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 180:sc= 0 USER MOD Single : A 98 GLN : amide:sc= -1.21 K(o=-1.2,f=-0.52) USER MOD Single : A 105 CYS SG : rot 180:sc= -4.7! USER MOD Single : A 107 ASN : amide:sc= -1.84! C(o=-1.8!,f=-2!) USER MOD Single : A 113 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.244) 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+ -168:sc= -0.0308 (180deg=-0.157) USER MOD Single : A 126 MET CE :methyl 157:sc= -0.469 (180deg=-1.25) USER MOD Single : A 132 LYS NZ :NH3+ -133:sc= -0.0808 (180deg=-0.896) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot -169:sc= -0.826 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 LYS NZ :NH3+ -105:sc= 0.588 (180deg=0.00296) USER MOD Single : A 150 ASN : amide:sc= -2.71 K(o=-2.7,f=0.44) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 ASN : amide:sc=-0.00552 X(o=-0.0055,f=0) USER MOD Single : A 157 SER OG : rot -90:sc= 1.01 USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 118:sc= 1.01 USER MOD Single : A 168 CYS SG : rot 180:sc= 0 USER MOD Single : A 171 ASN : amide:sc= -1.64! K(o=-1.6!,f=-0.62) USER MOD Single : A 181 GLN : amide:sc= 0.0221 X(o=0.022,f=0) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 89 9.310 10.828 12.331 1.00 1.92 N ATOM 2 CA ALA A 89 9.097 11.462 10.995 1.00 1.43 C ATOM 3 C ALA A 89 8.115 10.627 10.174 1.00 1.08 C ATOM 4 O ALA A 89 7.019 11.058 9.870 1.00 1.13 O ATOM 5 CB ALA A 89 10.475 11.474 10.334 1.00 1.90 C ATOM 0 HA ALA A 89 8.678 12.465 11.074 1.00 1.43 H new ATOM 0 HB1 ALA A 89 10.400 11.926 9.345 1.00 1.90 H new ATOM 0 HB2 ALA A 89 11.167 12.052 10.946 1.00 1.90 H new ATOM 0 HB3 ALA A 89 10.842 10.452 10.239 1.00 1.90 H new ATOM 11 N ALA A 90 8.500 9.427 9.833 1.00 0.96 N ATOM 12 CA ALA A 90 7.593 8.535 9.046 1.00 0.72 C ATOM 13 C ALA A 90 6.369 8.214 9.907 1.00 0.58 C ATOM 14 O ALA A 90 6.284 8.690 11.023 1.00 1.23 O ATOM 15 CB ALA A 90 8.425 7.276 8.773 1.00 1.03 C ATOM 0 H ALA A 90 9.407 9.022 10.065 1.00 0.96 H new ATOM 0 HA ALA A 90 7.237 8.978 8.116 1.00 0.72 H new ATOM 0 HB1 ALA A 90 7.832 6.566 8.197 1.00 1.03 H new ATOM 0 HB2 ALA A 90 9.317 7.545 8.208 1.00 1.03 H new ATOM 0 HB3 ALA A 90 8.718 6.821 9.719 1.00 1.03 H new ATOM 21 N PRO A 91 5.449 7.422 9.396 1.00 0.79 N ATOM 22 CA PRO A 91 4.246 7.083 10.195 1.00 1.10 C ATOM 23 C PRO A 91 4.658 6.391 11.503 1.00 0.60 C ATOM 24 O PRO A 91 5.123 5.268 11.482 1.00 0.91 O ATOM 25 CB PRO A 91 3.456 6.151 9.275 1.00 1.98 C ATOM 26 CG PRO A 91 4.477 5.614 8.334 1.00 2.18 C ATOM 27 CD PRO A 91 5.411 6.762 8.083 1.00 1.62 C ATOM 0 HA PRO A 91 3.659 7.951 10.496 1.00 1.10 H new ATOM 0 HB2 PRO A 91 2.973 5.352 9.837 1.00 1.98 H new ATOM 0 HB3 PRO A 91 2.669 6.688 8.745 1.00 1.98 H new ATOM 0 HG2 PRO A 91 5.004 4.763 8.766 1.00 2.18 H new ATOM 0 HG3 PRO A 91 4.018 5.268 7.408 1.00 2.18 H new ATOM 0 HD2 PRO A 91 6.398 6.423 7.769 1.00 1.62 H new ATOM 0 HD3 PRO A 91 5.039 7.427 7.303 1.00 1.62 H new ATOM 35 N PRO A 92 4.481 7.086 12.613 1.00 0.59 N ATOM 36 CA PRO A 92 4.855 6.510 13.929 1.00 0.84 C ATOM 37 C PRO A 92 4.038 5.246 14.199 1.00 0.71 C ATOM 38 O PRO A 92 4.552 4.270 14.711 1.00 0.83 O ATOM 39 CB PRO A 92 4.551 7.636 14.919 1.00 1.49 C ATOM 40 CG PRO A 92 3.546 8.486 14.218 1.00 1.64 C ATOM 41 CD PRO A 92 3.920 8.438 12.762 1.00 1.21 C ATOM 0 HA PRO A 92 5.897 6.196 13.995 1.00 0.84 H new ATOM 0 HB2 PRO A 92 4.156 7.245 15.856 1.00 1.49 H new ATOM 0 HB3 PRO A 92 5.449 8.203 15.164 1.00 1.49 H new ATOM 0 HG2 PRO A 92 2.536 8.109 14.376 1.00 1.64 H new ATOM 0 HG3 PRO A 92 3.567 9.509 14.594 1.00 1.64 H new ATOM 0 HD2 PRO A 92 3.055 8.590 12.117 1.00 1.21 H new ATOM 0 HD3 PRO A 92 4.648 9.208 12.506 1.00 1.21 H new ATOM 49 N GLY A 93 2.781 5.241 13.824 1.00 0.65 N ATOM 50 CA GLY A 93 1.944 4.016 14.024 1.00 0.71 C ATOM 51 C GLY A 93 2.107 3.062 12.833 1.00 0.58 C ATOM 52 O GLY A 93 1.135 2.598 12.267 1.00 0.58 O ATOM 0 H GLY A 93 2.300 6.029 13.390 1.00 0.65 H new ATOM 0 HA2 GLY A 93 2.238 3.513 14.945 1.00 0.71 H new ATOM 0 HA3 GLY A 93 0.896 4.296 14.134 1.00 0.71 H new ATOM 56 N GLU A 94 3.324 2.770 12.454 1.00 0.56 N ATOM 57 CA GLU A 94 3.562 1.848 11.301 1.00 0.55 C ATOM 58 C GLU A 94 3.098 0.432 11.641 1.00 0.49 C ATOM 59 O GLU A 94 2.822 -0.360 10.760 1.00 0.53 O ATOM 60 CB GLU A 94 5.073 1.891 11.061 1.00 0.66 C ATOM 61 CG GLU A 94 5.407 1.157 9.761 1.00 1.09 C ATOM 62 CD GLU A 94 6.909 1.270 9.460 1.00 1.10 C ATOM 63 OE1 GLU A 94 7.558 2.123 10.047 1.00 1.44 O ATOM 64 OE2 GLU A 94 7.383 0.507 8.635 1.00 1.62 O ATOM 0 H GLU A 94 4.169 3.132 12.896 1.00 0.56 H new ATOM 0 HA GLU A 94 3.005 2.147 10.413 1.00 0.55 H new ATOM 0 HB2 GLU A 94 5.413 2.925 11.004 1.00 0.66 H new ATOM 0 HB3 GLU A 94 5.598 1.428 11.897 1.00 0.66 H new ATOM 0 HG2 GLU A 94 5.123 0.108 9.844 1.00 1.09 H new ATOM 0 HG3 GLU A 94 4.831 1.579 8.938 1.00 1.09 H new ATOM 71 N ALA A 95 3.005 0.100 12.908 1.00 0.49 N ATOM 72 CA ALA A 95 2.555 -1.275 13.283 1.00 0.50 C ATOM 73 C ALA A 95 1.156 -1.539 12.727 1.00 0.38 C ATOM 74 O ALA A 95 0.911 -2.571 12.128 1.00 0.36 O ATOM 75 CB ALA A 95 2.543 -1.304 14.814 1.00 0.61 C ATOM 0 H ALA A 95 3.220 0.717 13.691 1.00 0.49 H new ATOM 0 HA ALA A 95 3.212 -2.044 12.876 1.00 0.50 H new ATOM 0 HB1 ALA A 95 2.221 -2.287 15.157 1.00 0.61 H new ATOM 0 HB2 ALA A 95 3.545 -1.099 15.190 1.00 0.61 H new ATOM 0 HB3 ALA A 95 1.854 -0.546 15.187 1.00 0.61 H new ATOM 81 N TYR A 96 0.244 -0.609 12.888 1.00 0.38 N ATOM 82 CA TYR A 96 -1.122 -0.818 12.325 1.00 0.35 C ATOM 83 C TYR A 96 -1.036 -0.806 10.802 1.00 0.28 C ATOM 84 O TYR A 96 -1.665 -1.594 10.120 1.00 0.29 O ATOM 85 CB TYR A 96 -1.976 0.343 12.848 1.00 0.42 C ATOM 86 CG TYR A 96 -2.872 -0.163 13.954 1.00 0.73 C ATOM 87 CD1 TYR A 96 -3.755 -1.219 13.697 1.00 1.47 C ATOM 88 CD2 TYR A 96 -2.818 0.409 15.231 1.00 1.54 C ATOM 89 CE1 TYR A 96 -4.581 -1.705 14.713 1.00 1.85 C ATOM 90 CE2 TYR A 96 -3.648 -0.077 16.250 1.00 1.93 C ATOM 91 CZ TYR A 96 -4.529 -1.135 15.990 1.00 1.77 C ATOM 92 OH TYR A 96 -5.342 -1.621 16.995 1.00 2.32 O ATOM 0 H TYR A 96 0.386 0.274 13.379 1.00 0.38 H new ATOM 0 HA TYR A 96 -1.559 -1.772 12.620 1.00 0.35 H new ATOM 0 HB2 TYR A 96 -1.336 1.144 13.219 1.00 0.42 H new ATOM 0 HB3 TYR A 96 -2.576 0.763 12.040 1.00 0.42 H new ATOM 0 HD1 TYR A 96 -3.797 -1.658 12.711 1.00 1.47 H new ATOM 0 HD2 TYR A 96 -2.138 1.224 15.430 1.00 1.54 H new ATOM 0 HE1 TYR A 96 -5.260 -2.521 14.513 1.00 1.85 H new ATOM 0 HE2 TYR A 96 -3.609 0.364 17.235 1.00 1.93 H new ATOM 0 HH TYR A 96 -5.181 -1.116 17.819 1.00 2.32 H new ATOM 102 N LEU A 97 -0.242 0.084 10.273 1.00 0.42 N ATOM 103 CA LEU A 97 -0.066 0.172 8.793 1.00 0.55 C ATOM 104 C LEU A 97 0.480 -1.148 8.246 1.00 0.43 C ATOM 105 O LEU A 97 -0.042 -1.693 7.291 1.00 0.35 O ATOM 106 CB LEU A 97 0.931 1.322 8.584 1.00 0.90 C ATOM 107 CG LEU A 97 1.328 1.429 7.102 1.00 0.94 C ATOM 108 CD1 LEU A 97 1.208 2.880 6.634 1.00 1.33 C ATOM 109 CD2 LEU A 97 2.776 0.963 6.920 1.00 1.75 C ATOM 0 H LEU A 97 0.299 0.763 10.809 1.00 0.42 H new ATOM 0 HA LEU A 97 -1.003 0.355 8.268 1.00 0.55 H new ATOM 0 HB2 LEU A 97 0.487 2.261 8.916 1.00 0.90 H new ATOM 0 HB3 LEU A 97 1.819 1.156 9.193 1.00 0.90 H new ATOM 0 HG LEU A 97 0.662 0.799 6.512 1.00 0.94 H new ATOM 0 HD11 LEU A 97 1.491 2.948 5.584 1.00 1.33 H new ATOM 0 HD12 LEU A 97 0.179 3.217 6.755 1.00 1.33 H new ATOM 0 HD13 LEU A 97 1.869 3.510 7.229 1.00 1.33 H new ATOM 0 HD21 LEU A 97 3.054 1.040 5.869 1.00 1.75 H new ATOM 0 HD22 LEU A 97 3.438 1.590 7.517 1.00 1.75 H new ATOM 0 HD23 LEU A 97 2.868 -0.074 7.244 1.00 1.75 H new ATOM 121 N GLN A 98 1.528 -1.661 8.840 1.00 0.47 N ATOM 122 CA GLN A 98 2.105 -2.947 8.343 1.00 0.49 C ATOM 123 C GLN A 98 1.072 -4.066 8.448 1.00 0.38 C ATOM 124 O GLN A 98 0.967 -4.898 7.568 1.00 0.39 O ATOM 125 CB GLN A 98 3.309 -3.241 9.235 1.00 0.63 C ATOM 126 CG GLN A 98 4.442 -2.283 8.879 1.00 0.57 C ATOM 127 CD GLN A 98 5.615 -2.506 9.833 1.00 1.24 C ATOM 128 OE1 GLN A 98 6.569 -3.178 9.493 1.00 2.00 O ATOM 129 NE2 GLN A 98 5.584 -1.970 11.021 1.00 2.04 N ATOM 0 H GLN A 98 2.006 -1.249 9.641 1.00 0.47 H new ATOM 0 HA GLN A 98 2.397 -2.878 7.295 1.00 0.49 H new ATOM 0 HB2 GLN A 98 3.036 -3.127 10.284 1.00 0.63 H new ATOM 0 HB3 GLN A 98 3.633 -4.273 9.100 1.00 0.63 H new ATOM 0 HG2 GLN A 98 4.761 -2.446 7.849 1.00 0.57 H new ATOM 0 HG3 GLN A 98 4.095 -1.252 8.946 1.00 0.57 H new ATOM 0 HE21 GLN A 98 4.783 -1.406 11.305 1.00 2.04 H new ATOM 0 HE22 GLN A 98 6.361 -2.114 11.666 1.00 2.04 H new ATOM 138 N VAL A 99 0.308 -4.097 9.512 1.00 0.33 N ATOM 139 CA VAL A 99 -0.714 -5.179 9.661 1.00 0.31 C ATOM 140 C VAL A 99 -1.708 -5.120 8.497 1.00 0.24 C ATOM 141 O VAL A 99 -1.965 -6.121 7.848 1.00 0.30 O ATOM 142 CB VAL A 99 -1.410 -4.895 11.003 1.00 0.32 C ATOM 143 CG1 VAL A 99 -2.583 -5.866 11.211 1.00 0.43 C ATOM 144 CG2 VAL A 99 -0.395 -5.066 12.136 1.00 0.43 C ATOM 0 H VAL A 99 0.347 -3.425 10.279 1.00 0.33 H new ATOM 0 HA VAL A 99 -0.274 -6.176 9.647 1.00 0.31 H new ATOM 0 HB VAL A 99 -1.797 -3.876 11.000 1.00 0.32 H new ATOM 0 HG11 VAL A 99 -3.066 -5.654 12.165 1.00 0.43 H new ATOM 0 HG12 VAL A 99 -3.304 -5.743 10.403 1.00 0.43 H new ATOM 0 HG13 VAL A 99 -2.211 -6.891 11.213 1.00 0.43 H new ATOM 0 HG21 VAL A 99 -0.880 -4.867 13.092 1.00 0.43 H new ATOM 0 HG22 VAL A 99 -0.011 -6.086 12.130 1.00 0.43 H new ATOM 0 HG23 VAL A 99 0.429 -4.367 11.994 1.00 0.43 H new ATOM 154 N ALA A 100 -2.248 -3.962 8.211 1.00 0.18 N ATOM 155 CA ALA A 100 -3.201 -3.861 7.070 1.00 0.18 C ATOM 156 C ALA A 100 -2.434 -4.038 5.766 1.00 0.14 C ATOM 157 O ALA A 100 -2.829 -4.795 4.911 1.00 0.14 O ATOM 158 CB ALA A 100 -3.806 -2.460 7.164 1.00 0.24 C ATOM 0 H ALA A 100 -2.071 -3.092 8.714 1.00 0.18 H new ATOM 0 HA ALA A 100 -3.979 -4.624 7.100 1.00 0.18 H new ATOM 0 HB1 ALA A 100 -4.519 -2.316 6.352 1.00 0.24 H new ATOM 0 HB2 ALA A 100 -4.317 -2.348 8.120 1.00 0.24 H new ATOM 0 HB3 ALA A 100 -3.014 -1.716 7.087 1.00 0.24 H new ATOM 164 N PHE A 101 -1.322 -3.361 5.626 1.00 0.15 N ATOM 165 CA PHE A 101 -0.499 -3.497 4.385 1.00 0.16 C ATOM 166 C PHE A 101 -0.059 -4.949 4.191 1.00 0.17 C ATOM 167 O PHE A 101 0.330 -5.324 3.119 1.00 0.20 O ATOM 168 CB PHE A 101 0.735 -2.604 4.613 1.00 0.19 C ATOM 169 CG PHE A 101 0.425 -1.112 4.461 1.00 0.25 C ATOM 170 CD1 PHE A 101 -0.889 -0.604 4.549 1.00 1.10 C ATOM 171 CD2 PHE A 101 1.491 -0.223 4.252 1.00 1.21 C ATOM 172 CE1 PHE A 101 -1.118 0.772 4.430 1.00 1.10 C ATOM 173 CE2 PHE A 101 1.253 1.150 4.128 1.00 1.26 C ATOM 174 CZ PHE A 101 -0.049 1.646 4.221 1.00 0.43 C ATOM 0 H PHE A 101 -0.947 -2.716 6.322 1.00 0.15 H new ATOM 0 HA PHE A 101 -1.061 -3.206 3.497 1.00 0.16 H new ATOM 0 HB2 PHE A 101 1.131 -2.788 5.612 1.00 0.19 H new ATOM 0 HB3 PHE A 101 1.515 -2.882 3.904 1.00 0.19 H new ATOM 0 HD1 PHE A 101 -1.718 -1.277 4.708 1.00 1.10 H new ATOM 0 HD2 PHE A 101 2.501 -0.601 4.187 1.00 1.21 H new ATOM 0 HE1 PHE A 101 -2.124 1.159 4.500 1.00 1.10 H new ATOM 0 HE2 PHE A 101 2.077 1.827 3.960 1.00 1.26 H new ATOM 0 HZ PHE A 101 -0.230 2.707 4.131 1.00 0.43 H new ATOM 184 N ASP A 102 -0.100 -5.767 5.215 1.00 0.18 N ATOM 185 CA ASP A 102 0.344 -7.185 5.047 1.00 0.21 C ATOM 186 C ASP A 102 -0.778 -8.049 4.491 1.00 0.20 C ATOM 187 O ASP A 102 -0.600 -8.740 3.505 1.00 0.22 O ATOM 188 CB ASP A 102 0.722 -7.654 6.443 1.00 0.25 C ATOM 189 CG ASP A 102 1.392 -9.033 6.378 1.00 0.32 C ATOM 190 OD1 ASP A 102 1.139 -9.758 5.428 1.00 1.01 O ATOM 191 OD2 ASP A 102 2.150 -9.341 7.282 1.00 1.13 O ATOM 0 H ASP A 102 -0.419 -5.517 6.151 1.00 0.18 H new ATOM 0 HA ASP A 102 1.174 -7.261 4.345 1.00 0.21 H new ATOM 0 HB2 ASP A 102 1.398 -6.935 6.905 1.00 0.25 H new ATOM 0 HB3 ASP A 102 -0.168 -7.704 7.071 1.00 0.25 H new ATOM 196 N ILE A 103 -1.933 -8.031 5.117 1.00 0.18 N ATOM 197 CA ILE A 103 -3.049 -8.878 4.605 1.00 0.18 C ATOM 198 C ILE A 103 -3.415 -8.453 3.189 1.00 0.17 C ATOM 199 O ILE A 103 -3.638 -9.274 2.316 1.00 0.18 O ATOM 200 CB ILE A 103 -4.237 -8.674 5.567 1.00 0.18 C ATOM 201 CG1 ILE A 103 -4.623 -7.188 5.690 1.00 0.94 C ATOM 202 CG2 ILE A 103 -3.878 -9.223 6.945 1.00 0.94 C ATOM 203 CD1 ILE A 103 -5.856 -7.049 6.592 1.00 0.87 C ATOM 0 H ILE A 103 -2.145 -7.475 5.946 1.00 0.18 H new ATOM 0 HA ILE A 103 -2.767 -9.930 4.565 1.00 0.18 H new ATOM 0 HB ILE A 103 -5.094 -9.211 5.160 1.00 0.18 H new ATOM 0 HG12 ILE A 103 -3.791 -6.619 6.104 1.00 0.94 H new ATOM 0 HG13 ILE A 103 -4.833 -6.774 4.704 1.00 0.94 H new ATOM 0 HG21 ILE A 103 -4.718 -9.078 7.624 1.00 0.94 H new ATOM 0 HG22 ILE A 103 -3.654 -10.287 6.866 1.00 0.94 H new ATOM 0 HG23 ILE A 103 -3.005 -8.696 7.330 1.00 0.94 H new ATOM 0 HD11 ILE A 103 -6.127 -5.997 6.678 1.00 0.87 H new ATOM 0 HD12 ILE A 103 -6.688 -7.604 6.159 1.00 0.87 H new ATOM 0 HD13 ILE A 103 -5.630 -7.447 7.581 1.00 0.87 H new ATOM 215 N VAL A 104 -3.469 -7.176 2.961 1.00 0.16 N ATOM 216 CA VAL A 104 -3.829 -6.675 1.607 1.00 0.16 C ATOM 217 C VAL A 104 -2.713 -6.953 0.593 1.00 0.17 C ATOM 218 O VAL A 104 -2.970 -7.296 -0.546 1.00 0.18 O ATOM 219 CB VAL A 104 -4.064 -5.173 1.771 1.00 0.16 C ATOM 220 CG1 VAL A 104 -5.161 -4.922 2.812 1.00 0.18 C ATOM 221 CG2 VAL A 104 -2.770 -4.476 2.199 1.00 0.14 C ATOM 0 H VAL A 104 -3.279 -6.453 3.655 1.00 0.16 H new ATOM 0 HA VAL A 104 -4.715 -7.179 1.221 1.00 0.16 H new ATOM 0 HB VAL A 104 -4.383 -4.764 0.812 1.00 0.16 H new ATOM 0 HG11 VAL A 104 -5.320 -3.849 2.921 1.00 0.18 H new ATOM 0 HG12 VAL A 104 -6.087 -5.395 2.486 1.00 0.18 H new ATOM 0 HG13 VAL A 104 -4.856 -5.343 3.770 1.00 0.18 H new ATOM 0 HG21 VAL A 104 -2.953 -3.407 2.312 1.00 0.14 H new ATOM 0 HG22 VAL A 104 -2.432 -4.889 3.149 1.00 0.14 H new ATOM 0 HG23 VAL A 104 -2.003 -4.635 1.441 1.00 0.14 H new ATOM 231 N CYS A 105 -1.477 -6.788 0.997 1.00 0.18 N ATOM 232 CA CYS A 105 -0.342 -7.025 0.048 1.00 0.19 C ATOM 233 C CYS A 105 -0.343 -8.458 -0.434 1.00 0.20 C ATOM 234 O CYS A 105 -0.316 -8.716 -1.618 1.00 0.21 O ATOM 235 CB CYS A 105 0.917 -6.717 0.857 1.00 0.22 C ATOM 236 SG CYS A 105 2.398 -6.970 -0.152 1.00 0.29 S ATOM 0 H CYS A 105 -1.205 -6.501 1.937 1.00 0.18 H new ATOM 0 HA CYS A 105 -0.412 -6.403 -0.845 1.00 0.19 H new ATOM 0 HB2 CYS A 105 0.884 -5.687 1.213 1.00 0.22 H new ATOM 0 HB3 CYS A 105 0.956 -7.358 1.738 1.00 0.22 H new ATOM 0 HG CYS A 105 3.456 -6.701 0.554 1.00 0.29 H new ATOM 242 N ASP A 106 -0.405 -9.387 0.471 1.00 0.21 N ATOM 243 CA ASP A 106 -0.431 -10.813 0.049 1.00 0.24 C ATOM 244 C ASP A 106 -1.726 -11.083 -0.740 1.00 0.25 C ATOM 245 O ASP A 106 -1.844 -12.080 -1.426 1.00 0.28 O ATOM 246 CB ASP A 106 -0.399 -11.619 1.343 1.00 0.25 C ATOM 247 CG ASP A 106 0.915 -11.350 2.080 1.00 0.27 C ATOM 248 OD1 ASP A 106 1.937 -11.270 1.419 1.00 1.05 O ATOM 249 OD2 ASP A 106 0.875 -11.228 3.294 1.00 1.05 O ATOM 0 H ASP A 106 -0.439 -9.225 1.478 1.00 0.21 H new ATOM 0 HA ASP A 106 0.405 -11.079 -0.597 1.00 0.24 H new ATOM 0 HB2 ASP A 106 -1.245 -11.347 1.974 1.00 0.25 H new ATOM 0 HB3 ASP A 106 -0.494 -12.682 1.124 1.00 0.25 H new ATOM 254 N ASN A 107 -2.697 -10.190 -0.652 1.00 0.24 N ATOM 255 CA ASN A 107 -3.975 -10.382 -1.399 1.00 0.26 C ATOM 256 C ASN A 107 -3.876 -9.762 -2.792 1.00 0.26 C ATOM 257 O ASN A 107 -4.270 -10.358 -3.778 1.00 0.29 O ATOM 258 CB ASN A 107 -5.008 -9.606 -0.586 1.00 0.25 C ATOM 259 CG ASN A 107 -6.374 -10.272 -0.732 1.00 0.29 C ATOM 260 OD1 ASN A 107 -7.270 -9.720 -1.339 1.00 1.02 O ATOM 261 ND2 ASN A 107 -6.572 -11.447 -0.200 1.00 1.23 N ATOM 0 H ASN A 107 -2.650 -9.339 -0.092 1.00 0.24 H new ATOM 0 HA ASN A 107 -4.222 -11.437 -1.522 1.00 0.26 H new ATOM 0 HB2 ASN A 107 -4.715 -9.579 0.464 1.00 0.25 H new ATOM 0 HB3 ASN A 107 -5.056 -8.573 -0.930 1.00 0.25 H new ATOM 0 HD21 ASN A 107 -7.480 -11.903 -0.294 1.00 1.23 H new ATOM 0 HD22 ASN A 107 -5.819 -11.910 0.309 1.00 1.23 H new ATOM 268 N VAL A 108 -3.361 -8.563 -2.876 1.00 0.23 N ATOM 269 CA VAL A 108 -3.245 -7.886 -4.198 1.00 0.24 C ATOM 270 C VAL A 108 -2.195 -6.778 -4.131 1.00 0.25 C ATOM 271 O VAL A 108 -2.417 -5.664 -4.558 1.00 0.42 O ATOM 272 CB VAL A 108 -4.649 -7.336 -4.466 1.00 0.23 C ATOM 273 CG1 VAL A 108 -4.980 -6.155 -3.546 1.00 0.27 C ATOM 274 CG2 VAL A 108 -4.748 -6.898 -5.927 1.00 0.27 C ATOM 0 H VAL A 108 -3.015 -8.023 -2.082 1.00 0.23 H new ATOM 0 HA VAL A 108 -2.920 -8.552 -4.997 1.00 0.24 H new ATOM 0 HB VAL A 108 -5.370 -8.127 -4.261 1.00 0.23 H new ATOM 0 HG11 VAL A 108 -5.984 -5.792 -3.766 1.00 0.27 H new ATOM 0 HG12 VAL A 108 -4.931 -6.479 -2.506 1.00 0.27 H new ATOM 0 HG13 VAL A 108 -4.260 -5.353 -3.710 1.00 0.27 H new ATOM 0 HG21 VAL A 108 -5.746 -6.506 -6.122 1.00 0.27 H new ATOM 0 HG22 VAL A 108 -4.008 -6.123 -6.125 1.00 0.27 H new ATOM 0 HG23 VAL A 108 -4.561 -7.753 -6.577 1.00 0.27 H new ATOM 284 N GLY A 109 -1.071 -7.089 -3.548 1.00 0.24 N ATOM 285 CA GLY A 109 0.034 -6.100 -3.361 1.00 0.22 C ATOM 286 C GLY A 109 0.235 -5.243 -4.631 1.00 0.23 C ATOM 287 O GLY A 109 0.586 -4.082 -4.555 1.00 0.21 O ATOM 0 H GLY A 109 -0.864 -8.018 -3.181 1.00 0.24 H new ATOM 0 HA2 GLY A 109 -0.193 -5.453 -2.514 1.00 0.22 H new ATOM 0 HA3 GLY A 109 0.959 -6.625 -3.122 1.00 0.22 H new ATOM 291 N ARG A 110 0.004 -5.808 -5.791 1.00 0.27 N ATOM 292 CA ARG A 110 0.189 -5.035 -7.066 1.00 0.28 C ATOM 293 C ARG A 110 -0.696 -3.779 -7.083 1.00 0.27 C ATOM 294 O ARG A 110 -0.451 -2.839 -7.833 1.00 0.27 O ATOM 295 CB ARG A 110 -0.230 -5.988 -8.191 1.00 0.36 C ATOM 296 CG ARG A 110 0.653 -7.244 -8.186 1.00 0.55 C ATOM 297 CD ARG A 110 1.994 -6.946 -8.859 1.00 0.72 C ATOM 298 NE ARG A 110 1.685 -6.905 -10.317 1.00 1.08 N ATOM 299 CZ ARG A 110 2.582 -7.279 -11.188 1.00 1.39 C ATOM 300 NH1 ARG A 110 3.246 -8.388 -11.009 1.00 1.68 N ATOM 301 NH2 ARG A 110 2.812 -6.545 -12.242 1.00 2.06 N ATOM 0 H ARG A 110 -0.305 -6.772 -5.913 1.00 0.27 H new ATOM 0 HA ARG A 110 1.219 -4.697 -7.176 1.00 0.28 H new ATOM 0 HB2 ARG A 110 -1.275 -6.270 -8.066 1.00 0.36 H new ATOM 0 HB3 ARG A 110 -0.149 -5.483 -9.153 1.00 0.36 H new ATOM 0 HG2 ARG A 110 0.818 -7.578 -7.162 1.00 0.55 H new ATOM 0 HG3 ARG A 110 0.147 -8.056 -8.709 1.00 0.55 H new ATOM 0 HD2 ARG A 110 2.408 -5.998 -8.515 1.00 0.72 H new ATOM 0 HD3 ARG A 110 2.731 -7.716 -8.632 1.00 0.72 H new ATOM 0 HE ARG A 110 0.770 -6.584 -10.634 1.00 1.08 H new ATOM 0 HH11 ARG A 110 3.064 -8.964 -10.187 1.00 1.68 H new ATOM 0 HH12 ARG A 110 3.947 -8.679 -11.691 1.00 1.68 H new ATOM 0 HH21 ARG A 110 2.291 -5.680 -12.385 1.00 2.06 H new ATOM 0 HH22 ARG A 110 3.513 -6.836 -12.923 1.00 2.06 H new ATOM 315 N ASP A 111 -1.716 -3.749 -6.261 1.00 0.27 N ATOM 316 CA ASP A 111 -2.613 -2.557 -6.230 1.00 0.30 C ATOM 317 C ASP A 111 -1.846 -1.350 -5.667 1.00 0.31 C ATOM 318 O ASP A 111 -2.248 -0.213 -5.840 1.00 0.39 O ATOM 319 CB ASP A 111 -3.766 -2.959 -5.294 1.00 0.30 C ATOM 320 CG ASP A 111 -4.741 -3.901 -6.016 1.00 0.30 C ATOM 321 OD1 ASP A 111 -4.456 -4.288 -7.140 1.00 0.82 O ATOM 322 OD2 ASP A 111 -5.766 -4.209 -5.432 1.00 0.93 O ATOM 0 H ASP A 111 -1.964 -4.497 -5.613 1.00 0.27 H new ATOM 0 HA ASP A 111 -2.976 -2.272 -7.218 1.00 0.30 H new ATOM 0 HB2 ASP A 111 -3.367 -3.450 -4.406 1.00 0.30 H new ATOM 0 HB3 ASP A 111 -4.295 -2.068 -4.956 1.00 0.30 H new ATOM 327 N TRP A 112 -0.732 -1.587 -5.015 1.00 0.27 N ATOM 328 CA TRP A 112 0.078 -0.457 -4.463 1.00 0.29 C ATOM 329 C TRP A 112 0.983 0.087 -5.563 1.00 0.32 C ATOM 330 O TRP A 112 1.289 1.259 -5.593 1.00 0.31 O ATOM 331 CB TRP A 112 0.910 -1.039 -3.309 1.00 0.29 C ATOM 332 CG TRP A 112 0.044 -1.908 -2.456 1.00 0.25 C ATOM 333 CD1 TRP A 112 0.406 -3.112 -1.974 1.00 0.23 C ATOM 334 CD2 TRP A 112 -1.331 -1.687 -2.022 1.00 0.25 C ATOM 335 NE1 TRP A 112 -0.642 -3.630 -1.245 1.00 0.20 N ATOM 336 CE2 TRP A 112 -1.733 -2.797 -1.254 1.00 0.20 C ATOM 337 CE3 TRP A 112 -2.261 -0.643 -2.206 1.00 0.31 C ATOM 338 CZ2 TRP A 112 -2.997 -2.881 -0.697 1.00 0.20 C ATOM 339 CZ3 TRP A 112 -3.545 -0.728 -1.640 1.00 0.32 C ATOM 340 CH2 TRP A 112 -3.908 -1.853 -0.887 1.00 0.27 C ATOM 0 H TRP A 112 -0.349 -2.516 -4.842 1.00 0.27 H new ATOM 0 HA TRP A 112 -0.547 0.361 -4.105 1.00 0.29 H new ATOM 0 HB2 TRP A 112 1.745 -1.617 -3.705 1.00 0.29 H new ATOM 0 HB3 TRP A 112 1.335 -0.233 -2.711 1.00 0.29 H new ATOM 0 HD1 TRP A 112 1.360 -3.592 -2.133 1.00 0.23 H new ATOM 0 HE1 TRP A 112 -0.611 -4.525 -0.757 1.00 0.20 H new ATOM 0 HE3 TRP A 112 -1.985 0.226 -2.785 1.00 0.31 H new ATOM 0 HZ2 TRP A 112 -3.274 -3.747 -0.114 1.00 0.20 H new ATOM 0 HZ3 TRP A 112 -4.253 0.075 -1.786 1.00 0.32 H new ATOM 0 HH2 TRP A 112 -4.896 -1.919 -0.455 1.00 0.27 H new ATOM 351 N LYS A 113 1.404 -0.755 -6.478 1.00 0.37 N ATOM 352 CA LYS A 113 2.272 -0.268 -7.591 1.00 0.40 C ATOM 353 C LYS A 113 1.491 0.734 -8.438 1.00 0.34 C ATOM 354 O LYS A 113 1.974 1.813 -8.734 1.00 0.30 O ATOM 355 CB LYS A 113 2.640 -1.509 -8.403 1.00 0.50 C ATOM 356 CG LYS A 113 3.685 -2.319 -7.635 1.00 0.72 C ATOM 357 CD LYS A 113 5.060 -1.675 -7.826 1.00 0.89 C ATOM 358 CE LYS A 113 5.720 -2.242 -9.085 1.00 1.51 C ATOM 359 NZ LYS A 113 6.395 -1.077 -9.724 1.00 1.66 N ATOM 0 H LYS A 113 1.184 -1.751 -6.500 1.00 0.37 H new ATOM 0 HA LYS A 113 3.168 0.239 -7.233 1.00 0.40 H new ATOM 0 HB2 LYS A 113 1.753 -2.116 -8.585 1.00 0.50 H new ATOM 0 HB3 LYS A 113 3.032 -1.218 -9.378 1.00 0.50 H new ATOM 0 HG2 LYS A 113 3.430 -2.353 -6.576 1.00 0.72 H new ATOM 0 HG3 LYS A 113 3.699 -3.349 -7.993 1.00 0.72 H new ATOM 0 HD2 LYS A 113 4.958 -0.593 -7.912 1.00 0.89 H new ATOM 0 HD3 LYS A 113 5.687 -1.868 -6.956 1.00 0.89 H new ATOM 0 HE2 LYS A 113 6.436 -3.026 -8.837 1.00 1.51 H new ATOM 0 HE3 LYS A 113 4.981 -2.685 -9.753 1.00 1.51 H new ATOM 0 HZ1 LYS A 113 7.083 -1.417 -10.426 1.00 1.66 H new ATOM 0 HZ2 LYS A 113 5.685 -0.480 -10.195 1.00 1.66 H new ATOM 0 HZ3 LYS A 113 6.888 -0.520 -8.997 1.00 1.66 H new ATOM 373 N ARG A 114 0.274 0.400 -8.807 1.00 0.35 N ATOM 374 CA ARG A 114 -0.534 1.370 -9.614 1.00 0.33 C ATOM 375 C ARG A 114 -0.849 2.603 -8.753 1.00 0.28 C ATOM 376 O ARG A 114 -0.828 3.728 -9.230 1.00 0.29 O ATOM 377 CB ARG A 114 -1.814 0.637 -10.057 1.00 0.37 C ATOM 378 CG ARG A 114 -2.529 -0.007 -8.861 1.00 0.38 C ATOM 379 CD ARG A 114 -3.838 0.735 -8.568 1.00 0.43 C ATOM 380 NE ARG A 114 -4.726 0.409 -9.716 1.00 0.57 N ATOM 381 CZ ARG A 114 -5.879 -0.163 -9.505 1.00 1.04 C ATOM 382 NH1 ARG A 114 -6.798 0.458 -8.818 1.00 1.62 N ATOM 383 NH2 ARG A 114 -6.112 -1.357 -9.978 1.00 1.77 N ATOM 0 H ARG A 114 -0.186 -0.484 -8.589 1.00 0.35 H new ATOM 0 HA ARG A 114 0.005 1.718 -10.495 1.00 0.33 H new ATOM 0 HB2 ARG A 114 -2.486 1.339 -10.550 1.00 0.37 H new ATOM 0 HB3 ARG A 114 -1.562 -0.130 -10.789 1.00 0.37 H new ATOM 0 HG2 ARG A 114 -2.736 -1.056 -9.073 1.00 0.38 H new ATOM 0 HG3 ARG A 114 -1.883 0.019 -7.984 1.00 0.38 H new ATOM 0 HD2 ARG A 114 -4.275 0.408 -7.625 1.00 0.43 H new ATOM 0 HD3 ARG A 114 -3.674 1.810 -8.488 1.00 0.43 H new ATOM 0 HE ARG A 114 -4.433 0.633 -10.667 1.00 0.57 H new ATOM 0 HH11 ARG A 114 -6.614 1.390 -8.446 1.00 1.62 H new ATOM 0 HH12 ARG A 114 -7.700 0.011 -8.652 1.00 1.62 H new ATOM 0 HH21 ARG A 114 -5.392 -1.843 -10.513 1.00 1.77 H new ATOM 0 HH22 ARG A 114 -7.014 -1.804 -9.813 1.00 1.77 H new ATOM 397 N LEU A 115 -1.100 2.407 -7.479 1.00 0.26 N ATOM 398 CA LEU A 115 -1.374 3.567 -6.581 1.00 0.25 C ATOM 399 C LEU A 115 -0.073 4.332 -6.323 1.00 0.25 C ATOM 400 O LEU A 115 -0.082 5.526 -6.086 1.00 0.26 O ATOM 401 CB LEU A 115 -1.929 2.970 -5.284 1.00 0.26 C ATOM 402 CG LEU A 115 -3.354 2.467 -5.522 1.00 0.25 C ATOM 403 CD1 LEU A 115 -3.862 1.752 -4.268 1.00 0.32 C ATOM 404 CD2 LEU A 115 -4.265 3.658 -5.830 1.00 0.23 C ATOM 0 H LEU A 115 -1.126 1.493 -7.026 1.00 0.26 H new ATOM 0 HA LEU A 115 -2.082 4.271 -7.017 1.00 0.25 H new ATOM 0 HB2 LEU A 115 -1.294 2.150 -4.948 1.00 0.26 H new ATOM 0 HB3 LEU A 115 -1.924 3.721 -4.494 1.00 0.26 H new ATOM 0 HG LEU A 115 -3.359 1.773 -6.362 1.00 0.25 H new ATOM 0 HD11 LEU A 115 -4.877 1.394 -4.439 1.00 0.32 H new ATOM 0 HD12 LEU A 115 -3.212 0.906 -4.043 1.00 0.32 H new ATOM 0 HD13 LEU A 115 -3.859 2.446 -3.427 1.00 0.32 H new ATOM 0 HD21 LEU A 115 -5.282 3.304 -6.000 1.00 0.23 H new ATOM 0 HD22 LEU A 115 -4.258 4.349 -4.987 1.00 0.23 H new ATOM 0 HD23 LEU A 115 -3.905 4.170 -6.722 1.00 0.23 H new ATOM 416 N ALA A 116 1.049 3.651 -6.378 1.00 0.26 N ATOM 417 CA ALA A 116 2.362 4.332 -6.150 1.00 0.28 C ATOM 418 C ALA A 116 2.540 5.431 -7.198 1.00 0.26 C ATOM 419 O ALA A 116 2.848 6.571 -6.883 1.00 0.27 O ATOM 420 CB ALA A 116 3.424 3.239 -6.325 1.00 0.31 C ATOM 0 H ALA A 116 1.110 2.651 -6.571 1.00 0.26 H new ATOM 0 HA ALA A 116 2.433 4.796 -5.166 1.00 0.28 H new ATOM 0 HB1 ALA A 116 4.415 3.667 -6.172 1.00 0.31 H new ATOM 0 HB2 ALA A 116 3.254 2.447 -5.596 1.00 0.31 H new ATOM 0 HB3 ALA A 116 3.359 2.826 -7.332 1.00 0.31 H new ATOM 426 N ARG A 117 2.312 5.101 -8.449 1.00 0.27 N ATOM 427 CA ARG A 117 2.430 6.130 -9.526 1.00 0.30 C ATOM 428 C ARG A 117 1.430 7.256 -9.238 1.00 0.32 C ATOM 429 O ARG A 117 1.734 8.426 -9.371 1.00 0.33 O ATOM 430 CB ARG A 117 2.059 5.407 -10.820 1.00 0.35 C ATOM 431 CG ARG A 117 3.159 4.408 -11.180 1.00 0.37 C ATOM 432 CD ARG A 117 2.783 3.687 -12.476 1.00 1.31 C ATOM 433 NE ARG A 117 3.872 2.698 -12.697 1.00 1.53 N ATOM 434 CZ ARG A 117 4.210 2.363 -13.912 1.00 1.93 C ATOM 435 NH1 ARG A 117 3.453 1.555 -14.602 1.00 2.24 N ATOM 436 NH2 ARG A 117 5.305 2.839 -14.438 1.00 2.61 N ATOM 0 H ARG A 117 2.051 4.168 -8.767 1.00 0.27 H new ATOM 0 HA ARG A 117 3.426 6.567 -9.589 1.00 0.30 H new ATOM 0 HB2 ARG A 117 1.108 4.889 -10.699 1.00 0.35 H new ATOM 0 HB3 ARG A 117 1.929 6.128 -11.627 1.00 0.35 H new ATOM 0 HG2 ARG A 117 4.111 4.925 -11.301 1.00 0.37 H new ATOM 0 HG3 ARG A 117 3.289 3.686 -10.373 1.00 0.37 H new ATOM 0 HD2 ARG A 117 1.815 3.194 -12.387 1.00 1.31 H new ATOM 0 HD3 ARG A 117 2.710 4.386 -13.309 1.00 1.31 H new ATOM 0 HE ARG A 117 4.354 2.282 -11.900 1.00 1.53 H new ATOM 0 HH11 ARG A 117 2.596 1.184 -14.192 1.00 2.24 H new ATOM 0 HH12 ARG A 117 3.718 1.294 -15.552 1.00 2.24 H new ATOM 0 HH21 ARG A 117 5.896 3.472 -13.900 1.00 2.61 H new ATOM 0 HH22 ARG A 117 5.570 2.578 -15.388 1.00 2.61 H new ATOM 450 N GLU A 118 0.243 6.893 -8.809 1.00 0.34 N ATOM 451 CA GLU A 118 -0.784 7.923 -8.465 1.00 0.39 C ATOM 452 C GLU A 118 -0.287 8.754 -7.278 1.00 0.39 C ATOM 453 O GLU A 118 -0.470 9.955 -7.224 1.00 0.41 O ATOM 454 CB GLU A 118 -2.043 7.136 -8.095 1.00 0.43 C ATOM 455 CG GLU A 118 -2.634 6.491 -9.355 1.00 0.47 C ATOM 456 CD GLU A 118 -3.462 7.519 -10.145 1.00 0.53 C ATOM 457 OE1 GLU A 118 -3.586 8.647 -9.689 1.00 1.45 O ATOM 458 OE2 GLU A 118 -3.959 7.158 -11.199 1.00 0.76 O ATOM 0 H GLU A 118 -0.057 5.926 -8.683 1.00 0.34 H new ATOM 0 HA GLU A 118 -0.981 8.613 -9.286 1.00 0.39 H new ATOM 0 HB2 GLU A 118 -1.801 6.368 -7.360 1.00 0.43 H new ATOM 0 HB3 GLU A 118 -2.776 7.798 -7.635 1.00 0.43 H new ATOM 0 HG2 GLU A 118 -1.832 6.101 -9.982 1.00 0.47 H new ATOM 0 HG3 GLU A 118 -3.262 5.644 -9.078 1.00 0.47 H new ATOM 465 N LEU A 119 0.356 8.111 -6.334 1.00 0.37 N ATOM 466 CA LEU A 119 0.897 8.844 -5.145 1.00 0.38 C ATOM 467 C LEU A 119 2.159 9.636 -5.525 1.00 0.36 C ATOM 468 O LEU A 119 2.706 10.357 -4.715 1.00 0.39 O ATOM 469 CB LEU A 119 1.213 7.755 -4.123 1.00 0.38 C ATOM 470 CG LEU A 119 -0.102 7.165 -3.606 1.00 0.56 C ATOM 471 CD1 LEU A 119 0.167 5.847 -2.882 1.00 1.33 C ATOM 472 CD2 LEU A 119 -0.750 8.153 -2.632 1.00 0.58 C ATOM 0 H LEU A 119 0.530 7.106 -6.335 1.00 0.37 H new ATOM 0 HA LEU A 119 0.190 9.574 -4.751 1.00 0.38 H new ATOM 0 HB2 LEU A 119 1.823 6.975 -4.579 1.00 0.38 H new ATOM 0 HB3 LEU A 119 1.791 8.169 -3.297 1.00 0.38 H new ATOM 0 HG LEU A 119 -0.769 6.982 -4.448 1.00 0.56 H new ATOM 0 HD11 LEU A 119 -0.773 5.434 -2.517 1.00 1.33 H new ATOM 0 HD12 LEU A 119 0.630 5.141 -3.571 1.00 1.33 H new ATOM 0 HD13 LEU A 119 0.836 6.024 -2.040 1.00 1.33 H new ATOM 0 HD21 LEU A 119 -1.687 7.737 -2.261 1.00 0.58 H new ATOM 0 HD22 LEU A 119 -0.076 8.333 -1.794 1.00 0.58 H new ATOM 0 HD23 LEU A 119 -0.949 9.093 -3.146 1.00 0.58 H new ATOM 484 N LYS A 120 2.620 9.514 -6.756 1.00 0.34 N ATOM 485 CA LYS A 120 3.834 10.265 -7.209 1.00 0.35 C ATOM 486 C LYS A 120 5.043 9.906 -6.354 1.00 0.30 C ATOM 487 O LYS A 120 5.739 10.768 -5.847 1.00 0.33 O ATOM 488 CB LYS A 120 3.494 11.756 -7.091 1.00 0.48 C ATOM 489 CG LYS A 120 2.339 12.087 -8.039 1.00 1.05 C ATOM 490 CD LYS A 120 1.996 13.572 -7.927 1.00 1.11 C ATOM 491 CE LYS A 120 0.842 13.903 -8.876 1.00 2.02 C ATOM 492 NZ LYS A 120 0.535 15.338 -8.621 1.00 2.16 N ATOM 0 H LYS A 120 2.198 8.919 -7.469 1.00 0.34 H new ATOM 0 HA LYS A 120 4.095 10.008 -8.236 1.00 0.35 H new ATOM 0 HB2 LYS A 120 3.218 11.998 -6.065 1.00 0.48 H new ATOM 0 HB3 LYS A 120 4.367 12.361 -7.337 1.00 0.48 H new ATOM 0 HG2 LYS A 120 2.615 11.843 -9.065 1.00 1.05 H new ATOM 0 HG3 LYS A 120 1.467 11.482 -7.792 1.00 1.05 H new ATOM 0 HD2 LYS A 120 1.719 13.816 -6.901 1.00 1.11 H new ATOM 0 HD3 LYS A 120 2.868 14.177 -8.174 1.00 1.11 H new ATOM 0 HE2 LYS A 120 1.126 13.738 -9.915 1.00 2.02 H new ATOM 0 HE3 LYS A 120 -0.025 13.272 -8.679 1.00 2.02 H new ATOM 0 HZ1 LYS A 120 -0.248 15.640 -9.236 1.00 2.16 H new ATOM 0 HZ2 LYS A 120 0.262 15.463 -7.625 1.00 2.16 H new ATOM 0 HZ3 LYS A 120 1.377 15.914 -8.824 1.00 2.16 H new ATOM 506 N VAL A 121 5.305 8.637 -6.207 1.00 0.29 N ATOM 507 CA VAL A 121 6.485 8.202 -5.401 1.00 0.33 C ATOM 508 C VAL A 121 7.770 8.532 -6.167 1.00 0.37 C ATOM 509 O VAL A 121 7.758 8.668 -7.377 1.00 0.42 O ATOM 510 CB VAL A 121 6.333 6.687 -5.221 1.00 0.36 C ATOM 511 CG1 VAL A 121 5.064 6.394 -4.421 1.00 1.65 C ATOM 512 CG2 VAL A 121 6.243 5.996 -6.588 1.00 1.29 C ATOM 0 H VAL A 121 4.753 7.880 -6.610 1.00 0.29 H new ATOM 0 HA VAL A 121 6.538 8.706 -4.436 1.00 0.33 H new ATOM 0 HB VAL A 121 7.203 6.306 -4.687 1.00 0.36 H new ATOM 0 HG11 VAL A 121 4.955 5.317 -4.293 1.00 1.65 H new ATOM 0 HG12 VAL A 121 5.132 6.871 -3.443 1.00 1.65 H new ATOM 0 HG13 VAL A 121 4.198 6.785 -4.956 1.00 1.65 H new ATOM 0 HG21 VAL A 121 6.135 4.921 -6.446 1.00 1.29 H new ATOM 0 HG22 VAL A 121 5.380 6.378 -7.133 1.00 1.29 H new ATOM 0 HG23 VAL A 121 7.150 6.198 -7.158 1.00 1.29 H new ATOM 522 N SER A 122 8.873 8.682 -5.474 1.00 0.45 N ATOM 523 CA SER A 122 10.161 9.029 -6.162 1.00 0.52 C ATOM 524 C SER A 122 10.463 8.037 -7.288 1.00 0.44 C ATOM 525 O SER A 122 10.562 6.844 -7.072 1.00 0.35 O ATOM 526 CB SER A 122 11.231 8.936 -5.074 1.00 0.63 C ATOM 527 OG SER A 122 12.466 9.417 -5.588 1.00 1.10 O ATOM 0 H SER A 122 8.939 8.580 -4.461 1.00 0.45 H new ATOM 0 HA SER A 122 10.120 10.018 -6.619 1.00 0.52 H new ATOM 0 HB2 SER A 122 10.933 9.521 -4.204 1.00 0.63 H new ATOM 0 HB3 SER A 122 11.340 7.904 -4.742 1.00 0.63 H new ATOM 0 HG SER A 122 13.154 9.360 -4.892 1.00 1.10 H new ATOM 533 N GLU A 123 10.612 8.536 -8.490 1.00 0.55 N ATOM 534 CA GLU A 123 10.913 7.642 -9.649 1.00 0.58 C ATOM 535 C GLU A 123 12.228 6.895 -9.410 1.00 0.52 C ATOM 536 O GLU A 123 12.442 5.822 -9.942 1.00 0.53 O ATOM 537 CB GLU A 123 11.021 8.567 -10.870 1.00 0.77 C ATOM 538 CG GLU A 123 12.093 9.640 -10.629 1.00 1.44 C ATOM 539 CD GLU A 123 13.307 9.371 -11.521 1.00 1.61 C ATOM 540 OE1 GLU A 123 13.115 9.196 -12.713 1.00 1.75 O ATOM 541 OE2 GLU A 123 14.409 9.351 -10.998 1.00 2.15 O ATOM 0 H GLU A 123 10.538 9.527 -8.718 1.00 0.55 H new ATOM 0 HA GLU A 123 10.141 6.886 -9.794 1.00 0.58 H new ATOM 0 HB2 GLU A 123 11.272 7.984 -11.756 1.00 0.77 H new ATOM 0 HB3 GLU A 123 10.059 9.041 -11.063 1.00 0.77 H new ATOM 0 HG2 GLU A 123 11.686 10.628 -10.842 1.00 1.44 H new ATOM 0 HG3 GLU A 123 12.393 9.638 -9.581 1.00 1.44 H new ATOM 548 N ALA A 124 13.107 7.450 -8.608 1.00 0.50 N ATOM 549 CA ALA A 124 14.409 6.759 -8.329 1.00 0.50 C ATOM 550 C ALA A 124 14.149 5.375 -7.724 1.00 0.39 C ATOM 551 O ALA A 124 14.525 4.357 -8.280 1.00 0.45 O ATOM 552 CB ALA A 124 15.132 7.652 -7.318 1.00 0.56 C ATOM 0 H ALA A 124 12.981 8.346 -8.137 1.00 0.50 H new ATOM 0 HA ALA A 124 14.998 6.612 -9.235 1.00 0.50 H new ATOM 0 HB1 ALA A 124 16.096 7.209 -7.065 1.00 0.56 H new ATOM 0 HB2 ALA A 124 15.289 8.640 -7.752 1.00 0.56 H new ATOM 0 HB3 ALA A 124 14.527 7.744 -6.416 1.00 0.56 H new ATOM 558 N LYS A 125 13.485 5.338 -6.599 1.00 0.31 N ATOM 559 CA LYS A 125 13.166 4.031 -5.947 1.00 0.34 C ATOM 560 C LYS A 125 12.268 3.210 -6.870 1.00 0.34 C ATOM 561 O LYS A 125 12.422 2.012 -7.008 1.00 0.39 O ATOM 562 CB LYS A 125 12.427 4.396 -4.663 1.00 0.42 C ATOM 563 CG LYS A 125 13.398 5.084 -3.703 1.00 0.54 C ATOM 564 CD LYS A 125 12.669 5.457 -2.412 1.00 0.75 C ATOM 565 CE LYS A 125 13.647 6.147 -1.455 1.00 0.75 C ATOM 566 NZ LYS A 125 12.898 7.316 -0.911 1.00 1.56 N ATOM 0 H LYS A 125 13.147 6.161 -6.100 1.00 0.31 H new ATOM 0 HA LYS A 125 14.055 3.435 -5.741 1.00 0.34 H new ATOM 0 HB2 LYS A 125 11.589 5.056 -4.887 1.00 0.42 H new ATOM 0 HB3 LYS A 125 12.013 3.500 -4.200 1.00 0.42 H new ATOM 0 HG2 LYS A 125 14.235 4.422 -3.481 1.00 0.54 H new ATOM 0 HG3 LYS A 125 13.813 5.978 -4.169 1.00 0.54 H new ATOM 0 HD2 LYS A 125 11.831 6.119 -2.633 1.00 0.75 H new ATOM 0 HD3 LYS A 125 12.255 4.564 -1.944 1.00 0.75 H new ATOM 0 HE2 LYS A 125 13.960 5.473 -0.657 1.00 0.75 H new ATOM 0 HE3 LYS A 125 14.550 6.465 -1.976 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 13.556 7.948 -0.412 1.00 1.56 H new ATOM 0 HZ2 LYS A 125 12.447 7.833 -1.692 1.00 1.56 H new ATOM 0 HZ3 LYS A 125 12.168 6.983 -0.249 1.00 1.56 H new ATOM 580 N MET A 126 11.333 3.864 -7.511 1.00 0.42 N ATOM 581 CA MET A 126 10.412 3.153 -8.448 1.00 0.56 C ATOM 582 C MET A 126 11.238 2.504 -9.565 1.00 0.57 C ATOM 583 O MET A 126 10.961 1.401 -10.001 1.00 0.66 O ATOM 584 CB MET A 126 9.471 4.241 -8.989 1.00 0.70 C ATOM 585 CG MET A 126 8.287 3.605 -9.731 1.00 1.10 C ATOM 586 SD MET A 126 7.247 2.700 -8.556 1.00 1.90 S ATOM 587 CE MET A 126 5.646 3.107 -9.303 1.00 2.03 C ATOM 0 H MET A 126 11.167 4.867 -7.425 1.00 0.42 H new ATOM 0 HA MET A 126 9.842 2.355 -7.972 1.00 0.56 H new ATOM 0 HB2 MET A 126 9.105 4.856 -8.167 1.00 0.70 H new ATOM 0 HB3 MET A 126 10.018 4.902 -9.662 1.00 0.70 H new ATOM 0 HG2 MET A 126 7.701 4.377 -10.231 1.00 1.10 H new ATOM 0 HG3 MET A 126 8.651 2.929 -10.505 1.00 1.10 H new ATOM 0 HE1 MET A 126 4.909 2.357 -9.015 1.00 2.03 H new ATOM 0 HE2 MET A 126 5.321 4.088 -8.955 1.00 2.03 H new ATOM 0 HE3 MET A 126 5.744 3.121 -10.388 1.00 2.03 H new ATOM 597 N ASP A 127 12.256 3.184 -10.024 1.00 0.55 N ATOM 598 CA ASP A 127 13.124 2.611 -11.099 1.00 0.62 C ATOM 599 C ASP A 127 13.809 1.320 -10.615 1.00 0.54 C ATOM 600 O ASP A 127 13.925 0.361 -11.355 1.00 0.59 O ATOM 601 CB ASP A 127 14.172 3.686 -11.395 1.00 0.71 C ATOM 602 CG ASP A 127 15.027 3.271 -12.602 1.00 1.04 C ATOM 603 OD1 ASP A 127 15.073 2.088 -12.907 1.00 1.71 O ATOM 604 OD2 ASP A 127 15.618 4.149 -13.208 1.00 1.60 O ATOM 0 H ASP A 127 12.525 4.113 -9.701 1.00 0.55 H new ATOM 0 HA ASP A 127 12.544 2.350 -11.985 1.00 0.62 H new ATOM 0 HB2 ASP A 127 13.681 4.638 -11.597 1.00 0.71 H new ATOM 0 HB3 ASP A 127 14.808 3.835 -10.523 1.00 0.71 H new ATOM 609 N GLY A 128 14.271 1.295 -9.383 1.00 0.46 N ATOM 610 CA GLY A 128 14.962 0.069 -8.861 1.00 0.46 C ATOM 611 C GLY A 128 13.974 -1.063 -8.569 1.00 0.48 C ATOM 612 O GLY A 128 14.197 -2.193 -8.953 1.00 0.51 O ATOM 0 H GLY A 128 14.200 2.067 -8.720 1.00 0.46 H new ATOM 0 HA2 GLY A 128 15.698 -0.271 -9.590 1.00 0.46 H new ATOM 0 HA3 GLY A 128 15.507 0.319 -7.951 1.00 0.46 H new ATOM 616 N ILE A 129 12.893 -0.777 -7.892 1.00 0.54 N ATOM 617 CA ILE A 129 11.898 -1.856 -7.570 1.00 0.68 C ATOM 618 C ILE A 129 11.362 -2.474 -8.866 1.00 0.68 C ATOM 619 O ILE A 129 11.229 -3.674 -8.977 1.00 0.72 O ATOM 620 CB ILE A 129 10.790 -1.126 -6.784 1.00 0.86 C ATOM 621 CG1 ILE A 129 9.713 -2.115 -6.292 1.00 1.04 C ATOM 622 CG2 ILE A 129 10.155 -0.012 -7.617 1.00 1.77 C ATOM 623 CD1 ILE A 129 8.790 -2.605 -7.431 1.00 2.01 C ATOM 0 H ILE A 129 12.652 0.152 -7.547 1.00 0.54 H new ATOM 0 HA ILE A 129 12.322 -2.679 -6.995 1.00 0.68 H new ATOM 0 HB ILE A 129 11.258 -0.669 -5.912 1.00 0.86 H new ATOM 0 HG12 ILE A 129 10.198 -2.974 -5.828 1.00 1.04 H new ATOM 0 HG13 ILE A 129 9.110 -1.635 -5.521 1.00 1.04 H new ATOM 0 HG21 ILE A 129 9.378 0.482 -7.033 1.00 1.77 H new ATOM 0 HG22 ILE A 129 10.918 0.715 -7.894 1.00 1.77 H new ATOM 0 HG23 ILE A 129 9.715 -0.438 -8.519 1.00 1.77 H new ATOM 0 HD11 ILE A 129 8.052 -3.298 -7.028 1.00 2.01 H new ATOM 0 HD12 ILE A 129 8.280 -1.752 -7.879 1.00 2.01 H new ATOM 0 HD13 ILE A 129 9.386 -3.111 -8.190 1.00 2.01 H new ATOM 635 N GLU A 130 11.051 -1.664 -9.838 1.00 0.70 N ATOM 636 CA GLU A 130 10.512 -2.201 -11.128 1.00 0.77 C ATOM 637 C GLU A 130 11.528 -3.102 -11.855 1.00 0.65 C ATOM 638 O GLU A 130 11.218 -4.218 -12.226 1.00 0.68 O ATOM 639 CB GLU A 130 10.187 -0.965 -11.970 1.00 0.85 C ATOM 640 CG GLU A 130 9.438 -1.391 -13.239 1.00 1.41 C ATOM 641 CD GLU A 130 9.030 -0.158 -14.060 1.00 1.66 C ATOM 642 OE1 GLU A 130 9.162 0.948 -13.558 1.00 2.14 O ATOM 643 OE2 GLU A 130 8.587 -0.344 -15.182 1.00 2.01 O ATOM 0 H GLU A 130 11.145 -0.649 -9.799 1.00 0.70 H new ATOM 0 HA GLU A 130 9.639 -2.830 -10.954 1.00 0.77 H new ATOM 0 HB2 GLU A 130 9.579 -0.269 -11.393 1.00 0.85 H new ATOM 0 HB3 GLU A 130 11.105 -0.441 -12.236 1.00 0.85 H new ATOM 0 HG2 GLU A 130 10.071 -2.043 -13.841 1.00 1.41 H new ATOM 0 HG3 GLU A 130 8.552 -1.966 -12.970 1.00 1.41 H new ATOM 650 N GLU A 131 12.725 -2.615 -12.091 1.00 0.59 N ATOM 651 CA GLU A 131 13.743 -3.435 -12.834 1.00 0.55 C ATOM 652 C GLU A 131 14.260 -4.639 -12.032 1.00 0.47 C ATOM 653 O GLU A 131 14.443 -5.711 -12.579 1.00 0.45 O ATOM 654 CB GLU A 131 14.896 -2.474 -13.137 1.00 0.63 C ATOM 655 CG GLU A 131 14.453 -1.456 -14.194 1.00 1.38 C ATOM 656 CD GLU A 131 15.606 -0.494 -14.506 1.00 1.89 C ATOM 657 OE1 GLU A 131 16.749 -0.884 -14.324 1.00 2.50 O ATOM 658 OE2 GLU A 131 15.325 0.612 -14.935 1.00 2.30 O ATOM 0 H GLU A 131 13.042 -1.689 -11.803 1.00 0.59 H new ATOM 0 HA GLU A 131 13.291 -3.861 -13.730 1.00 0.55 H new ATOM 0 HB2 GLU A 131 15.202 -1.958 -12.227 1.00 0.63 H new ATOM 0 HB3 GLU A 131 15.762 -3.031 -13.494 1.00 0.63 H new ATOM 0 HG2 GLU A 131 14.143 -1.973 -15.102 1.00 1.38 H new ATOM 0 HG3 GLU A 131 13.589 -0.898 -13.834 1.00 1.38 H new ATOM 665 N LYS A 132 14.527 -4.471 -10.765 1.00 0.51 N ATOM 666 CA LYS A 132 15.073 -5.611 -9.957 1.00 0.53 C ATOM 667 C LYS A 132 13.997 -6.632 -9.574 1.00 0.54 C ATOM 668 O LYS A 132 14.314 -7.705 -9.092 1.00 0.63 O ATOM 669 CB LYS A 132 15.666 -4.972 -8.700 1.00 0.68 C ATOM 670 CG LYS A 132 17.071 -4.445 -9.006 1.00 1.39 C ATOM 671 CD LYS A 132 16.986 -3.024 -9.566 1.00 1.91 C ATOM 672 CE LYS A 132 18.397 -2.509 -9.867 1.00 2.62 C ATOM 673 NZ LYS A 132 19.054 -2.367 -8.536 1.00 2.69 N ATOM 0 H LYS A 132 14.393 -3.600 -10.252 1.00 0.51 H new ATOM 0 HA LYS A 132 15.810 -6.166 -10.536 1.00 0.53 H new ATOM 0 HB2 LYS A 132 15.028 -4.157 -8.358 1.00 0.68 H new ATOM 0 HB3 LYS A 132 15.709 -5.704 -7.893 1.00 0.68 H new ATOM 0 HG2 LYS A 132 17.676 -4.452 -8.100 1.00 1.39 H new ATOM 0 HG3 LYS A 132 17.565 -5.099 -9.724 1.00 1.39 H new ATOM 0 HD2 LYS A 132 16.383 -3.015 -10.474 1.00 1.91 H new ATOM 0 HD3 LYS A 132 16.493 -2.368 -8.849 1.00 1.91 H new ATOM 0 HE2 LYS A 132 18.943 -3.206 -10.503 1.00 2.62 H new ATOM 0 HE3 LYS A 132 18.364 -1.555 -10.394 1.00 2.62 H new ATOM 0 HZ1 LYS A 132 19.528 -1.443 -8.480 1.00 2.69 H new ATOM 0 HZ2 LYS A 132 18.337 -2.434 -7.786 1.00 2.69 H new ATOM 0 HZ3 LYS A 132 19.756 -3.124 -8.413 1.00 2.69 H new ATOM 687 N TYR A 133 12.739 -6.313 -9.744 1.00 0.55 N ATOM 688 CA TYR A 133 11.672 -7.275 -9.342 1.00 0.65 C ATOM 689 C TYR A 133 10.653 -7.496 -10.467 1.00 0.54 C ATOM 690 O TYR A 133 9.666 -6.790 -10.542 1.00 0.66 O ATOM 691 CB TYR A 133 11.004 -6.620 -8.136 1.00 0.89 C ATOM 692 CG TYR A 133 12.026 -6.374 -7.041 1.00 1.14 C ATOM 693 CD1 TYR A 133 12.917 -7.390 -6.661 1.00 2.20 C ATOM 694 CD2 TYR A 133 12.075 -5.130 -6.403 1.00 0.98 C ATOM 695 CE1 TYR A 133 13.852 -7.159 -5.646 1.00 2.44 C ATOM 696 CE2 TYR A 133 13.013 -4.899 -5.389 1.00 1.14 C ATOM 697 CZ TYR A 133 13.901 -5.913 -5.011 1.00 1.67 C ATOM 698 OH TYR A 133 14.823 -5.684 -4.010 1.00 1.95 O ATOM 0 H TYR A 133 12.407 -5.434 -10.141 1.00 0.55 H new ATOM 0 HA TYR A 133 12.082 -8.260 -9.117 1.00 0.65 H new ATOM 0 HB2 TYR A 133 10.544 -5.677 -8.433 1.00 0.89 H new ATOM 0 HB3 TYR A 133 10.205 -7.260 -7.761 1.00 0.89 H new ATOM 0 HD1 TYR A 133 12.881 -8.351 -7.153 1.00 2.20 H new ATOM 0 HD2 TYR A 133 11.389 -4.347 -6.692 1.00 0.98 H new ATOM 0 HE1 TYR A 133 14.536 -7.942 -5.353 1.00 2.44 H new ATOM 0 HE2 TYR A 133 13.051 -3.938 -4.898 1.00 1.14 H new ATOM 0 HH TYR A 133 14.723 -4.768 -3.676 1.00 1.95 H new ATOM 708 N PRO A 134 10.910 -8.476 -11.306 1.00 0.51 N ATOM 709 CA PRO A 134 9.975 -8.768 -12.415 1.00 0.53 C ATOM 710 C PRO A 134 8.718 -9.469 -11.884 1.00 0.47 C ATOM 711 O PRO A 134 7.634 -9.281 -12.406 1.00 0.54 O ATOM 712 CB PRO A 134 10.769 -9.699 -13.325 1.00 0.70 C ATOM 713 CG PRO A 134 11.780 -10.348 -12.435 1.00 0.76 C ATOM 714 CD PRO A 134 12.068 -9.387 -11.310 1.00 0.66 C ATOM 0 HA PRO A 134 9.631 -7.871 -12.929 1.00 0.53 H new ATOM 0 HB2 PRO A 134 10.121 -10.441 -13.791 1.00 0.70 H new ATOM 0 HB3 PRO A 134 11.251 -9.145 -14.131 1.00 0.70 H new ATOM 0 HG2 PRO A 134 11.400 -11.293 -12.046 1.00 0.76 H new ATOM 0 HG3 PRO A 134 12.691 -10.575 -12.989 1.00 0.76 H new ATOM 0 HD2 PRO A 134 12.168 -9.908 -10.358 1.00 0.66 H new ATOM 0 HD3 PRO A 134 12.999 -8.846 -11.477 1.00 0.66 H new ATOM 722 N ARG A 135 8.850 -10.281 -10.857 1.00 0.43 N ATOM 723 CA ARG A 135 7.648 -10.990 -10.314 1.00 0.48 C ATOM 724 C ARG A 135 7.793 -11.281 -8.810 1.00 0.43 C ATOM 725 O ARG A 135 8.034 -12.404 -8.407 1.00 0.60 O ATOM 726 CB ARG A 135 7.579 -12.294 -11.106 1.00 0.70 C ATOM 727 CG ARG A 135 6.237 -12.978 -10.843 1.00 0.91 C ATOM 728 CD ARG A 135 5.151 -12.293 -11.676 1.00 1.17 C ATOM 729 NE ARG A 135 3.866 -12.840 -11.160 1.00 1.44 N ATOM 730 CZ ARG A 135 2.965 -13.283 -11.993 1.00 2.17 C ATOM 731 NH1 ARG A 135 3.296 -14.145 -12.915 1.00 3.07 N ATOM 732 NH2 ARG A 135 1.732 -12.863 -11.906 1.00 2.61 N ATOM 0 H ARG A 135 9.728 -10.480 -10.378 1.00 0.43 H new ATOM 0 HA ARG A 135 6.746 -10.387 -10.416 1.00 0.48 H new ATOM 0 HB2 ARG A 135 7.694 -12.092 -12.171 1.00 0.70 H new ATOM 0 HB3 ARG A 135 8.398 -12.952 -10.816 1.00 0.70 H new ATOM 0 HG2 ARG A 135 6.297 -14.035 -11.101 1.00 0.91 H new ATOM 0 HG3 ARG A 135 5.988 -12.922 -9.783 1.00 0.91 H new ATOM 0 HD2 ARG A 135 5.192 -11.210 -11.564 1.00 1.17 H new ATOM 0 HD3 ARG A 135 5.273 -12.508 -12.738 1.00 1.17 H new ATOM 0 HE ARG A 135 3.690 -12.868 -10.156 1.00 1.44 H new ATOM 0 HH11 ARG A 135 4.259 -14.473 -12.985 1.00 3.07 H new ATOM 0 HH12 ARG A 135 2.591 -14.491 -13.566 1.00 3.07 H new ATOM 0 HH21 ARG A 135 1.473 -12.188 -11.186 1.00 2.61 H new ATOM 0 HH22 ARG A 135 1.028 -13.210 -12.558 1.00 2.61 H new ATOM 746 N SER A 136 7.621 -10.282 -7.983 1.00 0.51 N ATOM 747 CA SER A 136 7.712 -10.487 -6.502 1.00 0.44 C ATOM 748 C SER A 136 6.855 -9.445 -5.791 1.00 0.33 C ATOM 749 O SER A 136 7.206 -8.285 -5.698 1.00 0.30 O ATOM 750 CB SER A 136 9.189 -10.340 -6.152 1.00 0.50 C ATOM 751 OG SER A 136 9.726 -9.231 -6.848 1.00 0.90 O ATOM 0 H SER A 136 7.420 -9.324 -8.271 1.00 0.51 H new ATOM 0 HA SER A 136 7.343 -11.464 -6.190 1.00 0.44 H new ATOM 0 HB2 SER A 136 9.308 -10.202 -5.077 1.00 0.50 H new ATOM 0 HB3 SER A 136 9.730 -11.248 -6.419 1.00 0.50 H new ATOM 0 HG SER A 136 10.702 -9.234 -6.764 1.00 0.90 H new ATOM 757 N LEU A 137 5.722 -9.865 -5.308 1.00 0.31 N ATOM 758 CA LEU A 137 4.789 -8.929 -4.612 1.00 0.24 C ATOM 759 C LEU A 137 5.448 -8.331 -3.363 1.00 0.20 C ATOM 760 O LEU A 137 5.276 -7.166 -3.057 1.00 0.21 O ATOM 761 CB LEU A 137 3.594 -9.814 -4.222 1.00 0.23 C ATOM 762 CG LEU A 137 2.388 -8.959 -3.832 1.00 0.21 C ATOM 763 CD1 LEU A 137 1.973 -8.065 -5.009 1.00 0.23 C ATOM 764 CD2 LEU A 137 1.232 -9.896 -3.473 1.00 0.27 C ATOM 0 H LEU A 137 5.395 -10.830 -5.365 1.00 0.31 H new ATOM 0 HA LEU A 137 4.501 -8.084 -5.238 1.00 0.24 H new ATOM 0 HB2 LEU A 137 3.330 -10.464 -5.056 1.00 0.23 H new ATOM 0 HB3 LEU A 137 3.871 -10.461 -3.389 1.00 0.23 H new ATOM 0 HG LEU A 137 2.643 -8.324 -2.983 1.00 0.21 H new ATOM 0 HD11 LEU A 137 1.113 -7.460 -4.721 1.00 0.23 H new ATOM 0 HD12 LEU A 137 2.802 -7.411 -5.280 1.00 0.23 H new ATOM 0 HD13 LEU A 137 1.708 -8.688 -5.863 1.00 0.23 H new ATOM 0 HD21 LEU A 137 0.360 -9.306 -3.191 1.00 0.27 H new ATOM 0 HD22 LEU A 137 0.987 -10.518 -4.334 1.00 0.27 H new ATOM 0 HD23 LEU A 137 1.525 -10.532 -2.638 1.00 0.27 H new ATOM 776 N SER A 138 6.182 -9.129 -2.636 1.00 0.24 N ATOM 777 CA SER A 138 6.839 -8.630 -1.378 1.00 0.26 C ATOM 778 C SER A 138 7.800 -7.452 -1.637 1.00 0.20 C ATOM 779 O SER A 138 7.533 -6.329 -1.251 1.00 0.22 O ATOM 780 CB SER A 138 7.597 -9.843 -0.839 1.00 0.38 C ATOM 781 OG SER A 138 8.595 -9.416 0.080 1.00 1.01 O ATOM 0 H SER A 138 6.360 -10.109 -2.854 1.00 0.24 H new ATOM 0 HA SER A 138 6.103 -8.240 -0.675 1.00 0.26 H new ATOM 0 HB2 SER A 138 6.905 -10.527 -0.347 1.00 0.38 H new ATOM 0 HB3 SER A 138 8.057 -10.391 -1.661 1.00 0.38 H new ATOM 0 HG SER A 138 9.078 -10.196 0.425 1.00 1.01 H new ATOM 787 N GLU A 139 8.925 -7.706 -2.257 1.00 0.24 N ATOM 788 CA GLU A 139 9.927 -6.607 -2.510 1.00 0.25 C ATOM 789 C GLU A 139 9.379 -5.498 -3.403 1.00 0.21 C ATOM 790 O GLU A 139 9.873 -4.385 -3.366 1.00 0.21 O ATOM 791 CB GLU A 139 11.141 -7.248 -3.206 1.00 0.39 C ATOM 792 CG GLU A 139 10.709 -8.129 -4.391 1.00 1.09 C ATOM 793 CD GLU A 139 11.569 -9.395 -4.423 1.00 2.02 C ATOM 794 OE1 GLU A 139 11.853 -9.921 -3.359 1.00 2.92 O ATOM 795 OE2 GLU A 139 11.932 -9.816 -5.509 1.00 2.24 O ATOM 0 H GLU A 139 9.200 -8.626 -2.602 1.00 0.24 H new ATOM 0 HA GLU A 139 10.185 -6.148 -1.555 1.00 0.25 H new ATOM 0 HB2 GLU A 139 11.815 -6.467 -3.558 1.00 0.39 H new ATOM 0 HB3 GLU A 139 11.698 -7.849 -2.488 1.00 0.39 H new ATOM 0 HG2 GLU A 139 9.656 -8.394 -4.297 1.00 1.09 H new ATOM 0 HG3 GLU A 139 10.817 -7.579 -5.326 1.00 1.09 H new ATOM 802 N ARG A 140 8.401 -5.776 -4.224 1.00 0.26 N ATOM 803 CA ARG A 140 7.892 -4.703 -5.127 1.00 0.33 C ATOM 804 C ARG A 140 7.104 -3.634 -4.364 1.00 0.29 C ATOM 805 O ARG A 140 7.470 -2.475 -4.352 1.00 0.35 O ATOM 806 CB ARG A 140 6.987 -5.412 -6.136 1.00 0.42 C ATOM 807 CG ARG A 140 7.844 -6.029 -7.244 1.00 1.07 C ATOM 808 CD ARG A 140 6.945 -6.750 -8.254 1.00 1.17 C ATOM 809 NE ARG A 140 6.137 -5.675 -8.894 1.00 0.98 N ATOM 810 CZ ARG A 140 6.347 -5.356 -10.143 1.00 1.13 C ATOM 811 NH1 ARG A 140 7.540 -4.999 -10.534 1.00 1.60 N ATOM 812 NH2 ARG A 140 5.365 -5.395 -11.001 1.00 1.55 N ATOM 0 H ARG A 140 7.940 -6.682 -4.308 1.00 0.26 H new ATOM 0 HA ARG A 140 8.719 -4.179 -5.607 1.00 0.33 H new ATOM 0 HB2 ARG A 140 6.405 -6.187 -5.637 1.00 0.42 H new ATOM 0 HB3 ARG A 140 6.276 -4.705 -6.563 1.00 0.42 H new ATOM 0 HG2 ARG A 140 8.420 -5.252 -7.746 1.00 1.07 H new ATOM 0 HG3 ARG A 140 8.560 -6.730 -6.815 1.00 1.07 H new ATOM 0 HD2 ARG A 140 7.537 -7.290 -8.993 1.00 1.17 H new ATOM 0 HD3 ARG A 140 6.306 -7.482 -7.760 1.00 1.17 H new ATOM 0 HE ARG A 140 5.420 -5.188 -8.357 1.00 0.98 H new ATOM 0 HH11 ARG A 140 8.309 -4.969 -9.864 1.00 1.60 H new ATOM 0 HH12 ARG A 140 7.704 -4.750 -11.509 1.00 1.60 H new ATOM 0 HH21 ARG A 140 4.433 -5.675 -10.697 1.00 1.55 H new ATOM 0 HH22 ARG A 140 5.530 -5.146 -11.976 1.00 1.55 H new ATOM 826 N VAL A 141 6.021 -4.009 -3.753 1.00 0.24 N ATOM 827 CA VAL A 141 5.185 -3.011 -3.011 1.00 0.27 C ATOM 828 C VAL A 141 5.879 -2.459 -1.762 1.00 0.25 C ATOM 829 O VAL A 141 5.638 -1.335 -1.366 1.00 0.29 O ATOM 830 CB VAL A 141 3.914 -3.751 -2.633 1.00 0.28 C ATOM 831 CG1 VAL A 141 3.198 -4.186 -3.909 1.00 0.33 C ATOM 832 CG2 VAL A 141 4.243 -4.983 -1.786 1.00 0.23 C ATOM 0 H VAL A 141 5.670 -4.967 -3.731 1.00 0.24 H new ATOM 0 HA VAL A 141 4.994 -2.139 -3.637 1.00 0.27 H new ATOM 0 HB VAL A 141 3.274 -3.089 -2.049 1.00 0.28 H new ATOM 0 HG11 VAL A 141 2.283 -4.719 -3.649 1.00 0.33 H new ATOM 0 HG12 VAL A 141 2.950 -3.307 -4.504 1.00 0.33 H new ATOM 0 HG13 VAL A 141 3.849 -4.843 -4.486 1.00 0.33 H new ATOM 0 HG21 VAL A 141 3.321 -5.501 -1.524 1.00 0.23 H new ATOM 0 HG22 VAL A 141 4.887 -5.654 -2.354 1.00 0.23 H new ATOM 0 HG23 VAL A 141 4.756 -4.672 -0.876 1.00 0.23 H new ATOM 842 N ARG A 142 6.701 -3.242 -1.117 1.00 0.21 N ATOM 843 CA ARG A 142 7.371 -2.766 0.141 1.00 0.22 C ATOM 844 C ARG A 142 8.038 -1.398 -0.049 1.00 0.24 C ATOM 845 O ARG A 142 7.813 -0.487 0.727 1.00 0.25 O ATOM 846 CB ARG A 142 8.427 -3.825 0.459 1.00 0.27 C ATOM 847 CG ARG A 142 7.794 -4.968 1.254 1.00 0.28 C ATOM 848 CD ARG A 142 8.815 -6.097 1.417 1.00 1.02 C ATOM 849 NE ARG A 142 8.402 -6.821 2.650 1.00 0.94 N ATOM 850 CZ ARG A 142 9.268 -7.016 3.610 1.00 1.48 C ATOM 851 NH1 ARG A 142 9.397 -6.133 4.562 1.00 2.24 N ATOM 852 NH2 ARG A 142 10.006 -8.093 3.614 1.00 2.10 N ATOM 0 H ARG A 142 6.941 -4.191 -1.402 1.00 0.21 H new ATOM 0 HA ARG A 142 6.646 -2.641 0.945 1.00 0.22 H new ATOM 0 HB2 ARG A 142 8.860 -4.209 -0.465 1.00 0.27 H new ATOM 0 HB3 ARG A 142 9.241 -3.379 1.031 1.00 0.27 H new ATOM 0 HG2 ARG A 142 7.471 -4.611 2.232 1.00 0.28 H new ATOM 0 HG3 ARG A 142 6.906 -5.336 0.740 1.00 0.28 H new ATOM 0 HD2 ARG A 142 8.811 -6.759 0.551 1.00 1.02 H new ATOM 0 HD3 ARG A 142 9.827 -5.702 1.512 1.00 1.02 H new ATOM 0 HE ARG A 142 7.446 -7.164 2.746 1.00 0.94 H new ATOM 0 HH11 ARG A 142 8.822 -5.290 4.557 1.00 2.24 H new ATOM 0 HH12 ARG A 142 10.073 -6.285 5.311 1.00 2.24 H new ATOM 0 HH21 ARG A 142 9.907 -8.782 2.868 1.00 2.10 H new ATOM 0 HH22 ARG A 142 10.682 -8.245 4.363 1.00 2.10 H new ATOM 866 N GLU A 143 8.847 -1.243 -1.064 1.00 0.26 N ATOM 867 CA GLU A 143 9.518 0.077 -1.290 1.00 0.31 C ATOM 868 C GLU A 143 8.478 1.146 -1.648 1.00 0.30 C ATOM 869 O GLU A 143 8.493 2.249 -1.127 1.00 0.31 O ATOM 870 CB GLU A 143 10.484 -0.159 -2.452 1.00 0.36 C ATOM 871 CG GLU A 143 11.394 1.064 -2.621 1.00 0.44 C ATOM 872 CD GLU A 143 12.523 0.756 -3.617 1.00 0.97 C ATOM 873 OE1 GLU A 143 12.590 -0.366 -4.097 1.00 1.62 O ATOM 874 OE2 GLU A 143 13.306 1.653 -3.883 1.00 1.84 O ATOM 0 H GLU A 143 9.073 -1.968 -1.745 1.00 0.26 H new ATOM 0 HA GLU A 143 10.039 0.434 -0.402 1.00 0.31 H new ATOM 0 HB2 GLU A 143 11.085 -1.049 -2.264 1.00 0.36 H new ATOM 0 HB3 GLU A 143 9.926 -0.340 -3.371 1.00 0.36 H new ATOM 0 HG2 GLU A 143 10.810 1.914 -2.974 1.00 0.44 H new ATOM 0 HG3 GLU A 143 11.817 1.347 -1.657 1.00 0.44 H new ATOM 881 N SER A 144 7.571 0.816 -2.528 1.00 0.29 N ATOM 882 CA SER A 144 6.509 1.789 -2.936 1.00 0.29 C ATOM 883 C SER A 144 5.649 2.175 -1.730 1.00 0.28 C ATOM 884 O SER A 144 5.255 3.317 -1.575 1.00 0.28 O ATOM 885 CB SER A 144 5.667 1.059 -3.983 1.00 0.29 C ATOM 886 OG SER A 144 6.435 0.896 -5.168 1.00 1.34 O ATOM 0 H SER A 144 7.518 -0.093 -2.987 1.00 0.29 H new ATOM 0 HA SER A 144 6.934 2.711 -3.332 1.00 0.29 H new ATOM 0 HB2 SER A 144 5.353 0.087 -3.602 1.00 0.29 H new ATOM 0 HB3 SER A 144 4.761 1.625 -4.198 1.00 0.29 H new ATOM 0 HG SER A 144 5.901 0.427 -5.842 1.00 1.34 H new ATOM 892 N LEU A 145 5.343 1.224 -0.889 1.00 0.27 N ATOM 893 CA LEU A 145 4.496 1.516 0.306 1.00 0.28 C ATOM 894 C LEU A 145 5.271 2.374 1.309 1.00 0.30 C ATOM 895 O LEU A 145 4.709 3.231 1.959 1.00 0.30 O ATOM 896 CB LEU A 145 4.175 0.151 0.917 1.00 0.29 C ATOM 897 CG LEU A 145 3.245 -0.631 -0.013 1.00 0.37 C ATOM 898 CD1 LEU A 145 3.245 -2.107 0.389 1.00 0.73 C ATOM 899 CD2 LEU A 145 1.823 -0.080 0.104 1.00 0.67 C ATOM 0 H LEU A 145 5.644 0.253 -0.978 1.00 0.27 H new ATOM 0 HA LEU A 145 3.594 2.067 0.040 1.00 0.28 H new ATOM 0 HB2 LEU A 145 5.096 -0.409 1.080 1.00 0.29 H new ATOM 0 HB3 LEU A 145 3.704 0.281 1.891 1.00 0.29 H new ATOM 0 HG LEU A 145 3.594 -0.530 -1.041 1.00 0.37 H new ATOM 0 HD11 LEU A 145 2.583 -2.664 -0.273 1.00 0.73 H new ATOM 0 HD12 LEU A 145 4.256 -2.506 0.310 1.00 0.73 H new ATOM 0 HD13 LEU A 145 2.896 -2.204 1.417 1.00 0.73 H new ATOM 0 HD21 LEU A 145 1.161 -0.637 -0.559 1.00 0.67 H new ATOM 0 HD22 LEU A 145 1.477 -0.182 1.132 1.00 0.67 H new ATOM 0 HD23 LEU A 145 1.816 0.973 -0.178 1.00 0.67 H new ATOM 911 N LYS A 146 6.556 2.142 1.443 1.00 0.33 N ATOM 912 CA LYS A 146 7.373 2.937 2.418 1.00 0.35 C ATOM 913 C LYS A 146 7.325 4.431 2.074 1.00 0.34 C ATOM 914 O LYS A 146 7.082 5.262 2.930 1.00 0.35 O ATOM 915 CB LYS A 146 8.805 2.400 2.273 1.00 0.41 C ATOM 916 CG LYS A 146 9.739 3.147 3.232 1.00 1.01 C ATOM 917 CD LYS A 146 11.164 2.609 3.082 1.00 1.15 C ATOM 918 CE LYS A 146 12.138 3.519 3.836 1.00 1.96 C ATOM 919 NZ LYS A 146 12.289 2.898 5.181 1.00 2.32 N ATOM 0 H LYS A 146 7.075 1.437 0.920 1.00 0.33 H new ATOM 0 HA LYS A 146 6.998 2.838 3.437 1.00 0.35 H new ATOM 0 HB2 LYS A 146 8.826 1.332 2.489 1.00 0.41 H new ATOM 0 HB3 LYS A 146 9.148 2.525 1.246 1.00 0.41 H new ATOM 0 HG2 LYS A 146 9.718 4.216 3.018 1.00 1.01 H new ATOM 0 HG3 LYS A 146 9.398 3.021 4.260 1.00 1.01 H new ATOM 0 HD2 LYS A 146 11.223 1.593 3.473 1.00 1.15 H new ATOM 0 HD3 LYS A 146 11.437 2.562 2.028 1.00 1.15 H new ATOM 0 HE2 LYS A 146 13.097 3.582 3.321 1.00 1.96 H new ATOM 0 HE3 LYS A 146 11.750 4.535 3.912 1.00 1.96 H new ATOM 0 HZ1 LYS A 146 12.943 3.467 5.755 1.00 2.32 H new ATOM 0 HZ2 LYS A 146 11.362 2.857 5.651 1.00 2.32 H new ATOM 0 HZ3 LYS A 146 12.667 1.935 5.078 1.00 2.32 H new ATOM 933 N VAL A 147 7.575 4.782 0.842 1.00 0.32 N ATOM 934 CA VAL A 147 7.547 6.229 0.466 1.00 0.33 C ATOM 935 C VAL A 147 6.136 6.811 0.625 1.00 0.31 C ATOM 936 O VAL A 147 5.970 7.906 1.131 1.00 0.31 O ATOM 937 CB VAL A 147 8.029 6.299 -0.985 1.00 0.36 C ATOM 938 CG1 VAL A 147 9.466 5.784 -1.052 1.00 0.40 C ATOM 939 CG2 VAL A 147 7.143 5.446 -1.901 1.00 0.36 C ATOM 0 H VAL A 147 7.796 4.137 0.083 1.00 0.32 H new ATOM 0 HA VAL A 147 8.189 6.824 1.116 1.00 0.33 H new ATOM 0 HB VAL A 147 7.976 7.334 -1.323 1.00 0.36 H new ATOM 0 HG11 VAL A 147 9.821 5.829 -2.082 1.00 0.40 H new ATOM 0 HG12 VAL A 147 10.104 6.403 -0.421 1.00 0.40 H new ATOM 0 HG13 VAL A 147 9.500 4.752 -0.701 1.00 0.40 H new ATOM 0 HG21 VAL A 147 7.508 5.514 -2.926 1.00 0.36 H new ATOM 0 HG22 VAL A 147 7.174 4.407 -1.573 1.00 0.36 H new ATOM 0 HG23 VAL A 147 6.117 5.810 -1.856 1.00 0.36 H new ATOM 949 N TRP A 148 5.122 6.094 0.208 1.00 0.32 N ATOM 950 CA TRP A 148 3.726 6.620 0.353 1.00 0.33 C ATOM 951 C TRP A 148 3.386 6.801 1.846 1.00 0.32 C ATOM 952 O TRP A 148 2.942 7.857 2.257 1.00 0.32 O ATOM 953 CB TRP A 148 2.819 5.569 -0.337 1.00 0.36 C ATOM 954 CG TRP A 148 1.413 5.615 0.210 1.00 0.28 C ATOM 955 CD1 TRP A 148 0.655 6.730 0.353 1.00 0.30 C ATOM 956 CD2 TRP A 148 0.610 4.509 0.705 1.00 0.24 C ATOM 957 NE1 TRP A 148 -0.557 6.373 0.931 1.00 0.23 N ATOM 958 CE2 TRP A 148 -0.633 5.011 1.163 1.00 0.18 C ATOM 959 CE3 TRP A 148 0.845 3.130 0.802 1.00 0.31 C ATOM 960 CZ2 TRP A 148 -1.607 4.160 1.708 1.00 0.17 C ATOM 961 CZ3 TRP A 148 -0.128 2.280 1.339 1.00 0.33 C ATOM 962 CH2 TRP A 148 -1.348 2.793 1.793 1.00 0.27 C ATOM 0 H TRP A 148 5.197 5.173 -0.224 1.00 0.32 H new ATOM 0 HA TRP A 148 3.591 7.600 -0.105 1.00 0.33 H new ATOM 0 HB2 TRP A 148 2.800 5.751 -1.411 1.00 0.36 H new ATOM 0 HB3 TRP A 148 3.236 4.573 -0.190 1.00 0.36 H new ATOM 0 HD1 TRP A 148 0.945 7.730 0.065 1.00 0.30 H new ATOM 0 HE1 TRP A 148 -1.300 7.034 1.157 1.00 0.23 H new ATOM 0 HE3 TRP A 148 1.784 2.721 0.460 1.00 0.31 H new ATOM 0 HZ2 TRP A 148 -2.547 4.560 2.058 1.00 0.17 H new ATOM 0 HZ3 TRP A 148 0.064 1.219 1.404 1.00 0.33 H new ATOM 0 HH2 TRP A 148 -2.090 2.129 2.210 1.00 0.27 H new ATOM 973 N LYS A 149 3.571 5.779 2.652 1.00 0.36 N ATOM 974 CA LYS A 149 3.230 5.908 4.101 1.00 0.38 C ATOM 975 C LYS A 149 4.053 7.032 4.754 1.00 0.34 C ATOM 976 O LYS A 149 3.569 7.733 5.623 1.00 0.33 O ATOM 977 CB LYS A 149 3.521 4.537 4.739 1.00 0.52 C ATOM 978 CG LYS A 149 5.027 4.266 4.795 1.00 1.36 C ATOM 979 CD LYS A 149 5.283 2.942 5.514 1.00 2.07 C ATOM 980 CE LYS A 149 6.745 2.882 5.961 1.00 2.80 C ATOM 981 NZ LYS A 149 7.124 1.447 5.849 1.00 3.70 N ATOM 0 H LYS A 149 3.940 4.871 2.369 1.00 0.36 H new ATOM 0 HA LYS A 149 2.184 6.178 4.245 1.00 0.38 H new ATOM 0 HB2 LYS A 149 3.104 4.505 5.746 1.00 0.52 H new ATOM 0 HB3 LYS A 149 3.028 3.753 4.165 1.00 0.52 H new ATOM 0 HG2 LYS A 149 5.438 4.229 3.786 1.00 1.36 H new ATOM 0 HG3 LYS A 149 5.534 5.078 5.316 1.00 1.36 H new ATOM 0 HD2 LYS A 149 4.623 2.850 6.377 1.00 2.07 H new ATOM 0 HD3 LYS A 149 5.059 2.106 4.851 1.00 2.07 H new ATOM 0 HE2 LYS A 149 7.377 3.507 5.330 1.00 2.80 H new ATOM 0 HE3 LYS A 149 6.860 3.242 6.983 1.00 2.80 H new ATOM 0 HZ1 LYS A 149 7.167 1.024 6.798 1.00 3.70 H new ATOM 0 HZ2 LYS A 149 6.415 0.944 5.278 1.00 3.70 H new ATOM 0 HZ3 LYS A 149 8.055 1.368 5.393 1.00 3.70 H new ATOM 995 N ASN A 150 5.288 7.212 4.340 1.00 0.37 N ATOM 996 CA ASN A 150 6.128 8.299 4.940 1.00 0.41 C ATOM 997 C ASN A 150 5.515 9.671 4.657 1.00 0.39 C ATOM 998 O ASN A 150 5.510 10.544 5.506 1.00 0.46 O ATOM 999 CB ASN A 150 7.492 8.192 4.258 1.00 0.50 C ATOM 1000 CG ASN A 150 8.404 7.266 5.060 1.00 1.07 C ATOM 1001 OD1 ASN A 150 8.342 6.060 4.925 1.00 1.86 O ATOM 1002 ND2 ASN A 150 9.258 7.789 5.897 1.00 1.27 N ATOM 0 H ASN A 150 5.747 6.657 3.618 1.00 0.37 H new ATOM 0 HA ASN A 150 6.200 8.192 6.022 1.00 0.41 H new ATOM 0 HB2 ASN A 150 7.372 7.810 3.244 1.00 0.50 H new ATOM 0 HB3 ASN A 150 7.945 9.180 4.175 1.00 0.50 H new ATOM 0 HD21 ASN A 150 9.875 7.185 6.440 1.00 1.27 H new ATOM 0 HD22 ASN A 150 9.308 8.802 6.008 1.00 1.27 H new ATOM 1009 N ALA A 151 5.005 9.868 3.469 1.00 0.38 N ATOM 1010 CA ALA A 151 4.398 11.189 3.123 1.00 0.49 C ATOM 1011 C ALA A 151 3.106 11.410 3.915 1.00 0.53 C ATOM 1012 O ALA A 151 2.941 12.422 4.569 1.00 0.72 O ATOM 1013 CB ALA A 151 4.104 11.119 1.624 1.00 0.57 C ATOM 0 H ALA A 151 4.982 9.172 2.724 1.00 0.38 H new ATOM 0 HA ALA A 151 5.062 12.018 3.367 1.00 0.49 H new ATOM 0 HB1 ALA A 151 3.655 12.057 1.297 1.00 0.57 H new ATOM 0 HB2 ALA A 151 5.033 10.951 1.079 1.00 0.57 H new ATOM 0 HB3 ALA A 151 3.414 10.299 1.426 1.00 0.57 H new ATOM 1019 N GLU A 152 2.191 10.473 3.860 1.00 0.40 N ATOM 1020 CA GLU A 152 0.911 10.633 4.612 1.00 0.50 C ATOM 1021 C GLU A 152 1.131 10.445 6.116 1.00 0.60 C ATOM 1022 O GLU A 152 1.550 9.394 6.564 1.00 1.48 O ATOM 1023 CB GLU A 152 -0.020 9.550 4.062 1.00 0.44 C ATOM 1024 CG GLU A 152 -0.779 10.095 2.847 1.00 0.77 C ATOM 1025 CD GLU A 152 0.144 10.146 1.624 1.00 1.10 C ATOM 1026 OE1 GLU A 152 1.117 9.409 1.602 1.00 1.81 O ATOM 1027 OE2 GLU A 152 -0.143 10.920 0.726 1.00 1.66 O ATOM 0 H GLU A 152 2.276 9.607 3.328 1.00 0.40 H new ATOM 0 HA GLU A 152 0.493 11.632 4.485 1.00 0.50 H new ATOM 0 HB2 GLU A 152 0.557 8.670 3.779 1.00 0.44 H new ATOM 0 HB3 GLU A 152 -0.724 9.235 4.832 1.00 0.44 H new ATOM 0 HG2 GLU A 152 -1.641 9.463 2.635 1.00 0.77 H new ATOM 0 HG3 GLU A 152 -1.161 11.092 3.065 1.00 0.77 H new ATOM 1034 N LYS A 153 0.823 11.450 6.895 1.00 0.76 N ATOM 1035 CA LYS A 153 0.980 11.336 8.375 1.00 0.67 C ATOM 1036 C LYS A 153 -0.306 10.739 8.959 1.00 0.64 C ATOM 1037 O LYS A 153 -0.347 9.580 9.324 1.00 0.57 O ATOM 1038 CB LYS A 153 1.216 12.773 8.859 1.00 0.86 C ATOM 1039 CG LYS A 153 1.368 12.795 10.382 1.00 1.17 C ATOM 1040 CD LYS A 153 1.653 14.228 10.843 1.00 1.57 C ATOM 1041 CE LYS A 153 1.902 14.242 12.353 1.00 2.22 C ATOM 1042 NZ LYS A 153 2.307 15.642 12.663 1.00 2.51 N ATOM 0 H LYS A 153 0.468 12.348 6.567 1.00 0.76 H new ATOM 0 HA LYS A 153 1.801 10.688 8.682 1.00 0.67 H new ATOM 0 HB2 LYS A 153 2.112 13.181 8.390 1.00 0.86 H new ATOM 0 HB3 LYS A 153 0.382 13.408 8.559 1.00 0.86 H new ATOM 0 HG2 LYS A 153 0.459 12.423 10.855 1.00 1.17 H new ATOM 0 HG3 LYS A 153 2.180 12.135 10.687 1.00 1.17 H new ATOM 0 HD2 LYS A 153 2.522 14.624 10.317 1.00 1.57 H new ATOM 0 HD3 LYS A 153 0.810 14.874 10.597 1.00 1.57 H new ATOM 0 HE2 LYS A 153 1.005 13.959 12.904 1.00 2.22 H new ATOM 0 HE3 LYS A 153 2.683 13.534 12.631 1.00 2.22 H new ATOM 0 HZ1 LYS A 153 2.495 15.731 13.682 1.00 2.51 H new ATOM 0 HZ2 LYS A 153 3.167 15.881 12.130 1.00 2.51 H new ATOM 0 HZ3 LYS A 153 1.541 16.292 12.394 1.00 2.51 H new ATOM 1056 N LYS A 154 -1.361 11.510 9.014 1.00 0.73 N ATOM 1057 CA LYS A 154 -2.658 10.976 9.531 1.00 0.77 C ATOM 1058 C LYS A 154 -3.215 9.962 8.528 1.00 0.62 C ATOM 1059 O LYS A 154 -3.854 8.986 8.888 1.00 0.60 O ATOM 1060 CB LYS A 154 -3.585 12.187 9.631 1.00 0.95 C ATOM 1061 CG LYS A 154 -3.118 13.102 10.762 1.00 1.29 C ATOM 1062 CD LYS A 154 -4.053 14.305 10.849 1.00 1.34 C ATOM 1063 CE LYS A 154 -3.594 15.227 11.978 1.00 2.02 C ATOM 1064 NZ LYS A 154 -4.289 16.520 11.723 1.00 2.51 N ATOM 0 H LYS A 154 -1.381 12.487 8.723 1.00 0.73 H new ATOM 0 HA LYS A 154 -2.552 10.475 10.493 1.00 0.77 H new ATOM 0 HB2 LYS A 154 -3.589 12.733 8.687 1.00 0.95 H new ATOM 0 HB3 LYS A 154 -4.608 11.859 9.814 1.00 0.95 H new ATOM 0 HG2 LYS A 154 -3.114 12.559 11.707 1.00 1.29 H new ATOM 0 HG3 LYS A 154 -2.095 13.433 10.580 1.00 1.29 H new ATOM 0 HD2 LYS A 154 -4.056 14.846 9.902 1.00 1.34 H new ATOM 0 HD3 LYS A 154 -5.075 13.972 11.030 1.00 1.34 H new ATOM 0 HE2 LYS A 154 -3.861 14.820 12.953 1.00 2.02 H new ATOM 0 HE3 LYS A 154 -2.511 15.352 11.970 1.00 2.02 H new ATOM 0 HZ1 LYS A 154 -4.025 17.207 12.458 1.00 2.51 H new ATOM 0 HZ2 LYS A 154 -4.010 16.886 10.790 1.00 2.51 H new ATOM 0 HZ3 LYS A 154 -5.318 16.371 11.743 1.00 2.51 H new ATOM 1078 N ASN A 155 -2.965 10.194 7.264 1.00 0.57 N ATOM 1079 CA ASN A 155 -3.473 9.268 6.209 1.00 0.47 C ATOM 1080 C ASN A 155 -2.667 7.965 6.193 1.00 0.37 C ATOM 1081 O ASN A 155 -3.002 7.044 5.470 1.00 0.34 O ATOM 1082 CB ASN A 155 -3.279 10.017 4.888 1.00 0.51 C ATOM 1083 CG ASN A 155 -4.359 11.089 4.728 1.00 0.76 C ATOM 1084 OD1 ASN A 155 -4.056 12.262 4.639 1.00 1.37 O ATOM 1085 ND2 ASN A 155 -5.615 10.735 4.682 1.00 1.03 N ATOM 0 H ASN A 155 -2.428 10.989 6.917 1.00 0.57 H new ATOM 0 HA ASN A 155 -4.514 8.996 6.384 1.00 0.47 H new ATOM 0 HB2 ASN A 155 -2.292 10.478 4.864 1.00 0.51 H new ATOM 0 HB3 ASN A 155 -3.324 9.317 4.054 1.00 0.51 H new ATOM 0 HD21 ASN A 155 -6.341 11.443 4.571 1.00 1.03 H new ATOM 0 HD22 ASN A 155 -5.870 9.750 4.757 1.00 1.03 H new ATOM 1092 N ALA A 156 -1.624 7.862 6.989 1.00 0.37 N ATOM 1093 CA ALA A 156 -0.834 6.595 7.006 1.00 0.33 C ATOM 1094 C ALA A 156 -1.673 5.477 7.628 1.00 0.28 C ATOM 1095 O ALA A 156 -1.331 4.312 7.523 1.00 0.28 O ATOM 1096 CB ALA A 156 0.387 6.868 7.888 1.00 0.41 C ATOM 0 H ALA A 156 -1.293 8.593 7.618 1.00 0.37 H new ATOM 0 HA ALA A 156 -0.544 6.289 6.001 1.00 0.33 H new ATOM 0 HB1 ALA A 156 1.007 5.973 7.939 1.00 0.41 H new ATOM 0 HB2 ALA A 156 0.967 7.687 7.463 1.00 0.41 H new ATOM 0 HB3 ALA A 156 0.058 7.139 8.891 1.00 0.41 H new ATOM 1102 N SER A 157 -2.769 5.813 8.276 1.00 0.28 N ATOM 1103 CA SER A 157 -3.603 4.752 8.895 1.00 0.28 C ATOM 1104 C SER A 157 -4.554 4.175 7.860 1.00 0.22 C ATOM 1105 O SER A 157 -4.711 4.705 6.766 1.00 0.21 O ATOM 1106 CB SER A 157 -4.385 5.444 10.007 1.00 0.34 C ATOM 1107 OG SER A 157 -4.898 6.679 9.524 1.00 1.05 O ATOM 0 H SER A 157 -3.111 6.767 8.397 1.00 0.28 H new ATOM 0 HA SER A 157 -3.001 3.929 9.280 1.00 0.28 H new ATOM 0 HB2 SER A 157 -5.201 4.805 10.345 1.00 0.34 H new ATOM 0 HB3 SER A 157 -3.739 5.617 10.868 1.00 0.34 H new ATOM 0 HG SER A 157 -4.247 7.392 9.692 1.00 1.05 H new ATOM 1113 N VAL A 158 -5.176 3.080 8.191 1.00 0.23 N ATOM 1114 CA VAL A 158 -6.108 2.442 7.229 1.00 0.22 C ATOM 1115 C VAL A 158 -7.245 3.394 6.869 1.00 0.18 C ATOM 1116 O VAL A 158 -7.552 3.554 5.713 1.00 0.18 O ATOM 1117 CB VAL A 158 -6.642 1.186 7.915 1.00 0.28 C ATOM 1118 CG1 VAL A 158 -5.482 0.235 8.211 1.00 0.34 C ATOM 1119 CG2 VAL A 158 -7.350 1.543 9.223 1.00 0.27 C ATOM 0 H VAL A 158 -5.078 2.601 9.086 1.00 0.23 H new ATOM 0 HA VAL A 158 -5.603 2.191 6.296 1.00 0.22 H new ATOM 0 HB VAL A 158 -7.358 0.705 7.249 1.00 0.28 H new ATOM 0 HG11 VAL A 158 -5.862 -0.662 8.701 1.00 0.34 H new ATOM 0 HG12 VAL A 158 -4.991 -0.042 7.278 1.00 0.34 H new ATOM 0 HG13 VAL A 158 -4.764 0.729 8.866 1.00 0.34 H new ATOM 0 HG21 VAL A 158 -7.723 0.634 9.695 1.00 0.27 H new ATOM 0 HG22 VAL A 158 -6.648 2.038 9.893 1.00 0.27 H new ATOM 0 HG23 VAL A 158 -8.185 2.212 9.014 1.00 0.27 H new ATOM 1129 N ALA A 159 -7.852 4.048 7.841 1.00 0.15 N ATOM 1130 CA ALA A 159 -8.973 5.008 7.543 1.00 0.13 C ATOM 1131 C ALA A 159 -8.592 5.939 6.396 1.00 0.13 C ATOM 1132 O ALA A 159 -9.422 6.311 5.583 1.00 0.15 O ATOM 1133 CB ALA A 159 -9.182 5.803 8.831 1.00 0.12 C ATOM 0 H ALA A 159 -7.618 3.957 8.830 1.00 0.15 H new ATOM 0 HA ALA A 159 -9.880 4.487 7.237 1.00 0.13 H new ATOM 0 HB1 ALA A 159 -9.987 6.524 8.687 1.00 0.12 H new ATOM 0 HB2 ALA A 159 -9.446 5.122 9.640 1.00 0.12 H new ATOM 0 HB3 ALA A 159 -8.263 6.331 9.086 1.00 0.12 H new ATOM 1139 N GLY A 160 -7.334 6.278 6.303 1.00 0.13 N ATOM 1140 CA GLY A 160 -6.890 7.146 5.183 1.00 0.15 C ATOM 1141 C GLY A 160 -6.980 6.348 3.892 1.00 0.16 C ATOM 1142 O GLY A 160 -7.774 6.649 3.014 1.00 0.18 O ATOM 0 H GLY A 160 -6.601 5.992 6.952 1.00 0.13 H new ATOM 0 HA2 GLY A 160 -7.515 8.037 5.123 1.00 0.15 H new ATOM 0 HA3 GLY A 160 -5.867 7.485 5.349 1.00 0.15 H new ATOM 1146 N LEU A 161 -6.165 5.331 3.765 1.00 0.16 N ATOM 1147 CA LEU A 161 -6.194 4.517 2.525 1.00 0.18 C ATOM 1148 C LEU A 161 -7.568 3.877 2.304 1.00 0.20 C ATOM 1149 O LEU A 161 -8.128 4.038 1.257 1.00 0.28 O ATOM 1150 CB LEU A 161 -5.143 3.427 2.724 1.00 0.19 C ATOM 1151 CG LEU A 161 -5.071 2.546 1.469 1.00 0.22 C ATOM 1152 CD1 LEU A 161 -4.332 3.299 0.351 1.00 0.23 C ATOM 1153 CD2 LEU A 161 -4.340 1.233 1.799 1.00 0.27 C ATOM 0 H LEU A 161 -5.486 5.035 4.466 1.00 0.16 H new ATOM 0 HA LEU A 161 -5.993 5.137 1.651 1.00 0.18 H new ATOM 0 HB2 LEU A 161 -4.170 3.877 2.921 1.00 0.19 H new ATOM 0 HB3 LEU A 161 -5.395 2.819 3.593 1.00 0.19 H new ATOM 0 HG LEU A 161 -6.080 2.312 1.131 1.00 0.22 H new ATOM 0 HD11 LEU A 161 -4.282 2.672 -0.539 1.00 0.23 H new ATOM 0 HD12 LEU A 161 -4.867 4.219 0.117 1.00 0.23 H new ATOM 0 HD13 LEU A 161 -3.322 3.541 0.681 1.00 0.23 H new ATOM 0 HD21 LEU A 161 -4.291 0.610 0.906 1.00 0.27 H new ATOM 0 HD22 LEU A 161 -3.330 1.455 2.143 1.00 0.27 H new ATOM 0 HD23 LEU A 161 -4.881 0.702 2.582 1.00 0.27 H new ATOM 1165 N VAL A 162 -8.115 3.141 3.258 1.00 0.22 N ATOM 1166 CA VAL A 162 -9.442 2.470 3.009 1.00 0.26 C ATOM 1167 C VAL A 162 -10.476 3.469 2.498 1.00 0.29 C ATOM 1168 O VAL A 162 -11.285 3.148 1.647 1.00 0.34 O ATOM 1169 CB VAL A 162 -9.894 1.852 4.339 1.00 0.30 C ATOM 1170 CG1 VAL A 162 -8.825 0.887 4.853 1.00 0.30 C ATOM 1171 CG2 VAL A 162 -10.173 2.931 5.392 1.00 0.31 C ATOM 0 H VAL A 162 -7.708 2.979 4.179 1.00 0.22 H new ATOM 0 HA VAL A 162 -9.341 1.703 2.242 1.00 0.26 H new ATOM 0 HB VAL A 162 -10.822 1.309 4.160 1.00 0.30 H new ATOM 0 HG11 VAL A 162 -9.152 0.452 5.797 1.00 0.30 H new ATOM 0 HG12 VAL A 162 -8.669 0.093 4.122 1.00 0.30 H new ATOM 0 HG13 VAL A 162 -7.891 1.427 5.006 1.00 0.30 H new ATOM 0 HG21 VAL A 162 -10.491 2.459 6.321 1.00 0.31 H new ATOM 0 HG22 VAL A 162 -9.266 3.509 5.570 1.00 0.31 H new ATOM 0 HG23 VAL A 162 -10.961 3.594 5.034 1.00 0.31 H new ATOM 1181 N LYS A 163 -10.437 4.680 2.982 1.00 0.29 N ATOM 1182 CA LYS A 163 -11.404 5.702 2.484 1.00 0.34 C ATOM 1183 C LYS A 163 -11.218 5.896 0.971 1.00 0.36 C ATOM 1184 O LYS A 163 -12.120 5.667 0.193 1.00 0.39 O ATOM 1185 CB LYS A 163 -11.059 6.992 3.237 1.00 0.33 C ATOM 1186 CG LYS A 163 -12.006 8.110 2.790 1.00 0.39 C ATOM 1187 CD LYS A 163 -11.656 9.409 3.518 1.00 1.30 C ATOM 1188 CE LYS A 163 -12.483 10.554 2.928 1.00 1.51 C ATOM 1189 NZ LYS A 163 -12.147 11.744 3.756 1.00 2.30 N ATOM 0 H LYS A 163 -9.784 5.005 3.695 1.00 0.29 H new ATOM 0 HA LYS A 163 -12.440 5.407 2.650 1.00 0.34 H new ATOM 0 HB2 LYS A 163 -11.147 6.834 4.312 1.00 0.33 H new ATOM 0 HB3 LYS A 163 -10.025 7.276 3.040 1.00 0.33 H new ATOM 0 HG2 LYS A 163 -11.929 8.255 1.712 1.00 0.39 H new ATOM 0 HG3 LYS A 163 -13.038 7.831 3.002 1.00 0.39 H new ATOM 0 HD2 LYS A 163 -11.860 9.309 4.584 1.00 1.30 H new ATOM 0 HD3 LYS A 163 -10.592 9.622 3.415 1.00 1.30 H new ATOM 0 HE2 LYS A 163 -12.234 10.720 1.880 1.00 1.51 H new ATOM 0 HE3 LYS A 163 -13.549 10.333 2.971 1.00 1.51 H new ATOM 0 HZ1 LYS A 163 -12.677 12.569 3.410 1.00 2.30 H new ATOM 0 HZ2 LYS A 163 -12.401 11.560 4.747 1.00 2.30 H new ATOM 0 HZ3 LYS A 163 -11.127 11.936 3.690 1.00 2.30 H new ATOM 1203 N ALA A 164 -10.042 6.295 0.556 1.00 0.36 N ATOM 1204 CA ALA A 164 -9.789 6.487 -0.912 1.00 0.39 C ATOM 1205 C ALA A 164 -9.796 5.136 -1.636 1.00 0.39 C ATOM 1206 O ALA A 164 -10.355 4.970 -2.701 1.00 0.33 O ATOM 1207 CB ALA A 164 -8.398 7.121 -0.991 1.00 0.44 C ATOM 0 H ALA A 164 -9.248 6.496 1.163 1.00 0.36 H new ATOM 0 HA ALA A 164 -10.553 7.105 -1.383 1.00 0.39 H new ATOM 0 HB1 ALA A 164 -8.136 7.295 -2.035 1.00 0.44 H new ATOM 0 HB2 ALA A 164 -8.400 8.070 -0.455 1.00 0.44 H new ATOM 0 HB3 ALA A 164 -7.666 6.451 -0.540 1.00 0.44 H new ATOM 1213 N LEU A 165 -9.126 4.195 -1.047 1.00 0.50 N ATOM 1214 CA LEU A 165 -8.978 2.820 -1.625 1.00 0.55 C ATOM 1215 C LEU A 165 -10.314 2.175 -2.014 1.00 0.45 C ATOM 1216 O LEU A 165 -10.535 1.841 -3.164 1.00 0.42 O ATOM 1217 CB LEU A 165 -8.358 2.058 -0.454 1.00 0.80 C ATOM 1218 CG LEU A 165 -8.097 0.611 -0.792 1.00 0.52 C ATOM 1219 CD1 LEU A 165 -6.862 0.550 -1.693 1.00 1.47 C ATOM 1220 CD2 LEU A 165 -7.841 -0.169 0.508 1.00 1.24 C ATOM 0 H LEU A 165 -8.653 4.319 -0.152 1.00 0.50 H new ATOM 0 HA LEU A 165 -8.398 2.822 -2.548 1.00 0.55 H new ATOM 0 HB2 LEU A 165 -7.422 2.537 -0.166 1.00 0.80 H new ATOM 0 HB3 LEU A 165 -9.024 2.114 0.407 1.00 0.80 H new ATOM 0 HG LEU A 165 -8.952 0.171 -1.305 1.00 0.52 H new ATOM 0 HD11 LEU A 165 -6.652 -0.488 -1.952 1.00 1.47 H new ATOM 0 HD12 LEU A 165 -7.047 1.121 -2.603 1.00 1.47 H new ATOM 0 HD13 LEU A 165 -6.006 0.973 -1.167 1.00 1.47 H new ATOM 0 HD21 LEU A 165 -7.651 -1.216 0.273 1.00 1.24 H new ATOM 0 HD22 LEU A 165 -6.975 0.251 1.019 1.00 1.24 H new ATOM 0 HD23 LEU A 165 -8.715 -0.095 1.155 1.00 1.24 H new ATOM 1232 N ARG A 166 -11.185 1.970 -1.066 1.00 0.47 N ATOM 1233 CA ARG A 166 -12.494 1.310 -1.373 1.00 0.45 C ATOM 1234 C ARG A 166 -13.384 2.218 -2.211 1.00 0.41 C ATOM 1235 O ARG A 166 -14.066 1.771 -3.116 1.00 0.52 O ATOM 1236 CB ARG A 166 -13.137 1.046 -0.011 1.00 0.52 C ATOM 1237 CG ARG A 166 -14.460 0.300 -0.199 1.00 1.19 C ATOM 1238 CD ARG A 166 -15.121 0.078 1.164 1.00 1.53 C ATOM 1239 NE ARG A 166 -15.594 1.428 1.585 1.00 2.29 N ATOM 1240 CZ ARG A 166 -16.716 1.553 2.239 1.00 2.88 C ATOM 1241 NH1 ARG A 166 -16.999 0.734 3.215 1.00 3.25 N ATOM 1242 NH2 ARG A 166 -17.557 2.498 1.915 1.00 3.60 N ATOM 0 H ARG A 166 -11.051 2.230 -0.089 1.00 0.47 H new ATOM 0 HA ARG A 166 -12.355 0.396 -1.950 1.00 0.45 H new ATOM 0 HB2 ARG A 166 -12.463 0.458 0.612 1.00 0.52 H new ATOM 0 HB3 ARG A 166 -13.311 1.988 0.508 1.00 0.52 H new ATOM 0 HG2 ARG A 166 -15.123 0.872 -0.847 1.00 1.19 H new ATOM 0 HG3 ARG A 166 -14.283 -0.657 -0.689 1.00 1.19 H new ATOM 0 HD2 ARG A 166 -15.950 -0.626 1.091 1.00 1.53 H new ATOM 0 HD3 ARG A 166 -14.414 -0.335 1.883 1.00 1.53 H new ATOM 0 HE ARG A 166 -15.040 2.255 1.361 1.00 2.29 H new ATOM 0 HH11 ARG A 166 -16.343 -0.005 3.467 1.00 3.25 H new ATOM 0 HH12 ARG A 166 -17.877 0.833 3.725 1.00 3.25 H new ATOM 0 HH21 ARG A 166 -17.336 3.137 1.151 1.00 3.60 H new ATOM 0 HH22 ARG A 166 -18.435 2.597 2.425 1.00 3.60 H new ATOM 1256 N THR A 167 -13.391 3.484 -1.909 1.00 0.33 N ATOM 1257 CA THR A 167 -14.249 4.433 -2.683 1.00 0.36 C ATOM 1258 C THR A 167 -13.853 4.430 -4.156 1.00 0.35 C ATOM 1259 O THR A 167 -14.693 4.497 -5.034 1.00 0.41 O ATOM 1260 CB THR A 167 -14.002 5.808 -2.063 1.00 0.42 C ATOM 1261 OG1 THR A 167 -14.373 5.774 -0.692 1.00 0.44 O ATOM 1262 CG2 THR A 167 -14.834 6.870 -2.789 1.00 0.47 C ATOM 0 H THR A 167 -12.842 3.907 -1.161 1.00 0.33 H new ATOM 0 HA THR A 167 -15.302 4.155 -2.638 1.00 0.36 H new ATOM 0 HB THR A 167 -12.946 6.060 -2.156 1.00 0.42 H new ATOM 0 HG1 THR A 167 -13.586 5.950 -0.136 1.00 0.44 H new ATOM 0 HG21 THR A 167 -14.651 7.846 -2.339 1.00 0.47 H new ATOM 0 HG22 THR A 167 -14.552 6.897 -3.841 1.00 0.47 H new ATOM 0 HG23 THR A 167 -15.892 6.624 -2.703 1.00 0.47 H new ATOM 1270 N CYS A 168 -12.579 4.371 -4.426 1.00 0.32 N ATOM 1271 CA CYS A 168 -12.119 4.391 -5.840 1.00 0.36 C ATOM 1272 C CYS A 168 -12.380 3.047 -6.526 1.00 0.31 C ATOM 1273 O CYS A 168 -13.016 2.999 -7.560 1.00 0.34 O ATOM 1274 CB CYS A 168 -10.613 4.663 -5.766 1.00 0.40 C ATOM 1275 SG CYS A 168 -9.986 5.047 -7.421 1.00 1.38 S ATOM 0 H CYS A 168 -11.838 4.310 -3.728 1.00 0.32 H new ATOM 0 HA CYS A 168 -12.650 5.144 -6.422 1.00 0.36 H new ATOM 0 HB2 CYS A 168 -10.416 5.494 -5.089 1.00 0.40 H new ATOM 0 HB3 CYS A 168 -10.095 3.793 -5.362 1.00 0.40 H new ATOM 0 HG CYS A 168 -8.709 5.280 -7.358 1.00 1.38 H new ATOM 1281 N ARG A 169 -11.897 1.955 -5.965 1.00 0.30 N ATOM 1282 CA ARG A 169 -12.125 0.605 -6.620 1.00 0.31 C ATOM 1283 C ARG A 169 -11.523 -0.561 -5.818 1.00 0.26 C ATOM 1284 O ARG A 169 -11.886 -1.705 -6.018 1.00 0.34 O ATOM 1285 CB ARG A 169 -11.408 0.675 -7.978 1.00 0.44 C ATOM 1286 CG ARG A 169 -11.732 -0.575 -8.803 1.00 0.69 C ATOM 1287 CD ARG A 169 -11.014 -0.493 -10.153 1.00 0.84 C ATOM 1288 NE ARG A 169 -11.405 -1.731 -10.881 1.00 1.56 N ATOM 1289 CZ ARG A 169 -11.859 -1.650 -12.102 1.00 2.15 C ATOM 1290 NH1 ARG A 169 -13.111 -1.350 -12.314 1.00 2.74 N ATOM 1291 NH2 ARG A 169 -11.059 -1.866 -13.110 1.00 2.73 N ATOM 0 H ARG A 169 -11.363 1.933 -5.096 1.00 0.30 H new ATOM 0 HA ARG A 169 -13.196 0.417 -6.694 1.00 0.31 H new ATOM 0 HB2 ARG A 169 -11.720 1.569 -8.518 1.00 0.44 H new ATOM 0 HB3 ARG A 169 -10.331 0.753 -7.827 1.00 0.44 H new ATOM 0 HG2 ARG A 169 -11.419 -1.470 -8.266 1.00 0.69 H new ATOM 0 HG3 ARG A 169 -12.808 -0.655 -8.955 1.00 0.69 H new ATOM 0 HD2 ARG A 169 -11.313 0.399 -10.704 1.00 0.84 H new ATOM 0 HD3 ARG A 169 -9.933 -0.439 -10.021 1.00 0.84 H new ATOM 0 HE ARG A 169 -11.318 -2.640 -10.427 1.00 1.56 H new ATOM 0 HH11 ARG A 169 -13.735 -1.179 -11.526 1.00 2.74 H new ATOM 0 HH12 ARG A 169 -13.466 -1.287 -13.268 1.00 2.74 H new ATOM 0 HH21 ARG A 169 -10.080 -2.098 -12.943 1.00 2.73 H new ATOM 0 HH22 ARG A 169 -11.413 -1.803 -14.065 1.00 2.73 H new ATOM 1305 N LEU A 170 -10.569 -0.293 -4.973 1.00 0.20 N ATOM 1306 CA LEU A 170 -9.884 -1.393 -4.219 1.00 0.17 C ATOM 1307 C LEU A 170 -10.705 -1.887 -3.016 1.00 0.19 C ATOM 1308 O LEU A 170 -10.223 -1.939 -1.895 1.00 0.23 O ATOM 1309 CB LEU A 170 -8.583 -0.752 -3.752 1.00 0.18 C ATOM 1310 CG LEU A 170 -7.760 -0.276 -4.961 1.00 0.21 C ATOM 1311 CD1 LEU A 170 -7.874 1.252 -5.111 1.00 0.26 C ATOM 1312 CD2 LEU A 170 -6.292 -0.655 -4.749 1.00 0.25 C ATOM 0 H LEU A 170 -10.228 0.646 -4.767 1.00 0.20 H new ATOM 0 HA LEU A 170 -9.739 -2.277 -4.840 1.00 0.17 H new ATOM 0 HB2 LEU A 170 -8.800 0.091 -3.096 1.00 0.18 H new ATOM 0 HB3 LEU A 170 -8.005 -1.469 -3.169 1.00 0.18 H new ATOM 0 HG LEU A 170 -8.142 -0.752 -5.864 1.00 0.21 H new ATOM 0 HD11 LEU A 170 -7.287 1.578 -5.970 1.00 0.26 H new ATOM 0 HD12 LEU A 170 -8.918 1.526 -5.260 1.00 0.26 H new ATOM 0 HD13 LEU A 170 -7.497 1.735 -4.210 1.00 0.26 H new ATOM 0 HD21 LEU A 170 -5.703 -0.320 -5.603 1.00 0.25 H new ATOM 0 HD22 LEU A 170 -5.920 -0.178 -3.842 1.00 0.25 H new ATOM 0 HD23 LEU A 170 -6.206 -1.737 -4.651 1.00 0.25 H new ATOM 1324 N ASN A 171 -11.931 -2.265 -3.250 1.00 0.24 N ATOM 1325 CA ASN A 171 -12.801 -2.777 -2.148 1.00 0.30 C ATOM 1326 C ASN A 171 -12.187 -4.028 -1.498 1.00 0.24 C ATOM 1327 O ASN A 171 -12.340 -4.259 -0.314 1.00 0.25 O ATOM 1328 CB ASN A 171 -14.116 -3.140 -2.839 1.00 0.40 C ATOM 1329 CG ASN A 171 -15.281 -2.902 -1.886 1.00 0.50 C ATOM 1330 OD1 ASN A 171 -15.636 -3.758 -1.100 1.00 0.58 O ATOM 1331 ND2 ASN A 171 -15.893 -1.754 -1.933 1.00 0.59 N ATOM 0 H ASN A 171 -12.375 -2.242 -4.168 1.00 0.24 H new ATOM 0 HA ASN A 171 -12.927 -2.042 -1.353 1.00 0.30 H new ATOM 0 HB2 ASN A 171 -14.242 -2.539 -3.740 1.00 0.40 H new ATOM 0 HB3 ASN A 171 -14.097 -4.184 -3.152 1.00 0.40 H new ATOM 0 HD21 ASN A 171 -16.677 -1.568 -1.307 1.00 0.59 H new ATOM 0 HD22 ASN A 171 -15.589 -1.041 -2.596 1.00 0.59 H new ATOM 1338 N LEU A 172 -11.529 -4.855 -2.278 1.00 0.21 N ATOM 1339 CA LEU A 172 -10.942 -6.127 -1.725 1.00 0.21 C ATOM 1340 C LEU A 172 -10.058 -5.865 -0.509 1.00 0.17 C ATOM 1341 O LEU A 172 -10.327 -6.332 0.583 1.00 0.21 O ATOM 1342 CB LEU A 172 -10.064 -6.677 -2.851 1.00 0.23 C ATOM 1343 CG LEU A 172 -10.940 -7.132 -4.019 1.00 0.32 C ATOM 1344 CD1 LEU A 172 -10.049 -7.573 -5.181 1.00 1.13 C ATOM 1345 CD2 LEU A 172 -11.814 -8.306 -3.574 1.00 0.85 C ATOM 0 H LEU A 172 -11.371 -4.707 -3.275 1.00 0.21 H new ATOM 0 HA LEU A 172 -11.733 -6.807 -1.408 1.00 0.21 H new ATOM 0 HB2 LEU A 172 -9.365 -5.911 -3.186 1.00 0.23 H new ATOM 0 HB3 LEU A 172 -9.469 -7.513 -2.484 1.00 0.23 H new ATOM 0 HG LEU A 172 -11.576 -6.307 -4.340 1.00 0.32 H new ATOM 0 HD11 LEU A 172 -10.672 -7.898 -6.014 1.00 1.13 H new ATOM 0 HD12 LEU A 172 -9.425 -6.738 -5.498 1.00 1.13 H new ATOM 0 HD13 LEU A 172 -9.414 -8.399 -4.860 1.00 1.13 H new ATOM 0 HD21 LEU A 172 -12.439 -8.631 -4.406 1.00 0.85 H new ATOM 0 HD22 LEU A 172 -11.179 -9.132 -3.254 1.00 0.85 H new ATOM 0 HD23 LEU A 172 -12.448 -7.993 -2.745 1.00 0.85 H new ATOM 1357 N VAL A 173 -9.004 -5.123 -0.694 1.00 0.16 N ATOM 1358 CA VAL A 173 -8.082 -4.831 0.446 1.00 0.21 C ATOM 1359 C VAL A 173 -8.825 -4.086 1.549 1.00 0.22 C ATOM 1360 O VAL A 173 -8.575 -4.296 2.722 1.00 0.25 O ATOM 1361 CB VAL A 173 -6.939 -3.979 -0.125 1.00 0.29 C ATOM 1362 CG1 VAL A 173 -6.052 -4.853 -1.005 1.00 0.38 C ATOM 1363 CG2 VAL A 173 -7.477 -2.816 -0.966 1.00 0.34 C ATOM 0 H VAL A 173 -8.738 -4.704 -1.585 1.00 0.16 H new ATOM 0 HA VAL A 173 -7.693 -5.747 0.890 1.00 0.21 H new ATOM 0 HB VAL A 173 -6.370 -3.570 0.710 1.00 0.29 H new ATOM 0 HG11 VAL A 173 -5.239 -4.252 -1.413 1.00 0.38 H new ATOM 0 HG12 VAL A 173 -5.638 -5.667 -0.410 1.00 0.38 H new ATOM 0 HG13 VAL A 173 -6.644 -5.265 -1.822 1.00 0.38 H new ATOM 0 HG21 VAL A 173 -6.643 -2.232 -1.356 1.00 0.34 H new ATOM 0 HG22 VAL A 173 -8.064 -3.208 -1.796 1.00 0.34 H new ATOM 0 HG23 VAL A 173 -8.107 -2.179 -0.345 1.00 0.34 H new ATOM 1373 N ALA A 174 -9.751 -3.238 1.188 1.00 0.27 N ATOM 1374 CA ALA A 174 -10.530 -2.498 2.227 1.00 0.34 C ATOM 1375 C ALA A 174 -11.275 -3.492 3.128 1.00 0.29 C ATOM 1376 O ALA A 174 -11.317 -3.350 4.335 1.00 0.32 O ATOM 1377 CB ALA A 174 -11.521 -1.645 1.443 1.00 0.43 C ATOM 0 H ALA A 174 -10.002 -3.025 0.223 1.00 0.27 H new ATOM 0 HA ALA A 174 -9.893 -1.893 2.872 1.00 0.34 H new ATOM 0 HB1 ALA A 174 -12.133 -1.069 2.137 1.00 0.43 H new ATOM 0 HB2 ALA A 174 -10.977 -0.965 0.788 1.00 0.43 H new ATOM 0 HB3 ALA A 174 -12.162 -2.291 0.843 1.00 0.43 H new ATOM 1383 N ASP A 175 -11.870 -4.493 2.535 1.00 0.24 N ATOM 1384 CA ASP A 175 -12.620 -5.513 3.333 1.00 0.23 C ATOM 1385 C ASP A 175 -11.703 -6.246 4.319 1.00 0.17 C ATOM 1386 O ASP A 175 -12.084 -6.511 5.444 1.00 0.20 O ATOM 1387 CB ASP A 175 -13.180 -6.492 2.297 1.00 0.27 C ATOM 1388 CG ASP A 175 -14.290 -5.815 1.483 1.00 0.37 C ATOM 1389 OD1 ASP A 175 -14.899 -4.888 1.994 1.00 0.99 O ATOM 1390 OD2 ASP A 175 -14.516 -6.240 0.362 1.00 0.80 O ATOM 0 H ASP A 175 -11.870 -4.651 1.527 1.00 0.24 H new ATOM 0 HA ASP A 175 -13.401 -5.049 3.936 1.00 0.23 H new ATOM 0 HB2 ASP A 175 -12.383 -6.827 1.633 1.00 0.27 H new ATOM 0 HB3 ASP A 175 -13.572 -7.378 2.796 1.00 0.27 H new ATOM 1395 N LEU A 176 -10.513 -6.604 3.900 1.00 0.14 N ATOM 1396 CA LEU A 176 -9.593 -7.356 4.818 1.00 0.20 C ATOM 1397 C LEU A 176 -9.238 -6.510 6.041 1.00 0.25 C ATOM 1398 O LEU A 176 -9.375 -6.953 7.166 1.00 0.27 O ATOM 1399 CB LEU A 176 -8.334 -7.662 3.986 1.00 0.28 C ATOM 1400 CG LEU A 176 -8.539 -8.840 2.991 1.00 0.49 C ATOM 1401 CD1 LEU A 176 -9.986 -8.946 2.476 1.00 1.33 C ATOM 1402 CD2 LEU A 176 -7.616 -8.630 1.792 1.00 1.09 C ATOM 0 H LEU A 176 -10.139 -6.411 2.971 1.00 0.14 H new ATOM 0 HA LEU A 176 -10.059 -8.267 5.193 1.00 0.20 H new ATOM 0 HB2 LEU A 176 -8.046 -6.770 3.431 1.00 0.28 H new ATOM 0 HB3 LEU A 176 -7.509 -7.900 4.658 1.00 0.28 H new ATOM 0 HG LEU A 176 -8.311 -9.762 3.526 1.00 0.49 H new ATOM 0 HD11 LEU A 176 -10.066 -9.786 1.786 1.00 1.33 H new ATOM 0 HD12 LEU A 176 -10.661 -9.102 3.317 1.00 1.33 H new ATOM 0 HD13 LEU A 176 -10.257 -8.025 1.959 1.00 1.33 H new ATOM 0 HD21 LEU A 176 -7.747 -9.448 1.084 1.00 1.09 H new ATOM 0 HD22 LEU A 176 -7.861 -7.686 1.305 1.00 1.09 H new ATOM 0 HD23 LEU A 176 -6.580 -8.606 2.130 1.00 1.09 H new ATOM 1414 N VAL A 177 -8.792 -5.295 5.833 1.00 0.33 N ATOM 1415 CA VAL A 177 -8.442 -4.425 6.997 1.00 0.41 C ATOM 1416 C VAL A 177 -9.699 -4.164 7.827 1.00 0.37 C ATOM 1417 O VAL A 177 -9.665 -4.194 9.043 1.00 0.39 O ATOM 1418 CB VAL A 177 -7.880 -3.126 6.405 1.00 0.52 C ATOM 1419 CG1 VAL A 177 -6.626 -3.441 5.594 1.00 0.58 C ATOM 1420 CG2 VAL A 177 -8.909 -2.460 5.490 1.00 0.52 C ATOM 0 H VAL A 177 -8.656 -4.871 4.915 1.00 0.33 H new ATOM 0 HA VAL A 177 -7.709 -4.888 7.658 1.00 0.41 H new ATOM 0 HB VAL A 177 -7.641 -2.447 7.223 1.00 0.52 H new ATOM 0 HG11 VAL A 177 -6.225 -2.520 5.172 1.00 0.58 H new ATOM 0 HG12 VAL A 177 -5.879 -3.899 6.242 1.00 0.58 H new ATOM 0 HG13 VAL A 177 -6.878 -4.130 4.788 1.00 0.58 H new ATOM 0 HG21 VAL A 177 -8.491 -1.541 5.081 1.00 0.52 H new ATOM 0 HG22 VAL A 177 -9.163 -3.137 4.675 1.00 0.52 H new ATOM 0 HG23 VAL A 177 -9.807 -2.227 6.062 1.00 0.52 H new ATOM 1430 N GLU A 178 -10.815 -3.944 7.175 1.00 0.36 N ATOM 1431 CA GLU A 178 -12.090 -3.721 7.923 1.00 0.39 C ATOM 1432 C GLU A 178 -12.430 -4.978 8.732 1.00 0.31 C ATOM 1433 O GLU A 178 -12.610 -4.932 9.935 1.00 0.34 O ATOM 1434 CB GLU A 178 -13.137 -3.460 6.827 1.00 0.45 C ATOM 1435 CG GLU A 178 -14.552 -3.481 7.416 1.00 0.51 C ATOM 1436 CD GLU A 178 -15.527 -2.765 6.474 1.00 1.32 C ATOM 1437 OE1 GLU A 178 -15.236 -2.684 5.291 1.00 1.85 O ATOM 1438 OE2 GLU A 178 -16.555 -2.317 6.953 1.00 1.85 O ATOM 0 H GLU A 178 -10.897 -3.909 6.159 1.00 0.36 H new ATOM 0 HA GLU A 178 -12.039 -2.894 8.632 1.00 0.39 H new ATOM 0 HB2 GLU A 178 -12.947 -2.495 6.358 1.00 0.45 H new ATOM 0 HB3 GLU A 178 -13.051 -4.216 6.047 1.00 0.45 H new ATOM 0 HG2 GLU A 178 -14.874 -4.511 7.571 1.00 0.51 H new ATOM 0 HG3 GLU A 178 -14.555 -2.996 8.392 1.00 0.51 H new ATOM 1445 N GLU A 179 -12.500 -6.100 8.066 1.00 0.25 N ATOM 1446 CA GLU A 179 -12.817 -7.382 8.764 1.00 0.24 C ATOM 1447 C GLU A 179 -11.754 -7.674 9.821 1.00 0.25 C ATOM 1448 O GLU A 179 -12.049 -8.176 10.890 1.00 0.39 O ATOM 1449 CB GLU A 179 -12.814 -8.444 7.664 1.00 0.31 C ATOM 1450 CG GLU A 179 -14.058 -8.267 6.786 1.00 1.03 C ATOM 1451 CD GLU A 179 -14.044 -9.278 5.631 1.00 1.32 C ATOM 1452 OE1 GLU A 179 -13.012 -9.894 5.406 1.00 1.92 O ATOM 1453 OE2 GLU A 179 -15.066 -9.410 4.979 1.00 1.76 O ATOM 0 H GLU A 179 -12.350 -6.185 7.061 1.00 0.25 H new ATOM 0 HA GLU A 179 -13.774 -7.353 9.284 1.00 0.24 H new ATOM 0 HB2 GLU A 179 -11.912 -8.355 7.059 1.00 0.31 H new ATOM 0 HB3 GLU A 179 -12.805 -9.441 8.105 1.00 0.31 H new ATOM 0 HG2 GLU A 179 -14.957 -8.403 7.386 1.00 1.03 H new ATOM 0 HG3 GLU A 179 -14.090 -7.252 6.389 1.00 1.03 H new ATOM 1460 N ALA A 180 -10.522 -7.351 9.529 1.00 0.26 N ATOM 1461 CA ALA A 180 -9.428 -7.592 10.514 1.00 0.38 C ATOM 1462 C ALA A 180 -9.670 -6.750 11.770 1.00 0.44 C ATOM 1463 O ALA A 180 -9.455 -7.200 12.880 1.00 0.60 O ATOM 1464 CB ALA A 180 -8.143 -7.156 9.805 1.00 0.50 C ATOM 0 H ALA A 180 -10.226 -6.930 8.649 1.00 0.26 H new ATOM 0 HA ALA A 180 -9.374 -8.633 10.831 1.00 0.38 H new ATOM 0 HB1 ALA A 180 -7.292 -7.304 10.470 1.00 0.50 H new ATOM 0 HB2 ALA A 180 -8.006 -7.751 8.902 1.00 0.50 H new ATOM 0 HB3 ALA A 180 -8.215 -6.102 9.538 1.00 0.50 H new ATOM 1470 N GLN A 181 -10.127 -5.534 11.601 1.00 0.48 N ATOM 1471 CA GLN A 181 -10.400 -4.658 12.784 1.00 0.70 C ATOM 1472 C GLN A 181 -11.617 -5.166 13.568 1.00 0.71 C ATOM 1473 O GLN A 181 -11.773 -4.875 14.739 1.00 1.08 O ATOM 1474 CB GLN A 181 -10.658 -3.265 12.207 1.00 1.25 C ATOM 1475 CG GLN A 181 -9.337 -2.664 11.722 1.00 1.59 C ATOM 1476 CD GLN A 181 -9.598 -1.304 11.076 1.00 2.23 C ATOM 1477 OE1 GLN A 181 -9.544 -0.284 11.734 1.00 2.65 O ATOM 1478 NE2 GLN A 181 -9.881 -1.245 9.804 1.00 2.46 N ATOM 0 H GLN A 181 -10.323 -5.109 10.695 1.00 0.48 H new ATOM 0 HA GLN A 181 -9.566 -4.652 13.486 1.00 0.70 H new ATOM 0 HB2 GLN A 181 -11.367 -3.327 11.382 1.00 1.25 H new ATOM 0 HB3 GLN A 181 -11.106 -2.623 12.965 1.00 1.25 H new ATOM 0 HG2 GLN A 181 -8.647 -2.554 12.559 1.00 1.59 H new ATOM 0 HG3 GLN A 181 -8.863 -3.334 11.004 1.00 1.59 H new ATOM 0 HE21 GLN A 181 -9.926 -2.101 9.251 1.00 2.46 H new ATOM 0 HE22 GLN A 181 -10.057 -0.343 9.362 1.00 2.46 H new ATOM 1487 N GLU A 182 -12.477 -5.932 12.936 1.00 0.74 N ATOM 1488 CA GLU A 182 -13.686 -6.480 13.641 1.00 1.33 C ATOM 1489 C GLU A 182 -14.480 -5.363 14.333 1.00 2.14 C ATOM 1490 O GLU A 182 -14.973 -5.534 15.431 1.00 2.63 O ATOM 1491 CB GLU A 182 -13.129 -7.458 14.679 1.00 1.79 C ATOM 1492 CG GLU A 182 -12.432 -8.617 13.964 1.00 2.06 C ATOM 1493 CD GLU A 182 -11.683 -9.472 14.988 1.00 2.67 C ATOM 1494 OE1 GLU A 182 -10.567 -9.112 15.327 1.00 3.67 O ATOM 1495 OE2 GLU A 182 -12.237 -10.471 15.415 1.00 2.49 O ATOM 0 H GLU A 182 -12.394 -6.203 11.956 1.00 0.74 H new ATOM 0 HA GLU A 182 -14.374 -6.959 12.944 1.00 1.33 H new ATOM 0 HB2 GLU A 182 -12.426 -6.946 15.336 1.00 1.79 H new ATOM 0 HB3 GLU A 182 -13.935 -7.836 15.308 1.00 1.79 H new ATOM 0 HG2 GLU A 182 -13.165 -9.225 13.434 1.00 2.06 H new ATOM 0 HG3 GLU A 182 -11.737 -8.233 13.218 1.00 2.06 H new ATOM 1502 N SER A 183 -14.611 -4.224 13.694 1.00 2.57 N ATOM 1503 CA SER A 183 -15.379 -3.085 14.302 1.00 3.70 C ATOM 1504 C SER A 183 -14.915 -2.809 15.739 1.00 4.04 C ATOM 1505 O SER A 183 -13.856 -3.294 16.102 1.00 4.36 O ATOM 1506 CB SER A 183 -16.840 -3.538 14.289 1.00 4.22 C ATOM 1507 OG SER A 183 -17.192 -3.947 12.975 1.00 4.75 O ATOM 1508 OXT SER A 183 -15.629 -2.120 16.449 1.00 4.26 O ATOM 0 H SER A 183 -14.218 -4.032 12.773 1.00 2.57 H new ATOM 0 HA SER A 183 -15.229 -2.158 13.748 1.00 3.70 H new ATOM 0 HB2 SER A 183 -16.984 -4.361 14.989 1.00 4.22 H new ATOM 0 HB3 SER A 183 -17.488 -2.725 14.615 1.00 4.22 H new ATOM 0 HG SER A 183 -18.127 -4.240 12.963 1.00 4.75 H new TER 1514 SER A 183