USER MOD reduce.3.24.130724 H: found=0, std=0, add=694, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 695 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: B 468 ASN : amide:sc= -1.3 K(o=-2.1,f=-1.1) USER MOD Set 1.2: B 472 GLN : amide:sc= -0.809 K(o=-2.1,f=-1.1) USER MOD Set 2.1: A 143 CYS SG : rot -13:sc= -0.7! USER MOD Set 2.2: B 473 CYS SG : rot 67:sc= 1.18 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.0128 K(o=-0.013,f=-0.98) USER MOD Single : A 91 ASN : amide:sc= 0.638 K(o=0.64,f=-3.8!) USER MOD Single : A 93 LYS NZ :NH3+ -165:sc= -0.0237 (180deg=-0.242) USER MOD Single : A 94 ASN : amide:sc= -1.11 X(o=-1.1,f=-0.78) USER MOD Single : A 98 SER OG : rot 80:sc= 1.16 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 107 ASN : amide:sc= 1.17 K(o=1.2,f=-0.059) USER MOD Single : A 109 HIS : no HD1:sc= 0.997 K(o=1,f=-5.2!) USER MOD Single : A 112 GLN : amide:sc= -1.52 K(o=-1.5,f=-0.49) USER MOD Single : A 114 MET CE :methyl 157:sc= -0.724 (180deg=-1.25) USER MOD Single : A 116 ASN : amide:sc=-0.00529 K(o=-0.0053,f=-1.1) USER MOD Single : A 119 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.48) USER MOD Single : A 123 LYS NZ :NH3+ 172:sc=-0.00257 (180deg=-0.0832) USER MOD Single : A 125 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0264) USER MOD Single : A 127 MET CE :methyl 160:sc= -1.76! (180deg=-2.8!) USER MOD Single : A 130 TYR OH : rot -170:sc= -0.704! USER MOD Single : A 131 MET CE :methyl 149:sc= -4.63! (180deg=-5.25!) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 142 CYS SG : rot 88:sc= -1.29 USER MOD Single : B 465 HIS : no HD1:sc= 0 X(o=0,f=-0.18) USER MOD Single : B 476 TYR OH : rot 180:sc=-0.000981 USER MOD Single : B 479 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 480 LYS NZ :NH3+ 167:sc= 0.0286 (180deg=0.0136) USER MOD ----------------------------------------------------------------- ATOM 70 N ARG A 86 -1.166 -12.307 -0.289 1.00 0.00 N ATOM 71 CA ARG A 86 -0.794 -11.141 -1.085 1.00 0.00 C ATOM 72 C ARG A 86 -1.685 -11.019 -2.312 1.00 0.00 C ATOM 73 O ARG A 86 -1.848 -11.970 -3.076 1.00 0.00 O ATOM 74 CB ARG A 86 0.677 -11.193 -1.504 1.00 0.00 C ATOM 75 CG ARG A 86 1.631 -10.755 -0.408 1.00 0.00 C ATOM 76 CD ARG A 86 3.037 -10.547 -0.943 1.00 0.00 C ATOM 77 NE ARG A 86 3.921 -9.971 0.069 1.00 0.00 N ATOM 78 CZ ARG A 86 5.089 -9.387 -0.202 1.00 0.00 C ATOM 79 NH1 ARG A 86 5.523 -9.294 -1.454 1.00 0.00 N ATOM 80 NH2 ARG A 86 5.819 -8.883 0.787 1.00 0.00 N ATOM 0 HA ARG A 86 -0.935 -10.260 -0.459 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.925 -12.210 -1.807 1.00 0.00 H new ATOM 0 HB3 ARG A 86 0.821 -10.557 -2.377 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.271 -9.829 0.041 1.00 0.00 H new ATOM 0 HG3 ARG A 86 1.649 -11.506 0.382 1.00 0.00 H new ATOM 0 HD2 ARG A 86 3.443 -11.501 -1.280 1.00 0.00 H new ATOM 0 HD3 ARG A 86 3.002 -9.890 -1.812 1.00 0.00 H new ATOM 0 HE ARG A 86 3.626 -10.019 1.044 1.00 0.00 H new ATOM 0 HH11 ARG A 86 4.962 -9.671 -2.218 1.00 0.00 H new ATOM 0 HH12 ARG A 86 6.418 -8.846 -1.652 1.00 0.00 H new ATOM 0 HH21 ARG A 86 5.486 -8.944 1.749 1.00 0.00 H new ATOM 0 HH22 ARG A 86 6.713 -8.436 0.584 1.00 0.00 H new ATOM 94 N VAL A 87 -2.261 -9.840 -2.478 1.00 0.00 N ATOM 95 CA VAL A 87 -3.234 -9.595 -3.529 1.00 0.00 C ATOM 96 C VAL A 87 -2.560 -9.530 -4.903 1.00 0.00 C ATOM 97 O VAL A 87 -1.408 -9.114 -5.026 1.00 0.00 O ATOM 98 CB VAL A 87 -4.017 -8.290 -3.247 1.00 0.00 C ATOM 99 CG1 VAL A 87 -3.095 -7.080 -3.270 1.00 0.00 C ATOM 100 CG2 VAL A 87 -5.166 -8.120 -4.228 1.00 0.00 C ATOM 0 H VAL A 87 -2.068 -9.029 -1.890 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.936 -10.429 -3.539 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.440 -8.366 -2.245 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -3.673 -6.178 -3.069 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.325 -7.195 -2.507 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.626 -6.999 -4.250 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -5.699 -7.195 -4.007 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.774 -8.079 -5.244 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.850 -8.964 -4.137 1.00 0.00 H new ATOM 110 N SER A 88 -3.293 -9.964 -5.922 1.00 0.00 N ATOM 111 CA SER A 88 -2.784 -10.018 -7.284 1.00 0.00 C ATOM 112 C SER A 88 -2.566 -8.617 -7.850 1.00 0.00 C ATOM 113 O SER A 88 -3.330 -7.690 -7.570 1.00 0.00 O ATOM 114 CB SER A 88 -3.778 -10.786 -8.152 1.00 0.00 C ATOM 115 OG SER A 88 -4.131 -12.020 -7.545 1.00 0.00 O ATOM 0 H SER A 88 -4.256 -10.288 -5.826 1.00 0.00 H new ATOM 0 HA SER A 88 -1.820 -10.526 -7.280 1.00 0.00 H new ATOM 0 HB2 SER A 88 -4.673 -10.183 -8.308 1.00 0.00 H new ATOM 0 HB3 SER A 88 -3.343 -10.970 -9.134 1.00 0.00 H new ATOM 0 HG SER A 88 -4.770 -12.495 -8.117 1.00 0.00 H new ATOM 121 N LEU A 89 -1.521 -8.487 -8.665 1.00 0.00 N ATOM 122 CA LEU A 89 -1.102 -7.204 -9.214 1.00 0.00 C ATOM 123 C LEU A 89 -2.156 -6.616 -10.148 1.00 0.00 C ATOM 124 O LEU A 89 -2.230 -5.402 -10.315 1.00 0.00 O ATOM 125 CB LEU A 89 0.221 -7.359 -9.950 1.00 0.00 C ATOM 126 CG LEU A 89 1.262 -6.292 -9.610 1.00 0.00 C ATOM 127 CD1 LEU A 89 2.623 -6.729 -10.090 1.00 0.00 C ATOM 128 CD2 LEU A 89 0.893 -4.949 -10.221 1.00 0.00 C ATOM 0 H LEU A 89 -0.941 -9.272 -8.962 1.00 0.00 H new ATOM 0 HA LEU A 89 -0.976 -6.512 -8.381 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.637 -8.340 -9.722 1.00 0.00 H new ATOM 0 HB3 LEU A 89 0.031 -7.335 -11.023 1.00 0.00 H new ATOM 0 HG LEU A 89 1.286 -6.172 -8.527 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.359 -5.963 -9.844 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.897 -7.665 -9.604 1.00 0.00 H new ATOM 0 HD13 LEU A 89 2.598 -6.875 -11.170 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.652 -4.211 -9.962 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.836 -5.046 -11.305 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -0.074 -4.627 -9.834 1.00 0.00 H new ATOM 140 N GLN A 90 -2.969 -7.478 -10.755 1.00 0.00 N ATOM 141 CA GLN A 90 -4.058 -7.018 -11.615 1.00 0.00 C ATOM 142 C GLN A 90 -5.035 -6.162 -10.819 1.00 0.00 C ATOM 143 O GLN A 90 -5.588 -5.187 -11.328 1.00 0.00 O ATOM 144 CB GLN A 90 -4.797 -8.197 -12.259 1.00 0.00 C ATOM 145 CG GLN A 90 -5.360 -9.207 -11.268 1.00 0.00 C ATOM 146 CD GLN A 90 -6.248 -10.241 -11.936 1.00 0.00 C ATOM 147 OE1 GLN A 90 -6.898 -9.963 -12.943 1.00 0.00 O ATOM 148 NE2 GLN A 90 -6.282 -11.443 -11.385 1.00 0.00 N ATOM 0 H GLN A 90 -2.896 -8.492 -10.669 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.621 -6.416 -12.412 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.614 -7.809 -12.867 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -4.114 -8.712 -12.935 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.538 -9.712 -10.761 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -5.931 -8.681 -10.503 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -5.729 -11.637 -10.550 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -6.861 -12.176 -11.795 1.00 0.00 H new ATOM 157 N ASN A 91 -5.222 -6.531 -9.560 1.00 0.00 N ATOM 158 CA ASN A 91 -6.088 -5.787 -8.656 1.00 0.00 C ATOM 159 C ASN A 91 -5.451 -4.456 -8.299 1.00 0.00 C ATOM 160 O ASN A 91 -6.129 -3.438 -8.186 1.00 0.00 O ATOM 161 CB ASN A 91 -6.355 -6.594 -7.383 1.00 0.00 C ATOM 162 CG ASN A 91 -7.318 -7.745 -7.605 1.00 0.00 C ATOM 163 OD1 ASN A 91 -7.443 -8.269 -8.713 1.00 0.00 O ATOM 164 ND2 ASN A 91 -7.992 -8.160 -6.546 1.00 0.00 N ATOM 0 H ASN A 91 -4.781 -7.349 -9.138 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.037 -5.605 -9.160 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.411 -6.985 -7.002 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.759 -5.932 -6.617 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.643 -8.940 -6.630 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -7.861 -7.700 -5.645 1.00 0.00 H new ATOM 171 N LEU A 92 -4.135 -4.476 -8.138 1.00 0.00 N ATOM 172 CA LEU A 92 -3.380 -3.271 -7.824 1.00 0.00 C ATOM 173 C LEU A 92 -3.398 -2.317 -9.010 1.00 0.00 C ATOM 174 O LEU A 92 -3.496 -1.108 -8.845 1.00 0.00 O ATOM 175 CB LEU A 92 -1.937 -3.632 -7.462 1.00 0.00 C ATOM 176 CG LEU A 92 -1.786 -4.661 -6.342 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.325 -5.032 -6.154 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.369 -4.121 -5.046 1.00 0.00 C ATOM 0 H LEU A 92 -3.566 -5.318 -8.220 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.845 -2.779 -6.969 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.440 -4.014 -8.354 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.414 -2.721 -7.170 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.336 -5.560 -6.621 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.236 -5.766 -5.353 1.00 0.00 H new ATOM 0 HD12 LEU A 92 0.065 -5.456 -7.079 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.246 -4.141 -5.895 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.254 -4.865 -4.258 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.844 -3.209 -4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.427 -3.902 -5.187 1.00 0.00 H new ATOM 190 N LYS A 93 -3.327 -2.875 -10.211 1.00 0.00 N ATOM 191 CA LYS A 93 -3.357 -2.083 -11.438 1.00 0.00 C ATOM 192 C LYS A 93 -4.663 -1.306 -11.582 1.00 0.00 C ATOM 193 O LYS A 93 -4.733 -0.320 -12.314 1.00 0.00 O ATOM 194 CB LYS A 93 -3.153 -2.988 -12.648 1.00 0.00 C ATOM 195 CG LYS A 93 -1.710 -3.428 -12.834 1.00 0.00 C ATOM 196 CD LYS A 93 -1.570 -4.426 -13.968 1.00 0.00 C ATOM 197 CE LYS A 93 -0.111 -4.730 -14.270 1.00 0.00 C ATOM 198 NZ LYS A 93 0.607 -3.550 -14.822 1.00 0.00 N ATOM 0 H LYS A 93 -3.248 -3.880 -10.364 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.545 -1.358 -11.383 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.784 -3.871 -12.543 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.484 -2.464 -13.545 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.087 -2.557 -13.037 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.343 -3.874 -11.909 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.088 -5.349 -13.707 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.053 -4.031 -14.862 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.386 -5.061 -13.358 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.053 -5.554 -14.981 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.506 -3.857 -15.246 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 0.019 -3.095 -15.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.799 -2.871 -14.058 1.00 0.00 H new ATOM 212 N ASN A 94 -5.690 -1.746 -10.871 1.00 0.00 N ATOM 213 CA ASN A 94 -6.988 -1.087 -10.911 1.00 0.00 C ATOM 214 C ASN A 94 -6.959 0.202 -10.098 1.00 0.00 C ATOM 215 O ASN A 94 -7.810 1.074 -10.264 1.00 0.00 O ATOM 216 CB ASN A 94 -8.075 -2.019 -10.371 1.00 0.00 C ATOM 217 CG ASN A 94 -8.254 -3.266 -11.216 1.00 0.00 C ATOM 218 OD1 ASN A 94 -8.135 -3.233 -12.442 1.00 0.00 O ATOM 219 ND2 ASN A 94 -8.507 -4.385 -10.560 1.00 0.00 N ATOM 0 H ASN A 94 -5.650 -2.560 -10.257 1.00 0.00 H new ATOM 0 HA ASN A 94 -7.215 -0.842 -11.949 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -7.824 -2.310 -9.351 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -9.020 -1.478 -10.325 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -8.611 -5.263 -11.069 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -8.598 -4.371 -9.544 1.00 0.00 H new ATOM 226 N LEU A 95 -5.962 0.325 -9.229 1.00 0.00 N ATOM 227 CA LEU A 95 -5.826 1.495 -8.369 1.00 0.00 C ATOM 228 C LEU A 95 -5.534 2.746 -9.191 1.00 0.00 C ATOM 229 O LEU A 95 -6.145 3.795 -8.980 1.00 0.00 O ATOM 230 CB LEU A 95 -4.701 1.277 -7.355 1.00 0.00 C ATOM 231 CG LEU A 95 -4.888 0.092 -6.404 1.00 0.00 C ATOM 232 CD1 LEU A 95 -3.647 -0.102 -5.552 1.00 0.00 C ATOM 233 CD2 LEU A 95 -6.107 0.294 -5.522 1.00 0.00 C ATOM 0 H LEU A 95 -5.232 -0.376 -9.101 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.769 1.636 -7.842 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.767 1.139 -7.900 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.592 2.184 -6.760 1.00 0.00 H new ATOM 0 HG LEU A 95 -5.045 -0.805 -7.004 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.795 -0.948 -4.881 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.790 -0.296 -6.197 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.464 0.798 -4.966 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -6.219 -0.561 -4.855 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -5.982 1.201 -4.931 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.996 0.387 -6.146 1.00 0.00 H new ATOM 245 N GLY A 96 -4.617 2.618 -10.143 1.00 0.00 N ATOM 246 CA GLY A 96 -4.190 3.758 -10.936 1.00 0.00 C ATOM 247 C GLY A 96 -5.263 4.276 -11.879 1.00 0.00 C ATOM 248 O GLY A 96 -5.138 5.370 -12.428 1.00 0.00 O ATOM 0 H GLY A 96 -4.158 1.739 -10.382 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.886 4.563 -10.267 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -3.311 3.478 -11.517 1.00 0.00 H new ATOM 252 N GLU A 97 -6.312 3.495 -12.079 1.00 0.00 N ATOM 253 CA GLU A 97 -7.406 3.909 -12.949 1.00 0.00 C ATOM 254 C GLU A 97 -8.642 4.270 -12.135 1.00 0.00 C ATOM 255 O GLU A 97 -9.708 4.544 -12.685 1.00 0.00 O ATOM 256 CB GLU A 97 -7.739 2.805 -13.949 1.00 0.00 C ATOM 257 CG GLU A 97 -8.039 1.465 -13.302 1.00 0.00 C ATOM 258 CD GLU A 97 -8.428 0.405 -14.306 1.00 0.00 C ATOM 259 OE1 GLU A 97 -9.640 0.167 -14.483 1.00 0.00 O ATOM 260 OE2 GLU A 97 -7.527 -0.199 -14.922 1.00 0.00 O ATOM 0 H GLU A 97 -6.431 2.575 -11.654 1.00 0.00 H new ATOM 0 HA GLU A 97 -7.085 4.795 -13.497 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.600 3.112 -14.543 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -6.903 2.687 -14.638 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -7.162 1.130 -12.748 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -8.846 1.588 -12.579 1.00 0.00 H new ATOM 267 N SER A 98 -8.488 4.270 -10.822 1.00 0.00 N ATOM 268 CA SER A 98 -9.579 4.609 -9.925 1.00 0.00 C ATOM 269 C SER A 98 -9.548 6.091 -9.569 1.00 0.00 C ATOM 270 O SER A 98 -8.641 6.558 -8.874 1.00 0.00 O ATOM 271 CB SER A 98 -9.502 3.761 -8.656 1.00 0.00 C ATOM 272 OG SER A 98 -9.676 2.386 -8.953 1.00 0.00 O ATOM 0 H SER A 98 -7.613 4.038 -10.352 1.00 0.00 H new ATOM 0 HA SER A 98 -10.519 4.399 -10.435 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.538 3.913 -8.171 1.00 0.00 H new ATOM 0 HB3 SER A 98 -10.268 4.084 -7.951 1.00 0.00 H new ATOM 0 HG SER A 98 -8.836 2.017 -9.298 1.00 0.00 H new ATOM 278 N ALA A 99 -10.555 6.819 -10.042 1.00 0.00 N ATOM 279 CA ALA A 99 -10.647 8.259 -9.818 1.00 0.00 C ATOM 280 C ALA A 99 -10.754 8.589 -8.333 1.00 0.00 C ATOM 281 O ALA A 99 -10.368 9.676 -7.897 1.00 0.00 O ATOM 282 CB ALA A 99 -11.836 8.833 -10.572 1.00 0.00 C ATOM 0 H ALA A 99 -11.325 6.432 -10.587 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.731 8.714 -10.195 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.894 9.907 -10.397 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -11.715 8.645 -11.639 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.753 8.359 -10.222 1.00 0.00 H new ATOM 288 N THR A 100 -11.275 7.651 -7.559 1.00 0.00 N ATOM 289 CA THR A 100 -11.421 7.839 -6.126 1.00 0.00 C ATOM 290 C THR A 100 -10.067 7.827 -5.418 1.00 0.00 C ATOM 291 O THR A 100 -9.805 8.658 -4.551 1.00 0.00 O ATOM 292 CB THR A 100 -12.318 6.748 -5.514 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.553 6.670 -6.237 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.601 7.043 -4.050 1.00 0.00 C ATOM 0 H THR A 100 -11.605 6.749 -7.901 1.00 0.00 H new ATOM 0 HA THR A 100 -11.886 8.814 -5.981 1.00 0.00 H new ATOM 0 HB THR A 100 -11.795 5.794 -5.583 1.00 0.00 H new ATOM 0 HG1 THR A 100 -14.119 5.973 -5.844 1.00 0.00 H new ATOM 0 HG21 THR A 100 -13.237 6.260 -3.637 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.662 7.077 -3.498 1.00 0.00 H new ATOM 0 HG23 THR A 100 -13.108 8.004 -3.964 1.00 0.00 H new ATOM 302 N LEU A 101 -9.193 6.909 -5.813 1.00 0.00 N ATOM 303 CA LEU A 101 -7.937 6.717 -5.102 1.00 0.00 C ATOM 304 C LEU A 101 -6.971 7.855 -5.391 1.00 0.00 C ATOM 305 O LEU A 101 -6.344 8.388 -4.483 1.00 0.00 O ATOM 306 CB LEU A 101 -7.284 5.387 -5.474 1.00 0.00 C ATOM 307 CG LEU A 101 -6.045 5.042 -4.644 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.437 4.647 -3.230 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.239 3.942 -5.308 1.00 0.00 C ATOM 0 H LEU A 101 -9.329 6.292 -6.614 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.168 6.706 -4.037 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -8.018 4.590 -5.359 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -7.006 5.414 -6.528 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.418 5.931 -4.586 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.541 4.406 -2.658 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.960 5.475 -2.753 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.091 3.776 -3.264 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.364 3.714 -4.700 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -5.855 3.048 -5.406 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -4.918 4.272 -6.296 1.00 0.00 H new ATOM 321 N ARG A 102 -6.865 8.231 -6.660 1.00 0.00 N ATOM 322 CA ARG A 102 -5.966 9.309 -7.061 1.00 0.00 C ATOM 323 C ARG A 102 -6.342 10.621 -6.385 1.00 0.00 C ATOM 324 O ARG A 102 -5.485 11.468 -6.149 1.00 0.00 O ATOM 325 CB ARG A 102 -5.969 9.486 -8.574 1.00 0.00 C ATOM 326 CG ARG A 102 -7.359 9.594 -9.172 1.00 0.00 C ATOM 327 CD ARG A 102 -7.299 10.068 -10.608 1.00 0.00 C ATOM 328 NE ARG A 102 -6.378 9.262 -11.404 1.00 0.00 N ATOM 329 CZ ARG A 102 -6.148 9.447 -12.700 1.00 0.00 C ATOM 330 NH1 ARG A 102 -6.794 10.394 -13.369 1.00 0.00 N ATOM 331 NH2 ARG A 102 -5.272 8.676 -13.327 1.00 0.00 N ATOM 0 H ARG A 102 -7.388 7.808 -7.427 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.961 9.031 -6.742 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -5.403 10.383 -8.827 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -5.451 8.643 -9.031 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.854 8.624 -9.126 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.959 10.287 -8.582 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -8.295 10.023 -11.048 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.985 11.112 -10.634 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.878 8.507 -10.935 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -7.472 10.986 -12.889 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -6.612 10.530 -14.363 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.778 7.945 -12.815 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -5.092 8.813 -14.321 1.00 0.00 H new ATOM 345 N SER A 103 -7.623 10.777 -6.064 1.00 0.00 N ATOM 346 CA SER A 103 -8.095 11.953 -5.350 1.00 0.00 C ATOM 347 C SER A 103 -7.423 12.033 -3.980 1.00 0.00 C ATOM 348 O SER A 103 -7.226 13.114 -3.425 1.00 0.00 O ATOM 349 CB SER A 103 -9.620 11.899 -5.202 1.00 0.00 C ATOM 350 OG SER A 103 -10.127 13.074 -4.595 1.00 0.00 O ATOM 0 H SER A 103 -8.352 10.100 -6.289 1.00 0.00 H new ATOM 0 HA SER A 103 -7.835 12.847 -5.917 1.00 0.00 H new ATOM 0 HB2 SER A 103 -10.077 11.769 -6.183 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.898 11.031 -4.604 1.00 0.00 H new ATOM 0 HG SER A 103 -11.102 13.008 -4.517 1.00 0.00 H new ATOM 356 N LEU A 104 -7.042 10.875 -3.457 1.00 0.00 N ATOM 357 CA LEU A 104 -6.391 10.797 -2.163 1.00 0.00 C ATOM 358 C LEU A 104 -4.895 11.051 -2.312 1.00 0.00 C ATOM 359 O LEU A 104 -4.263 11.641 -1.438 1.00 0.00 O ATOM 360 CB LEU A 104 -6.639 9.425 -1.534 1.00 0.00 C ATOM 361 CG LEU A 104 -8.088 8.936 -1.606 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.238 7.603 -0.899 1.00 0.00 C ATOM 363 CD2 LEU A 104 -9.035 9.969 -1.015 1.00 0.00 C ATOM 0 H LEU A 104 -7.175 9.973 -3.915 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.810 11.562 -1.509 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.999 8.694 -2.028 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.334 9.460 -0.488 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.350 8.797 -2.655 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.275 7.273 -0.961 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.593 6.864 -1.374 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.954 7.712 0.148 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -10.059 9.601 -1.076 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.775 10.146 0.029 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.950 10.901 -1.573 1.00 0.00 H new ATOM 375 N LEU A 105 -4.339 10.640 -3.448 1.00 0.00 N ATOM 376 CA LEU A 105 -2.919 10.852 -3.725 1.00 0.00 C ATOM 377 C LEU A 105 -2.656 12.305 -4.101 1.00 0.00 C ATOM 378 O LEU A 105 -1.533 12.684 -4.427 1.00 0.00 O ATOM 379 CB LEU A 105 -2.414 9.931 -4.842 1.00 0.00 C ATOM 380 CG LEU A 105 -2.069 8.498 -4.421 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.323 7.682 -4.162 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.208 7.830 -5.479 1.00 0.00 C ATOM 0 H LEU A 105 -4.847 10.159 -4.191 1.00 0.00 H new ATOM 0 HA LEU A 105 -2.374 10.611 -2.812 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -3.174 9.887 -5.622 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.527 10.383 -5.286 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.506 8.547 -3.489 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -3.044 6.671 -3.865 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.902 8.148 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.924 7.641 -5.070 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.971 6.813 -5.166 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -1.750 7.802 -6.424 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.285 8.395 -5.607 1.00 0.00 H new ATOM 394 N LEU A 106 -3.702 13.113 -4.061 1.00 0.00 N ATOM 395 CA LEU A 106 -3.573 14.541 -4.288 1.00 0.00 C ATOM 396 C LEU A 106 -3.059 15.228 -3.026 1.00 0.00 C ATOM 397 O LEU A 106 -2.715 16.409 -3.039 1.00 0.00 O ATOM 398 CB LEU A 106 -4.914 15.123 -4.717 1.00 0.00 C ATOM 399 CG LEU A 106 -5.465 14.566 -6.032 1.00 0.00 C ATOM 400 CD1 LEU A 106 -6.750 15.273 -6.407 1.00 0.00 C ATOM 401 CD2 LEU A 106 -4.440 14.695 -7.149 1.00 0.00 C ATOM 0 H LEU A 106 -4.655 12.801 -3.872 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.853 14.714 -5.088 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.643 14.940 -3.927 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.811 16.204 -4.811 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.679 13.507 -5.890 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -7.129 14.866 -7.344 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -7.490 15.124 -5.621 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -6.557 16.339 -6.526 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.856 14.292 -8.073 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -4.188 15.746 -7.292 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -3.541 14.140 -6.883 1.00 0.00 H new ATOM 413 N ASN A 107 -3.011 14.469 -1.934 1.00 0.00 N ATOM 414 CA ASN A 107 -2.468 14.960 -0.674 1.00 0.00 C ATOM 415 C ASN A 107 -0.976 14.661 -0.603 1.00 0.00 C ATOM 416 O ASN A 107 -0.566 13.498 -0.621 1.00 0.00 O ATOM 417 CB ASN A 107 -3.165 14.300 0.523 1.00 0.00 C ATOM 418 CG ASN A 107 -4.656 14.554 0.560 1.00 0.00 C ATOM 419 OD1 ASN A 107 -5.113 15.576 1.070 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.422 13.612 0.047 1.00 0.00 N ATOM 0 H ASN A 107 -3.344 13.506 -1.899 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.638 16.036 -0.632 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.987 13.225 0.491 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.717 14.670 1.445 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.437 13.715 0.063 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.000 12.780 -0.366 1.00 0.00 H new ATOM 427 N PRO A 108 -0.148 15.718 -0.532 1.00 0.00 N ATOM 428 CA PRO A 108 1.313 15.590 -0.449 1.00 0.00 C ATOM 429 C PRO A 108 1.770 14.702 0.705 1.00 0.00 C ATOM 430 O PRO A 108 2.706 13.916 0.559 1.00 0.00 O ATOM 431 CB PRO A 108 1.787 17.029 -0.230 1.00 0.00 C ATOM 432 CG PRO A 108 0.705 17.876 -0.796 1.00 0.00 C ATOM 433 CD PRO A 108 -0.574 17.129 -0.545 1.00 0.00 C ATOM 0 HA PRO A 108 1.722 15.118 -1.342 1.00 0.00 H new ATOM 0 HB2 PRO A 108 1.940 17.238 0.829 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.737 17.213 -0.732 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.686 18.856 -0.319 1.00 0.00 H new ATOM 0 HG3 PRO A 108 0.857 18.044 -1.862 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -1.030 17.420 0.401 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -1.310 17.319 -1.326 1.00 0.00 H new ATOM 441 N HIS A 109 1.102 14.821 1.845 1.00 0.00 N ATOM 442 CA HIS A 109 1.470 14.045 3.021 1.00 0.00 C ATOM 443 C HIS A 109 1.165 12.565 2.811 1.00 0.00 C ATOM 444 O HIS A 109 1.968 11.702 3.171 1.00 0.00 O ATOM 445 CB HIS A 109 0.740 14.567 4.263 1.00 0.00 C ATOM 446 CG HIS A 109 0.975 13.743 5.492 1.00 0.00 C ATOM 447 ND1 HIS A 109 2.018 14.002 6.349 1.00 0.00 N ATOM 448 CD2 HIS A 109 0.274 12.683 5.955 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.926 13.099 7.310 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.887 12.281 7.112 1.00 0.00 N ATOM 0 H HIS A 109 0.306 15.445 1.980 1.00 0.00 H new ATOM 0 HA HIS A 109 2.543 14.157 3.177 1.00 0.00 H new ATOM 0 HB2 HIS A 109 1.059 15.591 4.457 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.330 14.600 4.058 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -0.600 12.240 5.501 1.00 0.00 H new ATOM 0 HE1 HIS A 109 2.604 13.031 8.148 1.00 0.00 H new ATOM 0 HE2 HIS A 109 0.604 11.504 7.710 1.00 0.00 H new ATOM 458 N LEU A 110 0.011 12.275 2.218 1.00 0.00 N ATOM 459 CA LEU A 110 -0.398 10.900 1.979 1.00 0.00 C ATOM 460 C LEU A 110 0.628 10.209 1.086 1.00 0.00 C ATOM 461 O LEU A 110 0.995 9.053 1.311 1.00 0.00 O ATOM 462 CB LEU A 110 -1.790 10.883 1.333 1.00 0.00 C ATOM 463 CG LEU A 110 -2.597 9.589 1.497 1.00 0.00 C ATOM 464 CD1 LEU A 110 -4.028 9.807 1.045 1.00 0.00 C ATOM 465 CD2 LEU A 110 -1.973 8.447 0.712 1.00 0.00 C ATOM 0 H LEU A 110 -0.656 12.976 1.895 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.450 10.360 2.924 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.372 11.705 1.751 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.676 11.083 0.268 1.00 0.00 H new ATOM 0 HG LEU A 110 -2.589 9.319 2.553 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -4.592 8.882 1.165 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -4.484 10.592 1.648 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -4.037 10.104 -0.004 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -2.568 7.544 0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -1.944 8.706 -0.346 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -0.959 8.271 1.070 1.00 0.00 H new ATOM 477 N ARG A 111 1.116 10.942 0.096 1.00 0.00 N ATOM 478 CA ARG A 111 2.107 10.405 -0.827 1.00 0.00 C ATOM 479 C ARG A 111 3.411 10.124 -0.100 1.00 0.00 C ATOM 480 O ARG A 111 4.054 9.105 -0.339 1.00 0.00 O ATOM 481 CB ARG A 111 2.357 11.361 -1.990 1.00 0.00 C ATOM 482 CG ARG A 111 1.150 11.550 -2.889 1.00 0.00 C ATOM 483 CD ARG A 111 1.499 12.369 -4.120 1.00 0.00 C ATOM 484 NE ARG A 111 2.060 13.673 -3.773 1.00 0.00 N ATOM 485 CZ ARG A 111 1.444 14.833 -3.982 1.00 0.00 C ATOM 486 NH1 ARG A 111 0.204 14.861 -4.455 1.00 0.00 N ATOM 487 NH2 ARG A 111 2.063 15.967 -3.696 1.00 0.00 N ATOM 0 H ARG A 111 0.843 11.907 -0.089 1.00 0.00 H new ATOM 0 HA ARG A 111 1.713 9.472 -1.230 1.00 0.00 H new ATOM 0 HB2 ARG A 111 2.660 12.330 -1.594 1.00 0.00 H new ATOM 0 HB3 ARG A 111 3.189 10.985 -2.586 1.00 0.00 H new ATOM 0 HG2 ARG A 111 0.766 10.577 -3.194 1.00 0.00 H new ATOM 0 HG3 ARG A 111 0.355 12.046 -2.333 1.00 0.00 H new ATOM 0 HD2 ARG A 111 2.215 11.818 -4.730 1.00 0.00 H new ATOM 0 HD3 ARG A 111 0.604 12.510 -4.727 1.00 0.00 H new ATOM 0 HE ARG A 111 2.984 13.695 -3.342 1.00 0.00 H new ATOM 0 HH11 ARG A 111 -0.283 13.989 -4.661 1.00 0.00 H new ATOM 0 HH12 ARG A 111 -0.262 15.755 -4.613 1.00 0.00 H new ATOM 0 HH21 ARG A 111 3.010 15.950 -3.317 1.00 0.00 H new ATOM 0 HH22 ARG A 111 1.594 16.858 -3.855 1.00 0.00 H new ATOM 501 N GLN A 112 3.792 11.025 0.797 1.00 0.00 N ATOM 502 CA GLN A 112 4.998 10.839 1.590 1.00 0.00 C ATOM 503 C GLN A 112 4.874 9.624 2.492 1.00 0.00 C ATOM 504 O GLN A 112 5.847 8.905 2.701 1.00 0.00 O ATOM 505 CB GLN A 112 5.314 12.083 2.417 1.00 0.00 C ATOM 506 CG GLN A 112 5.978 13.183 1.609 1.00 0.00 C ATOM 507 CD GLN A 112 7.251 12.713 0.924 1.00 0.00 C ATOM 508 OE1 GLN A 112 7.603 13.197 -0.153 1.00 0.00 O ATOM 509 NE2 GLN A 112 7.956 11.778 1.550 1.00 0.00 N ATOM 0 H GLN A 112 3.285 11.888 0.992 1.00 0.00 H new ATOM 0 HA GLN A 112 5.823 10.672 0.897 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.391 12.467 2.852 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.966 11.805 3.245 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.279 13.550 0.858 1.00 0.00 H new ATOM 0 HG3 GLN A 112 6.210 14.022 2.265 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.629 11.404 2.441 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.825 11.434 1.140 1.00 0.00 H new ATOM 518 N LEU A 113 3.679 9.392 3.016 1.00 0.00 N ATOM 519 CA LEU A 113 3.418 8.190 3.793 1.00 0.00 C ATOM 520 C LEU A 113 3.699 6.960 2.940 1.00 0.00 C ATOM 521 O LEU A 113 4.395 6.043 3.368 1.00 0.00 O ATOM 522 CB LEU A 113 1.971 8.170 4.298 1.00 0.00 C ATOM 523 CG LEU A 113 1.627 9.242 5.336 1.00 0.00 C ATOM 524 CD1 LEU A 113 0.161 9.163 5.716 1.00 0.00 C ATOM 525 CD2 LEU A 113 2.497 9.093 6.575 1.00 0.00 C ATOM 0 H LEU A 113 2.879 10.017 2.918 1.00 0.00 H new ATOM 0 HA LEU A 113 4.077 8.184 4.661 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.304 8.287 3.444 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.768 7.190 4.730 1.00 0.00 H new ATOM 0 HG LEU A 113 1.822 10.218 4.892 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.065 9.932 6.454 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.454 9.319 4.829 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.053 8.181 6.138 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.235 9.865 7.299 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.334 8.110 7.018 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.546 9.197 6.298 1.00 0.00 H new ATOM 537 N MET A 114 3.185 6.970 1.720 1.00 0.00 N ATOM 538 CA MET A 114 3.435 5.893 0.770 1.00 0.00 C ATOM 539 C MET A 114 4.932 5.731 0.508 1.00 0.00 C ATOM 540 O MET A 114 5.457 4.624 0.561 1.00 0.00 O ATOM 541 CB MET A 114 2.689 6.160 -0.537 1.00 0.00 C ATOM 542 CG MET A 114 1.200 5.864 -0.461 1.00 0.00 C ATOM 543 SD MET A 114 0.295 6.524 -1.874 1.00 0.00 S ATOM 544 CE MET A 114 1.128 5.695 -3.223 1.00 0.00 C ATOM 0 H MET A 114 2.589 7.716 1.361 1.00 0.00 H new ATOM 0 HA MET A 114 3.066 4.963 1.202 1.00 0.00 H new ATOM 0 HB2 MET A 114 2.829 7.204 -0.819 1.00 0.00 H new ATOM 0 HB3 MET A 114 3.131 5.554 -1.328 1.00 0.00 H new ATOM 0 HG2 MET A 114 1.049 4.786 -0.408 1.00 0.00 H new ATOM 0 HG3 MET A 114 0.794 6.289 0.457 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.469 5.659 -4.090 1.00 0.00 H new ATOM 0 HE2 MET A 114 2.036 6.240 -3.480 1.00 0.00 H new ATOM 0 HE3 MET A 114 1.387 4.680 -2.922 1.00 0.00 H new ATOM 554 N VAL A 115 5.617 6.844 0.252 1.00 0.00 N ATOM 555 CA VAL A 115 7.052 6.836 0.015 1.00 0.00 C ATOM 556 C VAL A 115 7.804 6.239 1.202 1.00 0.00 C ATOM 557 O VAL A 115 8.739 5.459 1.031 1.00 0.00 O ATOM 558 CB VAL A 115 7.563 8.266 -0.248 1.00 0.00 C ATOM 559 CG1 VAL A 115 9.066 8.277 -0.407 1.00 0.00 C ATOM 560 CG2 VAL A 115 6.899 8.857 -1.480 1.00 0.00 C ATOM 0 H VAL A 115 5.192 7.770 0.204 1.00 0.00 H new ATOM 0 HA VAL A 115 7.237 6.217 -0.863 1.00 0.00 H new ATOM 0 HB VAL A 115 7.302 8.880 0.614 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.405 9.296 -0.592 1.00 0.00 H new ATOM 0 HG12 VAL A 115 9.531 7.900 0.504 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.348 7.643 -1.248 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.275 9.867 -1.647 1.00 0.00 H new ATOM 0 HG22 VAL A 115 7.126 8.238 -2.348 1.00 0.00 H new ATOM 0 HG23 VAL A 115 5.820 8.891 -1.331 1.00 0.00 H new ATOM 570 N ASN A 116 7.387 6.615 2.402 1.00 0.00 N ATOM 571 CA ASN A 116 8.012 6.131 3.626 1.00 0.00 C ATOM 572 C ASN A 116 7.774 4.634 3.811 1.00 0.00 C ATOM 573 O ASN A 116 8.693 3.884 4.143 1.00 0.00 O ATOM 574 CB ASN A 116 7.470 6.902 4.834 1.00 0.00 C ATOM 575 CG ASN A 116 7.993 8.321 4.911 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.102 8.616 4.465 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.197 9.214 5.480 1.00 0.00 N ATOM 0 H ASN A 116 6.611 7.260 2.555 1.00 0.00 H new ATOM 0 HA ASN A 116 9.086 6.297 3.546 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.381 6.924 4.786 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.738 6.371 5.747 1.00 0.00 H new ATOM 0 HD21 ASN A 116 7.496 10.186 5.561 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.285 8.930 5.837 1.00 0.00 H new ATOM 584 N LEU A 117 6.537 4.202 3.580 1.00 0.00 N ATOM 585 CA LEU A 117 6.159 2.808 3.780 1.00 0.00 C ATOM 586 C LEU A 117 6.746 1.910 2.694 1.00 0.00 C ATOM 587 O LEU A 117 7.030 0.737 2.944 1.00 0.00 O ATOM 588 CB LEU A 117 4.637 2.678 3.805 1.00 0.00 C ATOM 589 CG LEU A 117 4.101 1.281 4.115 1.00 0.00 C ATOM 590 CD1 LEU A 117 4.522 0.837 5.508 1.00 0.00 C ATOM 591 CD2 LEU A 117 2.586 1.255 3.981 1.00 0.00 C ATOM 0 H LEU A 117 5.778 4.800 3.253 1.00 0.00 H new ATOM 0 HA LEU A 117 6.565 2.483 4.738 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.243 3.372 4.547 1.00 0.00 H new ATOM 0 HB3 LEU A 117 4.247 2.991 2.836 1.00 0.00 H new ATOM 0 HG LEU A 117 4.526 0.583 3.394 1.00 0.00 H new ATOM 0 HD11 LEU A 117 4.129 -0.160 5.706 1.00 0.00 H new ATOM 0 HD12 LEU A 117 5.610 0.817 5.570 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.129 1.535 6.247 1.00 0.00 H new ATOM 0 HD21 LEU A 117 2.218 0.254 4.205 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.147 1.967 4.679 1.00 0.00 H new ATOM 0 HD23 LEU A 117 2.306 1.525 2.963 1.00 0.00 H new ATOM 603 N ASP A 118 6.911 2.458 1.490 1.00 0.00 N ATOM 604 CA ASP A 118 7.523 1.724 0.383 1.00 0.00 C ATOM 605 C ASP A 118 8.892 1.192 0.783 1.00 0.00 C ATOM 606 O ASP A 118 9.219 0.026 0.537 1.00 0.00 O ATOM 607 CB ASP A 118 7.668 2.632 -0.837 1.00 0.00 C ATOM 608 CG ASP A 118 8.170 1.888 -2.061 1.00 0.00 C ATOM 609 OD1 ASP A 118 7.397 1.082 -2.621 1.00 0.00 O ATOM 610 OD2 ASP A 118 9.321 2.132 -2.487 1.00 0.00 O ATOM 0 H ASP A 118 6.629 3.410 1.256 1.00 0.00 H new ATOM 0 HA ASP A 118 6.875 0.884 0.134 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.704 3.087 -1.063 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.357 3.444 -0.602 1.00 0.00 H new ATOM 615 N GLN A 119 9.663 2.049 1.444 1.00 0.00 N ATOM 616 CA GLN A 119 11.027 1.719 1.838 1.00 0.00 C ATOM 617 C GLN A 119 11.040 0.624 2.888 1.00 0.00 C ATOM 618 O GLN A 119 11.971 -0.172 2.973 1.00 0.00 O ATOM 619 CB GLN A 119 11.720 2.962 2.388 1.00 0.00 C ATOM 620 CG GLN A 119 11.559 4.174 1.493 1.00 0.00 C ATOM 621 CD GLN A 119 12.192 5.422 2.070 1.00 0.00 C ATOM 622 OE1 GLN A 119 13.185 5.356 2.793 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.612 6.569 1.763 1.00 0.00 N ATOM 0 H GLN A 119 9.363 2.984 1.720 1.00 0.00 H new ATOM 0 HA GLN A 119 11.559 1.360 0.957 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.317 3.190 3.375 1.00 0.00 H new ATOM 0 HB3 GLN A 119 12.782 2.752 2.518 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.005 3.963 0.521 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.498 4.356 1.324 1.00 0.00 H new ATOM 0 HE21 GLN A 119 10.790 6.579 1.160 1.00 0.00 H new ATOM 0 HE22 GLN A 119 11.987 7.444 2.129 1.00 0.00 H new ATOM 632 N GLY A 120 9.988 0.607 3.694 1.00 0.00 N ATOM 633 CA GLY A 120 9.790 -0.455 4.659 1.00 0.00 C ATOM 634 C GLY A 120 10.854 -0.491 5.739 1.00 0.00 C ATOM 635 O GLY A 120 11.058 -1.532 6.362 1.00 0.00 O ATOM 0 H GLY A 120 9.259 1.320 3.696 1.00 0.00 H new ATOM 0 HA2 GLY A 120 8.812 -0.335 5.126 1.00 0.00 H new ATOM 0 HA3 GLY A 120 9.779 -1.412 4.138 1.00 0.00 H new ATOM 639 N GLU A 121 11.530 0.639 5.956 1.00 0.00 N ATOM 640 CA GLU A 121 12.596 0.726 6.956 1.00 0.00 C ATOM 641 C GLU A 121 12.099 0.265 8.321 1.00 0.00 C ATOM 642 O GLU A 121 12.728 -0.568 8.973 1.00 0.00 O ATOM 643 CB GLU A 121 13.137 2.156 7.039 1.00 0.00 C ATOM 644 CG GLU A 121 13.937 2.579 5.816 1.00 0.00 C ATOM 645 CD GLU A 121 15.237 1.809 5.671 1.00 0.00 C ATOM 646 OE1 GLU A 121 15.291 0.858 4.864 1.00 0.00 O ATOM 647 OE2 GLU A 121 16.217 2.150 6.371 1.00 0.00 O ATOM 0 H GLU A 121 11.358 1.508 5.451 1.00 0.00 H new ATOM 0 HA GLU A 121 13.406 0.065 6.648 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.302 2.844 7.172 1.00 0.00 H new ATOM 0 HB3 GLU A 121 13.768 2.246 7.924 1.00 0.00 H new ATOM 0 HG2 GLU A 121 13.331 2.432 4.922 1.00 0.00 H new ATOM 0 HG3 GLU A 121 14.156 3.645 5.881 1.00 0.00 H new ATOM 654 N ASP A 122 10.968 0.803 8.745 1.00 0.00 N ATOM 655 CA ASP A 122 10.317 0.329 9.956 1.00 0.00 C ATOM 656 C ASP A 122 8.830 0.177 9.701 1.00 0.00 C ATOM 657 O ASP A 122 8.002 0.912 10.243 1.00 0.00 O ATOM 658 CB ASP A 122 10.561 1.273 11.135 1.00 0.00 C ATOM 659 CG ASP A 122 10.264 0.612 12.472 1.00 0.00 C ATOM 660 OD1 ASP A 122 10.973 0.909 13.451 1.00 0.00 O ATOM 661 OD2 ASP A 122 9.333 -0.223 12.546 1.00 0.00 O ATOM 0 H ASP A 122 10.483 1.565 8.272 1.00 0.00 H new ATOM 0 HA ASP A 122 10.746 -0.638 10.220 1.00 0.00 H new ATOM 0 HB2 ASP A 122 11.598 1.609 11.120 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.937 2.160 11.023 1.00 0.00 H new ATOM 666 N LYS A 123 8.512 -0.773 8.838 1.00 0.00 N ATOM 667 CA LYS A 123 7.133 -1.127 8.530 1.00 0.00 C ATOM 668 C LYS A 123 6.336 -1.425 9.803 1.00 0.00 C ATOM 669 O LYS A 123 5.135 -1.181 9.853 1.00 0.00 O ATOM 670 CB LYS A 123 7.085 -2.342 7.585 1.00 0.00 C ATOM 671 CG LYS A 123 7.656 -3.633 8.174 1.00 0.00 C ATOM 672 CD LYS A 123 9.176 -3.592 8.292 1.00 0.00 C ATOM 673 CE LYS A 123 9.725 -4.831 8.975 1.00 0.00 C ATOM 674 NZ LYS A 123 9.407 -6.075 8.224 1.00 0.00 N ATOM 0 H LYS A 123 9.204 -1.323 8.329 1.00 0.00 H new ATOM 0 HA LYS A 123 6.676 -0.271 8.034 1.00 0.00 H new ATOM 0 HB2 LYS A 123 6.049 -2.518 7.294 1.00 0.00 H new ATOM 0 HB3 LYS A 123 7.635 -2.100 6.675 1.00 0.00 H new ATOM 0 HG2 LYS A 123 7.222 -3.804 9.159 1.00 0.00 H new ATOM 0 HG3 LYS A 123 7.365 -4.476 7.547 1.00 0.00 H new ATOM 0 HD2 LYS A 123 9.615 -3.501 7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.473 -2.706 8.854 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.806 -4.738 9.079 1.00 0.00 H new ATOM 0 HE3 LYS A 123 9.313 -4.901 9.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 9.913 -6.877 8.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 8.383 -6.252 8.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 9.702 -5.967 7.233 1.00 0.00 H new ATOM 688 N ALA A 124 7.014 -1.926 10.833 1.00 0.00 N ATOM 689 CA ALA A 124 6.349 -2.288 12.079 1.00 0.00 C ATOM 690 C ALA A 124 5.739 -1.065 12.753 1.00 0.00 C ATOM 691 O ALA A 124 4.635 -1.129 13.297 1.00 0.00 O ATOM 692 CB ALA A 124 7.318 -2.986 13.019 1.00 0.00 C ATOM 0 H ALA A 124 8.021 -2.090 10.828 1.00 0.00 H new ATOM 0 HA ALA A 124 5.540 -2.978 11.838 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.803 -3.248 13.943 1.00 0.00 H new ATOM 0 HB2 ALA A 124 7.696 -3.892 12.545 1.00 0.00 H new ATOM 0 HB3 ALA A 124 8.151 -2.319 13.244 1.00 0.00 H new ATOM 698 N LYS A 125 6.460 0.047 12.723 1.00 0.00 N ATOM 699 CA LYS A 125 5.939 1.298 13.248 1.00 0.00 C ATOM 700 C LYS A 125 4.988 1.941 12.258 1.00 0.00 C ATOM 701 O LYS A 125 3.886 2.345 12.623 1.00 0.00 O ATOM 702 CB LYS A 125 7.067 2.272 13.573 1.00 0.00 C ATOM 703 CG LYS A 125 7.804 1.948 14.860 1.00 0.00 C ATOM 704 CD LYS A 125 8.959 2.910 15.095 1.00 0.00 C ATOM 705 CE LYS A 125 8.492 4.358 15.152 1.00 0.00 C ATOM 706 NZ LYS A 125 7.593 4.615 16.311 1.00 0.00 N ATOM 0 H LYS A 125 7.404 0.107 12.342 1.00 0.00 H new ATOM 0 HA LYS A 125 5.400 1.067 14.166 1.00 0.00 H new ATOM 0 HB2 LYS A 125 7.780 2.276 12.748 1.00 0.00 H new ATOM 0 HB3 LYS A 125 6.656 3.279 13.644 1.00 0.00 H new ATOM 0 HG2 LYS A 125 7.111 1.997 15.700 1.00 0.00 H new ATOM 0 HG3 LYS A 125 8.182 0.927 14.817 1.00 0.00 H new ATOM 0 HD2 LYS A 125 9.460 2.654 16.028 1.00 0.00 H new ATOM 0 HD3 LYS A 125 9.693 2.797 14.297 1.00 0.00 H new ATOM 0 HE2 LYS A 125 9.359 5.015 15.215 1.00 0.00 H new ATOM 0 HE3 LYS A 125 7.970 4.606 14.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 7.369 5.629 16.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.714 4.071 16.196 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 8.068 4.324 17.190 1.00 0.00 H new ATOM 720 N LEU A 126 5.414 2.018 11.003 1.00 0.00 N ATOM 721 CA LEU A 126 4.643 2.694 9.968 1.00 0.00 C ATOM 722 C LEU A 126 3.238 2.108 9.839 1.00 0.00 C ATOM 723 O LEU A 126 2.263 2.842 9.817 1.00 0.00 O ATOM 724 CB LEU A 126 5.374 2.617 8.626 1.00 0.00 C ATOM 725 CG LEU A 126 6.772 3.245 8.610 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.460 2.981 7.282 1.00 0.00 C ATOM 727 CD2 LEU A 126 6.706 4.741 8.878 1.00 0.00 C ATOM 0 H LEU A 126 6.294 1.618 10.677 1.00 0.00 H new ATOM 0 HA LEU A 126 4.541 3.739 10.260 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.460 1.570 8.336 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.763 3.108 7.869 1.00 0.00 H new ATOM 0 HG LEU A 126 7.354 2.782 9.407 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.451 3.434 7.289 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.554 1.906 7.128 1.00 0.00 H new ATOM 0 HD13 LEU A 126 6.869 3.413 6.474 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.713 5.159 8.860 1.00 0.00 H new ATOM 0 HD22 LEU A 126 6.100 5.222 8.110 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.258 4.916 9.856 1.00 0.00 H new ATOM 739 N MET A 127 3.132 0.787 9.789 1.00 0.00 N ATOM 740 CA MET A 127 1.832 0.137 9.617 1.00 0.00 C ATOM 741 C MET A 127 0.838 0.562 10.697 1.00 0.00 C ATOM 742 O MET A 127 -0.353 0.702 10.431 1.00 0.00 O ATOM 743 CB MET A 127 1.979 -1.385 9.624 1.00 0.00 C ATOM 744 CG MET A 127 2.607 -1.962 8.360 1.00 0.00 C ATOM 745 SD MET A 127 1.404 -2.376 7.074 1.00 0.00 S ATOM 746 CE MET A 127 0.713 -0.774 6.666 1.00 0.00 C ATOM 0 H MET A 127 3.921 0.145 9.864 1.00 0.00 H new ATOM 0 HA MET A 127 1.443 0.456 8.650 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.586 -1.676 10.482 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.995 -1.832 9.763 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.321 -1.243 7.959 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.170 -2.858 8.621 1.00 0.00 H new ATOM 0 HE1 MET A 127 0.244 -0.820 5.683 1.00 0.00 H new ATOM 0 HE2 MET A 127 -0.033 -0.499 7.411 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.507 -0.027 6.655 1.00 0.00 H new ATOM 756 N ARG A 128 1.333 0.774 11.907 1.00 0.00 N ATOM 757 CA ARG A 128 0.483 1.205 13.010 1.00 0.00 C ATOM 758 C ARG A 128 0.298 2.717 12.983 1.00 0.00 C ATOM 759 O ARG A 128 -0.813 3.225 13.138 1.00 0.00 O ATOM 760 CB ARG A 128 1.087 0.781 14.351 1.00 0.00 C ATOM 761 CG ARG A 128 1.209 -0.723 14.522 1.00 0.00 C ATOM 762 CD ARG A 128 1.775 -1.084 15.885 1.00 0.00 C ATOM 763 NE ARG A 128 1.865 -2.531 16.073 1.00 0.00 N ATOM 764 CZ ARG A 128 2.611 -3.120 17.010 1.00 0.00 C ATOM 765 NH1 ARG A 128 3.309 -2.385 17.869 1.00 0.00 N ATOM 766 NH2 ARG A 128 2.645 -4.445 17.093 1.00 0.00 N ATOM 0 H ARG A 128 2.316 0.655 12.151 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.490 0.728 12.894 1.00 0.00 H new ATOM 0 HB2 ARG A 128 2.075 1.230 14.451 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.472 1.180 15.158 1.00 0.00 H new ATOM 0 HG2 ARG A 128 0.229 -1.185 14.400 1.00 0.00 H new ATOM 0 HG3 ARG A 128 1.852 -1.128 13.741 1.00 0.00 H new ATOM 0 HD2 ARG A 128 2.765 -0.641 15.996 1.00 0.00 H new ATOM 0 HD3 ARG A 128 1.145 -0.655 16.665 1.00 0.00 H new ATOM 0 HE ARG A 128 1.323 -3.128 15.448 1.00 0.00 H new ATOM 0 HH11 ARG A 128 3.276 -1.367 17.814 1.00 0.00 H new ATOM 0 HH12 ARG A 128 3.878 -2.839 18.584 1.00 0.00 H new ATOM 0 HH21 ARG A 128 2.102 -5.011 16.441 1.00 0.00 H new ATOM 0 HH22 ARG A 128 3.215 -4.897 17.808 1.00 0.00 H new ATOM 780 N ALA A 129 1.395 3.429 12.757 1.00 0.00 N ATOM 781 CA ALA A 129 1.399 4.886 12.784 1.00 0.00 C ATOM 782 C ALA A 129 0.605 5.481 11.628 1.00 0.00 C ATOM 783 O ALA A 129 0.181 6.629 11.688 1.00 0.00 O ATOM 784 CB ALA A 129 2.828 5.405 12.760 1.00 0.00 C ATOM 0 H ALA A 129 2.304 3.014 12.551 1.00 0.00 H new ATOM 0 HA ALA A 129 0.914 5.198 13.709 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.820 6.495 12.780 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.366 5.030 13.631 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.324 5.063 11.852 1.00 0.00 H new ATOM 790 N TYR A 130 0.409 4.706 10.573 1.00 0.00 N ATOM 791 CA TYR A 130 -0.344 5.178 9.418 1.00 0.00 C ATOM 792 C TYR A 130 -1.843 5.052 9.655 1.00 0.00 C ATOM 793 O TYR A 130 -2.633 5.834 9.129 1.00 0.00 O ATOM 794 CB TYR A 130 0.039 4.393 8.165 1.00 0.00 C ATOM 795 CG TYR A 130 1.386 4.756 7.577 1.00 0.00 C ATOM 796 CD1 TYR A 130 2.415 5.261 8.364 1.00 0.00 C ATOM 797 CD2 TYR A 130 1.633 4.572 6.230 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.640 5.567 7.822 1.00 0.00 C ATOM 799 CE2 TYR A 130 2.852 4.880 5.683 1.00 0.00 C ATOM 800 CZ TYR A 130 3.850 5.378 6.481 1.00 0.00 C ATOM 801 OH TYR A 130 5.067 5.670 5.935 1.00 0.00 O ATOM 0 H TYR A 130 0.758 3.751 10.491 1.00 0.00 H new ATOM 0 HA TYR A 130 -0.096 6.229 9.272 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.037 3.330 8.405 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.728 4.550 7.406 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.249 5.415 9.420 1.00 0.00 H new ATOM 0 HD2 TYR A 130 0.852 4.178 5.597 1.00 0.00 H new ATOM 0 HE1 TYR A 130 4.431 5.953 8.448 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.026 4.731 4.628 1.00 0.00 H new ATOM 0 HH TYR A 130 5.006 5.628 4.958 1.00 0.00 H new ATOM 811 N MET A 131 -2.229 4.076 10.466 1.00 0.00 N ATOM 812 CA MET A 131 -3.641 3.800 10.705 1.00 0.00 C ATOM 813 C MET A 131 -4.246 4.806 11.674 1.00 0.00 C ATOM 814 O MET A 131 -5.447 4.788 11.929 1.00 0.00 O ATOM 815 CB MET A 131 -3.831 2.376 11.232 1.00 0.00 C ATOM 816 CG MET A 131 -3.521 1.287 10.211 1.00 0.00 C ATOM 817 SD MET A 131 -4.917 0.871 9.131 1.00 0.00 S ATOM 818 CE MET A 131 -5.097 2.350 8.128 1.00 0.00 C ATOM 0 H MET A 131 -1.587 3.463 10.969 1.00 0.00 H new ATOM 0 HA MET A 131 -4.162 3.894 9.752 1.00 0.00 H new ATOM 0 HB2 MET A 131 -3.192 2.234 12.103 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.861 2.260 11.570 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.681 1.609 9.595 1.00 0.00 H new ATOM 0 HG3 MET A 131 -3.203 0.388 10.739 1.00 0.00 H new ATOM 0 HE1 MET A 131 -5.473 2.077 7.142 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.799 3.032 8.608 1.00 0.00 H new ATOM 0 HE3 MET A 131 -4.129 2.839 8.024 1.00 0.00 H new ATOM 828 N GLN A 132 -3.415 5.691 12.207 1.00 0.00 N ATOM 829 CA GLN A 132 -3.899 6.738 13.093 1.00 0.00 C ATOM 830 C GLN A 132 -4.010 8.049 12.326 1.00 0.00 C ATOM 831 O GLN A 132 -4.380 9.083 12.884 1.00 0.00 O ATOM 832 CB GLN A 132 -2.963 6.910 14.289 1.00 0.00 C ATOM 833 CG GLN A 132 -1.580 7.394 13.902 1.00 0.00 C ATOM 834 CD GLN A 132 -0.676 7.621 15.092 1.00 0.00 C ATOM 835 OE1 GLN A 132 -0.792 6.951 16.118 1.00 0.00 O ATOM 836 NE2 GLN A 132 0.232 8.568 14.960 1.00 0.00 N ATOM 0 H GLN A 132 -2.409 5.705 12.042 1.00 0.00 H new ATOM 0 HA GLN A 132 -4.883 6.452 13.465 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.406 7.618 14.989 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.874 5.958 14.812 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.119 6.664 13.237 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -1.671 8.324 13.340 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.293 9.099 14.091 1.00 0.00 H new ATOM 0 HE22 GLN A 132 0.874 8.770 15.727 1.00 0.00 H new ATOM 845 N GLU A 133 -3.666 8.004 11.046 1.00 0.00 N ATOM 846 CA GLU A 133 -3.710 9.187 10.211 1.00 0.00 C ATOM 847 C GLU A 133 -4.898 9.122 9.263 1.00 0.00 C ATOM 848 O GLU A 133 -4.975 8.224 8.424 1.00 0.00 O ATOM 849 CB GLU A 133 -2.418 9.319 9.406 1.00 0.00 C ATOM 850 CG GLU A 133 -1.172 9.060 10.227 1.00 0.00 C ATOM 851 CD GLU A 133 0.064 9.675 9.615 1.00 0.00 C ATOM 852 OE1 GLU A 133 -0.013 10.834 9.156 1.00 0.00 O ATOM 853 OE2 GLU A 133 1.126 9.022 9.620 1.00 0.00 O ATOM 0 H GLU A 133 -3.354 7.159 10.567 1.00 0.00 H new ATOM 0 HA GLU A 133 -3.817 10.058 10.857 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.446 8.620 8.570 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.363 10.321 8.982 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.313 9.460 11.231 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -1.026 7.985 10.330 1.00 0.00 H new ATOM 860 N PRO A 134 -5.832 10.083 9.376 1.00 0.00 N ATOM 861 CA PRO A 134 -7.017 10.152 8.511 1.00 0.00 C ATOM 862 C PRO A 134 -6.645 10.319 7.038 1.00 0.00 C ATOM 863 O PRO A 134 -7.484 10.174 6.152 1.00 0.00 O ATOM 864 CB PRO A 134 -7.787 11.373 9.023 1.00 0.00 C ATOM 865 CG PRO A 134 -6.791 12.166 9.797 1.00 0.00 C ATOM 866 CD PRO A 134 -5.814 11.177 10.364 1.00 0.00 C ATOM 0 HA PRO A 134 -7.602 9.233 8.554 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.197 11.954 8.197 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.626 11.074 9.651 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.286 12.888 9.155 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -7.277 12.732 10.592 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -4.819 11.609 10.469 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -6.118 10.832 11.352 1.00 0.00 H new ATOM 874 N LEU A 135 -5.387 10.646 6.785 1.00 0.00 N ATOM 875 CA LEU A 135 -4.874 10.702 5.428 1.00 0.00 C ATOM 876 C LEU A 135 -4.728 9.298 4.846 1.00 0.00 C ATOM 877 O LEU A 135 -5.203 9.020 3.748 1.00 0.00 O ATOM 878 CB LEU A 135 -3.517 11.421 5.380 1.00 0.00 C ATOM 879 CG LEU A 135 -3.561 12.955 5.350 1.00 0.00 C ATOM 880 CD1 LEU A 135 -4.286 13.449 4.107 1.00 0.00 C ATOM 881 CD2 LEU A 135 -4.213 13.512 6.604 1.00 0.00 C ATOM 0 H LEU A 135 -4.702 10.877 7.505 1.00 0.00 H new ATOM 0 HA LEU A 135 -5.591 11.264 4.829 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -2.935 11.112 6.249 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -2.978 11.077 4.497 1.00 0.00 H new ATOM 0 HG LEU A 135 -2.533 13.316 5.317 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -4.305 14.539 4.106 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -3.766 13.095 3.217 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -5.307 13.068 4.106 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -4.229 14.601 6.553 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.234 13.137 6.681 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -3.645 13.198 7.480 1.00 0.00 H new ATOM 893 N PHE A 136 -4.114 8.398 5.606 1.00 0.00 N ATOM 894 CA PHE A 136 -3.715 7.109 5.061 1.00 0.00 C ATOM 895 C PHE A 136 -4.837 6.097 5.199 1.00 0.00 C ATOM 896 O PHE A 136 -4.966 5.184 4.385 1.00 0.00 O ATOM 897 CB PHE A 136 -2.457 6.605 5.763 1.00 0.00 C ATOM 898 CG PHE A 136 -1.779 5.478 5.037 1.00 0.00 C ATOM 899 CD1 PHE A 136 -1.970 4.164 5.432 1.00 0.00 C ATOM 900 CD2 PHE A 136 -0.951 5.736 3.956 1.00 0.00 C ATOM 901 CE1 PHE A 136 -1.346 3.130 4.765 1.00 0.00 C ATOM 902 CE2 PHE A 136 -0.324 4.706 3.284 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.522 3.401 3.689 1.00 0.00 C ATOM 0 H PHE A 136 -3.884 8.536 6.590 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.498 7.237 4.000 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -1.755 7.432 5.872 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -2.719 6.274 6.768 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -2.614 3.947 6.271 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -0.794 6.755 3.635 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -1.501 2.110 5.083 1.00 0.00 H new ATOM 0 HE2 PHE A 136 0.320 4.920 2.444 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.033 2.593 3.165 1.00 0.00 H new ATOM 913 N VAL A 137 -5.647 6.268 6.231 1.00 0.00 N ATOM 914 CA VAL A 137 -6.805 5.414 6.445 1.00 0.00 C ATOM 915 C VAL A 137 -7.727 5.430 5.231 1.00 0.00 C ATOM 916 O VAL A 137 -8.183 4.387 4.776 1.00 0.00 O ATOM 917 CB VAL A 137 -7.601 5.855 7.678 1.00 0.00 C ATOM 918 CG1 VAL A 137 -6.861 5.528 8.962 1.00 0.00 C ATOM 919 CG2 VAL A 137 -7.911 7.315 7.609 1.00 0.00 C ATOM 0 H VAL A 137 -5.523 6.994 6.937 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.430 4.403 6.604 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.539 5.299 7.684 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.454 5.854 9.817 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.697 4.452 9.024 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.900 6.042 8.969 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.477 7.609 8.493 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -6.981 7.883 7.567 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.501 7.520 6.716 1.00 0.00 H new ATOM 929 N GLU A 138 -7.987 6.625 4.717 1.00 0.00 N ATOM 930 CA GLU A 138 -8.796 6.798 3.517 1.00 0.00 C ATOM 931 C GLU A 138 -8.182 6.044 2.354 1.00 0.00 C ATOM 932 O GLU A 138 -8.865 5.289 1.668 1.00 0.00 O ATOM 933 CB GLU A 138 -8.919 8.278 3.163 1.00 0.00 C ATOM 934 CG GLU A 138 -9.630 9.094 4.222 1.00 0.00 C ATOM 935 CD GLU A 138 -11.063 8.656 4.432 1.00 0.00 C ATOM 936 OE1 GLU A 138 -11.340 7.988 5.449 1.00 0.00 O ATOM 937 OE2 GLU A 138 -11.921 8.978 3.580 1.00 0.00 O ATOM 0 H GLU A 138 -7.645 7.498 5.118 1.00 0.00 H new ATOM 0 HA GLU A 138 -9.790 6.398 3.716 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -7.922 8.690 3.006 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -9.456 8.375 2.219 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -9.087 9.011 5.164 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -9.614 10.146 3.936 1.00 0.00 H new ATOM 944 N PHE A 139 -6.884 6.248 2.152 1.00 0.00 N ATOM 945 CA PHE A 139 -6.147 5.558 1.105 1.00 0.00 C ATOM 946 C PHE A 139 -6.333 4.057 1.243 1.00 0.00 C ATOM 947 O PHE A 139 -6.688 3.369 0.287 1.00 0.00 O ATOM 948 CB PHE A 139 -4.662 5.920 1.196 1.00 0.00 C ATOM 949 CG PHE A 139 -3.770 5.126 0.280 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.610 5.485 -1.048 1.00 0.00 C ATOM 951 CD2 PHE A 139 -3.084 4.021 0.757 1.00 0.00 C ATOM 952 CE1 PHE A 139 -2.783 4.752 -1.884 1.00 0.00 C ATOM 953 CE2 PHE A 139 -2.260 3.285 -0.071 1.00 0.00 C ATOM 954 CZ PHE A 139 -2.108 3.651 -1.393 1.00 0.00 C ATOM 0 H PHE A 139 -6.319 6.892 2.706 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.528 5.868 0.132 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.544 6.980 0.969 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.328 5.775 2.223 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.135 6.345 -1.436 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -3.195 3.731 1.791 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.666 5.041 -2.918 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.735 2.424 0.315 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.463 3.078 -2.042 1.00 0.00 H new ATOM 964 N ALA A 140 -6.126 3.574 2.458 1.00 0.00 N ATOM 965 CA ALA A 140 -6.237 2.162 2.756 1.00 0.00 C ATOM 966 C ALA A 140 -7.657 1.662 2.539 1.00 0.00 C ATOM 967 O ALA A 140 -7.874 0.714 1.786 1.00 0.00 O ATOM 968 CB ALA A 140 -5.790 1.896 4.184 1.00 0.00 C ATOM 0 H ALA A 140 -5.877 4.152 3.261 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.586 1.616 2.073 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.877 0.831 4.400 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.752 2.207 4.304 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.420 2.458 4.873 1.00 0.00 H new ATOM 974 N ASP A 141 -8.623 2.333 3.153 1.00 0.00 N ATOM 975 CA ASP A 141 -10.012 1.884 3.121 1.00 0.00 C ATOM 976 C ASP A 141 -10.537 1.881 1.692 1.00 0.00 C ATOM 977 O ASP A 141 -11.387 1.068 1.324 1.00 0.00 O ATOM 978 CB ASP A 141 -10.878 2.788 4.001 1.00 0.00 C ATOM 979 CG ASP A 141 -12.316 2.318 4.097 1.00 0.00 C ATOM 980 OD1 ASP A 141 -12.606 1.449 4.945 1.00 0.00 O ATOM 981 OD2 ASP A 141 -13.167 2.830 3.340 1.00 0.00 O ATOM 0 H ASP A 141 -8.471 3.192 3.681 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.058 0.866 3.509 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.448 2.832 5.002 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.859 3.802 3.601 1.00 0.00 H new ATOM 986 N CYS A 142 -9.994 2.774 0.885 1.00 0.00 N ATOM 987 CA CYS A 142 -10.409 2.910 -0.498 1.00 0.00 C ATOM 988 C CYS A 142 -9.745 1.865 -1.389 1.00 0.00 C ATOM 989 O CYS A 142 -10.419 1.210 -2.188 1.00 0.00 O ATOM 990 CB CYS A 142 -10.090 4.316 -0.997 1.00 0.00 C ATOM 991 SG CYS A 142 -11.108 5.604 -0.244 1.00 0.00 S ATOM 0 H CYS A 142 -9.258 3.421 1.168 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.485 2.745 -0.547 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -9.040 4.533 -0.798 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -10.223 4.347 -2.078 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.544 6.017 0.852 1.00 0.00 H new ATOM 997 N CYS A 143 -8.431 1.686 -1.244 1.00 0.00 N ATOM 998 CA CYS A 143 -7.705 0.751 -2.090 1.00 0.00 C ATOM 999 C CYS A 143 -8.170 -0.673 -1.827 1.00 0.00 C ATOM 1000 O CYS A 143 -8.208 -1.499 -2.739 1.00 0.00 O ATOM 1001 CB CYS A 143 -6.192 0.875 -1.879 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.629 0.482 -0.208 1.00 0.00 S ATOM 0 H CYS A 143 -7.857 2.173 -0.555 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.918 0.999 -3.130 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.685 0.215 -2.583 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.887 1.893 -2.120 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.651 0.429 0.593 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.564 -0.941 -0.583 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.062 -2.258 -0.206 1.00 0.00 C ATOM 1010 C LEU A 144 -10.279 -2.629 -1.035 1.00 0.00 C ATOM 1011 O LEU A 144 -10.401 -3.762 -1.488 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.419 -2.305 1.281 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.249 -2.092 2.239 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.697 -2.269 3.679 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -7.109 -3.037 1.905 1.00 0.00 C ATOM 0 H LEU A 144 -8.547 -0.263 0.179 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.267 -2.979 -0.398 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.174 -1.545 1.481 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -9.874 -3.271 1.498 1.00 0.00 H new ATOM 0 HG LEU A 144 -7.888 -1.070 2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.849 -2.113 4.346 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.477 -1.544 3.909 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.087 -3.277 3.817 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.284 -2.871 2.598 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.454 -4.068 1.991 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.770 -2.852 0.886 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.156 -1.657 -1.252 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.370 -1.903 -2.006 1.00 0.00 C ATOM 1029 C GLY A 145 -12.090 -2.154 -3.469 1.00 0.00 C ATOM 1030 O GLY A 145 -12.832 -2.865 -4.145 1.00 0.00 O ATOM 0 H GLY A 145 -11.047 -0.699 -0.918 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.890 -2.763 -1.584 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -13.037 -1.047 -1.907 1.00 0.00 H new ATOM 1034 N ILE A 146 -11.005 -1.577 -3.952 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.617 -1.715 -5.343 1.00 0.00 C ATOM 1036 C ILE A 146 -9.917 -3.051 -5.572 1.00 0.00 C ATOM 1037 O ILE A 146 -10.098 -3.694 -6.607 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.683 -0.561 -5.762 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -10.353 0.785 -5.468 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.322 -0.670 -7.239 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -9.420 1.971 -5.591 1.00 0.00 C ATOM 0 H ILE A 146 -10.372 -1.003 -3.395 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.520 -1.678 -5.952 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.761 -0.628 -5.184 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -11.190 0.921 -6.152 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.766 0.762 -4.460 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.663 0.153 -7.514 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.815 -1.617 -7.421 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -10.230 -0.624 -7.840 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.966 2.888 -5.368 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -8.595 1.860 -4.887 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -9.026 2.021 -6.606 1.00 0.00 H new ATOM 1053 N VAL A 147 -9.138 -3.480 -4.587 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.362 -4.704 -4.720 1.00 0.00 C ATOM 1055 C VAL A 147 -9.103 -5.915 -4.160 1.00 0.00 C ATOM 1056 O VAL A 147 -8.523 -6.995 -4.065 1.00 0.00 O ATOM 1057 CB VAL A 147 -6.983 -4.593 -4.033 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -6.206 -3.404 -4.573 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -7.129 -4.507 -2.521 1.00 0.00 C ATOM 0 H VAL A 147 -9.028 -3.001 -3.693 1.00 0.00 H new ATOM 0 HA VAL A 147 -8.213 -4.846 -5.790 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.420 -5.498 -4.261 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -5.238 -3.345 -4.075 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.055 -3.525 -5.646 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.766 -2.488 -4.386 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.142 -4.430 -2.064 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.719 -3.628 -2.262 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.630 -5.402 -2.152 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.371 -5.735 -3.783 1.00 0.00 N ATOM 1070 CA GLU A 148 -11.204 -6.850 -3.337 1.00 0.00 C ATOM 1071 C GLU A 148 -11.344 -7.889 -4.447 1.00 0.00 C ATOM 1072 O GLU A 148 -11.971 -7.626 -5.476 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.602 -6.371 -2.913 1.00 0.00 C ATOM 1074 CG GLU A 148 -12.642 -5.659 -1.569 1.00 0.00 C ATOM 1075 CD GLU A 148 -14.054 -5.325 -1.124 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -14.735 -6.223 -0.579 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -14.496 -4.169 -1.311 1.00 0.00 O ATOM 0 H GLU A 148 -10.841 -4.830 -3.778 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.712 -7.299 -2.474 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -12.990 -5.699 -3.678 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -13.271 -7.231 -2.875 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -12.167 -6.287 -0.815 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -12.059 -4.740 -1.632 1.00 0.00 H new ATOM 1197 N ILE B 463 -7.208 -7.365 9.535 1.00 0.00 N ATOM 1198 CA ILE B 463 -6.374 -6.174 9.434 1.00 0.00 C ATOM 1199 C ILE B 463 -4.923 -6.524 9.097 1.00 0.00 C ATOM 1200 O ILE B 463 -4.237 -5.749 8.434 1.00 0.00 O ATOM 1201 CB ILE B 463 -6.424 -5.339 10.732 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -7.871 -4.969 11.069 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -5.580 -4.079 10.592 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -8.014 -4.185 12.356 1.00 0.00 C ATOM 0 HA ILE B 463 -6.781 -5.576 8.618 1.00 0.00 H new ATOM 0 HB ILE B 463 -6.015 -5.941 11.544 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -8.288 -4.384 10.249 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -8.463 -5.882 11.142 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -5.628 -3.504 11.517 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -4.545 -4.355 10.390 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -5.962 -3.475 9.769 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -9.066 -3.959 12.529 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -7.628 -4.776 13.187 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -7.451 -3.255 12.280 1.00 0.00 H new ATOM 1216 N ARG B 464 -4.463 -7.691 9.534 1.00 0.00 N ATOM 1217 CA ARG B 464 -3.106 -8.135 9.219 1.00 0.00 C ATOM 1218 C ARG B 464 -2.958 -8.266 7.711 1.00 0.00 C ATOM 1219 O ARG B 464 -1.993 -7.785 7.112 1.00 0.00 O ATOM 1220 CB ARG B 464 -2.811 -9.484 9.872 1.00 0.00 C ATOM 1221 CG ARG B 464 -3.017 -9.505 11.374 1.00 0.00 C ATOM 1222 CD ARG B 464 -3.003 -10.929 11.897 1.00 0.00 C ATOM 1223 NE ARG B 464 -3.999 -11.763 11.224 1.00 0.00 N ATOM 1224 CZ ARG B 464 -3.968 -13.094 11.207 1.00 0.00 C ATOM 1225 NH1 ARG B 464 -2.992 -13.746 11.828 1.00 0.00 N ATOM 1226 NH2 ARG B 464 -4.912 -13.773 10.563 1.00 0.00 N ATOM 0 H ARG B 464 -5.003 -8.343 10.103 1.00 0.00 H new ATOM 0 HA ARG B 464 -2.401 -7.399 9.605 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -3.449 -10.242 9.418 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -1.780 -9.763 9.654 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -2.233 -8.925 11.862 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -3.966 -9.030 11.623 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -2.012 -11.359 11.754 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -3.197 -10.925 12.970 1.00 0.00 H new ATOM 0 HE ARG B 464 -4.764 -11.296 10.738 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -2.264 -13.227 12.319 1.00 0.00 H new ATOM 0 HH12 ARG B 464 -2.970 -14.766 11.814 1.00 0.00 H new ATOM 0 HH21 ARG B 464 -5.660 -13.274 10.082 1.00 0.00 H new ATOM 0 HH22 ARG B 464 -4.888 -14.793 10.550 1.00 0.00 H new ATOM 1240 N HIS B 465 -3.948 -8.909 7.113 1.00 0.00 N ATOM 1241 CA HIS B 465 -4.009 -9.074 5.673 1.00 0.00 C ATOM 1242 C HIS B 465 -4.166 -7.723 4.991 1.00 0.00 C ATOM 1243 O HIS B 465 -3.445 -7.407 4.051 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.168 -10.008 5.304 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.541 -9.974 3.856 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -4.803 -10.581 2.867 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.590 -9.391 3.237 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -5.383 -10.377 1.700 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -6.473 -9.657 1.897 1.00 0.00 N ATOM 0 H HIS B 465 -4.731 -9.330 7.613 1.00 0.00 H new ATOM 0 HA HIS B 465 -3.078 -9.522 5.327 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -4.899 -11.029 5.575 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -6.041 -9.740 5.900 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -7.376 -8.821 3.710 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -5.027 -10.737 0.746 1.00 0.00 H new ATOM 0 HE2 HIS B 465 -7.121 -9.350 1.172 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.100 -6.928 5.484 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.396 -5.633 4.890 1.00 0.00 C ATOM 1260 C GLU B 466 -4.170 -4.722 4.888 1.00 0.00 C ATOM 1261 O GLU B 466 -3.835 -4.139 3.863 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.552 -4.968 5.632 1.00 0.00 C ATOM 1263 CG GLU B 466 -7.869 -5.715 5.487 1.00 0.00 C ATOM 1264 CD GLU B 466 -8.942 -5.213 6.432 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -9.357 -4.046 6.303 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -9.403 -6.000 7.290 1.00 0.00 O ATOM 0 H GLU B 466 -5.670 -7.157 6.298 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.685 -5.798 3.852 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -6.300 -4.892 6.690 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -6.676 -3.951 5.260 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -8.223 -5.620 4.461 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -7.700 -6.776 5.669 1.00 0.00 H new ATOM 1273 N ARG B 467 -3.489 -4.628 6.026 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.333 -3.742 6.154 1.00 0.00 C ATOM 1275 C ARG B 467 -1.196 -4.147 5.222 1.00 0.00 C ATOM 1276 O ARG B 467 -0.558 -3.288 4.612 1.00 0.00 O ATOM 1277 CB ARG B 467 -1.827 -3.698 7.595 1.00 0.00 C ATOM 1278 CG ARG B 467 -2.735 -2.932 8.539 1.00 0.00 C ATOM 1279 CD ARG B 467 -2.153 -2.869 9.942 1.00 0.00 C ATOM 1280 NE ARG B 467 -1.876 -4.202 10.477 1.00 0.00 N ATOM 1281 CZ ARG B 467 -2.173 -4.590 11.716 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -2.732 -3.740 12.571 1.00 0.00 N ATOM 1283 NH2 ARG B 467 -1.896 -5.828 12.101 1.00 0.00 N ATOM 0 H ARG B 467 -3.715 -5.152 6.871 1.00 0.00 H new ATOM 0 HA ARG B 467 -2.671 -2.747 5.865 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -1.714 -4.718 7.962 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -0.837 -3.243 7.609 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -2.886 -1.921 8.161 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -3.714 -3.409 8.571 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -1.233 -2.285 9.928 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -2.849 -2.351 10.601 1.00 0.00 H new ATOM 0 HE ARG B 467 -1.426 -4.879 9.861 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -2.936 -2.784 12.280 1.00 0.00 H new ATOM 0 HH12 ARG B 467 -2.957 -4.044 13.518 1.00 0.00 H new ATOM 0 HH21 ARG B 467 -1.457 -6.479 11.449 1.00 0.00 H new ATOM 0 HH22 ARG B 467 -2.122 -6.130 13.049 1.00 0.00 H new ATOM 1297 N ASN B 468 -0.941 -5.444 5.090 1.00 0.00 N ATOM 1298 CA ASN B 468 0.153 -5.892 4.239 1.00 0.00 C ATOM 1299 C ASN B 468 -0.274 -5.793 2.782 1.00 0.00 C ATOM 1300 O ASN B 468 0.551 -5.637 1.888 1.00 0.00 O ATOM 1301 CB ASN B 468 0.622 -7.315 4.594 1.00 0.00 C ATOM 1302 CG ASN B 468 0.019 -8.403 3.722 1.00 0.00 C ATOM 1303 OD1 ASN B 468 0.530 -8.699 2.637 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -1.036 -9.033 4.206 1.00 0.00 N ATOM 0 H ASN B 468 -1.464 -6.189 5.550 1.00 0.00 H new ATOM 0 HA ASN B 468 1.011 -5.241 4.408 1.00 0.00 H new ATOM 0 HB2 ASN B 468 1.708 -7.359 4.512 1.00 0.00 H new ATOM 0 HB3 ASN B 468 0.372 -7.519 5.635 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -1.460 -9.796 3.679 1.00 0.00 H new ATOM 0 HD22 ASN B 468 -1.426 -8.756 5.107 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.580 -5.861 2.562 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.158 -5.604 1.255 1.00 0.00 C ATOM 1313 C VAL B 469 -1.890 -4.161 0.836 1.00 0.00 C ATOM 1314 O VAL B 469 -1.620 -3.881 -0.337 1.00 0.00 O ATOM 1315 CB VAL B 469 -3.678 -5.897 1.266 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.436 -5.001 0.302 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -3.931 -7.356 0.937 1.00 0.00 C ATOM 0 H VAL B 469 -2.263 -6.095 3.282 1.00 0.00 H new ATOM 0 HA VAL B 469 -1.690 -6.269 0.529 1.00 0.00 H new ATOM 0 HB VAL B 469 -4.047 -5.684 2.269 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.499 -5.240 0.342 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.288 -3.958 0.582 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -4.066 -5.161 -0.711 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -5.003 -7.551 0.948 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -3.531 -7.581 -0.052 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.440 -7.987 1.679 1.00 0.00 H new ATOM 1327 N ILE B 470 -1.946 -3.253 1.808 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.666 -1.846 1.558 1.00 0.00 C ATOM 1329 C ILE B 470 -0.248 -1.680 1.029 1.00 0.00 C ATOM 1330 O ILE B 470 0.005 -0.846 0.160 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.824 -0.981 2.828 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -3.168 -1.237 3.509 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.690 0.490 2.473 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.363 -0.953 2.628 1.00 0.00 C ATOM 0 H ILE B 470 -2.183 -3.470 2.776 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.393 -1.507 0.820 1.00 0.00 H new ATOM 0 HB ILE B 470 -1.035 -1.257 3.527 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -3.207 -2.276 3.835 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -3.234 -0.620 4.405 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -1.803 1.093 3.374 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.708 0.671 2.036 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.463 0.763 1.755 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.280 -1.158 3.181 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.350 0.093 2.323 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.323 -1.589 1.744 1.00 0.00 H new ATOM 1346 N LEU B 471 0.670 -2.492 1.551 1.00 0.00 N ATOM 1347 CA LEU B 471 2.058 -2.476 1.106 1.00 0.00 C ATOM 1348 C LEU B 471 2.132 -2.637 -0.405 1.00 0.00 C ATOM 1349 O LEU B 471 2.791 -1.854 -1.085 1.00 0.00 O ATOM 1350 CB LEU B 471 2.863 -3.593 1.778 1.00 0.00 C ATOM 1351 CG LEU B 471 2.962 -3.515 3.302 1.00 0.00 C ATOM 1352 CD1 LEU B 471 3.664 -4.746 3.850 1.00 0.00 C ATOM 1353 CD2 LEU B 471 3.701 -2.258 3.725 1.00 0.00 C ATOM 0 H LEU B 471 0.474 -3.171 2.286 1.00 0.00 H new ATOM 0 HA LEU B 471 2.488 -1.515 1.389 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.415 -4.550 1.510 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.872 -3.587 1.366 1.00 0.00 H new ATOM 0 HG LEU B 471 1.952 -3.477 3.710 1.00 0.00 H new ATOM 0 HD11 LEU B 471 3.727 -4.676 4.936 1.00 0.00 H new ATOM 0 HD12 LEU B 471 3.101 -5.638 3.576 1.00 0.00 H new ATOM 0 HD13 LEU B 471 4.669 -4.808 3.432 1.00 0.00 H new ATOM 0 HD21 LEU B 471 3.761 -2.220 4.813 1.00 0.00 H new ATOM 0 HD22 LEU B 471 4.707 -2.269 3.306 1.00 0.00 H new ATOM 0 HD23 LEU B 471 3.166 -1.381 3.361 1.00 0.00 H new ATOM 1365 N GLN B 472 1.435 -3.646 -0.919 1.00 0.00 N ATOM 1366 CA GLN B 472 1.413 -3.917 -2.354 1.00 0.00 C ATOM 1367 C GLN B 472 0.776 -2.762 -3.116 1.00 0.00 C ATOM 1368 O GLN B 472 1.253 -2.381 -4.182 1.00 0.00 O ATOM 1369 CB GLN B 472 0.659 -5.215 -2.663 1.00 0.00 C ATOM 1370 CG GLN B 472 1.452 -6.487 -2.390 1.00 0.00 C ATOM 1371 CD GLN B 472 1.704 -6.726 -0.917 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.720 -6.302 -0.368 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.767 -7.396 -0.268 1.00 0.00 N ATOM 0 H GLN B 472 0.876 -4.292 -0.362 1.00 0.00 H new ATOM 0 HA GLN B 472 2.448 -4.029 -2.678 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -0.256 -5.238 -2.071 1.00 0.00 H new ATOM 0 HB3 GLN B 472 0.360 -5.206 -3.711 1.00 0.00 H new ATOM 0 HG2 GLN B 472 0.913 -7.340 -2.803 1.00 0.00 H new ATOM 0 HG3 GLN B 472 2.408 -6.431 -2.911 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.059 -7.729 -0.765 1.00 0.00 H new ATOM 0 HE22 GLN B 472 0.870 -7.580 0.730 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.295 -2.208 -2.560 1.00 0.00 N ATOM 1383 CA CYS B 473 -0.984 -1.078 -3.175 1.00 0.00 C ATOM 1384 C CYS B 473 -0.024 0.096 -3.333 1.00 0.00 C ATOM 1385 O CYS B 473 0.109 0.666 -4.417 1.00 0.00 O ATOM 1386 CB CYS B 473 -2.188 -0.670 -2.324 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.365 -2.013 -2.028 1.00 0.00 S ATOM 0 H CYS B 473 -0.707 -2.524 -1.682 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.339 -1.374 -4.162 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.832 -0.294 -1.365 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.707 0.153 -2.816 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.806 -2.925 -1.290 1.00 0.00 H new ATOM 1393 N VAL B 474 0.647 0.436 -2.240 1.00 0.00 N ATOM 1394 CA VAL B 474 1.665 1.466 -2.237 1.00 0.00 C ATOM 1395 C VAL B 474 2.759 1.176 -3.262 1.00 0.00 C ATOM 1396 O VAL B 474 2.979 1.967 -4.179 1.00 0.00 O ATOM 1397 CB VAL B 474 2.300 1.599 -0.835 1.00 0.00 C ATOM 1398 CG1 VAL B 474 3.452 2.586 -0.845 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.254 2.010 0.188 1.00 0.00 C ATOM 0 H VAL B 474 0.496 0.001 -1.330 1.00 0.00 H new ATOM 0 HA VAL B 474 1.177 2.403 -2.506 1.00 0.00 H new ATOM 0 HB VAL B 474 2.697 0.624 -0.554 1.00 0.00 H new ATOM 0 HG11 VAL B 474 3.878 2.658 0.156 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.218 2.245 -1.542 1.00 0.00 H new ATOM 0 HG13 VAL B 474 3.089 3.566 -1.156 1.00 0.00 H new ATOM 0 HG21 VAL B 474 1.720 2.099 1.169 1.00 0.00 H new ATOM 0 HG22 VAL B 474 0.824 2.970 -0.097 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.467 1.257 0.227 1.00 0.00 H new ATOM 1409 N ARG B 475 3.414 0.025 -3.131 1.00 0.00 N ATOM 1410 CA ARG B 475 4.622 -0.250 -3.904 1.00 0.00 C ATOM 1411 C ARG B 475 4.337 -0.502 -5.374 1.00 0.00 C ATOM 1412 O ARG B 475 5.234 -0.384 -6.205 1.00 0.00 O ATOM 1413 CB ARG B 475 5.437 -1.385 -3.303 1.00 0.00 C ATOM 1414 CG ARG B 475 4.730 -2.706 -3.168 1.00 0.00 C ATOM 1415 CD ARG B 475 5.543 -3.627 -2.277 1.00 0.00 C ATOM 1416 NE ARG B 475 5.799 -3.020 -0.964 1.00 0.00 N ATOM 1417 CZ ARG B 475 6.937 -2.395 -0.625 1.00 0.00 C ATOM 1418 NH1 ARG B 475 7.971 -2.374 -1.457 1.00 0.00 N ATOM 1419 NH2 ARG B 475 7.045 -1.808 0.561 1.00 0.00 N ATOM 0 H ARG B 475 3.132 -0.727 -2.502 1.00 0.00 H new ATOM 0 HA ARG B 475 5.223 0.658 -3.849 1.00 0.00 H new ATOM 0 HB2 ARG B 475 6.326 -1.532 -3.917 1.00 0.00 H new ATOM 0 HB3 ARG B 475 5.780 -1.076 -2.315 1.00 0.00 H new ATOM 0 HG2 ARG B 475 3.737 -2.557 -2.745 1.00 0.00 H new ATOM 0 HG3 ARG B 475 4.594 -3.160 -4.150 1.00 0.00 H new ATOM 0 HD2 ARG B 475 5.012 -4.570 -2.146 1.00 0.00 H new ATOM 0 HD3 ARG B 475 6.491 -3.860 -2.762 1.00 0.00 H new ATOM 0 HE ARG B 475 5.061 -3.078 -0.262 1.00 0.00 H new ATOM 0 HH11 ARG B 475 7.905 -2.836 -2.364 1.00 0.00 H new ATOM 0 HH12 ARG B 475 8.831 -1.896 -1.189 1.00 0.00 H new ATOM 0 HH21 ARG B 475 6.263 -1.832 1.215 1.00 0.00 H new ATOM 0 HH22 ARG B 475 7.910 -1.333 0.818 1.00 0.00 H new ATOM 1433 N TYR B 476 3.103 -0.852 -5.708 1.00 0.00 N ATOM 1434 CA TYR B 476 2.714 -0.932 -7.102 1.00 0.00 C ATOM 1435 C TYR B 476 2.790 0.460 -7.720 1.00 0.00 C ATOM 1436 O TYR B 476 3.306 0.641 -8.823 1.00 0.00 O ATOM 1437 CB TYR B 476 1.298 -1.507 -7.242 1.00 0.00 C ATOM 1438 CG TYR B 476 0.508 -0.873 -8.364 1.00 0.00 C ATOM 1439 CD1 TYR B 476 0.740 -1.207 -9.693 1.00 0.00 C ATOM 1440 CD2 TYR B 476 -0.446 0.092 -8.086 1.00 0.00 C ATOM 1441 CE1 TYR B 476 0.040 -0.594 -10.713 1.00 0.00 C ATOM 1442 CE2 TYR B 476 -1.154 0.706 -9.098 1.00 0.00 C ATOM 1443 CZ TYR B 476 -0.907 0.363 -10.410 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.608 0.985 -11.419 1.00 0.00 O ATOM 0 H TYR B 476 2.366 -1.081 -5.041 1.00 0.00 H new ATOM 0 HA TYR B 476 3.396 -1.601 -7.627 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.364 -2.581 -7.414 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.761 -1.367 -6.304 1.00 0.00 H new ATOM 0 HD1 TYR B 476 1.479 -1.957 -9.931 1.00 0.00 H new ATOM 0 HD2 TYR B 476 -0.639 0.368 -7.060 1.00 0.00 H new ATOM 0 HE1 TYR B 476 0.232 -0.862 -11.741 1.00 0.00 H new ATOM 0 HE2 TYR B 476 -1.899 1.452 -8.863 1.00 0.00 H new ATOM 0 HH TYR B 476 -2.235 1.631 -11.032 1.00 0.00 H new ATOM 1454 N ILE B 477 2.288 1.442 -6.980 1.00 0.00 N ATOM 1455 CA ILE B 477 2.292 2.825 -7.425 1.00 0.00 C ATOM 1456 C ILE B 477 3.708 3.370 -7.424 1.00 0.00 C ATOM 1457 O ILE B 477 4.193 3.851 -8.447 1.00 0.00 O ATOM 1458 CB ILE B 477 1.399 3.696 -6.519 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.038 3.178 -6.558 1.00 0.00 C ATOM 1460 CG2 ILE B 477 1.457 5.160 -6.940 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -0.947 3.842 -5.556 1.00 0.00 C ATOM 0 H ILE B 477 1.870 1.300 -6.061 1.00 0.00 H new ATOM 0 HA ILE B 477 1.894 2.856 -8.439 1.00 0.00 H new ATOM 0 HB ILE B 477 1.771 3.631 -5.496 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.443 3.329 -7.559 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.033 2.103 -6.375 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.818 5.753 -6.285 1.00 0.00 H new ATOM 0 HG22 ILE B 477 2.484 5.519 -6.868 1.00 0.00 H new ATOM 0 HG23 ILE B 477 1.110 5.257 -7.969 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -1.950 3.424 -5.642 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.567 3.669 -4.549 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -0.983 4.914 -5.751 1.00 0.00 H new ATOM 1473 N ILE B 478 4.378 3.248 -6.281 1.00 0.00 N ATOM 1474 CA ILE B 478 5.753 3.727 -6.127 1.00 0.00 C ATOM 1475 C ILE B 478 6.647 3.153 -7.217 1.00 0.00 C ATOM 1476 O ILE B 478 7.597 3.802 -7.654 1.00 0.00 O ATOM 1477 CB ILE B 478 6.374 3.302 -4.785 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.438 3.556 -3.609 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.687 4.030 -4.556 1.00 0.00 C ATOM 1480 CD1 ILE B 478 5.262 5.006 -3.224 1.00 0.00 C ATOM 0 H ILE B 478 3.989 2.819 -5.441 1.00 0.00 H new ATOM 0 HA ILE B 478 5.696 4.814 -6.183 1.00 0.00 H new ATOM 0 HB ILE B 478 6.552 2.228 -4.843 1.00 0.00 H new ATOM 0 HG12 ILE B 478 4.460 3.140 -3.849 1.00 0.00 H new ATOM 0 HG13 ILE B 478 5.813 3.010 -2.743 1.00 0.00 H new ATOM 0 HG21 ILE B 478 8.114 3.719 -3.603 1.00 0.00 H new ATOM 0 HG22 ILE B 478 8.382 3.789 -5.361 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.509 5.105 -4.540 1.00 0.00 H new ATOM 0 HD11 ILE B 478 4.578 5.077 -2.378 1.00 0.00 H new ATOM 0 HD12 ILE B 478 6.228 5.429 -2.947 1.00 0.00 H new ATOM 0 HD13 ILE B 478 4.853 5.560 -4.069 1.00 0.00 H new ATOM 1492 N LYS B 479 6.318 1.936 -7.648 1.00 0.00 N ATOM 1493 CA LYS B 479 7.141 1.192 -8.598 1.00 0.00 C ATOM 1494 C LYS B 479 7.425 2.020 -9.845 1.00 0.00 C ATOM 1495 O LYS B 479 8.527 1.977 -10.392 1.00 0.00 O ATOM 1496 CB LYS B 479 6.454 -0.123 -8.984 1.00 0.00 C ATOM 1497 CG LYS B 479 7.401 -1.174 -9.550 1.00 0.00 C ATOM 1498 CD LYS B 479 8.450 -1.604 -8.529 1.00 0.00 C ATOM 1499 CE LYS B 479 7.825 -2.277 -7.313 1.00 0.00 C ATOM 1500 NZ LYS B 479 8.834 -2.570 -6.260 1.00 0.00 N ATOM 0 H LYS B 479 5.478 1.441 -7.350 1.00 0.00 H new ATOM 0 HA LYS B 479 8.092 0.967 -8.114 1.00 0.00 H new ATOM 0 HB2 LYS B 479 5.956 -0.533 -8.105 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.678 0.087 -9.721 1.00 0.00 H new ATOM 0 HG2 LYS B 479 6.828 -2.044 -9.870 1.00 0.00 H new ATOM 0 HG3 LYS B 479 7.898 -0.776 -10.435 1.00 0.00 H new ATOM 0 HD2 LYS B 479 9.154 -2.290 -9.000 1.00 0.00 H new ATOM 0 HD3 LYS B 479 9.020 -0.733 -8.207 1.00 0.00 H new ATOM 0 HE2 LYS B 479 7.048 -1.633 -6.902 1.00 0.00 H new ATOM 0 HE3 LYS B 479 7.341 -3.204 -7.620 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 8.368 -3.027 -5.450 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 9.562 -3.205 -6.644 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 9.278 -1.683 -5.948 1.00 0.00 H new ATOM 1514 N LYS B 480 6.433 2.778 -10.283 1.00 0.00 N ATOM 1515 CA LYS B 480 6.606 3.648 -11.433 1.00 0.00 C ATOM 1516 C LYS B 480 6.493 5.118 -11.040 1.00 0.00 C ATOM 1517 O LYS B 480 6.833 6.005 -11.825 1.00 0.00 O ATOM 1518 CB LYS B 480 5.601 3.315 -12.549 1.00 0.00 C ATOM 1519 CG LYS B 480 4.148 3.203 -12.094 1.00 0.00 C ATOM 1520 CD LYS B 480 3.806 1.804 -11.609 1.00 0.00 C ATOM 1521 CE LYS B 480 3.907 0.781 -12.730 1.00 0.00 C ATOM 1522 NZ LYS B 480 3.351 -0.537 -12.330 1.00 0.00 N ATOM 0 H LYS B 480 5.505 2.808 -9.862 1.00 0.00 H new ATOM 0 HA LYS B 480 7.611 3.472 -11.817 1.00 0.00 H new ATOM 0 HB2 LYS B 480 5.667 4.084 -13.319 1.00 0.00 H new ATOM 0 HB3 LYS B 480 5.895 2.373 -13.013 1.00 0.00 H new ATOM 0 HG2 LYS B 480 3.963 3.919 -11.293 1.00 0.00 H new ATOM 0 HG3 LYS B 480 3.489 3.471 -12.919 1.00 0.00 H new ATOM 0 HD2 LYS B 480 4.480 1.524 -10.799 1.00 0.00 H new ATOM 0 HD3 LYS B 480 2.796 1.797 -11.200 1.00 0.00 H new ATOM 0 HE2 LYS B 480 3.373 1.149 -13.606 1.00 0.00 H new ATOM 0 HE3 LYS B 480 4.951 0.662 -13.019 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 3.235 -1.135 -13.173 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 4.001 -1.000 -11.664 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 2.427 -0.400 -11.873 1.00 0.00 H new