 -6.408 -4.349 1.00 0.25 C ATOM 271 O VAL A 108 -2.311 -5.303 -4.822 1.00 0.42 O ATOM 272 CB VAL A 108 -4.656 -6.832 -4.567 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.869 -5.674 -3.583 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.821 -6.327 -5.999 1.00 0.27 C ATOM 0 H VAL A 108 -2.926 -7.703 -2.312 1.00 0.23 H new ATOM 0 HA VAL A 108 -3.019 -8.106 -5.250 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.402 -7.596 -4.350 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.864 -5.253 -3.727 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.775 -6.043 -2.562 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.119 -4.903 -3.761 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.808 -5.879 -6.115 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.056 -5.580 -6.212 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.717 -7.161 -6.693 1.00 0.27 H new ATOM 284 N GLY A 109 -1.072 -6.754 -3.722 1.00 0.24 N ATOM 285 CA GLY A 109 0.080 -5.821 -3.532 1.00 0.22 C ATOM 286 C GLY A 109 0.340 -4.970 -4.792 1.00 0.23 C ATOM 287 O GLY A 109 0.730 -3.822 -4.702 1.00 0.21 O ATOM 0 H GLY A 109 -0.926 -7.679 -3.318 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.119 -5.165 -2.685 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.975 -6.393 -3.288 1.00 0.22 H new ATOM 291 N ARG A 110 0.134 -5.528 -5.957 1.00 0.27 N ATOM 292 CA ARG A 110 0.385 -4.760 -7.222 1.00 0.28 C ATOM 293 C ARG A 110 -0.514 -3.514 -7.289 1.00 0.27 C ATOM 294 O ARG A 110 -0.207 -2.541 -7.972 1.00 0.27 O ATOM 295 CB ARG A 110 0.050 -5.720 -8.368 1.00 0.36 C ATOM 296 CG ARG A 110 0.907 -6.997 -8.283 1.00 0.55 C ATOM 297 CD ARG A 110 2.388 -6.670 -8.514 1.00 0.72 C ATOM 298 NE ARG A 110 2.476 -6.282 -9.949 1.00 1.08 N ATOM 299 CZ ARG A 110 2.579 -7.204 -10.867 1.00 1.39 C ATOM 300 NH1 ARG A 110 3.737 -7.754 -11.113 1.00 2.06 N ATOM 301 NH2 ARG A 110 1.525 -7.577 -11.539 1.00 1.68 N ATOM 0 H ARG A 110 -0.198 -6.483 -6.091 1.00 0.27 H new ATOM 0 HA ARG A 110 1.416 -4.411 -7.276 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -1.007 -5.983 -8.330 1.00 0.36 H new ATOM 0 HB3 ARG A 110 0.221 -5.225 -9.324 1.00 0.36 H new ATOM 0 HG2 ARG A 110 0.780 -7.462 -7.306 1.00 0.55 H new ATOM 0 HG3 ARG A 110 0.568 -7.719 -9.026 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.719 -5.860 -7.865 1.00 0.72 H new ATOM 0 HD3 ARG A 110 3.021 -7.531 -8.298 1.00 0.72 H new ATOM 0 HE ARG A 110 2.456 -5.297 -10.214 1.00 1.08 H new ATOM 0 HH11 ARG A 110 4.562 -7.463 -10.588 1.00 2.06 H new ATOM 0 HH12 ARG A 110 3.817 -8.475 -11.830 1.00 2.06 H new ATOM 0 HH21 ARG A 110 0.620 -7.148 -11.347 1.00 1.68 H new ATOM 0 HH22 ARG A 110 1.606 -8.298 -12.256 1.00 1.68 H new ATOM 315 N ASP A 111 -1.612 -3.518 -6.573 1.00 0.27 N ATOM 316 CA ASP A 111 -2.510 -2.327 -6.598 1.00 0.30 C ATOM 317 C ASP A 111 -1.772 -1.136 -5.981 1.00 0.31 C ATOM 318 O ASP A 111 -2.092 0.005 -6.251 1.00 0.39 O ATOM 319 CB ASP A 111 -3.730 -2.709 -5.744 1.00 0.30 C ATOM 320 CG ASP A 111 -4.787 -3.401 -6.612 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.423 -3.961 -7.633 1.00 0.93 O ATOM 322 OD2 ASP A 111 -5.948 -3.364 -6.233 1.00 0.82 O ATOM 0 H ASP A 111 -1.921 -4.287 -5.979 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.811 -2.049 -7.608 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.423 -3.371 -4.934 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.154 -1.817 -5.283 1.00 0.30 H new ATOM 327 N TRP A 112 -0.765 -1.394 -5.178 1.00 0.27 N ATOM 328 CA TRP A 112 0.014 -0.275 -4.578 1.00 0.29 C ATOM 329 C TRP A 112 0.815 0.395 -5.676 1.00 0.32 C ATOM 330 O TRP A 112 1.055 1.575 -5.627 1.00 0.31 O ATOM 331 CB TRP A 112 0.928 -0.893 -3.523 1.00 0.29 C ATOM 332 CG TRP A 112 0.110 -1.720 -2.587 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.512 -2.890 -2.060 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.249 -1.489 -2.095 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.496 -3.387 -1.262 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.599 -2.567 -1.256 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.204 -0.465 -2.280 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -2.838 -2.637 -0.635 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.456 -0.538 -1.652 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.772 -1.627 -0.830 1.00 0.27 C ATOM 0 H TRP A 112 -0.454 -2.329 -4.916 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.624 0.479 -4.117 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.690 -1.509 -4.001 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.450 -0.110 -2.973 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.468 -3.363 -2.233 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.431 -4.260 -0.738 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -1.969 0.380 -2.910 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.076 -3.477 0.000 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.180 0.249 -1.803 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.738 -1.681 -0.350 1.00 0.27 H new ATOM 351 N LYS A 113 1.199 -0.342 -6.692 1.00 0.37 N ATOM 352 CA LYS A 113 1.945 0.289 -7.819 1.00 0.40 C ATOM 353 C LYS A 113 0.985 1.269 -8.501 1.00 0.34 C ATOM 354 O LYS A 113 1.345 2.376 -8.853 1.00 0.30 O ATOM 355 CB LYS A 113 2.335 -0.862 -8.752 1.00 0.50 C ATOM 356 CG LYS A 113 3.398 -1.722 -8.060 1.00 0.72 C ATOM 357 CD LYS A 113 3.641 -3.005 -8.864 1.00 0.89 C ATOM 358 CE LYS A 113 4.195 -2.659 -10.252 1.00 1.51 C ATOM 359 NZ LYS A 113 5.477 -1.937 -10.002 1.00 1.66 N ATOM 0 H LYS A 113 1.029 -1.343 -6.786 1.00 0.37 H new ATOM 0 HA LYS A 113 2.837 0.836 -7.514 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.460 -1.465 -8.993 1.00 0.50 H new ATOM 0 HB3 LYS A 113 2.721 -0.470 -9.693 1.00 0.50 H new ATOM 0 HG2 LYS A 113 4.327 -1.160 -7.967 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.074 -1.972 -7.050 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.343 -3.649 -8.334 1.00 0.89 H new ATOM 0 HD3 LYS A 113 2.710 -3.563 -8.964 1.00 0.89 H new ATOM 0 HE2 LYS A 113 4.361 -3.559 -10.844 1.00 1.51 H new ATOM 0 HE3 LYS A 113 3.496 -2.035 -10.809 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 6.114 -2.069 -10.814 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 5.285 -0.923 -9.874 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 5.927 -2.315 -9.144 1.00 1.66 H new ATOM 373 N ARG A 114 -0.259 0.868 -8.634 1.00 0.35 N ATOM 374 CA ARG A 114 -1.291 1.776 -9.242 1.00 0.33 C ATOM 375 C ARG A 114 -1.503 3.003 -8.337 1.00 0.28 C ATOM 376 O ARG A 114 -1.456 4.145 -8.775 1.00 0.29 O ATOM 377 CB ARG A 114 -2.576 0.932 -9.282 1.00 0.37 C ATOM 378 CG ARG A 114 -3.755 1.765 -9.810 1.00 0.38 C ATOM 379 CD ARG A 114 -5.063 1.247 -9.200 1.00 0.43 C ATOM 380 NE ARG A 114 -6.107 2.185 -9.698 1.00 0.57 N ATOM 381 CZ ARG A 114 -7.118 1.732 -10.385 1.00 1.04 C ATOM 382 NH1 ARG A 114 -6.914 0.934 -11.397 1.00 1.62 N ATOM 383 NH2 ARG A 114 -8.334 2.079 -10.062 1.00 1.77 N ATOM 0 H ARG A 114 -0.606 -0.048 -8.348 1.00 0.35 H new ATOM 0 HA ARG A 114 -0.999 2.139 -10.227 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.425 0.061 -9.919 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -2.805 0.561 -8.283 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -3.614 2.816 -9.556 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -3.799 1.703 -10.897 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -5.268 0.223 -9.513 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -5.019 1.245 -8.111 1.00 0.43 H new ATOM 0 HE ARG A 114 -6.031 3.183 -9.501 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -5.963 0.665 -11.651 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -7.705 0.580 -11.935 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -8.493 2.705 -9.272 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -9.125 1.725 -10.599 1.00 1.77 H new ATOM 397 N LEU A 115 -1.747 2.763 -7.074 1.00 0.26 N ATOM 398 CA LEU A 115 -1.980 3.889 -6.121 1.00 0.25 C ATOM 399 C LEU A 115 -0.671 4.645 -5.886 1.00 0.25 C ATOM 400 O LEU A 115 -0.670 5.824 -5.593 1.00 0.26 O ATOM 401 CB LEU A 115 -2.482 3.235 -4.828 1.00 0.26 C ATOM 402 CG LEU A 115 -3.820 2.532 -5.085 1.00 0.25 C ATOM 403 CD1 LEU A 115 -4.200 1.700 -3.858 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.911 3.576 -5.345 1.00 0.23 C ATOM 0 H LEU A 115 -1.795 1.832 -6.661 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.702 4.613 -6.499 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.747 2.516 -4.465 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -2.601 3.990 -4.051 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.725 1.883 -5.955 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -5.151 1.199 -4.038 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.427 0.955 -3.670 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -4.293 2.353 -2.990 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.860 3.072 -5.527 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -5.006 4.227 -4.476 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -4.643 4.172 -6.217 1.00 0.23 H new ATOM 416 N ALA A 116 0.447 3.973 -6.023 1.00 0.26 N ATOM 417 CA ALA A 116 1.767 4.649 -5.827 1.00 0.28 C ATOM 418 C ALA A 116 1.891 5.792 -6.830 1.00 0.26 C ATOM 419 O ALA A 116 2.269 6.904 -6.495 1.00 0.27 O ATOM 420 CB ALA A 116 2.825 3.577 -6.104 1.00 0.31 C ATOM 0 H ALA A 116 0.501 2.983 -6.263 1.00 0.26 H new ATOM 0 HA ALA A 116 1.881 5.065 -4.826 1.00 0.28 H new ATOM 0 HB1 ALA A 116 3.819 4.006 -5.978 1.00 0.31 H new ATOM 0 HB2 ALA A 116 2.696 2.749 -5.407 1.00 0.31 H new ATOM 0 HB3 ALA A 116 2.714 3.212 -7.125 1.00 0.31 H new ATOM 426 N ARG A 117 1.537 5.524 -8.066 1.00 0.27 N ATOM 427 CA ARG A 117 1.595 6.588 -9.107 1.00 0.30 C ATOM 428 C ARG A 117 0.652 7.717 -8.689 1.00 0.32 C ATOM 429 O ARG A 117 0.971 8.885 -8.808 1.00 0.33 O ATOM 430 CB ARG A 117 1.105 5.921 -10.401 1.00 0.35 C ATOM 431 CG ARG A 117 2.150 4.913 -10.886 1.00 0.37 C ATOM 432 CD ARG A 117 1.659 4.245 -12.176 1.00 1.31 C ATOM 433 NE ARG A 117 1.721 5.308 -13.222 1.00 1.53 N ATOM 434 CZ ARG A 117 1.475 5.006 -14.469 1.00 1.93 C ATOM 435 NH1 ARG A 117 0.405 4.325 -14.776 1.00 2.24 N ATOM 436 NH2 ARG A 117 2.299 5.380 -15.409 1.00 2.61 N ATOM 0 H ARG A 117 1.212 4.614 -8.393 1.00 0.27 H new ATOM 0 HA ARG A 117 2.592 7.008 -9.240 1.00 0.30 H new ATOM 0 HB2 ARG A 117 0.154 5.418 -10.225 1.00 0.35 H new ATOM 0 HB3 ARG A 117 0.930 6.676 -11.168 1.00 0.35 H new ATOM 0 HG2 ARG A 117 3.100 5.416 -11.064 1.00 0.37 H new ATOM 0 HG3 ARG A 117 2.327 4.159 -10.119 1.00 0.37 H new ATOM 0 HD2 ARG A 117 2.288 3.395 -12.442 1.00 1.31 H new ATOM 0 HD3 ARG A 117 0.643 3.867 -12.060 1.00 1.31 H new ATOM 0 HE ARG A 117 1.955 6.267 -12.964 1.00 1.53 H new ATOM 0 HH11 ARG A 117 -0.239 4.029 -14.042 1.00 2.24 H new ATOM 0 HH12 ARG A 117 0.213 4.089 -15.749 1.00 2.24 H new ATOM 0 HH21 ARG A 117 3.138 5.910 -15.171 1.00 2.61 H new ATOM 0 HH22 ARG A 117 2.104 5.143 -16.382 1.00 2.61 H new ATOM 450 N GLU A 118 -0.496 7.360 -8.164 1.00 0.34 N ATOM 451 CA GLU A 118 -1.463 8.397 -7.691 1.00 0.39 C ATOM 452 C GLU A 118 -0.833 9.165 -6.524 1.00 0.39 C ATOM 453 O GLU A 118 -0.984 10.366 -6.399 1.00 0.41 O ATOM 454 CB GLU A 118 -2.700 7.622 -7.234 1.00 0.43 C ATOM 455 CG GLU A 118 -3.396 7.015 -8.457 1.00 0.47 C ATOM 456 CD GLU A 118 -4.643 6.226 -8.031 1.00 0.53 C ATOM 457 OE1 GLU A 118 -5.038 6.336 -6.879 1.00 1.45 O ATOM 458 OE2 GLU A 118 -5.188 5.529 -8.870 1.00 0.76 O ATOM 0 H GLU A 118 -0.804 6.395 -8.043 1.00 0.34 H new ATOM 0 HA GLU A 118 -1.722 9.122 -8.462 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -2.413 6.835 -6.536 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -3.384 8.285 -6.704 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -3.679 7.806 -9.151 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -2.706 6.358 -8.986 1.00 0.47 H new ATOM 465 N LEU A 119 -0.107 8.471 -5.678 1.00 0.37 N ATOM 466 CA LEU A 119 0.564 9.140 -4.518 1.00 0.38 C ATOM 467 C LEU A 119 1.786 9.942 -4.992 1.00 0.36 C ATOM 468 O LEU A 119 2.418 10.630 -4.212 1.00 0.39 O ATOM 469 CB LEU A 119 1.010 7.998 -3.604 1.00 0.38 C ATOM 470 CG LEU A 119 -0.218 7.289 -3.031 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.199 5.941 -2.441 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.836 8.152 -1.930 1.00 0.58 C ATOM 0 H LEU A 119 0.050 7.465 -5.742 1.00 0.37 H new ATOM 0 HA LEU A 119 -0.102 9.840 -4.012 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.623 7.291 -4.162 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.628 8.387 -2.795 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.947 7.130 -3.825 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.676 5.436 -2.033 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.643 5.324 -3.222 1.00 1.33 H new ATOM 0 HD13 LEU A 119 0.928 6.101 -1.647 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.711 7.648 -1.521 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -0.104 8.310 -1.137 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -1.133 9.115 -2.346 1.00 0.58 H new ATOM 484 N LYS A 120 2.133 9.861 -6.263 1.00 0.34 N ATOM 485 CA LYS A 120 3.319 10.617 -6.782 1.00 0.35 C ATOM 486 C LYS A 120 4.580 10.195 -6.035 1.00 0.30 C ATOM 487 O LYS A 120 5.335 11.019 -5.551 1.00 0.33 O ATOM 488 CB LYS A 120 3.025 12.109 -6.561 1.00 0.48 C ATOM 489 CG LYS A 120 2.554 12.743 -7.871 1.00 1.05 C ATOM 490 CD LYS A 120 2.150 14.192 -7.605 1.00 1.11 C ATOM 491 CE LYS A 120 2.152 14.977 -8.919 1.00 2.02 C ATOM 492 NZ LYS A 120 1.152 16.062 -8.719 1.00 2.16 N ATOM 0 H LYS A 120 1.642 9.302 -6.961 1.00 0.34 H new ATOM 0 HA LYS A 120 3.487 10.412 -7.839 1.00 0.35 H new ATOM 0 HB2 LYS A 120 2.261 12.229 -5.793 1.00 0.48 H new ATOM 0 HB3 LYS A 120 3.920 12.616 -6.202 1.00 0.48 H new ATOM 0 HG2 LYS A 120 3.349 12.704 -8.615 1.00 1.05 H new ATOM 0 HG3 LYS A 120 1.710 12.185 -8.277 1.00 1.05 H new ATOM 0 HD2 LYS A 120 1.160 14.226 -7.151 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.841 14.648 -6.896 1.00 1.11 H new ATOM 0 HE2 LYS A 120 3.140 15.385 -9.134 1.00 2.02 H new ATOM 0 HE3 LYS A 120 1.880 14.340 -9.760 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 1.096 16.645 -9.578 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 0.220 15.644 -8.523 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 1.441 16.656 -7.916 1.00 2.16 H new ATOM 506 N VAL A 121 4.811 8.914 -5.942 1.00 0.29 N ATOM 507 CA VAL A 121 6.030 8.422 -5.231 1.00 0.33 C ATOM 508 C VAL A 121 7.267 8.697 -6.087 1.00 0.37 C ATOM 509 O VAL A 121 7.188 8.770 -7.298 1.00 0.42 O ATOM 510 CB VAL A 121 5.821 6.914 -5.041 1.00 0.36 C ATOM 511 CG1 VAL A 121 4.601 6.679 -4.149 1.00 1.65 C ATOM 512 CG2 VAL A 121 5.598 6.235 -6.399 1.00 1.29 C ATOM 0 H VAL A 121 4.210 8.185 -6.327 1.00 0.29 H new ATOM 0 HA VAL A 121 6.180 8.920 -4.273 1.00 0.33 H new ATOM 0 HB VAL A 121 6.709 6.488 -4.573 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.451 5.608 -4.013 1.00 1.65 H new ATOM 0 HG12 VAL A 121 4.764 7.149 -3.179 1.00 1.65 H new ATOM 0 HG13 VAL A 121 3.718 7.112 -4.619 1.00 1.65 H new ATOM 0 HG21 VAL A 121 5.451 5.165 -6.251 1.00 1.29 H new ATOM 0 HG22 VAL A 121 4.716 6.660 -6.878 1.00 1.29 H new ATOM 0 HG23 VAL A 121 6.469 6.397 -7.034 1.00 1.29 H new ATOM 522 N SER A 122 8.408 8.863 -5.465 1.00 0.45 N ATOM 523 CA SER A 122 9.658 9.150 -6.240 1.00 0.52 C ATOM 524 C SER A 122 9.892 8.088 -7.313 1.00 0.44 C ATOM 525 O SER A 122 9.884 6.902 -7.046 1.00 0.35 O ATOM 526 CB SER A 122 10.783 9.119 -5.206 1.00 0.63 C ATOM 527 OG SER A 122 12.028 9.330 -5.858 1.00 1.10 O ATOM 0 H SER A 122 8.529 8.812 -4.454 1.00 0.45 H new ATOM 0 HA SER A 122 9.600 10.107 -6.759 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.620 9.889 -4.451 1.00 0.63 H new ATOM 0 HB3 SER A 122 10.789 8.160 -4.687 1.00 0.63 H new ATOM 0 HG SER A 122 12.591 9.913 -5.307 1.00 1.10 H new ATOM 533 N GLU A 123 10.112 8.519 -8.529 1.00 0.55 N ATOM 534 CA GLU A 123 10.361 7.555 -9.643 1.00 0.58 C ATOM 535 C GLU A 123 11.576 6.682 -9.307 1.00 0.52 C ATOM 536 O GLU A 123 11.717 5.583 -9.809 1.00 0.53 O ATOM 537 CB GLU A 123 10.638 8.422 -10.877 1.00 0.77 C ATOM 538 CG GLU A 123 10.896 7.521 -12.092 1.00 1.44 C ATOM 539 CD GLU A 123 11.182 8.373 -13.338 1.00 1.61 C ATOM 540 OE1 GLU A 123 10.925 9.567 -13.302 1.00 2.15 O ATOM 541 OE2 GLU A 123 11.671 7.814 -14.306 1.00 1.75 O ATOM 0 H GLU A 123 10.130 9.502 -8.799 1.00 0.55 H new ATOM 0 HA GLU A 123 9.518 6.885 -9.810 1.00 0.58 H new ATOM 0 HB2 GLU A 123 9.789 9.077 -11.071 1.00 0.77 H new ATOM 0 HB3 GLU A 123 11.501 9.063 -10.697 1.00 0.77 H new ATOM 0 HG2 GLU A 123 11.741 6.863 -11.892 1.00 1.44 H new ATOM 0 HG3 GLU A 123 10.030 6.883 -12.270 1.00 1.44 H new ATOM 548 N ALA A 124 12.459 7.168 -8.461 1.00 0.50 N ATOM 549 CA ALA A 124 13.669 6.365 -8.091 1.00 0.50 C ATOM 550 C ALA A 124 13.253 5.001 -7.523 1.00 0.39 C ATOM 551 O ALA A 124 13.676 3.968 -8.007 1.00 0.45 O ATOM 552 CB ALA A 124 14.394 7.191 -7.024 1.00 0.56 C ATOM 0 H ALA A 124 12.393 8.082 -8.014 1.00 0.50 H new ATOM 0 HA ALA A 124 14.306 6.169 -8.954 1.00 0.50 H new ATOM 0 HB1 ALA A 124 15.293 6.664 -6.704 1.00 0.56 H new ATOM 0 HB2 ALA A 124 14.670 8.160 -7.440 1.00 0.56 H new ATOM 0 HB3 ALA A 124 13.736 7.338 -6.168 1.00 0.56 H new ATOM 558 N LYS A 125 12.420 4.992 -6.510 1.00 0.31 N ATOM 559 CA LYS A 125 11.964 3.692 -5.923 1.00 0.34 C ATOM 560 C LYS A 125 11.187 2.886 -6.965 1.00 0.34 C ATOM 561 O LYS A 125 11.413 1.704 -7.140 1.00 0.39 O ATOM 562 CB LYS A 125 11.067 4.066 -4.747 1.00 0.42 C ATOM 563 CG LYS A 125 11.937 4.423 -3.539 1.00 0.54 C ATOM 564 CD LYS A 125 12.225 5.932 -3.522 1.00 0.75 C ATOM 565 CE LYS A 125 13.707 6.184 -3.819 1.00 0.75 C ATOM 566 NZ LYS A 125 13.887 7.654 -3.659 1.00 1.56 N ATOM 0 H LYS A 125 12.037 5.826 -6.065 1.00 0.31 H new ATOM 0 HA LYS A 125 12.801 3.072 -5.603 1.00 0.34 H new ATOM 0 HB2 LYS A 125 10.432 4.910 -5.014 1.00 0.42 H new ATOM 0 HB3 LYS A 125 10.406 3.235 -4.501 1.00 0.42 H new ATOM 0 HG2 LYS A 125 11.432 4.131 -2.618 1.00 0.54 H new ATOM 0 HG3 LYS A 125 12.874 3.867 -3.579 1.00 0.54 H new ATOM 0 HD2 LYS A 125 11.606 6.438 -4.263 1.00 0.75 H new ATOM 0 HD3 LYS A 125 11.964 6.350 -2.550 1.00 0.75 H new ATOM 0 HE2 LYS A 125 14.347 5.631 -3.132 1.00 0.75 H new ATOM 0 HE3 LYS A 125 13.968 5.862 -4.827 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 14.851 7.919 -3.945 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 13.199 8.155 -4.257 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 13.736 7.916 -2.664 1.00 1.56 H new ATOM 580 N MET A 126 10.284 3.523 -7.671 1.00 0.42 N ATOM 581 CA MET A 126 9.506 2.801 -8.725 1.00 0.56 C ATOM 582 C MET A 126 10.467 2.241 -9.774 1.00 0.57 C ATOM 583 O MET A 126 10.303 1.136 -10.256 1.00 0.66 O ATOM 584 CB MET A 126 8.571 3.851 -9.338 1.00 0.70 C ATOM 585 CG MET A 126 7.477 4.221 -8.333 1.00 1.10 C ATOM 586 SD MET A 126 6.380 2.802 -8.091 1.00 1.90 S ATOM 587 CE MET A 126 5.669 2.782 -9.756 1.00 2.03 C ATOM 0 H MET A 126 10.053 4.511 -7.563 1.00 0.42 H new ATOM 0 HA MET A 126 8.940 1.960 -8.325 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.139 4.739 -9.615 1.00 0.70 H new ATOM 0 HB3 MET A 126 8.122 3.462 -10.252 1.00 0.70 H new ATOM 0 HG2 MET A 126 7.924 4.515 -7.384 1.00 1.10 H new ATOM 0 HG3 MET A 126 6.908 5.077 -8.696 1.00 1.10 H new ATOM 0 HE1 MET A 126 4.658 2.375 -9.715 1.00 2.03 H new ATOM 0 HE2 MET A 126 5.636 3.798 -10.150 1.00 2.03 H new ATOM 0 HE3 MET A 126 6.284 2.161 -10.407 1.00 2.03 H new ATOM 597 N ASP A 127 11.478 2.998 -10.119 1.00 0.55 N ATOM 598 CA ASP A 127 12.468 2.524 -11.136 1.00 0.62 C ATOM 599 C ASP A 127 13.130 1.222 -10.660 1.00 0.54 C ATOM 600 O ASP A 127 13.273 0.279 -11.421 1.00 0.59 O ATOM 601 CB ASP A 127 13.511 3.645 -11.231 1.00 0.71 C ATOM 602 CG ASP A 127 14.533 3.333 -12.332 1.00 1.04 C ATOM 603 OD1 ASP A 127 14.625 2.184 -12.737 1.00 1.60 O ATOM 604 OD2 ASP A 127 15.210 4.256 -12.754 1.00 1.71 O ATOM 0 H ASP A 127 11.662 3.927 -9.739 1.00 0.55 H new ATOM 0 HA ASP A 127 12.002 2.316 -12.099 1.00 0.62 H new ATOM 0 HB2 ASP A 127 13.017 4.593 -11.443 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.021 3.758 -10.274 1.00 0.71 H new ATOM 609 N GLY A 128 13.524 1.155 -9.409 1.00 0.46 N ATOM 610 CA GLY A 128 14.164 -0.096 -8.895 1.00 0.46 C ATOM 611 C GLY A 128 13.122 -1.186 -8.658 1.00 0.48 C ATOM 612 O GLY A 128 13.380 -2.349 -8.890 1.00 0.51 O ATOM 0 H GLY A 128 13.430 1.908 -8.727 1.00 0.46 H new ATOM 0 HA2 GLY A 128 14.908 -0.448 -9.610 1.00 0.46 H new ATOM 0 HA3 GLY A 128 14.691 0.117 -7.965 1.00 0.46 H new ATOM 616 N ILE A 129 11.949 -0.829 -8.201 1.00 0.54 N ATOM 617 CA ILE A 129 10.896 -1.865 -7.945 1.00 0.68 C ATOM 618 C ILE A 129 10.669 -2.719 -9.210 1.00 0.68 C ATOM 619 O ILE A 129 10.902 -3.914 -9.207 1.00 0.72 O ATOM 620 CB ILE A 129 9.639 -1.053 -7.541 1.00 0.86 C ATOM 621 CG1 ILE A 129 9.758 -0.654 -6.071 1.00 1.04 C ATOM 622 CG2 ILE A 129 8.348 -1.859 -7.747 1.00 1.77 C ATOM 623 CD1 ILE A 129 8.823 0.530 -5.790 1.00 2.01 C ATOM 0 H ILE A 129 11.673 0.131 -7.994 1.00 0.54 H new ATOM 0 HA ILE A 129 11.170 -2.573 -7.163 1.00 0.68 H new ATOM 0 HB ILE A 129 9.585 -0.170 -8.177 1.00 0.86 H new ATOM 0 HG12 ILE A 129 9.498 -1.497 -5.431 1.00 1.04 H new ATOM 0 HG13 ILE A 129 10.788 -0.382 -5.838 1.00 1.04 H new ATOM 0 HG21 ILE A 129 7.490 -1.254 -7.452 1.00 1.77 H new ATOM 0 HG22 ILE A 129 8.254 -2.134 -8.798 1.00 1.77 H new ATOM 0 HG23 ILE A 129 8.382 -2.762 -7.138 1.00 1.77 H new ATOM 0 HD11 ILE A 129 8.905 0.818 -4.742 1.00 2.01 H new ATOM 0 HD12 ILE A 129 9.104 1.373 -6.421 1.00 2.01 H new ATOM 0 HD13 ILE A 129 7.795 0.241 -6.007 1.00 2.01 H new ATOM 635 N GLU A 130 10.212 -2.117 -10.271 1.00 0.70 N ATOM 636 CA GLU A 130 9.965 -2.891 -11.529 1.00 0.77 C ATOM 637 C GLU A 130 11.269 -3.477 -12.105 1.00 0.65 C ATOM 638 O GLU A 130 11.298 -4.604 -12.559 1.00 0.68 O ATOM 639 CB GLU A 130 9.346 -1.884 -12.498 1.00 0.85 C ATOM 640 CG GLU A 130 8.957 -2.598 -13.795 1.00 1.41 C ATOM 641 CD GLU A 130 8.273 -1.620 -14.763 1.00 1.66 C ATOM 642 OE1 GLU A 130 7.965 -0.510 -14.352 1.00 2.01 O ATOM 643 OE2 GLU A 130 8.067 -2.000 -15.903 1.00 2.14 O ATOM 0 H GLU A 130 9.997 -1.121 -10.326 1.00 0.70 H new ATOM 0 HA GLU A 130 9.314 -3.746 -11.349 1.00 0.77 H new ATOM 0 HB2 GLU A 130 8.468 -1.422 -12.047 1.00 0.85 H new ATOM 0 HB3 GLU A 130 10.055 -1.083 -12.709 1.00 0.85 H new ATOM 0 HG2 GLU A 130 9.845 -3.022 -14.264 1.00 1.41 H new ATOM 0 HG3 GLU A 130 8.286 -3.428 -13.573 1.00 1.41 H new ATOM 650 N GLU A 131 12.332 -2.708 -12.123 1.00 0.59 N ATOM 651 CA GLU A 131 13.627 -3.204 -12.708 1.00 0.55 C ATOM 652 C GLU A 131 14.264 -4.334 -11.885 1.00 0.47 C ATOM 653 O GLU A 131 14.545 -5.401 -12.399 1.00 0.45 O ATOM 654 CB GLU A 131 14.549 -1.980 -12.712 1.00 0.63 C ATOM 655 CG GLU A 131 15.826 -2.286 -13.510 1.00 1.38 C ATOM 656 CD GLU A 131 17.030 -2.349 -12.566 1.00 1.89 C ATOM 657 OE1 GLU A 131 17.173 -1.445 -11.758 1.00 2.30 O ATOM 658 OE2 GLU A 131 17.791 -3.296 -12.671 1.00 2.50 O ATOM 0 H GLU A 131 12.362 -1.756 -11.758 1.00 0.59 H new ATOM 0 HA GLU A 131 13.459 -3.626 -13.699 1.00 0.55 H new ATOM 0 HB2 GLU A 131 14.032 -1.127 -13.151 1.00 0.63 H new ATOM 0 HB3 GLU A 131 14.807 -1.705 -11.689 1.00 0.63 H new ATOM 0 HG2 GLU A 131 15.717 -3.234 -14.038 1.00 1.38 H new ATOM 0 HG3 GLU A 131 15.986 -1.517 -14.266 1.00 1.38 H new ATOM 665 N LYS A 132 14.525 -4.095 -10.628 1.00 0.51 N ATOM 666 CA LYS A 132 15.186 -5.139 -9.777 1.00 0.53 C ATOM 667 C LYS A 132 14.261 -6.337 -9.530 1.00 0.54 C ATOM 668 O LYS A 132 14.701 -7.473 -9.513 1.00 0.63 O ATOM 669 CB LYS A 132 15.510 -4.433 -8.457 1.00 0.68 C ATOM 670 CG LYS A 132 16.602 -3.385 -8.695 1.00 1.39 C ATOM 671 CD LYS A 132 16.734 -2.489 -7.461 1.00 1.91 C ATOM 672 CE LYS A 132 17.391 -3.270 -6.321 1.00 2.62 C ATOM 673 NZ LYS A 132 18.835 -2.906 -6.386 1.00 2.69 N ATOM 0 H LYS A 132 14.310 -3.221 -10.148 1.00 0.51 H new ATOM 0 HA LYS A 132 16.075 -5.540 -10.264 1.00 0.53 H new ATOM 0 HB2 LYS A 132 14.615 -3.957 -8.057 1.00 0.68 H new ATOM 0 HB3 LYS A 132 15.843 -5.159 -7.716 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.552 -3.877 -8.903 1.00 1.39 H new ATOM 0 HG3 LYS A 132 16.357 -2.782 -9.570 1.00 1.39 H new ATOM 0 HD2 LYS A 132 17.330 -1.609 -7.702 1.00 1.91 H new ATOM 0 HD3 LYS A 132 15.751 -2.134 -7.151 1.00 1.91 H new ATOM 0 HE2 LYS A 132 16.959 -3.000 -5.357 1.00 2.62 H new ATOM 0 HE3 LYS A 132 17.249 -4.344 -6.445 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 19.353 -3.403 -5.634 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 19.221 -3.181 -7.312 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 18.940 -1.879 -6.258 1.00 2.69 H new ATOM 687 N TYR A 133 12.997 -6.095 -9.310 1.00 0.55 N ATOM 688 CA TYR A 133 12.048 -7.220 -9.030 1.00 0.65 C ATOM 689 C TYR A 133 11.176 -7.515 -10.261 1.00 0.54 C ATOM 690 O TYR A 133 10.376 -6.689 -10.651 1.00 0.66 O ATOM 691 CB TYR A 133 11.180 -6.725 -7.865 1.00 0.89 C ATOM 692 CG TYR A 133 12.061 -6.236 -6.735 1.00 1.14 C ATOM 693 CD1 TYR A 133 13.087 -7.048 -6.236 1.00 0.98 C ATOM 694 CD2 TYR A 133 11.861 -4.959 -6.208 1.00 2.20 C ATOM 695 CE1 TYR A 133 13.907 -6.581 -5.202 1.00 1.14 C ATOM 696 CE2 TYR A 133 12.682 -4.488 -5.177 1.00 2.44 C ATOM 697 CZ TYR A 133 13.707 -5.299 -4.674 1.00 1.67 C ATOM 698 OH TYR A 133 14.519 -4.837 -3.658 1.00 1.95 O ATOM 0 H TYR A 133 12.576 -5.166 -9.311 1.00 0.55 H new ATOM 0 HA TYR A 133 12.572 -8.145 -8.790 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.528 -5.920 -8.203 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.536 -7.531 -7.513 1.00 0.89 H new ATOM 0 HD1 TYR A 133 13.245 -8.033 -6.648 1.00 0.98 H new ATOM 0 HD2 TYR A 133 11.071 -4.333 -6.597 1.00 2.20 H new ATOM 0 HE1 TYR A 133 14.694 -7.209 -4.811 1.00 1.14 H new ATOM 0 HE2 TYR A 133 12.525 -3.500 -4.770 1.00 2.44 H new ATOM 0 HH TYR A 133 14.246 -3.929 -3.408 1.00 1.95 H new ATOM 708 N PRO A 134 11.352 -8.684 -10.845 1.00 0.51 N ATOM 709 CA PRO A 134 10.560 -9.053 -12.032 1.00 0.53 C ATOM 710 C PRO A 134 9.244 -9.732 -11.633 1.00 0.47 C ATOM 711 O PRO A 134 8.309 -9.770 -12.413 1.00 0.54 O ATOM 712 CB PRO A 134 11.465 -10.039 -12.762 1.00 0.70 C ATOM 713 CG PRO A 134 12.362 -10.629 -11.711 1.00 0.76 C ATOM 714 CD PRO A 134 12.291 -9.755 -10.481 1.00 0.66 C ATOM 0 HA PRO A 134 10.279 -8.190 -12.635 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.880 -10.814 -13.256 1.00 0.70 H new ATOM 0 HB3 PRO A 134 12.047 -9.537 -13.535 1.00 0.70 H new ATOM 0 HG2 PRO A 134 12.050 -11.646 -11.473 1.00 0.76 H new ATOM 0 HG3 PRO A 134 13.387 -10.688 -12.076 1.00 0.76 H new ATOM 0 HD2 PRO A 134 11.938 -10.316 -9.615 1.00 0.66 H new ATOM 0 HD3 PRO A 134 13.271 -9.353 -10.222 1.00 0.66 H new ATOM 722 N ARG A 135 9.159 -10.285 -10.441 1.00 0.43 N ATOM 723 CA ARG A 135 7.886 -10.971 -10.041 1.00 0.48 C ATOM 724 C ARG A 135 7.705 -11.011 -8.514 1.00 0.43 C ATOM 725 O ARG A 135 6.947 -11.815 -8.003 1.00 0.60 O ATOM 726 CB ARG A 135 8.025 -12.385 -10.609 1.00 0.70 C ATOM 727 CG ARG A 135 6.657 -13.076 -10.645 1.00 0.91 C ATOM 728 CD ARG A 135 5.737 -12.344 -11.626 1.00 1.17 C ATOM 729 NE ARG A 135 4.545 -13.226 -11.765 1.00 1.44 N ATOM 730 CZ ARG A 135 4.043 -13.465 -12.946 1.00 2.17 C ATOM 731 NH1 ARG A 135 3.788 -12.477 -13.760 1.00 3.07 N ATOM 732 NH2 ARG A 135 3.795 -14.692 -13.313 1.00 2.61 N ATOM 0 H ARG A 135 9.901 -10.291 -9.741 1.00 0.43 H new ATOM 0 HA ARG A 135 7.009 -10.445 -10.420 1.00 0.48 H new ATOM 0 HB2 ARG A 135 8.446 -12.342 -11.614 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.717 -12.964 -9.998 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.772 -14.117 -10.947 1.00 0.91 H new ATOM 0 HG3 ARG A 135 6.214 -13.080 -9.649 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.459 -11.360 -11.248 1.00 1.17 H new ATOM 0 HD3 ARG A 135 6.228 -12.189 -12.587 1.00 1.17 H new ATOM 0 HE ARG A 135 4.121 -13.644 -10.937 1.00 1.44 H new ATOM 0 HH11 ARG A 135 3.981 -11.517 -13.473 1.00 3.07 H new ATOM 0 HH12 ARG A 135 3.396 -12.665 -14.683 1.00 3.07 H new ATOM 0 HH21 ARG A 135 3.993 -15.464 -12.677 1.00 2.61 H new ATOM 0 HH22 ARG A 135 3.403 -14.879 -14.236 1.00 2.61 H new ATOM 746 N SER A 136 8.376 -10.159 -7.779 1.00 0.51 N ATOM 747 CA SER A 136 8.211 -10.171 -6.292 1.00 0.44 C ATOM 748 C SER A 136 7.172 -9.146 -5.864 1.00 0.33 C ATOM 749 O SER A 136 7.405 -7.954 -5.890 1.00 0.30 O ATOM 750 CB SER A 136 9.588 -9.821 -5.731 1.00 0.50 C ATOM 751 OG SER A 136 10.440 -10.954 -5.840 1.00 0.90 O ATOM 0 H SER A 136 9.026 -9.461 -8.140 1.00 0.51 H new ATOM 0 HA SER A 136 7.863 -11.137 -5.926 1.00 0.44 H new ATOM 0 HB2 SER A 136 10.012 -8.978 -6.277 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.502 -9.515 -4.688 1.00 0.50 H new ATOM 0 HG SER A 136 11.361 -10.691 -5.634 1.00 0.90 H new ATOM 757 N LEU A 137 6.021 -9.615 -5.450 1.00 0.31 N ATOM 758 CA LEU A 137 4.950 -8.685 -4.994 1.00 0.24 C ATOM 759 C LEU A 137 5.459 -7.898 -3.789 1.00 0.20 C ATOM 760 O LEU A 137 5.285 -6.700 -3.689 1.00 0.21 O ATOM 761 CB LEU A 137 3.773 -9.594 -4.589 1.00 0.23 C ATOM 762 CG LEU A 137 2.597 -8.748 -4.094 1.00 0.21 C ATOM 763 CD1 LEU A 137 2.088 -7.861 -5.233 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.468 -9.676 -3.636 1.00 0.27 C ATOM 0 H LEU A 137 5.779 -10.605 -5.409 1.00 0.31 H new ATOM 0 HA LEU A 137 4.654 -7.968 -5.760 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.462 -10.199 -5.440 1.00 0.23 H new ATOM 0 HB3 LEU A 137 4.089 -10.284 -3.806 1.00 0.23 H new ATOM 0 HG LEU A 137 2.923 -8.122 -3.263 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.251 -7.259 -4.879 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.890 -7.204 -5.569 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.760 -8.487 -6.063 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.627 -9.079 -3.282 1.00 0.27 H new ATOM 0 HD22 LEU A 137 1.146 -10.297 -4.472 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.826 -10.313 -2.827 1.00 0.27 H new ATOM 776 N SER A 138 6.083 -8.590 -2.878 1.00 0.24 N ATOM 777 CA SER A 138 6.621 -7.929 -1.648 1.00 0.26 C ATOM 778 C SER A 138 7.731 -6.915 -1.968 1.00 0.20 C ATOM 779 O SER A 138 7.750 -5.824 -1.439 1.00 0.22 O ATOM 780 CB SER A 138 7.181 -9.071 -0.801 1.00 0.38 C ATOM 781 OG SER A 138 7.715 -8.541 0.404 1.00 1.01 O ATOM 0 H SER A 138 6.247 -9.595 -2.930 1.00 0.24 H new ATOM 0 HA SER A 138 5.841 -7.363 -1.139 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.396 -9.793 -0.578 1.00 0.38 H new ATOM 0 HB3 SER A 138 7.956 -9.603 -1.353 1.00 0.38 H new ATOM 0 HG SER A 138 8.074 -9.270 0.951 1.00 1.01 H new ATOM 787 N GLU A 139 8.676 -7.285 -2.794 1.00 0.24 N ATOM 788 CA GLU A 139 9.822 -6.360 -3.103 1.00 0.25 C ATOM 789 C GLU A 139 9.373 -5.082 -3.817 1.00 0.21 C ATOM 790 O GLU A 139 9.884 -4.008 -3.556 1.00 0.21 O ATOM 791 CB GLU A 139 10.734 -7.152 -4.038 1.00 0.39 C ATOM 792 CG GLU A 139 11.243 -8.414 -3.338 1.00 1.09 C ATOM 793 CD GLU A 139 12.405 -8.062 -2.404 1.00 2.02 C ATOM 794 OE1 GLU A 139 12.430 -6.946 -1.909 1.00 2.24 O ATOM 795 OE2 GLU A 139 13.250 -8.917 -2.198 1.00 2.92 O ATOM 0 H GLU A 139 8.709 -8.186 -3.271 1.00 0.24 H new ATOM 0 HA GLU A 139 10.306 -6.044 -2.179 1.00 0.25 H new ATOM 0 HB2 GLU A 139 10.191 -7.424 -4.943 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.577 -6.533 -4.346 1.00 0.39 H new ATOM 0 HG2 GLU A 139 10.435 -8.875 -2.770 1.00 1.09 H new ATOM 0 HG3 GLU A 139 11.569 -9.144 -4.079 1.00 1.09 H new ATOM 802 N ARG A 140 8.457 -5.192 -4.739 1.00 0.26 N ATOM 803 CA ARG A 140 8.015 -3.989 -5.502 1.00 0.33 C ATOM 804 C ARG A 140 7.195 -3.034 -4.632 1.00 0.29 C ATOM 805 O ARG A 140 7.478 -1.855 -4.557 1.00 0.35 O ATOM 806 CB ARG A 140 7.141 -4.535 -6.638 1.00 0.42 C ATOM 807 CG ARG A 140 7.986 -5.391 -7.585 1.00 1.07 C ATOM 808 CD ARG A 140 7.147 -5.753 -8.815 1.00 1.17 C ATOM 809 NE ARG A 140 8.008 -6.657 -9.630 1.00 0.98 N ATOM 810 CZ ARG A 140 7.560 -7.142 -10.755 1.00 1.13 C ATOM 811 NH1 ARG A 140 6.770 -8.179 -10.748 1.00 1.55 N ATOM 812 NH2 ARG A 140 7.904 -6.593 -11.888 1.00 1.60 N ATOM 0 H ARG A 140 7.995 -6.063 -4.998 1.00 0.26 H new ATOM 0 HA ARG A 140 8.872 -3.419 -5.861 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.326 -5.130 -6.227 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.688 -3.710 -7.187 1.00 0.42 H new ATOM 0 HG2 ARG A 140 8.881 -4.847 -7.887 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.320 -6.296 -7.077 1.00 1.07 H new ATOM 0 HD2 ARG A 140 6.220 -6.248 -8.526 1.00 1.17 H new ATOM 0 HD3 ARG A 140 6.870 -4.862 -9.378 1.00 1.17 H new ATOM 0 HE ARG A 140 8.946 -6.896 -9.308 1.00 0.98 H new ATOM 0 HH11 ARG A 140 6.503 -8.610 -9.863 1.00 1.55 H new ATOM 0 HH12 ARG A 140 6.419 -8.559 -11.627 1.00 1.55 H new ATOM 0 HH21 ARG A 140 8.524 -5.783 -11.895 1.00 1.60 H new ATOM 0 HH22 ARG A 140 7.553 -6.974 -12.767 1.00 1.60 H new ATOM 826 N VAL A 141 6.158 -3.524 -4.019 1.00 0.24 N ATOM 827 CA VAL A 141 5.283 -2.634 -3.194 1.00 0.27 C ATOM 828 C VAL A 141 5.975 -2.079 -1.940 1.00 0.25 C ATOM 829 O VAL A 141 5.788 -0.929 -1.600 1.00 0.29 O ATOM 830 CB VAL A 141 4.075 -3.487 -2.818 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.361 -3.948 -4.088 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.521 -4.706 -2.016 1.00 0.23 C ATOM 0 H VAL A 141 5.873 -4.503 -4.050 1.00 0.24 H new ATOM 0 HA VAL A 141 5.010 -1.747 -3.766 1.00 0.27 H new ATOM 0 HB VAL A 141 3.395 -2.890 -2.210 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.498 -4.557 -3.819 1.00 0.33 H new ATOM 0 HG12 VAL A 141 3.029 -3.078 -4.655 1.00 0.33 H new ATOM 0 HG13 VAL A 141 4.046 -4.538 -4.697 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.650 -5.307 -1.753 1.00 0.23 H new ATOM 0 HG22 VAL A 141 5.208 -5.304 -2.615 1.00 0.23 H new ATOM 0 HG23 VAL A 141 5.024 -4.379 -1.106 1.00 0.23 H new ATOM 842 N ARG A 142 6.752 -2.867 -1.236 1.00 0.21 N ATOM 843 CA ARG A 142 7.396 -2.349 0.018 1.00 0.22 C ATOM 844 C ARG A 142 8.150 -1.036 -0.227 1.00 0.24 C ATOM 845 O ARG A 142 8.015 -0.097 0.537 1.00 0.25 O ATOM 846 CB ARG A 142 8.356 -3.448 0.481 1.00 0.27 C ATOM 847 CG ARG A 142 7.554 -4.647 1.000 1.00 0.28 C ATOM 848 CD ARG A 142 6.975 -4.320 2.379 1.00 1.02 C ATOM 849 NE ARG A 142 6.094 -5.475 2.706 1.00 0.94 N ATOM 850 CZ ARG A 142 4.999 -5.288 3.392 1.00 1.48 C ATOM 851 NH1 ARG A 142 3.913 -4.889 2.789 1.00 2.10 N ATOM 852 NH2 ARG A 142 4.992 -5.497 4.680 1.00 2.24 N ATOM 0 H ARG A 142 6.968 -3.836 -1.470 1.00 0.21 H new ATOM 0 HA ARG A 142 6.643 -2.123 0.773 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.997 -3.757 -0.345 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.009 -3.067 1.266 1.00 0.27 H new ATOM 0 HG2 ARG A 142 6.750 -4.888 0.305 1.00 0.28 H new ATOM 0 HG3 ARG A 142 8.195 -5.526 1.063 1.00 0.28 H new ATOM 0 HD2 ARG A 142 7.764 -4.202 3.121 1.00 1.02 H new ATOM 0 HD3 ARG A 142 6.413 -3.386 2.361 1.00 1.02 H new ATOM 0 HE ARG A 142 6.346 -6.413 2.394 1.00 0.94 H new ATOM 0 HH11 ARG A 142 3.920 -4.723 1.783 1.00 2.10 H new ATOM 0 HH12 ARG A 142 3.057 -4.743 3.324 1.00 2.10 H new ATOM 0 HH21 ARG A 142 5.842 -5.807 5.151 1.00 2.24 H new ATOM 0 HH22 ARG A 142 4.136 -5.351 5.216 1.00 2.24 H new ATOM 866 N GLU A 143 8.919 -0.948 -1.280 1.00 0.26 N ATOM 867 CA GLU A 143 9.653 0.328 -1.559 1.00 0.31 C ATOM 868 C GLU A 143 8.643 1.454 -1.799 1.00 0.30 C ATOM 869 O GLU A 143 8.721 2.520 -1.206 1.00 0.31 O ATOM 870 CB GLU A 143 10.474 0.057 -2.814 1.00 0.36 C ATOM 871 CG GLU A 143 11.349 1.276 -3.114 1.00 0.44 C ATOM 872 CD GLU A 143 12.642 1.206 -2.294 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.639 0.557 -1.259 1.00 1.84 O ATOM 874 OE2 GLU A 143 13.618 1.802 -2.719 1.00 1.62 O ATOM 0 H GLU A 143 9.072 -1.696 -1.956 1.00 0.26 H new ATOM 0 HA GLU A 143 10.291 0.635 -0.730 1.00 0.31 H new ATOM 0 HB2 GLU A 143 11.096 -0.827 -2.672 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.815 -0.149 -3.657 1.00 0.36 H new ATOM 0 HG2 GLU A 143 11.584 1.312 -4.178 1.00 0.44 H new ATOM 0 HG3 GLU A 143 10.807 2.191 -2.876 1.00 0.44 H new ATOM 881 N SER A 144 7.684 1.216 -2.664 1.00 0.29 N ATOM 882 CA SER A 144 6.648 2.259 -2.944 1.00 0.29 C ATOM 883 C SER A 144 5.881 2.573 -1.655 1.00 0.28 C ATOM 884 O SER A 144 5.570 3.713 -1.372 1.00 0.28 O ATOM 885 CB SER A 144 5.713 1.639 -3.981 1.00 0.29 C ATOM 886 OG SER A 144 4.927 0.629 -3.365 1.00 1.34 O ATOM 0 H SER A 144 7.575 0.347 -3.186 1.00 0.29 H new ATOM 0 HA SER A 144 7.084 3.190 -3.306 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.068 2.406 -4.410 1.00 0.29 H new ATOM 0 HB3 SER A 144 6.292 1.215 -4.801 1.00 0.29 H new ATOM 0 HG SER A 144 5.512 0.008 -2.883 1.00 1.34 H new ATOM 892 N LEU A 145 5.590 1.564 -0.870 1.00 0.27 N ATOM 893 CA LEU A 145 4.867 1.791 0.412 1.00 0.28 C ATOM 894 C LEU A 145 5.756 2.554 1.388 1.00 0.30 C ATOM 895 O LEU A 145 5.275 3.320 2.199 1.00 0.30 O ATOM 896 CB LEU A 145 4.555 0.399 0.974 1.00 0.29 C ATOM 897 CG LEU A 145 3.168 -0.067 0.521 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.212 -0.545 -0.923 1.00 0.73 C ATOM 899 CD2 LEU A 145 2.695 -1.215 1.424 1.00 0.67 C ATOM 0 H LEU A 145 5.825 0.591 -1.066 1.00 0.27 H new ATOM 0 HA LEU A 145 3.961 2.377 0.259 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.311 -0.312 0.639 1.00 0.29 H new ATOM 0 HB3 LEU A 145 4.599 0.422 2.063 1.00 0.29 H new ATOM 0 HG LEU A 145 2.475 0.771 0.593 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.218 -0.872 -1.228 1.00 0.73 H new ATOM 0 HD12 LEU A 145 3.539 0.272 -1.567 1.00 0.73 H new ATOM 0 HD13 LEU A 145 3.911 -1.377 -1.010 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.708 -1.548 1.103 1.00 0.67 H new ATOM 0 HD22 LEU A 145 3.398 -2.045 1.355 1.00 0.67 H new ATOM 0 HD23 LEU A 145 2.643 -0.868 2.456 1.00 0.67 H new ATOM 911 N LYS A 146 7.049 2.338 1.330 1.00 0.33 N ATOM 912 CA LYS A 146 7.967 3.047 2.276 1.00 0.35 C ATOM 913 C LYS A 146 7.844 4.562 2.097 1.00 0.34 C ATOM 914 O LYS A 146 7.653 5.292 3.052 1.00 0.35 O ATOM 915 CB LYS A 146 9.380 2.582 1.897 1.00 0.41 C ATOM 916 CG LYS A 146 10.408 3.241 2.825 1.00 1.01 C ATOM 917 CD LYS A 146 11.819 2.799 2.429 1.00 1.15 C ATOM 918 CE LYS A 146 12.843 3.523 3.308 1.00 1.96 C ATOM 919 NZ LYS A 146 14.062 2.667 3.276 1.00 2.32 N ATOM 0 H LYS A 146 7.505 1.705 0.673 1.00 0.33 H new ATOM 0 HA LYS A 146 7.730 2.824 3.316 1.00 0.35 H new ATOM 0 HB2 LYS A 146 9.449 1.497 1.974 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.593 2.842 0.860 1.00 0.41 H new ATOM 0 HG2 LYS A 146 10.326 4.326 2.763 1.00 1.01 H new ATOM 0 HG3 LYS A 146 10.207 2.965 3.860 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.921 1.720 2.546 1.00 1.15 H new ATOM 0 HD3 LYS A 146 12.001 3.024 1.378 1.00 1.15 H new ATOM 0 HE2 LYS A 146 13.053 4.522 2.926 1.00 1.96 H new ATOM 0 HE3 LYS A 146 12.473 3.643 4.326 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 14.807 3.102 3.858 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 13.834 1.725 3.652 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 14.397 2.576 2.296 1.00 2.32 H new ATOM 933 N VAL A 147 7.958 5.041 0.884 1.00 0.32 N ATOM 934 CA VAL A 147 7.846 6.515 0.658 1.00 0.33 C ATOM 935 C VAL A 147 6.415 6.994 0.908 1.00 0.31 C ATOM 936 O VAL A 147 6.203 8.025 1.517 1.00 0.31 O ATOM 937 CB VAL A 147 8.288 6.763 -0.785 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.738 6.300 -0.944 1.00 0.40 C ATOM 939 CG2 VAL A 147 7.392 6.000 -1.774 1.00 0.36 C ATOM 0 H VAL A 147 8.122 4.482 0.047 1.00 0.32 H new ATOM 0 HA VAL A 147 8.475 7.076 1.350 1.00 0.33 H new ATOM 0 HB VAL A 147 8.204 7.828 -1.002 1.00 0.36 H new ATOM 0 HG11 VAL A 147 10.064 6.472 -1.970 1.00 0.40 H new ATOM 0 HG12 VAL A 147 10.376 6.861 -0.261 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.808 5.237 -0.715 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.728 6.193 -2.793 1.00 0.36 H new ATOM 0 HG22 VAL A 147 7.452 4.931 -1.569 1.00 0.36 H new ATOM 0 HG23 VAL A 147 6.360 6.334 -1.662 1.00 0.36 H new ATOM 949 N TRP A 148 5.432 6.253 0.458 1.00 0.32 N ATOM 950 CA TRP A 148 4.014 6.672 0.692 1.00 0.33 C ATOM 951 C TRP A 148 3.741 6.739 2.206 1.00 0.32 C ATOM 952 O TRP A 148 3.253 7.737 2.703 1.00 0.32 O ATOM 953 CB TRP A 148 3.143 5.604 -0.019 1.00 0.36 C ATOM 954 CG TRP A 148 1.736 5.593 0.530 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.972 6.687 0.765 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.932 4.444 0.923 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.240 6.279 1.307 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.312 4.901 1.420 1.00 0.18 C ATOM 959 CE3 TRP A 148 1.167 3.061 0.901 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.286 4.006 1.887 1.00 0.17 C ATOM 961 CZ3 TRP A 148 0.193 2.164 1.360 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.027 2.636 1.854 1.00 0.27 C ATOM 0 H TRP A 148 5.548 5.381 -0.058 1.00 0.32 H new ATOM 0 HA TRP A 148 3.791 7.663 0.297 1.00 0.33 H new ATOM 0 HB2 TRP A 148 3.117 5.806 -1.090 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.594 4.620 0.108 1.00 0.36 H new ATOM 0 HD1 TRP A 148 1.258 7.709 0.564 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -0.985 6.916 1.587 1.00 0.23 H new ATOM 0 HE3 TRP A 148 2.107 2.684 0.527 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.227 4.374 2.268 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.386 1.102 1.332 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -1.770 1.938 2.211 1.00 0.27 H new ATOM 973 N LYS A 149 4.043 5.689 2.938 1.00 0.36 N ATOM 974 CA LYS A 149 3.785 5.719 4.408 1.00 0.38 C ATOM 975 C LYS A 149 4.633 6.816 5.079 1.00 0.34 C ATOM 976 O LYS A 149 4.152 7.540 5.929 1.00 0.33 O ATOM 977 CB LYS A 149 4.115 4.304 4.932 1.00 0.52 C ATOM 978 CG LYS A 149 5.630 4.083 5.062 1.00 1.36 C ATOM 979 CD LYS A 149 5.884 2.703 5.676 1.00 2.07 C ATOM 980 CE LYS A 149 7.149 2.744 6.544 1.00 2.80 C ATOM 981 NZ LYS A 149 8.237 2.152 5.708 1.00 3.70 N ATOM 0 H LYS A 149 4.452 4.825 2.582 1.00 0.36 H new ATOM 0 HA LYS A 149 2.749 5.967 4.640 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.641 4.156 5.903 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.696 3.559 4.256 1.00 0.52 H new ATOM 0 HG2 LYS A 149 6.106 4.153 4.084 1.00 1.36 H new ATOM 0 HG3 LYS A 149 6.071 4.860 5.687 1.00 1.36 H new ATOM 0 HD2 LYS A 149 5.028 2.400 6.279 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.997 1.959 4.887 1.00 2.07 H new ATOM 0 HE2 LYS A 149 7.391 3.766 6.834 1.00 2.80 H new ATOM 0 HE3 LYS A 149 7.010 2.176 7.464 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 8.952 1.718 6.326 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 7.836 1.427 5.080 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 8.681 2.899 5.136 1.00 3.70 H new ATOM 995 N ASN A 150 5.881 6.955 4.686 1.00 0.37 N ATOM 996 CA ASN A 150 6.750 8.017 5.294 1.00 0.41 C ATOM 997 C ASN A 150 6.155 9.397 5.014 1.00 0.39 C ATOM 998 O ASN A 150 6.120 10.253 5.880 1.00 0.46 O ATOM 999 CB ASN A 150 8.118 7.858 4.614 1.00 0.50 C ATOM 1000 CG ASN A 150 9.075 8.976 5.052 1.00 1.07 C ATOM 1001 OD1 ASN A 150 9.663 9.645 4.224 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.258 9.206 6.321 1.00 1.27 N ATOM 0 H ASN A 150 6.333 6.381 3.974 1.00 0.37 H new ATOM 0 HA ASN A 150 6.831 7.921 6.377 1.00 0.41 H new ATOM 0 HB2 ASN A 150 8.545 6.887 4.867 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.996 7.880 3.531 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.894 9.946 6.619 1.00 1.27 H new ATOM 0 HD22 ASN A 150 8.766 8.646 7.017 1.00 1.27 H new ATOM 1009 N ALA A 151 5.680 9.614 3.816 1.00 0.38 N ATOM 1010 CA ALA A 151 5.075 10.935 3.485 1.00 0.49 C ATOM 1011 C ALA A 151 3.791 11.111 4.295 1.00 0.53 C ATOM 1012 O ALA A 151 3.570 12.138 4.908 1.00 0.72 O ATOM 1013 CB ALA A 151 4.770 10.878 1.986 1.00 0.57 C ATOM 0 H ALA A 151 5.685 8.935 3.055 1.00 0.38 H new ATOM 0 HA ALA A 151 5.731 11.773 3.720 1.00 0.49 H new ATOM 0 HB1 ALA A 151 4.321 11.820 1.670 1.00 0.57 H new ATOM 0 HB2 ALA A 151 5.694 10.713 1.433 1.00 0.57 H new ATOM 0 HB3 ALA A 151 4.077 10.061 1.787 1.00 0.57 H new ATOM 1019 N GLU A 152 2.954 10.104 4.314 1.00 0.40 N ATOM 1020 CA GLU A 152 1.691 10.194 5.099 1.00 0.50 C ATOM 1021 C GLU A 152 1.992 10.102 6.594 1.00 0.60 C ATOM 1022 O GLU A 152 2.861 9.364 7.017 1.00 1.48 O ATOM 1023 CB GLU A 152 0.849 8.994 4.664 1.00 0.44 C ATOM 1024 CG GLU A 152 0.542 9.078 3.169 1.00 0.77 C ATOM 1025 CD GLU A 152 -0.279 10.335 2.873 1.00 1.10 C ATOM 1026 OE1 GLU A 152 -1.351 10.465 3.439 1.00 1.66 O ATOM 1027 OE2 GLU A 152 0.177 11.143 2.081 1.00 1.81 O ATOM 0 H GLU A 152 3.094 9.224 3.818 1.00 0.40 H new ATOM 0 HA GLU A 152 1.176 11.138 4.925 1.00 0.50 H new ATOM 0 HB2 GLU A 152 1.382 8.069 4.882 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.081 8.968 5.233 1.00 0.44 H new ATOM 0 HG2 GLU A 152 1.471 9.098 2.599 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -0.008 8.192 2.852 1.00 0.77 H new ATOM 1034 N LYS A 153 1.251 10.815 7.392 1.00 0.76 N ATOM 1035 CA LYS A 153 1.451 10.745 8.874 1.00 0.67 C ATOM 1036 C LYS A 153 0.236 10.028 9.478 1.00 0.64 C ATOM 1037 O LYS A 153 0.250 8.821 9.639 1.00 0.57 O ATOM 1038 CB LYS A 153 1.600 12.193 9.426 1.00 0.86 C ATOM 1039 CG LYS A 153 0.907 13.243 8.535 1.00 1.17 C ATOM 1040 CD LYS A 153 0.877 14.591 9.259 1.00 1.57 C ATOM 1041 CE LYS A 153 0.400 15.677 8.292 1.00 2.22 C ATOM 1042 NZ LYS A 153 -0.350 16.644 9.142 1.00 2.51 N ATOM 0 H LYS A 153 0.511 11.447 7.086 1.00 0.76 H new ATOM 0 HA LYS A 153 2.352 10.191 9.137 1.00 0.67 H new ATOM 0 HB2 LYS A 153 1.179 12.240 10.430 1.00 0.86 H new ATOM 0 HB3 LYS A 153 2.659 12.437 9.512 1.00 0.86 H new ATOM 0 HG2 LYS A 153 1.438 13.339 7.588 1.00 1.17 H new ATOM 0 HG3 LYS A 153 -0.108 12.922 8.300 1.00 1.17 H new ATOM 0 HD2 LYS A 153 0.212 14.539 10.121 1.00 1.57 H new ATOM 0 HD3 LYS A 153 1.870 14.836 9.637 1.00 1.57 H new ATOM 0 HE2 LYS A 153 1.241 16.159 7.793 1.00 2.22 H new ATOM 0 HE3 LYS A 153 -0.237 15.260 7.512 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 -0.710 17.420 8.550 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 -1.148 16.158 9.599 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 0.284 17.030 9.871 1.00 2.51 H new ATOM 1056 N LYS A 154 -0.821 10.742 9.780 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.041 10.074 10.330 1.00 0.77 C ATOM 1058 C LYS A 154 -2.668 9.185 9.241 1.00 0.62 C ATOM 1059 O LYS A 154 -3.287 8.173 9.523 1.00 0.60 O ATOM 1060 CB LYS A 154 -2.992 11.212 10.733 1.00 0.95 C ATOM 1061 CG LYS A 154 -3.426 12.015 9.498 1.00 1.29 C ATOM 1062 CD LYS A 154 -4.274 13.207 9.941 1.00 1.34 C ATOM 1063 CE LYS A 154 -4.818 13.936 8.711 1.00 2.02 C ATOM 1064 NZ LYS A 154 -6.050 13.188 8.333 1.00 2.51 N ATOM 0 H LYS A 154 -0.892 11.754 9.670 1.00 0.73 H new ATOM 0 HA LYS A 154 -1.820 9.434 11.184 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -3.869 10.801 11.233 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -2.498 11.871 11.447 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -2.550 12.361 8.949 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -3.997 11.380 8.820 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -5.098 12.867 10.568 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -3.674 13.888 10.544 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -5.043 14.978 8.937 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -4.091 13.936 7.899 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -6.149 13.183 7.298 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -5.982 12.210 8.679 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -6.880 13.648 8.758 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.491 9.558 7.996 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.062 8.748 6.875 1.00 0.47 C ATOM 1080 C ASN A 155 -2.242 7.472 6.665 1.00 0.37 C ATOM 1081 O ASN A 155 -2.672 6.561 5.980 1.00 0.34 O ATOM 1082 CB ASN A 155 -2.954 9.637 5.635 1.00 0.51 C ATOM 1083 CG ASN A 155 -3.979 10.770 5.709 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -3.628 11.928 5.604 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.241 10.485 5.883 1.00 1.03 N ATOM 0 H ASN A 155 -1.975 10.389 7.708 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.089 8.447 7.082 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -1.948 10.050 5.561 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.121 9.043 4.737 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -5.931 11.234 5.931 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -5.537 9.513 5.971 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.073 7.390 7.259 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.238 6.163 7.100 1.00 0.33 C ATOM 1094 C ALA A 156 -0.949 4.966 7.737 1.00 0.28 C ATOM 1095 O ALA A 156 -0.577 3.831 7.508 1.00 0.28 O ATOM 1096 CB ALA A 156 1.059 6.448 7.864 1.00 0.41 C ATOM 0 H ALA A 156 -0.666 8.119 7.844 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.056 5.931 6.051 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.722 5.586 7.790 1.00 0.41 H new ATOM 0 HB2 ALA A 156 1.550 7.321 7.435 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.829 6.640 8.912 1.00 0.41 H new ATOM 1102 N SER A 157 -1.966 5.206 8.537 1.00 0.28 N ATOM 1103 CA SER A 157 -2.680 4.070 9.182 1.00 0.28 C ATOM 1104 C SER A 157 -3.694 3.483 8.214 1.00 0.22 C ATOM 1105 O SER A 157 -3.889 3.987 7.117 1.00 0.21 O ATOM 1106 CB SER A 157 -3.395 4.670 10.387 1.00 0.34 C ATOM 1107 OG SER A 157 -4.084 5.848 9.989 1.00 1.05 O ATOM 0 H SER A 157 -2.324 6.133 8.765 1.00 0.28 H new ATOM 0 HA SER A 157 -1.998 3.270 9.472 1.00 0.28 H new ATOM 0 HB2 SER A 157 -4.097 3.948 10.804 1.00 0.34 H new ATOM 0 HB3 SER A 157 -2.675 4.904 11.171 1.00 0.34 H new ATOM 0 HG SER A 157 -3.501 6.626 10.114 1.00 1.05 H new ATOM 1113 N VAL A 158 -4.334 2.416 8.605 1.00 0.23 N ATOM 1114 CA VAL A 158 -5.321 1.780 7.697 1.00 0.22 C ATOM 1115 C VAL A 158 -6.449 2.749 7.344 1.00 0.18 C ATOM 1116 O VAL A 158 -6.778 2.888 6.188 1.00 0.18 O ATOM 1117 CB VAL A 158 -5.874 0.564 8.439 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -4.738 -0.411 8.735 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -6.538 0.979 9.756 1.00 0.27 C ATOM 0 H VAL A 158 -4.215 1.961 9.510 1.00 0.23 H new ATOM 0 HA VAL A 158 -4.849 1.491 6.758 1.00 0.22 H new ATOM 0 HB VAL A 158 -6.623 0.088 7.807 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.132 -1.279 9.264 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.282 -0.733 7.799 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -3.988 0.082 9.354 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -6.923 0.095 10.264 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -5.805 1.473 10.393 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -7.359 1.665 9.549 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.029 3.436 8.313 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.141 4.404 8.012 1.00 0.13 C ATOM 1131 C ALA A 159 -7.772 5.292 6.826 1.00 0.13 C ATOM 1132 O ALA A 159 -8.608 5.640 6.006 1.00 0.15 O ATOM 1133 CB ALA A 159 -8.305 5.240 9.283 1.00 0.12 C ATOM 0 H ALA A 159 -6.778 3.366 9.299 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.065 3.891 7.743 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.101 5.970 9.138 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -8.559 4.587 10.118 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -7.372 5.759 9.500 1.00 0.12 H new ATOM 1139 N GLY A 160 -6.515 5.618 6.712 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.072 6.445 5.561 1.00 0.15 C ATOM 1141 C GLY A 160 -6.201 5.617 4.291 1.00 0.16 C ATOM 1142 O GLY A 160 -6.968 5.943 3.403 1.00 0.18 O ATOM 0 H GLY A 160 -5.779 5.348 7.365 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -6.679 7.347 5.488 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.040 6.766 5.700 1.00 0.15 H new ATOM 1146 N LEU A 161 -5.452 4.548 4.197 1.00 0.16 N ATOM 1147 CA LEU A 161 -5.526 3.698 2.977 1.00 0.18 C ATOM 1148 C LEU A 161 -6.922 3.090 2.790 1.00 0.20 C ATOM 1149 O LEU A 161 -7.534 3.281 1.761 1.00 0.28 O ATOM 1150 CB LEU A 161 -4.503 2.579 3.196 1.00 0.19 C ATOM 1151 CG LEU A 161 -4.487 1.648 1.975 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -3.842 2.367 0.781 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -3.694 0.383 2.322 1.00 0.27 C ATOM 0 H LEU A 161 -4.796 4.230 4.910 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.322 4.289 2.084 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -3.512 3.005 3.354 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -4.754 2.014 4.093 1.00 0.19 H new ATOM 0 HG LEU A 161 -5.507 1.374 1.706 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -3.833 1.702 -0.083 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.415 3.263 0.543 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -2.819 2.647 1.034 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -3.678 -0.284 1.460 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -2.673 0.655 2.589 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.167 -0.123 3.164 1.00 0.27 H new ATOM 1165 N VAL A 162 -7.421 2.335 3.758 1.00 0.22 N ATOM 1166 CA VAL A 162 -8.756 1.656 3.589 1.00 0.26 C ATOM 1167 C VAL A 162 -9.811 2.620 3.062 1.00 0.29 C ATOM 1168 O VAL A 162 -10.571 2.282 2.172 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.154 1.094 4.968 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.051 0.177 5.506 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -9.413 2.217 5.979 1.00 0.31 C ATOM 0 H VAL A 162 -6.961 2.163 4.652 1.00 0.22 H new ATOM 0 HA VAL A 162 -8.683 0.855 2.853 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.075 0.526 4.836 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -8.345 -0.213 6.480 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -7.897 -0.652 4.815 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.124 0.742 5.606 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -9.691 1.784 6.940 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -8.509 2.815 6.098 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.223 2.851 5.619 1.00 0.31 H new ATOM 1181 N LYS A 163 -9.842 3.823 3.563 1.00 0.29 N ATOM 1182 CA LYS A 163 -10.822 4.817 3.035 1.00 0.34 C ATOM 1183 C LYS A 163 -10.537 5.004 1.543 1.00 0.36 C ATOM 1184 O LYS A 163 -11.421 4.962 0.712 1.00 0.39 O ATOM 1185 CB LYS A 163 -10.562 6.104 3.823 1.00 0.33 C ATOM 1186 CG LYS A 163 -11.617 7.148 3.458 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.362 8.431 4.251 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.456 9.451 3.935 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.319 10.499 4.984 1.00 2.30 N ATOM 0 H LYS A 163 -9.236 4.161 4.311 1.00 0.29 H new ATOM 0 HA LYS A 163 -11.863 4.512 3.144 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -10.592 5.900 4.893 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -9.566 6.485 3.599 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.583 7.356 2.389 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -12.614 6.765 3.677 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -11.349 8.215 5.319 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -10.384 8.840 3.997 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -12.328 9.872 2.938 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -13.444 8.992 3.962 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -13.037 11.236 4.834 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -12.453 10.071 5.922 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.371 10.923 4.929 1.00 2.30 H new ATOM 1203 N ALA A 164 -9.285 5.184 1.218 1.00 0.36 N ATOM 1204 CA ALA A 164 -8.871 5.347 -0.209 1.00 0.39 C ATOM 1205 C ALA A 164 -9.126 4.066 -1.034 1.00 0.39 C ATOM 1206 O ALA A 164 -9.497 4.142 -2.183 1.00 0.33 O ATOM 1207 CB ALA A 164 -7.373 5.657 -0.162 1.00 0.44 C ATOM 0 H ALA A 164 -8.519 5.226 1.890 1.00 0.36 H new ATOM 0 HA ALA A 164 -9.447 6.136 -0.693 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -6.997 5.790 -1.176 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -7.208 6.571 0.409 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -6.845 4.831 0.315 1.00 0.44 H new ATOM 1213 N LEU A 165 -8.888 2.896 -0.476 1.00 0.50 N ATOM 1214 CA LEU A 165 -9.082 1.617 -1.271 1.00 0.55 C ATOM 1215 C LEU A 165 -10.517 1.464 -1.760 1.00 0.45 C ATOM 1216 O LEU A 165 -10.787 1.412 -2.950 1.00 0.42 O ATOM 1217 CB LEU A 165 -8.795 0.438 -0.322 1.00 0.80 C ATOM 1218 CG LEU A 165 -7.458 0.613 0.375 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -7.211 -0.540 1.357 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -6.329 0.675 -0.657 1.00 1.24 C ATOM 0 H LEU A 165 -8.571 2.765 0.485 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.419 1.642 -2.136 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -9.589 0.363 0.421 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -8.796 -0.495 -0.885 1.00 0.80 H new ATOM 0 HG LEU A 165 -7.478 1.549 0.934 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.248 -0.399 1.848 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -8.002 -0.555 2.107 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -7.207 -1.485 0.814 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -5.375 0.801 -0.145 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -6.312 -0.250 -1.234 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -6.495 1.518 -1.328 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.437 1.377 -0.843 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.863 1.200 -1.232 1.00 0.45 C ATOM 1234 C ARG A 166 -13.320 2.427 -2.016 1.00 0.41 C ATOM 1235 O ARG A 166 -14.124 2.327 -2.924 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.624 1.000 0.092 1.00 0.52 C ATOM 1237 CG ARG A 166 -15.130 0.877 -0.174 1.00 1.19 C ATOM 1238 CD ARG A 166 -15.872 0.662 1.153 1.00 1.53 C ATOM 1239 NE ARG A 166 -17.312 0.540 0.777 1.00 2.29 N ATOM 1240 CZ ARG A 166 -18.227 1.211 1.430 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -18.108 1.410 2.717 1.00 3.25 N ATOM 1242 NH2 ARG A 166 -19.267 1.680 0.795 1.00 3.60 N ATOM 0 H ARG A 166 -11.263 1.421 0.161 1.00 0.47 H new ATOM 0 HA ARG A 166 -13.040 0.346 -1.886 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -13.262 0.104 0.596 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -13.433 1.840 0.760 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -15.497 1.778 -0.666 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -15.323 0.044 -0.849 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -15.520 -0.236 1.661 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -15.712 1.498 1.834 1.00 1.53 H new ATOM 0 HE ARG A 166 -17.584 -0.070 0.006 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -17.299 1.042 3.217 1.00 3.25 H new ATOM 0 HH12 ARG A 166 -18.824 1.934 3.220 1.00 3.25 H new ATOM 0 HH21 ARG A 166 -19.365 1.523 -0.208 1.00 3.60 H new ATOM 0 HH22 ARG A 166 -19.981 2.203 1.302 1.00 3.60 H new ATOM 1256 N THR A 167 -12.784 3.576 -1.696 1.00 0.33 N ATOM 1257 CA THR A 167 -13.152 4.806 -2.466 1.00 0.36 C ATOM 1258 C THR A 167 -12.496 4.773 -3.863 1.00 0.35 C ATOM 1259 O THR A 167 -13.073 5.221 -4.834 1.00 0.41 O ATOM 1260 CB THR A 167 -12.680 5.993 -1.621 1.00 0.42 C ATOM 1261 OG1 THR A 167 -13.406 6.006 -0.402 1.00 0.44 O ATOM 1262 CG2 THR A 167 -12.938 7.303 -2.371 1.00 0.47 C ATOM 0 H THR A 167 -12.113 3.718 -0.941 1.00 0.33 H new ATOM 0 HA THR A 167 -14.225 4.881 -2.643 1.00 0.36 H new ATOM 0 HB THR A 167 -11.612 5.896 -1.424 1.00 0.42 H new ATOM 0 HG1 THR A 167 -12.948 5.444 0.257 1.00 0.44 H new ATOM 0 HG21 THR A 167 -12.600 8.143 -1.764 1.00 0.47 H new ATOM 0 HG22 THR A 167 -12.393 7.295 -3.315 1.00 0.47 H new ATOM 0 HG23 THR A 167 -14.005 7.405 -2.569 1.00 0.47 H new ATOM 1270 N CYS A 168 -11.290 4.255 -3.965 1.00 0.32 N ATOM 1271 CA CYS A 168 -10.590 4.197 -5.291 1.00 0.36 C ATOM 1272 C CYS A 168 -10.855 2.866 -6.017 1.00 0.31 C ATOM 1273 O CYS A 168 -10.220 2.570 -7.012 1.00 0.34 O ATOM 1274 CB CYS A 168 -9.101 4.354 -4.973 1.00 0.40 C ATOM 1275 SG CYS A 168 -8.802 6.016 -4.320 1.00 1.38 S ATOM 0 H CYS A 168 -10.760 3.869 -3.183 1.00 0.32 H new ATOM 0 HA CYS A 168 -10.951 4.978 -5.960 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -8.791 3.604 -4.246 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -8.506 4.191 -5.872 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.945 6.007 -3.028 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.784 2.063 -5.527 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.129 0.739 -6.172 1.00 0.31 C ATOM 1283 C ARG A 169 -11.071 -0.318 -5.851 1.00 0.26 C ATOM 1284 O ARG A 169 -10.406 -0.850 -6.720 1.00 0.34 O ATOM 1285 CB ARG A 169 -12.247 0.968 -7.689 1.00 0.44 C ATOM 1286 CG ARG A 169 -13.110 -0.132 -8.307 1.00 0.69 C ATOM 1287 CD ARG A 169 -13.297 0.149 -9.801 1.00 0.84 C ATOM 1288 NE ARG A 169 -14.161 -0.957 -10.304 1.00 1.56 N ATOM 1289 CZ ARG A 169 -14.466 -1.017 -11.570 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -15.459 -0.311 -12.035 1.00 2.74 N ATOM 1291 NH2 ARG A 169 -13.777 -1.783 -12.370 1.00 2.73 N ATOM 0 H ARG A 169 -12.329 2.273 -4.691 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.075 0.365 -5.780 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -12.688 1.945 -7.886 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -11.257 0.967 -8.145 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -12.637 -1.104 -8.165 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -14.079 -0.173 -7.809 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -13.766 1.119 -9.963 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -12.339 0.167 -10.321 1.00 0.84 H new ATOM 0 HE ARG A 169 -14.513 -1.665 -9.659 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -15.997 0.288 -11.408 1.00 2.74 H new ATOM 0 HH12 ARG A 169 -15.698 -0.358 -13.025 1.00 2.74 H new ATOM 0 HH21 ARG A 169 -13.000 -2.334 -12.005 1.00 2.73 H new ATOM 0 HH22 ARG A 169 -14.015 -1.831 -13.361 1.00 2.73 H new ATOM 1305 N LEU A 170 -10.945 -0.635 -4.596 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.978 -1.668 -4.141 1.00 0.17 C ATOM 1307 C LEU A 170 -10.629 -2.440 -2.990 1.00 0.19 C ATOM 1308 O LEU A 170 -10.036 -2.674 -1.956 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.759 -0.889 -3.647 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.962 -0.348 -4.833 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -8.283 1.136 -5.043 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.464 -0.504 -4.549 1.00 0.25 C ATOM 0 H LEU A 170 -11.488 -0.208 -3.845 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.696 -2.377 -4.919 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -9.079 -0.065 -3.009 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.127 -1.536 -3.039 1.00 0.18 H new ATOM 0 HG LEU A 170 -8.230 -0.906 -5.730 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.712 1.516 -5.890 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -9.348 1.253 -5.242 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -8.018 1.696 -4.146 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.892 -0.119 -5.393 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -6.204 0.054 -3.650 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.229 -1.558 -4.402 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.874 -2.799 -3.170 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.644 -3.530 -2.112 1.00 0.30 C ATOM 1326 C ASN A 171 -11.867 -4.729 -1.573 1.00 0.24 C ATOM 1327 O ASN A 171 -12.027 -5.119 -0.433 1.00 0.25 O ATOM 1328 CB ASN A 171 -13.905 -4.011 -2.824 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.068 -4.054 -1.836 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.500 -5.113 -1.429 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.598 -2.932 -1.437 1.00 0.59 N ATOM 0 H ASN A 171 -12.402 -2.613 -4.023 1.00 0.24 H new ATOM 0 HA ASN A 171 -12.849 -2.889 -1.255 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.143 -3.344 -3.653 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -13.739 -5.001 -3.249 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.379 -2.942 -0.780 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.232 -2.044 -1.781 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.038 -5.327 -2.388 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.257 -6.523 -1.927 1.00 0.21 C ATOM 1340 C LEU A 172 -9.483 -6.195 -0.646 1.00 0.17 C ATOM 1341 O LEU A 172 -9.678 -6.807 0.386 1.00 0.21 O ATOM 1342 CB LEU A 172 -9.277 -6.817 -3.067 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.043 -7.316 -4.294 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -9.122 -7.274 -5.514 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -10.501 -8.758 -4.062 1.00 0.85 C ATOM 0 H LEU A 172 -10.865 -5.043 -3.352 1.00 0.21 H new ATOM 0 HA LEU A 172 -10.904 -7.371 -1.704 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -8.717 -5.916 -3.318 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -8.551 -7.566 -2.751 1.00 0.23 H new ATOM 0 HG LEU A 172 -10.912 -6.680 -4.462 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -9.663 -7.629 -6.391 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -8.788 -6.250 -5.683 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -8.257 -7.913 -5.339 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -11.046 -9.112 -4.937 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -9.631 -9.394 -3.895 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -11.152 -8.797 -3.189 1.00 0.85 H new ATOM 1357 N VAL A 173 -8.620 -5.220 -0.709 1.00 0.16 N ATOM 1358 CA VAL A 173 -7.831 -4.831 0.497 1.00 0.21 C ATOM 1359 C VAL A 173 -8.751 -4.224 1.554 1.00 0.22 C ATOM 1360 O VAL A 173 -8.597 -4.470 2.735 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.781 -3.817 0.016 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -5.800 -4.522 -0.914 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.428 -2.648 -0.747 1.00 0.34 C ATOM 0 H VAL A 173 -8.425 -4.672 -1.547 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.347 -5.691 0.960 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.272 -3.416 0.893 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.051 -3.810 -1.260 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.308 -5.333 -0.377 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.338 -4.928 -1.771 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.654 -1.952 -1.071 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -7.959 -3.032 -1.618 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.130 -2.131 -0.093 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.711 -3.442 1.137 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.660 -2.825 2.111 1.00 0.34 C ATOM 1375 C ALA A 174 -11.406 -3.928 2.874 1.00 0.29 C ATOM 1376 O ALA A 174 -11.604 -3.845 4.070 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.624 -1.991 1.260 1.00 0.43 C ATOM 0 H ALA A 174 -9.880 -3.203 0.160 1.00 0.27 H new ATOM 0 HA ALA A 174 -10.157 -2.209 2.856 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.354 -1.505 1.908 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -11.064 -1.233 0.712 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.141 -2.641 0.554 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.822 -4.959 2.185 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.545 -6.072 2.871 1.00 0.23 C ATOM 1385 C ASP A 175 -11.665 -6.733 3.940 1.00 0.17 C ATOM 1386 O ASP A 175 -12.138 -7.072 5.009 1.00 0.20 O ATOM 1387 CB ASP A 175 -12.902 -7.066 1.762 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.001 -6.478 0.869 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -14.748 -5.636 1.347 1.00 0.99 O ATOM 1390 OD2 ASP A 175 -14.079 -6.882 -0.279 1.00 0.80 O ATOM 0 H ASP A 175 -11.693 -5.079 1.180 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.431 -5.712 3.394 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.018 -7.291 1.165 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.240 -8.006 2.199 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.400 -6.936 3.660 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.510 -7.603 4.668 1.00 0.20 C ATOM 1397 C LEU A 176 -9.353 -6.718 5.902 1.00 0.25 C ATOM 1398 O LEU A 176 -9.631 -7.128 7.015 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.147 -7.792 3.974 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.168 -8.862 2.832 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.591 -9.220 2.345 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -7.349 -8.335 1.641 1.00 1.09 C ATOM 0 H LEU A 176 -9.946 -6.672 2.785 1.00 0.14 H new ATOM 0 HA LEU A 176 -9.926 -8.554 4.999 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -7.824 -6.837 3.560 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.407 -8.083 4.719 1.00 0.28 H new ATOM 0 HG LEU A 176 -7.738 -9.774 3.245 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -9.528 -9.967 1.554 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.170 -9.621 3.177 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -10.080 -8.325 1.961 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -7.357 -9.073 0.839 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -7.787 -7.404 1.282 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -6.322 -8.154 1.957 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.921 -5.499 5.708 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.754 -4.566 6.863 1.00 0.41 C ATOM 1416 C VAL A 177 -10.105 -4.355 7.544 1.00 0.37 C ATOM 1417 O VAL A 177 -10.196 -4.321 8.756 1.00 0.39 O ATOM 1418 CB VAL A 177 -8.218 -3.252 6.281 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.838 -3.494 5.671 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -9.168 -2.720 5.204 1.00 0.52 C ATOM 0 H VAL A 177 -8.676 -5.108 4.798 1.00 0.33 H new ATOM 0 HA VAL A 177 -8.068 -4.959 7.613 1.00 0.41 H new ATOM 0 HB VAL A 177 -8.144 -2.514 7.080 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.455 -2.562 5.257 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -6.158 -3.855 6.442 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.916 -4.238 4.878 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.774 -1.787 4.800 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.257 -3.453 4.403 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -10.150 -2.540 5.642 1.00 0.52 H new ATOM 1430 N GLU A 178 -11.162 -4.234 6.774 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.517 -4.056 7.385 1.00 0.39 C ATOM 1432 C GLU A 178 -12.835 -5.264 8.276 1.00 0.31 C ATOM 1433 O GLU A 178 -13.168 -5.127 9.437 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.470 -3.993 6.183 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.928 -4.010 6.653 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.237 -2.765 7.497 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -14.431 -1.846 7.496 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.279 -2.752 8.131 1.00 1.85 O ATOM 0 H GLU A 178 -11.144 -4.251 5.754 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.596 -3.168 8.012 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -13.278 -3.088 5.606 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.285 -4.839 5.520 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -15.594 -4.046 5.791 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -15.117 -4.910 7.239 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.710 -6.443 7.729 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.978 -7.683 8.518 1.00 0.24 C ATOM 1447 C GLU A 179 -11.890 -7.884 9.581 1.00 0.25 C ATOM 1448 O GLU A 179 -12.102 -8.548 10.578 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.959 -8.817 7.489 1.00 0.31 C ATOM 1450 CG GLU A 179 -14.259 -8.796 6.679 1.00 1.03 C ATOM 1451 CD GLU A 179 -14.242 -9.908 5.621 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -13.165 -10.383 5.292 1.00 1.92 O ATOM 1453 OE2 GLU A 179 -15.310 -10.258 5.145 1.00 1.76 O ATOM 0 H GLU A 179 -12.431 -6.603 6.761 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.927 -7.639 9.052 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -12.102 -8.705 6.824 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.848 -9.777 7.993 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -15.112 -8.929 7.344 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -14.380 -7.826 6.196 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.725 -7.323 9.367 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.611 -7.485 10.354 1.00 0.38 C ATOM 1462 C ALA A 180 -9.907 -6.748 11.668 1.00 0.44 C ATOM 1463 O ALA A 180 -9.228 -6.958 12.657 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.384 -6.868 9.678 1.00 0.50 C ATOM 0 H ALA A 180 -10.497 -6.758 8.549 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.468 -8.534 10.613 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.524 -6.949 10.342 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.176 -7.398 8.748 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.578 -5.817 9.461 1.00 0.50 H new ATOM 1470 N GLN A 181 -10.895 -5.883 11.694 1.00 0.48 N ATOM 1471 CA GLN A 181 -11.191 -5.140 12.961 1.00 0.70 C ATOM 1472 C GLN A 181 -12.629 -4.599 12.986 1.00 0.71 C ATOM 1473 O GLN A 181 -13.262 -4.565 14.024 1.00 1.08 O ATOM 1474 CB GLN A 181 -10.170 -3.996 12.984 1.00 1.25 C ATOM 1475 CG GLN A 181 -10.380 -3.076 11.776 1.00 1.59 C ATOM 1476 CD GLN A 181 -9.321 -1.968 11.780 1.00 2.23 C ATOM 1477 OE1 GLN A 181 -8.351 -2.034 12.511 1.00 2.65 O ATOM 1478 NE2 GLN A 181 -9.465 -0.944 10.985 1.00 2.46 N ATOM 0 H GLN A 181 -11.501 -5.662 10.904 1.00 0.48 H new ATOM 0 HA GLN A 181 -11.113 -5.786 13.835 1.00 0.70 H new ATOM 0 HB2 GLN A 181 -10.273 -3.426 13.907 1.00 1.25 H new ATOM 0 HB3 GLN A 181 -9.158 -4.401 12.970 1.00 1.25 H new ATOM 0 HG2 GLN A 181 -10.314 -3.652 10.853 1.00 1.59 H new ATOM 0 HG3 GLN A 181 -11.378 -2.639 11.809 1.00 1.59 H new ATOM 0 HE21 GLN A 181 -10.277 -0.886 10.371 1.00 2.46 H new ATOM 0 HE22 GLN A 181 -8.765 -0.202 10.978 1.00 2.46 H new ATOM 1487 N GLU A 182 -13.145 -4.165 11.860 1.00 0.74 N ATOM 1488 CA GLU A 182 -14.542 -3.613 11.815 1.00 1.33 C ATOM 1489 C GLU A 182 -14.706 -2.480 12.835 1.00 2.14 C ATOM 1490 O GLU A 182 -15.650 -2.454 13.602 1.00 2.63 O ATOM 1491 CB GLU A 182 -15.474 -4.782 12.158 1.00 1.79 C ATOM 1492 CG GLU A 182 -15.444 -5.814 11.029 1.00 2.06 C ATOM 1493 CD GLU A 182 -16.404 -6.959 11.359 1.00 2.67 C ATOM 1494 OE1 GLU A 182 -17.577 -6.828 11.050 1.00 3.67 O ATOM 1495 OE2 GLU A 182 -15.952 -7.946 11.916 1.00 2.49 O ATOM 0 H GLU A 182 -12.657 -4.169 10.964 1.00 0.74 H new ATOM 0 HA GLU A 182 -14.772 -3.196 10.834 1.00 1.33 H new ATOM 0 HB2 GLU A 182 -15.163 -5.245 13.095 1.00 1.79 H new ATOM 0 HB3 GLU A 182 -16.491 -4.418 12.304 1.00 1.79 H new ATOM 0 HG2 GLU A 182 -15.729 -5.346 10.087 1.00 2.06 H new ATOM 0 HG3 GLU A 182 -14.432 -6.199 10.901 1.00 2.06 H new ATOM 1502 N SER A 183 -13.786 -1.543 12.850 1.00 2.57 N ATOM 1503 CA SER A 183 -13.865 -0.398 13.817 1.00 3.70 C ATOM 1504 C SER A 183 -14.016 -0.910 15.254 1.00 4.04 C ATOM 1505 O SER A 183 -14.646 -0.226 16.043 1.00 4.36 O ATOM 1506 CB SER A 183 -15.100 0.406 13.401 1.00 4.22 C ATOM 1507 OG SER A 183 -14.808 1.135 12.216 1.00 4.75 O ATOM 1508 OXT SER A 183 -13.499 -1.978 15.539 1.00 4.26 O ATOM 0 H SER A 183 -12.977 -1.522 12.229 1.00 2.57 H new ATOM 0 HA SER A 183 -12.960 0.209 13.794 1.00 3.70 H new ATOM 0 HB2 SER A 183 -15.944 -0.263 13.232 1.00 4.22 H new ATOM 0 HB3 SER A 183 -15.390 1.089 14.200 1.00 4.22 H new ATOM 0 HG SER A 183 -15.597 1.650 11.946 1.00 4.75 H new TER 1514 SER A 183