USER MOD reduce.3.24.130724 H: found=0, std=0, add=553, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 554 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 147 GLN : amide:sc= -0.0124 X(o=-0.89,f=-0.47) USER MOD Set 1.2: A 150 HIS : no HD1:sc= -0.876 K(o=-0.89,f=-0.053) USER MOD Set 2.1: A 138 ASN : amide:sc= -1.92 K(o=-4.5,f=-6.9!) USER MOD Set 2.2: A 141 GLN : amide:sc= -2.57! K(o=-4.5!,f=-2.8) USER MOD Set 3.1: A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 131 THR OG1 : rot 64:sc= 1.24 USER MOD Single : A 101 ASN : amide:sc= 0.388 K(o=0.39,f=-0.99) USER MOD Single : A 104 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 SER OG : rot 50:sc= -5.32! USER MOD Single : A 107 ASN : amide:sc= -4.45! C(o=-4.5!,f=-4.9!) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 HIS : no HD1:sc= -3.8! C(o=-3.8!,f=-2.6!) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 TYR OH : rot -166:sc= 0.112 USER MOD Single : A 121 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.689) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.05 K(o=-0.05,f=-1.8!) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -5.43! C(o=-5.4!,f=-10!) USER MOD Single : A 144 ASN : amide:sc= 0.623 K(o=0.62,f=0) USER MOD Single : A 148 MET CE :methyl 156:sc= -2.22! (180deg=-3.61!) USER MOD Single : A 151 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 GLN : amide:sc= 0 K(o=0,f=0.76) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 96 1.403 12.469 -1.829 1.00 0.00 N ATOM 60 CA GLY A 96 1.817 11.412 -0.924 1.00 0.00 C ATOM 61 C GLY A 96 0.697 10.437 -0.622 1.00 0.00 C ATOM 62 O GLY A 96 -0.442 10.843 -0.387 1.00 0.00 O ATOM 0 HA2 GLY A 96 2.657 10.872 -1.361 1.00 0.00 H new ATOM 0 HA3 GLY A 96 2.172 11.853 0.007 1.00 0.00 H new ATOM 66 N ILE A 97 1.019 9.148 -0.628 1.00 0.00 N ATOM 67 CA ILE A 97 0.031 8.112 -0.353 1.00 0.00 C ATOM 68 C ILE A 97 0.585 7.064 0.605 1.00 0.00 C ATOM 69 O ILE A 97 1.798 6.865 0.691 1.00 0.00 O ATOM 70 CB ILE A 97 -0.431 7.416 -1.647 1.00 0.00 C ATOM 71 CG1 ILE A 97 0.776 6.894 -2.429 1.00 0.00 C ATOM 72 CG2 ILE A 97 -1.249 8.373 -2.500 1.00 0.00 C ATOM 73 CD1 ILE A 97 0.400 6.098 -3.659 1.00 0.00 C ATOM 0 H ILE A 97 1.957 8.796 -0.820 1.00 0.00 H new ATOM 0 HA ILE A 97 -0.824 8.606 0.109 1.00 0.00 H new ATOM 0 HB ILE A 97 -1.062 6.568 -1.381 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.398 7.738 -2.728 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.381 6.269 -1.773 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -1.568 7.866 -3.411 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -2.125 8.700 -1.941 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -0.641 9.239 -2.761 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.305 5.760 -4.164 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -0.196 5.234 -3.365 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -0.180 6.726 -4.336 1.00 0.00 H new ATOM 85 N LEU A 98 -0.310 6.394 1.324 1.00 0.00 N ATOM 86 CA LEU A 98 0.090 5.363 2.275 1.00 0.00 C ATOM 87 C LEU A 98 -0.258 3.974 1.751 1.00 0.00 C ATOM 88 O LEU A 98 -1.393 3.717 1.349 1.00 0.00 O ATOM 89 CB LEU A 98 -0.591 5.597 3.625 1.00 0.00 C ATOM 90 CG LEU A 98 -0.384 6.976 4.252 1.00 0.00 C ATOM 91 CD1 LEU A 98 -1.160 7.092 5.555 1.00 0.00 C ATOM 92 CD2 LEU A 98 1.096 7.239 4.485 1.00 0.00 C ATOM 0 H LEU A 98 -1.317 6.547 1.266 1.00 0.00 H new ATOM 0 HA LEU A 98 1.171 5.421 2.404 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.662 5.433 3.502 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.231 4.844 4.326 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.762 7.729 3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.001 8.080 5.987 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.223 6.949 5.360 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -0.814 6.331 6.254 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.224 8.225 4.932 1.00 0.00 H new ATOM 0 HD22 LEU A 98 1.499 6.481 5.157 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.627 7.200 3.534 1.00 0.00 H new ATOM 104 N VAL A 99 0.726 3.080 1.760 1.00 0.00 N ATOM 105 CA VAL A 99 0.523 1.715 1.289 1.00 0.00 C ATOM 106 C VAL A 99 0.310 0.757 2.455 1.00 0.00 C ATOM 107 O VAL A 99 1.268 0.284 3.068 1.00 0.00 O ATOM 108 CB VAL A 99 1.719 1.228 0.450 1.00 0.00 C ATOM 109 CG1 VAL A 99 1.709 -0.289 0.335 1.00 0.00 C ATOM 110 CG2 VAL A 99 1.703 1.875 -0.927 1.00 0.00 C ATOM 0 H VAL A 99 1.672 3.277 2.088 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.370 1.725 0.664 1.00 0.00 H new ATOM 0 HB VAL A 99 2.639 1.524 0.955 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.561 -0.614 -0.261 1.00 0.00 H new ATOM 0 HG12 VAL A 99 1.773 -0.730 1.330 1.00 0.00 H new ATOM 0 HG13 VAL A 99 0.786 -0.611 -0.146 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.555 1.519 -1.506 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.779 1.612 -1.442 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.763 2.958 -0.821 1.00 0.00 H new ATOM 120 N LYS A 100 -0.952 0.473 2.758 1.00 0.00 N ATOM 121 CA LYS A 100 -1.293 -0.431 3.850 1.00 0.00 C ATOM 122 C LYS A 100 -1.750 -1.784 3.313 1.00 0.00 C ATOM 123 O LYS A 100 -2.134 -1.903 2.151 1.00 0.00 O ATOM 124 CB LYS A 100 -2.392 0.181 4.722 1.00 0.00 C ATOM 125 CG LYS A 100 -2.047 1.562 5.254 1.00 0.00 C ATOM 126 CD LYS A 100 -2.778 1.856 6.553 1.00 0.00 C ATOM 127 CE LYS A 100 -2.196 3.073 7.256 1.00 0.00 C ATOM 128 NZ LYS A 100 -1.048 2.711 8.133 1.00 0.00 N ATOM 0 H LYS A 100 -1.757 0.856 2.262 1.00 0.00 H new ATOM 0 HA LYS A 100 -0.400 -0.583 4.456 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -3.312 0.244 4.141 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -2.590 -0.484 5.563 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -0.971 1.632 5.416 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -2.307 2.315 4.510 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -3.835 2.024 6.347 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -2.715 0.989 7.211 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -1.870 3.800 6.513 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -2.972 3.553 7.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -0.680 3.567 8.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -1.365 2.036 8.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -0.297 2.276 7.560 1.00 0.00 H new ATOM 142 N ASN A 101 -1.706 -2.800 4.169 1.00 0.00 N ATOM 143 CA ASN A 101 -2.116 -4.144 3.781 1.00 0.00 C ATOM 144 C ASN A 101 -1.090 -4.778 2.847 1.00 0.00 C ATOM 145 O ASN A 101 -1.435 -5.279 1.776 1.00 0.00 O ATOM 146 CB ASN A 101 -3.486 -4.105 3.101 1.00 0.00 C ATOM 147 CG ASN A 101 -4.278 -5.380 3.321 1.00 0.00 C ATOM 148 OD1 ASN A 101 -4.251 -5.960 4.407 1.00 0.00 O ATOM 149 ND2 ASN A 101 -4.987 -5.822 2.289 1.00 0.00 N ATOM 0 H ASN A 101 -1.391 -2.718 5.136 1.00 0.00 H new ATOM 0 HA ASN A 101 -2.183 -4.751 4.684 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -4.054 -3.257 3.483 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -3.353 -3.943 2.031 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -5.539 -6.675 2.378 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -4.979 -5.308 1.408 1.00 0.00 H new ATOM 156 N LEU A 102 0.172 -4.752 3.259 1.00 0.00 N ATOM 157 CA LEU A 102 1.250 -5.325 2.460 1.00 0.00 C ATOM 158 C LEU A 102 1.472 -6.791 2.816 1.00 0.00 C ATOM 159 O LEU A 102 1.148 -7.245 3.913 1.00 0.00 O ATOM 160 CB LEU A 102 2.543 -4.535 2.672 1.00 0.00 C ATOM 161 CG LEU A 102 2.621 -3.175 1.979 1.00 0.00 C ATOM 162 CD1 LEU A 102 3.875 -2.428 2.406 1.00 0.00 C ATOM 163 CD2 LEU A 102 2.587 -3.344 0.467 1.00 0.00 C ATOM 0 H LEU A 102 0.475 -4.340 4.142 1.00 0.00 H new ATOM 0 HA LEU A 102 0.963 -5.265 1.410 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.681 -4.383 3.743 1.00 0.00 H new ATOM 0 HB3 LEU A 102 3.378 -5.145 2.327 1.00 0.00 H new ATOM 0 HG LEU A 102 1.754 -2.587 2.278 1.00 0.00 H new ATOM 0 HD11 LEU A 102 3.913 -1.462 1.902 1.00 0.00 H new ATOM 0 HD12 LEU A 102 3.857 -2.274 3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.755 -3.012 2.138 1.00 0.00 H new ATOM 0 HD21 LEU A 102 2.643 -2.365 -0.010 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.434 -3.952 0.150 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.659 -3.836 0.177 1.00 0.00 H new ATOM 175 N PRO A 103 2.040 -7.551 1.867 1.00 0.00 N ATOM 176 CA PRO A 103 2.321 -8.977 2.058 1.00 0.00 C ATOM 177 C PRO A 103 3.443 -9.218 3.062 1.00 0.00 C ATOM 178 O PRO A 103 3.801 -8.326 3.831 1.00 0.00 O ATOM 179 CB PRO A 103 2.740 -9.446 0.663 1.00 0.00 C ATOM 180 CG PRO A 103 3.261 -8.221 -0.007 1.00 0.00 C ATOM 181 CD PRO A 103 2.452 -7.076 0.536 1.00 0.00 C ATOM 0 HA PRO A 103 1.461 -9.511 2.461 1.00 0.00 H new ATOM 0 HB2 PRO A 103 3.503 -10.222 0.719 1.00 0.00 H new ATOM 0 HB3 PRO A 103 1.896 -9.868 0.117 1.00 0.00 H new ATOM 0 HG2 PRO A 103 4.322 -8.083 0.202 1.00 0.00 H new ATOM 0 HG3 PRO A 103 3.156 -8.294 -1.090 1.00 0.00 H new ATOM 0 HD2 PRO A 103 3.042 -6.162 0.600 1.00 0.00 H new ATOM 0 HD3 PRO A 103 1.592 -6.856 -0.096 1.00 0.00 H new ATOM 189 N GLN A 104 3.995 -10.427 3.046 1.00 0.00 N ATOM 190 CA GLN A 104 5.078 -10.783 3.956 1.00 0.00 C ATOM 191 C GLN A 104 6.431 -10.387 3.374 1.00 0.00 C ATOM 192 O GLN A 104 7.337 -9.985 4.103 1.00 0.00 O ATOM 193 CB GLN A 104 5.054 -12.285 4.247 1.00 0.00 C ATOM 194 CG GLN A 104 3.836 -12.732 5.038 1.00 0.00 C ATOM 195 CD GLN A 104 3.722 -14.241 5.130 1.00 0.00 C ATOM 196 OE1 GLN A 104 4.323 -14.868 6.002 1.00 0.00 O ATOM 197 NE2 GLN A 104 2.947 -14.833 4.228 1.00 0.00 N ATOM 0 H GLN A 104 3.711 -11.176 2.414 1.00 0.00 H new ATOM 0 HA GLN A 104 4.931 -10.237 4.888 1.00 0.00 H new ATOM 0 HB2 GLN A 104 5.084 -12.830 3.303 1.00 0.00 H new ATOM 0 HB3 GLN A 104 5.954 -12.554 4.799 1.00 0.00 H new ATOM 0 HG2 GLN A 104 3.886 -12.313 6.043 1.00 0.00 H new ATOM 0 HG3 GLN A 104 2.937 -12.331 4.570 1.00 0.00 H new ATOM 0 HE21 GLN A 104 2.467 -14.274 3.522 1.00 0.00 H new ATOM 0 HE22 GLN A 104 2.832 -15.846 4.241 1.00 0.00 H new ATOM 206 N ASP A 105 6.559 -10.504 2.057 1.00 0.00 N ATOM 207 CA ASP A 105 7.802 -10.158 1.376 1.00 0.00 C ATOM 208 C ASP A 105 7.648 -8.857 0.595 1.00 0.00 C ATOM 209 O ASP A 105 8.212 -8.701 -0.488 1.00 0.00 O ATOM 210 CB ASP A 105 8.224 -11.286 0.434 1.00 0.00 C ATOM 211 CG ASP A 105 8.064 -12.656 1.063 1.00 0.00 C ATOM 212 OD1 ASP A 105 8.088 -12.744 2.309 1.00 0.00 O ATOM 213 OD2 ASP A 105 7.914 -13.641 0.310 1.00 0.00 O ATOM 0 H ASP A 105 5.818 -10.836 1.440 1.00 0.00 H new ATOM 0 HA ASP A 105 8.575 -10.019 2.131 1.00 0.00 H new ATOM 0 HB2 ASP A 105 7.628 -11.236 -0.478 1.00 0.00 H new ATOM 0 HB3 ASP A 105 9.265 -11.142 0.143 1.00 0.00 H new ATOM 218 N SER A 106 6.881 -7.925 1.151 1.00 0.00 N ATOM 219 CA SER A 106 6.649 -6.639 0.504 1.00 0.00 C ATOM 220 C SER A 106 7.925 -5.801 0.488 1.00 0.00 C ATOM 221 O SER A 106 8.668 -5.764 1.468 1.00 0.00 O ATOM 222 CB SER A 106 5.534 -5.876 1.222 1.00 0.00 C ATOM 223 OG SER A 106 4.919 -4.938 0.357 1.00 0.00 O ATOM 0 H SER A 106 6.409 -8.036 2.049 1.00 0.00 H new ATOM 0 HA SER A 106 6.345 -6.828 -0.526 1.00 0.00 H new ATOM 0 HB2 SER A 106 4.787 -6.579 1.591 1.00 0.00 H new ATOM 0 HB3 SER A 106 5.943 -5.360 2.091 1.00 0.00 H new ATOM 0 HG SER A 106 4.676 -5.379 -0.484 1.00 0.00 H new ATOM 229 N ASN A 107 8.171 -5.131 -0.633 1.00 0.00 N ATOM 230 CA ASN A 107 9.356 -4.294 -0.778 1.00 0.00 C ATOM 231 C ASN A 107 9.123 -3.196 -1.811 1.00 0.00 C ATOM 232 O ASN A 107 8.137 -3.221 -2.549 1.00 0.00 O ATOM 233 CB ASN A 107 10.560 -5.145 -1.186 1.00 0.00 C ATOM 234 CG ASN A 107 10.591 -6.483 -0.472 1.00 0.00 C ATOM 235 OD1 ASN A 107 10.825 -6.550 0.735 1.00 0.00 O ATOM 236 ND2 ASN A 107 10.353 -7.557 -1.217 1.00 0.00 N ATOM 0 H ASN A 107 7.566 -5.151 -1.454 1.00 0.00 H new ATOM 0 HA ASN A 107 9.560 -3.826 0.185 1.00 0.00 H new ATOM 0 HB2 ASN A 107 10.536 -5.311 -2.263 1.00 0.00 H new ATOM 0 HB3 ASN A 107 11.478 -4.599 -0.969 1.00 0.00 H new ATOM 0 HD21 ASN A 107 10.360 -8.484 -0.792 1.00 0.00 H new ATOM 0 HD22 ASN A 107 10.164 -7.454 -2.214 1.00 0.00 H new ATOM 243 N CYS A 108 10.037 -2.232 -1.859 1.00 0.00 N ATOM 244 CA CYS A 108 9.933 -1.124 -2.800 1.00 0.00 C ATOM 245 C CYS A 108 10.098 -1.613 -4.236 1.00 0.00 C ATOM 246 O CYS A 108 9.237 -1.380 -5.084 1.00 0.00 O ATOM 247 CB CYS A 108 10.987 -0.061 -2.488 1.00 0.00 C ATOM 248 SG CYS A 108 10.427 1.221 -1.320 1.00 0.00 S ATOM 0 H CYS A 108 10.859 -2.196 -1.256 1.00 0.00 H new ATOM 0 HA CYS A 108 8.941 -0.684 -2.696 1.00 0.00 H new ATOM 0 HB2 CYS A 108 11.871 -0.550 -2.078 1.00 0.00 H new ATOM 0 HB3 CYS A 108 11.291 0.418 -3.419 1.00 0.00 H new ATOM 253 N GLN A 109 11.210 -2.293 -4.500 1.00 0.00 N ATOM 254 CA GLN A 109 11.488 -2.814 -5.833 1.00 0.00 C ATOM 255 C GLN A 109 10.201 -3.244 -6.529 1.00 0.00 C ATOM 256 O GLN A 109 10.054 -3.078 -7.739 1.00 0.00 O ATOM 257 CB GLN A 109 12.456 -3.996 -5.749 1.00 0.00 C ATOM 258 CG GLN A 109 13.842 -3.613 -5.257 1.00 0.00 C ATOM 259 CD GLN A 109 14.690 -2.975 -6.340 1.00 0.00 C ATOM 260 OE1 GLN A 109 15.311 -3.667 -7.147 1.00 0.00 O ATOM 261 NE2 GLN A 109 14.720 -1.648 -6.364 1.00 0.00 N ATOM 0 H GLN A 109 11.932 -2.496 -3.809 1.00 0.00 H new ATOM 0 HA GLN A 109 11.947 -2.018 -6.419 1.00 0.00 H new ATOM 0 HB2 GLN A 109 12.038 -4.750 -5.082 1.00 0.00 H new ATOM 0 HB3 GLN A 109 12.543 -4.454 -6.734 1.00 0.00 H new ATOM 0 HG2 GLN A 109 13.748 -2.921 -4.420 1.00 0.00 H new ATOM 0 HG3 GLN A 109 14.348 -4.502 -4.881 1.00 0.00 H new ATOM 0 HE21 GLN A 109 14.190 -1.113 -5.676 1.00 0.00 H new ATOM 0 HE22 GLN A 109 15.273 -1.163 -7.071 1.00 0.00 H new ATOM 270 N GLU A 110 9.272 -3.798 -5.755 1.00 0.00 N ATOM 271 CA GLU A 110 7.998 -4.253 -6.299 1.00 0.00 C ATOM 272 C GLU A 110 7.025 -3.087 -6.454 1.00 0.00 C ATOM 273 O GLU A 110 6.528 -2.820 -7.548 1.00 0.00 O ATOM 274 CB GLU A 110 7.385 -5.325 -5.395 1.00 0.00 C ATOM 275 CG GLU A 110 6.462 -6.284 -6.127 1.00 0.00 C ATOM 276 CD GLU A 110 7.012 -6.708 -7.475 1.00 0.00 C ATOM 277 OE1 GLU A 110 8.160 -7.197 -7.521 1.00 0.00 O ATOM 278 OE2 GLU A 110 6.293 -6.551 -8.484 1.00 0.00 O ATOM 0 H GLU A 110 9.378 -3.942 -4.751 1.00 0.00 H new ATOM 0 HA GLU A 110 8.185 -4.682 -7.283 1.00 0.00 H new ATOM 0 HB2 GLU A 110 8.187 -5.894 -4.925 1.00 0.00 H new ATOM 0 HB3 GLU A 110 6.828 -4.838 -4.594 1.00 0.00 H new ATOM 0 HG2 GLU A 110 6.300 -7.168 -5.511 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.490 -5.811 -6.268 1.00 0.00 H new ATOM 285 N VAL A 111 6.759 -2.395 -5.350 1.00 0.00 N ATOM 286 CA VAL A 111 5.847 -1.258 -5.363 1.00 0.00 C ATOM 287 C VAL A 111 6.168 -0.309 -6.512 1.00 0.00 C ATOM 288 O VAL A 111 5.279 0.100 -7.260 1.00 0.00 O ATOM 289 CB VAL A 111 5.904 -0.478 -4.036 1.00 0.00 C ATOM 290 CG1 VAL A 111 5.051 0.779 -4.117 1.00 0.00 C ATOM 291 CG2 VAL A 111 5.459 -1.361 -2.880 1.00 0.00 C ATOM 0 H VAL A 111 7.162 -2.602 -4.436 1.00 0.00 H new ATOM 0 HA VAL A 111 4.843 -1.659 -5.497 1.00 0.00 H new ATOM 0 HB VAL A 111 6.936 -0.176 -3.857 1.00 0.00 H new ATOM 0 HG11 VAL A 111 5.104 1.316 -3.170 1.00 0.00 H new ATOM 0 HG12 VAL A 111 5.421 1.419 -4.918 1.00 0.00 H new ATOM 0 HG13 VAL A 111 4.016 0.504 -4.320 1.00 0.00 H new ATOM 0 HG21 VAL A 111 5.505 -0.794 -1.950 1.00 0.00 H new ATOM 0 HG22 VAL A 111 4.436 -1.695 -3.050 1.00 0.00 H new ATOM 0 HG23 VAL A 111 6.117 -2.227 -2.810 1.00 0.00 H new ATOM 301 N HIS A 112 7.444 0.039 -6.647 1.00 0.00 N ATOM 302 CA HIS A 112 7.883 0.940 -7.706 1.00 0.00 C ATOM 303 C HIS A 112 7.231 0.573 -9.036 1.00 0.00 C ATOM 304 O HIS A 112 6.475 1.360 -9.606 1.00 0.00 O ATOM 305 CB HIS A 112 9.405 0.898 -7.842 1.00 0.00 C ATOM 306 CG HIS A 112 9.999 2.183 -8.330 1.00 0.00 C ATOM 307 ND1 HIS A 112 10.085 2.513 -9.666 1.00 0.00 N ATOM 308 CD2 HIS A 112 10.536 3.224 -7.651 1.00 0.00 C ATOM 309 CE1 HIS A 112 10.651 3.701 -9.788 1.00 0.00 C ATOM 310 NE2 HIS A 112 10.934 4.154 -8.580 1.00 0.00 N ATOM 0 H HIS A 112 8.192 -0.290 -6.036 1.00 0.00 H new ATOM 0 HA HIS A 112 7.578 1.952 -7.439 1.00 0.00 H new ATOM 0 HB2 HIS A 112 9.841 0.650 -6.874 1.00 0.00 H new ATOM 0 HB3 HIS A 112 9.678 0.097 -8.529 1.00 0.00 H new ATOM 0 HD2 HIS A 112 10.633 3.308 -6.579 1.00 0.00 H new ATOM 0 HE1 HIS A 112 10.849 4.214 -10.718 1.00 0.00 H new ATOM 0 HE2 HIS A 112 11.376 5.049 -8.371 1.00 0.00 H new ATOM 319 N ASP A 113 7.530 -0.626 -9.525 1.00 0.00 N ATOM 320 CA ASP A 113 6.974 -1.097 -10.788 1.00 0.00 C ATOM 321 C ASP A 113 5.459 -0.915 -10.816 1.00 0.00 C ATOM 322 O ASP A 113 4.895 -0.465 -11.814 1.00 0.00 O ATOM 323 CB ASP A 113 7.327 -2.569 -11.008 1.00 0.00 C ATOM 324 CG ASP A 113 6.285 -3.507 -10.431 1.00 0.00 C ATOM 325 OD1 ASP A 113 5.130 -3.476 -10.905 1.00 0.00 O ATOM 326 OD2 ASP A 113 6.625 -4.272 -9.505 1.00 0.00 O ATOM 0 H ASP A 113 8.154 -1.289 -9.066 1.00 0.00 H new ATOM 0 HA ASP A 113 7.409 -0.503 -11.592 1.00 0.00 H new ATOM 0 HB2 ASP A 113 7.431 -2.759 -12.076 1.00 0.00 H new ATOM 0 HB3 ASP A 113 8.294 -2.780 -10.551 1.00 0.00 H new ATOM 331 N LEU A 114 4.806 -1.268 -9.714 1.00 0.00 N ATOM 332 CA LEU A 114 3.356 -1.144 -9.612 1.00 0.00 C ATOM 333 C LEU A 114 2.913 0.295 -9.855 1.00 0.00 C ATOM 334 O LEU A 114 1.982 0.549 -10.620 1.00 0.00 O ATOM 335 CB LEU A 114 2.880 -1.611 -8.235 1.00 0.00 C ATOM 336 CG LEU A 114 1.380 -1.490 -7.967 1.00 0.00 C ATOM 337 CD1 LEU A 114 0.596 -2.406 -8.894 1.00 0.00 C ATOM 338 CD2 LEU A 114 1.071 -1.810 -6.512 1.00 0.00 C ATOM 0 H LEU A 114 5.257 -1.642 -8.879 1.00 0.00 H new ATOM 0 HA LEU A 114 2.908 -1.776 -10.378 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.169 -2.654 -8.108 1.00 0.00 H new ATOM 0 HB3 LEU A 114 3.412 -1.038 -7.475 1.00 0.00 H new ATOM 0 HG LEU A 114 1.077 -0.462 -8.165 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -0.470 -2.306 -8.688 1.00 0.00 H new ATOM 0 HD12 LEU A 114 0.793 -2.130 -9.930 1.00 0.00 H new ATOM 0 HD13 LEU A 114 0.902 -3.439 -8.729 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.001 -1.719 -6.339 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.389 -2.828 -6.288 1.00 0.00 H new ATOM 0 HD23 LEU A 114 1.603 -1.113 -5.865 1.00 0.00 H new ATOM 350 N LEU A 115 3.588 1.234 -9.200 1.00 0.00 N ATOM 351 CA LEU A 115 3.266 2.649 -9.346 1.00 0.00 C ATOM 352 C LEU A 115 4.209 3.322 -10.339 1.00 0.00 C ATOM 353 O LEU A 115 4.651 4.451 -10.125 1.00 0.00 O ATOM 354 CB LEU A 115 3.348 3.353 -7.991 1.00 0.00 C ATOM 355 CG LEU A 115 2.142 3.176 -7.068 1.00 0.00 C ATOM 356 CD1 LEU A 115 2.484 3.611 -5.652 1.00 0.00 C ATOM 357 CD2 LEU A 115 0.948 3.959 -7.595 1.00 0.00 C ATOM 0 H LEU A 115 4.361 1.041 -8.563 1.00 0.00 H new ATOM 0 HA LEU A 115 2.248 2.727 -9.728 1.00 0.00 H new ATOM 0 HB2 LEU A 115 4.235 2.992 -7.470 1.00 0.00 H new ATOM 0 HB3 LEU A 115 3.493 4.419 -8.166 1.00 0.00 H new ATOM 0 HG LEU A 115 1.878 2.119 -7.047 1.00 0.00 H new ATOM 0 HD11 LEU A 115 1.613 3.478 -5.010 1.00 0.00 H new ATOM 0 HD12 LEU A 115 3.309 3.006 -5.275 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.775 4.661 -5.654 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.099 3.822 -6.926 1.00 0.00 H new ATOM 0 HD22 LEU A 115 1.201 5.018 -7.647 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.688 3.599 -8.590 1.00 0.00 H new ATOM 369 N LYS A 116 4.511 2.623 -11.428 1.00 0.00 N ATOM 370 CA LYS A 116 5.397 3.153 -12.457 1.00 0.00 C ATOM 371 C LYS A 116 4.762 4.348 -13.159 1.00 0.00 C ATOM 372 O LYS A 116 5.407 5.379 -13.356 1.00 0.00 O ATOM 373 CB LYS A 116 5.732 2.065 -13.480 1.00 0.00 C ATOM 374 CG LYS A 116 4.510 1.476 -14.163 1.00 0.00 C ATOM 375 CD LYS A 116 4.898 0.439 -15.204 1.00 0.00 C ATOM 376 CE LYS A 116 5.537 1.087 -16.424 1.00 0.00 C ATOM 377 NZ LYS A 116 5.382 0.246 -17.643 1.00 0.00 N ATOM 0 H LYS A 116 4.154 1.687 -11.621 1.00 0.00 H new ATOM 0 HA LYS A 116 6.316 3.485 -11.974 1.00 0.00 H new ATOM 0 HB2 LYS A 116 6.396 2.482 -14.237 1.00 0.00 H new ATOM 0 HB3 LYS A 116 6.280 1.265 -12.981 1.00 0.00 H new ATOM 0 HG2 LYS A 116 3.860 1.018 -13.417 1.00 0.00 H new ATOM 0 HG3 LYS A 116 3.938 2.273 -14.638 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.593 -0.277 -14.765 1.00 0.00 H new ATOM 0 HD3 LYS A 116 4.014 -0.121 -15.509 1.00 0.00 H new ATOM 0 HE2 LYS A 116 5.084 2.063 -16.596 1.00 0.00 H new ATOM 0 HE3 LYS A 116 6.596 1.257 -16.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 5.830 0.722 -18.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 5.837 -0.677 -17.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 4.371 0.105 -17.841 1.00 0.00 H new ATOM 391 N ASP A 117 3.496 4.204 -13.533 1.00 0.00 N ATOM 392 CA ASP A 117 2.773 5.274 -14.212 1.00 0.00 C ATOM 393 C ASP A 117 3.029 6.617 -13.535 1.00 0.00 C ATOM 394 O ASP A 117 3.295 7.618 -14.201 1.00 0.00 O ATOM 395 CB ASP A 117 1.273 4.974 -14.227 1.00 0.00 C ATOM 396 CG ASP A 117 0.928 3.793 -15.113 1.00 0.00 C ATOM 397 OD1 ASP A 117 0.677 4.008 -16.317 1.00 0.00 O ATOM 398 OD2 ASP A 117 0.907 2.653 -14.601 1.00 0.00 O ATOM 0 H ASP A 117 2.949 3.357 -13.378 1.00 0.00 H new ATOM 0 HA ASP A 117 3.135 5.330 -15.239 1.00 0.00 H new ATOM 0 HB2 ASP A 117 0.935 4.773 -13.210 1.00 0.00 H new ATOM 0 HB3 ASP A 117 0.733 5.855 -14.574 1.00 0.00 H new ATOM 403 N TYR A 118 2.945 6.631 -12.210 1.00 0.00 N ATOM 404 CA TYR A 118 3.163 7.852 -11.443 1.00 0.00 C ATOM 405 C TYR A 118 4.645 8.044 -11.135 1.00 0.00 C ATOM 406 O TYR A 118 5.440 7.109 -11.246 1.00 0.00 O ATOM 407 CB TYR A 118 2.362 7.812 -10.141 1.00 0.00 C ATOM 408 CG TYR A 118 0.931 7.359 -10.324 1.00 0.00 C ATOM 409 CD1 TYR A 118 -0.073 8.268 -10.634 1.00 0.00 C ATOM 410 CD2 TYR A 118 0.583 6.020 -10.189 1.00 0.00 C ATOM 411 CE1 TYR A 118 -1.381 7.858 -10.802 1.00 0.00 C ATOM 412 CE2 TYR A 118 -0.722 5.601 -10.356 1.00 0.00 C ATOM 413 CZ TYR A 118 -1.701 6.523 -10.662 1.00 0.00 C ATOM 414 OH TYR A 118 -3.003 6.110 -10.830 1.00 0.00 O ATOM 0 H TYR A 118 2.727 5.811 -11.644 1.00 0.00 H new ATOM 0 HA TYR A 118 2.823 8.694 -12.045 1.00 0.00 H new ATOM 0 HB2 TYR A 118 2.859 7.143 -9.439 1.00 0.00 H new ATOM 0 HB3 TYR A 118 2.365 8.805 -9.692 1.00 0.00 H new ATOM 0 HD1 TYR A 118 0.174 9.313 -10.746 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.347 5.295 -9.949 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -2.149 8.578 -11.042 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -0.975 4.557 -10.248 1.00 0.00 H new ATOM 0 HH TYR A 118 -3.104 5.198 -10.485 1.00 0.00 H new ATOM 424 N ASP A 119 5.010 9.261 -10.747 1.00 0.00 N ATOM 425 CA ASP A 119 6.395 9.577 -10.421 1.00 0.00 C ATOM 426 C ASP A 119 6.676 9.327 -8.943 1.00 0.00 C ATOM 427 O ASP A 119 5.972 9.838 -8.071 1.00 0.00 O ATOM 428 CB ASP A 119 6.705 11.032 -10.773 1.00 0.00 C ATOM 429 CG ASP A 119 8.145 11.406 -10.477 1.00 0.00 C ATOM 430 OD1 ASP A 119 9.043 10.593 -10.781 1.00 0.00 O ATOM 431 OD2 ASP A 119 8.373 12.511 -9.942 1.00 0.00 O ATOM 0 H ASP A 119 4.365 10.045 -10.651 1.00 0.00 H new ATOM 0 HA ASP A 119 7.039 8.924 -11.010 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.500 11.199 -11.830 1.00 0.00 H new ATOM 0 HB3 ASP A 119 6.040 11.688 -10.212 1.00 0.00 H new ATOM 436 N LEU A 120 7.708 8.536 -8.667 1.00 0.00 N ATOM 437 CA LEU A 120 8.082 8.217 -7.294 1.00 0.00 C ATOM 438 C LEU A 120 9.259 9.073 -6.837 1.00 0.00 C ATOM 439 O LEU A 120 10.291 9.136 -7.505 1.00 0.00 O ATOM 440 CB LEU A 120 8.437 6.734 -7.172 1.00 0.00 C ATOM 441 CG LEU A 120 7.270 5.753 -7.286 1.00 0.00 C ATOM 442 CD1 LEU A 120 6.827 5.615 -8.734 1.00 0.00 C ATOM 443 CD2 LEU A 120 7.656 4.397 -6.713 1.00 0.00 C ATOM 0 H LEU A 120 8.300 8.104 -9.376 1.00 0.00 H new ATOM 0 HA LEU A 120 7.228 8.434 -6.652 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.167 6.491 -7.944 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.926 6.576 -6.211 1.00 0.00 H new ATOM 0 HG LEU A 120 6.433 6.145 -6.708 1.00 0.00 H new ATOM 0 HD11 LEU A 120 5.996 4.913 -8.795 1.00 0.00 H new ATOM 0 HD12 LEU A 120 6.509 6.587 -9.112 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.658 5.246 -9.335 1.00 0.00 H new ATOM 0 HD21 LEU A 120 6.814 3.711 -6.802 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.508 3.999 -7.263 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.923 4.509 -5.662 1.00 0.00 H new ATOM 455 N LYS A 121 9.097 9.729 -5.692 1.00 0.00 N ATOM 456 CA LYS A 121 10.147 10.579 -5.143 1.00 0.00 C ATOM 457 C LYS A 121 10.880 9.872 -4.007 1.00 0.00 C ATOM 458 O LYS A 121 12.110 9.849 -3.969 1.00 0.00 O ATOM 459 CB LYS A 121 9.553 11.896 -4.639 1.00 0.00 C ATOM 460 CG LYS A 121 8.811 12.678 -5.709 1.00 0.00 C ATOM 461 CD LYS A 121 7.890 13.722 -5.100 1.00 0.00 C ATOM 462 CE LYS A 121 8.624 15.029 -4.842 1.00 0.00 C ATOM 463 NZ LYS A 121 9.364 15.005 -3.550 1.00 0.00 N ATOM 0 H LYS A 121 8.249 9.688 -5.127 1.00 0.00 H new ATOM 0 HA LYS A 121 10.862 10.790 -5.938 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.870 11.685 -3.816 1.00 0.00 H new ATOM 0 HB3 LYS A 121 10.354 12.516 -4.238 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.529 13.165 -6.368 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.228 11.992 -6.324 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.049 13.902 -5.769 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.478 13.344 -4.164 1.00 0.00 H new ATOM 0 HE2 LYS A 121 9.322 15.220 -5.657 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.909 15.852 -4.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.428 15.970 -3.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.860 14.398 -2.873 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.322 14.630 -3.705 1.00 0.00 H new ATOM 477 N TYR A 122 10.117 9.296 -3.085 1.00 0.00 N ATOM 478 CA TYR A 122 10.695 8.589 -1.948 1.00 0.00 C ATOM 479 C TYR A 122 9.799 7.433 -1.513 1.00 0.00 C ATOM 480 O TYR A 122 8.574 7.552 -1.497 1.00 0.00 O ATOM 481 CB TYR A 122 10.909 9.551 -0.778 1.00 0.00 C ATOM 482 CG TYR A 122 11.888 9.040 0.254 1.00 0.00 C ATOM 483 CD1 TYR A 122 13.258 9.088 0.025 1.00 0.00 C ATOM 484 CD2 TYR A 122 11.444 8.511 1.460 1.00 0.00 C ATOM 485 CE1 TYR A 122 14.156 8.622 0.965 1.00 0.00 C ATOM 486 CE2 TYR A 122 12.335 8.044 2.407 1.00 0.00 C ATOM 487 CZ TYR A 122 13.690 8.101 2.154 1.00 0.00 C ATOM 488 OH TYR A 122 14.582 7.637 3.094 1.00 0.00 O ATOM 0 H TYR A 122 9.097 9.305 -3.102 1.00 0.00 H new ATOM 0 HA TYR A 122 11.658 8.182 -2.257 1.00 0.00 H new ATOM 0 HB2 TYR A 122 11.266 10.506 -1.164 1.00 0.00 H new ATOM 0 HB3 TYR A 122 9.951 9.741 -0.295 1.00 0.00 H new ATOM 0 HD1 TYR A 122 13.627 9.497 -0.904 1.00 0.00 H new ATOM 0 HD2 TYR A 122 10.384 8.464 1.660 1.00 0.00 H new ATOM 0 HE1 TYR A 122 15.217 8.665 0.770 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.973 7.637 3.340 1.00 0.00 H new ATOM 0 HH TYR A 122 14.091 7.304 3.874 1.00 0.00 H new ATOM 498 N CYS A 123 10.421 6.312 -1.160 1.00 0.00 N ATOM 499 CA CYS A 123 9.683 5.133 -0.725 1.00 0.00 C ATOM 500 C CYS A 123 10.336 4.506 0.504 1.00 0.00 C ATOM 501 O CYS A 123 11.538 4.238 0.512 1.00 0.00 O ATOM 502 CB CYS A 123 9.608 4.106 -1.856 1.00 0.00 C ATOM 503 SG CYS A 123 11.036 2.978 -1.932 1.00 0.00 S ATOM 0 H CYS A 123 11.434 6.196 -1.167 1.00 0.00 H new ATOM 0 HA CYS A 123 8.673 5.445 -0.459 1.00 0.00 H new ATOM 0 HB2 CYS A 123 8.699 3.516 -1.737 1.00 0.00 H new ATOM 0 HB3 CYS A 123 9.524 4.633 -2.806 1.00 0.00 H new ATOM 508 N TYR A 124 9.536 4.275 1.539 1.00 0.00 N ATOM 509 CA TYR A 124 10.036 3.682 2.774 1.00 0.00 C ATOM 510 C TYR A 124 9.155 2.516 3.213 1.00 0.00 C ATOM 511 O TYR A 124 8.047 2.713 3.713 1.00 0.00 O ATOM 512 CB TYR A 124 10.097 4.735 3.881 1.00 0.00 C ATOM 513 CG TYR A 124 10.963 4.330 5.053 1.00 0.00 C ATOM 514 CD1 TYR A 124 10.577 3.304 5.907 1.00 0.00 C ATOM 515 CD2 TYR A 124 12.168 4.974 5.306 1.00 0.00 C ATOM 516 CE1 TYR A 124 11.365 2.933 6.979 1.00 0.00 C ATOM 517 CE2 TYR A 124 12.963 4.608 6.375 1.00 0.00 C ATOM 518 CZ TYR A 124 12.557 3.587 7.209 1.00 0.00 C ATOM 519 OH TYR A 124 13.345 3.219 8.275 1.00 0.00 O ATOM 0 H TYR A 124 8.539 4.489 1.547 1.00 0.00 H new ATOM 0 HA TYR A 124 11.041 3.304 2.586 1.00 0.00 H new ATOM 0 HB2 TYR A 124 10.477 5.667 3.464 1.00 0.00 H new ATOM 0 HB3 TYR A 124 9.087 4.934 4.238 1.00 0.00 H new ATOM 0 HD1 TYR A 124 9.645 2.788 5.730 1.00 0.00 H new ATOM 0 HD2 TYR A 124 12.489 5.774 4.656 1.00 0.00 H new ATOM 0 HE1 TYR A 124 11.049 2.134 7.634 1.00 0.00 H new ATOM 0 HE2 TYR A 124 13.897 5.118 6.557 1.00 0.00 H new ATOM 0 HH TYR A 124 14.150 3.777 8.295 1.00 0.00 H new ATOM 529 N VAL A 125 9.657 1.300 3.023 1.00 0.00 N ATOM 530 CA VAL A 125 8.918 0.101 3.401 1.00 0.00 C ATOM 531 C VAL A 125 9.111 -0.221 4.879 1.00 0.00 C ATOM 532 O VAL A 125 10.240 -0.300 5.365 1.00 0.00 O ATOM 533 CB VAL A 125 9.353 -1.115 2.561 1.00 0.00 C ATOM 534 CG1 VAL A 125 8.604 -2.363 3.000 1.00 0.00 C ATOM 535 CG2 VAL A 125 9.134 -0.844 1.080 1.00 0.00 C ATOM 0 H VAL A 125 10.572 1.119 2.610 1.00 0.00 H new ATOM 0 HA VAL A 125 7.864 0.306 3.211 1.00 0.00 H new ATOM 0 HB VAL A 125 10.418 -1.285 2.723 1.00 0.00 H new ATOM 0 HG11 VAL A 125 8.925 -3.211 2.395 1.00 0.00 H new ATOM 0 HG12 VAL A 125 8.817 -2.565 4.050 1.00 0.00 H new ATOM 0 HG13 VAL A 125 7.533 -2.209 2.870 1.00 0.00 H new ATOM 0 HG21 VAL A 125 9.446 -1.713 0.501 1.00 0.00 H new ATOM 0 HG22 VAL A 125 8.077 -0.648 0.898 1.00 0.00 H new ATOM 0 HG23 VAL A 125 9.721 0.023 0.778 1.00 0.00 H new ATOM 545 N ASP A 126 8.004 -0.407 5.588 1.00 0.00 N ATOM 546 CA ASP A 126 8.050 -0.722 7.011 1.00 0.00 C ATOM 547 C ASP A 126 7.383 -2.064 7.292 1.00 0.00 C ATOM 548 O ASP A 126 6.161 -2.147 7.417 1.00 0.00 O ATOM 549 CB ASP A 126 7.368 0.381 7.822 1.00 0.00 C ATOM 550 CG ASP A 126 7.960 0.529 9.210 1.00 0.00 C ATOM 551 OD1 ASP A 126 9.072 1.088 9.325 1.00 0.00 O ATOM 552 OD2 ASP A 126 7.312 0.087 10.181 1.00 0.00 O ATOM 0 H ASP A 126 7.063 -0.345 5.200 1.00 0.00 H new ATOM 0 HA ASP A 126 9.096 -0.787 7.310 1.00 0.00 H new ATOM 0 HB2 ASP A 126 7.457 1.328 7.289 1.00 0.00 H new ATOM 0 HB3 ASP A 126 6.304 0.161 7.906 1.00 0.00 H new ATOM 557 N ARG A 127 8.193 -3.113 7.391 1.00 0.00 N ATOM 558 CA ARG A 127 7.681 -4.452 7.655 1.00 0.00 C ATOM 559 C ARG A 127 6.984 -4.510 9.011 1.00 0.00 C ATOM 560 O ARG A 127 5.914 -5.103 9.146 1.00 0.00 O ATOM 561 CB ARG A 127 8.818 -5.475 7.610 1.00 0.00 C ATOM 562 CG ARG A 127 9.334 -5.751 6.208 1.00 0.00 C ATOM 563 CD ARG A 127 8.501 -6.813 5.507 1.00 0.00 C ATOM 564 NE ARG A 127 7.093 -6.433 5.417 1.00 0.00 N ATOM 565 CZ ARG A 127 6.634 -5.505 4.584 1.00 0.00 C ATOM 566 NH1 ARG A 127 7.467 -4.866 3.774 1.00 0.00 N ATOM 567 NH2 ARG A 127 5.340 -5.215 4.560 1.00 0.00 N ATOM 0 H ARG A 127 9.207 -3.061 7.292 1.00 0.00 H new ATOM 0 HA ARG A 127 6.953 -4.694 6.881 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.642 -5.117 8.227 1.00 0.00 H new ATOM 0 HB3 ARG A 127 8.472 -6.410 8.051 1.00 0.00 H new ATOM 0 HG2 ARG A 127 9.317 -4.830 5.625 1.00 0.00 H new ATOM 0 HG3 ARG A 127 10.373 -6.077 6.259 1.00 0.00 H new ATOM 0 HD2 ARG A 127 8.896 -6.981 4.505 1.00 0.00 H new ATOM 0 HD3 ARG A 127 8.588 -7.756 6.046 1.00 0.00 H new ATOM 0 HE ARG A 127 6.426 -6.906 6.027 1.00 0.00 H new ATOM 0 HH11 ARG A 127 8.463 -5.086 3.789 1.00 0.00 H new ATOM 0 HH12 ARG A 127 7.112 -4.154 3.136 1.00 0.00 H new ATOM 0 HH21 ARG A 127 4.696 -5.704 5.181 1.00 0.00 H new ATOM 0 HH22 ARG A 127 4.989 -4.502 3.920 1.00 0.00 H new ATOM 581 N ASN A 128 7.598 -3.889 10.013 1.00 0.00 N ATOM 582 CA ASN A 128 7.037 -3.871 11.359 1.00 0.00 C ATOM 583 C ASN A 128 5.547 -3.545 11.323 1.00 0.00 C ATOM 584 O ASN A 128 4.746 -4.173 12.016 1.00 0.00 O ATOM 585 CB ASN A 128 7.773 -2.848 12.227 1.00 0.00 C ATOM 586 CG ASN A 128 7.616 -3.128 13.709 1.00 0.00 C ATOM 587 OD1 ASN A 128 7.215 -4.222 14.107 1.00 0.00 O ATOM 588 ND2 ASN A 128 7.933 -2.137 14.535 1.00 0.00 N ATOM 0 H ASN A 128 8.484 -3.392 9.918 1.00 0.00 H new ATOM 0 HA ASN A 128 7.164 -4.863 11.792 1.00 0.00 H new ATOM 0 HB2 ASN A 128 8.832 -2.852 11.969 1.00 0.00 H new ATOM 0 HB3 ASN A 128 7.395 -1.850 12.007 1.00 0.00 H new ATOM 0 HD21 ASN A 128 7.848 -2.266 15.543 1.00 0.00 H new ATOM 0 HD22 ASN A 128 8.261 -1.247 14.161 1.00 0.00 H new ATOM 595 N LYS A 129 5.182 -2.559 10.511 1.00 0.00 N ATOM 596 CA LYS A 129 3.789 -2.150 10.381 1.00 0.00 C ATOM 597 C LYS A 129 3.251 -2.479 8.992 1.00 0.00 C ATOM 598 O LYS A 129 2.193 -1.992 8.594 1.00 0.00 O ATOM 599 CB LYS A 129 3.649 -0.650 10.651 1.00 0.00 C ATOM 600 CG LYS A 129 3.573 -0.302 12.128 1.00 0.00 C ATOM 601 CD LYS A 129 2.160 -0.457 12.665 1.00 0.00 C ATOM 602 CE LYS A 129 1.303 0.756 12.337 1.00 0.00 C ATOM 603 NZ LYS A 129 0.060 0.795 13.156 1.00 0.00 N ATOM 0 H LYS A 129 5.833 -2.028 9.932 1.00 0.00 H new ATOM 0 HA LYS A 129 3.205 -2.702 11.117 1.00 0.00 H new ATOM 0 HB2 LYS A 129 4.497 -0.129 10.207 1.00 0.00 H new ATOM 0 HB3 LYS A 129 2.752 -0.282 10.153 1.00 0.00 H new ATOM 0 HG2 LYS A 129 4.249 -0.946 12.690 1.00 0.00 H new ATOM 0 HG3 LYS A 129 3.910 0.723 12.279 1.00 0.00 H new ATOM 0 HD2 LYS A 129 1.704 -1.351 12.240 1.00 0.00 H new ATOM 0 HD3 LYS A 129 2.194 -0.599 13.745 1.00 0.00 H new ATOM 0 HE2 LYS A 129 1.880 1.665 12.509 1.00 0.00 H new ATOM 0 HE3 LYS A 129 1.041 0.740 11.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -0.496 1.636 12.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -0.503 -0.060 12.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 0.310 0.836 14.165 1.00 0.00 H new ATOM 617 N ARG A 130 3.987 -3.310 8.260 1.00 0.00 N ATOM 618 CA ARG A 130 3.583 -3.704 6.916 1.00 0.00 C ATOM 619 C ARG A 130 2.987 -2.522 6.158 1.00 0.00 C ATOM 620 O ARG A 130 1.864 -2.594 5.656 1.00 0.00 O ATOM 621 CB ARG A 130 2.568 -4.847 6.980 1.00 0.00 C ATOM 622 CG ARG A 130 3.145 -6.144 7.524 1.00 0.00 C ATOM 623 CD ARG A 130 2.183 -7.306 7.330 1.00 0.00 C ATOM 624 NE ARG A 130 2.495 -8.428 8.212 1.00 0.00 N ATOM 625 CZ ARG A 130 1.897 -9.611 8.135 1.00 0.00 C ATOM 626 NH1 ARG A 130 0.961 -9.826 7.222 1.00 0.00 N ATOM 627 NH2 ARG A 130 2.236 -10.583 8.973 1.00 0.00 N ATOM 0 H ARG A 130 4.865 -3.723 8.575 1.00 0.00 H new ATOM 0 HA ARG A 130 4.471 -4.044 6.383 1.00 0.00 H new ATOM 0 HB2 ARG A 130 1.729 -4.542 7.605 1.00 0.00 H new ATOM 0 HB3 ARG A 130 2.172 -5.026 5.980 1.00 0.00 H new ATOM 0 HG2 ARG A 130 4.088 -6.363 7.022 1.00 0.00 H new ATOM 0 HG3 ARG A 130 3.368 -6.028 8.585 1.00 0.00 H new ATOM 0 HD2 ARG A 130 1.164 -6.969 7.519 1.00 0.00 H new ATOM 0 HD3 ARG A 130 2.221 -7.639 6.293 1.00 0.00 H new ATOM 0 HE ARG A 130 3.211 -8.295 8.926 1.00 0.00 H new ATOM 0 HH11 ARG A 130 0.698 -9.082 6.576 1.00 0.00 H new ATOM 0 HH12 ARG A 130 0.503 -10.736 7.165 1.00 0.00 H new ATOM 0 HH21 ARG A 130 2.956 -10.421 9.677 1.00 0.00 H new ATOM 0 HH22 ARG A 130 1.776 -11.491 8.913 1.00 0.00 H new ATOM 641 N THR A 131 3.744 -1.432 6.080 1.00 0.00 N ATOM 642 CA THR A 131 3.291 -0.234 5.386 1.00 0.00 C ATOM 643 C THR A 131 4.450 0.471 4.690 1.00 0.00 C ATOM 644 O THR A 131 5.550 0.560 5.234 1.00 0.00 O ATOM 645 CB THR A 131 2.612 0.753 6.354 1.00 0.00 C ATOM 646 OG1 THR A 131 1.497 0.123 6.994 1.00 0.00 O ATOM 647 CG2 THR A 131 2.142 1.998 5.617 1.00 0.00 C ATOM 0 H THR A 131 4.675 -1.355 6.490 1.00 0.00 H new ATOM 0 HA THR A 131 2.565 -0.557 4.640 1.00 0.00 H new ATOM 0 HB THR A 131 3.343 1.049 7.106 1.00 0.00 H new ATOM 0 HG1 THR A 131 1.815 -0.622 7.546 1.00 0.00 H new ATOM 0 HG21 THR A 131 1.666 2.680 6.322 1.00 0.00 H new ATOM 0 HG22 THR A 131 2.997 2.492 5.155 1.00 0.00 H new ATOM 0 HG23 THR A 131 1.426 1.715 4.845 1.00 0.00 H new ATOM 655 N ALA A 132 4.195 0.970 3.485 1.00 0.00 N ATOM 656 CA ALA A 132 5.218 1.669 2.717 1.00 0.00 C ATOM 657 C ALA A 132 4.763 3.079 2.354 1.00 0.00 C ATOM 658 O ALA A 132 3.719 3.264 1.729 1.00 0.00 O ATOM 659 CB ALA A 132 5.562 0.884 1.460 1.00 0.00 C ATOM 0 H ALA A 132 3.290 0.903 3.020 1.00 0.00 H new ATOM 0 HA ALA A 132 6.111 1.751 3.337 1.00 0.00 H new ATOM 0 HB1 ALA A 132 6.327 1.417 0.896 1.00 0.00 H new ATOM 0 HB2 ALA A 132 5.936 -0.101 1.737 1.00 0.00 H new ATOM 0 HB3 ALA A 132 4.669 0.773 0.845 1.00 0.00 H new ATOM 665 N PHE A 133 5.554 4.071 2.751 1.00 0.00 N ATOM 666 CA PHE A 133 5.232 5.465 2.469 1.00 0.00 C ATOM 667 C PHE A 133 5.761 5.879 1.099 1.00 0.00 C ATOM 668 O PHE A 133 6.968 5.858 0.855 1.00 0.00 O ATOM 669 CB PHE A 133 5.817 6.375 3.551 1.00 0.00 C ATOM 670 CG PHE A 133 5.490 5.931 4.948 1.00 0.00 C ATOM 671 CD1 PHE A 133 4.199 6.038 5.439 1.00 0.00 C ATOM 672 CD2 PHE A 133 6.475 5.408 5.771 1.00 0.00 C ATOM 673 CE1 PHE A 133 3.895 5.631 6.724 1.00 0.00 C ATOM 674 CE2 PHE A 133 6.176 4.998 7.057 1.00 0.00 C ATOM 675 CZ PHE A 133 4.885 5.111 7.534 1.00 0.00 C ATOM 0 H PHE A 133 6.422 3.935 3.269 1.00 0.00 H new ATOM 0 HA PHE A 133 4.147 5.568 2.466 1.00 0.00 H new ATOM 0 HB2 PHE A 133 6.900 6.414 3.435 1.00 0.00 H new ATOM 0 HB3 PHE A 133 5.443 7.388 3.403 1.00 0.00 H new ATOM 0 HD1 PHE A 133 3.421 6.444 4.810 1.00 0.00 H new ATOM 0 HD2 PHE A 133 7.487 5.320 5.404 1.00 0.00 H new ATOM 0 HE1 PHE A 133 2.884 5.719 7.094 1.00 0.00 H new ATOM 0 HE2 PHE A 133 6.951 4.590 7.688 1.00 0.00 H new ATOM 0 HZ PHE A 133 4.650 4.793 8.539 1.00 0.00 H new ATOM 685 N VAL A 134 4.850 6.256 0.208 1.00 0.00 N ATOM 686 CA VAL A 134 5.224 6.676 -1.137 1.00 0.00 C ATOM 687 C VAL A 134 4.833 8.128 -1.388 1.00 0.00 C ATOM 688 O VAL A 134 3.685 8.520 -1.176 1.00 0.00 O ATOM 689 CB VAL A 134 4.563 5.786 -2.207 1.00 0.00 C ATOM 690 CG1 VAL A 134 4.977 6.230 -3.602 1.00 0.00 C ATOM 691 CG2 VAL A 134 4.917 4.325 -1.977 1.00 0.00 C ATOM 0 H VAL A 134 3.847 6.279 0.393 1.00 0.00 H new ATOM 0 HA VAL A 134 6.307 6.576 -1.210 1.00 0.00 H new ATOM 0 HB VAL A 134 3.481 5.892 -2.124 1.00 0.00 H new ATOM 0 HG11 VAL A 134 4.500 5.590 -4.344 1.00 0.00 H new ATOM 0 HG12 VAL A 134 4.668 7.263 -3.762 1.00 0.00 H new ATOM 0 HG13 VAL A 134 6.060 6.156 -3.701 1.00 0.00 H new ATOM 0 HG21 VAL A 134 4.442 3.711 -2.742 1.00 0.00 H new ATOM 0 HG22 VAL A 134 5.998 4.200 -2.031 1.00 0.00 H new ATOM 0 HG23 VAL A 134 4.565 4.016 -0.993 1.00 0.00 H new ATOM 701 N THR A 135 5.796 8.924 -1.843 1.00 0.00 N ATOM 702 CA THR A 135 5.554 10.334 -2.122 1.00 0.00 C ATOM 703 C THR A 135 5.442 10.586 -3.621 1.00 0.00 C ATOM 704 O THR A 135 6.394 10.363 -4.372 1.00 0.00 O ATOM 705 CB THR A 135 6.674 11.221 -1.546 1.00 0.00 C ATOM 706 OG1 THR A 135 6.756 11.047 -0.127 1.00 0.00 O ATOM 707 CG2 THR A 135 6.423 12.686 -1.868 1.00 0.00 C ATOM 0 H THR A 135 6.751 8.616 -2.026 1.00 0.00 H new ATOM 0 HA THR A 135 4.611 10.594 -1.641 1.00 0.00 H new ATOM 0 HB THR A 135 7.617 10.921 -2.004 1.00 0.00 H new ATOM 0 HG1 THR A 135 7.471 11.613 0.231 1.00 0.00 H new ATOM 0 HG21 THR A 135 7.227 13.293 -1.451 1.00 0.00 H new ATOM 0 HG22 THR A 135 6.390 12.820 -2.949 1.00 0.00 H new ATOM 0 HG23 THR A 135 5.472 12.996 -1.435 1.00 0.00 H new ATOM 715 N LEU A 136 4.275 11.051 -4.053 1.00 0.00 N ATOM 716 CA LEU A 136 4.039 11.335 -5.464 1.00 0.00 C ATOM 717 C LEU A 136 4.441 12.766 -5.807 1.00 0.00 C ATOM 718 O LEU A 136 4.786 13.553 -4.925 1.00 0.00 O ATOM 719 CB LEU A 136 2.566 11.110 -5.810 1.00 0.00 C ATOM 720 CG LEU A 136 2.071 9.665 -5.733 1.00 0.00 C ATOM 721 CD1 LEU A 136 0.565 9.606 -5.932 1.00 0.00 C ATOM 722 CD2 LEU A 136 2.783 8.802 -6.765 1.00 0.00 C ATOM 0 H LEU A 136 3.477 11.239 -3.446 1.00 0.00 H new ATOM 0 HA LEU A 136 4.653 10.654 -6.054 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.959 11.717 -5.138 1.00 0.00 H new ATOM 0 HB3 LEU A 136 2.390 11.480 -6.820 1.00 0.00 H new ATOM 0 HG LEU A 136 2.301 9.274 -4.742 1.00 0.00 H new ATOM 0 HD11 LEU A 136 0.231 8.570 -5.874 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.072 10.190 -5.155 1.00 0.00 H new ATOM 0 HD13 LEU A 136 0.311 10.015 -6.910 1.00 0.00 H new ATOM 0 HD21 LEU A 136 2.419 7.777 -6.696 1.00 0.00 H new ATOM 0 HD22 LEU A 136 2.585 9.191 -7.764 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.856 8.819 -6.575 1.00 0.00 H new ATOM 734 N LEU A 137 4.393 13.096 -7.093 1.00 0.00 N ATOM 735 CA LEU A 137 4.750 14.434 -7.553 1.00 0.00 C ATOM 736 C LEU A 137 3.712 15.458 -7.106 1.00 0.00 C ATOM 737 O LEU A 137 3.991 16.313 -6.266 1.00 0.00 O ATOM 738 CB LEU A 137 4.879 14.453 -9.077 1.00 0.00 C ATOM 739 CG LEU A 137 5.319 15.780 -9.697 1.00 0.00 C ATOM 740 CD1 LEU A 137 6.758 16.094 -9.321 1.00 0.00 C ATOM 741 CD2 LEU A 137 5.156 15.741 -11.209 1.00 0.00 C ATOM 0 H LEU A 137 4.111 12.456 -7.835 1.00 0.00 H new ATOM 0 HA LEU A 137 5.710 14.700 -7.110 1.00 0.00 H new ATOM 0 HB2 LEU A 137 5.593 13.683 -9.371 1.00 0.00 H new ATOM 0 HB3 LEU A 137 3.916 14.176 -9.507 1.00 0.00 H new ATOM 0 HG LEU A 137 4.682 16.572 -9.303 1.00 0.00 H new ATOM 0 HD11 LEU A 137 7.053 17.042 -9.771 1.00 0.00 H new ATOM 0 HD12 LEU A 137 6.843 16.165 -8.237 1.00 0.00 H new ATOM 0 HD13 LEU A 137 7.411 15.300 -9.685 1.00 0.00 H new ATOM 0 HD21 LEU A 137 5.474 16.693 -11.634 1.00 0.00 H new ATOM 0 HD22 LEU A 137 5.768 14.938 -11.620 1.00 0.00 H new ATOM 0 HD23 LEU A 137 4.110 15.564 -11.458 1.00 0.00 H new ATOM 753 N ASN A 138 2.514 15.364 -7.673 1.00 0.00 N ATOM 754 CA ASN A 138 1.433 16.282 -7.332 1.00 0.00 C ATOM 755 C ASN A 138 0.281 15.541 -6.660 1.00 0.00 C ATOM 756 O ASN A 138 0.199 14.315 -6.720 1.00 0.00 O ATOM 757 CB ASN A 138 0.930 17.000 -8.586 1.00 0.00 C ATOM 758 CG ASN A 138 0.817 16.069 -9.778 1.00 0.00 C ATOM 759 OD1 ASN A 138 -0.221 15.443 -9.995 1.00 0.00 O ATOM 760 ND2 ASN A 138 1.887 15.973 -10.558 1.00 0.00 N ATOM 0 H ASN A 138 2.267 14.662 -8.370 1.00 0.00 H new ATOM 0 HA ASN A 138 1.825 17.020 -6.632 1.00 0.00 H new ATOM 0 HB2 ASN A 138 -0.044 17.444 -8.381 1.00 0.00 H new ATOM 0 HB3 ASN A 138 1.608 17.818 -8.830 1.00 0.00 H new ATOM 0 HD21 ASN A 138 1.870 15.362 -11.375 1.00 0.00 H new ATOM 0 HD22 ASN A 138 2.726 16.510 -10.341 1.00 0.00 H new ATOM 767 N GLY A 139 -0.608 16.295 -6.020 1.00 0.00 N ATOM 768 CA GLY A 139 -1.744 15.692 -5.347 1.00 0.00 C ATOM 769 C GLY A 139 -2.691 15.005 -6.310 1.00 0.00 C ATOM 770 O GLY A 139 -2.971 13.815 -6.173 1.00 0.00 O ATOM 0 H GLY A 139 -0.562 17.312 -5.956 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -1.386 14.968 -4.615 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -2.286 16.461 -4.796 1.00 0.00 H new ATOM 774 N GLU A 140 -3.188 15.758 -7.287 1.00 0.00 N ATOM 775 CA GLU A 140 -4.112 15.214 -8.275 1.00 0.00 C ATOM 776 C GLU A 140 -3.770 13.762 -8.599 1.00 0.00 C ATOM 777 O GLU A 140 -4.638 12.890 -8.577 1.00 0.00 O ATOM 778 CB GLU A 140 -4.080 16.054 -9.554 1.00 0.00 C ATOM 779 CG GLU A 140 -5.311 15.881 -10.427 1.00 0.00 C ATOM 780 CD GLU A 140 -5.131 16.470 -11.813 1.00 0.00 C ATOM 781 OE1 GLU A 140 -5.356 17.688 -11.974 1.00 0.00 O ATOM 782 OE2 GLU A 140 -4.763 15.713 -12.735 1.00 0.00 O ATOM 0 H GLU A 140 -2.966 16.745 -7.415 1.00 0.00 H new ATOM 0 HA GLU A 140 -5.116 15.247 -7.852 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -3.980 17.106 -9.285 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -3.195 15.787 -10.132 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -5.543 14.820 -10.515 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -6.165 16.355 -9.943 1.00 0.00 H new ATOM 789 N GLN A 141 -2.499 13.513 -8.900 1.00 0.00 N ATOM 790 CA GLN A 141 -2.043 12.168 -9.230 1.00 0.00 C ATOM 791 C GLN A 141 -2.477 11.169 -8.163 1.00 0.00 C ATOM 792 O GLN A 141 -2.997 10.098 -8.476 1.00 0.00 O ATOM 793 CB GLN A 141 -0.520 12.146 -9.377 1.00 0.00 C ATOM 794 CG GLN A 141 -0.042 12.420 -10.793 1.00 0.00 C ATOM 795 CD GLN A 141 1.427 12.099 -10.986 1.00 0.00 C ATOM 796 OE1 GLN A 141 1.783 11.181 -11.726 1.00 0.00 O ATOM 797 NE2 GLN A 141 2.291 12.855 -10.318 1.00 0.00 N ATOM 0 H GLN A 141 -1.768 14.224 -8.922 1.00 0.00 H new ATOM 0 HA GLN A 141 -2.497 11.879 -10.178 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -0.088 12.889 -8.706 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -0.146 11.173 -9.058 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -0.634 11.830 -11.493 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -0.215 13.469 -11.034 1.00 0.00 H new ATOM 0 HE21 GLN A 141 1.953 13.605 -9.716 1.00 0.00 H new ATOM 0 HE22 GLN A 141 3.293 12.685 -10.408 1.00 0.00 H new ATOM 806 N ALA A 142 -2.261 11.526 -6.901 1.00 0.00 N ATOM 807 CA ALA A 142 -2.632 10.662 -5.788 1.00 0.00 C ATOM 808 C ALA A 142 -4.147 10.534 -5.673 1.00 0.00 C ATOM 809 O ALA A 142 -4.683 9.428 -5.621 1.00 0.00 O ATOM 810 CB ALA A 142 -2.045 11.193 -4.489 1.00 0.00 C ATOM 0 H ALA A 142 -1.831 12.408 -6.624 1.00 0.00 H new ATOM 0 HA ALA A 142 -2.224 9.670 -5.979 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -2.330 10.538 -3.666 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -0.958 11.225 -4.567 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -2.425 12.197 -4.302 1.00 0.00 H new ATOM 816 N GLN A 143 -4.831 11.673 -5.634 1.00 0.00 N ATOM 817 CA GLN A 143 -6.285 11.687 -5.524 1.00 0.00 C ATOM 818 C GLN A 143 -6.900 10.514 -6.279 1.00 0.00 C ATOM 819 O GLN A 143 -7.846 9.886 -5.806 1.00 0.00 O ATOM 820 CB GLN A 143 -6.846 13.005 -6.062 1.00 0.00 C ATOM 821 CG GLN A 143 -6.829 14.134 -5.044 1.00 0.00 C ATOM 822 CD GLN A 143 -5.456 14.758 -4.886 1.00 0.00 C ATOM 823 OE1 GLN A 143 -5.102 15.695 -5.601 1.00 0.00 O ATOM 824 NE2 GLN A 143 -4.675 14.239 -3.946 1.00 0.00 N ATOM 0 H GLN A 143 -4.402 12.597 -5.677 1.00 0.00 H new ATOM 0 HA GLN A 143 -6.545 11.593 -4.470 1.00 0.00 H new ATOM 0 HB2 GLN A 143 -6.268 13.306 -6.936 1.00 0.00 H new ATOM 0 HB3 GLN A 143 -7.871 12.844 -6.397 1.00 0.00 H new ATOM 0 HG2 GLN A 143 -7.540 14.902 -5.348 1.00 0.00 H new ATOM 0 HG3 GLN A 143 -7.164 13.753 -4.079 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -5.010 13.462 -3.376 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -3.740 14.617 -3.794 1.00 0.00 H new ATOM 833 N ASN A 144 -6.355 10.223 -7.456 1.00 0.00 N ATOM 834 CA ASN A 144 -6.850 9.125 -8.278 1.00 0.00 C ATOM 835 C ASN A 144 -6.135 7.822 -7.933 1.00 0.00 C ATOM 836 O ASN A 144 -6.769 6.830 -7.575 1.00 0.00 O ATOM 837 CB ASN A 144 -6.663 9.446 -9.762 1.00 0.00 C ATOM 838 CG ASN A 144 -7.482 10.643 -10.203 1.00 0.00 C ATOM 839 OD1 ASN A 144 -8.557 10.494 -10.785 1.00 0.00 O ATOM 840 ND2 ASN A 144 -6.977 11.840 -9.926 1.00 0.00 N ATOM 0 H ASN A 144 -5.570 10.733 -7.862 1.00 0.00 H new ATOM 0 HA ASN A 144 -7.913 9.001 -8.072 1.00 0.00 H new ATOM 0 HB2 ASN A 144 -5.608 9.639 -9.959 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -6.945 8.577 -10.357 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -7.484 12.683 -10.197 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -6.082 11.917 -9.442 1.00 0.00 H new ATOM 847 N ALA A 145 -4.811 7.833 -8.045 1.00 0.00 N ATOM 848 CA ALA A 145 -4.009 6.654 -7.743 1.00 0.00 C ATOM 849 C ALA A 145 -4.523 5.945 -6.494 1.00 0.00 C ATOM 850 O ALA A 145 -4.336 4.739 -6.332 1.00 0.00 O ATOM 851 CB ALA A 145 -2.548 7.040 -7.569 1.00 0.00 C ATOM 0 H ALA A 145 -4.271 8.646 -8.343 1.00 0.00 H new ATOM 0 HA ALA A 145 -4.094 5.963 -8.582 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -1.961 6.150 -7.344 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -2.180 7.495 -8.489 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -2.455 7.753 -6.750 1.00 0.00 H new ATOM 857 N ILE A 146 -5.171 6.702 -5.614 1.00 0.00 N ATOM 858 CA ILE A 146 -5.712 6.145 -4.381 1.00 0.00 C ATOM 859 C ILE A 146 -6.766 5.083 -4.673 1.00 0.00 C ATOM 860 O ILE A 146 -6.528 3.891 -4.484 1.00 0.00 O ATOM 861 CB ILE A 146 -6.334 7.240 -3.495 1.00 0.00 C ATOM 862 CG1 ILE A 146 -5.245 8.167 -2.951 1.00 0.00 C ATOM 863 CG2 ILE A 146 -7.122 6.614 -2.354 1.00 0.00 C ATOM 864 CD1 ILE A 146 -5.765 9.519 -2.514 1.00 0.00 C ATOM 0 H ILE A 146 -5.334 7.702 -5.733 1.00 0.00 H new ATOM 0 HA ILE A 146 -4.878 5.688 -3.848 1.00 0.00 H new ATOM 0 HB ILE A 146 -7.019 7.832 -4.102 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -4.757 7.684 -2.105 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -4.484 8.310 -3.718 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -7.556 7.401 -1.737 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -7.919 5.991 -2.761 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -6.457 6.001 -1.746 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -4.939 10.123 -2.140 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -6.227 10.023 -3.363 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -6.504 9.387 -1.724 1.00 0.00 H new ATOM 876 N GLN A 147 -7.931 5.525 -5.136 1.00 0.00 N ATOM 877 CA GLN A 147 -9.022 4.612 -5.456 1.00 0.00 C ATOM 878 C GLN A 147 -8.658 3.723 -6.640 1.00 0.00 C ATOM 879 O GLN A 147 -8.945 2.526 -6.642 1.00 0.00 O ATOM 880 CB GLN A 147 -10.298 5.396 -5.765 1.00 0.00 C ATOM 881 CG GLN A 147 -11.060 5.831 -4.523 1.00 0.00 C ATOM 882 CD GLN A 147 -12.050 4.785 -4.050 1.00 0.00 C ATOM 883 OE1 GLN A 147 -11.829 4.117 -3.040 1.00 0.00 O ATOM 884 NE2 GLN A 147 -13.150 4.637 -4.779 1.00 0.00 N ATOM 0 H GLN A 147 -8.144 6.509 -5.298 1.00 0.00 H new ATOM 0 HA GLN A 147 -9.196 3.976 -4.588 1.00 0.00 H new ATOM 0 HB2 GLN A 147 -10.040 6.278 -6.350 1.00 0.00 H new ATOM 0 HB3 GLN A 147 -10.951 4.782 -6.385 1.00 0.00 H new ATOM 0 HG2 GLN A 147 -10.351 6.044 -3.722 1.00 0.00 H new ATOM 0 HG3 GLN A 147 -11.591 6.759 -4.734 1.00 0.00 H new ATOM 0 HE21 GLN A 147 -13.293 5.212 -5.609 1.00 0.00 H new ATOM 0 HE22 GLN A 147 -13.852 3.948 -4.509 1.00 0.00 H new ATOM 893 N MET A 148 -8.024 4.316 -7.647 1.00 0.00 N ATOM 894 CA MET A 148 -7.621 3.577 -8.837 1.00 0.00 C ATOM 895 C MET A 148 -6.901 2.286 -8.458 1.00 0.00 C ATOM 896 O MET A 148 -7.130 1.237 -9.059 1.00 0.00 O ATOM 897 CB MET A 148 -6.714 4.440 -9.716 1.00 0.00 C ATOM 898 CG MET A 148 -7.454 5.546 -10.451 1.00 0.00 C ATOM 899 SD MET A 148 -8.050 5.025 -12.072 1.00 0.00 S ATOM 900 CE MET A 148 -9.293 3.823 -11.604 1.00 0.00 C ATOM 0 H MET A 148 -7.779 5.306 -7.662 1.00 0.00 H new ATOM 0 HA MET A 148 -8.521 3.320 -9.396 1.00 0.00 H new ATOM 0 HB2 MET A 148 -5.936 4.885 -9.095 1.00 0.00 H new ATOM 0 HB3 MET A 148 -6.214 3.802 -10.445 1.00 0.00 H new ATOM 0 HG2 MET A 148 -8.299 5.877 -9.847 1.00 0.00 H new ATOM 0 HG3 MET A 148 -6.792 6.404 -10.570 1.00 0.00 H new ATOM 0 HE1 MET A 148 -10.025 3.726 -12.406 1.00 0.00 H new ATOM 0 HE2 MET A 148 -8.818 2.858 -11.427 1.00 0.00 H new ATOM 0 HE3 MET A 148 -9.794 4.153 -10.694 1.00 0.00 H new ATOM 910 N PHE A 149 -6.031 2.372 -7.458 1.00 0.00 N ATOM 911 CA PHE A 149 -5.277 1.211 -6.999 1.00 0.00 C ATOM 912 C PHE A 149 -5.945 0.573 -5.784 1.00 0.00 C ATOM 913 O PHE A 149 -5.784 -0.620 -5.528 1.00 0.00 O ATOM 914 CB PHE A 149 -3.841 1.612 -6.654 1.00 0.00 C ATOM 915 CG PHE A 149 -2.970 1.817 -7.860 1.00 0.00 C ATOM 916 CD1 PHE A 149 -3.422 2.557 -8.941 1.00 0.00 C ATOM 917 CD2 PHE A 149 -1.698 1.269 -7.914 1.00 0.00 C ATOM 918 CE1 PHE A 149 -2.623 2.748 -10.052 1.00 0.00 C ATOM 919 CE2 PHE A 149 -0.894 1.457 -9.022 1.00 0.00 C ATOM 920 CZ PHE A 149 -1.358 2.196 -10.093 1.00 0.00 C ATOM 0 H PHE A 149 -5.830 3.233 -6.950 1.00 0.00 H new ATOM 0 HA PHE A 149 -5.258 0.479 -7.807 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -3.860 2.531 -6.069 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -3.399 0.841 -6.023 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -4.411 2.990 -8.915 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -1.331 0.688 -7.081 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -2.987 3.328 -10.887 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.096 1.027 -9.051 1.00 0.00 H new ATOM 0 HZ PHE A 149 -0.732 2.342 -10.961 1.00 0.00 H new ATOM 930 N HIS A 150 -6.694 1.379 -5.038 1.00 0.00 N ATOM 931 CA HIS A 150 -7.387 0.895 -3.850 1.00 0.00 C ATOM 932 C HIS A 150 -8.001 -0.479 -4.100 1.00 0.00 C ATOM 933 O HIS A 150 -8.719 -0.678 -5.079 1.00 0.00 O ATOM 934 CB HIS A 150 -8.475 1.883 -3.430 1.00 0.00 C ATOM 935 CG HIS A 150 -9.198 1.484 -2.180 1.00 0.00 C ATOM 936 ND1 HIS A 150 -8.557 0.970 -1.072 1.00 0.00 N ATOM 937 CD2 HIS A 150 -10.514 1.527 -1.866 1.00 0.00 C ATOM 938 CE1 HIS A 150 -9.448 0.712 -0.131 1.00 0.00 C ATOM 939 NE2 HIS A 150 -10.643 1.042 -0.588 1.00 0.00 N ATOM 0 H HIS A 150 -6.836 2.370 -5.235 1.00 0.00 H new ATOM 0 HA HIS A 150 -6.657 0.806 -3.046 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -8.025 2.865 -3.282 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -9.196 1.982 -4.241 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -11.313 1.877 -2.502 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -9.236 0.301 0.845 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -11.520 0.951 -0.074 1.00 0.00 H new ATOM 948 N GLN A 151 -7.712 -1.423 -3.210 1.00 0.00 N ATOM 949 CA GLN A 151 -8.235 -2.778 -3.336 1.00 0.00 C ATOM 950 C GLN A 151 -7.726 -3.441 -4.612 1.00 0.00 C ATOM 951 O GLN A 151 -8.498 -4.034 -5.366 1.00 0.00 O ATOM 952 CB GLN A 151 -9.764 -2.760 -3.332 1.00 0.00 C ATOM 953 CG GLN A 151 -10.368 -2.730 -1.938 1.00 0.00 C ATOM 954 CD GLN A 151 -11.876 -2.891 -1.951 1.00 0.00 C ATOM 955 OE1 GLN A 151 -12.393 -4.008 -1.909 1.00 0.00 O ATOM 956 NE2 GLN A 151 -12.590 -1.773 -2.010 1.00 0.00 N ATOM 0 H GLN A 151 -7.118 -1.274 -2.394 1.00 0.00 H new ATOM 0 HA GLN A 151 -7.884 -3.357 -2.482 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -10.110 -1.889 -3.888 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -10.131 -3.641 -3.859 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -9.927 -3.526 -1.338 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -10.111 -1.787 -1.455 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -12.120 -0.869 -2.043 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -13.609 -1.819 -2.022 1.00 0.00 H new ATOM 965 N TYR A 152 -6.423 -3.335 -4.849 1.00 0.00 N ATOM 966 CA TYR A 152 -5.811 -3.922 -6.035 1.00 0.00 C ATOM 967 C TYR A 152 -5.286 -5.324 -5.741 1.00 0.00 C ATOM 968 O TYR A 152 -4.976 -5.655 -4.597 1.00 0.00 O ATOM 969 CB TYR A 152 -4.672 -3.034 -6.539 1.00 0.00 C ATOM 970 CG TYR A 152 -3.782 -3.711 -7.557 1.00 0.00 C ATOM 971 CD1 TYR A 152 -4.210 -3.904 -8.865 1.00 0.00 C ATOM 972 CD2 TYR A 152 -2.512 -4.157 -7.211 1.00 0.00 C ATOM 973 CE1 TYR A 152 -3.401 -4.522 -9.798 1.00 0.00 C ATOM 974 CE2 TYR A 152 -1.695 -4.775 -8.138 1.00 0.00 C ATOM 975 CZ TYR A 152 -2.144 -4.956 -9.430 1.00 0.00 C ATOM 976 OH TYR A 152 -1.335 -5.571 -10.357 1.00 0.00 O ATOM 0 H TYR A 152 -5.770 -2.848 -4.235 1.00 0.00 H new ATOM 0 HA TYR A 152 -6.576 -3.995 -6.808 1.00 0.00 H new ATOM 0 HB2 TYR A 152 -5.094 -2.132 -6.981 1.00 0.00 H new ATOM 0 HB3 TYR A 152 -4.065 -2.719 -5.690 1.00 0.00 H new ATOM 0 HD1 TYR A 152 -5.193 -3.565 -9.157 1.00 0.00 H new ATOM 0 HD2 TYR A 152 -2.158 -4.018 -6.200 1.00 0.00 H new ATOM 0 HE1 TYR A 152 -3.750 -4.665 -10.810 1.00 0.00 H new ATOM 0 HE2 TYR A 152 -0.710 -5.115 -7.853 1.00 0.00 H new ATOM 0 HH TYR A 152 -0.483 -5.815 -9.938 1.00 0.00 H new ATOM 986 N SER A 153 -5.190 -6.143 -6.783 1.00 0.00 N ATOM 987 CA SER A 153 -4.707 -7.511 -6.637 1.00 0.00 C ATOM 988 C SER A 153 -3.200 -7.532 -6.395 1.00 0.00 C ATOM 989 O SER A 153 -2.418 -7.098 -7.241 1.00 0.00 O ATOM 990 CB SER A 153 -5.045 -8.330 -7.885 1.00 0.00 C ATOM 991 OG SER A 153 -4.966 -9.720 -7.620 1.00 0.00 O ATOM 0 H SER A 153 -5.440 -5.883 -7.737 1.00 0.00 H new ATOM 0 HA SER A 153 -5.203 -7.955 -5.774 1.00 0.00 H new ATOM 0 HB2 SER A 153 -6.049 -8.079 -8.228 1.00 0.00 H new ATOM 0 HB3 SER A 153 -4.358 -8.071 -8.691 1.00 0.00 H new ATOM 0 HG SER A 153 -5.188 -10.221 -8.432 1.00 0.00 H new ATOM 997 N PHE A 154 -2.801 -8.039 -5.233 1.00 0.00 N ATOM 998 CA PHE A 154 -1.389 -8.116 -4.877 1.00 0.00 C ATOM 999 C PHE A 154 -1.132 -9.276 -3.919 1.00 0.00 C ATOM 1000 O PHE A 154 -1.492 -9.215 -2.744 1.00 0.00 O ATOM 1001 CB PHE A 154 -0.930 -6.803 -4.241 1.00 0.00 C ATOM 1002 CG PHE A 154 0.550 -6.568 -4.352 1.00 0.00 C ATOM 1003 CD1 PHE A 154 1.420 -7.089 -3.408 1.00 0.00 C ATOM 1004 CD2 PHE A 154 1.070 -5.827 -5.401 1.00 0.00 C ATOM 1005 CE1 PHE A 154 2.782 -6.873 -3.508 1.00 0.00 C ATOM 1006 CE2 PHE A 154 2.431 -5.609 -5.506 1.00 0.00 C ATOM 1007 CZ PHE A 154 3.288 -6.134 -4.559 1.00 0.00 C ATOM 0 H PHE A 154 -3.436 -8.403 -4.522 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.818 -8.289 -5.790 1.00 0.00 H new ATOM 0 HB2 PHE A 154 -1.458 -5.975 -4.715 1.00 0.00 H new ATOM 0 HB3 PHE A 154 -1.212 -6.800 -3.188 1.00 0.00 H new ATOM 0 HD1 PHE A 154 1.030 -7.670 -2.585 1.00 0.00 H new ATOM 0 HD2 PHE A 154 0.404 -5.415 -6.145 1.00 0.00 H new ATOM 0 HE1 PHE A 154 3.450 -7.282 -2.764 1.00 0.00 H new ATOM 0 HE2 PHE A 154 2.824 -5.029 -6.328 1.00 0.00 H new ATOM 0 HZ PHE A 154 4.352 -5.967 -4.640 1.00 0.00 H new ATOM 1017 N ARG A 155 -0.508 -10.331 -4.432 1.00 0.00 N ATOM 1018 CA ARG A 155 -0.205 -11.506 -3.624 1.00 0.00 C ATOM 1019 C ARG A 155 -1.453 -12.009 -2.905 1.00 0.00 C ATOM 1020 O ARG A 155 -1.379 -12.495 -1.777 1.00 0.00 O ATOM 1021 CB ARG A 155 0.888 -11.181 -2.604 1.00 0.00 C ATOM 1022 CG ARG A 155 2.095 -10.480 -3.207 1.00 0.00 C ATOM 1023 CD ARG A 155 3.008 -11.461 -3.926 1.00 0.00 C ATOM 1024 NE ARG A 155 4.404 -11.034 -3.892 1.00 0.00 N ATOM 1025 CZ ARG A 155 5.310 -11.413 -4.787 1.00 0.00 C ATOM 1026 NH1 ARG A 155 4.967 -12.220 -5.781 1.00 0.00 N ATOM 1027 NH2 ARG A 155 6.561 -10.982 -4.689 1.00 0.00 N ATOM 0 H ARG A 155 -0.202 -10.396 -5.403 1.00 0.00 H new ATOM 0 HA ARG A 155 0.150 -12.292 -4.290 1.00 0.00 H new ATOM 0 HB2 ARG A 155 0.466 -10.551 -1.821 1.00 0.00 H new ATOM 0 HB3 ARG A 155 1.215 -12.105 -2.128 1.00 0.00 H new ATOM 0 HG2 ARG A 155 1.760 -9.714 -3.906 1.00 0.00 H new ATOM 0 HG3 ARG A 155 2.653 -9.972 -2.420 1.00 0.00 H new ATOM 0 HD2 ARG A 155 2.918 -12.445 -3.465 1.00 0.00 H new ATOM 0 HD3 ARG A 155 2.685 -11.564 -4.962 1.00 0.00 H new ATOM 0 HE ARG A 155 4.700 -10.411 -3.140 1.00 0.00 H new ATOM 0 HH11 ARG A 155 4.006 -12.552 -5.860 1.00 0.00 H new ATOM 0 HH12 ARG A 155 5.664 -12.509 -6.467 1.00 0.00 H new ATOM 0 HH21 ARG A 155 6.828 -10.359 -3.926 1.00 0.00 H new ATOM 0 HH22 ARG A 155 7.256 -11.273 -5.376 1.00 0.00 H new ATOM 1041 N GLY A 156 -2.600 -11.887 -3.566 1.00 0.00 N ATOM 1042 CA GLY A 156 -3.848 -12.332 -2.974 1.00 0.00 C ATOM 1043 C GLY A 156 -4.435 -11.311 -2.021 1.00 0.00 C ATOM 1044 O GLY A 156 -5.601 -11.406 -1.637 1.00 0.00 O ATOM 0 H GLY A 156 -2.687 -11.488 -4.501 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -4.568 -12.541 -3.766 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -3.680 -13.268 -2.441 1.00 0.00 H new ATOM 1048 N LYS A 157 -3.625 -10.331 -1.634 1.00 0.00 N ATOM 1049 CA LYS A 157 -4.070 -9.286 -0.719 1.00 0.00 C ATOM 1050 C LYS A 157 -4.565 -8.065 -1.487 1.00 0.00 C ATOM 1051 O LYS A 157 -4.191 -7.851 -2.640 1.00 0.00 O ATOM 1052 CB LYS A 157 -2.931 -8.884 0.221 1.00 0.00 C ATOM 1053 CG LYS A 157 -2.406 -10.032 1.066 1.00 0.00 C ATOM 1054 CD LYS A 157 -3.281 -10.271 2.286 1.00 0.00 C ATOM 1055 CE LYS A 157 -2.616 -11.219 3.271 1.00 0.00 C ATOM 1056 NZ LYS A 157 -3.612 -11.900 4.144 1.00 0.00 N ATOM 0 H LYS A 157 -2.656 -10.239 -1.940 1.00 0.00 H new ATOM 0 HA LYS A 157 -4.897 -9.682 -0.129 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -2.112 -8.474 -0.369 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -3.279 -8.088 0.880 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -2.364 -10.939 0.463 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -1.387 -9.814 1.385 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -3.489 -9.321 2.778 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -4.240 -10.684 1.972 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -2.041 -11.966 2.724 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -1.910 -10.664 3.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -3.119 -12.538 4.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -4.143 -11.188 4.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -4.270 -12.450 3.556 1.00 0.00 H new ATOM 1070 N ASP A 158 -5.406 -7.266 -0.839 1.00 0.00 N ATOM 1071 CA ASP A 158 -5.950 -6.064 -1.460 1.00 0.00 C ATOM 1072 C ASP A 158 -5.247 -4.815 -0.936 1.00 0.00 C ATOM 1073 O ASP A 158 -5.665 -4.228 0.063 1.00 0.00 O ATOM 1074 CB ASP A 158 -7.454 -5.965 -1.199 1.00 0.00 C ATOM 1075 CG ASP A 158 -8.274 -6.654 -2.272 1.00 0.00 C ATOM 1076 OD1 ASP A 158 -8.526 -7.869 -2.137 1.00 0.00 O ATOM 1077 OD2 ASP A 158 -8.664 -5.977 -3.247 1.00 0.00 O ATOM 0 H ASP A 158 -5.726 -7.429 0.116 1.00 0.00 H new ATOM 0 HA ASP A 158 -5.779 -6.131 -2.534 1.00 0.00 H new ATOM 0 HB2 ASP A 158 -7.682 -6.410 -0.230 1.00 0.00 H new ATOM 0 HB3 ASP A 158 -7.742 -4.915 -1.144 1.00 0.00 H new ATOM 1082 N LEU A 159 -4.178 -4.416 -1.615 1.00 0.00 N ATOM 1083 CA LEU A 159 -3.415 -3.237 -1.217 1.00 0.00 C ATOM 1084 C LEU A 159 -4.343 -2.062 -0.925 1.00 0.00 C ATOM 1085 O LEU A 159 -5.143 -1.664 -1.773 1.00 0.00 O ATOM 1086 CB LEU A 159 -2.420 -2.856 -2.314 1.00 0.00 C ATOM 1087 CG LEU A 159 -1.246 -3.815 -2.519 1.00 0.00 C ATOM 1088 CD1 LEU A 159 -0.459 -3.437 -3.764 1.00 0.00 C ATOM 1089 CD2 LEU A 159 -0.342 -3.820 -1.295 1.00 0.00 C ATOM 0 H LEU A 159 -3.819 -4.891 -2.444 1.00 0.00 H new ATOM 0 HA LEU A 159 -2.867 -3.478 -0.306 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -2.963 -2.772 -3.255 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -2.020 -1.868 -2.087 1.00 0.00 H new ATOM 0 HG LEU A 159 -1.643 -4.821 -2.657 1.00 0.00 H new ATOM 0 HD11 LEU A 159 0.372 -4.130 -3.894 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.112 -3.486 -4.636 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.073 -2.423 -3.656 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.488 -4.508 -1.458 1.00 0.00 H new ATOM 0 HD22 LEU A 159 0.047 -2.816 -1.126 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -0.912 -4.140 -0.423 1.00 0.00 H new ATOM 1101 N ILE A 160 -4.228 -1.509 0.277 1.00 0.00 N ATOM 1102 CA ILE A 160 -5.053 -0.377 0.679 1.00 0.00 C ATOM 1103 C ILE A 160 -4.289 0.936 0.546 1.00 0.00 C ATOM 1104 O ILE A 160 -3.387 1.224 1.332 1.00 0.00 O ATOM 1105 CB ILE A 160 -5.545 -0.526 2.131 1.00 0.00 C ATOM 1106 CG1 ILE A 160 -6.404 -1.784 2.274 1.00 0.00 C ATOM 1107 CG2 ILE A 160 -6.328 0.708 2.554 1.00 0.00 C ATOM 1108 CD1 ILE A 160 -7.717 -1.708 1.526 1.00 0.00 C ATOM 0 H ILE A 160 -3.571 -1.827 0.990 1.00 0.00 H new ATOM 0 HA ILE A 160 -5.914 -0.363 0.011 1.00 0.00 H new ATOM 0 HB ILE A 160 -4.679 -0.624 2.785 1.00 0.00 H new ATOM 0 HG12 ILE A 160 -5.839 -2.643 1.913 1.00 0.00 H new ATOM 0 HG13 ILE A 160 -6.607 -1.957 3.331 1.00 0.00 H new ATOM 0 HG21 ILE A 160 -6.669 0.588 3.582 1.00 0.00 H new ATOM 0 HG22 ILE A 160 -5.687 1.587 2.485 1.00 0.00 H new ATOM 0 HG23 ILE A 160 -7.190 0.835 1.898 1.00 0.00 H new ATOM 0 HD11 ILE A 160 -8.273 -2.634 1.672 1.00 0.00 H new ATOM 0 HD12 ILE A 160 -8.302 -0.869 1.903 1.00 0.00 H new ATOM 0 HD13 ILE A 160 -7.522 -1.566 0.463 1.00 0.00 H new ATOM 1120 N VAL A 161 -4.657 1.730 -0.455 1.00 0.00 N ATOM 1121 CA VAL A 161 -4.008 3.014 -0.690 1.00 0.00 C ATOM 1122 C VAL A 161 -4.822 4.158 -0.096 1.00 0.00 C ATOM 1123 O VAL A 161 -6.022 4.272 -0.343 1.00 0.00 O ATOM 1124 CB VAL A 161 -3.803 3.272 -2.195 1.00 0.00 C ATOM 1125 CG1 VAL A 161 -2.735 4.332 -2.415 1.00 0.00 C ATOM 1126 CG2 VAL A 161 -3.440 1.981 -2.912 1.00 0.00 C ATOM 0 H VAL A 161 -5.401 1.506 -1.116 1.00 0.00 H new ATOM 0 HA VAL A 161 -3.035 2.971 -0.200 1.00 0.00 H new ATOM 0 HB VAL A 161 -4.739 3.642 -2.613 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -2.604 4.500 -3.484 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -3.041 5.262 -1.936 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -1.793 3.994 -1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.299 2.182 -3.974 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -2.517 1.579 -2.493 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -4.243 1.255 -2.784 1.00 0.00 H new ATOM 1136 N GLN A 162 -4.160 5.002 0.689 1.00 0.00 N ATOM 1137 CA GLN A 162 -4.823 6.138 1.319 1.00 0.00 C ATOM 1138 C GLN A 162 -4.049 7.428 1.068 1.00 0.00 C ATOM 1139 O GLN A 162 -2.883 7.398 0.672 1.00 0.00 O ATOM 1140 CB GLN A 162 -4.967 5.900 2.823 1.00 0.00 C ATOM 1141 CG GLN A 162 -5.741 4.638 3.169 1.00 0.00 C ATOM 1142 CD GLN A 162 -7.240 4.818 3.034 1.00 0.00 C ATOM 1143 OE1 GLN A 162 -7.785 4.782 1.930 1.00 0.00 O ATOM 1144 NE2 GLN A 162 -7.917 5.013 4.160 1.00 0.00 N ATOM 0 H GLN A 162 -3.166 4.921 0.904 1.00 0.00 H new ATOM 0 HA GLN A 162 -5.814 6.239 0.877 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -3.974 5.841 3.270 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -5.468 6.758 3.272 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -5.416 3.827 2.517 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -5.505 4.340 4.191 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -7.425 5.036 5.053 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -8.929 5.140 4.131 1.00 0.00 H new ATOM 1153 N LEU A 163 -4.704 8.560 1.300 1.00 0.00 N ATOM 1154 CA LEU A 163 -4.078 9.862 1.099 1.00 0.00 C ATOM 1155 C LEU A 163 -3.338 10.310 2.355 1.00 0.00 C ATOM 1156 O LEU A 163 -3.651 9.871 3.461 1.00 0.00 O ATOM 1157 CB LEU A 163 -5.131 10.902 0.715 1.00 0.00 C ATOM 1158 CG LEU A 163 -4.627 12.336 0.544 1.00 0.00 C ATOM 1159 CD1 LEU A 163 -3.902 12.492 -0.784 1.00 0.00 C ATOM 1160 CD2 LEU A 163 -5.782 13.322 0.642 1.00 0.00 C ATOM 0 H LEU A 163 -5.669 8.603 1.628 1.00 0.00 H new ATOM 0 HA LEU A 163 -3.356 9.769 0.288 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -5.599 10.589 -0.218 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -5.910 10.900 1.478 1.00 0.00 H new ATOM 0 HG LEU A 163 -3.922 12.551 1.347 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -3.551 13.518 -0.888 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -3.051 11.812 -0.816 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -4.584 12.257 -1.601 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -5.405 14.337 0.518 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -6.511 13.108 -0.140 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -6.258 13.228 1.618 1.00 0.00 H new