USER MOD reduce.3.24.130724 H: found=0, std=0, add=956, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 956 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 102 GLN : amide:sc= 0.227 K(o=0.77,f=-5.4!) USER MOD Set 1.2: A 125 THR OG1 : rot 151:sc= 0.538 USER MOD Set 2.1: A 39 THR OG1 : rot -170:sc= 0.213 USER MOD Set 2.2: A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 19 CYS SG : rot 170:sc= -0.262 USER MOD Single : A 25 MET CE :methyl 167:sc= -2.37 (180deg=-3.04) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 36 CYS SG : rot 176:sc= -0.238 USER MOD Single : A 48 TYR OH : rot 179:sc= -0.404 USER MOD Single : A 49 GLN : amide:sc= -0.196 X(o=-0.2,f=-0.6) USER MOD Single : A 52 SER OG : rot 140:sc= 1.18 USER MOD Single : A 53 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.136) USER MOD Single : A 55 CYS SG : rot 4:sc= -0.373 USER MOD Single : A 58 MET CE :methyl -149:sc= -2.51 (180deg=-5.67!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -0.118 K(o=-0.12,f=-2.2!) USER MOD Single : A 63 HIS : no HD1:sc= -0.112 K(o=-0.11,f=-2.3!) USER MOD Single : A 64 CYS SG : rot 170:sc= -0.125 USER MOD Single : A 67 LYS NZ :NH3+ -116:sc= 0.686 (180deg=-0.235) USER MOD Single : A 68 GLN : amide:sc= -0.946 K(o=-0.95,f=-5.4!) USER MOD Single : A 69 ASN : amide:sc= -1.22 K(o=-1.2,f=-10!) USER MOD Single : A 73 GLN : amide:sc= -0.0614 X(o=-0.061,f=-0.49) USER MOD Single : A 75 THR OG1 : rot 34:sc= 0.319 USER MOD Single : A 77 MET CE :methyl 167:sc=-0.00781 (180deg=-0.252) USER MOD Single : A 79 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 80 LYS NZ :NH3+ -159:sc= -0.0075 (180deg=-0.286) USER MOD Single : A 81 SER OG : rot -132:sc= 1.09 USER MOD Single : A 83 ASN : amide:sc= -0.343 X(o=-0.34,f=-0.055) USER MOD Single : A 88 ASN : amide:sc= 0.0723 K(o=0.072,f=-9.6!) USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0.0699 USER MOD Single : A 101 HIS : no HE2:sc= -0.365 K(o=-0.37,f=-0.94) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= -0.29 X(o=-0.29,f=-0.65) USER MOD Single : A 120 TYR OH : rot 30:sc= -0.344 USER MOD Single : A 122 TYR OH : rot -51:sc= -0.857 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot -105:sc= 0.618 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot -105:sc= 0.0635 USER MOD ----------------------------------------------------------------- ATOM 156 N GLY A 15 8.800 -18.018 -9.723 1.00 0.00 N ATOM 157 CA GLY A 15 7.350 -18.019 -9.795 1.00 0.00 C ATOM 158 C GLY A 15 6.770 -16.619 -9.829 1.00 0.00 C ATOM 159 O GLY A 15 7.462 -15.646 -9.531 1.00 0.00 O ATOM 0 HA2 GLY A 15 7.034 -18.562 -10.686 1.00 0.00 H new ATOM 0 HA3 GLY A 15 6.947 -18.555 -8.936 1.00 0.00 H new ATOM 163 N ARG A 16 5.496 -16.517 -10.196 1.00 0.00 N ATOM 164 CA ARG A 16 4.824 -15.226 -10.272 1.00 0.00 C ATOM 165 C ARG A 16 4.909 -14.490 -8.938 1.00 0.00 C ATOM 166 O ARG A 16 5.107 -15.105 -7.890 1.00 0.00 O ATOM 167 CB ARG A 16 3.360 -15.412 -10.672 1.00 0.00 C ATOM 168 CG ARG A 16 3.122 -15.321 -12.171 1.00 0.00 C ATOM 169 CD ARG A 16 2.793 -16.681 -12.766 1.00 0.00 C ATOM 170 NE ARG A 16 1.433 -16.733 -13.295 1.00 0.00 N ATOM 171 CZ ARG A 16 0.897 -17.820 -13.839 1.00 0.00 C ATOM 172 NH1 ARG A 16 1.601 -18.940 -13.923 1.00 0.00 N ATOM 173 NH2 ARG A 16 -0.348 -17.788 -14.298 1.00 0.00 N ATOM 0 H ARG A 16 4.909 -17.313 -10.445 1.00 0.00 H new ATOM 0 HA ARG A 16 5.327 -14.627 -11.031 1.00 0.00 H new ATOM 0 HB2 ARG A 16 3.015 -16.383 -10.316 1.00 0.00 H new ATOM 0 HB3 ARG A 16 2.756 -14.656 -10.170 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.304 -14.628 -12.369 1.00 0.00 H new ATOM 0 HG3 ARG A 16 4.009 -14.915 -12.657 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.501 -16.909 -13.563 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.915 -17.450 -12.003 1.00 0.00 H new ATOM 0 HE ARG A 16 0.863 -15.888 -13.244 1.00 0.00 H new ATOM 0 HH11 ARG A 16 2.557 -18.969 -13.569 1.00 0.00 H new ATOM 0 HH12 ARG A 16 1.186 -19.773 -14.341 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -0.894 -16.929 -14.233 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -0.759 -18.623 -14.716 1.00 0.00 H new ATOM 187 N SER A 17 4.757 -13.170 -8.985 1.00 0.00 N ATOM 188 CA SER A 17 4.820 -12.350 -7.781 1.00 0.00 C ATOM 189 C SER A 17 3.832 -11.190 -7.861 1.00 0.00 C ATOM 190 O SER A 17 4.026 -10.248 -8.629 1.00 0.00 O ATOM 191 CB SER A 17 6.238 -11.814 -7.578 1.00 0.00 C ATOM 192 OG SER A 17 6.980 -12.651 -6.708 1.00 0.00 O ATOM 0 H SER A 17 4.589 -12.646 -9.844 1.00 0.00 H new ATOM 0 HA SER A 17 4.550 -12.976 -6.930 1.00 0.00 H new ATOM 0 HB2 SER A 17 6.745 -11.744 -8.540 1.00 0.00 H new ATOM 0 HB3 SER A 17 6.194 -10.805 -7.167 1.00 0.00 H new ATOM 0 HG SER A 17 7.883 -12.288 -6.596 1.00 0.00 H new ATOM 198 N TRP A 18 2.773 -11.267 -7.064 1.00 0.00 N ATOM 199 CA TRP A 18 1.754 -10.224 -7.044 1.00 0.00 C ATOM 200 C TRP A 18 2.385 -8.850 -6.845 1.00 0.00 C ATOM 201 O TRP A 18 3.563 -8.742 -6.503 1.00 0.00 O ATOM 202 CB TRP A 18 0.737 -10.497 -5.935 1.00 0.00 C ATOM 203 CG TRP A 18 -0.127 -11.693 -6.203 1.00 0.00 C ATOM 204 CD1 TRP A 18 0.192 -13.001 -5.977 1.00 0.00 C ATOM 205 CD2 TRP A 18 -1.450 -11.689 -6.749 1.00 0.00 C ATOM 206 NE1 TRP A 18 -0.854 -13.811 -6.349 1.00 0.00 N ATOM 207 CE2 TRP A 18 -1.873 -13.030 -6.826 1.00 0.00 C ATOM 208 CE3 TRP A 18 -2.320 -10.683 -7.179 1.00 0.00 C ATOM 209 CZ2 TRP A 18 -3.126 -13.389 -7.316 1.00 0.00 C ATOM 210 CZ3 TRP A 18 -3.563 -11.040 -7.666 1.00 0.00 C ATOM 211 CH2 TRP A 18 -3.957 -12.383 -7.730 1.00 0.00 C ATOM 0 H TRP A 18 2.597 -12.041 -6.423 1.00 0.00 H new ATOM 0 HA TRP A 18 1.242 -10.232 -8.006 1.00 0.00 H new ATOM 0 HB2 TRP A 18 1.267 -10.644 -4.994 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.102 -9.620 -5.810 1.00 0.00 H new ATOM 0 HD1 TRP A 18 1.129 -13.348 -5.566 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -0.869 -14.829 -6.281 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -2.026 -9.645 -7.131 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -3.431 -14.424 -7.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -4.242 -10.271 -8.003 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -4.936 -12.630 -8.114 1.00 0.00 H new ATOM 222 N CYS A 19 1.595 -7.804 -7.060 1.00 0.00 N ATOM 223 CA CYS A 19 2.077 -6.437 -6.904 1.00 0.00 C ATOM 224 C CYS A 19 0.936 -5.437 -7.062 1.00 0.00 C ATOM 225 O CYS A 19 -0.220 -5.821 -7.245 1.00 0.00 O ATOM 226 CB CYS A 19 3.176 -6.142 -7.926 1.00 0.00 C ATOM 227 SG CYS A 19 2.575 -5.954 -9.621 1.00 0.00 S ATOM 0 H CYS A 19 0.618 -7.877 -7.343 1.00 0.00 H new ATOM 0 HA CYS A 19 2.488 -6.335 -5.900 1.00 0.00 H new ATOM 0 HB2 CYS A 19 3.695 -5.230 -7.632 1.00 0.00 H new ATOM 0 HB3 CYS A 19 3.909 -6.948 -7.899 1.00 0.00 H new ATOM 0 HG CYS A 19 3.533 -5.499 -10.373 1.00 0.00 H new ATOM 233 N LEU A 20 1.268 -4.152 -6.989 1.00 0.00 N ATOM 234 CA LEU A 20 0.272 -3.096 -7.122 1.00 0.00 C ATOM 235 C LEU A 20 0.523 -2.265 -8.377 1.00 0.00 C ATOM 236 O LEU A 20 0.986 -1.128 -8.297 1.00 0.00 O ATOM 237 CB LEU A 20 0.288 -2.193 -5.887 1.00 0.00 C ATOM 238 CG LEU A 20 -0.158 -2.841 -4.576 1.00 0.00 C ATOM 239 CD1 LEU A 20 0.020 -1.874 -3.416 1.00 0.00 C ATOM 240 CD2 LEU A 20 -1.605 -3.300 -4.673 1.00 0.00 C ATOM 0 H LEU A 20 2.220 -3.817 -6.838 1.00 0.00 H new ATOM 0 HA LEU A 20 -0.708 -3.565 -7.209 1.00 0.00 H new ATOM 0 HB2 LEU A 20 1.300 -1.811 -5.754 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -0.354 -1.334 -6.081 1.00 0.00 H new ATOM 0 HG LEU A 20 0.467 -3.715 -4.393 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -0.302 -2.352 -2.491 1.00 0.00 H new ATOM 0 HD12 LEU A 20 1.070 -1.595 -3.333 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -0.580 -0.981 -3.591 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -1.905 -3.759 -3.731 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -2.246 -2.443 -4.879 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -1.703 -4.028 -5.478 1.00 0.00 H new ATOM 252 N ARG A 21 0.212 -2.841 -9.533 1.00 0.00 N ATOM 253 CA ARG A 21 0.404 -2.154 -10.805 1.00 0.00 C ATOM 254 C ARG A 21 -0.239 -0.770 -10.777 1.00 0.00 C ATOM 255 O ARG A 21 -1.463 -0.644 -10.752 1.00 0.00 O ATOM 256 CB ARG A 21 -0.188 -2.979 -11.949 1.00 0.00 C ATOM 257 CG ARG A 21 0.184 -2.462 -13.329 1.00 0.00 C ATOM 258 CD ARG A 21 -0.583 -3.189 -14.422 1.00 0.00 C ATOM 259 NE ARG A 21 -1.813 -2.492 -14.785 1.00 0.00 N ATOM 260 CZ ARG A 21 -2.652 -2.919 -15.722 1.00 0.00 C ATOM 261 NH1 ARG A 21 -2.393 -4.037 -16.387 1.00 0.00 N ATOM 262 NH2 ARG A 21 -3.752 -2.229 -15.995 1.00 0.00 N ATOM 0 H ARG A 21 -0.174 -3.782 -9.616 1.00 0.00 H new ATOM 0 HA ARG A 21 1.475 -2.036 -10.968 1.00 0.00 H new ATOM 0 HB2 ARG A 21 0.150 -4.011 -11.854 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.274 -2.989 -11.855 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -0.024 -1.394 -13.386 1.00 0.00 H new ATOM 0 HG3 ARG A 21 1.255 -2.588 -13.489 1.00 0.00 H new ATOM 0 HD2 ARG A 21 0.050 -3.289 -15.304 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -0.824 -4.198 -14.086 1.00 0.00 H new ATOM 0 HE ARG A 21 -2.041 -1.629 -14.292 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -1.549 -4.570 -16.179 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -3.038 -4.364 -17.106 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -3.954 -1.369 -15.485 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -4.395 -2.558 -16.715 1.00 0.00 H new ATOM 276 N ARG A 22 0.596 0.264 -10.780 1.00 0.00 N ATOM 277 CA ARG A 22 0.109 1.638 -10.754 1.00 0.00 C ATOM 278 C ARG A 22 -0.782 1.923 -11.959 1.00 0.00 C ATOM 279 O ARG A 22 -0.370 1.743 -13.105 1.00 0.00 O ATOM 280 CB ARG A 22 1.285 2.617 -10.732 1.00 0.00 C ATOM 281 CG ARG A 22 0.884 4.042 -10.385 1.00 0.00 C ATOM 282 CD ARG A 22 0.943 4.287 -8.885 1.00 0.00 C ATOM 283 NE ARG A 22 1.417 5.632 -8.569 1.00 0.00 N ATOM 284 CZ ARG A 22 2.701 5.972 -8.548 1.00 0.00 C ATOM 285 NH1 ARG A 22 3.634 5.072 -8.824 1.00 0.00 N ATOM 286 NH2 ARG A 22 3.054 7.217 -8.251 1.00 0.00 N ATOM 0 H ARG A 22 1.612 0.176 -10.800 1.00 0.00 H new ATOM 0 HA ARG A 22 -0.483 1.770 -9.848 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.023 2.270 -10.009 1.00 0.00 H new ATOM 0 HB3 ARG A 22 1.769 2.612 -11.708 1.00 0.00 H new ATOM 0 HG2 ARG A 22 1.545 4.742 -10.896 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -0.126 4.236 -10.747 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -0.048 4.141 -8.455 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.603 3.552 -8.423 1.00 0.00 H new ATOM 0 HE ARG A 22 0.725 6.349 -8.353 1.00 0.00 H new ATOM 0 HH11 ARG A 22 3.367 4.115 -9.054 1.00 0.00 H new ATOM 0 HH12 ARG A 22 4.619 5.337 -8.807 1.00 0.00 H new ATOM 0 HH21 ARG A 22 2.339 7.913 -8.039 1.00 0.00 H new ATOM 0 HH22 ARG A 22 4.040 7.477 -8.235 1.00 0.00 H new ATOM 300 N VAL A 23 -2.006 2.368 -11.692 1.00 0.00 N ATOM 301 CA VAL A 23 -2.955 2.678 -12.753 1.00 0.00 C ATOM 302 C VAL A 23 -2.570 3.964 -13.477 1.00 0.00 C ATOM 303 O VAL A 23 -2.389 5.009 -12.854 1.00 0.00 O ATOM 304 CB VAL A 23 -4.386 2.822 -12.202 1.00 0.00 C ATOM 305 CG1 VAL A 23 -5.363 3.133 -13.326 1.00 0.00 C ATOM 306 CG2 VAL A 23 -4.800 1.560 -11.460 1.00 0.00 C ATOM 0 H VAL A 23 -2.363 2.522 -10.749 1.00 0.00 H new ATOM 0 HA VAL A 23 -2.926 1.846 -13.456 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.403 3.654 -11.497 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.369 3.231 -12.917 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -5.075 4.066 -13.810 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.346 2.325 -14.057 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.814 1.679 -11.077 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.767 0.710 -12.141 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.117 1.386 -10.629 1.00 0.00 H new ATOM 316 N GLY A 24 -2.447 3.879 -14.798 1.00 0.00 N ATOM 317 CA GLY A 24 -2.084 5.043 -15.586 1.00 0.00 C ATOM 318 C GLY A 24 -0.591 5.136 -15.829 1.00 0.00 C ATOM 319 O GLY A 24 -0.155 5.629 -16.869 1.00 0.00 O ATOM 0 H GLY A 24 -2.592 3.025 -15.337 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -2.603 5.006 -16.544 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -2.423 5.944 -15.075 1.00 0.00 H new ATOM 323 N MET A 25 0.194 4.662 -14.867 1.00 0.00 N ATOM 324 CA MET A 25 1.648 4.694 -14.983 1.00 0.00 C ATOM 325 C MET A 25 2.214 3.285 -15.124 1.00 0.00 C ATOM 326 O MET A 25 1.744 2.350 -14.475 1.00 0.00 O ATOM 327 CB MET A 25 2.262 5.384 -13.763 1.00 0.00 C ATOM 328 CG MET A 25 2.487 6.874 -13.957 1.00 0.00 C ATOM 329 SD MET A 25 2.618 7.766 -12.395 1.00 0.00 S ATOM 330 CE MET A 25 3.735 6.698 -11.489 1.00 0.00 C ATOM 0 H MET A 25 -0.151 4.252 -13.999 1.00 0.00 H new ATOM 0 HA MET A 25 1.904 5.259 -15.879 1.00 0.00 H new ATOM 0 HB2 MET A 25 1.609 5.232 -12.903 1.00 0.00 H new ATOM 0 HB3 MET A 25 3.214 4.909 -13.528 1.00 0.00 H new ATOM 0 HG2 MET A 25 3.398 7.028 -14.536 1.00 0.00 H new ATOM 0 HG3 MET A 25 1.665 7.289 -14.540 1.00 0.00 H new ATOM 0 HE1 MET A 25 4.097 7.218 -10.602 1.00 0.00 H new ATOM 0 HE2 MET A 25 3.209 5.792 -11.189 1.00 0.00 H new ATOM 0 HE3 MET A 25 4.580 6.433 -12.124 1.00 0.00 H new ATOM 340 N SER A 26 3.224 3.140 -15.975 1.00 0.00 N ATOM 341 CA SER A 26 3.851 1.843 -16.204 1.00 0.00 C ATOM 342 C SER A 26 5.050 1.649 -15.281 1.00 0.00 C ATOM 343 O SER A 26 5.881 0.768 -15.502 1.00 0.00 O ATOM 344 CB SER A 26 4.290 1.715 -17.664 1.00 0.00 C ATOM 345 OG SER A 26 4.190 0.374 -18.111 1.00 0.00 O ATOM 0 H SER A 26 3.626 3.904 -16.518 1.00 0.00 H new ATOM 0 HA SER A 26 3.116 1.068 -15.984 1.00 0.00 H new ATOM 0 HB2 SER A 26 3.671 2.358 -18.291 1.00 0.00 H new ATOM 0 HB3 SER A 26 5.318 2.061 -17.770 1.00 0.00 H new ATOM 0 HG SER A 26 4.475 0.319 -19.047 1.00 0.00 H new ATOM 351 N ALA A 27 5.134 2.480 -14.247 1.00 0.00 N ATOM 352 CA ALA A 27 6.229 2.400 -13.289 1.00 0.00 C ATOM 353 C ALA A 27 5.715 2.494 -11.857 1.00 0.00 C ATOM 354 O ALA A 27 4.514 2.626 -11.626 1.00 0.00 O ATOM 355 CB ALA A 27 7.248 3.497 -13.560 1.00 0.00 C ATOM 0 H ALA A 27 4.456 3.217 -14.052 1.00 0.00 H new ATOM 0 HA ALA A 27 6.714 1.431 -13.409 1.00 0.00 H new ATOM 0 HB1 ALA A 27 8.061 3.425 -12.837 1.00 0.00 H new ATOM 0 HB2 ALA A 27 7.648 3.382 -14.568 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.767 4.471 -13.470 1.00 0.00 H new ATOM 361 N GLY A 28 6.633 2.425 -10.897 1.00 0.00 N ATOM 362 CA GLY A 28 6.251 2.504 -9.499 1.00 0.00 C ATOM 363 C GLY A 28 5.417 1.317 -9.058 1.00 0.00 C ATOM 364 O GLY A 28 4.518 1.456 -8.229 1.00 0.00 O ATOM 0 H GLY A 28 7.634 2.316 -11.063 1.00 0.00 H new ATOM 0 HA2 GLY A 28 7.148 2.563 -8.883 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.688 3.422 -9.331 1.00 0.00 H new ATOM 368 N TRP A 29 5.714 0.148 -9.614 1.00 0.00 N ATOM 369 CA TRP A 29 4.983 -1.067 -9.274 1.00 0.00 C ATOM 370 C TRP A 29 5.446 -1.623 -7.932 1.00 0.00 C ATOM 371 O TRP A 29 6.570 -2.110 -7.805 1.00 0.00 O ATOM 372 CB TRP A 29 5.167 -2.120 -10.368 1.00 0.00 C ATOM 373 CG TRP A 29 4.535 -1.739 -11.672 1.00 0.00 C ATOM 374 CD1 TRP A 29 3.920 -0.557 -11.971 1.00 0.00 C ATOM 375 CD2 TRP A 29 4.454 -2.545 -12.853 1.00 0.00 C ATOM 376 NE1 TRP A 29 3.462 -0.579 -13.266 1.00 0.00 N ATOM 377 CE2 TRP A 29 3.778 -1.787 -13.829 1.00 0.00 C ATOM 378 CE3 TRP A 29 4.888 -3.832 -13.182 1.00 0.00 C ATOM 379 CZ2 TRP A 29 3.527 -2.275 -15.109 1.00 0.00 C ATOM 380 CZ3 TRP A 29 4.638 -4.315 -14.452 1.00 0.00 C ATOM 381 CH2 TRP A 29 3.963 -3.538 -15.403 1.00 0.00 C ATOM 0 H TRP A 29 6.455 0.016 -10.302 1.00 0.00 H new ATOM 0 HA TRP A 29 3.925 -0.816 -9.196 1.00 0.00 H new ATOM 0 HB2 TRP A 29 6.232 -2.288 -10.524 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.741 -3.064 -10.029 1.00 0.00 H new ATOM 0 HD1 TRP A 29 3.810 0.273 -11.289 1.00 0.00 H new ATOM 0 HE1 TRP A 29 2.967 0.181 -13.733 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.410 -4.438 -12.456 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 3.007 -1.678 -15.843 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 4.969 -5.309 -14.716 1.00 0.00 H new ATOM 0 HH2 TRP A 29 3.783 -3.944 -16.387 1.00 0.00 H new ATOM 392 N LEU A 30 4.573 -1.549 -6.934 1.00 0.00 N ATOM 393 CA LEU A 30 4.893 -2.046 -5.600 1.00 0.00 C ATOM 394 C LEU A 30 4.835 -3.570 -5.558 1.00 0.00 C ATOM 395 O LEU A 30 3.757 -4.163 -5.613 1.00 0.00 O ATOM 396 CB LEU A 30 3.926 -1.460 -4.570 1.00 0.00 C ATOM 397 CG LEU A 30 3.668 0.044 -4.672 1.00 0.00 C ATOM 398 CD1 LEU A 30 2.565 0.463 -3.712 1.00 0.00 C ATOM 399 CD2 LEU A 30 4.944 0.824 -4.393 1.00 0.00 C ATOM 0 H LEU A 30 3.638 -1.150 -7.023 1.00 0.00 H new ATOM 0 HA LEU A 30 5.908 -1.732 -5.357 1.00 0.00 H new ATOM 0 HB2 LEU A 30 2.972 -1.979 -4.660 1.00 0.00 H new ATOM 0 HB3 LEU A 30 4.313 -1.675 -3.574 1.00 0.00 H new ATOM 0 HG LEU A 30 3.343 0.269 -5.688 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.395 1.536 -3.799 1.00 0.00 H new ATOM 0 HD12 LEU A 30 1.647 -0.070 -3.958 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.861 0.224 -2.691 1.00 0.00 H new ATOM 0 HD21 LEU A 30 4.742 1.892 -4.470 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.299 0.593 -3.389 1.00 0.00 H new ATOM 0 HD23 LEU A 30 5.707 0.546 -5.120 1.00 0.00 H new ATOM 411 N LEU A 31 6.001 -4.199 -5.459 1.00 0.00 N ATOM 412 CA LEU A 31 6.084 -5.654 -5.408 1.00 0.00 C ATOM 413 C LEU A 31 5.428 -6.192 -4.140 1.00 0.00 C ATOM 414 O LEU A 31 5.510 -5.577 -3.076 1.00 0.00 O ATOM 415 CB LEU A 31 7.545 -6.104 -5.470 1.00 0.00 C ATOM 416 CG LEU A 31 7.798 -7.594 -5.241 1.00 0.00 C ATOM 417 CD1 LEU A 31 7.377 -8.401 -6.460 1.00 0.00 C ATOM 418 CD2 LEU A 31 9.264 -7.842 -4.916 1.00 0.00 C ATOM 0 H LEU A 31 6.902 -3.724 -5.412 1.00 0.00 H new ATOM 0 HA LEU A 31 5.550 -6.054 -6.270 1.00 0.00 H new ATOM 0 HB2 LEU A 31 7.947 -5.834 -6.447 1.00 0.00 H new ATOM 0 HB3 LEU A 31 8.110 -5.541 -4.726 1.00 0.00 H new ATOM 0 HG LEU A 31 7.198 -7.918 -4.391 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.565 -9.459 -6.278 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.314 -8.248 -6.648 1.00 0.00 H new ATOM 0 HD13 LEU A 31 7.950 -8.075 -7.328 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.426 -8.908 -4.756 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.883 -7.501 -5.746 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.534 -7.294 -4.013 1.00 0.00 H new ATOM 430 N LEU A 32 4.779 -7.345 -4.260 1.00 0.00 N ATOM 431 CA LEU A 32 4.110 -7.968 -3.123 1.00 0.00 C ATOM 432 C LEU A 32 4.661 -9.367 -2.867 1.00 0.00 C ATOM 433 O LEU A 32 3.974 -10.364 -3.086 1.00 0.00 O ATOM 434 CB LEU A 32 2.602 -8.038 -3.369 1.00 0.00 C ATOM 435 CG LEU A 32 1.844 -6.714 -3.274 1.00 0.00 C ATOM 436 CD1 LEU A 32 0.438 -6.862 -3.835 1.00 0.00 C ATOM 437 CD2 LEU A 32 1.797 -6.228 -1.832 1.00 0.00 C ATOM 0 H LEU A 32 4.702 -7.867 -5.133 1.00 0.00 H new ATOM 0 HA LEU A 32 4.300 -7.356 -2.241 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.435 -8.459 -4.361 1.00 0.00 H new ATOM 0 HB3 LEU A 32 2.169 -8.734 -2.650 1.00 0.00 H new ATOM 0 HG LEU A 32 2.374 -5.971 -3.870 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.086 -5.909 -3.759 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.493 -7.163 -4.881 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.102 -7.620 -3.268 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.254 -5.284 -1.784 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.291 -6.970 -1.214 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.813 -6.081 -1.464 1.00 0.00 H new ATOM 449 N GLU A 33 5.904 -9.433 -2.401 1.00 0.00 N ATOM 450 CA GLU A 33 6.546 -10.710 -2.115 1.00 0.00 C ATOM 451 C GLU A 33 5.687 -11.552 -1.175 1.00 0.00 C ATOM 452 O GLU A 33 5.217 -11.068 -0.145 1.00 0.00 O ATOM 453 CB GLU A 33 7.927 -10.485 -1.496 1.00 0.00 C ATOM 454 CG GLU A 33 9.075 -10.893 -2.404 1.00 0.00 C ATOM 455 CD GLU A 33 10.431 -10.695 -1.755 1.00 0.00 C ATOM 456 OE1 GLU A 33 10.609 -9.678 -1.052 1.00 0.00 O ATOM 457 OE2 GLU A 33 11.314 -11.556 -1.950 1.00 0.00 O ATOM 0 H GLU A 33 6.486 -8.617 -2.214 1.00 0.00 H new ATOM 0 HA GLU A 33 6.661 -11.248 -3.056 1.00 0.00 H new ATOM 0 HB2 GLU A 33 8.034 -9.431 -1.241 1.00 0.00 H new ATOM 0 HB3 GLU A 33 7.994 -11.047 -0.565 1.00 0.00 H new ATOM 0 HG2 GLU A 33 8.959 -11.941 -2.682 1.00 0.00 H new ATOM 0 HG3 GLU A 33 9.029 -10.312 -3.325 1.00 0.00 H new ATOM 464 N ASP A 34 5.485 -12.814 -1.539 1.00 0.00 N ATOM 465 CA ASP A 34 4.683 -13.724 -0.730 1.00 0.00 C ATOM 466 C ASP A 34 5.315 -13.930 0.644 1.00 0.00 C ATOM 467 O ASP A 34 6.390 -14.517 0.762 1.00 0.00 O ATOM 468 CB ASP A 34 4.528 -15.070 -1.440 1.00 0.00 C ATOM 469 CG ASP A 34 4.057 -16.166 -0.506 1.00 0.00 C ATOM 470 OD1 ASP A 34 4.888 -16.681 0.271 1.00 0.00 O ATOM 471 OD2 ASP A 34 2.857 -16.511 -0.552 1.00 0.00 O ATOM 0 H ASP A 34 5.866 -13.230 -2.389 1.00 0.00 H new ATOM 0 HA ASP A 34 3.698 -13.278 -0.594 1.00 0.00 H new ATOM 0 HB2 ASP A 34 3.818 -14.965 -2.260 1.00 0.00 H new ATOM 0 HB3 ASP A 34 5.483 -15.357 -1.880 1.00 0.00 H new ATOM 476 N GLY A 35 4.639 -13.441 1.679 1.00 0.00 N ATOM 477 CA GLY A 35 5.150 -13.580 3.030 1.00 0.00 C ATOM 478 C GLY A 35 6.011 -12.405 3.449 1.00 0.00 C ATOM 479 O GLY A 35 6.773 -12.497 4.412 1.00 0.00 O ATOM 0 H GLY A 35 3.747 -12.951 1.606 1.00 0.00 H new ATOM 0 HA2 GLY A 35 4.314 -13.679 3.723 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.734 -14.498 3.102 1.00 0.00 H new ATOM 483 N CYS A 36 5.891 -11.299 2.724 1.00 0.00 N ATOM 484 CA CYS A 36 6.667 -10.100 3.023 1.00 0.00 C ATOM 485 C CYS A 36 5.751 -8.900 3.241 1.00 0.00 C ATOM 486 O CYS A 36 4.991 -8.519 2.351 1.00 0.00 O ATOM 487 CB CYS A 36 7.651 -9.807 1.890 1.00 0.00 C ATOM 488 SG CYS A 36 9.167 -10.790 1.957 1.00 0.00 S ATOM 0 H CYS A 36 5.264 -11.207 1.925 1.00 0.00 H new ATOM 0 HA CYS A 36 7.226 -10.279 3.941 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.155 -9.988 0.936 1.00 0.00 H new ATOM 0 HB3 CYS A 36 7.915 -8.750 1.916 1.00 0.00 H new ATOM 0 HG CYS A 36 9.892 -10.542 0.907 1.00 0.00 H new ATOM 494 N GLU A 37 5.829 -8.311 4.430 1.00 0.00 N ATOM 495 CA GLU A 37 5.004 -7.155 4.764 1.00 0.00 C ATOM 496 C GLU A 37 5.377 -5.953 3.901 1.00 0.00 C ATOM 497 O GLU A 37 6.548 -5.588 3.799 1.00 0.00 O ATOM 498 CB GLU A 37 5.159 -6.802 6.245 1.00 0.00 C ATOM 499 CG GLU A 37 3.855 -6.400 6.914 1.00 0.00 C ATOM 500 CD GLU A 37 4.072 -5.551 8.152 1.00 0.00 C ATOM 501 OE1 GLU A 37 4.909 -4.626 8.098 1.00 0.00 O ATOM 502 OE2 GLU A 37 3.405 -5.813 9.174 1.00 0.00 O ATOM 0 H GLU A 37 6.454 -8.614 5.177 1.00 0.00 H new ATOM 0 HA GLU A 37 3.964 -7.413 4.566 1.00 0.00 H new ATOM 0 HB2 GLU A 37 5.579 -7.659 6.772 1.00 0.00 H new ATOM 0 HB3 GLU A 37 5.875 -5.986 6.342 1.00 0.00 H new ATOM 0 HG2 GLU A 37 3.241 -5.848 6.202 1.00 0.00 H new ATOM 0 HG3 GLU A 37 3.299 -7.297 7.186 1.00 0.00 H new ATOM 509 N VAL A 38 4.371 -5.343 3.282 1.00 0.00 N ATOM 510 CA VAL A 38 4.592 -4.182 2.428 1.00 0.00 C ATOM 511 C VAL A 38 3.928 -2.938 3.009 1.00 0.00 C ATOM 512 O VAL A 38 2.716 -2.753 2.888 1.00 0.00 O ATOM 513 CB VAL A 38 4.053 -4.421 1.005 1.00 0.00 C ATOM 514 CG1 VAL A 38 4.262 -3.187 0.140 1.00 0.00 C ATOM 515 CG2 VAL A 38 4.718 -5.638 0.381 1.00 0.00 C ATOM 0 H VAL A 38 3.396 -5.633 3.356 1.00 0.00 H new ATOM 0 HA VAL A 38 5.670 -4.026 2.379 1.00 0.00 H new ATOM 0 HB VAL A 38 2.982 -4.613 1.069 1.00 0.00 H new ATOM 0 HG11 VAL A 38 3.875 -3.375 -0.862 1.00 0.00 H new ATOM 0 HG12 VAL A 38 3.735 -2.341 0.580 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.326 -2.960 0.081 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.325 -5.792 -0.624 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.795 -5.478 0.329 1.00 0.00 H new ATOM 0 HG23 VAL A 38 4.511 -6.518 0.990 1.00 0.00 H new ATOM 525 N THR A 39 4.729 -2.086 3.641 1.00 0.00 N ATOM 526 CA THR A 39 4.220 -0.860 4.242 1.00 0.00 C ATOM 527 C THR A 39 4.478 0.342 3.340 1.00 0.00 C ATOM 528 O THR A 39 5.625 0.663 3.030 1.00 0.00 O ATOM 529 CB THR A 39 4.860 -0.601 5.619 1.00 0.00 C ATOM 530 OG1 THR A 39 6.265 -0.371 5.471 1.00 0.00 O ATOM 531 CG2 THR A 39 4.630 -1.780 6.552 1.00 0.00 C ATOM 0 H THR A 39 5.734 -2.223 3.750 1.00 0.00 H new ATOM 0 HA THR A 39 3.146 -0.992 4.369 1.00 0.00 H new ATOM 0 HB THR A 39 4.392 0.283 6.052 1.00 0.00 H new ATOM 0 HG1 THR A 39 6.690 -0.364 6.354 1.00 0.00 H new ATOM 0 HG21 THR A 39 5.091 -1.575 7.518 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.559 -1.935 6.686 1.00 0.00 H new ATOM 0 HG23 THR A 39 5.075 -2.677 6.121 1.00 0.00 H new ATOM 539 N VAL A 40 3.404 1.004 2.923 1.00 0.00 N ATOM 540 CA VAL A 40 3.514 2.173 2.058 1.00 0.00 C ATOM 541 C VAL A 40 3.389 3.463 2.860 1.00 0.00 C ATOM 542 O VAL A 40 2.708 3.507 3.884 1.00 0.00 O ATOM 543 CB VAL A 40 2.438 2.159 0.956 1.00 0.00 C ATOM 544 CG1 VAL A 40 2.684 3.279 -0.044 1.00 0.00 C ATOM 545 CG2 VAL A 40 2.407 0.808 0.259 1.00 0.00 C ATOM 0 H VAL A 40 2.447 0.751 3.170 1.00 0.00 H new ATOM 0 HA VAL A 40 4.499 2.132 1.593 1.00 0.00 H new ATOM 0 HB VAL A 40 1.465 2.325 1.419 1.00 0.00 H new ATOM 0 HG11 VAL A 40 1.914 3.254 -0.815 1.00 0.00 H new ATOM 0 HG12 VAL A 40 2.651 4.240 0.470 1.00 0.00 H new ATOM 0 HG13 VAL A 40 3.663 3.147 -0.504 1.00 0.00 H new ATOM 0 HG21 VAL A 40 1.641 0.816 -0.516 1.00 0.00 H new ATOM 0 HG22 VAL A 40 3.379 0.609 -0.193 1.00 0.00 H new ATOM 0 HG23 VAL A 40 2.179 0.029 0.986 1.00 0.00 H new ATOM 555 N GLY A 41 4.051 4.515 2.386 1.00 0.00 N ATOM 556 CA GLY A 41 4.000 5.793 3.070 1.00 0.00 C ATOM 557 C GLY A 41 4.903 6.830 2.431 1.00 0.00 C ATOM 558 O GLY A 41 5.351 6.657 1.297 1.00 0.00 O ATOM 0 H GLY A 41 4.621 4.504 1.540 1.00 0.00 H new ATOM 0 HA2 GLY A 41 2.974 6.160 3.071 1.00 0.00 H new ATOM 0 HA3 GLY A 41 4.290 5.656 4.112 1.00 0.00 H new ATOM 562 N ARG A 42 5.169 7.910 3.158 1.00 0.00 N ATOM 563 CA ARG A 42 6.022 8.979 2.654 1.00 0.00 C ATOM 564 C ARG A 42 7.230 9.185 3.563 1.00 0.00 C ATOM 565 O ARG A 42 7.801 10.274 3.617 1.00 0.00 O ATOM 566 CB ARG A 42 5.229 10.282 2.539 1.00 0.00 C ATOM 567 CG ARG A 42 4.721 10.806 3.873 1.00 0.00 C ATOM 568 CD ARG A 42 4.577 12.319 3.858 1.00 0.00 C ATOM 569 NE ARG A 42 3.978 12.824 5.090 1.00 0.00 N ATOM 570 CZ ARG A 42 4.657 13.003 6.218 1.00 0.00 C ATOM 571 NH1 ARG A 42 5.951 12.721 6.268 1.00 0.00 N ATOM 572 NH2 ARG A 42 4.041 13.466 7.298 1.00 0.00 N ATOM 0 H ARG A 42 4.806 8.068 4.098 1.00 0.00 H new ATOM 0 HA ARG A 42 6.378 8.690 1.665 1.00 0.00 H new ATOM 0 HB2 ARG A 42 5.859 11.041 2.076 1.00 0.00 H new ATOM 0 HB3 ARG A 42 4.380 10.123 1.874 1.00 0.00 H new ATOM 0 HG2 ARG A 42 3.758 10.350 4.101 1.00 0.00 H new ATOM 0 HG3 ARG A 42 5.409 10.513 4.666 1.00 0.00 H new ATOM 0 HD2 ARG A 42 5.557 12.775 3.718 1.00 0.00 H new ATOM 0 HD3 ARG A 42 3.963 12.616 3.008 1.00 0.00 H new ATOM 0 HE ARG A 42 2.984 13.052 5.084 1.00 0.00 H new ATOM 0 HH11 ARG A 42 6.428 12.366 5.439 1.00 0.00 H new ATOM 0 HH12 ARG A 42 6.470 12.859 7.135 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.045 13.685 7.263 1.00 0.00 H new ATOM 0 HH22 ARG A 42 4.563 13.603 8.163 1.00 0.00 H new ATOM 586 N GLY A 43 7.615 8.131 4.276 1.00 0.00 N ATOM 587 CA GLY A 43 8.752 8.218 5.174 1.00 0.00 C ATOM 588 C GLY A 43 9.914 7.354 4.723 1.00 0.00 C ATOM 589 O GLY A 43 9.954 6.905 3.577 1.00 0.00 O ATOM 0 H GLY A 43 7.160 7.219 4.248 1.00 0.00 H new ATOM 0 HA2 GLY A 43 9.079 9.256 5.242 1.00 0.00 H new ATOM 0 HA3 GLY A 43 8.445 7.915 6.175 1.00 0.00 H new ATOM 593 N PHE A 44 10.862 7.123 5.624 1.00 0.00 N ATOM 594 CA PHE A 44 12.032 6.311 5.312 1.00 0.00 C ATOM 595 C PHE A 44 11.891 4.908 5.896 1.00 0.00 C ATOM 596 O PHE A 44 12.433 3.943 5.359 1.00 0.00 O ATOM 597 CB PHE A 44 13.300 6.975 5.853 1.00 0.00 C ATOM 598 CG PHE A 44 14.532 6.650 5.058 1.00 0.00 C ATOM 599 CD1 PHE A 44 14.891 7.421 3.964 1.00 0.00 C ATOM 600 CD2 PHE A 44 15.332 5.572 5.404 1.00 0.00 C ATOM 601 CE1 PHE A 44 16.025 7.124 3.231 1.00 0.00 C ATOM 602 CE2 PHE A 44 16.466 5.271 4.675 1.00 0.00 C ATOM 603 CZ PHE A 44 16.813 6.047 3.587 1.00 0.00 C ATOM 0 H PHE A 44 10.843 7.487 6.577 1.00 0.00 H new ATOM 0 HA PHE A 44 12.108 6.229 4.228 1.00 0.00 H new ATOM 0 HB2 PHE A 44 13.159 8.056 5.863 1.00 0.00 H new ATOM 0 HB3 PHE A 44 13.451 6.663 6.886 1.00 0.00 H new ATOM 0 HD1 PHE A 44 14.278 8.264 3.681 1.00 0.00 H new ATOM 0 HD2 PHE A 44 15.066 4.960 6.253 1.00 0.00 H new ATOM 0 HE1 PHE A 44 16.294 7.733 2.381 1.00 0.00 H new ATOM 0 HE2 PHE A 44 17.081 4.429 4.956 1.00 0.00 H new ATOM 0 HZ PHE A 44 17.699 5.812 3.015 1.00 0.00 H new ATOM 613 N GLY A 45 11.158 4.804 7.001 1.00 0.00 N ATOM 614 CA GLY A 45 10.959 3.516 7.640 1.00 0.00 C ATOM 615 C GLY A 45 10.132 2.570 6.793 1.00 0.00 C ATOM 616 O GLY A 45 10.400 1.369 6.749 1.00 0.00 O ATOM 0 H GLY A 45 10.699 5.588 7.465 1.00 0.00 H new ATOM 0 HA2 GLY A 45 11.929 3.062 7.845 1.00 0.00 H new ATOM 0 HA3 GLY A 45 10.466 3.663 8.601 1.00 0.00 H new ATOM 620 N VAL A 46 9.122 3.111 6.119 1.00 0.00 N ATOM 621 CA VAL A 46 8.252 2.306 5.269 1.00 0.00 C ATOM 622 C VAL A 46 9.039 1.656 4.137 1.00 0.00 C ATOM 623 O VAL A 46 10.059 2.183 3.691 1.00 0.00 O ATOM 624 CB VAL A 46 7.114 3.153 4.669 1.00 0.00 C ATOM 625 CG1 VAL A 46 6.117 3.548 5.747 1.00 0.00 C ATOM 626 CG2 VAL A 46 7.676 4.384 3.974 1.00 0.00 C ATOM 0 H VAL A 46 8.886 4.103 6.145 1.00 0.00 H new ATOM 0 HA VAL A 46 7.822 1.529 5.901 1.00 0.00 H new ATOM 0 HB VAL A 46 6.590 2.552 3.926 1.00 0.00 H new ATOM 0 HG11 VAL A 46 5.320 4.146 5.304 1.00 0.00 H new ATOM 0 HG12 VAL A 46 5.691 2.650 6.195 1.00 0.00 H new ATOM 0 HG13 VAL A 46 6.624 4.131 6.516 1.00 0.00 H new ATOM 0 HG21 VAL A 46 6.858 4.971 3.556 1.00 0.00 H new ATOM 0 HG22 VAL A 46 8.226 4.989 4.695 1.00 0.00 H new ATOM 0 HG23 VAL A 46 8.347 4.075 3.173 1.00 0.00 H new ATOM 636 N THR A 47 8.558 0.506 3.673 1.00 0.00 N ATOM 637 CA THR A 47 9.216 -0.217 2.592 1.00 0.00 C ATOM 638 C THR A 47 9.122 0.551 1.279 1.00 0.00 C ATOM 639 O THR A 47 10.080 0.598 0.507 1.00 0.00 O ATOM 640 CB THR A 47 8.603 -1.617 2.400 1.00 0.00 C ATOM 641 OG1 THR A 47 8.579 -2.318 3.648 1.00 0.00 O ATOM 642 CG2 THR A 47 9.396 -2.419 1.378 1.00 0.00 C ATOM 0 H THR A 47 7.715 0.056 4.029 1.00 0.00 H new ATOM 0 HA THR A 47 10.264 -0.322 2.873 1.00 0.00 H new ATOM 0 HB THR A 47 7.584 -1.495 2.033 1.00 0.00 H new ATOM 0 HG1 THR A 47 8.186 -3.206 3.517 1.00 0.00 H new ATOM 0 HG21 THR A 47 8.945 -3.404 1.259 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.388 -1.898 0.421 1.00 0.00 H new ATOM 0 HG23 THR A 47 10.424 -2.530 1.721 1.00 0.00 H new ATOM 650 N TYR A 48 7.964 1.153 1.033 1.00 0.00 N ATOM 651 CA TYR A 48 7.745 1.919 -0.189 1.00 0.00 C ATOM 652 C TYR A 48 7.454 3.382 0.130 1.00 0.00 C ATOM 653 O TYR A 48 6.388 3.715 0.645 1.00 0.00 O ATOM 654 CB TYR A 48 6.588 1.320 -0.990 1.00 0.00 C ATOM 655 CG TYR A 48 6.926 0.002 -1.649 1.00 0.00 C ATOM 656 CD1 TYR A 48 8.087 -0.146 -2.398 1.00 0.00 C ATOM 657 CD2 TYR A 48 6.084 -1.096 -1.522 1.00 0.00 C ATOM 658 CE1 TYR A 48 8.398 -1.348 -3.002 1.00 0.00 C ATOM 659 CE2 TYR A 48 6.388 -2.303 -2.122 1.00 0.00 C ATOM 660 CZ TYR A 48 7.547 -2.424 -2.861 1.00 0.00 C ATOM 661 OH TYR A 48 7.854 -3.624 -3.461 1.00 0.00 O ATOM 0 H TYR A 48 7.162 1.126 1.663 1.00 0.00 H new ATOM 0 HA TYR A 48 8.655 1.871 -0.786 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.734 1.177 -0.328 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.281 2.032 -1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 48 8.757 0.693 -2.510 1.00 0.00 H new ATOM 0 HD2 TYR A 48 5.176 -1.004 -0.944 1.00 0.00 H new ATOM 0 HE1 TYR A 48 9.304 -1.445 -3.582 1.00 0.00 H new ATOM 0 HE2 TYR A 48 5.722 -3.147 -2.013 1.00 0.00 H new ATOM 0 HH TYR A 48 7.160 -4.283 -3.249 1.00 0.00 H new ATOM 671 N GLN A 49 8.412 4.250 -0.180 1.00 0.00 N ATOM 672 CA GLN A 49 8.259 5.678 0.073 1.00 0.00 C ATOM 673 C GLN A 49 7.806 6.409 -1.187 1.00 0.00 C ATOM 674 O GLN A 49 8.560 6.526 -2.154 1.00 0.00 O ATOM 675 CB GLN A 49 9.576 6.271 0.576 1.00 0.00 C ATOM 676 CG GLN A 49 9.530 7.779 0.768 1.00 0.00 C ATOM 677 CD GLN A 49 10.875 8.358 1.160 1.00 0.00 C ATOM 678 OE1 GLN A 49 11.912 7.969 0.623 1.00 0.00 O ATOM 679 NE2 GLN A 49 10.864 9.296 2.101 1.00 0.00 N ATOM 0 H GLN A 49 9.301 3.990 -0.606 1.00 0.00 H new ATOM 0 HA GLN A 49 7.494 5.806 0.839 1.00 0.00 H new ATOM 0 HB2 GLN A 49 9.839 5.800 1.523 1.00 0.00 H new ATOM 0 HB3 GLN A 49 10.368 6.027 -0.132 1.00 0.00 H new ATOM 0 HG2 GLN A 49 9.191 8.249 -0.155 1.00 0.00 H new ATOM 0 HG3 GLN A 49 8.796 8.021 1.537 1.00 0.00 H new ATOM 0 HE21 GLN A 49 9.981 9.588 2.519 1.00 0.00 H new ATOM 0 HE22 GLN A 49 11.739 9.724 2.405 1.00 0.00 H new ATOM 688 N LEU A 50 6.571 6.898 -1.168 1.00 0.00 N ATOM 689 CA LEU A 50 6.017 7.618 -2.310 1.00 0.00 C ATOM 690 C LEU A 50 6.099 9.126 -2.095 1.00 0.00 C ATOM 691 O LEU A 50 5.609 9.649 -1.094 1.00 0.00 O ATOM 692 CB LEU A 50 4.563 7.203 -2.542 1.00 0.00 C ATOM 693 CG LEU A 50 4.280 5.701 -2.509 1.00 0.00 C ATOM 694 CD1 LEU A 50 2.786 5.441 -2.399 1.00 0.00 C ATOM 695 CD2 LEU A 50 4.852 5.024 -3.746 1.00 0.00 C ATOM 0 H LEU A 50 5.935 6.809 -0.376 1.00 0.00 H new ATOM 0 HA LEU A 50 6.607 7.363 -3.190 1.00 0.00 H new ATOM 0 HB2 LEU A 50 3.943 7.686 -1.786 1.00 0.00 H new ATOM 0 HB3 LEU A 50 4.245 7.591 -3.510 1.00 0.00 H new ATOM 0 HG LEU A 50 4.766 5.278 -1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 50 2.604 4.366 -2.377 1.00 0.00 H new ATOM 0 HD12 LEU A 50 2.405 5.892 -1.483 1.00 0.00 H new ATOM 0 HD13 LEU A 50 2.277 5.877 -3.258 1.00 0.00 H new ATOM 0 HD21 LEU A 50 4.641 3.955 -3.706 1.00 0.00 H new ATOM 0 HD22 LEU A 50 4.395 5.451 -4.639 1.00 0.00 H new ATOM 0 HD23 LEU A 50 5.930 5.180 -3.781 1.00 0.00 H new ATOM 707 N VAL A 51 6.722 9.821 -3.042 1.00 0.00 N ATOM 708 CA VAL A 51 6.866 11.269 -2.958 1.00 0.00 C ATOM 709 C VAL A 51 6.320 11.949 -4.209 1.00 0.00 C ATOM 710 O VAL A 51 6.539 11.483 -5.327 1.00 0.00 O ATOM 711 CB VAL A 51 8.339 11.677 -2.767 1.00 0.00 C ATOM 712 CG1 VAL A 51 8.473 13.191 -2.723 1.00 0.00 C ATOM 713 CG2 VAL A 51 8.906 11.046 -1.504 1.00 0.00 C ATOM 0 H VAL A 51 7.135 9.404 -3.876 1.00 0.00 H new ATOM 0 HA VAL A 51 6.291 11.594 -2.091 1.00 0.00 H new ATOM 0 HB VAL A 51 8.913 11.311 -3.618 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.521 13.460 -2.588 1.00 0.00 H new ATOM 0 HG12 VAL A 51 8.107 13.616 -3.658 1.00 0.00 H new ATOM 0 HG13 VAL A 51 7.887 13.584 -1.892 1.00 0.00 H new ATOM 0 HG21 VAL A 51 9.947 11.344 -1.384 1.00 0.00 H new ATOM 0 HG22 VAL A 51 8.331 11.380 -0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 51 8.846 9.960 -1.581 1.00 0.00 H new ATOM 723 N SER A 52 5.608 13.054 -4.012 1.00 0.00 N ATOM 724 CA SER A 52 5.027 13.797 -5.124 1.00 0.00 C ATOM 725 C SER A 52 5.505 15.246 -5.117 1.00 0.00 C ATOM 726 O SER A 52 6.224 15.671 -4.213 1.00 0.00 O ATOM 727 CB SER A 52 3.500 13.751 -5.053 1.00 0.00 C ATOM 728 OG SER A 52 2.919 14.267 -6.238 1.00 0.00 O ATOM 0 H SER A 52 5.420 13.454 -3.093 1.00 0.00 H new ATOM 0 HA SER A 52 5.354 13.329 -6.052 1.00 0.00 H new ATOM 0 HB2 SER A 52 3.171 12.723 -4.900 1.00 0.00 H new ATOM 0 HB3 SER A 52 3.155 14.327 -4.194 1.00 0.00 H new ATOM 0 HG SER A 52 2.142 13.724 -6.485 1.00 0.00 H new ATOM 734 N LYS A 53 5.099 16.001 -6.132 1.00 0.00 N ATOM 735 CA LYS A 53 5.482 17.403 -6.245 1.00 0.00 C ATOM 736 C LYS A 53 4.267 18.313 -6.094 1.00 0.00 C ATOM 737 O LYS A 53 4.395 19.474 -5.704 1.00 0.00 O ATOM 738 CB LYS A 53 6.161 17.661 -7.593 1.00 0.00 C ATOM 739 CG LYS A 53 7.435 16.859 -7.795 1.00 0.00 C ATOM 740 CD LYS A 53 8.417 17.076 -6.656 1.00 0.00 C ATOM 741 CE LYS A 53 9.843 16.761 -7.082 1.00 0.00 C ATOM 742 NZ LYS A 53 9.948 15.420 -7.720 1.00 0.00 N ATOM 0 H LYS A 53 4.504 15.665 -6.889 1.00 0.00 H new ATOM 0 HA LYS A 53 6.184 17.627 -5.442 1.00 0.00 H new ATOM 0 HB2 LYS A 53 5.461 17.424 -8.394 1.00 0.00 H new ATOM 0 HB3 LYS A 53 6.393 18.723 -7.676 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.191 15.799 -7.869 1.00 0.00 H new ATOM 0 HG3 LYS A 53 7.901 17.146 -8.738 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.358 18.110 -6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.141 16.445 -5.811 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.190 17.523 -7.780 1.00 0.00 H new ATOM 0 HE3 LYS A 53 10.499 16.802 -6.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.950 15.171 -7.842 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 9.486 14.711 -7.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.481 15.440 -8.649 1.00 0.00 H new ATOM 756 N ILE A 54 3.091 17.778 -6.403 1.00 0.00 N ATOM 757 CA ILE A 54 1.854 18.542 -6.298 1.00 0.00 C ATOM 758 C ILE A 54 1.329 18.545 -4.866 1.00 0.00 C ATOM 759 O ILE A 54 1.102 19.604 -4.280 1.00 0.00 O ATOM 760 CB ILE A 54 0.765 17.981 -7.231 1.00 0.00 C ATOM 761 CG1 ILE A 54 1.262 17.962 -8.678 1.00 0.00 C ATOM 762 CG2 ILE A 54 -0.509 18.804 -7.113 1.00 0.00 C ATOM 763 CD1 ILE A 54 1.996 16.692 -9.049 1.00 0.00 C ATOM 0 H ILE A 54 2.969 16.819 -6.728 1.00 0.00 H new ATOM 0 HA ILE A 54 2.088 19.563 -6.599 1.00 0.00 H new ATOM 0 HB ILE A 54 0.542 16.957 -6.930 1.00 0.00 H new ATOM 0 HG12 ILE A 54 0.411 18.089 -9.347 1.00 0.00 H new ATOM 0 HG13 ILE A 54 1.923 18.814 -8.838 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -1.269 18.395 -7.779 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -0.870 18.770 -6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -0.302 19.837 -7.391 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.319 16.749 -10.088 1.00 0.00 H new ATOM 0 HD12 ILE A 54 2.867 16.573 -8.404 1.00 0.00 H new ATOM 0 HD13 ILE A 54 1.332 15.837 -8.922 1.00 0.00 H new ATOM 775 N CYS A 55 1.141 17.355 -4.309 1.00 0.00 N ATOM 776 CA CYS A 55 0.644 17.219 -2.944 1.00 0.00 C ATOM 777 C CYS A 55 1.254 16.000 -2.262 1.00 0.00 C ATOM 778 O CYS A 55 0.596 14.980 -2.054 1.00 0.00 O ATOM 779 CB CYS A 55 -0.882 17.109 -2.944 1.00 0.00 C ATOM 780 SG CYS A 55 -1.730 18.602 -3.513 1.00 0.00 S ATOM 0 H CYS A 55 1.325 16.470 -4.781 1.00 0.00 H new ATOM 0 HA CYS A 55 0.937 18.108 -2.386 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -1.175 16.273 -3.579 1.00 0.00 H new ATOM 0 HB3 CYS A 55 -1.219 16.875 -1.934 1.00 0.00 H new ATOM 0 HG CYS A 55 -0.852 19.477 -3.906 1.00 0.00 H new ATOM 786 N PRO A 56 2.543 16.103 -1.906 1.00 0.00 N ATOM 787 CA PRO A 56 3.271 15.018 -1.242 1.00 0.00 C ATOM 788 C PRO A 56 2.792 14.788 0.187 1.00 0.00 C ATOM 789 O PRO A 56 2.989 13.712 0.753 1.00 0.00 O ATOM 790 CB PRO A 56 4.721 15.507 -1.249 1.00 0.00 C ATOM 791 CG PRO A 56 4.619 16.992 -1.311 1.00 0.00 C ATOM 792 CD PRO A 56 3.388 17.289 -2.122 1.00 0.00 C ATOM 0 HA PRO A 56 3.127 14.062 -1.746 1.00 0.00 H new ATOM 0 HB2 PRO A 56 5.252 15.184 -0.354 1.00 0.00 H new ATOM 0 HB3 PRO A 56 5.268 15.112 -2.105 1.00 0.00 H new ATOM 0 HG2 PRO A 56 4.540 17.420 -0.312 1.00 0.00 H new ATOM 0 HG3 PRO A 56 5.505 17.425 -1.774 1.00 0.00 H new ATOM 0 HD2 PRO A 56 2.895 18.201 -1.785 1.00 0.00 H new ATOM 0 HD3 PRO A 56 3.625 17.427 -3.177 1.00 0.00 H new ATOM 800 N LEU A 57 2.163 15.805 0.766 1.00 0.00 N ATOM 801 CA LEU A 57 1.656 15.713 2.131 1.00 0.00 C ATOM 802 C LEU A 57 0.427 14.812 2.196 1.00 0.00 C ATOM 803 O LEU A 57 0.072 14.305 3.260 1.00 0.00 O ATOM 804 CB LEU A 57 1.310 17.105 2.662 1.00 0.00 C ATOM 805 CG LEU A 57 2.388 18.176 2.489 1.00 0.00 C ATOM 806 CD1 LEU A 57 1.776 19.566 2.565 1.00 0.00 C ATOM 807 CD2 LEU A 57 3.476 18.013 3.539 1.00 0.00 C ATOM 0 H LEU A 57 1.992 16.702 0.312 1.00 0.00 H new ATOM 0 HA LEU A 57 2.437 15.277 2.754 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.403 17.447 2.164 1.00 0.00 H new ATOM 0 HB3 LEU A 57 1.078 17.020 3.724 1.00 0.00 H new ATOM 0 HG LEU A 57 2.840 18.053 1.505 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.558 20.315 2.440 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.034 19.681 1.775 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.297 19.700 3.535 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.234 18.784 3.400 1.00 0.00 H new ATOM 0 HD22 LEU A 57 3.039 18.108 4.533 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.935 17.030 3.437 1.00 0.00 H new ATOM 819 N MET A 58 -0.218 14.616 1.050 1.00 0.00 N ATOM 820 CA MET A 58 -1.406 13.773 0.977 1.00 0.00 C ATOM 821 C MET A 58 -1.144 12.409 1.607 1.00 0.00 C ATOM 822 O MET A 58 -1.944 11.921 2.406 1.00 0.00 O ATOM 823 CB MET A 58 -1.845 13.600 -0.478 1.00 0.00 C ATOM 824 CG MET A 58 -3.187 12.902 -0.629 1.00 0.00 C ATOM 825 SD MET A 58 -4.052 13.378 -2.138 1.00 0.00 S ATOM 826 CE MET A 58 -4.678 14.992 -1.675 1.00 0.00 C ATOM 0 H MET A 58 0.062 15.029 0.160 1.00 0.00 H new ATOM 0 HA MET A 58 -2.204 14.263 1.534 1.00 0.00 H new ATOM 0 HB2 MET A 58 -1.899 14.580 -0.952 1.00 0.00 H new ATOM 0 HB3 MET A 58 -1.086 13.029 -1.013 1.00 0.00 H new ATOM 0 HG2 MET A 58 -3.033 11.823 -0.628 1.00 0.00 H new ATOM 0 HG3 MET A 58 -3.812 13.135 0.233 1.00 0.00 H new ATOM 0 HE1 MET A 58 -5.619 15.179 -2.192 1.00 0.00 H new ATOM 0 HE2 MET A 58 -4.843 15.023 -0.598 1.00 0.00 H new ATOM 0 HE3 MET A 58 -3.953 15.757 -1.953 1.00 0.00 H new ATOM 836 N ILE A 59 -0.021 11.800 1.243 1.00 0.00 N ATOM 837 CA ILE A 59 0.345 10.493 1.774 1.00 0.00 C ATOM 838 C ILE A 59 0.974 10.618 3.158 1.00 0.00 C ATOM 839 O ILE A 59 1.849 11.455 3.380 1.00 0.00 O ATOM 840 CB ILE A 59 1.327 9.761 0.841 1.00 0.00 C ATOM 841 CG1 ILE A 59 0.720 9.609 -0.555 1.00 0.00 C ATOM 842 CG2 ILE A 59 1.691 8.400 1.417 1.00 0.00 C ATOM 843 CD1 ILE A 59 -0.601 8.871 -0.563 1.00 0.00 C ATOM 0 H ILE A 59 0.651 12.191 0.583 1.00 0.00 H new ATOM 0 HA ILE A 59 -0.575 9.913 1.847 1.00 0.00 H new ATOM 0 HB ILE A 59 2.238 10.354 0.759 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.577 10.598 -0.990 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.427 9.079 -1.194 1.00 0.00 H new ATOM 0 HG21 ILE A 59 2.386 7.895 0.746 1.00 0.00 H new ATOM 0 HG22 ILE A 59 2.159 8.531 2.393 1.00 0.00 H new ATOM 0 HG23 ILE A 59 0.789 7.798 1.526 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -0.972 8.801 -1.585 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -0.460 7.869 -0.158 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -1.323 9.411 0.049 1.00 0.00 H new ATOM 855 N SER A 60 0.524 9.779 4.085 1.00 0.00 N ATOM 856 CA SER A 60 1.041 9.797 5.448 1.00 0.00 C ATOM 857 C SER A 60 1.864 8.544 5.734 1.00 0.00 C ATOM 858 O SER A 60 1.701 7.517 5.074 1.00 0.00 O ATOM 859 CB SER A 60 -0.109 9.905 6.451 1.00 0.00 C ATOM 860 OG SER A 60 0.209 10.808 7.497 1.00 0.00 O ATOM 0 H SER A 60 -0.198 9.078 3.917 1.00 0.00 H new ATOM 0 HA SER A 60 1.688 10.668 5.553 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.012 10.239 5.939 1.00 0.00 H new ATOM 0 HB3 SER A 60 -0.325 8.922 6.868 1.00 0.00 H new ATOM 0 HG SER A 60 -0.543 10.861 8.124 1.00 0.00 H new ATOM 866 N ARG A 61 2.749 8.637 6.721 1.00 0.00 N ATOM 867 CA ARG A 61 3.599 7.513 7.093 1.00 0.00 C ATOM 868 C ARG A 61 2.763 6.264 7.359 1.00 0.00 C ATOM 869 O ARG A 61 1.801 6.301 8.124 1.00 0.00 O ATOM 870 CB ARG A 61 4.426 7.860 8.333 1.00 0.00 C ATOM 871 CG ARG A 61 5.312 9.081 8.152 1.00 0.00 C ATOM 872 CD ARG A 61 6.221 9.293 9.352 1.00 0.00 C ATOM 873 NE ARG A 61 7.486 9.919 8.978 1.00 0.00 N ATOM 874 CZ ARG A 61 8.574 9.892 9.740 1.00 0.00 C ATOM 875 NH1 ARG A 61 8.551 9.272 10.911 1.00 0.00 N ATOM 876 NH2 ARG A 61 9.688 10.485 9.330 1.00 0.00 N ATOM 0 H ARG A 61 2.896 9.479 7.277 1.00 0.00 H new ATOM 0 HA ARG A 61 4.273 7.308 6.261 1.00 0.00 H new ATOM 0 HB2 ARG A 61 3.752 8.032 9.172 1.00 0.00 H new ATOM 0 HB3 ARG A 61 5.049 7.005 8.595 1.00 0.00 H new ATOM 0 HG2 ARG A 61 5.917 8.963 7.253 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.690 9.964 8.005 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.712 9.917 10.087 1.00 0.00 H new ATOM 0 HD3 ARG A 61 6.419 8.334 9.830 1.00 0.00 H new ATOM 0 HE ARG A 61 7.537 10.404 8.082 1.00 0.00 H new ATOM 0 HH11 ARG A 61 7.697 8.814 11.229 1.00 0.00 H new ATOM 0 HH12 ARG A 61 9.388 9.253 11.494 1.00 0.00 H new ATOM 0 HH21 ARG A 61 9.710 10.962 8.429 1.00 0.00 H new ATOM 0 HH22 ARG A 61 10.523 10.464 9.916 1.00 0.00 H new ATOM 890 N ASN A 62 3.139 5.160 6.721 1.00 0.00 N ATOM 891 CA ASN A 62 2.423 3.901 6.888 1.00 0.00 C ATOM 892 C ASN A 62 0.954 4.055 6.508 1.00 0.00 C ATOM 893 O ASN A 62 0.063 3.618 7.238 1.00 0.00 O ATOM 894 CB ASN A 62 2.540 3.411 8.333 1.00 0.00 C ATOM 895 CG ASN A 62 3.953 3.524 8.869 1.00 0.00 C ATOM 896 OD1 ASN A 62 4.399 4.606 9.252 1.00 0.00 O ATOM 897 ND2 ASN A 62 4.666 2.404 8.899 1.00 0.00 N ATOM 0 H ASN A 62 3.935 5.112 6.084 1.00 0.00 H new ATOM 0 HA ASN A 62 2.875 3.164 6.224 1.00 0.00 H new ATOM 0 HB2 ASN A 62 1.867 3.990 8.966 1.00 0.00 H new ATOM 0 HB3 ASN A 62 2.215 2.372 8.389 1.00 0.00 H new ATOM 0 HD21 ASN A 62 5.624 2.418 9.250 1.00 0.00 H new ATOM 0 HD22 ASN A 62 4.256 1.529 8.571 1.00 0.00 H new ATOM 904 N HIS A 63 0.707 4.680 5.361 1.00 0.00 N ATOM 905 CA HIS A 63 -0.654 4.891 4.883 1.00 0.00 C ATOM 906 C HIS A 63 -1.438 3.582 4.879 1.00 0.00 C ATOM 907 O HIS A 63 -2.656 3.576 5.063 1.00 0.00 O ATOM 908 CB HIS A 63 -0.637 5.493 3.477 1.00 0.00 C ATOM 909 CG HIS A 63 -1.877 6.261 3.138 1.00 0.00 C ATOM 910 ND1 HIS A 63 -1.902 7.634 3.013 1.00 0.00 N ATOM 911 CD2 HIS A 63 -3.140 5.840 2.896 1.00 0.00 C ATOM 912 CE1 HIS A 63 -3.127 8.024 2.711 1.00 0.00 C ATOM 913 NE2 HIS A 63 -3.898 6.955 2.634 1.00 0.00 N ATOM 0 H HIS A 63 1.432 5.049 4.746 1.00 0.00 H new ATOM 0 HA HIS A 63 -1.146 5.587 5.562 1.00 0.00 H new ATOM 0 HB2 HIS A 63 0.226 6.153 3.384 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -0.506 4.692 2.750 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -3.487 4.817 2.907 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -3.444 9.044 2.554 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -4.894 6.957 2.416 1.00 0.00 H new ATOM 921 N CYS A 64 -0.733 2.477 4.667 1.00 0.00 N ATOM 922 CA CYS A 64 -1.363 1.162 4.637 1.00 0.00 C ATOM 923 C CYS A 64 -0.317 0.055 4.728 1.00 0.00 C ATOM 924 O CYS A 64 0.867 0.284 4.479 1.00 0.00 O ATOM 925 CB CYS A 64 -2.188 0.997 3.360 1.00 0.00 C ATOM 926 SG CYS A 64 -1.196 0.827 1.858 1.00 0.00 S ATOM 0 H CYS A 64 0.275 2.465 4.513 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.024 1.084 5.500 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.826 0.119 3.463 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -2.847 1.859 3.252 1.00 0.00 H new ATOM 0 HG CYS A 64 -1.964 0.481 0.868 1.00 0.00 H new ATOM 932 N VAL A 65 -0.762 -1.144 5.088 1.00 0.00 N ATOM 933 CA VAL A 65 0.135 -2.287 5.212 1.00 0.00 C ATOM 934 C VAL A 65 -0.473 -3.534 4.581 1.00 0.00 C ATOM 935 O VAL A 65 -1.621 -3.886 4.855 1.00 0.00 O ATOM 936 CB VAL A 65 0.467 -2.581 6.687 1.00 0.00 C ATOM 937 CG1 VAL A 65 1.455 -3.733 6.792 1.00 0.00 C ATOM 938 CG2 VAL A 65 1.014 -1.336 7.369 1.00 0.00 C ATOM 0 H VAL A 65 -1.739 -1.350 5.299 1.00 0.00 H new ATOM 0 HA VAL A 65 1.053 -2.028 4.685 1.00 0.00 H new ATOM 0 HB VAL A 65 -0.451 -2.873 7.197 1.00 0.00 H new ATOM 0 HG11 VAL A 65 1.678 -3.927 7.841 1.00 0.00 H new ATOM 0 HG12 VAL A 65 1.021 -4.626 6.342 1.00 0.00 H new ATOM 0 HG13 VAL A 65 2.375 -3.473 6.268 1.00 0.00 H new ATOM 0 HG21 VAL A 65 1.243 -1.562 8.410 1.00 0.00 H new ATOM 0 HG22 VAL A 65 1.922 -1.011 6.860 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.270 -0.541 7.326 1.00 0.00 H new ATOM 948 N LEU A 66 0.305 -4.201 3.734 1.00 0.00 N ATOM 949 CA LEU A 66 -0.156 -5.411 3.063 1.00 0.00 C ATOM 950 C LEU A 66 0.552 -6.644 3.616 1.00 0.00 C ATOM 951 O LEU A 66 1.759 -6.623 3.859 1.00 0.00 O ATOM 952 CB LEU A 66 0.083 -5.305 1.556 1.00 0.00 C ATOM 953 CG LEU A 66 -0.978 -4.543 0.760 1.00 0.00 C ATOM 954 CD1 LEU A 66 -0.428 -3.210 0.278 1.00 0.00 C ATOM 955 CD2 LEU A 66 -1.464 -5.378 -0.415 1.00 0.00 C ATOM 0 H LEU A 66 1.257 -3.924 3.496 1.00 0.00 H new ATOM 0 HA LEU A 66 -1.225 -5.515 3.249 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.047 -4.822 1.394 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.160 -6.313 1.149 1.00 0.00 H new ATOM 0 HG LEU A 66 -1.826 -4.347 1.416 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.197 -2.682 -0.286 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.130 -2.608 1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 66 0.437 -3.383 -0.362 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.218 -4.821 -0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.624 -5.605 -1.072 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.898 -6.307 -0.046 1.00 0.00 H new ATOM 967 N LYS A 67 -0.206 -7.717 3.812 1.00 0.00 N ATOM 968 CA LYS A 67 0.349 -8.961 4.332 1.00 0.00 C ATOM 969 C LYS A 67 -0.573 -10.138 4.026 1.00 0.00 C ATOM 970 O LYS A 67 -1.763 -9.955 3.772 1.00 0.00 O ATOM 971 CB LYS A 67 0.570 -8.852 5.843 1.00 0.00 C ATOM 972 CG LYS A 67 -0.634 -8.312 6.596 1.00 0.00 C ATOM 973 CD LYS A 67 -0.487 -6.829 6.891 1.00 0.00 C ATOM 974 CE LYS A 67 -0.669 -6.535 8.372 1.00 0.00 C ATOM 975 NZ LYS A 67 -2.108 -6.466 8.751 1.00 0.00 N ATOM 0 H LYS A 67 -1.207 -7.750 3.619 1.00 0.00 H new ATOM 0 HA LYS A 67 1.307 -9.136 3.842 1.00 0.00 H new ATOM 0 HB2 LYS A 67 0.823 -9.836 6.237 1.00 0.00 H new ATOM 0 HB3 LYS A 67 1.426 -8.204 6.031 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -1.537 -8.479 6.009 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -0.756 -8.860 7.531 1.00 0.00 H new ATOM 0 HD2 LYS A 67 0.497 -6.489 6.570 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -1.222 -6.268 6.314 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -0.175 -7.309 8.959 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -0.183 -5.591 8.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -2.336 -5.504 9.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -2.696 -6.703 7.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -2.298 -7.143 9.517 1.00 0.00 H new ATOM 989 N GLN A 68 -0.014 -11.344 4.054 1.00 0.00 N ATOM 990 CA GLN A 68 -0.788 -12.549 3.780 1.00 0.00 C ATOM 991 C GLN A 68 -1.254 -13.203 5.077 1.00 0.00 C ATOM 992 O GLN A 68 -0.445 -13.706 5.855 1.00 0.00 O ATOM 993 CB GLN A 68 0.045 -13.541 2.966 1.00 0.00 C ATOM 994 CG GLN A 68 0.415 -13.032 1.582 1.00 0.00 C ATOM 995 CD GLN A 68 1.120 -14.080 0.744 1.00 0.00 C ATOM 996 OE1 GLN A 68 2.191 -14.567 1.110 1.00 0.00 O ATOM 997 NE2 GLN A 68 0.523 -14.434 -0.388 1.00 0.00 N ATOM 0 H GLN A 68 0.970 -11.512 4.263 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.667 -12.263 3.202 1.00 0.00 H new ATOM 0 HB2 GLN A 68 0.958 -13.773 3.515 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -0.511 -14.473 2.865 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.488 -12.706 1.065 1.00 0.00 H new ATOM 0 HG3 GLN A 68 1.059 -12.158 1.681 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -0.364 -14.005 -0.653 1.00 0.00 H new ATOM 0 HE22 GLN A 68 0.951 -15.135 -0.993 1.00 0.00 H new ATOM 1006 N ASN A 69 -2.564 -13.192 5.301 1.00 0.00 N ATOM 1007 CA ASN A 69 -3.138 -13.783 6.504 1.00 0.00 C ATOM 1008 C ASN A 69 -2.640 -15.212 6.699 1.00 0.00 C ATOM 1009 O ASN A 69 -2.156 -15.859 5.770 1.00 0.00 O ATOM 1010 CB ASN A 69 -4.666 -13.770 6.425 1.00 0.00 C ATOM 1011 CG ASN A 69 -5.182 -14.319 5.109 1.00 0.00 C ATOM 1012 OD1 ASN A 69 -4.679 -15.322 4.603 1.00 0.00 O ATOM 1013 ND2 ASN A 69 -6.190 -13.661 4.549 1.00 0.00 N ATOM 0 H ASN A 69 -3.248 -12.781 4.666 1.00 0.00 H new ATOM 0 HA ASN A 69 -2.820 -13.186 7.359 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -5.074 -14.359 7.246 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -5.025 -12.749 6.555 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -6.579 -13.983 3.663 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -6.575 -12.834 5.005 1.00 0.00 H new ATOM 1020 N PRO A 70 -2.762 -15.718 7.935 1.00 0.00 N ATOM 1021 CA PRO A 70 -2.332 -17.076 8.281 1.00 0.00 C ATOM 1022 C PRO A 70 -2.848 -18.117 7.293 1.00 0.00 C ATOM 1023 O PRO A 70 -2.232 -19.165 7.104 1.00 0.00 O ATOM 1024 CB PRO A 70 -2.946 -17.302 9.664 1.00 0.00 C ATOM 1025 CG PRO A 70 -3.074 -15.938 10.249 1.00 0.00 C ATOM 1026 CD PRO A 70 -3.330 -15.004 9.091 1.00 0.00 C ATOM 0 HA PRO A 70 -1.247 -17.177 8.260 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -3.916 -17.794 9.591 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.311 -17.939 10.280 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -3.892 -15.899 10.969 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -2.166 -15.657 10.782 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -4.395 -14.812 8.959 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -2.848 -14.038 9.241 1.00 0.00 H new ATOM 1034 N GLU A 71 -3.982 -17.820 6.665 1.00 0.00 N ATOM 1035 CA GLU A 71 -4.580 -18.731 5.697 1.00 0.00 C ATOM 1036 C GLU A 71 -3.700 -18.861 4.457 1.00 0.00 C ATOM 1037 O GLU A 71 -3.542 -19.950 3.906 1.00 0.00 O ATOM 1038 CB GLU A 71 -5.974 -18.243 5.297 1.00 0.00 C ATOM 1039 CG GLU A 71 -6.858 -17.890 6.482 1.00 0.00 C ATOM 1040 CD GLU A 71 -8.332 -18.086 6.188 1.00 0.00 C ATOM 1041 OE1 GLU A 71 -8.679 -19.086 5.527 1.00 0.00 O ATOM 1042 OE2 GLU A 71 -9.140 -17.237 6.620 1.00 0.00 O ATOM 0 H GLU A 71 -4.504 -16.956 6.810 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.667 -19.712 6.165 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.873 -17.367 4.656 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -6.465 -19.016 4.706 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -6.577 -18.505 7.337 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -6.683 -16.852 6.765 1.00 0.00 H new ATOM 1049 N GLY A 72 -3.130 -17.741 4.022 1.00 0.00 N ATOM 1050 CA GLY A 72 -2.274 -17.751 2.850 1.00 0.00 C ATOM 1051 C GLY A 72 -2.782 -16.836 1.754 1.00 0.00 C ATOM 1052 O GLY A 72 -2.402 -16.979 0.592 1.00 0.00 O ATOM 0 H GLY A 72 -3.246 -16.827 4.460 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -1.267 -17.446 3.136 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -2.202 -18.768 2.465 1.00 0.00 H new ATOM 1056 N GLN A 73 -3.644 -15.894 2.123 1.00 0.00 N ATOM 1057 CA GLN A 73 -4.207 -14.954 1.161 1.00 0.00 C ATOM 1058 C GLN A 73 -3.830 -13.520 1.517 1.00 0.00 C ATOM 1059 O GLN A 73 -3.753 -13.162 2.692 1.00 0.00 O ATOM 1060 CB GLN A 73 -5.729 -15.096 1.108 1.00 0.00 C ATOM 1061 CG GLN A 73 -6.412 -14.014 0.287 1.00 0.00 C ATOM 1062 CD GLN A 73 -5.996 -14.037 -1.171 1.00 0.00 C ATOM 1063 OE1 GLN A 73 -5.747 -15.100 -1.741 1.00 0.00 O ATOM 1064 NE2 GLN A 73 -5.918 -12.862 -1.783 1.00 0.00 N ATOM 0 H GLN A 73 -3.968 -15.762 3.081 1.00 0.00 H new ATOM 0 HA GLN A 73 -3.793 -15.186 0.180 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -5.980 -16.071 0.690 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -6.123 -15.073 2.124 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -7.493 -14.140 0.354 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -6.178 -13.038 0.712 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.133 -12.006 -1.272 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -5.643 -12.815 -2.764 1.00 0.00 H new ATOM 1073 N TRP A 74 -3.595 -12.704 0.495 1.00 0.00 N ATOM 1074 CA TRP A 74 -3.225 -11.309 0.701 1.00 0.00 C ATOM 1075 C TRP A 74 -4.395 -10.514 1.269 1.00 0.00 C ATOM 1076 O TRP A 74 -5.553 -10.771 0.938 1.00 0.00 O ATOM 1077 CB TRP A 74 -2.759 -10.684 -0.615 1.00 0.00 C ATOM 1078 CG TRP A 74 -1.342 -11.026 -0.966 1.00 0.00 C ATOM 1079 CD1 TRP A 74 -0.924 -11.870 -1.954 1.00 0.00 C ATOM 1080 CD2 TRP A 74 -0.159 -10.533 -0.329 1.00 0.00 C ATOM 1081 NE1 TRP A 74 0.449 -11.932 -1.970 1.00 0.00 N ATOM 1082 CE2 TRP A 74 0.942 -11.120 -0.984 1.00 0.00 C ATOM 1083 CE3 TRP A 74 0.079 -9.651 0.729 1.00 0.00 C ATOM 1084 CZ2 TRP A 74 2.257 -10.853 -0.613 1.00 0.00 C ATOM 1085 CZ3 TRP A 74 1.385 -9.388 1.096 1.00 0.00 C ATOM 1086 CH2 TRP A 74 2.460 -9.986 0.426 1.00 0.00 C ATOM 0 H TRP A 74 -3.654 -12.985 -0.484 1.00 0.00 H new ATOM 0 HA TRP A 74 -2.406 -11.278 1.420 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -3.415 -11.016 -1.419 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -2.858 -9.600 -0.550 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -1.576 -12.410 -2.625 1.00 0.00 H new ATOM 0 HE1 TRP A 74 1.010 -12.492 -2.612 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -0.743 -9.183 1.250 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 3.088 -11.314 -1.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 1.580 -8.710 1.913 1.00 0.00 H new ATOM 0 HH2 TRP A 74 3.469 -9.758 0.736 1.00 0.00 H new ATOM 1097 N THR A 75 -4.087 -9.545 2.127 1.00 0.00 N ATOM 1098 CA THR A 75 -5.114 -8.713 2.741 1.00 0.00 C ATOM 1099 C THR A 75 -4.575 -7.325 3.067 1.00 0.00 C ATOM 1100 O THR A 75 -3.588 -7.187 3.790 1.00 0.00 O ATOM 1101 CB THR A 75 -5.660 -9.355 4.031 1.00 0.00 C ATOM 1102 OG1 THR A 75 -4.592 -9.571 4.960 1.00 0.00 O ATOM 1103 CG2 THR A 75 -6.350 -10.677 3.727 1.00 0.00 C ATOM 0 H THR A 75 -3.134 -9.318 2.412 1.00 0.00 H new ATOM 0 HA THR A 75 -5.924 -8.625 2.017 1.00 0.00 H new ATOM 0 HB THR A 75 -6.390 -8.675 4.469 1.00 0.00 H new ATOM 0 HG1 THR A 75 -3.927 -8.857 4.866 1.00 0.00 H new ATOM 0 HG21 THR A 75 -6.727 -11.112 4.653 1.00 0.00 H new ATOM 0 HG22 THR A 75 -7.180 -10.505 3.042 1.00 0.00 H new ATOM 0 HG23 THR A 75 -5.637 -11.362 3.268 1.00 0.00 H new ATOM 1111 N ILE A 76 -5.228 -6.301 2.530 1.00 0.00 N ATOM 1112 CA ILE A 76 -4.815 -4.923 2.765 1.00 0.00 C ATOM 1113 C ILE A 76 -5.399 -4.389 4.069 1.00 0.00 C ATOM 1114 O ILE A 76 -6.588 -4.551 4.340 1.00 0.00 O ATOM 1115 CB ILE A 76 -5.242 -4.001 1.608 1.00 0.00 C ATOM 1116 CG1 ILE A 76 -4.767 -2.570 1.866 1.00 0.00 C ATOM 1117 CG2 ILE A 76 -6.752 -4.040 1.430 1.00 0.00 C ATOM 1118 CD1 ILE A 76 -4.859 -1.675 0.650 1.00 0.00 C ATOM 0 H ILE A 76 -6.046 -6.399 1.929 1.00 0.00 H new ATOM 0 HA ILE A 76 -3.727 -4.927 2.832 1.00 0.00 H new ATOM 0 HB ILE A 76 -4.778 -4.357 0.688 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -5.361 -2.138 2.671 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.733 -2.595 2.211 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -7.039 -3.383 0.609 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -7.066 -5.060 1.206 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -7.235 -3.705 2.348 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -4.506 -0.676 0.906 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -4.242 -2.084 -0.150 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -5.895 -1.619 0.317 1.00 0.00 H new ATOM 1130 N MET A 77 -4.555 -3.750 4.871 1.00 0.00 N ATOM 1131 CA MET A 77 -4.989 -3.189 6.146 1.00 0.00 C ATOM 1132 C MET A 77 -4.431 -1.782 6.338 1.00 0.00 C ATOM 1133 O MET A 77 -3.220 -1.594 6.453 1.00 0.00 O ATOM 1134 CB MET A 77 -4.545 -4.088 7.301 1.00 0.00 C ATOM 1135 CG MET A 77 -4.991 -3.588 8.666 1.00 0.00 C ATOM 1136 SD MET A 77 -3.711 -3.767 9.923 1.00 0.00 S ATOM 1137 CE MET A 77 -2.728 -2.301 9.615 1.00 0.00 C ATOM 0 H MET A 77 -3.567 -3.607 4.662 1.00 0.00 H new ATOM 0 HA MET A 77 -6.077 -3.132 6.138 1.00 0.00 H new ATOM 0 HB2 MET A 77 -4.941 -5.091 7.143 1.00 0.00 H new ATOM 0 HB3 MET A 77 -3.458 -4.169 7.290 1.00 0.00 H new ATOM 0 HG2 MET A 77 -5.275 -2.539 8.589 1.00 0.00 H new ATOM 0 HG3 MET A 77 -5.880 -4.137 8.977 1.00 0.00 H new ATOM 0 HE1 MET A 77 -2.040 -2.143 10.446 1.00 0.00 H new ATOM 0 HE2 MET A 77 -2.160 -2.431 8.694 1.00 0.00 H new ATOM 0 HE3 MET A 77 -3.385 -1.436 9.518 1.00 0.00 H new ATOM 1147 N ASP A 78 -5.322 -0.797 6.371 1.00 0.00 N ATOM 1148 CA ASP A 78 -4.919 0.593 6.550 1.00 0.00 C ATOM 1149 C ASP A 78 -4.460 0.846 7.983 1.00 0.00 C ATOM 1150 O ASP A 78 -5.219 0.650 8.931 1.00 0.00 O ATOM 1151 CB ASP A 78 -6.075 1.531 6.199 1.00 0.00 C ATOM 1152 CG ASP A 78 -5.748 2.984 6.481 1.00 0.00 C ATOM 1153 OD1 ASP A 78 -6.012 3.444 7.612 1.00 0.00 O ATOM 1154 OD2 ASP A 78 -5.226 3.662 5.571 1.00 0.00 O ATOM 0 H ASP A 78 -6.328 -0.935 6.276 1.00 0.00 H new ATOM 0 HA ASP A 78 -4.083 0.792 5.879 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.325 1.416 5.144 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -6.958 1.243 6.769 1.00 0.00 H new ATOM 1159 N ASN A 79 -3.213 1.280 8.131 1.00 0.00 N ATOM 1160 CA ASN A 79 -2.652 1.558 9.449 1.00 0.00 C ATOM 1161 C ASN A 79 -3.126 2.912 9.967 1.00 0.00 C ATOM 1162 O ASN A 79 -2.319 3.799 10.247 1.00 0.00 O ATOM 1163 CB ASN A 79 -1.123 1.527 9.392 1.00 0.00 C ATOM 1164 CG ASN A 79 -0.502 1.166 10.727 1.00 0.00 C ATOM 1165 OD1 ASN A 79 -1.133 1.305 11.776 1.00 0.00 O ATOM 1166 ND2 ASN A 79 0.741 0.701 10.695 1.00 0.00 N ATOM 0 H ASN A 79 -2.572 1.447 7.356 1.00 0.00 H new ATOM 0 HA ASN A 79 -2.999 0.785 10.135 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.805 0.806 8.639 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -0.754 2.502 9.075 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.211 0.442 11.562 1.00 0.00 H new ATOM 0 HD22 ASN A 79 1.226 0.602 9.803 1.00 0.00 H new ATOM 1173 N LYS A 80 -4.440 3.064 10.094 1.00 0.00 N ATOM 1174 CA LYS A 80 -5.023 4.309 10.580 1.00 0.00 C ATOM 1175 C LYS A 80 -4.481 5.504 9.803 1.00 0.00 C ATOM 1176 O LYS A 80 -3.505 6.132 10.212 1.00 0.00 O ATOM 1177 CB LYS A 80 -4.732 4.483 12.073 1.00 0.00 C ATOM 1178 CG LYS A 80 -5.771 3.840 12.974 1.00 0.00 C ATOM 1179 CD LYS A 80 -5.134 3.226 14.210 1.00 0.00 C ATOM 1180 CE LYS A 80 -5.406 4.063 15.451 1.00 0.00 C ATOM 1181 NZ LYS A 80 -5.017 5.487 15.256 1.00 0.00 N ATOM 0 H LYS A 80 -5.122 2.340 9.867 1.00 0.00 H new ATOM 0 HA LYS A 80 -6.101 4.259 10.429 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.755 4.055 12.296 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.674 5.547 12.302 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.505 4.587 13.275 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -6.308 3.070 12.420 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -5.521 2.218 14.358 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.058 3.135 14.059 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -6.465 4.007 15.702 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -4.856 3.649 16.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -4.876 5.938 16.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -4.133 5.534 14.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -5.770 5.985 14.739 1.00 0.00 H new ATOM 1195 N SER A 81 -5.122 5.814 8.681 1.00 0.00 N ATOM 1196 CA SER A 81 -4.703 6.933 7.845 1.00 0.00 C ATOM 1197 C SER A 81 -5.585 8.153 8.089 1.00 0.00 C ATOM 1198 O SER A 81 -6.696 8.038 8.608 1.00 0.00 O ATOM 1199 CB SER A 81 -4.754 6.540 6.367 1.00 0.00 C ATOM 1200 OG SER A 81 -6.061 6.146 5.988 1.00 0.00 O ATOM 0 H SER A 81 -5.934 5.306 8.330 1.00 0.00 H new ATOM 0 HA SER A 81 -3.677 7.189 8.110 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.432 7.381 5.753 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.056 5.724 6.180 1.00 0.00 H new ATOM 0 HG SER A 81 -6.017 5.301 5.493 1.00 0.00 H new ATOM 1206 N LEU A 82 -5.083 9.323 7.711 1.00 0.00 N ATOM 1207 CA LEU A 82 -5.824 10.568 7.888 1.00 0.00 C ATOM 1208 C LEU A 82 -6.805 10.785 6.740 1.00 0.00 C ATOM 1209 O LEU A 82 -7.957 11.157 6.958 1.00 0.00 O ATOM 1210 CB LEU A 82 -4.858 11.751 7.979 1.00 0.00 C ATOM 1211 CG LEU A 82 -5.490 13.141 7.894 1.00 0.00 C ATOM 1212 CD1 LEU A 82 -6.325 13.424 9.133 1.00 0.00 C ATOM 1213 CD2 LEU A 82 -4.416 14.204 7.717 1.00 0.00 C ATOM 0 H LEU A 82 -4.166 9.436 7.280 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.390 10.497 8.817 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.314 11.678 8.920 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.124 11.658 7.178 1.00 0.00 H new ATOM 0 HG LEU A 82 -6.147 13.169 7.025 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -6.767 14.417 9.055 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.117 12.680 9.216 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -5.690 13.378 10.018 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -4.883 15.187 7.658 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -3.734 14.177 8.566 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -3.861 14.011 6.799 1.00 0.00 H new ATOM 1225 N ASN A 83 -6.340 10.547 5.518 1.00 0.00 N ATOM 1226 CA ASN A 83 -7.177 10.715 4.336 1.00 0.00 C ATOM 1227 C ASN A 83 -8.147 9.547 4.185 1.00 0.00 C ATOM 1228 O ASN A 83 -9.363 9.726 4.238 1.00 0.00 O ATOM 1229 CB ASN A 83 -6.308 10.835 3.082 1.00 0.00 C ATOM 1230 CG ASN A 83 -5.614 12.180 2.986 1.00 0.00 C ATOM 1231 OD1 ASN A 83 -6.140 13.121 2.391 1.00 0.00 O ATOM 1232 ND2 ASN A 83 -4.427 12.277 3.573 1.00 0.00 N ATOM 0 H ASN A 83 -5.388 10.237 5.321 1.00 0.00 H new ATOM 0 HA ASN A 83 -7.755 11.631 4.459 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -5.560 10.042 3.085 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -6.928 10.685 2.198 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -3.913 13.158 3.542 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -4.029 11.471 4.055 1.00 0.00 H new ATOM 1239 N GLY A 84 -7.600 8.350 3.999 1.00 0.00 N ATOM 1240 CA GLY A 84 -8.430 7.170 3.845 1.00 0.00 C ATOM 1241 C GLY A 84 -8.058 6.355 2.622 1.00 0.00 C ATOM 1242 O GLY A 84 -7.508 6.885 1.657 1.00 0.00 O ATOM 0 H GLY A 84 -6.596 8.176 3.952 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -8.339 6.547 4.735 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -9.475 7.471 3.773 1.00 0.00 H new ATOM 1246 N VAL A 85 -8.356 5.060 2.664 1.00 0.00 N ATOM 1247 CA VAL A 85 -8.048 4.169 1.551 1.00 0.00 C ATOM 1248 C VAL A 85 -9.321 3.680 0.870 1.00 0.00 C ATOM 1249 O VAL A 85 -10.283 3.294 1.534 1.00 0.00 O ATOM 1250 CB VAL A 85 -7.229 2.951 2.018 1.00 0.00 C ATOM 1251 CG1 VAL A 85 -5.782 3.346 2.273 1.00 0.00 C ATOM 1252 CG2 VAL A 85 -7.850 2.337 3.264 1.00 0.00 C ATOM 0 H VAL A 85 -8.810 4.605 3.456 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.457 4.745 0.839 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.242 2.202 1.226 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.219 2.473 2.602 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -5.344 3.735 1.354 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -5.745 4.114 3.046 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -7.258 1.478 3.580 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -7.870 3.078 4.063 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -8.868 2.015 3.043 1.00 0.00 H new ATOM 1262 N TRP A 86 -9.319 3.700 -0.458 1.00 0.00 N ATOM 1263 CA TRP A 86 -10.475 3.258 -1.230 1.00 0.00 C ATOM 1264 C TRP A 86 -10.176 1.953 -1.960 1.00 0.00 C ATOM 1265 O TRP A 86 -9.144 1.823 -2.622 1.00 0.00 O ATOM 1266 CB TRP A 86 -10.886 4.336 -2.234 1.00 0.00 C ATOM 1267 CG TRP A 86 -11.094 5.682 -1.608 1.00 0.00 C ATOM 1268 CD1 TRP A 86 -10.132 6.603 -1.305 1.00 0.00 C ATOM 1269 CD2 TRP A 86 -12.343 6.257 -1.208 1.00 0.00 C ATOM 1270 NE1 TRP A 86 -10.707 7.715 -0.740 1.00 0.00 N ATOM 1271 CE2 TRP A 86 -12.062 7.528 -0.670 1.00 0.00 C ATOM 1272 CE3 TRP A 86 -13.670 5.822 -1.253 1.00 0.00 C ATOM 1273 CZ2 TRP A 86 -13.061 8.366 -0.181 1.00 0.00 C ATOM 1274 CZ3 TRP A 86 -14.660 6.655 -0.767 1.00 0.00 C ATOM 1275 CH2 TRP A 86 -14.352 7.915 -0.238 1.00 0.00 C ATOM 0 H TRP A 86 -8.531 4.017 -1.022 1.00 0.00 H new ATOM 0 HA TRP A 86 -11.298 3.084 -0.537 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -10.119 4.416 -3.005 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -11.806 4.028 -2.731 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -9.074 6.476 -1.483 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -10.206 8.545 -0.424 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -13.918 4.853 -1.660 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -12.825 9.337 0.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -15.689 6.329 -0.796 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -15.149 8.543 0.132 1.00 0.00 H new ATOM 1286 N LEU A 87 -11.082 0.990 -1.837 1.00 0.00 N ATOM 1287 CA LEU A 87 -10.914 -0.306 -2.487 1.00 0.00 C ATOM 1288 C LEU A 87 -12.150 -0.669 -3.304 1.00 0.00 C ATOM 1289 O LEU A 87 -13.210 -0.958 -2.750 1.00 0.00 O ATOM 1290 CB LEU A 87 -10.642 -1.390 -1.443 1.00 0.00 C ATOM 1291 CG LEU A 87 -10.663 -2.832 -1.952 1.00 0.00 C ATOM 1292 CD1 LEU A 87 -9.422 -3.122 -2.782 1.00 0.00 C ATOM 1293 CD2 LEU A 87 -10.768 -3.807 -0.788 1.00 0.00 C ATOM 0 H LEU A 87 -11.940 1.081 -1.294 1.00 0.00 H new ATOM 0 HA LEU A 87 -10.061 -0.239 -3.163 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.667 -1.198 -0.995 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.382 -1.295 -0.649 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.539 -2.961 -2.588 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.454 -4.152 -3.136 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -9.389 -2.446 -3.636 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -8.532 -2.976 -2.169 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.782 -4.828 -1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -9.911 -3.678 -0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.686 -3.614 -0.234 1.00 0.00 H new ATOM 1305 N ASN A 88 -12.005 -0.654 -4.625 1.00 0.00 N ATOM 1306 CA ASN A 88 -13.109 -0.984 -5.519 1.00 0.00 C ATOM 1307 C ASN A 88 -14.271 -0.014 -5.329 1.00 0.00 C ATOM 1308 O ASN A 88 -15.415 -0.429 -5.142 1.00 0.00 O ATOM 1309 CB ASN A 88 -13.581 -2.418 -5.272 1.00 0.00 C ATOM 1310 CG ASN A 88 -12.457 -3.428 -5.403 1.00 0.00 C ATOM 1311 OD1 ASN A 88 -11.325 -3.074 -5.734 1.00 0.00 O ATOM 1312 ND2 ASN A 88 -12.765 -4.693 -5.143 1.00 0.00 N ATOM 0 H ASN A 88 -11.134 -0.417 -5.100 1.00 0.00 H new ATOM 0 HA ASN A 88 -12.751 -0.898 -6.545 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -14.014 -2.488 -4.274 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -14.372 -2.664 -5.981 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -12.050 -5.417 -5.214 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -13.717 -4.941 -4.872 1.00 0.00 H new ATOM 1319 N ARG A 89 -13.969 1.279 -5.378 1.00 0.00 N ATOM 1320 CA ARG A 89 -14.989 2.308 -5.210 1.00 0.00 C ATOM 1321 C ARG A 89 -15.715 2.143 -3.878 1.00 0.00 C ATOM 1322 O ARG A 89 -16.924 2.350 -3.790 1.00 0.00 O ATOM 1323 CB ARG A 89 -15.994 2.253 -6.362 1.00 0.00 C ATOM 1324 CG ARG A 89 -15.346 2.264 -7.737 1.00 0.00 C ATOM 1325 CD ARG A 89 -14.576 3.553 -7.980 1.00 0.00 C ATOM 1326 NE ARG A 89 -14.001 3.602 -9.321 1.00 0.00 N ATOM 1327 CZ ARG A 89 -14.722 3.771 -10.424 1.00 0.00 C ATOM 1328 NH1 ARG A 89 -16.038 3.905 -10.345 1.00 0.00 N ATOM 1329 NH2 ARG A 89 -14.126 3.805 -11.609 1.00 0.00 N ATOM 0 H ARG A 89 -13.027 1.639 -5.532 1.00 0.00 H new ATOM 0 HA ARG A 89 -14.494 3.279 -5.215 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -16.599 1.352 -6.262 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.672 3.103 -6.282 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -14.671 1.413 -7.829 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -16.113 2.147 -8.503 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -15.241 4.405 -7.840 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -13.780 3.645 -7.241 1.00 0.00 H new ATOM 0 HE ARG A 89 -12.990 3.501 -9.416 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -16.500 3.879 -9.436 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -16.589 4.035 -11.193 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -13.113 3.701 -11.674 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -14.681 3.935 -12.455 1.00 0.00 H new ATOM 1343 N ALA A 90 -14.967 1.767 -2.846 1.00 0.00 N ATOM 1344 CA ALA A 90 -15.539 1.575 -1.519 1.00 0.00 C ATOM 1345 C ALA A 90 -14.512 1.867 -0.431 1.00 0.00 C ATOM 1346 O ALA A 90 -13.443 1.257 -0.393 1.00 0.00 O ATOM 1347 CB ALA A 90 -16.075 0.158 -1.375 1.00 0.00 C ATOM 0 H ALA A 90 -13.964 1.589 -2.903 1.00 0.00 H new ATOM 0 HA ALA A 90 -16.364 2.278 -1.401 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -16.499 0.029 -0.379 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -16.847 -0.017 -2.124 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -15.263 -0.555 -1.519 1.00 0.00 H new ATOM 1353 N ARG A 91 -14.842 2.803 0.453 1.00 0.00 N ATOM 1354 CA ARG A 91 -13.946 3.176 1.541 1.00 0.00 C ATOM 1355 C ARG A 91 -13.617 1.968 2.413 1.00 0.00 C ATOM 1356 O ARG A 91 -14.260 0.923 2.313 1.00 0.00 O ATOM 1357 CB ARG A 91 -14.578 4.278 2.395 1.00 0.00 C ATOM 1358 CG ARG A 91 -13.954 5.647 2.181 1.00 0.00 C ATOM 1359 CD ARG A 91 -13.356 6.194 3.468 1.00 0.00 C ATOM 1360 NE ARG A 91 -14.312 6.165 4.571 1.00 0.00 N ATOM 1361 CZ ARG A 91 -15.275 7.065 4.734 1.00 0.00 C ATOM 1362 NH1 ARG A 91 -15.409 8.061 3.868 1.00 0.00 N ATOM 1363 NH2 ARG A 91 -16.107 6.971 5.763 1.00 0.00 N ATOM 0 H ARG A 91 -15.723 3.317 0.437 1.00 0.00 H new ATOM 0 HA ARG A 91 -13.020 3.550 1.104 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -15.643 4.334 2.170 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -14.488 4.007 3.447 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -13.178 5.579 1.418 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -14.709 6.338 1.807 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -12.476 5.610 3.736 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -13.021 7.218 3.305 1.00 0.00 H new ATOM 0 HE ARG A 91 -14.236 5.412 5.254 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -14.772 8.137 3.075 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -16.149 8.751 3.995 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -16.008 6.206 6.431 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -16.846 7.663 5.886 1.00 0.00 H new ATOM 1377 N LEU A 92 -12.611 2.119 3.268 1.00 0.00 N ATOM 1378 CA LEU A 92 -12.195 1.041 4.158 1.00 0.00 C ATOM 1379 C LEU A 92 -11.883 1.575 5.552 1.00 0.00 C ATOM 1380 O LEU A 92 -11.252 2.621 5.699 1.00 0.00 O ATOM 1381 CB LEU A 92 -10.968 0.327 3.587 1.00 0.00 C ATOM 1382 CG LEU A 92 -11.076 -0.134 2.133 1.00 0.00 C ATOM 1383 CD1 LEU A 92 -9.722 -0.051 1.445 1.00 0.00 C ATOM 1384 CD2 LEU A 92 -11.626 -1.551 2.062 1.00 0.00 C ATOM 0 H LEU A 92 -12.069 2.978 3.363 1.00 0.00 H new ATOM 0 HA LEU A 92 -13.018 0.331 4.237 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.111 0.995 3.673 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -10.757 -0.543 4.208 1.00 0.00 H new ATOM 0 HG LEU A 92 -11.767 0.529 1.612 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -9.818 -0.383 0.411 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -9.367 0.979 1.464 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -9.009 -0.690 1.966 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.696 -1.862 1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -10.960 -2.227 2.599 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -12.616 -1.580 2.517 1.00 0.00 H new ATOM 1396 N GLU A 93 -12.329 0.848 6.572 1.00 0.00 N ATOM 1397 CA GLU A 93 -12.096 1.249 7.954 1.00 0.00 C ATOM 1398 C GLU A 93 -10.644 1.005 8.354 1.00 0.00 C ATOM 1399 O GLU A 93 -9.924 0.226 7.729 1.00 0.00 O ATOM 1400 CB GLU A 93 -13.031 0.485 8.895 1.00 0.00 C ATOM 1401 CG GLU A 93 -14.193 1.319 9.407 1.00 0.00 C ATOM 1402 CD GLU A 93 -15.491 0.537 9.465 1.00 0.00 C ATOM 1403 OE1 GLU A 93 -15.848 -0.095 8.449 1.00 0.00 O ATOM 1404 OE2 GLU A 93 -16.150 0.558 10.526 1.00 0.00 O ATOM 0 H GLU A 93 -12.853 -0.021 6.467 1.00 0.00 H new ATOM 0 HA GLU A 93 -12.303 2.316 8.035 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -13.423 -0.388 8.374 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -12.456 0.117 9.745 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -13.955 1.695 10.402 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.325 2.187 8.761 1.00 0.00 H new ATOM 1411 N PRO A 94 -10.202 1.687 9.421 1.00 0.00 N ATOM 1412 CA PRO A 94 -8.832 1.562 9.929 1.00 0.00 C ATOM 1413 C PRO A 94 -8.573 0.202 10.568 1.00 0.00 C ATOM 1414 O PRO A 94 -9.431 -0.341 11.266 1.00 0.00 O ATOM 1415 CB PRO A 94 -8.740 2.672 10.979 1.00 0.00 C ATOM 1416 CG PRO A 94 -10.145 2.893 11.421 1.00 0.00 C ATOM 1417 CD PRO A 94 -11.005 2.633 10.214 1.00 0.00 C ATOM 0 HA PRO A 94 -8.093 1.648 9.133 1.00 0.00 H new ATOM 0 HB2 PRO A 94 -8.104 2.376 11.814 1.00 0.00 H new ATOM 0 HB3 PRO A 94 -8.310 3.581 10.558 1.00 0.00 H new ATOM 0 HG2 PRO A 94 -10.407 2.222 12.239 1.00 0.00 H new ATOM 0 HG3 PRO A 94 -10.283 3.910 11.787 1.00 0.00 H new ATOM 0 HD2 PRO A 94 -11.969 2.207 10.492 1.00 0.00 H new ATOM 0 HD3 PRO A 94 -11.209 3.550 9.661 1.00 0.00 H new ATOM 1425 N LEU A 95 -7.386 -0.343 10.327 1.00 0.00 N ATOM 1426 CA LEU A 95 -7.014 -1.641 10.881 1.00 0.00 C ATOM 1427 C LEU A 95 -8.057 -2.699 10.538 1.00 0.00 C ATOM 1428 O LEU A 95 -8.473 -3.476 11.397 1.00 0.00 O ATOM 1429 CB LEU A 95 -6.850 -1.542 12.398 1.00 0.00 C ATOM 1430 CG LEU A 95 -6.227 -0.249 12.924 1.00 0.00 C ATOM 1431 CD1 LEU A 95 -6.101 -0.293 14.439 1.00 0.00 C ATOM 1432 CD2 LEU A 95 -4.868 -0.012 12.281 1.00 0.00 C ATOM 0 H LEU A 95 -6.665 0.093 9.752 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.064 -1.938 10.438 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -7.831 -1.662 12.858 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -6.237 -2.379 12.732 1.00 0.00 H new ATOM 0 HG LEU A 95 -6.883 0.581 12.659 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -5.655 0.636 14.794 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.089 -0.415 14.883 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -5.468 -1.132 14.727 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -4.439 0.913 12.667 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -4.205 -0.845 12.515 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -4.986 0.066 11.200 1.00 0.00 H new ATOM 1444 N ARG A 96 -8.475 -2.724 9.276 1.00 0.00 N ATOM 1445 CA ARG A 96 -9.469 -3.687 8.820 1.00 0.00 C ATOM 1446 C ARG A 96 -8.869 -4.644 7.794 1.00 0.00 C ATOM 1447 O ARG A 96 -7.932 -4.292 7.075 1.00 0.00 O ATOM 1448 CB ARG A 96 -10.672 -2.962 8.214 1.00 0.00 C ATOM 1449 CG ARG A 96 -12.006 -3.614 8.544 1.00 0.00 C ATOM 1450 CD ARG A 96 -12.574 -3.089 9.853 1.00 0.00 C ATOM 1451 NE ARG A 96 -13.477 -4.049 10.482 1.00 0.00 N ATOM 1452 CZ ARG A 96 -14.268 -3.751 11.507 1.00 0.00 C ATOM 1453 NH1 ARG A 96 -14.267 -2.527 12.016 1.00 0.00 N ATOM 1454 NH2 ARG A 96 -15.062 -4.679 12.025 1.00 0.00 N ATOM 0 H ARG A 96 -8.140 -2.088 8.552 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.799 -4.266 9.682 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -10.682 -1.932 8.571 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -10.554 -2.923 7.131 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -12.714 -3.425 7.737 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -11.878 -4.694 8.609 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -11.757 -2.859 10.536 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -13.108 -2.157 9.669 1.00 0.00 H new ATOM 0 HE ARG A 96 -13.502 -5.000 10.114 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -13.658 -1.811 11.621 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -14.875 -2.301 12.803 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -15.065 -5.622 11.636 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -15.669 -4.449 12.812 1.00 0.00 H new ATOM 1468 N VAL A 97 -9.413 -5.855 7.731 1.00 0.00 N ATOM 1469 CA VAL A 97 -8.932 -6.862 6.792 1.00 0.00 C ATOM 1470 C VAL A 97 -9.833 -6.944 5.565 1.00 0.00 C ATOM 1471 O VAL A 97 -11.031 -7.205 5.678 1.00 0.00 O ATOM 1472 CB VAL A 97 -8.853 -8.251 7.452 1.00 0.00 C ATOM 1473 CG1 VAL A 97 -8.204 -9.254 6.510 1.00 0.00 C ATOM 1474 CG2 VAL A 97 -8.093 -8.173 8.768 1.00 0.00 C ATOM 0 H VAL A 97 -10.187 -6.163 8.319 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.932 -6.557 6.484 1.00 0.00 H new ATOM 0 HB VAL A 97 -9.866 -8.592 7.664 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -8.157 -10.230 6.994 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.794 -9.330 5.597 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -7.195 -8.922 6.264 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -8.047 -9.163 9.221 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -7.082 -7.811 8.583 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -8.605 -7.489 9.444 1.00 0.00 H new ATOM 1484 N TYR A 98 -9.248 -6.722 4.393 1.00 0.00 N ATOM 1485 CA TYR A 98 -9.999 -6.769 3.144 1.00 0.00 C ATOM 1486 C TYR A 98 -9.232 -7.546 2.078 1.00 0.00 C ATOM 1487 O TYR A 98 -8.313 -7.019 1.450 1.00 0.00 O ATOM 1488 CB TYR A 98 -10.292 -5.352 2.647 1.00 0.00 C ATOM 1489 CG TYR A 98 -11.432 -4.679 3.376 1.00 0.00 C ATOM 1490 CD1 TYR A 98 -12.753 -4.950 3.042 1.00 0.00 C ATOM 1491 CD2 TYR A 98 -11.189 -3.770 4.399 1.00 0.00 C ATOM 1492 CE1 TYR A 98 -13.798 -4.336 3.705 1.00 0.00 C ATOM 1493 CE2 TYR A 98 -12.227 -3.153 5.069 1.00 0.00 C ATOM 1494 CZ TYR A 98 -13.530 -3.439 4.718 1.00 0.00 C ATOM 1495 OH TYR A 98 -14.568 -2.825 5.382 1.00 0.00 O ATOM 0 H TYR A 98 -8.257 -6.508 4.282 1.00 0.00 H new ATOM 0 HA TYR A 98 -10.942 -7.282 3.334 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -9.393 -4.745 2.756 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -10.524 -5.390 1.583 1.00 0.00 H new ATOM 0 HD1 TYR A 98 -12.967 -5.653 2.250 1.00 0.00 H new ATOM 0 HD2 TYR A 98 -10.170 -3.542 4.675 1.00 0.00 H new ATOM 0 HE1 TYR A 98 -14.819 -4.557 3.432 1.00 0.00 H new ATOM 0 HE2 TYR A 98 -12.020 -2.451 5.863 1.00 0.00 H new ATOM 0 HH TYR A 98 -14.208 -2.224 6.067 1.00 0.00 H new ATOM 1505 N SER A 99 -9.618 -8.802 1.878 1.00 0.00 N ATOM 1506 CA SER A 99 -8.967 -9.654 0.890 1.00 0.00 C ATOM 1507 C SER A 99 -8.939 -8.978 -0.477 1.00 0.00 C ATOM 1508 O SER A 99 -9.929 -8.387 -0.910 1.00 0.00 O ATOM 1509 CB SER A 99 -9.688 -11.000 0.792 1.00 0.00 C ATOM 1510 OG SER A 99 -11.030 -10.893 1.233 1.00 0.00 O ATOM 0 H SER A 99 -10.379 -9.252 2.387 1.00 0.00 H new ATOM 0 HA SER A 99 -7.940 -9.823 1.213 1.00 0.00 H new ATOM 0 HB2 SER A 99 -9.668 -11.353 -0.239 1.00 0.00 H new ATOM 0 HB3 SER A 99 -9.163 -11.742 1.393 1.00 0.00 H new ATOM 0 HG SER A 99 -11.469 -11.766 1.159 1.00 0.00 H new ATOM 1516 N ILE A 100 -7.798 -9.068 -1.152 1.00 0.00 N ATOM 1517 CA ILE A 100 -7.641 -8.466 -2.470 1.00 0.00 C ATOM 1518 C ILE A 100 -7.342 -9.525 -3.526 1.00 0.00 C ATOM 1519 O ILE A 100 -6.608 -10.481 -3.272 1.00 0.00 O ATOM 1520 CB ILE A 100 -6.514 -7.417 -2.479 1.00 0.00 C ATOM 1521 CG1 ILE A 100 -5.160 -8.089 -2.245 1.00 0.00 C ATOM 1522 CG2 ILE A 100 -6.773 -6.353 -1.423 1.00 0.00 C ATOM 1523 CD1 ILE A 100 -3.994 -7.125 -2.274 1.00 0.00 C ATOM 0 H ILE A 100 -6.969 -9.552 -0.808 1.00 0.00 H new ATOM 0 HA ILE A 100 -8.585 -7.976 -2.707 1.00 0.00 H new ATOM 0 HB ILE A 100 -6.495 -6.934 -3.456 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.177 -8.597 -1.281 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -5.007 -8.855 -3.006 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -5.968 -5.618 -1.441 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -7.721 -5.857 -1.631 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -6.816 -6.820 -0.439 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.066 -7.671 -2.101 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.951 -6.635 -3.247 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -4.124 -6.374 -1.495 1.00 0.00 H new ATOM 1535 N HIS A 101 -7.915 -9.348 -4.712 1.00 0.00 N ATOM 1536 CA HIS A 101 -7.708 -10.288 -5.809 1.00 0.00 C ATOM 1537 C HIS A 101 -7.564 -9.550 -7.136 1.00 0.00 C ATOM 1538 O HIS A 101 -7.770 -8.339 -7.209 1.00 0.00 O ATOM 1539 CB HIS A 101 -8.871 -11.278 -5.886 1.00 0.00 C ATOM 1540 CG HIS A 101 -9.238 -11.875 -4.562 1.00 0.00 C ATOM 1541 ND1 HIS A 101 -8.640 -13.011 -4.058 1.00 0.00 N ATOM 1542 CD2 HIS A 101 -10.146 -11.487 -3.637 1.00 0.00 C ATOM 1543 CE1 HIS A 101 -9.167 -13.296 -2.880 1.00 0.00 C ATOM 1544 NE2 HIS A 101 -10.083 -12.386 -2.602 1.00 0.00 N ATOM 0 H HIS A 101 -8.526 -8.563 -4.938 1.00 0.00 H new ATOM 0 HA HIS A 101 -6.786 -10.836 -5.616 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -9.742 -10.771 -6.301 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -8.610 -12.080 -6.577 1.00 0.00 H new ATOM 0 HD1 HIS A 101 -7.906 -13.547 -4.522 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -10.799 -10.629 -3.701 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -8.895 -14.131 -2.251 1.00 0.00 H new ATOM 1552 N GLN A 102 -7.208 -10.288 -8.183 1.00 0.00 N ATOM 1553 CA GLN A 102 -7.035 -9.703 -9.507 1.00 0.00 C ATOM 1554 C GLN A 102 -8.294 -8.961 -9.943 1.00 0.00 C ATOM 1555 O GLN A 102 -9.294 -9.577 -10.309 1.00 0.00 O ATOM 1556 CB GLN A 102 -6.689 -10.789 -10.527 1.00 0.00 C ATOM 1557 CG GLN A 102 -6.386 -10.247 -11.914 1.00 0.00 C ATOM 1558 CD GLN A 102 -4.904 -10.026 -12.143 1.00 0.00 C ATOM 1559 OE1 GLN A 102 -4.064 -10.653 -11.497 1.00 0.00 O ATOM 1560 NE2 GLN A 102 -4.574 -9.131 -13.067 1.00 0.00 N ATOM 0 H GLN A 102 -7.034 -11.292 -8.140 1.00 0.00 H new ATOM 0 HA GLN A 102 -6.214 -8.988 -9.456 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -5.826 -11.350 -10.169 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -7.520 -11.491 -10.594 1.00 0.00 H new ATOM 0 HG2 GLN A 102 -6.766 -10.942 -12.663 1.00 0.00 H new ATOM 0 HG3 GLN A 102 -6.916 -9.305 -12.056 1.00 0.00 H new ATOM 0 HE21 GLN A 102 -5.303 -8.634 -13.579 1.00 0.00 H new ATOM 0 HE22 GLN A 102 -3.592 -8.941 -13.265 1.00 0.00 H new ATOM 1569 N GLY A 103 -8.237 -7.633 -9.901 1.00 0.00 N ATOM 1570 CA GLY A 103 -9.380 -6.830 -10.294 1.00 0.00 C ATOM 1571 C GLY A 103 -9.801 -5.853 -9.214 1.00 0.00 C ATOM 1572 O GLY A 103 -10.986 -5.555 -9.065 1.00 0.00 O ATOM 0 H GLY A 103 -7.420 -7.100 -9.602 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -9.138 -6.280 -11.203 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -10.217 -7.487 -10.532 1.00 0.00 H new ATOM 1576 N ASP A 104 -8.830 -5.356 -8.457 1.00 0.00 N ATOM 1577 CA ASP A 104 -9.106 -4.408 -7.384 1.00 0.00 C ATOM 1578 C ASP A 104 -8.451 -3.060 -7.668 1.00 0.00 C ATOM 1579 O ASP A 104 -7.581 -2.951 -8.532 1.00 0.00 O ATOM 1580 CB ASP A 104 -8.608 -4.959 -6.047 1.00 0.00 C ATOM 1581 CG ASP A 104 -9.640 -5.832 -5.360 1.00 0.00 C ATOM 1582 OD1 ASP A 104 -10.584 -6.282 -6.042 1.00 0.00 O ATOM 1583 OD2 ASP A 104 -9.505 -6.063 -4.140 1.00 0.00 O ATOM 0 H ASP A 104 -7.844 -5.594 -8.566 1.00 0.00 H new ATOM 0 HA ASP A 104 -10.185 -4.263 -7.329 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.699 -5.537 -6.212 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -8.344 -4.129 -5.391 1.00 0.00 H new ATOM 1588 N TYR A 105 -8.875 -2.036 -6.936 1.00 0.00 N ATOM 1589 CA TYR A 105 -8.332 -0.694 -7.111 1.00 0.00 C ATOM 1590 C TYR A 105 -8.102 -0.019 -5.762 1.00 0.00 C ATOM 1591 O TYR A 105 -9.045 0.438 -5.115 1.00 0.00 O ATOM 1592 CB TYR A 105 -9.278 0.154 -7.963 1.00 0.00 C ATOM 1593 CG TYR A 105 -8.867 0.246 -9.415 1.00 0.00 C ATOM 1594 CD1 TYR A 105 -8.930 -0.865 -10.247 1.00 0.00 C ATOM 1595 CD2 TYR A 105 -8.416 1.444 -9.955 1.00 0.00 C ATOM 1596 CE1 TYR A 105 -8.554 -0.786 -11.574 1.00 0.00 C ATOM 1597 CE2 TYR A 105 -8.039 1.533 -11.282 1.00 0.00 C ATOM 1598 CZ TYR A 105 -8.110 0.415 -12.087 1.00 0.00 C ATOM 1599 OH TYR A 105 -7.736 0.498 -13.409 1.00 0.00 O ATOM 0 H TYR A 105 -9.593 -2.110 -6.216 1.00 0.00 H new ATOM 0 HA TYR A 105 -7.373 -0.781 -7.621 1.00 0.00 H new ATOM 0 HB2 TYR A 105 -10.282 -0.267 -7.904 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -9.328 1.159 -7.544 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -9.279 -1.807 -9.849 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -8.359 2.321 -9.327 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -8.607 -1.660 -12.206 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -7.691 2.472 -11.686 1.00 0.00 H new ATOM 0 HH TYR A 105 -7.449 1.413 -13.611 1.00 0.00 H new ATOM 1609 N ILE A 106 -6.842 0.040 -5.346 1.00 0.00 N ATOM 1610 CA ILE A 106 -6.486 0.661 -4.075 1.00 0.00 C ATOM 1611 C ILE A 106 -6.119 2.129 -4.264 1.00 0.00 C ATOM 1612 O ILE A 106 -5.170 2.454 -4.977 1.00 0.00 O ATOM 1613 CB ILE A 106 -5.308 -0.069 -3.403 1.00 0.00 C ATOM 1614 CG1 ILE A 106 -5.662 -1.537 -3.156 1.00 0.00 C ATOM 1615 CG2 ILE A 106 -4.935 0.618 -2.098 1.00 0.00 C ATOM 1616 CD1 ILE A 106 -5.179 -2.467 -4.247 1.00 0.00 C ATOM 0 H ILE A 106 -6.051 -0.334 -5.869 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.363 0.588 -3.431 1.00 0.00 H new ATOM 0 HB ILE A 106 -4.448 -0.030 -4.071 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -5.232 -1.851 -2.205 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -6.744 -1.631 -3.063 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -4.101 0.091 -1.635 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -4.645 1.649 -2.300 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -5.791 0.607 -1.423 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -5.465 -3.491 -4.006 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -5.630 -2.179 -5.197 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -4.094 -2.403 -4.326 1.00 0.00 H new ATOM 1628 N GLN A 107 -6.876 3.010 -3.619 1.00 0.00 N ATOM 1629 CA GLN A 107 -6.630 4.444 -3.716 1.00 0.00 C ATOM 1630 C GLN A 107 -6.161 5.007 -2.378 1.00 0.00 C ATOM 1631 O GLN A 107 -6.930 5.074 -1.417 1.00 0.00 O ATOM 1632 CB GLN A 107 -7.895 5.171 -4.173 1.00 0.00 C ATOM 1633 CG GLN A 107 -7.621 6.345 -5.099 1.00 0.00 C ATOM 1634 CD GLN A 107 -8.885 6.904 -5.723 1.00 0.00 C ATOM 1635 OE1 GLN A 107 -9.088 6.810 -6.933 1.00 0.00 O ATOM 1636 NE2 GLN A 107 -9.744 7.490 -4.896 1.00 0.00 N ATOM 0 H GLN A 107 -7.665 2.756 -3.024 1.00 0.00 H new ATOM 0 HA GLN A 107 -5.843 4.603 -4.453 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -8.548 4.462 -4.682 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -8.435 5.529 -3.296 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -7.117 7.134 -4.540 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -6.940 6.029 -5.889 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -9.535 7.546 -3.899 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -10.612 7.884 -5.258 1.00 0.00 H new ATOM 1645 N LEU A 108 -4.897 5.410 -2.321 1.00 0.00 N ATOM 1646 CA LEU A 108 -4.325 5.967 -1.101 1.00 0.00 C ATOM 1647 C LEU A 108 -4.629 7.457 -0.988 1.00 0.00 C ATOM 1648 O LEU A 108 -3.858 8.296 -1.452 1.00 0.00 O ATOM 1649 CB LEU A 108 -2.812 5.740 -1.073 1.00 0.00 C ATOM 1650 CG LEU A 108 -2.351 4.283 -1.113 1.00 0.00 C ATOM 1651 CD1 LEU A 108 -0.833 4.202 -1.071 1.00 0.00 C ATOM 1652 CD2 LEU A 108 -2.961 3.499 0.040 1.00 0.00 C ATOM 0 H LEU A 108 -4.248 5.361 -3.106 1.00 0.00 H new ATOM 0 HA LEU A 108 -4.778 5.457 -0.251 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.371 6.263 -1.921 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -2.412 6.202 -0.170 1.00 0.00 H new ATOM 0 HG LEU A 108 -2.692 3.840 -2.048 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -0.523 3.157 -1.100 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -0.417 4.728 -1.930 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.469 4.663 -0.152 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -2.622 2.464 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.651 3.942 0.986 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -4.048 3.528 -0.035 1.00 0.00 H new ATOM 1664 N GLY A 109 -5.759 7.780 -0.365 1.00 0.00 N ATOM 1665 CA GLY A 109 -6.145 9.169 -0.200 1.00 0.00 C ATOM 1666 C GLY A 109 -7.303 9.560 -1.096 1.00 0.00 C ATOM 1667 O GLY A 109 -7.966 8.700 -1.677 1.00 0.00 O ATOM 0 H GLY A 109 -6.414 7.104 0.028 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -6.419 9.345 0.840 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -5.290 9.809 -0.417 1.00 0.00 H new ATOM 1671 N VAL A 110 -7.550 10.861 -1.209 1.00 0.00 N ATOM 1672 CA VAL A 110 -8.637 11.364 -2.040 1.00 0.00 C ATOM 1673 C VAL A 110 -8.120 12.342 -3.089 1.00 0.00 C ATOM 1674 O VAL A 110 -7.066 12.959 -2.932 1.00 0.00 O ATOM 1675 CB VAL A 110 -9.716 12.062 -1.191 1.00 0.00 C ATOM 1676 CG1 VAL A 110 -10.604 11.035 -0.506 1.00 0.00 C ATOM 1677 CG2 VAL A 110 -9.073 12.989 -0.170 1.00 0.00 C ATOM 0 H VAL A 110 -7.012 11.586 -0.735 1.00 0.00 H new ATOM 0 HA VAL A 110 -9.079 10.501 -2.538 1.00 0.00 H new ATOM 0 HB VAL A 110 -10.341 12.663 -1.851 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -11.360 11.547 0.089 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -11.092 10.416 -1.259 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.997 10.404 0.143 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -9.850 13.474 0.421 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.424 12.411 0.488 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.484 13.747 -0.687 1.00 0.00 H new ATOM 1687 N PRO A 111 -8.878 12.489 -4.186 1.00 0.00 N ATOM 1688 CA PRO A 111 -8.516 13.392 -5.283 1.00 0.00 C ATOM 1689 C PRO A 111 -8.632 14.860 -4.887 1.00 0.00 C ATOM 1690 O PRO A 111 -9.574 15.256 -4.199 1.00 0.00 O ATOM 1691 CB PRO A 111 -9.535 13.050 -6.374 1.00 0.00 C ATOM 1692 CG PRO A 111 -10.707 12.499 -5.638 1.00 0.00 C ATOM 1693 CD PRO A 111 -10.146 11.785 -4.440 1.00 0.00 C ATOM 0 HA PRO A 111 -7.479 13.262 -5.593 1.00 0.00 H new ATOM 0 HB2 PRO A 111 -9.809 13.933 -6.951 1.00 0.00 H new ATOM 0 HB3 PRO A 111 -9.132 12.322 -7.078 1.00 0.00 H new ATOM 0 HG2 PRO A 111 -11.387 13.295 -5.335 1.00 0.00 H new ATOM 0 HG3 PRO A 111 -11.277 11.816 -6.268 1.00 0.00 H new ATOM 0 HD2 PRO A 111 -10.818 11.847 -3.584 1.00 0.00 H new ATOM 0 HD3 PRO A 111 -9.984 10.726 -4.643 1.00 0.00 H new ATOM 1701 N LEU A 112 -7.670 15.663 -5.325 1.00 0.00 N ATOM 1702 CA LEU A 112 -7.664 17.089 -5.017 1.00 0.00 C ATOM 1703 C LEU A 112 -8.840 17.795 -5.684 1.00 0.00 C ATOM 1704 O LEU A 112 -9.636 17.169 -6.384 1.00 0.00 O ATOM 1705 CB LEU A 112 -6.349 17.724 -5.473 1.00 0.00 C ATOM 1706 CG LEU A 112 -5.125 17.431 -4.603 1.00 0.00 C ATOM 1707 CD1 LEU A 112 -5.399 17.803 -3.154 1.00 0.00 C ATOM 1708 CD2 LEU A 112 -4.731 15.965 -4.714 1.00 0.00 C ATOM 0 H LEU A 112 -6.883 15.352 -5.895 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.760 17.202 -3.937 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -6.138 17.386 -6.488 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.487 18.804 -5.519 1.00 0.00 H new ATOM 0 HG LEU A 112 -4.294 18.038 -4.962 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -4.517 17.588 -2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -5.633 18.866 -3.089 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -6.244 17.223 -2.783 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -3.859 15.774 -4.089 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -5.559 15.339 -4.382 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -4.492 15.730 -5.751 1.00 0.00 H new ATOM 1800 N ALA A 118 -7.326 10.473 -8.121 1.00 0.00 N ATOM 1801 CA ALA A 118 -6.237 10.297 -7.168 1.00 0.00 C ATOM 1802 C ALA A 118 -4.926 9.991 -7.883 1.00 0.00 C ATOM 1803 O ALA A 118 -4.787 8.952 -8.527 1.00 0.00 O ATOM 1804 CB ALA A 118 -6.574 9.188 -6.182 1.00 0.00 C ATOM 0 HA ALA A 118 -6.112 11.231 -6.620 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -5.752 9.067 -5.476 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -7.483 9.447 -5.640 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -6.728 8.254 -6.723 1.00 0.00 H new ATOM 1810 N GLU A 119 -3.966 10.904 -7.766 1.00 0.00 N ATOM 1811 CA GLU A 119 -2.666 10.731 -8.403 1.00 0.00 C ATOM 1812 C GLU A 119 -2.065 9.373 -8.052 1.00 0.00 C ATOM 1813 O GLU A 119 -1.322 8.788 -8.841 1.00 0.00 O ATOM 1814 CB GLU A 119 -1.712 11.849 -7.978 1.00 0.00 C ATOM 1815 CG GLU A 119 -1.208 11.709 -6.552 1.00 0.00 C ATOM 1816 CD GLU A 119 -0.225 12.800 -6.171 1.00 0.00 C ATOM 1817 OE1 GLU A 119 -0.665 13.954 -5.983 1.00 0.00 O ATOM 1818 OE2 GLU A 119 0.982 12.500 -6.060 1.00 0.00 O ATOM 0 H GLU A 119 -4.064 11.770 -7.236 1.00 0.00 H new ATOM 0 HA GLU A 119 -2.810 10.777 -9.482 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -0.859 11.865 -8.656 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -2.220 12.808 -8.083 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.056 11.733 -5.867 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.730 10.737 -6.433 1.00 0.00 H new ATOM 1825 N TYR A 120 -2.390 8.878 -6.864 1.00 0.00 N ATOM 1826 CA TYR A 120 -1.880 7.591 -6.406 1.00 0.00 C ATOM 1827 C TYR A 120 -2.938 6.502 -6.555 1.00 0.00 C ATOM 1828 O TYR A 120 -3.836 6.377 -5.723 1.00 0.00 O ATOM 1829 CB TYR A 120 -1.432 7.686 -4.946 1.00 0.00 C ATOM 1830 CG TYR A 120 -0.126 8.425 -4.761 1.00 0.00 C ATOM 1831 CD1 TYR A 120 1.047 7.961 -5.345 1.00 0.00 C ATOM 1832 CD2 TYR A 120 -0.064 9.588 -4.003 1.00 0.00 C ATOM 1833 CE1 TYR A 120 2.242 8.633 -5.178 1.00 0.00 C ATOM 1834 CE2 TYR A 120 1.127 10.267 -3.832 1.00 0.00 C ATOM 1835 CZ TYR A 120 2.277 9.785 -4.420 1.00 0.00 C ATOM 1836 OH TYR A 120 3.466 10.458 -4.252 1.00 0.00 O ATOM 0 H TYR A 120 -3.005 9.348 -6.200 1.00 0.00 H new ATOM 0 HA TYR A 120 -1.023 7.327 -7.026 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -2.209 8.187 -4.368 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -1.331 6.680 -4.539 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.023 7.060 -5.939 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.963 9.968 -3.539 1.00 0.00 H new ATOM 0 HE1 TYR A 120 3.144 8.259 -5.638 1.00 0.00 H new ATOM 0 HE2 TYR A 120 1.157 11.170 -3.241 1.00 0.00 H new ATOM 0 HH TYR A 120 4.033 10.322 -5.040 1.00 0.00 H new ATOM 1846 N GLU A 121 -2.823 5.716 -7.621 1.00 0.00 N ATOM 1847 CA GLU A 121 -3.769 4.637 -7.879 1.00 0.00 C ATOM 1848 C GLU A 121 -3.047 3.386 -8.372 1.00 0.00 C ATOM 1849 O GLU A 121 -2.120 3.468 -9.178 1.00 0.00 O ATOM 1850 CB GLU A 121 -4.810 5.077 -8.910 1.00 0.00 C ATOM 1851 CG GLU A 121 -5.970 5.854 -8.310 1.00 0.00 C ATOM 1852 CD GLU A 121 -6.648 6.761 -9.318 1.00 0.00 C ATOM 1853 OE1 GLU A 121 -6.646 6.419 -10.519 1.00 0.00 O ATOM 1854 OE2 GLU A 121 -7.180 7.813 -8.906 1.00 0.00 O ATOM 0 H GLU A 121 -2.085 5.806 -8.319 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.273 4.399 -6.942 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.323 5.693 -9.666 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -5.199 4.196 -9.420 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -6.702 5.154 -7.907 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.608 6.453 -7.474 1.00 0.00 H new ATOM 1861 N TYR A 122 -3.478 2.229 -7.881 1.00 0.00 N ATOM 1862 CA TYR A 122 -2.871 0.961 -8.269 1.00 0.00 C ATOM 1863 C TYR A 122 -3.937 -0.047 -8.687 1.00 0.00 C ATOM 1864 O TYR A 122 -5.120 0.282 -8.767 1.00 0.00 O ATOM 1865 CB TYR A 122 -2.042 0.395 -7.115 1.00 0.00 C ATOM 1866 CG TYR A 122 -1.187 1.430 -6.419 1.00 0.00 C ATOM 1867 CD1 TYR A 122 -1.708 2.220 -5.402 1.00 0.00 C ATOM 1868 CD2 TYR A 122 0.142 1.618 -6.779 1.00 0.00 C ATOM 1869 CE1 TYR A 122 -0.931 3.167 -4.763 1.00 0.00 C ATOM 1870 CE2 TYR A 122 0.927 2.562 -6.145 1.00 0.00 C ATOM 1871 CZ TYR A 122 0.386 3.334 -5.138 1.00 0.00 C ATOM 1872 OH TYR A 122 1.164 4.276 -4.505 1.00 0.00 O ATOM 0 H TYR A 122 -4.245 2.143 -7.214 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.217 1.145 -9.121 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -2.713 -0.060 -6.386 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -1.399 -0.399 -7.496 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.739 2.092 -5.106 1.00 0.00 H new ATOM 0 HD2 TYR A 122 0.569 1.016 -7.568 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -1.352 3.773 -3.975 1.00 0.00 H new ATOM 0 HE2 TYR A 122 1.958 2.695 -6.436 1.00 0.00 H new ATOM 0 HH TYR A 122 0.698 5.138 -4.504 1.00 0.00 H new ATOM 1882 N GLU A 123 -3.507 -1.277 -8.950 1.00 0.00 N ATOM 1883 CA GLU A 123 -4.424 -2.335 -9.360 1.00 0.00 C ATOM 1884 C GLU A 123 -3.833 -3.711 -9.067 1.00 0.00 C ATOM 1885 O GLU A 123 -2.875 -4.138 -9.711 1.00 0.00 O ATOM 1886 CB GLU A 123 -4.745 -2.212 -10.851 1.00 0.00 C ATOM 1887 CG GLU A 123 -5.820 -3.176 -11.324 1.00 0.00 C ATOM 1888 CD GLU A 123 -5.848 -3.326 -12.832 1.00 0.00 C ATOM 1889 OE1 GLU A 123 -5.498 -2.353 -13.532 1.00 0.00 O ATOM 1890 OE2 GLU A 123 -6.220 -4.417 -13.313 1.00 0.00 O ATOM 0 H GLU A 123 -2.531 -1.566 -8.887 1.00 0.00 H new ATOM 0 HA GLU A 123 -5.345 -2.225 -8.787 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.065 -1.192 -11.062 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -3.835 -2.386 -11.425 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -5.653 -4.152 -10.869 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -6.793 -2.826 -10.980 1.00 0.00 H new ATOM 1897 N VAL A 124 -4.412 -4.401 -8.090 1.00 0.00 N ATOM 1898 CA VAL A 124 -3.945 -5.729 -7.710 1.00 0.00 C ATOM 1899 C VAL A 124 -3.843 -6.643 -8.926 1.00 0.00 C ATOM 1900 O VAL A 124 -4.837 -6.910 -9.602 1.00 0.00 O ATOM 1901 CB VAL A 124 -4.879 -6.377 -6.671 1.00 0.00 C ATOM 1902 CG1 VAL A 124 -4.394 -7.774 -6.316 1.00 0.00 C ATOM 1903 CG2 VAL A 124 -4.977 -5.506 -5.427 1.00 0.00 C ATOM 0 H VAL A 124 -5.206 -4.062 -7.547 1.00 0.00 H new ATOM 0 HA VAL A 124 -2.956 -5.603 -7.269 1.00 0.00 H new ATOM 0 HB VAL A 124 -5.875 -6.463 -7.106 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -5.066 -8.217 -5.581 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -4.379 -8.393 -7.213 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -3.388 -7.715 -5.899 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -5.641 -5.979 -4.703 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -3.987 -5.387 -4.987 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -5.374 -4.528 -5.698 1.00 0.00 H new ATOM 1913 N THR A 125 -2.633 -7.123 -9.199 1.00 0.00 N ATOM 1914 CA THR A 125 -2.400 -8.007 -10.333 1.00 0.00 C ATOM 1915 C THR A 125 -1.242 -8.960 -10.059 1.00 0.00 C ATOM 1916 O THR A 125 -0.393 -8.690 -9.210 1.00 0.00 O ATOM 1917 CB THR A 125 -2.101 -7.209 -11.616 1.00 0.00 C ATOM 1918 OG1 THR A 125 -1.917 -8.104 -12.719 1.00 0.00 O ATOM 1919 CG2 THR A 125 -0.857 -6.350 -11.441 1.00 0.00 C ATOM 0 H THR A 125 -1.800 -6.914 -8.649 1.00 0.00 H new ATOM 0 HA THR A 125 -3.314 -8.583 -10.477 1.00 0.00 H new ATOM 0 HB THR A 125 -2.950 -6.556 -11.817 1.00 0.00 H new ATOM 0 HG1 THR A 125 -2.186 -7.659 -13.550 1.00 0.00 H new ATOM 0 HG21 THR A 125 -0.665 -5.796 -12.360 1.00 0.00 H new ATOM 0 HG22 THR A 125 -1.011 -5.650 -10.620 1.00 0.00 H new ATOM 0 HG23 THR A 125 -0.002 -6.989 -11.218 1.00 0.00 H new ATOM 1927 N GLU A 126 -1.214 -10.074 -10.784 1.00 0.00 N ATOM 1928 CA GLU A 126 -0.159 -11.067 -10.617 1.00 0.00 C ATOM 1929 C GLU A 126 0.775 -11.076 -11.824 1.00 0.00 C ATOM 1930 O GLU A 126 0.356 -11.375 -12.942 1.00 0.00 O ATOM 1931 CB GLU A 126 -0.763 -12.458 -10.415 1.00 0.00 C ATOM 1932 CG GLU A 126 0.194 -13.450 -9.777 1.00 0.00 C ATOM 1933 CD GLU A 126 -0.517 -14.666 -9.214 1.00 0.00 C ATOM 1934 OE1 GLU A 126 -1.734 -14.807 -9.453 1.00 0.00 O ATOM 1935 OE2 GLU A 126 0.146 -15.477 -8.533 1.00 0.00 O ATOM 0 H GLU A 126 -1.909 -10.311 -11.492 1.00 0.00 H new ATOM 0 HA GLU A 126 0.420 -10.799 -9.733 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.653 -12.371 -9.791 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -1.087 -12.848 -11.380 1.00 0.00 H new ATOM 0 HG2 GLU A 126 0.925 -13.772 -10.518 1.00 0.00 H new ATOM 0 HG3 GLU A 126 0.746 -12.954 -8.979 1.00 0.00 H new ATOM 1942 N GLU A 127 2.041 -10.747 -11.588 1.00 0.00 N ATOM 1943 CA GLU A 127 3.033 -10.716 -12.656 1.00 0.00 C ATOM 1944 C GLU A 127 4.364 -11.292 -12.179 1.00 0.00 C ATOM 1945 O GLU A 127 4.700 -11.210 -10.998 1.00 0.00 O ATOM 1946 CB GLU A 127 3.234 -9.284 -13.155 1.00 0.00 C ATOM 1947 CG GLU A 127 1.935 -8.555 -13.452 1.00 0.00 C ATOM 1948 CD GLU A 127 1.990 -7.768 -14.747 1.00 0.00 C ATOM 1949 OE1 GLU A 127 2.438 -6.602 -14.713 1.00 0.00 O ATOM 1950 OE2 GLU A 127 1.586 -8.316 -15.793 1.00 0.00 O ATOM 0 H GLU A 127 2.404 -10.498 -10.668 1.00 0.00 H new ATOM 0 HA GLU A 127 2.664 -11.330 -13.477 1.00 0.00 H new ATOM 0 HB2 GLU A 127 3.793 -8.722 -12.406 1.00 0.00 H new ATOM 0 HB3 GLU A 127 3.844 -9.305 -14.058 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.121 -9.278 -13.505 1.00 0.00 H new ATOM 0 HG3 GLU A 127 1.707 -7.878 -12.629 1.00 0.00 H new ATOM 1957 N ASP A 128 5.116 -11.874 -13.107 1.00 0.00 N ATOM 1958 CA ASP A 128 6.410 -12.464 -12.783 1.00 0.00 C ATOM 1959 C ASP A 128 7.409 -11.387 -12.371 1.00 0.00 C ATOM 1960 O ASP A 128 7.293 -10.231 -12.777 1.00 0.00 O ATOM 1961 CB ASP A 128 6.950 -13.249 -13.979 1.00 0.00 C ATOM 1962 CG ASP A 128 6.082 -14.442 -14.328 1.00 0.00 C ATOM 1963 OD1 ASP A 128 4.952 -14.231 -14.818 1.00 0.00 O ATOM 1964 OD2 ASP A 128 6.532 -15.586 -14.113 1.00 0.00 O ATOM 0 H ASP A 128 4.852 -11.950 -14.089 1.00 0.00 H new ATOM 0 HA ASP A 128 6.272 -13.146 -11.944 1.00 0.00 H new ATOM 0 HB2 ASP A 128 7.018 -12.588 -14.843 1.00 0.00 H new ATOM 0 HB3 ASP A 128 7.961 -13.591 -13.759 1.00 0.00 H new ATOM 1969 N TRP A 129 8.389 -11.775 -11.564 1.00 0.00 N ATOM 1970 CA TRP A 129 9.409 -10.843 -11.096 1.00 0.00 C ATOM 1971 C TRP A 129 10.139 -10.201 -12.271 1.00 0.00 C ATOM 1972 O TRP A 129 10.540 -9.040 -12.204 1.00 0.00 O ATOM 1973 CB TRP A 129 10.409 -11.561 -10.189 1.00 0.00 C ATOM 1974 CG TRP A 129 11.670 -10.784 -9.963 1.00 0.00 C ATOM 1975 CD1 TRP A 129 12.890 -11.019 -10.529 1.00 0.00 C ATOM 1976 CD2 TRP A 129 11.835 -9.647 -9.107 1.00 0.00 C ATOM 1977 NE1 TRP A 129 13.804 -10.097 -10.077 1.00 0.00 N ATOM 1978 CE2 TRP A 129 13.181 -9.244 -9.205 1.00 0.00 C ATOM 1979 CE3 TRP A 129 10.976 -8.930 -8.270 1.00 0.00 C ATOM 1980 CZ2 TRP A 129 13.686 -8.158 -8.496 1.00 0.00 C ATOM 1981 CZ3 TRP A 129 11.479 -7.852 -7.567 1.00 0.00 C ATOM 1982 CH2 TRP A 129 12.823 -7.473 -7.684 1.00 0.00 C ATOM 0 H TRP A 129 8.499 -12.729 -11.220 1.00 0.00 H new ATOM 0 HA TRP A 129 8.913 -10.057 -10.526 1.00 0.00 H new ATOM 0 HB2 TRP A 129 9.937 -11.762 -9.227 1.00 0.00 H new ATOM 0 HB3 TRP A 129 10.659 -12.526 -10.629 1.00 0.00 H new ATOM 0 HD1 TRP A 129 13.105 -11.813 -11.229 1.00 0.00 H new ATOM 0 HE1 TRP A 129 14.787 -10.055 -10.347 1.00 0.00 H new ATOM 0 HE3 TRP A 129 9.938 -9.213 -8.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 129 14.722 -7.866 -8.583 1.00 0.00 H new ATOM 0 HZ3 TRP A 129 10.825 -7.292 -6.916 1.00 0.00 H new ATOM 0 HH2 TRP A 129 13.185 -6.624 -7.123 1.00 0.00 H new ATOM 1993 N GLU A 130 10.308 -10.965 -13.346 1.00 0.00 N ATOM 1994 CA GLU A 130 10.991 -10.469 -14.535 1.00 0.00 C ATOM 1995 C GLU A 130 10.113 -9.479 -15.294 1.00 0.00 C ATOM 1996 O GLU A 130 10.556 -8.845 -16.252 1.00 0.00 O ATOM 1997 CB GLU A 130 11.377 -11.632 -15.451 1.00 0.00 C ATOM 1998 CG GLU A 130 11.996 -12.808 -14.714 1.00 0.00 C ATOM 1999 CD GLU A 130 13.252 -13.324 -15.390 1.00 0.00 C ATOM 2000 OE1 GLU A 130 14.349 -12.825 -15.062 1.00 0.00 O ATOM 2001 OE2 GLU A 130 13.138 -14.226 -16.246 1.00 0.00 O ATOM 0 H GLU A 130 9.982 -11.929 -13.418 1.00 0.00 H new ATOM 0 HA GLU A 130 11.896 -9.953 -14.214 1.00 0.00 H new ATOM 0 HB2 GLU A 130 10.489 -11.974 -15.983 1.00 0.00 H new ATOM 0 HB3 GLU A 130 12.081 -11.274 -16.202 1.00 0.00 H new ATOM 0 HG2 GLU A 130 12.234 -12.508 -13.694 1.00 0.00 H new ATOM 0 HG3 GLU A 130 11.266 -13.615 -14.647 1.00 0.00 H new ATOM 2008 N THR A 131 8.863 -9.351 -14.859 1.00 0.00 N ATOM 2009 CA THR A 131 7.921 -8.441 -15.497 1.00 0.00 C ATOM 2010 C THR A 131 7.818 -7.128 -14.728 1.00 0.00 C ATOM 2011 O THR A 131 7.616 -6.067 -15.319 1.00 0.00 O ATOM 2012 CB THR A 131 6.519 -9.069 -15.607 1.00 0.00 C ATOM 2013 OG1 THR A 131 6.578 -10.265 -16.392 1.00 0.00 O ATOM 2014 CG2 THR A 131 5.536 -8.093 -16.235 1.00 0.00 C ATOM 0 H THR A 131 8.480 -9.867 -14.067 1.00 0.00 H new ATOM 0 HA THR A 131 8.302 -8.244 -16.499 1.00 0.00 H new ATOM 0 HB THR A 131 6.174 -9.311 -14.602 1.00 0.00 H new ATOM 0 HG1 THR A 131 5.683 -10.659 -16.456 1.00 0.00 H new ATOM 0 HG21 THR A 131 4.553 -8.559 -16.302 1.00 0.00 H new ATOM 0 HG22 THR A 131 5.471 -7.196 -15.620 1.00 0.00 H new ATOM 0 HG23 THR A 131 5.879 -7.824 -17.234 1.00 0.00 H new ATOM 2022 N ILE A 132 7.959 -7.208 -13.410 1.00 0.00 N ATOM 2023 CA ILE A 132 7.884 -6.025 -12.561 1.00 0.00 C ATOM 2024 C ILE A 132 9.275 -5.485 -12.246 1.00 0.00 C ATOM 2025 O ILE A 132 9.426 -4.337 -11.828 1.00 0.00 O ATOM 2026 CB ILE A 132 7.151 -6.326 -11.240 1.00 0.00 C ATOM 2027 CG1 ILE A 132 5.819 -7.024 -11.518 1.00 0.00 C ATOM 2028 CG2 ILE A 132 6.929 -5.042 -10.454 1.00 0.00 C ATOM 2029 CD1 ILE A 132 5.305 -7.833 -10.348 1.00 0.00 C ATOM 0 H ILE A 132 8.126 -8.079 -12.906 1.00 0.00 H new ATOM 0 HA ILE A 132 7.322 -5.273 -13.116 1.00 0.00 H new ATOM 0 HB ILE A 132 7.771 -6.993 -10.641 1.00 0.00 H new ATOM 0 HG12 ILE A 132 5.074 -6.275 -11.786 1.00 0.00 H new ATOM 0 HG13 ILE A 132 5.935 -7.681 -12.380 1.00 0.00 H new ATOM 0 HG21 ILE A 132 6.410 -5.270 -9.523 1.00 0.00 H new ATOM 0 HG22 ILE A 132 7.891 -4.582 -10.230 1.00 0.00 H new ATOM 0 HG23 ILE A 132 6.326 -4.353 -11.046 1.00 0.00 H new ATOM 0 HD11 ILE A 132 4.357 -8.300 -10.617 1.00 0.00 H new ATOM 0 HD12 ILE A 132 6.030 -8.606 -10.093 1.00 0.00 H new ATOM 0 HD13 ILE A 132 5.156 -7.178 -9.490 1.00 0.00 H new ATOM 2041 N TYR A 133 10.288 -6.319 -12.452 1.00 0.00 N ATOM 2042 CA TYR A 133 11.667 -5.926 -12.189 1.00 0.00 C ATOM 2043 C TYR A 133 12.015 -4.635 -12.924 1.00 0.00 C ATOM 2044 O TYR A 133 12.437 -3.645 -12.327 1.00 0.00 O ATOM 2045 CB TYR A 133 12.626 -7.041 -12.611 1.00 0.00 C ATOM 2046 CG TYR A 133 13.991 -6.540 -13.027 1.00 0.00 C ATOM 2047 CD1 TYR A 133 14.704 -5.659 -12.223 1.00 0.00 C ATOM 2048 CD2 TYR A 133 14.567 -6.946 -14.224 1.00 0.00 C ATOM 2049 CE1 TYR A 133 15.951 -5.198 -12.599 1.00 0.00 C ATOM 2050 CE2 TYR A 133 15.814 -6.492 -14.607 1.00 0.00 C ATOM 2051 CZ TYR A 133 16.502 -5.618 -13.792 1.00 0.00 C ATOM 2052 OH TYR A 133 17.744 -5.162 -14.171 1.00 0.00 O ATOM 0 H TYR A 133 10.180 -7.272 -12.800 1.00 0.00 H new ATOM 0 HA TYR A 133 11.771 -5.752 -11.118 1.00 0.00 H new ATOM 0 HB2 TYR A 133 12.742 -7.742 -11.784 1.00 0.00 H new ATOM 0 HB3 TYR A 133 12.184 -7.595 -13.439 1.00 0.00 H new ATOM 0 HD1 TYR A 133 14.276 -5.329 -11.288 1.00 0.00 H new ATOM 0 HD2 TYR A 133 14.030 -7.629 -14.866 1.00 0.00 H new ATOM 0 HE1 TYR A 133 16.491 -4.513 -11.963 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.248 -6.820 -15.540 1.00 0.00 H new ATOM 0 HH TYR A 133 17.987 -5.554 -15.036 1.00 0.00 H new ATOM 2062 N PRO A 134 11.833 -4.645 -14.253 1.00 0.00 N ATOM 2063 CA PRO A 134 12.120 -3.483 -15.100 1.00 0.00 C ATOM 2064 C PRO A 134 11.443 -2.215 -14.592 1.00 0.00 C ATOM 2065 O PRO A 134 12.070 -1.158 -14.503 1.00 0.00 O ATOM 2066 CB PRO A 134 11.548 -3.887 -16.461 1.00 0.00 C ATOM 2067 CG PRO A 134 11.599 -5.375 -16.468 1.00 0.00 C ATOM 2068 CD PRO A 134 11.333 -5.791 -15.031 1.00 0.00 C ATOM 0 HA PRO A 134 13.184 -3.247 -15.123 1.00 0.00 H new ATOM 0 HB2 PRO A 134 10.527 -3.526 -16.584 1.00 0.00 H new ATOM 0 HB3 PRO A 134 12.135 -3.467 -17.278 1.00 0.00 H new ATOM 0 HG2 PRO A 134 10.851 -5.791 -17.143 1.00 0.00 H new ATOM 0 HG3 PRO A 134 12.570 -5.734 -16.808 1.00 0.00 H new ATOM 0 HD2 PRO A 134 10.272 -5.967 -14.852 1.00 0.00 H new ATOM 0 HD3 PRO A 134 11.857 -6.712 -14.774 1.00 0.00 H new ATOM 2076 N CYS A 135 10.162 -2.326 -14.261 1.00 0.00 N ATOM 2077 CA CYS A 135 9.399 -1.187 -13.762 1.00 0.00 C ATOM 2078 C CYS A 135 9.011 -1.390 -12.301 1.00 0.00 C ATOM 2079 O CYS A 135 7.828 -1.447 -11.963 1.00 0.00 O ATOM 2080 CB CYS A 135 8.145 -0.975 -14.610 1.00 0.00 C ATOM 2081 SG CYS A 135 8.452 -0.967 -16.392 1.00 0.00 S ATOM 0 H CYS A 135 9.629 -3.193 -14.329 1.00 0.00 H new ATOM 0 HA CYS A 135 10.030 -0.301 -13.832 1.00 0.00 H new ATOM 0 HB2 CYS A 135 7.426 -1.761 -14.379 1.00 0.00 H new ATOM 0 HB3 CYS A 135 7.684 -0.029 -14.327 1.00 0.00 H new ATOM 0 HG CYS A 135 7.331 -0.783 -17.025 1.00 0.00 H new ATOM 2087 N LEU A 136 10.015 -1.501 -11.437 1.00 0.00 N ATOM 2088 CA LEU A 136 9.779 -1.700 -10.012 1.00 0.00 C ATOM 2089 C LEU A 136 9.591 -0.364 -9.299 1.00 0.00 C ATOM 2090 O LEU A 136 9.863 0.696 -9.864 1.00 0.00 O ATOM 2091 CB LEU A 136 10.945 -2.466 -9.384 1.00 0.00 C ATOM 2092 CG LEU A 136 10.636 -3.884 -8.905 1.00 0.00 C ATOM 2093 CD1 LEU A 136 11.845 -4.488 -8.207 1.00 0.00 C ATOM 2094 CD2 LEU A 136 9.428 -3.883 -7.979 1.00 0.00 C ATOM 0 H LEU A 136 11.000 -1.456 -11.699 1.00 0.00 H new ATOM 0 HA LEU A 136 8.865 -2.283 -9.898 1.00 0.00 H new ATOM 0 HB2 LEU A 136 11.754 -2.518 -10.113 1.00 0.00 H new ATOM 0 HB3 LEU A 136 11.317 -1.891 -8.536 1.00 0.00 H new ATOM 0 HG LEU A 136 10.401 -4.497 -9.775 1.00 0.00 H new ATOM 0 HD11 LEU A 136 11.606 -5.498 -7.873 1.00 0.00 H new ATOM 0 HD12 LEU A 136 12.685 -4.525 -8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.112 -3.875 -7.346 1.00 0.00 H new ATOM 0 HD21 LEU A 136 9.223 -4.901 -7.648 1.00 0.00 H new ATOM 0 HD22 LEU A 136 9.634 -3.254 -7.113 1.00 0.00 H new ATOM 0 HD23 LEU A 136 8.561 -3.493 -8.512 1.00 0.00 H new ATOM 2106 N SER A 137 9.127 -0.423 -8.055 1.00 0.00 N ATOM 2107 CA SER A 137 8.901 0.782 -7.266 1.00 0.00 C ATOM 2108 C SER A 137 10.110 1.090 -6.387 1.00 0.00 C ATOM 2109 O SER A 137 10.945 0.229 -6.112 1.00 0.00 O ATOM 2110 CB SER A 137 7.652 0.621 -6.397 1.00 0.00 C ATOM 2111 OG SER A 137 7.899 1.043 -5.066 1.00 0.00 O ATOM 0 H SER A 137 8.900 -1.292 -7.572 1.00 0.00 H new ATOM 0 HA SER A 137 8.752 1.615 -7.953 1.00 0.00 H new ATOM 0 HB2 SER A 137 6.833 1.203 -6.820 1.00 0.00 H new ATOM 0 HB3 SER A 137 7.336 -0.422 -6.398 1.00 0.00 H new ATOM 0 HG SER A 137 7.991 0.259 -4.486 1.00 0.00 H new ATOM 2117 N PRO A 138 10.206 2.350 -5.936 1.00 0.00 N ATOM 2118 CA PRO A 138 11.308 2.802 -5.081 1.00 0.00 C ATOM 2119 C PRO A 138 11.240 2.201 -3.681 1.00 0.00 C ATOM 2120 O PRO A 138 10.309 2.472 -2.923 1.00 0.00 O ATOM 2121 CB PRO A 138 11.112 4.319 -5.022 1.00 0.00 C ATOM 2122 CG PRO A 138 9.659 4.523 -5.278 1.00 0.00 C ATOM 2123 CD PRO A 138 9.247 3.429 -6.224 1.00 0.00 C ATOM 0 HA PRO A 138 12.279 2.499 -5.473 1.00 0.00 H new ATOM 0 HB2 PRO A 138 11.403 4.718 -4.050 1.00 0.00 H new ATOM 0 HB3 PRO A 138 11.721 4.826 -5.770 1.00 0.00 H new ATOM 0 HG2 PRO A 138 9.089 4.472 -4.351 1.00 0.00 H new ATOM 0 HG3 PRO A 138 9.474 5.505 -5.713 1.00 0.00 H new ATOM 0 HD2 PRO A 138 8.219 3.111 -6.048 1.00 0.00 H new ATOM 0 HD3 PRO A 138 9.306 3.753 -7.263 1.00 0.00 H new ATOM 2131 N LYS A 139 12.233 1.385 -3.344 1.00 0.00 N ATOM 2132 CA LYS A 139 12.288 0.747 -2.034 1.00 0.00 C ATOM 2133 C LYS A 139 13.173 1.541 -1.078 1.00 0.00 C ATOM 2134 O LYS A 139 14.145 2.170 -1.496 1.00 0.00 O ATOM 2135 CB LYS A 139 12.813 -0.684 -2.163 1.00 0.00 C ATOM 2136 CG LYS A 139 11.741 -1.696 -2.529 1.00 0.00 C ATOM 2137 CD LYS A 139 12.306 -3.104 -2.605 1.00 0.00 C ATOM 2138 CE LYS A 139 12.591 -3.666 -1.221 1.00 0.00 C ATOM 2139 NZ LYS A 139 13.110 -5.060 -1.284 1.00 0.00 N ATOM 0 H LYS A 139 13.011 1.150 -3.960 1.00 0.00 H new ATOM 0 HA LYS A 139 11.277 0.721 -1.627 1.00 0.00 H new ATOM 0 HB2 LYS A 139 13.596 -0.707 -2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 139 13.273 -0.980 -1.220 1.00 0.00 H new ATOM 0 HG2 LYS A 139 10.941 -1.663 -1.789 1.00 0.00 H new ATOM 0 HG3 LYS A 139 11.299 -1.428 -3.489 1.00 0.00 H new ATOM 0 HD2 LYS A 139 11.600 -3.753 -3.124 1.00 0.00 H new ATOM 0 HD3 LYS A 139 13.224 -3.097 -3.192 1.00 0.00 H new ATOM 0 HE2 LYS A 139 13.317 -3.031 -0.714 1.00 0.00 H new ATOM 0 HE3 LYS A 139 11.678 -3.645 -0.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 13.292 -5.407 -0.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 12.407 -5.672 -1.745 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 13.995 -5.077 -1.830 1.00 0.00 H new ATOM 2153 N SER A 140 12.830 1.506 0.206 1.00 0.00 N ATOM 2154 CA SER A 140 13.593 2.224 1.220 1.00 0.00 C ATOM 2155 C SER A 140 13.788 1.363 2.464 1.00 0.00 C ATOM 2156 O SER A 140 12.918 0.573 2.828 1.00 0.00 O ATOM 2157 CB SER A 140 12.883 3.527 1.594 1.00 0.00 C ATOM 2158 OG SER A 140 13.706 4.338 2.414 1.00 0.00 O ATOM 0 H SER A 140 12.029 0.988 0.568 1.00 0.00 H new ATOM 0 HA SER A 140 14.573 2.458 0.804 1.00 0.00 H new ATOM 0 HB2 SER A 140 12.616 4.072 0.689 1.00 0.00 H new ATOM 0 HB3 SER A 140 11.953 3.301 2.116 1.00 0.00 H new ATOM 0 HG SER A 140 13.386 4.298 3.339 1.00 0.00 H new