USER MOD reduce.3.24.130724 H: found=0, std=0, add=1327, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1324 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 120 THR OG1 : rot -62:sc= 1.84 USER MOD Set 1.2: A 134 SER OG : rot 90:sc= 0.976 USER MOD Set 2.1: A 92 HIS : no HE2:sc= -0.0575 K(o=-1.3,f=-2.9) USER MOD Set 2.2: A 94 MET CE :methyl -171:sc= -1.27 (180deg=-1.41) USER MOD Set 3.1: A 43 SER OG : rot -110:sc= 0.0872 USER MOD Set 3.2: A 63 TYR OH : rot 30:sc= 0.0842 USER MOD Set 4.1: A 48 HIS : no HD1:sc= -0.403 X(o=-0.45,f=-0.42) USER MOD Set 4.2: A 166 MET CE :methyl -171:sc= -0.0468 (180deg=-0.176) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 146:sc=-0.00136 (180deg=-1.71) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 20 MET CE :methyl -169:sc= -0.0718 (180deg=-0.155) USER MOD Single : A 22 THR OG1 : rot -170:sc= 0.263 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= 1.14 K(o=1.1,f=-3.5!) USER MOD Single : A 33 GLN : amide:sc= 0.623 K(o=0.62,f=-0.048) USER MOD Single : A 35 GLN : amide:sc= 1.14 K(o=1.1,f=-0.55) USER MOD Single : A 36 GLN : amide:sc= -0.0841 X(o=-0.084,f=-0.056) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot -125:sc= 0.76 USER MOD Single : A 45 CYS SG : rot 20:sc= 0.0903 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -153:sc= 1.69 USER MOD Single : A 62 ASN : amide:sc= -0.0954 X(o=-0.095,f=-0.48) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 173:sc= 0.0106 USER MOD Single : A 71 TYR OH : rot -15:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00204) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= -0.0835 X(o=-0.083,f=-0.2) USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-2.4!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.108 K(o=-0.11,f=-0.75) USER MOD Single : A 96 ASN : amide:sc= 0.947 K(o=0.95,f=0.0075) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 0.982 K(o=0.98,f=0) USER MOD Single : A 113 HIS : no HE2:sc= -0.222 K(o=-0.22,f=-2.9!) USER MOD Single : A 121 GLN : amide:sc= 0.397 K(o=0.4,f=-5.9!) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -164:sc= -0.17 (180deg=-0.566) USER MOD Single : A 136 SER OG : rot 86:sc= 1.31 USER MOD Single : A 138 CYS SG : rot -79:sc= 0.0768 USER MOD Single : A 139 SER OG : rot 38:sc= 0.0256 USER MOD Single : A 147 SER OG : rot 74:sc= 0.559 USER MOD Single : A 151 GLN : amide:sc= 0.76 K(o=0.76,f=-0.23) USER MOD Single : A 153 LYS NZ :NH3+ 174:sc= 0.714 (180deg=0.63) USER MOD Single : A 154 MET CE :methyl -129:sc= 0 (180deg=-0.269) USER MOD Single : A 155 GLN : amide:sc= -0.6 X(o=-0.6,f=-0.6) USER MOD Single : A 161 SER OG : rot -65:sc= 1.26 USER MOD Single : A 163 MET CE :methyl -166:sc= -0.539 (180deg=-0.963) USER MOD Single : A 169 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 128 N TRP A 9 -3.064 18.911 9.663 1.00 0.95 N ATOM 129 CA TRP A 9 -3.442 18.068 8.529 1.00 0.91 C ATOM 130 C TRP A 9 -3.565 16.613 8.982 1.00 0.80 C ATOM 131 O TRP A 9 -4.569 15.960 8.704 1.00 0.70 O ATOM 132 CB TRP A 9 -2.390 18.221 7.420 1.00 1.06 C ATOM 133 CG TRP A 9 -2.604 17.376 6.200 1.00 1.08 C ATOM 134 CD1 TRP A 9 -3.352 17.725 5.131 1.00 2.18 C ATOM 135 CD2 TRP A 9 -2.080 16.043 5.898 1.00 1.78 C ATOM 136 NE1 TRP A 9 -3.333 16.711 4.194 1.00 1.74 N ATOM 137 CE2 TRP A 9 -2.580 15.639 4.623 1.00 1.42 C ATOM 138 CE3 TRP A 9 -1.233 15.131 6.570 1.00 3.62 C ATOM 139 CZ2 TRP A 9 -2.287 14.389 4.059 1.00 2.46 C ATOM 140 CZ3 TRP A 9 -0.919 13.881 6.003 1.00 4.92 C ATOM 141 CH2 TRP A 9 -1.453 13.501 4.759 1.00 4.30 C ATOM 0 HA TRP A 9 -4.411 18.378 8.136 1.00 0.91 H new ATOM 0 HB2 TRP A 9 -2.360 19.267 7.114 1.00 1.06 H new ATOM 0 HB3 TRP A 9 -1.412 17.983 7.837 1.00 1.06 H new ATOM 0 HD1 TRP A 9 -3.885 18.658 5.025 1.00 2.18 H new ATOM 0 HE1 TRP A 9 -3.816 16.750 3.296 1.00 1.74 H new ATOM 0 HE3 TRP A 9 -0.821 15.397 7.532 1.00 3.62 H new ATOM 0 HZ2 TRP A 9 -2.697 14.112 3.099 1.00 2.46 H new ATOM 0 HZ3 TRP A 9 -0.260 13.206 6.530 1.00 4.92 H new ATOM 0 HH2 TRP A 9 -1.223 12.531 4.343 1.00 4.30 H new ATOM 152 N ARG A 10 -2.597 16.139 9.774 1.00 0.85 N ATOM 153 CA ARG A 10 -2.620 14.804 10.373 1.00 0.79 C ATOM 154 C ARG A 10 -3.811 14.646 11.328 1.00 0.69 C ATOM 155 O ARG A 10 -4.511 13.641 11.266 1.00 0.61 O ATOM 156 CB ARG A 10 -1.261 14.529 11.043 1.00 0.97 C ATOM 157 CG ARG A 10 -1.160 13.115 11.631 1.00 0.88 C ATOM 158 CD ARG A 10 -1.404 13.016 13.139 1.00 1.71 C ATOM 159 NE ARG A 10 -0.285 13.588 13.906 1.00 2.13 N ATOM 160 CZ ARG A 10 -0.059 13.417 15.203 1.00 2.63 C ATOM 161 NH1 ARG A 10 -0.880 12.727 15.969 1.00 3.31 N ATOM 162 NH2 ARG A 10 1.016 13.937 15.752 1.00 3.73 N ATOM 0 H ARG A 10 -1.767 16.679 10.019 1.00 0.85 H new ATOM 0 HA ARG A 10 -2.766 14.051 9.599 1.00 0.79 H new ATOM 0 HB2 ARG A 10 -0.466 14.670 10.311 1.00 0.97 H new ATOM 0 HB3 ARG A 10 -1.098 15.259 11.836 1.00 0.97 H new ATOM 0 HG2 ARG A 10 -1.879 12.474 11.120 1.00 0.88 H new ATOM 0 HG3 ARG A 10 -0.168 12.718 11.413 1.00 0.88 H new ATOM 0 HD2 ARG A 10 -2.326 13.538 13.394 1.00 1.71 H new ATOM 0 HD3 ARG A 10 -1.542 11.971 13.418 1.00 1.71 H new ATOM 0 HE ARG A 10 0.378 14.169 13.393 1.00 2.13 H new ATOM 0 HH11 ARG A 10 -1.718 12.306 15.569 1.00 3.31 H new ATOM 0 HH12 ARG A 10 -0.677 12.614 16.962 1.00 3.31 H new ATOM 0 HH21 ARG A 10 1.673 14.470 15.182 1.00 3.73 H new ATOM 0 HH22 ARG A 10 1.193 13.808 16.748 1.00 3.73 H new ATOM 176 N ARG A 11 -4.107 15.655 12.156 1.00 0.74 N ATOM 177 CA ARG A 11 -5.246 15.653 13.091 1.00 0.72 C ATOM 178 C ARG A 11 -6.586 15.596 12.353 1.00 0.61 C ATOM 179 O ARG A 11 -7.471 14.828 12.737 1.00 0.60 O ATOM 180 CB ARG A 11 -5.179 16.902 13.997 1.00 0.82 C ATOM 181 CG ARG A 11 -5.486 16.593 15.463 1.00 1.56 C ATOM 182 CD ARG A 11 -6.959 16.285 15.775 1.00 2.36 C ATOM 183 NE ARG A 11 -7.088 15.161 16.723 1.00 3.67 N ATOM 184 CZ ARG A 11 -7.654 13.978 16.501 1.00 5.10 C ATOM 185 NH1 ARG A 11 -8.124 13.624 15.323 1.00 5.95 N ATOM 186 NH2 ARG A 11 -7.759 13.115 17.487 1.00 6.30 N ATOM 0 H ARG A 11 -3.555 16.511 12.198 1.00 0.74 H new ATOM 0 HA ARG A 11 -5.177 14.756 13.706 1.00 0.72 H new ATOM 0 HB2 ARG A 11 -4.185 17.344 13.925 1.00 0.82 H new ATOM 0 HB3 ARG A 11 -5.886 17.647 13.632 1.00 0.82 H new ATOM 0 HG2 ARG A 11 -4.880 15.741 15.772 1.00 1.56 H new ATOM 0 HG3 ARG A 11 -5.173 17.443 16.070 1.00 1.56 H new ATOM 0 HD2 ARG A 11 -7.436 17.171 16.193 1.00 2.36 H new ATOM 0 HD3 ARG A 11 -7.485 16.045 14.851 1.00 2.36 H new ATOM 0 HE ARG A 11 -6.699 15.308 17.654 1.00 3.67 H new ATOM 0 HH11 ARG A 11 -8.062 14.268 14.535 1.00 5.95 H new ATOM 0 HH12 ARG A 11 -8.550 12.706 15.199 1.00 5.95 H new ATOM 0 HH21 ARG A 11 -7.408 13.355 18.414 1.00 6.30 H new ATOM 0 HH22 ARG A 11 -8.192 12.206 17.325 1.00 6.30 H new ATOM 200 N THR A 12 -6.708 16.386 11.285 1.00 0.58 N ATOM 201 CA THR A 12 -7.881 16.459 10.395 1.00 0.57 C ATOM 202 C THR A 12 -8.107 15.135 9.682 1.00 0.52 C ATOM 203 O THR A 12 -9.229 14.636 9.672 1.00 0.54 O ATOM 204 CB THR A 12 -7.715 17.604 9.384 1.00 0.65 C ATOM 205 OG1 THR A 12 -7.594 18.815 10.094 1.00 0.72 O ATOM 206 CG2 THR A 12 -8.917 17.736 8.445 1.00 0.76 C ATOM 0 H THR A 12 -5.963 17.022 10.999 1.00 0.58 H new ATOM 0 HA THR A 12 -8.761 16.663 11.005 1.00 0.57 H new ATOM 0 HB THR A 12 -6.832 17.385 8.784 1.00 0.65 H new ATOM 0 HG1 THR A 12 -7.486 19.556 9.461 1.00 0.72 H new ATOM 0 HG21 THR A 12 -8.748 18.560 7.751 1.00 0.76 H new ATOM 0 HG22 THR A 12 -9.044 16.810 7.885 1.00 0.76 H new ATOM 0 HG23 THR A 12 -9.816 17.933 9.030 1.00 0.76 H new ATOM 214 N MET A 13 -7.047 14.529 9.142 1.00 0.53 N ATOM 215 CA MET A 13 -7.138 13.218 8.494 1.00 0.54 C ATOM 216 C MET A 13 -7.479 12.131 9.512 1.00 0.48 C ATOM 217 O MET A 13 -8.358 11.326 9.238 1.00 0.47 O ATOM 218 CB MET A 13 -5.862 12.894 7.694 1.00 0.69 C ATOM 219 CG MET A 13 -6.148 12.748 6.190 1.00 1.08 C ATOM 220 SD MET A 13 -7.036 14.097 5.351 1.00 1.54 S ATOM 221 CE MET A 13 -6.064 15.532 5.865 1.00 1.28 C ATOM 0 H MET A 13 -6.109 14.929 9.141 1.00 0.53 H new ATOM 0 HA MET A 13 -7.955 13.251 7.773 1.00 0.54 H new ATOM 0 HB2 MET A 13 -5.127 13.684 7.848 1.00 0.69 H new ATOM 0 HB3 MET A 13 -5.422 11.971 8.071 1.00 0.69 H new ATOM 0 HG2 MET A 13 -5.194 12.610 5.681 1.00 1.08 H new ATOM 0 HG3 MET A 13 -6.721 11.832 6.047 1.00 1.08 H new ATOM 0 HE1 MET A 13 -6.045 16.266 5.060 1.00 1.28 H new ATOM 0 HE2 MET A 13 -6.514 15.978 6.752 1.00 1.28 H new ATOM 0 HE3 MET A 13 -5.045 15.218 6.094 1.00 1.28 H new ATOM 231 N LEU A 14 -6.903 12.157 10.715 1.00 0.52 N ATOM 232 CA LEU A 14 -7.227 11.224 11.800 1.00 0.58 C ATOM 233 C LEU A 14 -8.708 11.314 12.192 1.00 0.55 C ATOM 234 O LEU A 14 -9.358 10.287 12.375 1.00 0.58 O ATOM 235 CB LEU A 14 -6.261 11.497 12.971 1.00 0.77 C ATOM 236 CG LEU A 14 -6.463 10.650 14.242 1.00 1.26 C ATOM 237 CD1 LEU A 14 -6.497 9.142 13.978 1.00 2.51 C ATOM 238 CD2 LEU A 14 -5.318 10.952 15.223 1.00 2.10 C ATOM 0 H LEU A 14 -6.186 12.837 10.969 1.00 0.52 H new ATOM 0 HA LEU A 14 -7.088 10.193 11.475 1.00 0.58 H new ATOM 0 HB2 LEU A 14 -5.242 11.341 12.616 1.00 0.77 H new ATOM 0 HB3 LEU A 14 -6.346 12.549 13.245 1.00 0.77 H new ATOM 0 HG LEU A 14 -7.436 10.922 14.652 1.00 1.26 H new ATOM 0 HD11 LEU A 14 -6.642 8.611 14.919 1.00 2.51 H new ATOM 0 HD12 LEU A 14 -7.318 8.910 13.300 1.00 2.51 H new ATOM 0 HD13 LEU A 14 -5.555 8.830 13.527 1.00 2.51 H new ATOM 0 HD21 LEU A 14 -5.448 10.359 16.128 1.00 2.10 H new ATOM 0 HD22 LEU A 14 -4.365 10.700 14.758 1.00 2.10 H new ATOM 0 HD23 LEU A 14 -5.328 12.011 15.479 1.00 2.10 H new ATOM 250 N LEU A 15 -9.271 12.526 12.248 1.00 0.53 N ATOM 251 CA LEU A 15 -10.691 12.765 12.519 1.00 0.57 C ATOM 252 C LEU A 15 -11.571 12.237 11.369 1.00 0.55 C ATOM 253 O LEU A 15 -12.581 11.590 11.639 1.00 0.65 O ATOM 254 CB LEU A 15 -10.849 14.270 12.838 1.00 0.62 C ATOM 255 CG LEU A 15 -12.075 14.709 13.665 1.00 0.82 C ATOM 256 CD1 LEU A 15 -13.366 14.641 12.852 1.00 0.91 C ATOM 257 CD2 LEU A 15 -12.241 13.916 14.970 1.00 0.95 C ATOM 0 H LEU A 15 -8.741 13.385 12.103 1.00 0.53 H new ATOM 0 HA LEU A 15 -11.045 12.206 13.385 1.00 0.57 H new ATOM 0 HB2 LEU A 15 -9.954 14.595 13.369 1.00 0.62 H new ATOM 0 HB3 LEU A 15 -10.873 14.811 11.892 1.00 0.62 H new ATOM 0 HG LEU A 15 -11.880 15.747 13.934 1.00 0.82 H new ATOM 0 HD11 LEU A 15 -14.204 14.958 13.473 1.00 0.91 H new ATOM 0 HD12 LEU A 15 -13.286 15.299 11.986 1.00 0.91 H new ATOM 0 HD13 LEU A 15 -13.531 13.617 12.516 1.00 0.91 H new ATOM 0 HD21 LEU A 15 -13.121 14.274 15.504 1.00 0.95 H new ATOM 0 HD22 LEU A 15 -12.362 12.857 14.740 1.00 0.95 H new ATOM 0 HD23 LEU A 15 -11.358 14.053 15.594 1.00 0.95 H new ATOM 269 N ARG A 16 -11.149 12.391 10.104 1.00 0.51 N ATOM 270 CA ARG A 16 -11.802 11.772 8.933 1.00 0.58 C ATOM 271 C ARG A 16 -11.727 10.234 8.969 1.00 0.59 C ATOM 272 O ARG A 16 -12.742 9.568 8.776 1.00 0.70 O ATOM 273 CB ARG A 16 -11.164 12.290 7.633 1.00 0.61 C ATOM 274 CG ARG A 16 -11.558 13.730 7.268 1.00 0.71 C ATOM 275 CD ARG A 16 -10.448 14.371 6.423 1.00 0.74 C ATOM 276 NE ARG A 16 -10.957 15.360 5.454 1.00 1.38 N ATOM 277 CZ ARG A 16 -10.965 15.226 4.129 1.00 1.55 C ATOM 278 NH1 ARG A 16 -10.637 14.107 3.526 1.00 2.73 N ATOM 279 NH2 ARG A 16 -11.310 16.240 3.365 1.00 2.43 N ATOM 0 H ARG A 16 -10.335 12.955 9.860 1.00 0.51 H new ATOM 0 HA ARG A 16 -12.854 12.054 8.967 1.00 0.58 H new ATOM 0 HB2 ARG A 16 -10.079 12.235 7.727 1.00 0.61 H new ATOM 0 HB3 ARG A 16 -11.447 11.629 6.814 1.00 0.61 H new ATOM 0 HG2 ARG A 16 -12.497 13.731 6.714 1.00 0.71 H new ATOM 0 HG3 ARG A 16 -11.722 14.313 8.174 1.00 0.71 H new ATOM 0 HD2 ARG A 16 -9.730 14.856 7.084 1.00 0.74 H new ATOM 0 HD3 ARG A 16 -9.910 13.589 5.887 1.00 0.74 H new ATOM 0 HE ARG A 16 -11.338 16.227 5.834 1.00 1.38 H new ATOM 0 HH11 ARG A 16 -10.361 13.293 4.076 1.00 2.73 H new ATOM 0 HH12 ARG A 16 -10.658 14.051 2.508 1.00 2.73 H new ATOM 0 HH21 ARG A 16 -11.572 17.131 3.787 1.00 2.43 H new ATOM 0 HH22 ARG A 16 -11.315 16.135 2.350 1.00 2.43 H new ATOM 293 N PHE A 17 -10.562 9.650 9.268 1.00 0.52 N ATOM 294 CA PHE A 17 -10.347 8.201 9.363 1.00 0.56 C ATOM 295 C PHE A 17 -11.156 7.579 10.514 1.00 0.66 C ATOM 296 O PHE A 17 -11.731 6.505 10.344 1.00 0.73 O ATOM 297 CB PHE A 17 -8.843 7.902 9.495 1.00 0.53 C ATOM 298 CG PHE A 17 -8.034 8.059 8.214 1.00 0.51 C ATOM 299 CD1 PHE A 17 -8.318 7.264 7.087 1.00 1.62 C ATOM 300 CD2 PHE A 17 -6.934 8.938 8.171 1.00 1.71 C ATOM 301 CE1 PHE A 17 -7.519 7.357 5.932 1.00 1.64 C ATOM 302 CE2 PHE A 17 -6.121 9.021 7.029 1.00 1.73 C ATOM 303 CZ PHE A 17 -6.419 8.236 5.902 1.00 0.64 C ATOM 0 H PHE A 17 -9.716 10.188 9.456 1.00 0.52 H new ATOM 0 HA PHE A 17 -10.710 7.738 8.446 1.00 0.56 H new ATOM 0 HB2 PHE A 17 -8.423 8.562 10.254 1.00 0.53 H new ATOM 0 HB3 PHE A 17 -8.723 6.882 9.859 1.00 0.53 H new ATOM 0 HD1 PHE A 17 -9.153 6.579 7.109 1.00 1.62 H new ATOM 0 HD2 PHE A 17 -6.713 9.557 9.028 1.00 1.71 H new ATOM 0 HE1 PHE A 17 -7.750 6.753 5.067 1.00 1.64 H new ATOM 0 HE2 PHE A 17 -5.270 9.686 7.017 1.00 1.73 H new ATOM 0 HZ PHE A 17 -5.806 8.307 5.015 1.00 0.64 H new ATOM 313 N GLN A 18 -11.283 8.284 11.643 1.00 0.72 N ATOM 314 CA GLN A 18 -12.167 7.917 12.757 1.00 0.89 C ATOM 315 C GLN A 18 -13.666 8.028 12.386 1.00 0.97 C ATOM 316 O GLN A 18 -14.507 7.413 13.045 1.00 1.21 O ATOM 317 CB GLN A 18 -11.786 8.798 13.966 1.00 0.96 C ATOM 318 CG GLN A 18 -12.419 8.348 15.295 1.00 1.17 C ATOM 319 CD GLN A 18 -11.880 9.095 16.523 1.00 2.20 C ATOM 320 OE1 GLN A 18 -11.107 10.045 16.449 1.00 2.98 O ATOM 321 NE2 GLN A 18 -12.270 8.692 17.717 1.00 3.14 N ATOM 0 H GLN A 18 -10.763 9.145 11.813 1.00 0.72 H new ATOM 0 HA GLN A 18 -12.026 6.866 13.010 1.00 0.89 H new ATOM 0 HB2 GLN A 18 -10.701 8.799 14.074 1.00 0.96 H new ATOM 0 HB3 GLN A 18 -12.087 9.826 13.762 1.00 0.96 H new ATOM 0 HG2 GLN A 18 -13.498 8.491 15.239 1.00 1.17 H new ATOM 0 HG3 GLN A 18 -12.245 7.280 15.426 1.00 1.17 H new ATOM 0 HE21 GLN A 18 -12.912 7.904 17.805 1.00 3.14 H new ATOM 0 HE22 GLN A 18 -11.929 9.168 18.552 1.00 3.14 H new ATOM 330 N ARG A 19 -14.008 8.767 11.319 1.00 0.87 N ATOM 331 CA ARG A 19 -15.375 8.956 10.810 1.00 0.97 C ATOM 332 C ARG A 19 -15.845 7.876 9.822 1.00 1.05 C ATOM 333 O ARG A 19 -17.054 7.741 9.619 1.00 1.19 O ATOM 334 CB ARG A 19 -15.478 10.338 10.127 1.00 0.95 C ATOM 335 CG ARG A 19 -16.645 11.187 10.638 1.00 1.10 C ATOM 336 CD ARG A 19 -16.445 11.629 12.096 1.00 1.22 C ATOM 337 NE ARG A 19 -17.507 12.563 12.510 1.00 1.30 N ATOM 338 CZ ARG A 19 -17.529 13.877 12.314 1.00 2.59 C ATOM 339 NH1 ARG A 19 -16.535 14.518 11.733 1.00 4.31 N ATOM 340 NH2 ARG A 19 -18.574 14.576 12.702 1.00 3.12 N ATOM 0 H ARG A 19 -13.313 9.268 10.766 1.00 0.87 H new ATOM 0 HA ARG A 19 -16.030 8.881 11.678 1.00 0.97 H new ATOM 0 HB2 ARG A 19 -14.547 10.882 10.284 1.00 0.95 H new ATOM 0 HB3 ARG A 19 -15.586 10.196 9.052 1.00 0.95 H new ATOM 0 HG2 ARG A 19 -16.756 12.067 10.005 1.00 1.10 H new ATOM 0 HG3 ARG A 19 -17.570 10.617 10.556 1.00 1.10 H new ATOM 0 HD2 ARG A 19 -16.447 10.756 12.749 1.00 1.22 H new ATOM 0 HD3 ARG A 19 -15.471 12.107 12.206 1.00 1.22 H new ATOM 0 HE ARG A 19 -18.307 12.159 12.997 1.00 1.30 H new ATOM 0 HH11 ARG A 19 -15.713 14.004 11.416 1.00 4.31 H new ATOM 0 HH12 ARG A 19 -16.588 15.528 11.600 1.00 4.31 H new ATOM 0 HH21 ARG A 19 -19.362 14.109 13.151 1.00 3.12 H new ATOM 0 HH22 ARG A 19 -18.596 15.585 12.554 1.00 3.12 H new ATOM 354 N MET A 20 -14.935 7.135 9.176 1.00 0.96 N ATOM 355 CA MET A 20 -15.267 6.181 8.101 1.00 0.98 C ATOM 356 C MET A 20 -16.201 5.058 8.586 1.00 1.20 C ATOM 357 O MET A 20 -15.790 4.185 9.350 1.00 2.33 O ATOM 358 CB MET A 20 -13.994 5.569 7.493 1.00 0.79 C ATOM 359 CG MET A 20 -12.989 6.604 6.982 1.00 0.76 C ATOM 360 SD MET A 20 -13.582 7.741 5.712 1.00 0.98 S ATOM 361 CE MET A 20 -12.038 8.655 5.510 1.00 0.76 C ATOM 0 H MET A 20 -13.937 7.179 9.384 1.00 0.96 H new ATOM 0 HA MET A 20 -15.794 6.749 7.335 1.00 0.98 H new ATOM 0 HB2 MET A 20 -13.508 4.946 8.244 1.00 0.79 H new ATOM 0 HB3 MET A 20 -14.276 4.914 6.669 1.00 0.79 H new ATOM 0 HG2 MET A 20 -12.642 7.192 7.832 1.00 0.76 H new ATOM 0 HG3 MET A 20 -12.123 6.073 6.587 1.00 0.76 H new ATOM 0 HE1 MET A 20 -12.218 9.545 4.907 1.00 0.76 H new ATOM 0 HE2 MET A 20 -11.659 8.950 6.489 1.00 0.76 H new ATOM 0 HE3 MET A 20 -11.303 8.022 5.012 1.00 0.76 H new ATOM 371 N GLU A 21 -17.451 5.064 8.114 1.00 0.82 N ATOM 372 CA GLU A 21 -18.459 4.051 8.459 1.00 0.87 C ATOM 373 C GLU A 21 -18.382 2.779 7.590 1.00 0.82 C ATOM 374 O GLU A 21 -19.031 1.786 7.931 1.00 0.86 O ATOM 375 CB GLU A 21 -19.867 4.679 8.423 1.00 1.09 C ATOM 376 CG GLU A 21 -20.165 5.428 9.733 1.00 2.00 C ATOM 377 CD GLU A 21 -21.521 6.158 9.727 1.00 2.34 C ATOM 378 OE1 GLU A 21 -22.496 5.669 9.107 1.00 2.26 O ATOM 379 OE2 GLU A 21 -21.632 7.225 10.376 1.00 3.68 O ATOM 0 H GLU A 21 -17.798 5.779 7.475 1.00 0.82 H new ATOM 0 HA GLU A 21 -18.240 3.716 9.473 1.00 0.87 H new ATOM 0 HB2 GLU A 21 -19.942 5.367 7.581 1.00 1.09 H new ATOM 0 HB3 GLU A 21 -20.613 3.900 8.266 1.00 1.09 H new ATOM 0 HG2 GLU A 21 -20.147 4.719 10.560 1.00 2.00 H new ATOM 0 HG3 GLU A 21 -19.372 6.153 9.917 1.00 2.00 H new ATOM 386 N THR A 22 -17.573 2.766 6.511 1.00 0.81 N ATOM 387 CA THR A 22 -17.309 1.565 5.696 1.00 0.85 C ATOM 388 C THR A 22 -15.830 1.417 5.344 1.00 0.82 C ATOM 389 O THR A 22 -15.097 2.399 5.208 1.00 0.76 O ATOM 390 CB THR A 22 -18.165 1.504 4.419 1.00 0.95 C ATOM 391 OG1 THR A 22 -17.630 2.353 3.430 1.00 0.93 O ATOM 392 CG2 THR A 22 -19.637 1.877 4.613 1.00 1.05 C ATOM 0 H THR A 22 -17.081 3.596 6.179 1.00 0.81 H new ATOM 0 HA THR A 22 -17.598 0.724 6.326 1.00 0.85 H new ATOM 0 HB THR A 22 -18.135 0.457 4.118 1.00 0.95 H new ATOM 0 HG1 THR A 22 -18.263 2.428 2.686 1.00 0.93 H new ATOM 0 HG21 THR A 22 -20.159 1.805 3.659 1.00 1.05 H new ATOM 0 HG22 THR A 22 -20.094 1.194 5.329 1.00 1.05 H new ATOM 0 HG23 THR A 22 -19.707 2.898 4.989 1.00 1.05 H new ATOM 400 N ALA A 23 -15.403 0.168 5.129 1.00 0.87 N ATOM 401 CA ALA A 23 -14.051 -0.180 4.665 1.00 0.86 C ATOM 402 C ALA A 23 -13.777 0.406 3.273 1.00 0.87 C ATOM 403 O ALA A 23 -12.649 0.770 2.942 1.00 0.86 O ATOM 404 CB ALA A 23 -13.923 -1.711 4.666 1.00 0.96 C ATOM 0 H ALA A 23 -15.998 -0.648 5.275 1.00 0.87 H new ATOM 0 HA ALA A 23 -13.306 0.249 5.335 1.00 0.86 H new ATOM 0 HB1 ALA A 23 -12.927 -1.993 4.325 1.00 0.96 H new ATOM 0 HB2 ALA A 23 -14.081 -2.089 5.676 1.00 0.96 H new ATOM 0 HB3 ALA A 23 -14.670 -2.139 3.998 1.00 0.96 H new ATOM 410 N GLU A 24 -14.845 0.532 2.487 1.00 0.91 N ATOM 411 CA GLU A 24 -14.864 1.143 1.168 1.00 0.98 C ATOM 412 C GLU A 24 -14.440 2.616 1.273 1.00 0.89 C ATOM 413 O GLU A 24 -13.555 3.052 0.541 1.00 0.93 O ATOM 414 CB GLU A 24 -16.263 1.005 0.531 1.00 1.13 C ATOM 415 CG GLU A 24 -16.910 -0.383 0.702 1.00 1.29 C ATOM 416 CD GLU A 24 -18.351 -0.398 0.174 1.00 1.77 C ATOM 417 OE1 GLU A 24 -19.259 0.104 0.878 1.00 2.80 O ATOM 418 OE2 GLU A 24 -18.591 -0.930 -0.935 1.00 2.21 O ATOM 0 H GLU A 24 -15.764 0.192 2.771 1.00 0.91 H new ATOM 0 HA GLU A 24 -14.154 0.627 0.521 1.00 0.98 H new ATOM 0 HB2 GLU A 24 -16.922 1.755 0.967 1.00 1.13 H new ATOM 0 HB3 GLU A 24 -16.187 1.228 -0.533 1.00 1.13 H new ATOM 0 HG2 GLU A 24 -16.319 -1.130 0.172 1.00 1.29 H new ATOM 0 HG3 GLU A 24 -16.904 -0.662 1.756 1.00 1.29 H new ATOM 425 N GLU A 25 -14.995 3.369 2.234 1.00 0.80 N ATOM 426 CA GLU A 25 -14.638 4.774 2.450 1.00 0.75 C ATOM 427 C GLU A 25 -13.184 4.933 2.943 1.00 0.66 C ATOM 428 O GLU A 25 -12.490 5.859 2.512 1.00 0.63 O ATOM 429 CB GLU A 25 -15.631 5.445 3.416 1.00 0.81 C ATOM 430 CG GLU A 25 -15.847 6.930 3.080 1.00 1.19 C ATOM 431 CD GLU A 25 -16.855 7.116 1.939 1.00 2.07 C ATOM 432 OE1 GLU A 25 -18.081 7.130 2.200 1.00 2.76 O ATOM 433 OE2 GLU A 25 -16.417 7.277 0.777 1.00 3.26 O ATOM 0 H GLU A 25 -15.702 3.020 2.881 1.00 0.80 H new ATOM 0 HA GLU A 25 -14.702 5.280 1.487 1.00 0.75 H new ATOM 0 HB2 GLU A 25 -16.586 4.921 3.376 1.00 0.81 H new ATOM 0 HB3 GLU A 25 -15.261 5.354 4.437 1.00 0.81 H new ATOM 0 HG2 GLU A 25 -16.201 7.455 3.967 1.00 1.19 H new ATOM 0 HG3 GLU A 25 -14.895 7.382 2.801 1.00 1.19 H new ATOM 440 N VAL A 26 -12.692 4.003 3.778 1.00 0.65 N ATOM 441 CA VAL A 26 -11.287 3.990 4.248 1.00 0.60 C ATOM 442 C VAL A 26 -10.314 3.860 3.068 1.00 0.63 C ATOM 443 O VAL A 26 -9.342 4.615 3.006 1.00 0.58 O ATOM 444 CB VAL A 26 -10.991 2.875 5.289 1.00 0.63 C ATOM 445 CG1 VAL A 26 -9.511 2.839 5.711 1.00 0.61 C ATOM 446 CG2 VAL A 26 -11.828 3.031 6.567 1.00 0.65 C ATOM 0 H VAL A 26 -13.253 3.236 4.149 1.00 0.65 H new ATOM 0 HA VAL A 26 -11.138 4.946 4.749 1.00 0.60 H new ATOM 0 HB VAL A 26 -11.254 1.948 4.780 1.00 0.63 H new ATOM 0 HG11 VAL A 26 -9.360 2.042 6.439 1.00 0.61 H new ATOM 0 HG12 VAL A 26 -8.888 2.654 4.836 1.00 0.61 H new ATOM 0 HG13 VAL A 26 -9.236 3.795 6.157 1.00 0.61 H new ATOM 0 HG21 VAL A 26 -11.584 2.228 7.262 1.00 0.65 H new ATOM 0 HG22 VAL A 26 -11.607 3.992 7.031 1.00 0.65 H new ATOM 0 HG23 VAL A 26 -12.888 2.984 6.316 1.00 0.65 H new ATOM 456 N TYR A 27 -10.570 2.954 2.112 1.00 0.74 N ATOM 457 CA TYR A 27 -9.705 2.829 0.931 1.00 0.81 C ATOM 458 C TYR A 27 -9.956 3.970 -0.079 1.00 0.80 C ATOM 459 O TYR A 27 -9.043 4.422 -0.768 1.00 0.81 O ATOM 460 CB TYR A 27 -9.773 1.422 0.300 1.00 0.96 C ATOM 461 CG TYR A 27 -10.711 1.252 -0.878 1.00 1.08 C ATOM 462 CD1 TYR A 27 -10.409 1.857 -2.113 1.00 1.84 C ATOM 463 CD2 TYR A 27 -11.885 0.497 -0.738 1.00 1.73 C ATOM 464 CE1 TYR A 27 -11.346 1.826 -3.161 1.00 1.98 C ATOM 465 CE2 TYR A 27 -12.807 0.419 -1.799 1.00 1.81 C ATOM 466 CZ TYR A 27 -12.555 1.113 -3.004 1.00 1.40 C ATOM 467 OH TYR A 27 -13.473 1.090 -4.012 1.00 1.60 O ATOM 0 H TYR A 27 -11.357 2.306 2.133 1.00 0.74 H new ATOM 0 HA TYR A 27 -8.674 2.943 1.267 1.00 0.81 H new ATOM 0 HB2 TYR A 27 -8.769 1.143 -0.021 1.00 0.96 H new ATOM 0 HB3 TYR A 27 -10.068 0.715 1.075 1.00 0.96 H new ATOM 0 HD1 TYR A 27 -9.456 2.346 -2.256 1.00 1.84 H new ATOM 0 HD2 TYR A 27 -12.082 -0.026 0.186 1.00 1.73 H new ATOM 0 HE1 TYR A 27 -11.141 2.347 -4.085 1.00 1.98 H new ATOM 0 HE2 TYR A 27 -13.706 -0.170 -1.692 1.00 1.81 H new ATOM 0 HH TYR A 27 -14.246 0.553 -3.738 1.00 1.60 H new ATOM 477 N HIS A 28 -11.188 4.463 -0.173 1.00 0.82 N ATOM 478 CA HIS A 28 -11.559 5.558 -1.063 1.00 0.85 C ATOM 479 C HIS A 28 -10.828 6.866 -0.716 1.00 0.75 C ATOM 480 O HIS A 28 -10.286 7.497 -1.616 1.00 0.77 O ATOM 481 CB HIS A 28 -13.082 5.694 -1.035 1.00 0.92 C ATOM 482 CG HIS A 28 -13.658 6.853 -1.799 1.00 1.09 C ATOM 483 ND1 HIS A 28 -14.656 7.672 -1.337 1.00 1.17 N ATOM 484 CD2 HIS A 28 -13.349 7.266 -3.069 1.00 1.32 C ATOM 485 CE1 HIS A 28 -14.932 8.573 -2.287 1.00 1.44 C ATOM 486 NE2 HIS A 28 -14.167 8.364 -3.377 1.00 1.53 N ATOM 0 H HIS A 28 -11.970 4.106 0.377 1.00 0.82 H new ATOM 0 HA HIS A 28 -11.241 5.333 -2.081 1.00 0.85 H new ATOM 0 HB2 HIS A 28 -13.516 4.775 -1.429 1.00 0.92 H new ATOM 0 HB3 HIS A 28 -13.400 5.777 0.004 1.00 0.92 H new ATOM 0 HD1 HIS A 28 -15.110 7.606 -0.426 1.00 1.17 H new ATOM 0 HD2 HIS A 28 -12.607 6.824 -3.718 1.00 1.32 H new ATOM 0 HE1 HIS A 28 -15.666 9.359 -2.193 1.00 1.44 H new ATOM 494 N GLU A 29 -10.722 7.243 0.563 1.00 0.65 N ATOM 495 CA GLU A 29 -9.952 8.430 0.987 1.00 0.60 C ATOM 496 C GLU A 29 -8.483 8.341 0.532 1.00 0.54 C ATOM 497 O GLU A 29 -7.912 9.297 0.001 1.00 0.55 O ATOM 498 CB GLU A 29 -10.044 8.515 2.523 1.00 0.61 C ATOM 499 CG GLU A 29 -9.161 9.563 3.222 1.00 1.13 C ATOM 500 CD GLU A 29 -9.770 10.967 3.177 1.00 1.10 C ATOM 501 OE1 GLU A 29 -9.817 11.583 2.087 1.00 1.99 O ATOM 502 OE2 GLU A 29 -10.196 11.471 4.244 1.00 2.32 O ATOM 0 H GLU A 29 -11.163 6.741 1.334 1.00 0.65 H new ATOM 0 HA GLU A 29 -10.366 9.327 0.526 1.00 0.60 H new ATOM 0 HB2 GLU A 29 -11.082 8.716 2.789 1.00 0.61 H new ATOM 0 HB3 GLU A 29 -9.794 7.536 2.931 1.00 0.61 H new ATOM 0 HG2 GLU A 29 -9.008 9.270 4.261 1.00 1.13 H new ATOM 0 HG3 GLU A 29 -8.180 9.581 2.748 1.00 1.13 H new ATOM 509 N ILE A 30 -7.851 7.185 0.738 1.00 0.52 N ATOM 510 CA ILE A 30 -6.437 6.983 0.383 1.00 0.54 C ATOM 511 C ILE A 30 -6.213 6.858 -1.134 1.00 0.58 C ATOM 512 O ILE A 30 -5.182 7.313 -1.629 1.00 0.58 O ATOM 513 CB ILE A 30 -5.817 5.848 1.222 1.00 0.61 C ATOM 514 CG1 ILE A 30 -6.406 4.481 0.861 1.00 0.71 C ATOM 515 CG2 ILE A 30 -6.046 6.161 2.715 1.00 0.65 C ATOM 516 CD1 ILE A 30 -5.909 3.303 1.696 1.00 0.82 C ATOM 0 H ILE A 30 -8.296 6.366 1.152 1.00 0.52 H new ATOM 0 HA ILE A 30 -5.889 7.886 0.649 1.00 0.54 H new ATOM 0 HB ILE A 30 -4.750 5.795 1.007 1.00 0.61 H new ATOM 0 HG12 ILE A 30 -7.490 4.537 0.955 1.00 0.71 H new ATOM 0 HG13 ILE A 30 -6.187 4.277 -0.187 1.00 0.71 H new ATOM 0 HG21 ILE A 30 -5.613 5.367 3.324 1.00 0.65 H new ATOM 0 HG22 ILE A 30 -5.571 7.110 2.965 1.00 0.65 H new ATOM 0 HG23 ILE A 30 -7.116 6.228 2.913 1.00 0.65 H new ATOM 0 HD11 ILE A 30 -6.391 2.387 1.355 1.00 0.82 H new ATOM 0 HD12 ILE A 30 -4.829 3.208 1.585 1.00 0.82 H new ATOM 0 HD13 ILE A 30 -6.152 3.472 2.745 1.00 0.82 H new ATOM 528 N GLU A 31 -7.182 6.321 -1.887 1.00 0.65 N ATOM 529 CA GLU A 31 -7.130 6.275 -3.354 1.00 0.70 C ATOM 530 C GLU A 31 -7.396 7.650 -3.986 1.00 0.67 C ATOM 531 O GLU A 31 -6.711 8.027 -4.936 1.00 0.67 O ATOM 532 CB GLU A 31 -7.987 5.132 -3.935 1.00 0.77 C ATOM 533 CG GLU A 31 -9.490 5.349 -4.167 1.00 1.61 C ATOM 534 CD GLU A 31 -9.923 5.180 -5.634 1.00 2.09 C ATOM 535 OE1 GLU A 31 -9.304 5.793 -6.535 1.00 2.69 O ATOM 536 OE2 GLU A 31 -10.927 4.476 -5.889 1.00 2.79 O ATOM 0 H GLU A 31 -8.027 5.905 -1.495 1.00 0.65 H new ATOM 0 HA GLU A 31 -6.107 6.027 -3.636 1.00 0.70 H new ATOM 0 HB2 GLU A 31 -7.547 4.850 -4.892 1.00 0.77 H new ATOM 0 HB3 GLU A 31 -7.881 4.275 -3.270 1.00 0.77 H new ATOM 0 HG2 GLU A 31 -10.049 4.645 -3.550 1.00 1.61 H new ATOM 0 HG3 GLU A 31 -9.759 6.351 -3.832 1.00 1.61 H new ATOM 543 N LEU A 32 -8.308 8.452 -3.418 1.00 0.67 N ATOM 544 CA LEU A 32 -8.480 9.869 -3.751 1.00 0.71 C ATOM 545 C LEU A 32 -7.153 10.631 -3.625 1.00 0.62 C ATOM 546 O LEU A 32 -6.839 11.438 -4.496 1.00 0.67 O ATOM 547 CB LEU A 32 -9.559 10.489 -2.836 1.00 0.79 C ATOM 548 CG LEU A 32 -11.029 10.230 -3.225 1.00 0.99 C ATOM 549 CD1 LEU A 32 -11.924 10.869 -2.151 1.00 1.11 C ATOM 550 CD2 LEU A 32 -11.388 10.800 -4.605 1.00 1.13 C ATOM 0 H LEU A 32 -8.957 8.126 -2.702 1.00 0.67 H new ATOM 0 HA LEU A 32 -8.806 9.948 -4.788 1.00 0.71 H new ATOM 0 HB2 LEU A 32 -9.404 10.114 -1.824 1.00 0.79 H new ATOM 0 HB3 LEU A 32 -9.400 11.567 -2.805 1.00 0.79 H new ATOM 0 HG LEU A 32 -11.184 9.153 -3.284 1.00 0.99 H new ATOM 0 HD11 LEU A 32 -12.971 10.700 -2.402 1.00 1.11 H new ATOM 0 HD12 LEU A 32 -11.707 10.420 -1.182 1.00 1.11 H new ATOM 0 HD13 LEU A 32 -11.730 11.941 -2.106 1.00 1.11 H new ATOM 0 HD21 LEU A 32 -12.434 10.588 -4.825 1.00 1.13 H new ATOM 0 HD22 LEU A 32 -11.228 11.878 -4.606 1.00 1.13 H new ATOM 0 HD23 LEU A 32 -10.757 10.339 -5.365 1.00 1.13 H new ATOM 562 N GLN A 33 -6.345 10.356 -2.598 1.00 0.55 N ATOM 563 CA GLN A 33 -5.030 10.984 -2.432 1.00 0.56 C ATOM 564 C GLN A 33 -4.037 10.577 -3.539 1.00 0.52 C ATOM 565 O GLN A 33 -3.198 11.391 -3.916 1.00 0.64 O ATOM 566 CB GLN A 33 -4.504 10.682 -1.011 1.00 0.61 C ATOM 567 CG GLN A 33 -3.504 11.723 -0.464 1.00 0.75 C ATOM 568 CD GLN A 33 -2.037 11.283 -0.516 1.00 2.00 C ATOM 569 OE1 GLN A 33 -1.394 11.055 0.500 1.00 2.81 O ATOM 570 NE2 GLN A 33 -1.441 11.152 -1.681 1.00 3.24 N ATOM 0 H GLN A 33 -6.582 9.694 -1.859 1.00 0.55 H new ATOM 0 HA GLN A 33 -5.137 12.063 -2.540 1.00 0.56 H new ATOM 0 HB2 GLN A 33 -5.352 10.618 -0.329 1.00 0.61 H new ATOM 0 HB3 GLN A 33 -4.024 9.703 -1.015 1.00 0.61 H new ATOM 0 HG2 GLN A 33 -3.613 12.647 -1.032 1.00 0.75 H new ATOM 0 HG3 GLN A 33 -3.765 11.951 0.569 1.00 0.75 H new ATOM 0 HE21 GLN A 33 -1.957 11.337 -2.541 1.00 3.24 H new ATOM 0 HE22 GLN A 33 -0.463 10.866 -1.724 1.00 3.24 H new ATOM 579 N ALA A 34 -4.133 9.365 -4.101 1.00 0.46 N ATOM 580 CA ALA A 34 -3.368 8.948 -5.285 1.00 0.47 C ATOM 581 C ALA A 34 -3.886 9.608 -6.579 1.00 0.48 C ATOM 582 O ALA A 34 -3.102 10.072 -7.408 1.00 0.48 O ATOM 583 CB ALA A 34 -3.415 7.418 -5.376 1.00 0.57 C ATOM 0 H ALA A 34 -4.751 8.637 -3.742 1.00 0.46 H new ATOM 0 HA ALA A 34 -2.336 9.281 -5.177 1.00 0.47 H new ATOM 0 HB1 ALA A 34 -2.852 7.088 -6.249 1.00 0.57 H new ATOM 0 HB2 ALA A 34 -2.975 6.986 -4.477 1.00 0.57 H new ATOM 0 HB3 ALA A 34 -4.451 7.091 -5.467 1.00 0.57 H new ATOM 589 N GLN A 35 -5.213 9.672 -6.744 1.00 0.57 N ATOM 590 CA GLN A 35 -5.889 10.294 -7.891 1.00 0.68 C ATOM 591 C GLN A 35 -5.603 11.802 -7.966 1.00 0.69 C ATOM 592 O GLN A 35 -5.382 12.337 -9.053 1.00 0.73 O ATOM 593 CB GLN A 35 -7.409 10.070 -7.772 1.00 0.90 C ATOM 594 CG GLN A 35 -7.839 8.588 -7.834 1.00 0.84 C ATOM 595 CD GLN A 35 -8.641 8.183 -9.079 1.00 1.33 C ATOM 596 OE1 GLN A 35 -8.634 8.820 -10.126 1.00 1.74 O ATOM 597 NE2 GLN A 35 -9.366 7.087 -9.007 1.00 1.84 N ATOM 0 H GLN A 35 -5.865 9.281 -6.064 1.00 0.57 H new ATOM 0 HA GLN A 35 -5.507 9.830 -8.800 1.00 0.68 H new ATOM 0 HB2 GLN A 35 -7.755 10.498 -6.831 1.00 0.90 H new ATOM 0 HB3 GLN A 35 -7.909 10.615 -8.573 1.00 0.90 H new ATOM 0 HG2 GLN A 35 -6.945 7.966 -7.781 1.00 0.84 H new ATOM 0 HG3 GLN A 35 -8.436 8.364 -6.950 1.00 0.84 H new ATOM 0 HE21 GLN A 35 -9.384 6.544 -8.144 1.00 1.84 H new ATOM 0 HE22 GLN A 35 -9.909 6.781 -9.814 1.00 1.84 H new ATOM 606 N GLN A 36 -5.557 12.483 -6.815 1.00 0.68 N ATOM 607 CA GLN A 36 -5.269 13.918 -6.703 1.00 0.77 C ATOM 608 C GLN A 36 -3.852 14.262 -7.176 1.00 0.73 C ATOM 609 O GLN A 36 -3.607 15.388 -7.617 1.00 0.85 O ATOM 610 CB GLN A 36 -5.478 14.356 -5.240 1.00 0.83 C ATOM 611 CG GLN A 36 -6.951 14.641 -4.904 1.00 1.09 C ATOM 612 CD GLN A 36 -7.474 15.923 -5.562 1.00 1.42 C ATOM 613 OE1 GLN A 36 -7.285 17.029 -5.069 1.00 1.84 O ATOM 614 NE2 GLN A 36 -8.133 15.840 -6.701 1.00 2.19 N ATOM 0 H GLN A 36 -5.723 12.040 -5.912 1.00 0.68 H new ATOM 0 HA GLN A 36 -5.954 14.460 -7.355 1.00 0.77 H new ATOM 0 HB2 GLN A 36 -5.104 13.577 -4.576 1.00 0.83 H new ATOM 0 HB3 GLN A 36 -4.887 15.251 -5.046 1.00 0.83 H new ATOM 0 HG2 GLN A 36 -7.562 13.798 -5.226 1.00 1.09 H new ATOM 0 HG3 GLN A 36 -7.063 14.721 -3.823 1.00 1.09 H new ATOM 0 HE21 GLN A 36 -8.301 14.929 -7.128 1.00 2.19 H new ATOM 0 HE22 GLN A 36 -8.475 16.687 -7.155 1.00 2.19 H new ATOM 623 N LEU A 37 -2.932 13.295 -7.111 1.00 0.63 N ATOM 624 CA LEU A 37 -1.541 13.426 -7.535 1.00 0.67 C ATOM 625 C LEU A 37 -1.260 12.744 -8.890 1.00 0.71 C ATOM 626 O LEU A 37 -0.093 12.602 -9.254 1.00 0.94 O ATOM 627 CB LEU A 37 -0.641 12.905 -6.399 1.00 0.73 C ATOM 628 CG LEU A 37 -0.839 13.585 -5.027 1.00 0.74 C ATOM 629 CD1 LEU A 37 0.183 13.010 -4.038 1.00 1.09 C ATOM 630 CD2 LEU A 37 -0.720 15.112 -5.081 1.00 1.07 C ATOM 0 H LEU A 37 -3.147 12.366 -6.748 1.00 0.63 H new ATOM 0 HA LEU A 37 -1.316 14.477 -7.716 1.00 0.67 H new ATOM 0 HB2 LEU A 37 -0.815 11.835 -6.283 1.00 0.73 H new ATOM 0 HB3 LEU A 37 0.400 13.028 -6.699 1.00 0.73 H new ATOM 0 HG LEU A 37 -1.857 13.374 -4.701 1.00 0.74 H new ATOM 0 HD11 LEU A 37 0.053 13.483 -3.065 1.00 1.09 H new ATOM 0 HD12 LEU A 37 0.032 11.935 -3.942 1.00 1.09 H new ATOM 0 HD13 LEU A 37 1.192 13.203 -4.404 1.00 1.09 H new ATOM 0 HD21 LEU A 37 -0.870 15.524 -4.083 1.00 1.07 H new ATOM 0 HD22 LEU A 37 0.271 15.387 -5.442 1.00 1.07 H new ATOM 0 HD23 LEU A 37 -1.476 15.512 -5.756 1.00 1.07 H new ATOM 642 N GLU A 38 -2.299 12.341 -9.640 1.00 0.60 N ATOM 643 CA GLU A 38 -2.212 11.912 -11.050 1.00 0.65 C ATOM 644 C GLU A 38 -1.394 10.602 -11.200 1.00 0.57 C ATOM 645 O GLU A 38 -0.575 10.464 -12.112 1.00 0.71 O ATOM 646 CB GLU A 38 -1.683 13.101 -11.897 1.00 1.05 C ATOM 647 CG GLU A 38 -1.769 12.969 -13.430 1.00 1.85 C ATOM 648 CD GLU A 38 -0.912 14.023 -14.162 1.00 2.61 C ATOM 649 OE1 GLU A 38 0.249 14.281 -13.758 1.00 3.54 O ATOM 650 OE2 GLU A 38 -1.384 14.578 -15.184 1.00 2.85 O ATOM 0 H GLU A 38 -3.250 12.303 -9.274 1.00 0.60 H new ATOM 0 HA GLU A 38 -3.200 11.653 -11.432 1.00 0.65 H new ATOM 0 HB2 GLU A 38 -2.233 13.995 -11.604 1.00 1.05 H new ATOM 0 HB3 GLU A 38 -0.639 13.267 -11.631 1.00 1.05 H new ATOM 0 HG2 GLU A 38 -1.443 11.972 -13.725 1.00 1.85 H new ATOM 0 HG3 GLU A 38 -2.808 13.070 -13.743 1.00 1.85 H new ATOM 657 N TYR A 39 -1.535 9.642 -10.274 1.00 0.61 N ATOM 658 CA TYR A 39 -0.589 8.516 -10.200 1.00 0.72 C ATOM 659 C TYR A 39 -0.627 7.568 -11.415 1.00 0.61 C ATOM 660 O TYR A 39 0.341 7.519 -12.170 1.00 0.59 O ATOM 661 CB TYR A 39 -0.763 7.736 -8.882 1.00 0.92 C ATOM 662 CG TYR A 39 0.153 8.175 -7.754 1.00 1.07 C ATOM 663 CD1 TYR A 39 0.324 9.537 -7.449 1.00 1.84 C ATOM 664 CD2 TYR A 39 0.917 7.211 -7.065 1.00 2.47 C ATOM 665 CE1 TYR A 39 1.287 9.937 -6.502 1.00 1.82 C ATOM 666 CE2 TYR A 39 1.879 7.601 -6.117 1.00 2.67 C ATOM 667 CZ TYR A 39 2.072 8.972 -5.840 1.00 1.43 C ATOM 668 OH TYR A 39 3.028 9.365 -4.957 1.00 1.67 O ATOM 0 H TYR A 39 -2.280 9.620 -9.578 1.00 0.61 H new ATOM 0 HA TYR A 39 0.402 8.969 -10.221 1.00 0.72 H new ATOM 0 HB2 TYR A 39 -1.797 7.836 -8.551 1.00 0.92 H new ATOM 0 HB3 TYR A 39 -0.592 6.677 -9.078 1.00 0.92 H new ATOM 0 HD1 TYR A 39 -0.285 10.279 -7.943 1.00 1.84 H new ATOM 0 HD2 TYR A 39 0.762 6.162 -7.268 1.00 2.47 H new ATOM 0 HE1 TYR A 39 1.424 10.986 -6.283 1.00 1.82 H new ATOM 0 HE2 TYR A 39 2.468 6.856 -5.603 1.00 2.67 H new ATOM 0 HH TYR A 39 3.477 8.576 -4.588 1.00 1.67 H new ATOM 678 N ASP A 40 -1.737 6.851 -11.605 1.00 0.65 N ATOM 679 CA ASP A 40 -1.866 5.545 -12.286 1.00 0.53 C ATOM 680 C ASP A 40 -2.829 4.708 -11.430 1.00 0.44 C ATOM 681 O ASP A 40 -4.035 4.757 -11.676 1.00 0.55 O ATOM 682 CB ASP A 40 -0.509 4.847 -12.549 1.00 0.55 C ATOM 683 CG ASP A 40 -0.595 3.389 -13.001 1.00 0.79 C ATOM 684 OD1 ASP A 40 -0.999 3.147 -14.162 1.00 1.56 O ATOM 685 OD2 ASP A 40 -0.178 2.517 -12.204 1.00 1.89 O ATOM 0 H ASP A 40 -2.639 7.185 -11.265 1.00 0.65 H new ATOM 0 HA ASP A 40 -2.265 5.678 -13.291 1.00 0.53 H new ATOM 0 HB2 ASP A 40 0.030 5.413 -13.309 1.00 0.55 H new ATOM 0 HB3 ASP A 40 0.086 4.892 -11.637 1.00 0.55 H new ATOM 690 N TYR A 41 -2.336 4.024 -10.387 1.00 0.39 N ATOM 691 CA TYR A 41 -3.127 3.112 -9.548 1.00 0.40 C ATOM 692 C TYR A 41 -2.589 2.926 -8.107 1.00 0.38 C ATOM 693 O TYR A 41 -1.467 3.296 -7.752 1.00 0.37 O ATOM 694 CB TYR A 41 -3.246 1.742 -10.242 1.00 0.43 C ATOM 695 CG TYR A 41 -4.007 1.687 -11.555 1.00 0.54 C ATOM 696 CD1 TYR A 41 -5.385 1.969 -11.588 1.00 1.55 C ATOM 697 CD2 TYR A 41 -3.349 1.287 -12.736 1.00 1.45 C ATOM 698 CE1 TYR A 41 -6.099 1.882 -12.799 1.00 1.63 C ATOM 699 CE2 TYR A 41 -4.053 1.203 -13.950 1.00 1.51 C ATOM 700 CZ TYR A 41 -5.434 1.499 -13.985 1.00 0.83 C ATOM 701 OH TYR A 41 -6.124 1.376 -15.154 1.00 0.98 O ATOM 0 H TYR A 41 -1.360 4.090 -10.098 1.00 0.39 H new ATOM 0 HA TYR A 41 -4.104 3.582 -9.438 1.00 0.40 H new ATOM 0 HB2 TYR A 41 -2.238 1.366 -10.421 1.00 0.43 H new ATOM 0 HB3 TYR A 41 -3.724 1.053 -9.546 1.00 0.43 H new ATOM 0 HD1 TYR A 41 -5.898 2.253 -10.681 1.00 1.55 H new ATOM 0 HD2 TYR A 41 -2.297 1.044 -12.708 1.00 1.45 H new ATOM 0 HE1 TYR A 41 -7.155 2.108 -12.821 1.00 1.63 H new ATOM 0 HE2 TYR A 41 -3.539 0.913 -14.854 1.00 1.51 H new ATOM 0 HH TYR A 41 -5.511 1.106 -15.869 1.00 0.98 H new ATOM 711 N TYR A 42 -3.433 2.331 -7.260 1.00 0.42 N ATOM 712 CA TYR A 42 -3.189 2.000 -5.851 1.00 0.41 C ATOM 713 C TYR A 42 -3.491 0.514 -5.576 1.00 0.35 C ATOM 714 O TYR A 42 -4.258 -0.119 -6.303 1.00 0.37 O ATOM 715 CB TYR A 42 -4.104 2.871 -4.969 1.00 0.52 C ATOM 716 CG TYR A 42 -5.576 2.510 -5.097 1.00 1.26 C ATOM 717 CD1 TYR A 42 -6.320 2.979 -6.196 1.00 2.61 C ATOM 718 CD2 TYR A 42 -6.175 1.628 -4.172 1.00 2.12 C ATOM 719 CE1 TYR A 42 -7.647 2.555 -6.385 1.00 3.60 C ATOM 720 CE2 TYR A 42 -7.496 1.183 -4.368 1.00 2.92 C ATOM 721 CZ TYR A 42 -8.231 1.634 -5.488 1.00 3.43 C ATOM 722 OH TYR A 42 -9.490 1.170 -5.716 1.00 4.52 O ATOM 0 H TYR A 42 -4.367 2.049 -7.559 1.00 0.42 H new ATOM 0 HA TYR A 42 -2.140 2.190 -5.622 1.00 0.41 H new ATOM 0 HB2 TYR A 42 -3.800 2.768 -3.927 1.00 0.52 H new ATOM 0 HB3 TYR A 42 -3.968 3.918 -5.238 1.00 0.52 H new ATOM 0 HD1 TYR A 42 -5.870 3.667 -6.896 1.00 2.61 H new ATOM 0 HD2 TYR A 42 -5.617 1.293 -3.310 1.00 2.12 H new ATOM 0 HE1 TYR A 42 -8.221 2.934 -7.218 1.00 3.60 H new ATOM 0 HE2 TYR A 42 -7.947 0.499 -3.664 1.00 2.92 H new ATOM 0 HH TYR A 42 -10.048 1.339 -4.928 1.00 4.52 H new ATOM 732 N SER A 43 -2.984 -0.022 -4.472 1.00 0.37 N ATOM 733 CA SER A 43 -3.392 -1.316 -3.924 1.00 0.40 C ATOM 734 C SER A 43 -3.366 -1.315 -2.387 1.00 0.42 C ATOM 735 O SER A 43 -2.488 -0.725 -1.748 1.00 0.42 O ATOM 736 CB SER A 43 -2.528 -2.455 -4.490 1.00 0.52 C ATOM 737 OG SER A 43 -1.146 -2.268 -4.235 1.00 1.33 O ATOM 0 H SER A 43 -2.262 0.439 -3.919 1.00 0.37 H new ATOM 0 HA SER A 43 -4.423 -1.489 -4.233 1.00 0.40 H new ATOM 0 HB2 SER A 43 -2.849 -3.401 -4.054 1.00 0.52 H new ATOM 0 HB3 SER A 43 -2.689 -2.528 -5.566 1.00 0.52 H new ATOM 0 HG SER A 43 -0.682 -2.069 -5.075 1.00 1.33 H new ATOM 743 N LEU A 44 -4.360 -1.987 -1.804 1.00 0.54 N ATOM 744 CA LEU A 44 -4.553 -2.222 -0.375 1.00 0.64 C ATOM 745 C LEU A 44 -4.588 -3.738 -0.160 1.00 0.64 C ATOM 746 O LEU A 44 -5.324 -4.439 -0.855 1.00 0.71 O ATOM 747 CB LEU A 44 -5.876 -1.543 0.027 1.00 0.76 C ATOM 748 CG LEU A 44 -6.433 -1.907 1.417 1.00 0.97 C ATOM 749 CD1 LEU A 44 -5.503 -1.537 2.581 1.00 1.39 C ATOM 750 CD2 LEU A 44 -7.758 -1.164 1.597 1.00 1.83 C ATOM 0 H LEU A 44 -5.103 -2.411 -2.359 1.00 0.54 H new ATOM 0 HA LEU A 44 -3.754 -1.808 0.240 1.00 0.64 H new ATOM 0 HB2 LEU A 44 -5.733 -0.463 -0.013 1.00 0.76 H new ATOM 0 HB3 LEU A 44 -6.630 -1.792 -0.720 1.00 0.76 H new ATOM 0 HG LEU A 44 -6.547 -2.991 1.446 1.00 0.97 H new ATOM 0 HD11 LEU A 44 -5.968 -1.826 3.524 1.00 1.39 H new ATOM 0 HD12 LEU A 44 -4.554 -2.061 2.469 1.00 1.39 H new ATOM 0 HD13 LEU A 44 -5.327 -0.461 2.578 1.00 1.39 H new ATOM 0 HD21 LEU A 44 -8.179 -1.402 2.574 1.00 1.83 H new ATOM 0 HD22 LEU A 44 -7.585 -0.090 1.528 1.00 1.83 H new ATOM 0 HD23 LEU A 44 -8.456 -1.470 0.818 1.00 1.83 H new ATOM 762 N CYS A 45 -3.819 -4.249 0.798 1.00 0.59 N ATOM 763 CA CYS A 45 -3.792 -5.661 1.174 1.00 0.53 C ATOM 764 C CYS A 45 -3.962 -5.808 2.695 1.00 0.49 C ATOM 765 O CYS A 45 -3.484 -4.966 3.455 1.00 0.57 O ATOM 766 CB CYS A 45 -2.485 -6.267 0.643 1.00 0.61 C ATOM 767 SG CYS A 45 -2.519 -8.075 0.803 1.00 1.19 S ATOM 0 H CYS A 45 -3.180 -3.677 1.350 1.00 0.59 H new ATOM 0 HA CYS A 45 -4.623 -6.209 0.730 1.00 0.53 H new ATOM 0 HB2 CYS A 45 -2.346 -5.990 -0.402 1.00 0.61 H new ATOM 0 HB3 CYS A 45 -1.637 -5.862 1.196 1.00 0.61 H new ATOM 0 HG CYS A 45 -3.749 -8.476 0.932 1.00 1.19 H new ATOM 773 N VAL A 46 -4.645 -6.862 3.135 1.00 0.45 N ATOM 774 CA VAL A 46 -4.950 -7.156 4.550 1.00 0.48 C ATOM 775 C VAL A 46 -4.498 -8.578 4.904 1.00 0.54 C ATOM 776 O VAL A 46 -4.503 -9.445 4.029 1.00 0.72 O ATOM 777 CB VAL A 46 -6.455 -6.929 4.853 1.00 0.64 C ATOM 778 CG1 VAL A 46 -7.328 -8.184 4.698 1.00 2.08 C ATOM 779 CG2 VAL A 46 -6.645 -6.347 6.262 1.00 2.04 C ATOM 0 H VAL A 46 -5.019 -7.567 2.499 1.00 0.45 H new ATOM 0 HA VAL A 46 -4.393 -6.464 5.182 1.00 0.48 H new ATOM 0 HB VAL A 46 -6.793 -6.219 4.098 1.00 0.64 H new ATOM 0 HG11 VAL A 46 -8.364 -7.937 4.928 1.00 2.08 H new ATOM 0 HG12 VAL A 46 -7.261 -8.549 3.673 1.00 2.08 H new ATOM 0 HG13 VAL A 46 -6.979 -8.957 5.382 1.00 2.08 H new ATOM 0 HG21 VAL A 46 -7.707 -6.196 6.453 1.00 2.04 H new ATOM 0 HG22 VAL A 46 -6.239 -7.039 6.999 1.00 2.04 H new ATOM 0 HG23 VAL A 46 -6.124 -5.392 6.335 1.00 2.04 H new ATOM 789 N ARG A 47 -4.114 -8.814 6.165 1.00 0.55 N ATOM 790 CA ARG A 47 -3.626 -10.112 6.647 1.00 0.65 C ATOM 791 C ARG A 47 -3.951 -10.328 8.136 1.00 0.72 C ATOM 792 O ARG A 47 -3.529 -9.547 8.991 1.00 0.76 O ATOM 793 CB ARG A 47 -2.113 -10.178 6.360 1.00 0.80 C ATOM 794 CG ARG A 47 -1.510 -11.582 6.509 1.00 1.46 C ATOM 795 CD ARG A 47 -0.063 -11.588 5.989 1.00 1.26 C ATOM 796 NE ARG A 47 0.368 -12.933 5.566 1.00 2.21 N ATOM 797 CZ ARG A 47 1.594 -13.272 5.182 1.00 2.51 C ATOM 798 NH1 ARG A 47 2.601 -12.430 5.246 1.00 2.41 N ATOM 799 NH2 ARG A 47 1.832 -14.477 4.712 1.00 3.47 N ATOM 0 H ARG A 47 -4.134 -8.097 6.890 1.00 0.55 H new ATOM 0 HA ARG A 47 -4.133 -10.923 6.123 1.00 0.65 H new ATOM 0 HB2 ARG A 47 -1.930 -9.821 5.347 1.00 0.80 H new ATOM 0 HB3 ARG A 47 -1.595 -9.498 7.036 1.00 0.80 H new ATOM 0 HG2 ARG A 47 -1.531 -11.887 7.555 1.00 1.46 H new ATOM 0 HG3 ARG A 47 -2.108 -12.305 5.954 1.00 1.46 H new ATOM 0 HD2 ARG A 47 0.023 -10.899 5.149 1.00 1.26 H new ATOM 0 HD3 ARG A 47 0.604 -11.223 6.770 1.00 1.26 H new ATOM 0 HE ARG A 47 -0.338 -13.669 5.568 1.00 2.21 H new ATOM 0 HH11 ARG A 47 2.453 -11.484 5.599 1.00 2.41 H new ATOM 0 HH12 ARG A 47 3.530 -12.722 4.943 1.00 2.41 H new ATOM 0 HH21 ARG A 47 1.074 -15.156 4.641 1.00 3.47 H new ATOM 0 HH22 ARG A 47 2.775 -14.733 4.418 1.00 3.47 H new ATOM 813 N HIS A 48 -4.668 -11.406 8.469 1.00 0.81 N ATOM 814 CA HIS A 48 -5.083 -11.713 9.850 1.00 0.89 C ATOM 815 C HIS A 48 -4.663 -13.138 10.291 1.00 0.94 C ATOM 816 O HIS A 48 -5.137 -14.119 9.703 1.00 1.03 O ATOM 817 CB HIS A 48 -6.604 -11.526 9.998 1.00 1.05 C ATOM 818 CG HIS A 48 -7.044 -11.450 11.445 1.00 2.29 C ATOM 819 ND1 HIS A 48 -7.579 -10.345 12.062 1.00 3.12 N ATOM 820 CD2 HIS A 48 -6.974 -12.435 12.396 1.00 3.85 C ATOM 821 CE1 HIS A 48 -7.821 -10.652 13.347 1.00 4.69 C ATOM 822 NE2 HIS A 48 -7.460 -11.922 13.604 1.00 5.21 N ATOM 0 H HIS A 48 -4.981 -12.097 7.787 1.00 0.81 H new ATOM 0 HA HIS A 48 -4.567 -11.014 10.509 1.00 0.89 H new ATOM 0 HB2 HIS A 48 -6.906 -10.615 9.482 1.00 1.05 H new ATOM 0 HB3 HIS A 48 -7.117 -12.354 9.509 1.00 1.05 H new ATOM 0 HD2 HIS A 48 -6.606 -13.438 12.239 1.00 3.85 H new ATOM 0 HE1 HIS A 48 -8.246 -9.974 14.072 1.00 4.69 H new ATOM 0 HE2 HIS A 48 -7.527 -12.411 14.497 1.00 5.21 H new ATOM 830 N PRO A 49 -3.828 -13.283 11.344 1.00 0.96 N ATOM 831 CA PRO A 49 -3.364 -14.575 11.839 1.00 1.08 C ATOM 832 C PRO A 49 -4.382 -15.188 12.817 1.00 1.13 C ATOM 833 O PRO A 49 -4.236 -15.086 14.034 1.00 1.32 O ATOM 834 CB PRO A 49 -2.000 -14.272 12.471 1.00 1.20 C ATOM 835 CG PRO A 49 -2.205 -12.880 13.066 1.00 1.17 C ATOM 836 CD PRO A 49 -3.149 -12.211 12.066 1.00 1.02 C ATOM 0 HA PRO A 49 -3.265 -15.329 11.058 1.00 1.08 H new ATOM 0 HB2 PRO A 49 -1.737 -15.004 13.235 1.00 1.20 H new ATOM 0 HB3 PRO A 49 -1.200 -14.282 11.731 1.00 1.20 H new ATOM 0 HG2 PRO A 49 -2.643 -12.928 14.063 1.00 1.17 H new ATOM 0 HG3 PRO A 49 -1.264 -12.338 13.157 1.00 1.17 H new ATOM 0 HD2 PRO A 49 -3.869 -11.575 12.580 1.00 1.02 H new ATOM 0 HD3 PRO A 49 -2.594 -11.573 11.378 1.00 1.02 H new ATOM 844 N VAL A 50 -5.431 -15.832 12.289 1.00 1.18 N ATOM 845 CA VAL A 50 -6.486 -16.458 13.121 1.00 1.27 C ATOM 846 C VAL A 50 -5.904 -17.652 13.906 1.00 1.40 C ATOM 847 O VAL A 50 -5.166 -18.446 13.319 1.00 1.61 O ATOM 848 CB VAL A 50 -7.713 -16.940 12.308 1.00 1.49 C ATOM 849 CG1 VAL A 50 -8.897 -17.317 13.216 1.00 1.56 C ATOM 850 CG2 VAL A 50 -8.228 -15.875 11.338 1.00 1.59 C ATOM 0 H VAL A 50 -5.579 -15.937 11.285 1.00 1.18 H new ATOM 0 HA VAL A 50 -6.835 -15.679 13.799 1.00 1.27 H new ATOM 0 HB VAL A 50 -7.355 -17.811 11.759 1.00 1.49 H new ATOM 0 HG11 VAL A 50 -9.735 -17.649 12.603 1.00 1.56 H new ATOM 0 HG12 VAL A 50 -8.598 -18.121 13.888 1.00 1.56 H new ATOM 0 HG13 VAL A 50 -9.198 -16.448 13.801 1.00 1.56 H new ATOM 0 HG21 VAL A 50 -9.088 -16.264 10.793 1.00 1.59 H new ATOM 0 HG22 VAL A 50 -8.524 -14.987 11.896 1.00 1.59 H new ATOM 0 HG23 VAL A 50 -7.440 -15.614 10.632 1.00 1.59 H new ATOM 860 N PRO A 51 -6.223 -17.814 15.209 1.00 1.40 N ATOM 861 CA PRO A 51 -5.764 -18.954 16.000 1.00 1.60 C ATOM 862 C PRO A 51 -6.680 -20.186 15.877 1.00 1.76 C ATOM 863 O PRO A 51 -6.212 -21.315 16.019 1.00 1.99 O ATOM 864 CB PRO A 51 -5.691 -18.422 17.433 1.00 1.60 C ATOM 865 CG PRO A 51 -6.757 -17.329 17.496 1.00 1.44 C ATOM 866 CD PRO A 51 -6.892 -16.832 16.054 1.00 1.31 C ATOM 0 HA PRO A 51 -4.800 -19.321 15.647 1.00 1.60 H new ATOM 0 HB2 PRO A 51 -5.889 -19.211 18.159 1.00 1.60 H new ATOM 0 HB3 PRO A 51 -4.702 -18.024 17.658 1.00 1.60 H new ATOM 0 HG2 PRO A 51 -7.703 -17.720 17.870 1.00 1.44 H new ATOM 0 HG3 PRO A 51 -6.458 -16.523 18.166 1.00 1.44 H new ATOM 0 HD2 PRO A 51 -7.941 -16.732 15.775 1.00 1.31 H new ATOM 0 HD3 PRO A 51 -6.437 -15.848 15.939 1.00 1.31 H new ATOM 874 N PHE A 52 -7.969 -19.981 15.585 1.00 1.73 N ATOM 875 CA PHE A 52 -8.987 -21.027 15.406 1.00 1.97 C ATOM 876 C PHE A 52 -9.011 -21.658 13.997 1.00 2.18 C ATOM 877 O PHE A 52 -9.607 -22.725 13.824 1.00 2.52 O ATOM 878 CB PHE A 52 -10.369 -20.426 15.721 1.00 1.98 C ATOM 879 CG PHE A 52 -10.630 -20.180 17.195 1.00 1.91 C ATOM 880 CD1 PHE A 52 -10.270 -18.957 17.791 1.00 2.45 C ATOM 881 CD2 PHE A 52 -11.254 -21.177 17.971 1.00 2.91 C ATOM 882 CE1 PHE A 52 -10.526 -18.735 19.157 1.00 2.48 C ATOM 883 CE2 PHE A 52 -11.516 -20.951 19.334 1.00 2.94 C ATOM 884 CZ PHE A 52 -11.151 -19.731 19.928 1.00 1.99 C ATOM 0 H PHE A 52 -8.349 -19.043 15.461 1.00 1.73 H new ATOM 0 HA PHE A 52 -8.729 -21.836 16.090 1.00 1.97 H new ATOM 0 HB2 PHE A 52 -10.471 -19.482 15.185 1.00 1.98 H new ATOM 0 HB3 PHE A 52 -11.138 -21.096 15.336 1.00 1.98 H new ATOM 0 HD1 PHE A 52 -9.797 -18.188 17.199 1.00 2.45 H new ATOM 0 HD2 PHE A 52 -11.532 -22.117 17.518 1.00 2.91 H new ATOM 0 HE1 PHE A 52 -10.242 -17.798 19.614 1.00 2.48 H new ATOM 0 HE2 PHE A 52 -11.998 -21.716 19.925 1.00 2.94 H new ATOM 0 HZ PHE A 52 -11.350 -19.559 20.975 1.00 1.99 H new ATOM 894 N THR A 53 -8.409 -21.005 12.992 1.00 1.99 N ATOM 895 CA THR A 53 -8.469 -21.394 11.569 1.00 2.09 C ATOM 896 C THR A 53 -7.203 -20.970 10.827 1.00 1.83 C ATOM 897 O THR A 53 -6.349 -20.301 11.408 1.00 1.72 O ATOM 898 CB THR A 53 -9.785 -20.881 10.949 1.00 2.16 C ATOM 899 OG1 THR A 53 -10.267 -21.907 10.111 1.00 2.70 O ATOM 900 CG2 THR A 53 -9.737 -19.589 10.135 1.00 1.83 C ATOM 0 H THR A 53 -7.850 -20.166 13.148 1.00 1.99 H new ATOM 0 HA THR A 53 -8.489 -22.480 11.474 1.00 2.09 H new ATOM 0 HB THR A 53 -10.420 -20.630 11.798 1.00 2.16 H new ATOM 0 HG1 THR A 53 -11.108 -21.622 9.696 1.00 2.70 H new ATOM 0 HG21 THR A 53 -10.735 -19.355 9.764 1.00 1.83 H new ATOM 0 HG22 THR A 53 -9.385 -18.774 10.767 1.00 1.83 H new ATOM 0 HG23 THR A 53 -9.057 -19.715 9.292 1.00 1.83 H new ATOM 908 N ARG A 54 -7.063 -21.328 9.547 1.00 1.86 N ATOM 909 CA ARG A 54 -5.954 -20.829 8.716 1.00 1.75 C ATOM 910 C ARG A 54 -6.057 -19.299 8.519 1.00 1.41 C ATOM 911 O ARG A 54 -7.169 -18.760 8.500 1.00 1.43 O ATOM 912 CB ARG A 54 -5.912 -21.567 7.364 1.00 1.99 C ATOM 913 CG ARG A 54 -5.384 -23.010 7.454 1.00 2.46 C ATOM 914 CD ARG A 54 -3.922 -23.074 7.929 1.00 3.28 C ATOM 915 NE ARG A 54 -3.332 -24.409 7.720 1.00 3.85 N ATOM 916 CZ ARG A 54 -3.270 -25.411 8.592 1.00 3.56 C ATOM 917 NH1 ARG A 54 -3.817 -25.340 9.789 1.00 3.24 N ATOM 918 NH2 ARG A 54 -2.640 -26.517 8.262 1.00 4.21 N ATOM 0 H ARG A 54 -7.700 -21.960 9.061 1.00 1.86 H new ATOM 0 HA ARG A 54 -5.018 -21.032 9.237 1.00 1.75 H new ATOM 0 HB2 ARG A 54 -6.916 -21.584 6.940 1.00 1.99 H new ATOM 0 HB3 ARG A 54 -5.284 -21.004 6.674 1.00 1.99 H new ATOM 0 HG2 ARG A 54 -6.011 -23.581 8.139 1.00 2.46 H new ATOM 0 HG3 ARG A 54 -5.466 -23.485 6.476 1.00 2.46 H new ATOM 0 HD2 ARG A 54 -3.334 -22.329 7.393 1.00 3.28 H new ATOM 0 HD3 ARG A 54 -3.873 -22.817 8.987 1.00 3.28 H new ATOM 0 HE ARG A 54 -2.925 -24.584 6.801 1.00 3.85 H new ATOM 0 HH11 ARG A 54 -4.310 -24.494 10.075 1.00 3.24 H new ATOM 0 HH12 ARG A 54 -3.747 -26.131 10.429 1.00 3.24 H new ATOM 0 HH21 ARG A 54 -2.204 -26.601 7.344 1.00 4.21 H new ATOM 0 HH22 ARG A 54 -2.587 -27.291 8.924 1.00 4.21 H new ATOM 932 N PRO A 55 -4.924 -18.583 8.383 1.00 1.36 N ATOM 933 CA PRO A 55 -4.915 -17.128 8.284 1.00 1.16 C ATOM 934 C PRO A 55 -5.599 -16.663 6.997 1.00 1.08 C ATOM 935 O PRO A 55 -5.620 -17.386 5.999 1.00 1.19 O ATOM 936 CB PRO A 55 -3.438 -16.722 8.341 1.00 1.47 C ATOM 937 CG PRO A 55 -2.711 -17.942 7.782 1.00 1.81 C ATOM 938 CD PRO A 55 -3.567 -19.104 8.285 1.00 1.72 C ATOM 0 HA PRO A 55 -5.475 -16.657 9.092 1.00 1.16 H new ATOM 0 HB2 PRO A 55 -3.243 -15.831 7.744 1.00 1.47 H new ATOM 0 HB3 PRO A 55 -3.122 -16.499 9.360 1.00 1.47 H new ATOM 0 HG2 PRO A 55 -2.659 -17.919 6.693 1.00 1.81 H new ATOM 0 HG3 PRO A 55 -1.686 -18.006 8.148 1.00 1.81 H new ATOM 0 HD2 PRO A 55 -3.521 -19.949 7.598 1.00 1.72 H new ATOM 0 HD3 PRO A 55 -3.214 -19.460 9.253 1.00 1.72 H new ATOM 946 N LYS A 56 -6.133 -15.438 7.012 1.00 1.12 N ATOM 947 CA LYS A 56 -6.809 -14.847 5.850 1.00 1.31 C ATOM 948 C LYS A 56 -5.988 -13.703 5.249 1.00 1.01 C ATOM 949 O LYS A 56 -5.367 -12.923 5.976 1.00 0.94 O ATOM 950 CB LYS A 56 -8.224 -14.347 6.209 1.00 1.74 C ATOM 951 CG LYS A 56 -9.220 -15.494 6.461 1.00 1.87 C ATOM 952 CD LYS A 56 -9.386 -15.851 7.945 1.00 4.07 C ATOM 953 CE LYS A 56 -10.712 -15.331 8.525 1.00 5.20 C ATOM 954 NZ LYS A 56 -10.777 -13.851 8.597 1.00 6.72 N ATOM 0 H LYS A 56 -6.110 -14.827 7.829 1.00 1.12 H new ATOM 0 HA LYS A 56 -6.903 -15.637 5.105 1.00 1.31 H new ATOM 0 HB2 LYS A 56 -8.167 -13.720 7.099 1.00 1.74 H new ATOM 0 HB3 LYS A 56 -8.598 -13.719 5.400 1.00 1.74 H new ATOM 0 HG2 LYS A 56 -10.192 -15.216 6.052 1.00 1.87 H new ATOM 0 HG3 LYS A 56 -8.887 -16.379 5.918 1.00 1.87 H new ATOM 0 HD2 LYS A 56 -9.340 -16.934 8.063 1.00 4.07 H new ATOM 0 HD3 LYS A 56 -8.555 -15.432 8.512 1.00 4.07 H new ATOM 0 HE2 LYS A 56 -11.537 -15.695 7.912 1.00 5.20 H new ATOM 0 HE3 LYS A 56 -10.851 -15.744 9.524 1.00 5.20 H new ATOM 0 HZ1 LYS A 56 -11.693 -13.563 8.996 1.00 6.72 H new ATOM 0 HZ2 LYS A 56 -10.009 -13.499 9.204 1.00 6.72 H new ATOM 0 HZ3 LYS A 56 -10.674 -13.452 7.642 1.00 6.72 H new ATOM 968 N VAL A 57 -6.036 -13.605 3.920 1.00 0.92 N ATOM 969 CA VAL A 57 -5.451 -12.539 3.097 1.00 0.68 C ATOM 970 C VAL A 57 -6.526 -12.047 2.124 1.00 0.64 C ATOM 971 O VAL A 57 -7.255 -12.854 1.546 1.00 0.87 O ATOM 972 CB VAL A 57 -4.208 -13.036 2.313 1.00 0.84 C ATOM 973 CG1 VAL A 57 -3.650 -11.977 1.342 1.00 1.37 C ATOM 974 CG2 VAL A 57 -3.074 -13.443 3.269 1.00 1.99 C ATOM 0 H VAL A 57 -6.511 -14.307 3.353 1.00 0.92 H new ATOM 0 HA VAL A 57 -5.117 -11.729 3.745 1.00 0.68 H new ATOM 0 HB VAL A 57 -4.553 -13.895 1.738 1.00 0.84 H new ATOM 0 HG11 VAL A 57 -2.782 -12.382 0.822 1.00 1.37 H new ATOM 0 HG12 VAL A 57 -4.417 -11.710 0.615 1.00 1.37 H new ATOM 0 HG13 VAL A 57 -3.356 -11.089 1.902 1.00 1.37 H new ATOM 0 HG21 VAL A 57 -2.216 -13.787 2.691 1.00 1.99 H new ATOM 0 HG22 VAL A 57 -2.783 -12.585 3.874 1.00 1.99 H new ATOM 0 HG23 VAL A 57 -3.418 -14.246 3.920 1.00 1.99 H new ATOM 984 N ALA A 58 -6.602 -10.730 1.930 1.00 0.48 N ATOM 985 CA ALA A 58 -7.430 -10.094 0.905 1.00 0.50 C ATOM 986 C ALA A 58 -6.699 -8.891 0.301 1.00 0.46 C ATOM 987 O ALA A 58 -5.967 -8.192 1.011 1.00 0.46 O ATOM 988 CB ALA A 58 -8.783 -9.677 1.504 1.00 0.65 C ATOM 0 H ALA A 58 -6.078 -10.061 2.494 1.00 0.48 H new ATOM 0 HA ALA A 58 -7.618 -10.810 0.104 1.00 0.50 H new ATOM 0 HB1 ALA A 58 -9.392 -9.205 0.733 1.00 0.65 H new ATOM 0 HB2 ALA A 58 -9.299 -10.558 1.885 1.00 0.65 H new ATOM 0 HB3 ALA A 58 -8.618 -8.972 2.319 1.00 0.65 H new ATOM 994 N PHE A 59 -6.924 -8.653 -0.992 1.00 0.54 N ATOM 995 CA PHE A 59 -6.351 -7.546 -1.753 1.00 0.48 C ATOM 996 C PHE A 59 -7.430 -6.807 -2.561 1.00 0.46 C ATOM 997 O PHE A 59 -8.339 -7.419 -3.126 1.00 0.51 O ATOM 998 CB PHE A 59 -5.192 -8.049 -2.636 1.00 0.48 C ATOM 999 CG PHE A 59 -5.479 -9.247 -3.534 1.00 0.64 C ATOM 1000 CD1 PHE A 59 -6.199 -9.085 -4.736 1.00 2.25 C ATOM 1001 CD2 PHE A 59 -4.997 -10.527 -3.189 1.00 1.52 C ATOM 1002 CE1 PHE A 59 -6.465 -10.194 -5.560 1.00 2.44 C ATOM 1003 CE2 PHE A 59 -5.263 -11.635 -4.013 1.00 1.50 C ATOM 1004 CZ PHE A 59 -6.004 -11.470 -5.196 1.00 1.12 C ATOM 0 H PHE A 59 -7.531 -9.247 -1.556 1.00 0.54 H new ATOM 0 HA PHE A 59 -5.938 -6.817 -1.056 1.00 0.48 H new ATOM 0 HB2 PHE A 59 -4.863 -7.223 -3.267 1.00 0.48 H new ATOM 0 HB3 PHE A 59 -4.356 -8.305 -1.985 1.00 0.48 H new ATOM 0 HD1 PHE A 59 -6.548 -8.105 -5.025 1.00 2.25 H new ATOM 0 HD2 PHE A 59 -4.420 -10.657 -2.286 1.00 1.52 H new ATOM 0 HE1 PHE A 59 -7.025 -10.064 -6.474 1.00 2.44 H new ATOM 0 HE2 PHE A 59 -4.898 -12.613 -3.737 1.00 1.50 H new ATOM 0 HZ PHE A 59 -6.218 -12.322 -5.824 1.00 1.12 H new ATOM 1014 N TYR A 60 -7.310 -5.479 -2.615 1.00 0.44 N ATOM 1015 CA TYR A 60 -8.233 -4.551 -3.275 1.00 0.48 C ATOM 1016 C TYR A 60 -7.447 -3.507 -4.092 1.00 0.47 C ATOM 1017 O TYR A 60 -6.438 -2.971 -3.617 1.00 0.48 O ATOM 1018 CB TYR A 60 -9.113 -3.859 -2.217 1.00 0.57 C ATOM 1019 CG TYR A 60 -9.832 -4.806 -1.268 1.00 0.59 C ATOM 1020 CD1 TYR A 60 -10.696 -5.794 -1.779 1.00 1.82 C ATOM 1021 CD2 TYR A 60 -9.611 -4.724 0.122 1.00 1.55 C ATOM 1022 CE1 TYR A 60 -11.317 -6.711 -0.913 1.00 1.84 C ATOM 1023 CE2 TYR A 60 -10.243 -5.628 0.997 1.00 1.59 C ATOM 1024 CZ TYR A 60 -11.095 -6.632 0.480 1.00 0.69 C ATOM 1025 OH TYR A 60 -11.705 -7.519 1.316 1.00 0.77 O ATOM 0 H TYR A 60 -6.526 -4.996 -2.177 1.00 0.44 H new ATOM 0 HA TYR A 60 -8.874 -5.107 -3.959 1.00 0.48 H new ATOM 0 HB2 TYR A 60 -8.489 -3.184 -1.631 1.00 0.57 H new ATOM 0 HB3 TYR A 60 -9.855 -3.245 -2.727 1.00 0.57 H new ATOM 0 HD1 TYR A 60 -10.882 -5.847 -2.841 1.00 1.82 H new ATOM 0 HD2 TYR A 60 -8.954 -3.964 0.518 1.00 1.55 H new ATOM 0 HE1 TYR A 60 -11.965 -7.477 -1.313 1.00 1.84 H new ATOM 0 HE2 TYR A 60 -10.078 -5.555 2.062 1.00 1.59 H new ATOM 0 HH TYR A 60 -11.446 -7.328 2.242 1.00 0.77 H new ATOM 1035 N THR A 61 -7.896 -3.222 -5.320 1.00 0.48 N ATOM 1036 CA THR A 61 -7.186 -2.388 -6.307 1.00 0.47 C ATOM 1037 C THR A 61 -8.073 -2.064 -7.506 1.00 0.53 C ATOM 1038 O THR A 61 -9.000 -2.810 -7.827 1.00 0.58 O ATOM 1039 CB THR A 61 -5.857 -3.042 -6.730 1.00 0.43 C ATOM 1040 OG1 THR A 61 -5.226 -2.213 -7.666 1.00 0.74 O ATOM 1041 CG2 THR A 61 -6.005 -4.421 -7.378 1.00 0.59 C ATOM 0 H THR A 61 -8.788 -3.573 -5.668 1.00 0.48 H new ATOM 0 HA THR A 61 -6.942 -1.439 -5.830 1.00 0.47 H new ATOM 0 HB THR A 61 -5.285 -3.172 -5.811 1.00 0.43 H new ATOM 0 HG1 THR A 61 -4.651 -2.754 -8.247 1.00 0.74 H new ATOM 0 HG21 THR A 61 -5.020 -4.806 -7.644 1.00 0.59 H new ATOM 0 HG22 THR A 61 -6.484 -5.103 -6.676 1.00 0.59 H new ATOM 0 HG23 THR A 61 -6.616 -4.337 -8.277 1.00 0.59 H new ATOM 1049 N ASN A 62 -7.763 -0.951 -8.169 1.00 0.56 N ATOM 1050 CA ASN A 62 -8.367 -0.511 -9.430 1.00 0.64 C ATOM 1051 C ASN A 62 -7.525 -0.923 -10.666 1.00 0.56 C ATOM 1052 O ASN A 62 -7.793 -0.469 -11.780 1.00 0.59 O ATOM 1053 CB ASN A 62 -8.597 1.005 -9.325 1.00 0.78 C ATOM 1054 CG ASN A 62 -9.458 1.614 -10.432 1.00 1.48 C ATOM 1055 OD1 ASN A 62 -10.334 0.980 -11.009 1.00 2.06 O ATOM 1056 ND2 ASN A 62 -9.258 2.888 -10.727 1.00 2.21 N ATOM 0 H ASN A 62 -7.054 -0.302 -7.829 1.00 0.56 H new ATOM 0 HA ASN A 62 -9.323 -1.010 -9.587 1.00 0.64 H new ATOM 0 HB2 ASN A 62 -9.065 1.219 -8.364 1.00 0.78 H new ATOM 0 HB3 ASN A 62 -7.628 1.504 -9.325 1.00 0.78 H new ATOM 0 HD21 ASN A 62 -9.833 3.344 -11.435 1.00 2.21 H new ATOM 0 HD22 ASN A 62 -8.529 3.414 -10.246 1.00 2.21 H new ATOM 1063 N TYR A 63 -6.512 -1.789 -10.500 1.00 0.49 N ATOM 1064 CA TYR A 63 -5.665 -2.292 -11.594 1.00 0.45 C ATOM 1065 C TYR A 63 -6.487 -2.896 -12.763 1.00 0.47 C ATOM 1066 O TYR A 63 -7.562 -3.465 -12.525 1.00 0.49 O ATOM 1067 CB TYR A 63 -4.720 -3.385 -11.053 1.00 0.41 C ATOM 1068 CG TYR A 63 -3.565 -2.988 -10.153 1.00 0.40 C ATOM 1069 CD1 TYR A 63 -2.990 -1.705 -10.206 1.00 1.80 C ATOM 1070 CD2 TYR A 63 -3.069 -3.936 -9.236 1.00 1.65 C ATOM 1071 CE1 TYR A 63 -2.018 -1.333 -9.263 1.00 1.83 C ATOM 1072 CE2 TYR A 63 -2.102 -3.565 -8.281 1.00 1.65 C ATOM 1073 CZ TYR A 63 -1.607 -2.241 -8.270 1.00 0.55 C ATOM 1074 OH TYR A 63 -0.757 -1.806 -7.302 1.00 0.76 O ATOM 0 H TYR A 63 -6.254 -2.165 -9.588 1.00 0.49 H new ATOM 0 HA TYR A 63 -5.108 -1.438 -11.979 1.00 0.45 H new ATOM 0 HB2 TYR A 63 -5.330 -4.104 -10.506 1.00 0.41 H new ATOM 0 HB3 TYR A 63 -4.301 -3.910 -11.911 1.00 0.41 H new ATOM 0 HD1 TYR A 63 -3.296 -1.007 -10.971 1.00 1.80 H new ATOM 0 HD2 TYR A 63 -3.432 -4.953 -9.265 1.00 1.65 H new ATOM 0 HE1 TYR A 63 -1.584 -0.345 -9.300 1.00 1.83 H new ATOM 0 HE2 TYR A 63 -1.742 -4.287 -7.563 1.00 1.65 H new ATOM 0 HH TYR A 63 -0.906 -0.851 -7.141 1.00 0.76 H new ATOM 1084 N PRO A 64 -5.986 -2.807 -14.015 1.00 0.49 N ATOM 1085 CA PRO A 64 -6.670 -3.335 -15.188 1.00 0.52 C ATOM 1086 C PRO A 64 -6.779 -4.858 -15.097 1.00 0.52 C ATOM 1087 O PRO A 64 -5.866 -5.524 -14.606 1.00 0.50 O ATOM 1088 CB PRO A 64 -5.864 -2.878 -16.410 1.00 0.59 C ATOM 1089 CG PRO A 64 -4.480 -2.536 -15.858 1.00 0.59 C ATOM 1090 CD PRO A 64 -4.747 -2.157 -14.405 1.00 0.52 C ATOM 0 HA PRO A 64 -7.692 -2.964 -15.263 1.00 0.52 H new ATOM 0 HB2 PRO A 64 -5.807 -3.664 -17.163 1.00 0.59 H new ATOM 0 HB3 PRO A 64 -6.325 -2.013 -16.887 1.00 0.59 H new ATOM 0 HG2 PRO A 64 -3.800 -3.385 -15.931 1.00 0.59 H new ATOM 0 HG3 PRO A 64 -4.023 -1.713 -16.408 1.00 0.59 H new ATOM 0 HD2 PRO A 64 -3.925 -2.479 -13.766 1.00 0.52 H new ATOM 0 HD3 PRO A 64 -4.829 -1.075 -14.298 1.00 0.52 H new ATOM 1098 N GLU A 65 -7.889 -5.419 -15.587 1.00 0.55 N ATOM 1099 CA GLU A 65 -8.186 -6.848 -15.457 1.00 0.58 C ATOM 1100 C GLU A 65 -7.115 -7.735 -16.113 1.00 0.60 C ATOM 1101 O GLU A 65 -6.885 -8.849 -15.657 1.00 0.62 O ATOM 1102 CB GLU A 65 -9.578 -7.139 -16.043 1.00 0.66 C ATOM 1103 CG GLU A 65 -9.604 -7.159 -17.579 1.00 0.72 C ATOM 1104 CD GLU A 65 -11.038 -7.250 -18.118 1.00 0.91 C ATOM 1105 OE1 GLU A 65 -11.569 -8.379 -18.251 1.00 1.93 O ATOM 1106 OE2 GLU A 65 -11.641 -6.195 -18.423 1.00 2.10 O ATOM 0 H GLU A 65 -8.607 -4.894 -16.085 1.00 0.55 H new ATOM 0 HA GLU A 65 -8.179 -7.096 -14.396 1.00 0.58 H new ATOM 0 HB2 GLU A 65 -9.927 -8.102 -15.669 1.00 0.66 H new ATOM 0 HB3 GLU A 65 -10.279 -6.385 -15.685 1.00 0.66 H new ATOM 0 HG2 GLU A 65 -9.127 -6.258 -17.963 1.00 0.72 H new ATOM 0 HG3 GLU A 65 -9.023 -8.007 -17.942 1.00 0.72 H new ATOM 1113 N ALA A 66 -6.418 -7.237 -17.140 1.00 0.62 N ATOM 1114 CA ALA A 66 -5.311 -7.932 -17.793 1.00 0.66 C ATOM 1115 C ALA A 66 -4.115 -8.122 -16.843 1.00 0.60 C ATOM 1116 O ALA A 66 -3.535 -9.204 -16.789 1.00 0.60 O ATOM 1117 CB ALA A 66 -4.928 -7.127 -19.041 1.00 0.72 C ATOM 0 H ALA A 66 -6.614 -6.322 -17.546 1.00 0.62 H new ATOM 0 HA ALA A 66 -5.619 -8.937 -18.080 1.00 0.66 H new ATOM 0 HB1 ALA A 66 -4.102 -7.620 -19.553 1.00 0.72 H new ATOM 0 HB2 ALA A 66 -5.785 -7.065 -19.711 1.00 0.72 H new ATOM 0 HB3 ALA A 66 -4.624 -6.122 -18.747 1.00 0.72 H new ATOM 1123 N TRP A 67 -3.802 -7.100 -16.042 1.00 0.57 N ATOM 1124 CA TRP A 67 -2.736 -7.124 -15.039 1.00 0.58 C ATOM 1125 C TRP A 67 -3.152 -7.939 -13.812 1.00 0.55 C ATOM 1126 O TRP A 67 -2.366 -8.732 -13.299 1.00 0.58 O ATOM 1127 CB TRP A 67 -2.403 -5.673 -14.660 1.00 0.61 C ATOM 1128 CG TRP A 67 -1.304 -5.425 -13.669 1.00 0.74 C ATOM 1129 CD1 TRP A 67 -1.350 -4.447 -12.737 1.00 0.91 C ATOM 1130 CD2 TRP A 67 -0.002 -6.081 -13.489 1.00 0.83 C ATOM 1131 NE1 TRP A 67 -0.200 -4.459 -11.983 1.00 1.09 N ATOM 1132 CE2 TRP A 67 0.677 -5.427 -12.412 1.00 1.06 C ATOM 1133 CE3 TRP A 67 0.694 -7.147 -14.110 1.00 0.79 C ATOM 1134 CZ2 TRP A 67 1.967 -5.787 -11.996 1.00 1.25 C ATOM 1135 CZ3 TRP A 67 1.951 -7.562 -13.639 1.00 0.96 C ATOM 1136 CH2 TRP A 67 2.606 -6.868 -12.613 1.00 1.19 C ATOM 0 H TRP A 67 -4.297 -6.209 -16.075 1.00 0.57 H new ATOM 0 HA TRP A 67 -1.850 -7.609 -15.450 1.00 0.58 H new ATOM 0 HB2 TRP A 67 -2.149 -5.141 -15.577 1.00 0.61 H new ATOM 0 HB3 TRP A 67 -3.312 -5.216 -14.268 1.00 0.61 H new ATOM 0 HD1 TRP A 67 -2.170 -3.757 -12.604 1.00 0.91 H new ATOM 0 HE1 TRP A 67 -0.020 -3.828 -11.202 1.00 1.09 H new ATOM 0 HE3 TRP A 67 0.252 -7.648 -14.958 1.00 0.79 H new ATOM 0 HZ2 TRP A 67 2.461 -5.237 -11.209 1.00 1.25 H new ATOM 0 HZ3 TRP A 67 2.421 -8.431 -14.075 1.00 0.96 H new ATOM 0 HH2 TRP A 67 3.596 -7.165 -12.301 1.00 1.19 H new ATOM 1147 N VAL A 68 -4.406 -7.784 -13.383 1.00 0.50 N ATOM 1148 CA VAL A 68 -4.978 -8.500 -12.231 1.00 0.48 C ATOM 1149 C VAL A 68 -5.108 -9.996 -12.528 1.00 0.58 C ATOM 1150 O VAL A 68 -4.720 -10.823 -11.703 1.00 0.62 O ATOM 1151 CB VAL A 68 -6.348 -7.902 -11.839 1.00 0.48 C ATOM 1152 CG1 VAL A 68 -7.069 -8.673 -10.729 1.00 0.52 C ATOM 1153 CG2 VAL A 68 -6.185 -6.460 -11.346 1.00 0.46 C ATOM 0 H VAL A 68 -5.067 -7.148 -13.830 1.00 0.50 H new ATOM 0 HA VAL A 68 -4.298 -8.379 -11.388 1.00 0.48 H new ATOM 0 HB VAL A 68 -6.947 -7.960 -12.748 1.00 0.48 H new ATOM 0 HG11 VAL A 68 -8.022 -8.191 -10.511 1.00 0.52 H new ATOM 0 HG12 VAL A 68 -7.247 -9.698 -11.054 1.00 0.52 H new ATOM 0 HG13 VAL A 68 -6.452 -8.679 -9.831 1.00 0.52 H new ATOM 0 HG21 VAL A 68 -7.160 -6.056 -11.075 1.00 0.46 H new ATOM 0 HG22 VAL A 68 -5.531 -6.445 -10.474 1.00 0.46 H new ATOM 0 HG23 VAL A 68 -5.748 -5.852 -12.138 1.00 0.46 H new ATOM 1163 N SER A 69 -5.608 -10.355 -13.714 1.00 0.63 N ATOM 1164 CA SER A 69 -5.717 -11.757 -14.125 1.00 0.71 C ATOM 1165 C SER A 69 -4.332 -12.374 -14.319 1.00 0.75 C ATOM 1166 O SER A 69 -4.085 -13.446 -13.786 1.00 0.80 O ATOM 1167 CB SER A 69 -6.560 -11.893 -15.400 1.00 0.75 C ATOM 1168 OG SER A 69 -6.875 -13.252 -15.671 1.00 0.84 O ATOM 0 H SER A 69 -5.945 -9.690 -14.410 1.00 0.63 H new ATOM 0 HA SER A 69 -6.224 -12.303 -13.329 1.00 0.71 H new ATOM 0 HB2 SER A 69 -7.480 -11.319 -15.292 1.00 0.75 H new ATOM 0 HB3 SER A 69 -6.017 -11.469 -16.244 1.00 0.75 H new ATOM 0 HG SER A 69 -7.414 -13.306 -16.488 1.00 0.84 H new ATOM 1174 N TYR A 70 -3.379 -11.694 -14.968 1.00 0.72 N ATOM 1175 CA TYR A 70 -1.997 -12.172 -15.110 1.00 0.74 C ATOM 1176 C TYR A 70 -1.332 -12.442 -13.754 1.00 0.66 C ATOM 1177 O TYR A 70 -0.737 -13.503 -13.559 1.00 0.69 O ATOM 1178 CB TYR A 70 -1.214 -11.125 -15.904 1.00 0.76 C ATOM 1179 CG TYR A 70 0.244 -11.465 -16.076 1.00 0.81 C ATOM 1180 CD1 TYR A 70 0.617 -12.459 -16.995 1.00 1.75 C ATOM 1181 CD2 TYR A 70 1.218 -10.810 -15.307 1.00 2.34 C ATOM 1182 CE1 TYR A 70 1.977 -12.770 -17.183 1.00 1.72 C ATOM 1183 CE2 TYR A 70 2.580 -11.103 -15.500 1.00 2.43 C ATOM 1184 CZ TYR A 70 2.967 -12.072 -16.453 1.00 0.97 C ATOM 1185 OH TYR A 70 4.286 -12.334 -16.669 1.00 1.08 O ATOM 0 H TYR A 70 -3.545 -10.791 -15.412 1.00 0.72 H new ATOM 0 HA TYR A 70 -2.002 -13.126 -15.638 1.00 0.74 H new ATOM 0 HB2 TYR A 70 -1.670 -11.011 -16.887 1.00 0.76 H new ATOM 0 HB3 TYR A 70 -1.297 -10.162 -15.400 1.00 0.76 H new ATOM 0 HD1 TYR A 70 -0.140 -12.985 -17.558 1.00 1.75 H new ATOM 0 HD2 TYR A 70 0.922 -10.081 -14.567 1.00 2.34 H new ATOM 0 HE1 TYR A 70 2.264 -13.540 -17.884 1.00 1.72 H new ATOM 0 HE2 TYR A 70 3.331 -10.587 -14.920 1.00 2.43 H new ATOM 0 HH TYR A 70 4.833 -11.692 -16.170 1.00 1.08 H new ATOM 1195 N TYR A 71 -1.490 -11.522 -12.801 1.00 0.59 N ATOM 1196 CA TYR A 71 -0.946 -11.651 -11.452 1.00 0.56 C ATOM 1197 C TYR A 71 -1.519 -12.872 -10.712 1.00 0.60 C ATOM 1198 O TYR A 71 -0.773 -13.630 -10.093 1.00 0.62 O ATOM 1199 CB TYR A 71 -1.198 -10.336 -10.700 1.00 0.55 C ATOM 1200 CG TYR A 71 -0.534 -10.263 -9.344 1.00 0.77 C ATOM 1201 CD1 TYR A 71 -1.145 -10.866 -8.228 1.00 1.44 C ATOM 1202 CD2 TYR A 71 0.698 -9.593 -9.196 1.00 2.20 C ATOM 1203 CE1 TYR A 71 -0.527 -10.796 -6.968 1.00 1.66 C ATOM 1204 CE2 TYR A 71 1.322 -9.532 -7.936 1.00 2.62 C ATOM 1205 CZ TYR A 71 0.708 -10.137 -6.817 1.00 1.81 C ATOM 1206 OH TYR A 71 1.282 -10.074 -5.588 1.00 2.36 O ATOM 0 H TYR A 71 -2.007 -10.655 -12.949 1.00 0.59 H new ATOM 0 HA TYR A 71 0.128 -11.829 -11.507 1.00 0.56 H new ATOM 0 HB2 TYR A 71 -0.843 -9.507 -11.312 1.00 0.55 H new ATOM 0 HB3 TYR A 71 -2.272 -10.202 -10.574 1.00 0.55 H new ATOM 0 HD1 TYR A 71 -2.087 -11.382 -8.340 1.00 1.44 H new ATOM 0 HD2 TYR A 71 1.164 -9.126 -10.051 1.00 2.20 H new ATOM 0 HE1 TYR A 71 -1.002 -11.250 -6.111 1.00 1.66 H new ATOM 0 HE2 TYR A 71 2.268 -9.024 -7.825 1.00 2.62 H new ATOM 0 HH TYR A 71 0.619 -10.308 -4.905 1.00 2.36 H new ATOM 1216 N GLN A 72 -2.831 -13.094 -10.798 1.00 0.64 N ATOM 1217 CA GLN A 72 -3.498 -14.254 -10.198 1.00 0.70 C ATOM 1218 C GLN A 72 -3.221 -15.572 -10.945 1.00 0.77 C ATOM 1219 O GLN A 72 -3.007 -16.603 -10.309 1.00 0.82 O ATOM 1220 CB GLN A 72 -5.006 -13.966 -10.110 1.00 0.74 C ATOM 1221 CG GLN A 72 -5.319 -13.047 -8.916 1.00 0.79 C ATOM 1222 CD GLN A 72 -6.820 -12.816 -8.737 1.00 1.42 C ATOM 1223 OE1 GLN A 72 -7.346 -11.733 -8.962 1.00 2.80 O ATOM 1224 NE2 GLN A 72 -7.575 -13.818 -8.328 1.00 2.12 N ATOM 0 H GLN A 72 -3.468 -12.468 -11.291 1.00 0.64 H new ATOM 0 HA GLN A 72 -3.085 -14.400 -9.200 1.00 0.70 H new ATOM 0 HB2 GLN A 72 -5.346 -13.498 -11.034 1.00 0.74 H new ATOM 0 HB3 GLN A 72 -5.554 -14.903 -10.007 1.00 0.74 H new ATOM 0 HG2 GLN A 72 -4.911 -13.486 -8.006 1.00 0.79 H new ATOM 0 HG3 GLN A 72 -4.821 -12.088 -9.059 1.00 0.79 H new ATOM 0 HE21 GLN A 72 -7.155 -14.727 -8.136 1.00 2.12 H new ATOM 0 HE22 GLN A 72 -8.578 -13.683 -8.204 1.00 2.12 H new ATOM 1233 N ALA A 73 -3.205 -15.553 -12.280 1.00 0.79 N ATOM 1234 CA ALA A 73 -3.153 -16.737 -13.145 1.00 0.88 C ATOM 1235 C ALA A 73 -1.799 -17.455 -13.078 1.00 0.89 C ATOM 1236 O ALA A 73 -1.729 -18.685 -13.089 1.00 0.96 O ATOM 1237 CB ALA A 73 -3.474 -16.285 -14.580 1.00 0.92 C ATOM 0 H ALA A 73 -3.229 -14.681 -12.809 1.00 0.79 H new ATOM 0 HA ALA A 73 -3.888 -17.465 -12.800 1.00 0.88 H new ATOM 0 HB1 ALA A 73 -3.443 -17.146 -15.248 1.00 0.92 H new ATOM 0 HB2 ALA A 73 -4.469 -15.840 -14.607 1.00 0.92 H new ATOM 0 HB3 ALA A 73 -2.738 -15.548 -14.903 1.00 0.92 H new ATOM 1243 N LYS A 74 -0.718 -16.677 -12.989 1.00 0.85 N ATOM 1244 CA LYS A 74 0.655 -17.154 -12.786 1.00 0.90 C ATOM 1245 C LYS A 74 1.044 -17.232 -11.292 1.00 0.83 C ATOM 1246 O LYS A 74 2.153 -17.656 -10.962 1.00 0.85 O ATOM 1247 CB LYS A 74 1.575 -16.211 -13.579 1.00 0.97 C ATOM 1248 CG LYS A 74 1.823 -16.623 -15.037 1.00 0.95 C ATOM 1249 CD LYS A 74 0.605 -16.882 -15.937 1.00 1.23 C ATOM 1250 CE LYS A 74 -0.086 -15.569 -16.316 1.00 1.66 C ATOM 1251 NZ LYS A 74 -1.235 -15.795 -17.234 1.00 2.15 N ATOM 0 H LYS A 74 -0.775 -15.661 -13.059 1.00 0.85 H new ATOM 0 HA LYS A 74 0.754 -18.178 -13.146 1.00 0.90 H new ATOM 0 HB2 LYS A 74 1.142 -15.211 -13.568 1.00 0.97 H new ATOM 0 HB3 LYS A 74 2.535 -16.148 -13.066 1.00 0.97 H new ATOM 0 HG2 LYS A 74 2.423 -15.843 -15.506 1.00 0.95 H new ATOM 0 HG3 LYS A 74 2.429 -17.529 -15.028 1.00 0.95 H new ATOM 0 HD2 LYS A 74 0.920 -17.405 -16.840 1.00 1.23 H new ATOM 0 HD3 LYS A 74 -0.101 -17.533 -15.421 1.00 1.23 H new ATOM 0 HE2 LYS A 74 -0.435 -15.068 -15.413 1.00 1.66 H new ATOM 0 HE3 LYS A 74 0.634 -14.903 -16.792 1.00 1.66 H new ATOM 0 HZ1 LYS A 74 -1.687 -14.885 -17.454 1.00 2.15 H new ATOM 0 HZ2 LYS A 74 -0.896 -16.235 -18.113 1.00 2.15 H new ATOM 0 HZ3 LYS A 74 -1.926 -16.423 -16.777 1.00 2.15 H new ATOM 1265 N ASN A 75 0.141 -16.825 -10.390 1.00 0.76 N ATOM 1266 CA ASN A 75 0.287 -16.858 -8.932 1.00 0.73 C ATOM 1267 C ASN A 75 1.490 -16.023 -8.449 1.00 0.62 C ATOM 1268 O ASN A 75 2.345 -16.496 -7.698 1.00 0.63 O ATOM 1269 CB ASN A 75 0.266 -18.300 -8.397 1.00 0.88 C ATOM 1270 CG ASN A 75 -1.108 -18.951 -8.531 1.00 1.10 C ATOM 1271 OD1 ASN A 75 -1.938 -18.869 -7.631 1.00 2.39 O ATOM 1272 ND2 ASN A 75 -1.392 -19.614 -9.638 1.00 1.97 N ATOM 0 H ASN A 75 -0.760 -16.443 -10.676 1.00 0.76 H new ATOM 0 HA ASN A 75 -0.585 -16.370 -8.496 1.00 0.73 H new ATOM 0 HB2 ASN A 75 1.001 -18.896 -8.938 1.00 0.88 H new ATOM 0 HB3 ASN A 75 0.564 -18.300 -7.349 1.00 0.88 H new ATOM 0 HD21 ASN A 75 -2.303 -20.059 -9.746 1.00 1.97 H new ATOM 0 HD22 ASN A 75 -0.700 -19.680 -10.384 1.00 1.97 H new ATOM 1279 N PHE A 76 1.557 -14.754 -8.868 1.00 0.55 N ATOM 1280 CA PHE A 76 2.631 -13.823 -8.512 1.00 0.50 C ATOM 1281 C PHE A 76 2.700 -13.505 -7.009 1.00 0.44 C ATOM 1282 O PHE A 76 3.748 -13.054 -6.550 1.00 0.43 O ATOM 1283 CB PHE A 76 2.515 -12.554 -9.367 1.00 0.49 C ATOM 1284 CG PHE A 76 3.175 -12.678 -10.727 1.00 0.57 C ATOM 1285 CD1 PHE A 76 2.471 -13.169 -11.841 1.00 2.07 C ATOM 1286 CD2 PHE A 76 4.522 -12.304 -10.872 1.00 2.12 C ATOM 1287 CE1 PHE A 76 3.109 -13.254 -13.092 1.00 2.03 C ATOM 1288 CE2 PHE A 76 5.167 -12.417 -12.114 1.00 2.19 C ATOM 1289 CZ PHE A 76 4.458 -12.895 -13.224 1.00 0.69 C ATOM 0 H PHE A 76 0.851 -14.338 -9.476 1.00 0.55 H new ATOM 0 HA PHE A 76 3.578 -14.317 -8.732 1.00 0.50 H new ATOM 0 HB2 PHE A 76 1.461 -12.313 -9.504 1.00 0.49 H new ATOM 0 HB3 PHE A 76 2.965 -11.720 -8.828 1.00 0.49 H new ATOM 0 HD1 PHE A 76 1.442 -13.480 -11.736 1.00 2.07 H new ATOM 0 HD2 PHE A 76 5.066 -11.926 -10.019 1.00 2.12 H new ATOM 0 HE1 PHE A 76 2.557 -13.597 -13.955 1.00 2.03 H new ATOM 0 HE2 PHE A 76 6.205 -12.137 -12.213 1.00 2.19 H new ATOM 0 HZ PHE A 76 4.950 -12.987 -14.181 1.00 0.69 H new ATOM 1299 N LEU A 77 1.676 -13.849 -6.212 1.00 0.46 N ATOM 1300 CA LEU A 77 1.779 -13.875 -4.747 1.00 0.50 C ATOM 1301 C LEU A 77 2.930 -14.778 -4.242 1.00 0.58 C ATOM 1302 O LEU A 77 3.443 -14.559 -3.146 1.00 0.66 O ATOM 1303 CB LEU A 77 0.443 -14.306 -4.099 1.00 0.57 C ATOM 1304 CG LEU A 77 -0.721 -13.304 -4.242 1.00 0.76 C ATOM 1305 CD1 LEU A 77 -1.624 -13.642 -5.438 1.00 1.54 C ATOM 1306 CD2 LEU A 77 -1.610 -13.283 -2.990 1.00 0.95 C ATOM 0 H LEU A 77 0.757 -14.116 -6.565 1.00 0.46 H new ATOM 0 HA LEU A 77 2.009 -12.854 -4.442 1.00 0.50 H new ATOM 0 HB2 LEU A 77 0.137 -15.256 -4.537 1.00 0.57 H new ATOM 0 HB3 LEU A 77 0.616 -14.486 -3.038 1.00 0.57 H new ATOM 0 HG LEU A 77 -0.253 -12.331 -4.389 1.00 0.76 H new ATOM 0 HD11 LEU A 77 -2.431 -12.912 -5.503 1.00 1.54 H new ATOM 0 HD12 LEU A 77 -1.037 -13.616 -6.356 1.00 1.54 H new ATOM 0 HD13 LEU A 77 -2.046 -14.638 -5.305 1.00 1.54 H new ATOM 0 HD21 LEU A 77 -2.418 -12.565 -3.130 1.00 0.95 H new ATOM 0 HD22 LEU A 77 -2.030 -14.275 -2.826 1.00 0.95 H new ATOM 0 HD23 LEU A 77 -1.013 -12.994 -2.125 1.00 0.95 H new ATOM 1318 N ALA A 78 3.377 -15.760 -5.035 1.00 0.62 N ATOM 1319 CA ALA A 78 4.533 -16.604 -4.726 1.00 0.71 C ATOM 1320 C ALA A 78 5.894 -15.902 -4.917 1.00 0.69 C ATOM 1321 O ALA A 78 6.892 -16.371 -4.366 1.00 0.80 O ATOM 1322 CB ALA A 78 4.450 -17.858 -5.606 1.00 0.78 C ATOM 0 H ALA A 78 2.936 -15.993 -5.925 1.00 0.62 H new ATOM 0 HA ALA A 78 4.488 -16.854 -3.666 1.00 0.71 H new ATOM 0 HB1 ALA A 78 5.301 -18.506 -5.397 1.00 0.78 H new ATOM 0 HB2 ALA A 78 3.525 -18.393 -5.391 1.00 0.78 H new ATOM 0 HB3 ALA A 78 4.466 -17.567 -6.656 1.00 0.78 H new ATOM 1328 N ILE A 79 5.959 -14.810 -5.696 1.00 0.57 N ATOM 1329 CA ILE A 79 7.223 -14.125 -6.059 1.00 0.55 C ATOM 1330 C ILE A 79 7.260 -12.633 -5.670 1.00 0.49 C ATOM 1331 O ILE A 79 8.323 -12.015 -5.703 1.00 0.50 O ATOM 1332 CB ILE A 79 7.597 -14.381 -7.546 1.00 0.57 C ATOM 1333 CG1 ILE A 79 6.823 -13.559 -8.603 1.00 0.54 C ATOM 1334 CG2 ILE A 79 7.452 -15.870 -7.914 1.00 0.70 C ATOM 1335 CD1 ILE A 79 7.471 -12.207 -8.926 1.00 0.58 C ATOM 0 H ILE A 79 5.132 -14.369 -6.098 1.00 0.57 H new ATOM 0 HA ILE A 79 8.004 -14.578 -5.448 1.00 0.55 H new ATOM 0 HB ILE A 79 8.633 -14.046 -7.589 1.00 0.57 H new ATOM 0 HG12 ILE A 79 6.746 -14.143 -9.520 1.00 0.54 H new ATOM 0 HG13 ILE A 79 5.807 -13.389 -8.246 1.00 0.54 H new ATOM 0 HG21 ILE A 79 7.721 -16.014 -8.960 1.00 0.70 H new ATOM 0 HG22 ILE A 79 8.112 -16.466 -7.284 1.00 0.70 H new ATOM 0 HG23 ILE A 79 6.420 -16.184 -7.758 1.00 0.70 H new ATOM 0 HD11 ILE A 79 6.873 -11.687 -9.674 1.00 0.58 H new ATOM 0 HD12 ILE A 79 7.524 -11.603 -8.020 1.00 0.58 H new ATOM 0 HD13 ILE A 79 8.477 -12.369 -9.313 1.00 0.58 H new ATOM 1347 N ASP A 80 6.130 -12.061 -5.252 1.00 0.49 N ATOM 1348 CA ASP A 80 5.993 -10.688 -4.759 1.00 0.56 C ATOM 1349 C ASP A 80 6.582 -10.507 -3.338 1.00 0.61 C ATOM 1350 O ASP A 80 6.178 -11.234 -2.426 1.00 0.70 O ATOM 1351 CB ASP A 80 4.501 -10.312 -4.755 1.00 0.68 C ATOM 1352 CG ASP A 80 4.254 -9.010 -3.984 1.00 1.42 C ATOM 1353 OD1 ASP A 80 5.042 -8.058 -4.181 1.00 2.00 O ATOM 1354 OD2 ASP A 80 3.363 -8.983 -3.109 1.00 2.69 O ATOM 0 H ASP A 80 5.243 -12.565 -5.247 1.00 0.49 H new ATOM 0 HA ASP A 80 6.557 -10.033 -5.423 1.00 0.56 H new ATOM 0 HB2 ASP A 80 4.149 -10.201 -5.781 1.00 0.68 H new ATOM 0 HB3 ASP A 80 3.922 -11.119 -4.305 1.00 0.68 H new ATOM 1359 N PRO A 81 7.464 -9.511 -3.102 1.00 0.65 N ATOM 1360 CA PRO A 81 7.972 -9.193 -1.776 1.00 0.72 C ATOM 1361 C PRO A 81 7.068 -8.216 -0.999 1.00 0.71 C ATOM 1362 O PRO A 81 7.239 -8.101 0.212 1.00 0.76 O ATOM 1363 CB PRO A 81 9.363 -8.619 -2.036 1.00 0.81 C ATOM 1364 CG PRO A 81 9.186 -7.861 -3.349 1.00 0.77 C ATOM 1365 CD PRO A 81 8.109 -8.651 -4.091 1.00 0.69 C ATOM 0 HA PRO A 81 8.000 -10.073 -1.134 1.00 0.72 H new ATOM 0 HB2 PRO A 81 9.684 -7.959 -1.230 1.00 0.81 H new ATOM 0 HB3 PRO A 81 10.113 -9.405 -2.122 1.00 0.81 H new ATOM 0 HG2 PRO A 81 8.877 -6.830 -3.176 1.00 0.77 H new ATOM 0 HG3 PRO A 81 10.116 -7.824 -3.917 1.00 0.77 H new ATOM 0 HD2 PRO A 81 7.384 -7.979 -4.551 1.00 0.69 H new ATOM 0 HD3 PRO A 81 8.548 -9.245 -4.893 1.00 0.69 H new ATOM 1373 N VAL A 82 6.111 -7.525 -1.641 1.00 0.66 N ATOM 1374 CA VAL A 82 5.236 -6.520 -1.001 1.00 0.70 C ATOM 1375 C VAL A 82 4.267 -7.150 0.025 1.00 0.74 C ATOM 1376 O VAL A 82 3.790 -6.455 0.919 1.00 0.84 O ATOM 1377 CB VAL A 82 4.472 -5.713 -2.087 1.00 0.78 C ATOM 1378 CG1 VAL A 82 3.378 -4.782 -1.560 1.00 2.38 C ATOM 1379 CG2 VAL A 82 5.437 -4.943 -3.014 1.00 1.72 C ATOM 0 H VAL A 82 5.918 -7.649 -2.635 1.00 0.66 H new ATOM 0 HA VAL A 82 5.870 -5.836 -0.437 1.00 0.70 H new ATOM 0 HB VAL A 82 3.950 -6.477 -2.663 1.00 0.78 H new ATOM 0 HG11 VAL A 82 2.906 -4.266 -2.396 1.00 2.38 H new ATOM 0 HG12 VAL A 82 2.629 -5.366 -1.025 1.00 2.38 H new ATOM 0 HG13 VAL A 82 3.818 -4.050 -0.883 1.00 2.38 H new ATOM 0 HG21 VAL A 82 4.863 -4.392 -3.759 1.00 1.72 H new ATOM 0 HG22 VAL A 82 6.030 -4.245 -2.423 1.00 1.72 H new ATOM 0 HG23 VAL A 82 6.100 -5.648 -3.515 1.00 1.72 H new ATOM 1389 N LEU A 83 4.021 -8.467 -0.041 1.00 0.77 N ATOM 1390 CA LEU A 83 3.253 -9.224 0.963 1.00 0.84 C ATOM 1391 C LEU A 83 4.118 -9.962 2.002 1.00 0.85 C ATOM 1392 O LEU A 83 3.578 -10.503 2.967 1.00 0.90 O ATOM 1393 CB LEU A 83 2.252 -10.147 0.234 1.00 0.86 C ATOM 1394 CG LEU A 83 2.830 -11.254 -0.679 1.00 0.82 C ATOM 1395 CD1 LEU A 83 3.346 -12.482 0.089 1.00 0.89 C ATOM 1396 CD2 LEU A 83 1.722 -11.717 -1.635 1.00 0.92 C ATOM 0 H LEU A 83 4.356 -9.049 -0.809 1.00 0.77 H new ATOM 0 HA LEU A 83 2.700 -8.508 1.572 1.00 0.84 H new ATOM 0 HB2 LEU A 83 1.627 -10.626 0.988 1.00 0.86 H new ATOM 0 HB3 LEU A 83 1.597 -9.520 -0.372 1.00 0.86 H new ATOM 0 HG LEU A 83 3.683 -10.822 -1.203 1.00 0.82 H new ATOM 0 HD11 LEU A 83 3.736 -13.215 -0.617 1.00 0.89 H new ATOM 0 HD12 LEU A 83 4.140 -12.177 0.771 1.00 0.89 H new ATOM 0 HD13 LEU A 83 2.529 -12.925 0.658 1.00 0.89 H new ATOM 0 HD21 LEU A 83 2.109 -12.499 -2.289 1.00 0.92 H new ATOM 0 HD22 LEU A 83 0.884 -12.108 -1.058 1.00 0.92 H new ATOM 0 HD23 LEU A 83 1.386 -10.873 -2.238 1.00 0.92 H new ATOM 1408 N ASN A 84 5.444 -10.005 1.827 1.00 0.85 N ATOM 1409 CA ASN A 84 6.362 -10.738 2.707 1.00 0.85 C ATOM 1410 C ASN A 84 6.950 -9.814 3.796 1.00 0.87 C ATOM 1411 O ASN A 84 7.825 -9.007 3.467 1.00 0.85 O ATOM 1412 CB ASN A 84 7.495 -11.343 1.859 1.00 0.87 C ATOM 1413 CG ASN A 84 7.101 -12.656 1.183 1.00 1.83 C ATOM 1414 OD1 ASN A 84 6.544 -13.559 1.796 1.00 2.45 O ATOM 1415 ND2 ASN A 84 7.384 -12.812 -0.097 1.00 2.76 N ATOM 0 H ASN A 84 5.916 -9.525 1.060 1.00 0.85 H new ATOM 0 HA ASN A 84 5.808 -11.532 3.209 1.00 0.85 H new ATOM 0 HB2 ASN A 84 7.794 -10.624 1.096 1.00 0.87 H new ATOM 0 HB3 ASN A 84 8.364 -11.514 2.494 1.00 0.87 H new ATOM 0 HD21 ASN A 84 7.139 -13.681 -0.571 1.00 2.76 H new ATOM 0 HD22 ASN A 84 7.848 -12.063 -0.612 1.00 2.76 H new ATOM 1422 N PRO A 85 6.548 -9.931 5.081 1.00 0.95 N ATOM 1423 CA PRO A 85 6.937 -8.996 6.143 1.00 0.99 C ATOM 1424 C PRO A 85 8.439 -9.029 6.471 1.00 1.03 C ATOM 1425 O PRO A 85 8.964 -8.066 7.024 1.00 1.07 O ATOM 1426 CB PRO A 85 6.081 -9.383 7.356 1.00 1.10 C ATOM 1427 CG PRO A 85 5.800 -10.864 7.139 1.00 1.11 C ATOM 1428 CD PRO A 85 5.641 -10.932 5.623 1.00 1.04 C ATOM 0 HA PRO A 85 6.763 -7.967 5.827 1.00 0.99 H new ATOM 0 HB2 PRO A 85 6.611 -9.209 8.292 1.00 1.10 H new ATOM 0 HB3 PRO A 85 5.160 -8.802 7.398 1.00 1.10 H new ATOM 0 HG2 PRO A 85 6.618 -11.492 7.493 1.00 1.11 H new ATOM 0 HG3 PRO A 85 4.900 -11.190 7.660 1.00 1.11 H new ATOM 0 HD2 PRO A 85 5.887 -11.926 5.249 1.00 1.04 H new ATOM 0 HD3 PRO A 85 4.612 -10.727 5.329 1.00 1.04 H new ATOM 1436 N GLU A 86 9.144 -10.104 6.102 1.00 1.09 N ATOM 1437 CA GLU A 86 10.588 -10.273 6.282 1.00 1.18 C ATOM 1438 C GLU A 86 11.412 -9.310 5.407 1.00 1.13 C ATOM 1439 O GLU A 86 12.524 -8.926 5.775 1.00 1.21 O ATOM 1440 CB GLU A 86 10.991 -11.714 5.951 1.00 1.31 C ATOM 1441 CG GLU A 86 10.246 -12.739 6.819 1.00 1.58 C ATOM 1442 CD GLU A 86 8.857 -13.157 6.295 1.00 2.71 C ATOM 1443 OE1 GLU A 86 8.410 -12.656 5.235 1.00 3.79 O ATOM 1444 OE2 GLU A 86 8.194 -13.980 6.969 1.00 3.58 O ATOM 0 H GLU A 86 8.707 -10.909 5.653 1.00 1.09 H new ATOM 0 HA GLU A 86 10.804 -10.043 7.325 1.00 1.18 H new ATOM 0 HB2 GLU A 86 10.786 -11.914 4.899 1.00 1.31 H new ATOM 0 HB3 GLU A 86 12.065 -11.831 6.095 1.00 1.31 H new ATOM 0 HG2 GLU A 86 10.865 -13.631 6.912 1.00 1.58 H new ATOM 0 HG3 GLU A 86 10.130 -12.326 7.821 1.00 1.58 H new ATOM 1451 N ASN A 87 10.871 -8.908 4.250 1.00 1.04 N ATOM 1452 CA ASN A 87 11.538 -8.014 3.297 1.00 1.01 C ATOM 1453 C ASN A 87 11.600 -6.553 3.798 1.00 0.91 C ATOM 1454 O ASN A 87 12.477 -5.787 3.390 1.00 0.94 O ATOM 1455 CB ASN A 87 10.819 -8.118 1.934 1.00 1.03 C ATOM 1456 CG ASN A 87 11.793 -8.462 0.811 1.00 1.29 C ATOM 1457 OD1 ASN A 87 12.357 -7.599 0.151 1.00 1.88 O ATOM 1458 ND2 ASN A 87 12.035 -9.739 0.572 1.00 2.49 N ATOM 0 H ASN A 87 9.942 -9.200 3.946 1.00 1.04 H new ATOM 0 HA ASN A 87 12.575 -8.330 3.189 1.00 1.01 H new ATOM 0 HB2 ASN A 87 10.042 -8.880 1.989 1.00 1.03 H new ATOM 0 HB3 ASN A 87 10.323 -7.173 1.710 1.00 1.03 H new ATOM 0 HD21 ASN A 87 12.691 -10.005 -0.162 1.00 2.49 H new ATOM 0 HD22 ASN A 87 11.565 -10.459 1.122 1.00 2.49 H new ATOM 1465 N PHE A 88 10.694 -6.171 4.709 1.00 0.85 N ATOM 1466 CA PHE A 88 10.541 -4.826 5.269 1.00 0.80 C ATOM 1467 C PHE A 88 11.563 -4.578 6.394 1.00 0.87 C ATOM 1468 O PHE A 88 11.219 -4.431 7.567 1.00 0.88 O ATOM 1469 CB PHE A 88 9.089 -4.639 5.740 1.00 0.75 C ATOM 1470 CG PHE A 88 8.069 -4.689 4.624 1.00 0.70 C ATOM 1471 CD1 PHE A 88 7.641 -5.925 4.115 1.00 2.12 C ATOM 1472 CD2 PHE A 88 7.552 -3.501 4.084 1.00 1.81 C ATOM 1473 CE1 PHE A 88 6.707 -5.984 3.067 1.00 2.11 C ATOM 1474 CE2 PHE A 88 6.581 -3.552 3.074 1.00 1.82 C ATOM 1475 CZ PHE A 88 6.170 -4.790 2.552 1.00 0.65 C ATOM 0 H PHE A 88 10.014 -6.828 5.093 1.00 0.85 H new ATOM 0 HA PHE A 88 10.748 -4.080 4.501 1.00 0.80 H new ATOM 0 HB2 PHE A 88 8.852 -5.413 6.470 1.00 0.75 H new ATOM 0 HB3 PHE A 88 9.005 -3.681 6.253 1.00 0.75 H new ATOM 0 HD1 PHE A 88 8.034 -6.840 4.533 1.00 2.12 H new ATOM 0 HD2 PHE A 88 7.903 -2.546 4.447 1.00 1.81 H new ATOM 0 HE1 PHE A 88 6.404 -6.938 2.660 1.00 2.11 H new ATOM 0 HE2 PHE A 88 6.148 -2.638 2.696 1.00 1.82 H new ATOM 0 HZ PHE A 88 5.442 -4.825 1.755 1.00 0.65 H new ATOM 1485 N SER A 89 12.846 -4.542 6.039 1.00 0.92 N ATOM 1486 CA SER A 89 13.969 -4.503 7.002 1.00 0.94 C ATOM 1487 C SER A 89 14.148 -3.139 7.702 1.00 0.86 C ATOM 1488 O SER A 89 14.869 -3.036 8.697 1.00 0.86 O ATOM 1489 CB SER A 89 15.264 -4.945 6.303 1.00 1.11 C ATOM 1490 OG SER A 89 15.256 -6.345 6.041 1.00 1.47 O ATOM 0 H SER A 89 13.149 -4.539 5.065 1.00 0.92 H new ATOM 0 HA SER A 89 13.724 -5.202 7.802 1.00 0.94 H new ATOM 0 HB2 SER A 89 15.380 -4.398 5.367 1.00 1.11 H new ATOM 0 HB3 SER A 89 16.121 -4.694 6.928 1.00 1.11 H new ATOM 0 HG SER A 89 16.091 -6.599 5.594 1.00 1.47 H new ATOM 1496 N GLN A 90 13.452 -2.100 7.228 1.00 0.86 N ATOM 1497 CA GLN A 90 13.248 -0.815 7.915 1.00 0.86 C ATOM 1498 C GLN A 90 11.746 -0.449 7.968 1.00 0.80 C ATOM 1499 O GLN A 90 11.375 0.726 7.959 1.00 0.82 O ATOM 1500 CB GLN A 90 14.116 0.270 7.238 1.00 0.92 C ATOM 1501 CG GLN A 90 15.610 0.173 7.607 1.00 0.97 C ATOM 1502 CD GLN A 90 15.915 0.471 9.084 1.00 2.15 C ATOM 1503 OE1 GLN A 90 15.082 0.916 9.866 1.00 3.17 O ATOM 1504 NE2 GLN A 90 17.134 0.248 9.534 1.00 2.95 N ATOM 0 H GLN A 90 12.995 -2.130 6.317 1.00 0.86 H new ATOM 0 HA GLN A 90 13.571 -0.893 8.953 1.00 0.86 H new ATOM 0 HB2 GLN A 90 14.010 0.188 6.156 1.00 0.92 H new ATOM 0 HB3 GLN A 90 13.742 1.254 7.521 1.00 0.92 H new ATOM 0 HG2 GLN A 90 15.967 -0.829 7.369 1.00 0.97 H new ATOM 0 HG3 GLN A 90 16.172 0.868 6.984 1.00 0.97 H new ATOM 0 HE21 GLN A 90 17.849 -0.122 8.908 1.00 2.95 H new ATOM 0 HE22 GLN A 90 17.362 0.445 10.508 1.00 2.95 H new ATOM 1513 N GLY A 91 10.858 -1.458 7.970 1.00 0.80 N ATOM 1514 CA GLY A 91 9.398 -1.280 7.966 1.00 0.78 C ATOM 1515 C GLY A 91 8.832 -0.775 6.632 1.00 0.74 C ATOM 1516 O GLY A 91 7.654 -0.448 6.550 1.00 0.81 O ATOM 0 H GLY A 91 11.141 -2.438 7.975 1.00 0.80 H new ATOM 0 HA2 GLY A 91 8.926 -2.231 8.212 1.00 0.78 H new ATOM 0 HA3 GLY A 91 9.126 -0.577 8.753 1.00 0.78 H new ATOM 1520 N HIS A 92 9.656 -0.707 5.588 1.00 0.67 N ATOM 1521 CA HIS A 92 9.364 -0.072 4.301 1.00 0.67 C ATOM 1522 C HIS A 92 9.953 -0.913 3.156 1.00 0.72 C ATOM 1523 O HIS A 92 10.894 -1.688 3.371 1.00 0.81 O ATOM 1524 CB HIS A 92 9.957 1.351 4.326 1.00 0.71 C ATOM 1525 CG HIS A 92 9.999 2.065 2.992 1.00 0.71 C ATOM 1526 ND1 HIS A 92 8.925 2.457 2.221 1.00 0.74 N ATOM 1527 CD2 HIS A 92 11.130 2.395 2.288 1.00 0.80 C ATOM 1528 CE1 HIS A 92 9.399 3.007 1.092 1.00 0.82 C ATOM 1529 NE2 HIS A 92 10.744 2.999 1.088 1.00 0.86 N ATOM 0 H HIS A 92 10.591 -1.113 5.616 1.00 0.67 H new ATOM 0 HA HIS A 92 8.289 -0.008 4.134 1.00 0.67 H new ATOM 0 HB2 HIS A 92 9.376 1.955 5.023 1.00 0.71 H new ATOM 0 HB3 HIS A 92 10.972 1.296 4.720 1.00 0.71 H new ATOM 0 HD1 HIS A 92 7.941 2.348 2.466 1.00 0.74 H new ATOM 0 HD2 HIS A 92 12.146 2.218 2.607 1.00 0.80 H new ATOM 0 HE1 HIS A 92 8.785 3.402 0.296 1.00 0.82 H new ATOM 1537 N LEU A 93 9.415 -0.747 1.943 1.00 0.71 N ATOM 1538 CA LEU A 93 9.909 -1.402 0.736 1.00 0.72 C ATOM 1539 C LEU A 93 9.902 -0.432 -0.451 1.00 0.70 C ATOM 1540 O LEU A 93 9.005 0.402 -0.586 1.00 0.64 O ATOM 1541 CB LEU A 93 9.060 -2.660 0.472 1.00 0.73 C ATOM 1542 CG LEU A 93 9.831 -3.846 -0.120 1.00 0.75 C ATOM 1543 CD1 LEU A 93 10.865 -4.388 0.876 1.00 1.52 C ATOM 1544 CD2 LEU A 93 8.839 -4.967 -0.443 1.00 1.61 C ATOM 0 H LEU A 93 8.611 -0.143 1.774 1.00 0.71 H new ATOM 0 HA LEU A 93 10.946 -1.709 0.874 1.00 0.72 H new ATOM 0 HB2 LEU A 93 8.602 -2.975 1.410 1.00 0.73 H new ATOM 0 HB3 LEU A 93 8.249 -2.397 -0.207 1.00 0.73 H new ATOM 0 HG LEU A 93 10.350 -3.507 -1.017 1.00 0.75 H new ATOM 0 HD11 LEU A 93 11.396 -5.228 0.428 1.00 1.52 H new ATOM 0 HD12 LEU A 93 11.576 -3.601 1.126 1.00 1.52 H new ATOM 0 HD13 LEU A 93 10.358 -4.720 1.782 1.00 1.52 H new ATOM 0 HD21 LEU A 93 9.375 -5.817 -0.865 1.00 1.61 H new ATOM 0 HD22 LEU A 93 8.330 -5.276 0.470 1.00 1.61 H new ATOM 0 HD23 LEU A 93 8.105 -4.607 -1.164 1.00 1.61 H new ATOM 1556 N MET A 94 10.913 -0.547 -1.310 1.00 0.75 N ATOM 1557 CA MET A 94 11.207 0.422 -2.368 1.00 0.76 C ATOM 1558 C MET A 94 11.435 -0.300 -3.694 1.00 0.71 C ATOM 1559 O MET A 94 12.193 -1.269 -3.749 1.00 0.77 O ATOM 1560 CB MET A 94 12.465 1.211 -1.963 1.00 1.06 C ATOM 1561 CG MET A 94 12.305 2.691 -2.277 1.00 0.84 C ATOM 1562 SD MET A 94 13.777 3.646 -1.855 1.00 0.85 S ATOM 1563 CE MET A 94 12.929 5.186 -1.465 1.00 0.77 C ATOM 0 H MET A 94 11.565 -1.331 -1.291 1.00 0.75 H new ATOM 0 HA MET A 94 10.367 1.104 -2.497 1.00 0.76 H new ATOM 0 HB2 MET A 94 12.653 1.080 -0.897 1.00 1.06 H new ATOM 0 HB3 MET A 94 13.333 0.815 -2.491 1.00 1.06 H new ATOM 0 HG2 MET A 94 12.088 2.813 -3.338 1.00 0.84 H new ATOM 0 HG3 MET A 94 11.450 3.086 -1.729 1.00 0.84 H new ATOM 0 HE1 MET A 94 13.662 5.980 -1.327 1.00 0.77 H new ATOM 0 HE2 MET A 94 12.258 5.449 -2.283 1.00 0.77 H new ATOM 0 HE3 MET A 94 12.352 5.062 -0.549 1.00 0.77 H new ATOM 1573 N TRP A 95 10.784 0.155 -4.764 1.00 0.67 N ATOM 1574 CA TRP A 95 10.805 -0.559 -6.039 1.00 0.63 C ATOM 1575 C TRP A 95 12.109 -0.268 -6.790 1.00 0.75 C ATOM 1576 O TRP A 95 12.334 0.850 -7.257 1.00 0.82 O ATOM 1577 CB TRP A 95 9.597 -0.165 -6.897 1.00 0.58 C ATOM 1578 CG TRP A 95 8.222 -0.515 -6.416 1.00 0.52 C ATOM 1579 CD1 TRP A 95 7.796 -0.635 -5.135 1.00 0.54 C ATOM 1580 CD2 TRP A 95 7.035 -0.709 -7.240 1.00 0.51 C ATOM 1581 NE1 TRP A 95 6.435 -0.842 -5.110 1.00 0.54 N ATOM 1582 CE2 TRP A 95 5.906 -0.844 -6.381 1.00 0.54 C ATOM 1583 CE3 TRP A 95 6.797 -0.722 -8.634 1.00 0.56 C ATOM 1584 CZ2 TRP A 95 4.602 -0.913 -6.879 1.00 0.65 C ATOM 1585 CZ3 TRP A 95 5.491 -0.833 -9.145 1.00 0.65 C ATOM 1586 CH2 TRP A 95 4.397 -0.915 -8.269 1.00 0.70 C ATOM 0 H TRP A 95 10.236 1.015 -4.773 1.00 0.67 H new ATOM 0 HA TRP A 95 10.750 -1.629 -5.836 1.00 0.63 H new ATOM 0 HB2 TRP A 95 9.632 0.915 -7.038 1.00 0.58 H new ATOM 0 HB3 TRP A 95 9.728 -0.619 -7.879 1.00 0.58 H new ATOM 0 HD1 TRP A 95 8.430 -0.577 -4.263 1.00 0.54 H new ATOM 0 HE1 TRP A 95 5.889 -0.977 -4.259 1.00 0.54 H new ATOM 0 HE3 TRP A 95 7.630 -0.646 -9.317 1.00 0.56 H new ATOM 0 HZ2 TRP A 95 3.761 -0.964 -6.203 1.00 0.65 H new ATOM 0 HZ3 TRP A 95 5.330 -0.855 -10.213 1.00 0.65 H new ATOM 0 HH2 TRP A 95 3.394 -0.980 -8.665 1.00 0.70 H new ATOM 1597 N ASN A 96 12.941 -1.300 -6.931 1.00 0.84 N ATOM 1598 CA ASN A 96 14.189 -1.268 -7.689 1.00 0.94 C ATOM 1599 C ASN A 96 14.326 -2.504 -8.586 1.00 0.88 C ATOM 1600 O ASN A 96 13.766 -3.564 -8.311 1.00 0.82 O ATOM 1601 CB ASN A 96 15.392 -1.100 -6.735 1.00 1.10 C ATOM 1602 CG ASN A 96 16.053 0.267 -6.899 1.00 1.31 C ATOM 1603 OD1 ASN A 96 15.441 1.307 -6.691 1.00 1.81 O ATOM 1604 ND2 ASN A 96 17.307 0.317 -7.313 1.00 2.05 N ATOM 0 H ASN A 96 12.758 -2.209 -6.507 1.00 0.84 H new ATOM 0 HA ASN A 96 14.172 -0.403 -8.352 1.00 0.94 H new ATOM 0 HB2 ASN A 96 15.060 -1.223 -5.704 1.00 1.10 H new ATOM 0 HB3 ASN A 96 16.124 -1.884 -6.929 1.00 1.10 H new ATOM 0 HD21 ASN A 96 17.761 1.219 -7.458 1.00 2.05 H new ATOM 0 HD22 ASN A 96 17.821 -0.546 -7.488 1.00 2.05 H new ATOM 1611 N ASP A 97 15.109 -2.370 -9.654 1.00 0.90 N ATOM 1612 CA ASP A 97 15.548 -3.460 -10.534 1.00 0.89 C ATOM 1613 C ASP A 97 16.302 -4.553 -9.752 1.00 0.91 C ATOM 1614 O ASP A 97 16.209 -5.734 -10.077 1.00 0.93 O ATOM 1615 CB ASP A 97 16.428 -2.846 -11.635 1.00 0.93 C ATOM 1616 CG ASP A 97 15.661 -1.853 -12.526 1.00 1.18 C ATOM 1617 OD1 ASP A 97 15.307 -0.747 -12.046 1.00 2.24 O ATOM 1618 OD2 ASP A 97 15.404 -2.191 -13.705 1.00 2.27 O ATOM 0 H ASP A 97 15.472 -1.463 -9.945 1.00 0.90 H new ATOM 0 HA ASP A 97 14.682 -3.951 -10.978 1.00 0.89 H new ATOM 0 HB2 ASP A 97 17.274 -2.336 -11.175 1.00 0.93 H new ATOM 0 HB3 ASP A 97 16.836 -3.644 -12.255 1.00 0.93 H new ATOM 1623 N ASP A 98 16.995 -4.152 -8.683 1.00 0.95 N ATOM 1624 CA ASP A 98 17.670 -5.008 -7.705 1.00 1.00 C ATOM 1625 C ASP A 98 16.677 -5.753 -6.792 1.00 0.95 C ATOM 1626 O ASP A 98 16.811 -6.957 -6.573 1.00 1.01 O ATOM 1627 CB ASP A 98 18.578 -4.133 -6.825 1.00 1.07 C ATOM 1628 CG ASP A 98 19.416 -3.114 -7.612 1.00 1.39 C ATOM 1629 OD1 ASP A 98 18.868 -2.027 -7.919 1.00 2.65 O ATOM 1630 OD2 ASP A 98 20.604 -3.393 -7.898 1.00 2.36 O ATOM 0 H ASP A 98 17.106 -3.162 -8.464 1.00 0.95 H new ATOM 0 HA ASP A 98 18.242 -5.753 -8.258 1.00 1.00 H new ATOM 0 HB2 ASP A 98 17.961 -3.600 -6.102 1.00 1.07 H new ATOM 0 HB3 ASP A 98 19.248 -4.779 -6.258 1.00 1.07 H new ATOM 1635 N LEU A 99 15.663 -5.040 -6.276 1.00 0.87 N ATOM 1636 CA LEU A 99 14.605 -5.585 -5.413 1.00 0.85 C ATOM 1637 C LEU A 99 13.833 -6.676 -6.172 1.00 0.85 C ATOM 1638 O LEU A 99 13.602 -7.773 -5.661 1.00 0.93 O ATOM 1639 CB LEU A 99 13.674 -4.419 -4.987 1.00 0.78 C ATOM 1640 CG LEU A 99 12.933 -4.551 -3.636 1.00 0.78 C ATOM 1641 CD1 LEU A 99 12.276 -5.912 -3.393 1.00 1.85 C ATOM 1642 CD2 LEU A 99 13.864 -4.204 -2.468 1.00 1.68 C ATOM 0 H LEU A 99 15.554 -4.041 -6.453 1.00 0.87 H new ATOM 0 HA LEU A 99 15.029 -6.042 -4.519 1.00 0.85 H new ATOM 0 HB2 LEU A 99 14.271 -3.507 -4.955 1.00 0.78 H new ATOM 0 HB3 LEU A 99 12.926 -4.284 -5.768 1.00 0.78 H new ATOM 0 HG LEU A 99 12.115 -3.832 -3.694 1.00 0.78 H new ATOM 0 HD11 LEU A 99 11.782 -5.909 -2.422 1.00 1.85 H new ATOM 0 HD12 LEU A 99 11.541 -6.106 -4.174 1.00 1.85 H new ATOM 0 HD13 LEU A 99 13.037 -6.692 -3.410 1.00 1.85 H new ATOM 0 HD21 LEU A 99 13.321 -4.304 -1.528 1.00 1.68 H new ATOM 0 HD22 LEU A 99 14.717 -4.883 -2.468 1.00 1.68 H new ATOM 0 HD23 LEU A 99 14.217 -3.178 -2.576 1.00 1.68 H new ATOM 1654 N PHE A 100 13.500 -6.383 -7.431 1.00 0.84 N ATOM 1655 CA PHE A 100 12.786 -7.261 -8.354 1.00 0.86 C ATOM 1656 C PHE A 100 13.766 -8.080 -9.230 1.00 0.82 C ATOM 1657 O PHE A 100 13.406 -8.521 -10.319 1.00 0.72 O ATOM 1658 CB PHE A 100 11.817 -6.406 -9.196 1.00 0.91 C ATOM 1659 CG PHE A 100 10.556 -5.837 -8.550 1.00 0.90 C ATOM 1660 CD1 PHE A 100 10.414 -5.674 -7.156 1.00 1.77 C ATOM 1661 CD2 PHE A 100 9.501 -5.428 -9.388 1.00 1.24 C ATOM 1662 CE1 PHE A 100 9.256 -5.085 -6.620 1.00 1.69 C ATOM 1663 CE2 PHE A 100 8.346 -4.828 -8.856 1.00 1.30 C ATOM 1664 CZ PHE A 100 8.225 -4.649 -7.469 1.00 0.84 C ATOM 0 H PHE A 100 13.733 -5.484 -7.852 1.00 0.84 H new ATOM 0 HA PHE A 100 12.208 -7.995 -7.792 1.00 0.86 H new ATOM 0 HB2 PHE A 100 12.386 -5.566 -9.595 1.00 0.91 H new ATOM 0 HB3 PHE A 100 11.503 -7.011 -10.046 1.00 0.91 H new ATOM 0 HD1 PHE A 100 11.202 -6.005 -6.495 1.00 1.77 H new ATOM 0 HD2 PHE A 100 9.580 -5.577 -10.455 1.00 1.24 H new ATOM 0 HE1 PHE A 100 9.158 -4.967 -5.551 1.00 1.69 H new ATOM 0 HE2 PHE A 100 7.553 -4.505 -9.514 1.00 1.30 H new ATOM 0 HZ PHE A 100 7.344 -4.179 -7.057 1.00 0.84 H new ATOM 1674 N SER A 101 15.009 -8.309 -8.790 1.00 0.92 N ATOM 1675 CA SER A 101 15.998 -9.086 -9.567 1.00 0.95 C ATOM 1676 C SER A 101 15.616 -10.578 -9.692 1.00 0.87 C ATOM 1677 O SER A 101 16.063 -11.257 -10.618 1.00 0.93 O ATOM 1678 CB SER A 101 17.405 -8.899 -8.973 1.00 1.13 C ATOM 1679 OG SER A 101 18.419 -9.488 -9.779 1.00 1.16 O ATOM 0 H SER A 101 15.361 -7.968 -7.896 1.00 0.92 H new ATOM 0 HA SER A 101 16.000 -8.696 -10.585 1.00 0.95 H new ATOM 0 HB2 SER A 101 17.609 -7.834 -8.858 1.00 1.13 H new ATOM 0 HB3 SER A 101 17.436 -9.339 -7.976 1.00 1.13 H new ATOM 0 HG SER A 101 19.294 -9.342 -9.362 1.00 1.16 H new ATOM 1685 N GLU A 102 14.742 -11.085 -8.813 1.00 0.82 N ATOM 1686 CA GLU A 102 13.992 -12.334 -9.020 1.00 0.79 C ATOM 1687 C GLU A 102 12.639 -12.056 -9.697 1.00 0.66 C ATOM 1688 O GLU A 102 12.278 -12.728 -10.665 1.00 0.68 O ATOM 1689 CB GLU A 102 13.775 -13.043 -7.674 1.00 0.97 C ATOM 1690 CG GLU A 102 15.084 -13.617 -7.118 1.00 1.52 C ATOM 1691 CD GLU A 102 14.888 -14.163 -5.696 1.00 1.74 C ATOM 1692 OE1 GLU A 102 14.379 -15.300 -5.543 1.00 2.42 O ATOM 1693 OE2 GLU A 102 15.248 -13.461 -4.722 1.00 2.46 O ATOM 0 H GLU A 102 14.532 -10.633 -7.923 1.00 0.82 H new ATOM 0 HA GLU A 102 14.574 -12.981 -9.676 1.00 0.79 H new ATOM 0 HB2 GLU A 102 13.352 -12.340 -6.956 1.00 0.97 H new ATOM 0 HB3 GLU A 102 13.049 -13.847 -7.799 1.00 0.97 H new ATOM 0 HG2 GLU A 102 15.442 -14.413 -7.771 1.00 1.52 H new ATOM 0 HG3 GLU A 102 15.851 -12.842 -7.111 1.00 1.52 H new ATOM 1700 N ALA A 103 11.909 -11.027 -9.246 1.00 0.59 N ATOM 1701 CA ALA A 103 10.616 -10.587 -9.785 1.00 0.48 C ATOM 1702 C ALA A 103 10.705 -9.857 -11.146 1.00 0.42 C ATOM 1703 O ALA A 103 9.959 -8.920 -11.418 1.00 0.44 O ATOM 1704 CB ALA A 103 9.884 -9.789 -8.692 1.00 0.47 C ATOM 0 H ALA A 103 12.218 -10.454 -8.461 1.00 0.59 H new ATOM 0 HA ALA A 103 10.026 -11.468 -10.037 1.00 0.48 H new ATOM 0 HB1 ALA A 103 8.919 -9.452 -9.072 1.00 0.47 H new ATOM 0 HB2 ALA A 103 9.729 -10.424 -7.820 1.00 0.47 H new ATOM 0 HB3 ALA A 103 10.485 -8.925 -8.409 1.00 0.47 H new ATOM 1710 N GLN A 104 11.584 -10.315 -12.036 1.00 0.43 N ATOM 1711 CA GLN A 104 11.702 -9.838 -13.415 1.00 0.44 C ATOM 1712 C GLN A 104 10.402 -9.998 -14.236 1.00 0.43 C ATOM 1713 O GLN A 104 10.055 -9.041 -14.938 1.00 0.45 O ATOM 1714 CB GLN A 104 12.874 -10.549 -14.114 1.00 0.52 C ATOM 1715 CG GLN A 104 14.239 -10.258 -13.466 1.00 0.77 C ATOM 1716 CD GLN A 104 15.370 -11.032 -14.153 1.00 0.94 C ATOM 1717 OE1 GLN A 104 15.521 -11.030 -15.370 1.00 0.90 O ATOM 1718 NE2 GLN A 104 16.199 -11.739 -13.414 1.00 1.46 N ATOM 0 H GLN A 104 12.254 -11.050 -11.812 1.00 0.43 H new ATOM 0 HA GLN A 104 11.894 -8.766 -13.363 1.00 0.44 H new ATOM 0 HB2 GLN A 104 12.696 -11.624 -14.102 1.00 0.52 H new ATOM 0 HB3 GLN A 104 12.904 -10.243 -15.160 1.00 0.52 H new ATOM 0 HG2 GLN A 104 14.446 -9.189 -13.518 1.00 0.77 H new ATOM 0 HG3 GLN A 104 14.205 -10.525 -12.410 1.00 0.77 H new ATOM 0 HE21 GLN A 104 16.091 -11.755 -12.400 1.00 1.46 H new ATOM 0 HE22 GLN A 104 16.949 -12.271 -13.856 1.00 1.46 H new ATOM 1727 N PRO A 105 9.642 -11.120 -14.157 1.00 0.44 N ATOM 1728 CA PRO A 105 8.383 -11.254 -14.887 1.00 0.46 C ATOM 1729 C PRO A 105 7.235 -10.458 -14.247 1.00 0.43 C ATOM 1730 O PRO A 105 6.200 -10.284 -14.890 1.00 0.41 O ATOM 1731 CB PRO A 105 8.113 -12.759 -14.965 1.00 0.51 C ATOM 1732 CG PRO A 105 8.745 -13.308 -13.692 1.00 0.52 C ATOM 1733 CD PRO A 105 9.915 -12.363 -13.429 1.00 0.47 C ATOM 0 HA PRO A 105 8.455 -10.823 -15.886 1.00 0.46 H new ATOM 0 HB2 PRO A 105 7.045 -12.972 -15.005 1.00 0.51 H new ATOM 0 HB3 PRO A 105 8.560 -13.200 -15.856 1.00 0.51 H new ATOM 0 HG2 PRO A 105 8.038 -13.309 -12.863 1.00 0.52 H new ATOM 0 HG3 PRO A 105 9.083 -14.336 -13.824 1.00 0.52 H new ATOM 0 HD2 PRO A 105 10.020 -12.168 -12.362 1.00 0.47 H new ATOM 0 HD3 PRO A 105 10.852 -12.808 -13.765 1.00 0.47 H new ATOM 1741 N LEU A 106 7.420 -9.926 -13.027 1.00 0.46 N ATOM 1742 CA LEU A 106 6.552 -8.898 -12.451 1.00 0.48 C ATOM 1743 C LEU A 106 6.930 -7.529 -13.021 1.00 0.46 C ATOM 1744 O LEU A 106 6.053 -6.799 -13.470 1.00 0.49 O ATOM 1745 CB LEU A 106 6.666 -8.934 -10.914 1.00 0.56 C ATOM 1746 CG LEU A 106 5.594 -8.121 -10.163 1.00 0.55 C ATOM 1747 CD1 LEU A 106 4.235 -8.837 -10.160 1.00 1.56 C ATOM 1748 CD2 LEU A 106 6.034 -7.902 -8.707 1.00 1.09 C ATOM 0 H LEU A 106 8.185 -10.203 -12.411 1.00 0.46 H new ATOM 0 HA LEU A 106 5.512 -9.090 -12.714 1.00 0.48 H new ATOM 0 HB2 LEU A 106 6.611 -9.972 -10.585 1.00 0.56 H new ATOM 0 HB3 LEU A 106 7.650 -8.561 -10.629 1.00 0.56 H new ATOM 0 HG LEU A 106 5.485 -7.168 -10.680 1.00 0.55 H new ATOM 0 HD11 LEU A 106 3.506 -8.232 -9.621 1.00 1.56 H new ATOM 0 HD12 LEU A 106 3.898 -8.982 -11.186 1.00 1.56 H new ATOM 0 HD13 LEU A 106 4.335 -9.806 -9.671 1.00 1.56 H new ATOM 0 HD21 LEU A 106 5.273 -7.327 -8.180 1.00 1.09 H new ATOM 0 HD22 LEU A 106 6.164 -8.867 -8.217 1.00 1.09 H new ATOM 0 HD23 LEU A 106 6.978 -7.357 -8.690 1.00 1.09 H new ATOM 1760 N TRP A 107 8.225 -7.202 -13.066 1.00 0.45 N ATOM 1761 CA TRP A 107 8.734 -5.910 -13.536 1.00 0.48 C ATOM 1762 C TRP A 107 8.380 -5.662 -15.006 1.00 0.50 C ATOM 1763 O TRP A 107 7.920 -4.578 -15.352 1.00 0.57 O ATOM 1764 CB TRP A 107 10.261 -5.824 -13.329 1.00 0.55 C ATOM 1765 CG TRP A 107 10.806 -4.632 -12.592 1.00 1.15 C ATOM 1766 CD1 TRP A 107 12.014 -4.635 -11.988 1.00 1.94 C ATOM 1767 CD2 TRP A 107 10.231 -3.309 -12.304 1.00 1.71 C ATOM 1768 NE1 TRP A 107 12.190 -3.469 -11.275 1.00 2.97 N ATOM 1769 CE2 TRP A 107 11.129 -2.617 -11.431 1.00 2.88 C ATOM 1770 CE3 TRP A 107 9.062 -2.604 -12.679 1.00 1.62 C ATOM 1771 CZ2 TRP A 107 10.875 -1.334 -10.933 1.00 3.76 C ATOM 1772 CZ3 TRP A 107 8.799 -1.310 -12.195 1.00 2.42 C ATOM 1773 CH2 TRP A 107 9.695 -0.683 -11.314 1.00 3.47 C ATOM 0 H TRP A 107 8.963 -7.841 -12.771 1.00 0.45 H new ATOM 0 HA TRP A 107 8.252 -5.132 -12.944 1.00 0.48 H new ATOM 0 HB2 TRP A 107 10.577 -6.720 -12.795 1.00 0.55 H new ATOM 0 HB3 TRP A 107 10.734 -5.855 -14.311 1.00 0.55 H new ATOM 0 HD1 TRP A 107 12.737 -5.435 -12.054 1.00 1.94 H new ATOM 0 HE1 TRP A 107 13.009 -3.266 -10.702 1.00 2.97 H new ATOM 0 HE3 TRP A 107 8.357 -3.070 -13.351 1.00 1.62 H new ATOM 0 HZ2 TRP A 107 11.577 -0.854 -10.267 1.00 3.76 H new ATOM 0 HZ3 TRP A 107 7.901 -0.795 -12.503 1.00 2.42 H new ATOM 0 HH2 TRP A 107 9.474 0.302 -10.930 1.00 3.47 H new ATOM 1784 N GLU A 108 8.557 -6.668 -15.866 1.00 0.48 N ATOM 1785 CA GLU A 108 8.248 -6.564 -17.296 1.00 0.50 C ATOM 1786 C GLU A 108 6.744 -6.346 -17.516 1.00 0.51 C ATOM 1787 O GLU A 108 6.334 -5.428 -18.228 1.00 0.56 O ATOM 1788 CB GLU A 108 8.733 -7.837 -18.013 1.00 0.51 C ATOM 1789 CG GLU A 108 8.514 -7.773 -19.532 1.00 0.65 C ATOM 1790 CD GLU A 108 8.899 -9.098 -20.209 1.00 2.01 C ATOM 1791 OE1 GLU A 108 8.129 -10.082 -20.102 1.00 3.33 O ATOM 1792 OE2 GLU A 108 9.963 -9.159 -20.870 1.00 2.61 O ATOM 0 H GLU A 108 8.920 -7.581 -15.590 1.00 0.48 H new ATOM 0 HA GLU A 108 8.766 -5.701 -17.714 1.00 0.50 H new ATOM 0 HB2 GLU A 108 9.793 -7.985 -17.807 1.00 0.51 H new ATOM 0 HB3 GLU A 108 8.206 -8.701 -17.609 1.00 0.51 H new ATOM 0 HG2 GLU A 108 7.469 -7.546 -19.741 1.00 0.65 H new ATOM 0 HG3 GLU A 108 9.107 -6.961 -19.953 1.00 0.65 H new ATOM 1799 N ALA A 109 5.917 -7.174 -16.877 1.00 0.50 N ATOM 1800 CA ALA A 109 4.461 -7.101 -16.955 1.00 0.50 C ATOM 1801 C ALA A 109 3.902 -5.786 -16.390 1.00 0.48 C ATOM 1802 O ALA A 109 3.002 -5.188 -16.981 1.00 0.46 O ATOM 1803 CB ALA A 109 3.924 -8.338 -16.261 1.00 0.52 C ATOM 0 H ALA A 109 6.250 -7.930 -16.278 1.00 0.50 H new ATOM 0 HA ALA A 109 4.131 -7.089 -17.994 1.00 0.50 H new ATOM 0 HB1 ALA A 109 2.835 -8.329 -16.293 1.00 0.52 H new ATOM 0 HB2 ALA A 109 4.295 -9.229 -16.767 1.00 0.52 H new ATOM 0 HB3 ALA A 109 4.256 -8.346 -15.223 1.00 0.52 H new ATOM 1809 N ALA A 110 4.463 -5.294 -15.287 1.00 0.52 N ATOM 1810 CA ALA A 110 4.148 -3.992 -14.708 1.00 0.60 C ATOM 1811 C ALA A 110 4.504 -2.840 -15.665 1.00 0.61 C ATOM 1812 O ALA A 110 3.661 -1.979 -15.924 1.00 0.65 O ATOM 1813 CB ALA A 110 4.892 -3.904 -13.368 1.00 0.66 C ATOM 0 H ALA A 110 5.169 -5.806 -14.757 1.00 0.52 H new ATOM 0 HA ALA A 110 3.076 -3.892 -14.540 1.00 0.60 H new ATOM 0 HB1 ALA A 110 4.684 -2.942 -12.899 1.00 0.66 H new ATOM 0 HB2 ALA A 110 4.557 -4.708 -12.712 1.00 0.66 H new ATOM 0 HB3 ALA A 110 5.964 -3.999 -13.540 1.00 0.66 H new ATOM 1819 N ARG A 111 5.704 -2.867 -16.262 1.00 0.60 N ATOM 1820 CA ARG A 111 6.158 -1.886 -17.264 1.00 0.63 C ATOM 1821 C ARG A 111 5.264 -1.888 -18.512 1.00 0.61 C ATOM 1822 O ARG A 111 4.968 -0.820 -19.051 1.00 0.68 O ATOM 1823 CB ARG A 111 7.624 -2.163 -17.650 1.00 0.74 C ATOM 1824 CG ARG A 111 8.598 -1.735 -16.542 1.00 1.88 C ATOM 1825 CD ARG A 111 9.993 -2.346 -16.729 1.00 2.60 C ATOM 1826 NE ARG A 111 10.807 -2.125 -15.522 1.00 4.73 N ATOM 1827 CZ ARG A 111 12.123 -2.238 -15.400 1.00 5.89 C ATOM 1828 NH1 ARG A 111 12.910 -2.595 -16.393 1.00 5.46 N ATOM 1829 NH2 ARG A 111 12.677 -1.982 -14.242 1.00 7.87 N ATOM 0 H ARG A 111 6.401 -3.584 -16.060 1.00 0.60 H new ATOM 0 HA ARG A 111 6.087 -0.895 -16.815 1.00 0.63 H new ATOM 0 HB2 ARG A 111 7.751 -3.226 -17.854 1.00 0.74 H new ATOM 0 HB3 ARG A 111 7.864 -1.630 -18.570 1.00 0.74 H new ATOM 0 HG2 ARG A 111 8.678 -0.648 -16.531 1.00 1.88 H new ATOM 0 HG3 ARG A 111 8.198 -2.035 -15.573 1.00 1.88 H new ATOM 0 HD2 ARG A 111 9.907 -3.414 -16.929 1.00 2.60 H new ATOM 0 HD3 ARG A 111 10.482 -1.898 -17.594 1.00 2.60 H new ATOM 0 HE ARG A 111 10.299 -1.853 -14.680 1.00 4.73 H new ATOM 0 HH11 ARG A 111 12.513 -2.800 -17.310 1.00 5.46 H new ATOM 0 HH12 ARG A 111 13.917 -2.667 -16.245 1.00 5.46 H new ATOM 0 HH21 ARG A 111 12.098 -1.701 -13.451 1.00 7.87 H new ATOM 0 HH22 ARG A 111 13.688 -2.064 -14.131 1.00 7.87 H new ATOM 1843 N ALA A 112 4.786 -3.061 -18.936 1.00 0.54 N ATOM 1844 CA ALA A 112 3.834 -3.215 -20.039 1.00 0.52 C ATOM 1845 C ALA A 112 2.454 -2.617 -19.703 1.00 0.53 C ATOM 1846 O ALA A 112 1.872 -1.898 -20.515 1.00 0.56 O ATOM 1847 CB ALA A 112 3.732 -4.710 -20.370 1.00 0.49 C ATOM 0 H ALA A 112 5.056 -3.949 -18.513 1.00 0.54 H new ATOM 0 HA ALA A 112 4.193 -2.662 -20.907 1.00 0.52 H new ATOM 0 HB1 ALA A 112 3.028 -4.854 -21.190 1.00 0.49 H new ATOM 0 HB2 ALA A 112 4.712 -5.085 -20.663 1.00 0.49 H new ATOM 0 HB3 ALA A 112 3.383 -5.254 -19.492 1.00 0.49 H new ATOM 1853 N HIS A 113 1.935 -2.895 -18.506 1.00 0.52 N ATOM 1854 CA HIS A 113 0.653 -2.367 -18.017 1.00 0.56 C ATOM 1855 C HIS A 113 0.667 -0.870 -17.625 1.00 0.61 C ATOM 1856 O HIS A 113 -0.401 -0.280 -17.440 1.00 0.67 O ATOM 1857 CB HIS A 113 0.133 -3.286 -16.905 1.00 0.55 C ATOM 1858 CG HIS A 113 -0.378 -4.589 -17.471 1.00 0.54 C ATOM 1859 ND1 HIS A 113 0.284 -5.793 -17.473 1.00 0.50 N ATOM 1860 CD2 HIS A 113 -1.558 -4.780 -18.142 1.00 0.63 C ATOM 1861 CE1 HIS A 113 -0.477 -6.690 -18.123 1.00 0.55 C ATOM 1862 NE2 HIS A 113 -1.615 -6.118 -18.553 1.00 0.62 N ATOM 0 H HIS A 113 2.400 -3.505 -17.834 1.00 0.52 H new ATOM 0 HA HIS A 113 -0.048 -2.379 -18.852 1.00 0.56 H new ATOM 0 HB2 HIS A 113 0.932 -3.485 -16.190 1.00 0.55 H new ATOM 0 HB3 HIS A 113 -0.666 -2.785 -16.359 1.00 0.55 H new ATOM 0 HD1 HIS A 113 1.196 -5.975 -17.053 1.00 0.50 H new ATOM 0 HD2 HIS A 113 -2.313 -4.029 -18.323 1.00 0.63 H new ATOM 0 HE1 HIS A 113 -0.211 -7.725 -18.278 1.00 0.55 H new ATOM 1870 N GLY A 114 1.849 -0.243 -17.527 1.00 0.61 N ATOM 1871 CA GLY A 114 2.029 1.207 -17.344 1.00 0.70 C ATOM 1872 C GLY A 114 2.617 1.632 -15.995 1.00 0.75 C ATOM 1873 O GLY A 114 2.905 2.816 -15.814 1.00 0.89 O ATOM 0 H GLY A 114 2.735 -0.746 -17.574 1.00 0.61 H new ATOM 0 HA2 GLY A 114 2.678 1.578 -18.137 1.00 0.70 H new ATOM 0 HA3 GLY A 114 1.062 1.694 -17.469 1.00 0.70 H new ATOM 1877 N LEU A 115 2.834 0.690 -15.075 1.00 0.69 N ATOM 1878 CA LEU A 115 3.348 0.909 -13.721 1.00 0.75 C ATOM 1879 C LEU A 115 4.873 1.126 -13.790 1.00 0.79 C ATOM 1880 O LEU A 115 5.644 0.164 -13.749 1.00 1.11 O ATOM 1881 CB LEU A 115 2.994 -0.310 -12.839 1.00 0.76 C ATOM 1882 CG LEU A 115 1.504 -0.584 -12.534 1.00 0.77 C ATOM 1883 CD1 LEU A 115 0.673 -1.068 -13.734 1.00 0.99 C ATOM 1884 CD2 LEU A 115 1.430 -1.649 -11.430 1.00 1.14 C ATOM 0 H LEU A 115 2.647 -0.295 -15.263 1.00 0.69 H new ATOM 0 HA LEU A 115 2.893 1.795 -13.278 1.00 0.75 H new ATOM 0 HB2 LEU A 115 3.404 -1.198 -13.319 1.00 0.76 H new ATOM 0 HB3 LEU A 115 3.513 -0.194 -11.887 1.00 0.76 H new ATOM 0 HG LEU A 115 1.072 0.371 -12.236 1.00 0.77 H new ATOM 0 HD11 LEU A 115 -0.358 -1.233 -13.420 1.00 0.99 H new ATOM 0 HD12 LEU A 115 0.697 -0.314 -14.521 1.00 0.99 H new ATOM 0 HD13 LEU A 115 1.090 -2.001 -14.113 1.00 0.99 H new ATOM 0 HD21 LEU A 115 0.386 -1.860 -11.197 1.00 1.14 H new ATOM 0 HD22 LEU A 115 1.917 -2.562 -11.772 1.00 1.14 H new ATOM 0 HD23 LEU A 115 1.934 -1.282 -10.536 1.00 1.14 H new ATOM 1896 N ARG A 116 5.318 2.379 -13.951 1.00 0.87 N ATOM 1897 CA ARG A 116 6.718 2.681 -14.296 1.00 0.88 C ATOM 1898 C ARG A 116 7.672 2.663 -13.089 1.00 0.76 C ATOM 1899 O ARG A 116 8.771 2.128 -13.219 1.00 0.70 O ATOM 1900 CB ARG A 116 6.821 4.018 -15.039 1.00 1.05 C ATOM 1901 CG ARG A 116 6.035 4.151 -16.353 1.00 1.34 C ATOM 1902 CD ARG A 116 6.113 2.930 -17.277 1.00 1.05 C ATOM 1903 NE ARG A 116 5.833 3.274 -18.684 1.00 1.46 N ATOM 1904 CZ ARG A 116 4.718 3.779 -19.203 1.00 1.95 C ATOM 1905 NH1 ARG A 116 3.638 4.010 -18.485 1.00 3.42 N ATOM 1906 NH2 ARG A 116 4.679 4.068 -20.486 1.00 2.39 N ATOM 0 H ARG A 116 4.728 3.205 -13.848 1.00 0.87 H new ATOM 0 HA ARG A 116 7.042 1.874 -14.953 1.00 0.88 H new ATOM 0 HB2 ARG A 116 6.488 4.807 -14.364 1.00 1.05 H new ATOM 0 HB3 ARG A 116 7.873 4.206 -15.254 1.00 1.05 H new ATOM 0 HG2 ARG A 116 4.989 4.343 -16.116 1.00 1.34 H new ATOM 0 HG3 ARG A 116 6.404 5.022 -16.894 1.00 1.34 H new ATOM 0 HD2 ARG A 116 7.105 2.485 -17.205 1.00 1.05 H new ATOM 0 HD3 ARG A 116 5.401 2.177 -16.941 1.00 1.05 H new ATOM 0 HE ARG A 116 6.592 3.102 -19.343 1.00 1.46 H new ATOM 0 HH11 ARG A 116 3.635 3.800 -17.487 1.00 3.42 H new ATOM 0 HH12 ARG A 116 2.805 4.399 -18.927 1.00 3.42 H new ATOM 0 HH21 ARG A 116 5.498 3.904 -21.071 1.00 2.39 H new ATOM 0 HH22 ARG A 116 3.829 4.456 -20.896 1.00 2.39 H new ATOM 1920 N ARG A 117 7.247 3.185 -11.931 1.00 0.79 N ATOM 1921 CA ARG A 117 7.825 2.939 -10.591 1.00 0.56 C ATOM 1922 C ARG A 117 6.683 2.887 -9.559 1.00 0.51 C ATOM 1923 O ARG A 117 5.523 3.162 -9.881 1.00 0.68 O ATOM 1924 CB ARG A 117 8.877 3.998 -10.161 1.00 0.76 C ATOM 1925 CG ARG A 117 10.125 4.214 -11.040 1.00 0.77 C ATOM 1926 CD ARG A 117 11.027 3.009 -11.342 1.00 0.67 C ATOM 1927 NE ARG A 117 12.031 2.712 -10.301 1.00 1.07 N ATOM 1928 CZ ARG A 117 13.146 2.008 -10.498 1.00 1.39 C ATOM 1929 NH1 ARG A 117 13.419 1.430 -11.651 1.00 1.86 N ATOM 1930 NH2 ARG A 117 14.021 1.867 -9.531 1.00 1.92 N ATOM 0 H ARG A 117 6.452 3.823 -11.895 1.00 0.79 H new ATOM 0 HA ARG A 117 8.356 1.988 -10.639 1.00 0.56 H new ATOM 0 HB2 ARG A 117 8.364 4.956 -10.078 1.00 0.76 H new ATOM 0 HB3 ARG A 117 9.221 3.733 -9.161 1.00 0.76 H new ATOM 0 HG2 ARG A 117 9.792 4.626 -11.993 1.00 0.77 H new ATOM 0 HG3 ARG A 117 10.740 4.976 -10.561 1.00 0.77 H new ATOM 0 HD2 ARG A 117 10.399 2.129 -11.483 1.00 0.67 H new ATOM 0 HD3 ARG A 117 11.544 3.187 -12.285 1.00 0.67 H new ATOM 0 HE ARG A 117 11.859 3.072 -9.362 1.00 1.07 H new ATOM 0 HH11 ARG A 117 12.766 1.514 -12.430 1.00 1.86 H new ATOM 0 HH12 ARG A 117 14.283 0.899 -11.764 1.00 1.86 H new ATOM 0 HH21 ARG A 117 13.850 2.297 -8.622 1.00 1.92 H new ATOM 0 HH22 ARG A 117 14.872 1.327 -9.688 1.00 1.92 H new ATOM 1944 N GLY A 118 7.002 2.555 -8.308 1.00 0.40 N ATOM 1945 CA GLY A 118 6.051 2.578 -7.195 1.00 0.40 C ATOM 1946 C GLY A 118 6.703 2.664 -5.820 1.00 0.40 C ATOM 1947 O GLY A 118 7.924 2.772 -5.696 1.00 0.46 O ATOM 0 H GLY A 118 7.939 2.259 -8.035 1.00 0.40 H new ATOM 0 HA2 GLY A 118 5.381 3.429 -7.321 1.00 0.40 H new ATOM 0 HA3 GLY A 118 5.436 1.679 -7.238 1.00 0.40 H new ATOM 1951 N VAL A 119 5.855 2.659 -4.795 1.00 0.43 N ATOM 1952 CA VAL A 119 6.192 2.938 -3.386 1.00 0.46 C ATOM 1953 C VAL A 119 5.307 2.078 -2.472 1.00 0.43 C ATOM 1954 O VAL A 119 4.127 1.897 -2.775 1.00 0.44 O ATOM 1955 CB VAL A 119 6.026 4.450 -3.063 1.00 0.52 C ATOM 1956 CG1 VAL A 119 7.134 5.289 -3.723 1.00 0.85 C ATOM 1957 CG2 VAL A 119 4.658 5.027 -3.482 1.00 0.57 C ATOM 0 H VAL A 119 4.864 2.451 -4.922 1.00 0.43 H new ATOM 0 HA VAL A 119 7.237 2.682 -3.212 1.00 0.46 H new ATOM 0 HB VAL A 119 6.098 4.513 -1.977 1.00 0.52 H new ATOM 0 HG11 VAL A 119 6.989 6.341 -3.478 1.00 0.85 H new ATOM 0 HG12 VAL A 119 8.106 4.961 -3.355 1.00 0.85 H new ATOM 0 HG13 VAL A 119 7.093 5.160 -4.805 1.00 0.85 H new ATOM 0 HG21 VAL A 119 4.615 6.085 -3.225 1.00 0.57 H new ATOM 0 HG22 VAL A 119 4.527 4.909 -4.558 1.00 0.57 H new ATOM 0 HG23 VAL A 119 3.863 4.495 -2.960 1.00 0.57 H new ATOM 1967 N THR A 120 5.869 1.533 -1.381 1.00 0.43 N ATOM 1968 CA THR A 120 5.257 0.458 -0.572 1.00 0.41 C ATOM 1969 C THR A 120 5.484 0.684 0.926 1.00 0.45 C ATOM 1970 O THR A 120 6.545 1.150 1.341 1.00 0.50 O ATOM 1971 CB THR A 120 5.842 -0.884 -1.042 1.00 0.40 C ATOM 1972 OG1 THR A 120 5.406 -1.134 -2.356 1.00 0.42 O ATOM 1973 CG2 THR A 120 5.469 -2.096 -0.192 1.00 0.48 C ATOM 0 H THR A 120 6.778 1.830 -1.027 1.00 0.43 H new ATOM 0 HA THR A 120 4.176 0.456 -0.715 1.00 0.41 H new ATOM 0 HB THR A 120 6.923 -0.770 -0.959 1.00 0.40 H new ATOM 0 HG1 THR A 120 4.429 -1.212 -2.367 1.00 0.42 H new ATOM 0 HG21 THR A 120 5.933 -2.990 -0.610 1.00 0.48 H new ATOM 0 HG22 THR A 120 5.822 -1.947 0.828 1.00 0.48 H new ATOM 0 HG23 THR A 120 4.386 -2.218 -0.187 1.00 0.48 H new ATOM 1981 N GLN A 121 4.492 0.355 1.758 1.00 0.44 N ATOM 1982 CA GLN A 121 4.523 0.581 3.210 1.00 0.43 C ATOM 1983 C GLN A 121 3.818 -0.534 4.009 1.00 0.49 C ATOM 1984 O GLN A 121 2.984 -1.279 3.491 1.00 0.51 O ATOM 1985 CB GLN A 121 3.907 1.959 3.534 1.00 0.40 C ATOM 1986 CG GLN A 121 4.917 3.086 3.822 1.00 1.12 C ATOM 1987 CD GLN A 121 5.667 2.946 5.149 1.00 1.98 C ATOM 1988 OE1 GLN A 121 5.746 1.884 5.743 1.00 2.70 O ATOM 1989 NE2 GLN A 121 6.248 4.009 5.669 1.00 2.88 N ATOM 0 H GLN A 121 3.629 -0.084 1.438 1.00 0.44 H new ATOM 0 HA GLN A 121 5.568 0.562 3.520 1.00 0.43 H new ATOM 0 HB2 GLN A 121 3.279 2.263 2.696 1.00 0.40 H new ATOM 0 HB3 GLN A 121 3.253 1.851 4.399 1.00 0.40 H new ATOM 0 HG2 GLN A 121 5.644 3.120 3.011 1.00 1.12 H new ATOM 0 HG3 GLN A 121 4.389 4.039 3.817 1.00 1.12 H new ATOM 0 HE21 GLN A 121 6.194 4.907 5.188 1.00 2.88 H new ATOM 0 HE22 GLN A 121 6.752 3.934 6.553 1.00 2.88 H new ATOM 1998 N TYR A 122 4.162 -0.611 5.300 1.00 0.64 N ATOM 1999 CA TYR A 122 3.821 -1.674 6.261 1.00 0.65 C ATOM 2000 C TYR A 122 3.839 -1.137 7.713 1.00 0.65 C ATOM 2001 O TYR A 122 4.529 -0.165 8.025 1.00 0.75 O ATOM 2002 CB TYR A 122 4.820 -2.833 6.043 1.00 0.67 C ATOM 2003 CG TYR A 122 5.216 -3.710 7.224 1.00 0.64 C ATOM 2004 CD1 TYR A 122 6.136 -3.220 8.174 1.00 2.06 C ATOM 2005 CD2 TYR A 122 4.762 -5.041 7.328 1.00 2.02 C ATOM 2006 CE1 TYR A 122 6.605 -4.043 9.214 1.00 2.15 C ATOM 2007 CE2 TYR A 122 5.239 -5.875 8.358 1.00 2.00 C ATOM 2008 CZ TYR A 122 6.166 -5.382 9.301 1.00 0.81 C ATOM 2009 OH TYR A 122 6.641 -6.190 10.290 1.00 0.98 O ATOM 0 H TYR A 122 4.727 0.119 5.735 1.00 0.64 H new ATOM 0 HA TYR A 122 2.807 -2.037 6.096 1.00 0.65 H new ATOM 0 HB2 TYR A 122 4.402 -3.486 5.276 1.00 0.67 H new ATOM 0 HB3 TYR A 122 5.734 -2.404 5.633 1.00 0.67 H new ATOM 0 HD1 TYR A 122 6.485 -2.200 8.102 1.00 2.06 H new ATOM 0 HD2 TYR A 122 4.046 -5.422 6.615 1.00 2.02 H new ATOM 0 HE1 TYR A 122 7.299 -3.652 9.944 1.00 2.15 H new ATOM 0 HE2 TYR A 122 4.894 -6.896 8.426 1.00 2.00 H new ATOM 0 HH TYR A 122 6.237 -7.079 10.208 1.00 0.98 H new ATOM 2019 N LEU A 123 3.103 -1.797 8.616 1.00 0.64 N ATOM 2020 CA LEU A 123 3.125 -1.567 10.070 1.00 0.69 C ATOM 2021 C LEU A 123 2.688 -2.848 10.802 1.00 0.71 C ATOM 2022 O LEU A 123 2.199 -3.779 10.166 1.00 0.91 O ATOM 2023 CB LEU A 123 2.246 -0.349 10.449 1.00 0.86 C ATOM 2024 CG LEU A 123 2.843 0.551 11.549 1.00 0.94 C ATOM 2025 CD1 LEU A 123 4.033 1.373 11.031 1.00 1.63 C ATOM 2026 CD2 LEU A 123 1.765 1.508 12.075 1.00 1.98 C ATOM 0 H LEU A 123 2.451 -2.534 8.346 1.00 0.64 H new ATOM 0 HA LEU A 123 4.142 -1.329 10.384 1.00 0.69 H new ATOM 0 HB2 LEU A 123 2.077 0.253 9.556 1.00 0.86 H new ATOM 0 HB3 LEU A 123 1.272 -0.709 10.780 1.00 0.86 H new ATOM 0 HG LEU A 123 3.199 -0.098 12.349 1.00 0.94 H new ATOM 0 HD11 LEU A 123 4.425 1.994 11.837 1.00 1.63 H new ATOM 0 HD12 LEU A 123 4.815 0.700 10.679 1.00 1.63 H new ATOM 0 HD13 LEU A 123 3.705 2.010 10.209 1.00 1.63 H new ATOM 0 HD21 LEU A 123 2.190 2.143 12.852 1.00 1.98 H new ATOM 0 HD22 LEU A 123 1.400 2.130 11.258 1.00 1.98 H new ATOM 0 HD23 LEU A 123 0.938 0.932 12.489 1.00 1.98 H new ATOM 2038 N MET A 124 2.865 -2.915 12.124 1.00 0.85 N ATOM 2039 CA MET A 124 2.590 -4.117 12.931 1.00 0.85 C ATOM 2040 C MET A 124 1.917 -3.746 14.264 1.00 0.98 C ATOM 2041 O MET A 124 2.274 -2.737 14.879 1.00 1.07 O ATOM 2042 CB MET A 124 3.914 -4.884 13.132 1.00 0.88 C ATOM 2043 CG MET A 124 3.767 -6.404 13.005 1.00 1.00 C ATOM 2044 SD MET A 124 2.864 -7.227 14.342 1.00 1.41 S ATOM 2045 CE MET A 124 1.383 -7.749 13.441 1.00 1.11 C ATOM 0 H MET A 124 3.208 -2.128 12.675 1.00 0.85 H new ATOM 0 HA MET A 124 1.886 -4.766 12.410 1.00 0.85 H new ATOM 0 HB2 MET A 124 4.641 -4.535 12.399 1.00 0.88 H new ATOM 0 HB3 MET A 124 4.316 -4.647 14.117 1.00 0.88 H new ATOM 0 HG2 MET A 124 3.263 -6.623 12.064 1.00 1.00 H new ATOM 0 HG3 MET A 124 4.763 -6.842 12.943 1.00 1.00 H new ATOM 0 HE1 MET A 124 0.600 -8.015 14.151 1.00 1.11 H new ATOM 0 HE2 MET A 124 1.036 -6.933 12.807 1.00 1.11 H new ATOM 0 HE3 MET A 124 1.620 -8.614 12.822 1.00 1.11 H new ATOM 2055 N LEU A 125 0.936 -4.545 14.702 1.00 1.07 N ATOM 2056 CA LEU A 125 0.126 -4.321 15.909 1.00 1.24 C ATOM 2057 C LEU A 125 0.415 -5.414 16.962 1.00 1.21 C ATOM 2058 O LEU A 125 0.357 -6.596 16.605 1.00 1.32 O ATOM 2059 CB LEU A 125 -1.371 -4.356 15.530 1.00 1.69 C ATOM 2060 CG LEU A 125 -1.827 -3.352 14.449 1.00 1.35 C ATOM 2061 CD1 LEU A 125 -3.321 -3.565 14.162 1.00 2.65 C ATOM 2062 CD2 LEU A 125 -1.582 -1.894 14.866 1.00 1.83 C ATOM 0 H LEU A 125 0.674 -5.398 14.208 1.00 1.07 H new ATOM 0 HA LEU A 125 0.381 -3.349 16.332 1.00 1.24 H new ATOM 0 HB2 LEU A 125 -1.614 -5.362 15.187 1.00 1.69 H new ATOM 0 HB3 LEU A 125 -1.956 -4.177 16.432 1.00 1.69 H new ATOM 0 HG LEU A 125 -1.235 -3.535 13.552 1.00 1.35 H new ATOM 0 HD11 LEU A 125 -3.649 -2.859 13.399 1.00 2.65 H new ATOM 0 HD12 LEU A 125 -3.482 -4.583 13.807 1.00 2.65 H new ATOM 0 HD13 LEU A 125 -3.893 -3.404 15.076 1.00 2.65 H new ATOM 0 HD21 LEU A 125 -1.919 -1.227 14.073 1.00 1.83 H new ATOM 0 HD22 LEU A 125 -2.135 -1.679 15.780 1.00 1.83 H new ATOM 0 HD23 LEU A 125 -0.517 -1.740 15.041 1.00 1.83 H new ATOM 2074 N PRO A 126 0.672 -5.078 18.245 1.00 1.24 N ATOM 2075 CA PRO A 126 0.953 -6.075 19.280 1.00 1.39 C ATOM 2076 C PRO A 126 -0.256 -6.971 19.592 1.00 1.62 C ATOM 2077 O PRO A 126 -0.067 -8.128 19.966 1.00 1.82 O ATOM 2078 CB PRO A 126 1.423 -5.280 20.504 1.00 1.46 C ATOM 2079 CG PRO A 126 0.782 -3.908 20.319 1.00 1.40 C ATOM 2080 CD PRO A 126 0.772 -3.734 18.801 1.00 1.27 C ATOM 0 HA PRO A 126 1.717 -6.776 18.945 1.00 1.39 H new ATOM 0 HB2 PRO A 126 1.100 -5.750 21.433 1.00 1.46 H new ATOM 0 HB3 PRO A 126 2.510 -5.211 20.542 1.00 1.46 H new ATOM 0 HG2 PRO A 126 -0.225 -3.874 20.736 1.00 1.40 H new ATOM 0 HG3 PRO A 126 1.358 -3.124 20.811 1.00 1.40 H new ATOM 0 HD2 PRO A 126 -0.069 -3.117 18.484 1.00 1.27 H new ATOM 0 HD3 PRO A 126 1.679 -3.236 18.459 1.00 1.27 H new ATOM 2088 N GLU A 127 -1.491 -6.492 19.378 1.00 1.73 N ATOM 2089 CA GLU A 127 -2.723 -7.286 19.483 1.00 2.05 C ATOM 2090 C GLU A 127 -2.852 -8.382 18.402 1.00 2.25 C ATOM 2091 O GLU A 127 -3.719 -9.248 18.535 1.00 3.01 O ATOM 2092 CB GLU A 127 -3.965 -6.376 19.390 1.00 2.29 C ATOM 2093 CG GLU A 127 -4.034 -5.246 20.431 1.00 2.36 C ATOM 2094 CD GLU A 127 -3.477 -3.903 19.925 1.00 2.55 C ATOM 2095 OE1 GLU A 127 -2.498 -3.897 19.146 1.00 3.83 O ATOM 2096 OE2 GLU A 127 -4.019 -2.844 20.322 1.00 2.79 O ATOM 0 H GLU A 127 -1.664 -5.520 19.121 1.00 1.73 H new ATOM 0 HA GLU A 127 -2.664 -7.777 20.454 1.00 2.05 H new ATOM 0 HB2 GLU A 127 -3.996 -5.933 18.395 1.00 2.29 H new ATOM 0 HB3 GLU A 127 -4.856 -6.995 19.491 1.00 2.29 H new ATOM 0 HG2 GLU A 127 -5.071 -5.107 20.735 1.00 2.36 H new ATOM 0 HG3 GLU A 127 -3.479 -5.548 21.319 1.00 2.36 H new ATOM 2103 N ARG A 128 -2.007 -8.328 17.356 1.00 2.14 N ATOM 2104 CA ARG A 128 -1.928 -9.143 16.123 1.00 2.39 C ATOM 2105 C ARG A 128 -2.690 -8.482 14.956 1.00 1.44 C ATOM 2106 O ARG A 128 -3.513 -7.589 15.166 1.00 2.16 O ATOM 2107 CB ARG A 128 -2.325 -10.633 16.277 1.00 3.69 C ATOM 2108 CG ARG A 128 -1.298 -11.508 17.015 1.00 4.99 C ATOM 2109 CD ARG A 128 -1.277 -11.342 18.539 1.00 5.71 C ATOM 2110 NE ARG A 128 -0.320 -12.284 19.148 1.00 7.08 N ATOM 2111 CZ ARG A 128 0.833 -11.992 19.741 1.00 8.03 C ATOM 2112 NH1 ARG A 128 1.244 -10.755 19.934 1.00 8.14 N ATOM 2113 NH2 ARG A 128 1.607 -12.969 20.160 1.00 9.34 N ATOM 0 H ARG A 128 -1.269 -7.624 17.353 1.00 2.14 H new ATOM 0 HA ARG A 128 -0.863 -9.166 15.890 1.00 2.39 H new ATOM 0 HB2 ARG A 128 -3.275 -10.687 16.809 1.00 3.69 H new ATOM 0 HB3 ARG A 128 -2.491 -11.053 15.285 1.00 3.69 H new ATOM 0 HG2 ARG A 128 -1.500 -12.553 16.782 1.00 4.99 H new ATOM 0 HG3 ARG A 128 -0.305 -11.281 16.627 1.00 4.99 H new ATOM 0 HD2 ARG A 128 -1.002 -10.319 18.795 1.00 5.71 H new ATOM 0 HD3 ARG A 128 -2.274 -11.515 18.943 1.00 5.71 H new ATOM 0 HE ARG A 128 -0.571 -13.272 19.110 1.00 7.08 H new ATOM 0 HH11 ARG A 128 0.669 -9.972 19.623 1.00 8.14 H new ATOM 0 HH12 ARG A 128 2.137 -10.580 20.394 1.00 8.14 H new ATOM 0 HH21 ARG A 128 1.320 -13.939 20.028 1.00 9.34 H new ATOM 0 HH22 ARG A 128 2.494 -12.757 20.616 1.00 9.34 H new ATOM 2127 N ALA A 129 -2.384 -8.952 13.735 1.00 1.94 N ATOM 2128 CA ALA A 129 -2.915 -8.558 12.416 1.00 1.33 C ATOM 2129 C ALA A 129 -2.176 -7.344 11.828 1.00 0.86 C ATOM 2130 O ALA A 129 -1.626 -6.519 12.561 1.00 1.17 O ATOM 2131 CB ALA A 129 -4.438 -8.346 12.441 1.00 1.81 C ATOM 0 H ALA A 129 -1.689 -9.692 13.636 1.00 1.94 H new ATOM 0 HA ALA A 129 -2.725 -9.396 11.746 1.00 1.33 H new ATOM 0 HB1 ALA A 129 -4.782 -8.057 11.448 1.00 1.81 H new ATOM 0 HB2 ALA A 129 -4.929 -9.272 12.740 1.00 1.81 H new ATOM 0 HB3 ALA A 129 -4.684 -7.558 13.153 1.00 1.81 H new ATOM 2137 N LEU A 130 -2.188 -7.230 10.495 1.00 0.64 N ATOM 2138 CA LEU A 130 -1.625 -6.093 9.764 1.00 0.98 C ATOM 2139 C LEU A 130 -2.230 -5.926 8.367 1.00 0.78 C ATOM 2140 O LEU A 130 -2.865 -6.829 7.824 1.00 0.56 O ATOM 2141 CB LEU A 130 -0.079 -6.140 9.714 1.00 1.71 C ATOM 2142 CG LEU A 130 0.586 -7.075 8.678 1.00 1.22 C ATOM 2143 CD1 LEU A 130 2.059 -6.684 8.533 1.00 1.77 C ATOM 2144 CD2 LEU A 130 0.533 -8.557 9.064 1.00 2.05 C ATOM 0 H LEU A 130 -2.597 -7.938 9.885 1.00 0.64 H new ATOM 0 HA LEU A 130 -1.904 -5.205 10.331 1.00 0.98 H new ATOM 0 HB2 LEU A 130 0.280 -5.128 9.529 1.00 1.71 H new ATOM 0 HB3 LEU A 130 0.278 -6.429 10.702 1.00 1.71 H new ATOM 0 HG LEU A 130 0.028 -6.955 7.750 1.00 1.22 H new ATOM 0 HD11 LEU A 130 2.539 -7.337 7.804 1.00 1.77 H new ATOM 0 HD12 LEU A 130 2.129 -5.650 8.195 1.00 1.77 H new ATOM 0 HD13 LEU A 130 2.559 -6.786 9.496 1.00 1.77 H new ATOM 0 HD21 LEU A 130 1.019 -9.152 8.290 1.00 2.05 H new ATOM 0 HD22 LEU A 130 1.049 -8.705 10.013 1.00 2.05 H new ATOM 0 HD23 LEU A 130 -0.506 -8.870 9.164 1.00 2.05 H new ATOM 2156 N GLY A 131 -1.973 -4.761 7.778 1.00 1.05 N ATOM 2157 CA GLY A 131 -2.163 -4.481 6.358 1.00 0.79 C ATOM 2158 C GLY A 131 -0.866 -4.039 5.683 1.00 0.67 C ATOM 2159 O GLY A 131 0.165 -3.820 6.325 1.00 0.78 O ATOM 0 H GLY A 131 -1.614 -3.958 8.295 1.00 1.05 H new ATOM 0 HA2 GLY A 131 -2.545 -5.373 5.861 1.00 0.79 H new ATOM 0 HA3 GLY A 131 -2.917 -3.703 6.240 1.00 0.79 H new ATOM 2163 N PHE A 132 -0.955 -3.878 4.369 1.00 0.62 N ATOM 2164 CA PHE A 132 0.071 -3.320 3.494 1.00 0.58 C ATOM 2165 C PHE A 132 -0.637 -2.393 2.496 1.00 0.50 C ATOM 2166 O PHE A 132 -1.753 -2.695 2.062 1.00 0.56 O ATOM 2167 CB PHE A 132 0.814 -4.441 2.735 1.00 0.75 C ATOM 2168 CG PHE A 132 1.321 -5.626 3.549 1.00 1.10 C ATOM 2169 CD1 PHE A 132 0.426 -6.632 3.971 1.00 2.59 C ATOM 2170 CD2 PHE A 132 2.696 -5.772 3.818 1.00 2.09 C ATOM 2171 CE1 PHE A 132 0.897 -7.753 4.677 1.00 3.23 C ATOM 2172 CE2 PHE A 132 3.171 -6.910 4.495 1.00 2.88 C ATOM 2173 CZ PHE A 132 2.271 -7.897 4.933 1.00 2.99 C ATOM 0 H PHE A 132 -1.793 -4.149 3.855 1.00 0.62 H new ATOM 0 HA PHE A 132 0.810 -2.774 4.080 1.00 0.58 H new ATOM 0 HB2 PHE A 132 0.146 -4.824 1.963 1.00 0.75 H new ATOM 0 HB3 PHE A 132 1.667 -3.994 2.225 1.00 0.75 H new ATOM 0 HD1 PHE A 132 -0.627 -6.540 3.750 1.00 2.59 H new ATOM 0 HD2 PHE A 132 3.389 -5.006 3.503 1.00 2.09 H new ATOM 0 HE1 PHE A 132 0.202 -8.504 5.023 1.00 3.23 H new ATOM 0 HE2 PHE A 132 4.229 -7.026 4.679 1.00 2.88 H new ATOM 0 HZ PHE A 132 2.635 -8.764 5.465 1.00 2.99 H new ATOM 2183 N LEU A 133 0.006 -1.300 2.083 1.00 0.47 N ATOM 2184 CA LEU A 133 -0.463 -0.513 0.938 1.00 0.41 C ATOM 2185 C LEU A 133 0.690 -0.155 0.012 1.00 0.40 C ATOM 2186 O LEU A 133 1.834 0.010 0.439 1.00 0.44 O ATOM 2187 CB LEU A 133 -1.325 0.701 1.359 1.00 0.43 C ATOM 2188 CG LEU A 133 -0.586 2.019 1.678 1.00 0.50 C ATOM 2189 CD1 LEU A 133 -1.610 3.142 1.898 1.00 1.85 C ATOM 2190 CD2 LEU A 133 0.301 1.908 2.920 1.00 1.76 C ATOM 0 H LEU A 133 0.852 -0.939 2.523 1.00 0.47 H new ATOM 0 HA LEU A 133 -1.140 -1.142 0.360 1.00 0.41 H new ATOM 0 HB2 LEU A 133 -2.040 0.900 0.561 1.00 0.43 H new ATOM 0 HB3 LEU A 133 -1.901 0.416 2.239 1.00 0.43 H new ATOM 0 HG LEU A 133 0.058 2.240 0.827 1.00 0.50 H new ATOM 0 HD11 LEU A 133 -1.088 4.072 2.123 1.00 1.85 H new ATOM 0 HD12 LEU A 133 -2.208 3.271 0.996 1.00 1.85 H new ATOM 0 HD13 LEU A 133 -2.262 2.881 2.731 1.00 1.85 H new ATOM 0 HD21 LEU A 133 0.797 2.862 3.099 1.00 1.76 H new ATOM 0 HD22 LEU A 133 -0.312 1.650 3.783 1.00 1.76 H new ATOM 0 HD23 LEU A 133 1.051 1.133 2.763 1.00 1.76 H new ATOM 2202 N SER A 134 0.375 -0.039 -1.270 1.00 0.40 N ATOM 2203 CA SER A 134 1.336 0.320 -2.308 1.00 0.43 C ATOM 2204 C SER A 134 0.676 1.155 -3.400 1.00 0.47 C ATOM 2205 O SER A 134 -0.466 0.905 -3.792 1.00 0.52 O ATOM 2206 CB SER A 134 1.964 -0.932 -2.927 1.00 0.53 C ATOM 2207 OG SER A 134 2.770 -1.600 -1.977 1.00 1.70 O ATOM 0 H SER A 134 -0.568 -0.193 -1.626 1.00 0.40 H new ATOM 0 HA SER A 134 2.120 0.914 -1.837 1.00 0.43 H new ATOM 0 HB2 SER A 134 1.181 -1.601 -3.284 1.00 0.53 H new ATOM 0 HB3 SER A 134 2.565 -0.655 -3.793 1.00 0.53 H new ATOM 0 HG SER A 134 2.226 -2.252 -1.488 1.00 1.70 H new ATOM 2213 N PHE A 135 1.410 2.146 -3.902 1.00 0.51 N ATOM 2214 CA PHE A 135 1.005 2.966 -5.035 1.00 0.48 C ATOM 2215 C PHE A 135 1.978 2.732 -6.192 1.00 0.39 C ATOM 2216 O PHE A 135 3.197 2.688 -5.993 1.00 0.37 O ATOM 2217 CB PHE A 135 0.976 4.449 -4.638 1.00 0.57 C ATOM 2218 CG PHE A 135 0.328 4.809 -3.310 1.00 0.72 C ATOM 2219 CD1 PHE A 135 -0.915 4.257 -2.940 1.00 2.26 C ATOM 2220 CD2 PHE A 135 0.959 5.736 -2.454 1.00 1.89 C ATOM 2221 CE1 PHE A 135 -1.513 4.613 -1.719 1.00 2.38 C ATOM 2222 CE2 PHE A 135 0.355 6.099 -1.237 1.00 1.98 C ATOM 2223 CZ PHE A 135 -0.880 5.536 -0.867 1.00 1.20 C ATOM 0 H PHE A 135 2.321 2.404 -3.523 1.00 0.51 H new ATOM 0 HA PHE A 135 -0.000 2.686 -5.350 1.00 0.48 H new ATOM 0 HB2 PHE A 135 2.004 4.812 -4.620 1.00 0.57 H new ATOM 0 HB3 PHE A 135 0.458 4.997 -5.425 1.00 0.57 H new ATOM 0 HD1 PHE A 135 -1.410 3.558 -3.597 1.00 2.26 H new ATOM 0 HD2 PHE A 135 1.908 6.168 -2.734 1.00 1.89 H new ATOM 0 HE1 PHE A 135 -2.459 4.177 -1.435 1.00 2.38 H new ATOM 0 HE2 PHE A 135 0.840 6.811 -0.586 1.00 1.98 H new ATOM 0 HZ PHE A 135 -1.341 5.812 0.070 1.00 1.20 H new ATOM 2233 N SER A 136 1.444 2.624 -7.401 1.00 0.39 N ATOM 2234 CA SER A 136 2.196 2.673 -8.655 1.00 0.37 C ATOM 2235 C SER A 136 1.952 4.020 -9.343 1.00 0.48 C ATOM 2236 O SER A 136 0.857 4.580 -9.249 1.00 0.92 O ATOM 2237 CB SER A 136 1.771 1.517 -9.570 1.00 0.60 C ATOM 2238 OG SER A 136 0.374 1.474 -9.805 1.00 1.78 O ATOM 0 H SER A 136 0.442 2.495 -7.544 1.00 0.39 H new ATOM 0 HA SER A 136 3.260 2.570 -8.444 1.00 0.37 H new ATOM 0 HB2 SER A 136 2.290 1.608 -10.524 1.00 0.60 H new ATOM 0 HB3 SER A 136 2.087 0.574 -9.123 1.00 0.60 H new ATOM 0 HG SER A 136 0.151 2.061 -10.557 1.00 1.78 H new ATOM 2244 N ARG A 137 2.958 4.550 -10.043 1.00 0.51 N ATOM 2245 CA ARG A 137 2.829 5.781 -10.825 1.00 0.60 C ATOM 2246 C ARG A 137 3.507 5.641 -12.192 1.00 0.65 C ATOM 2247 O ARG A 137 4.508 4.940 -12.356 1.00 0.70 O ATOM 2248 CB ARG A 137 3.233 7.015 -9.977 1.00 0.91 C ATOM 2249 CG ARG A 137 3.250 8.334 -10.774 1.00 2.45 C ATOM 2250 CD ARG A 137 2.977 9.643 -10.021 1.00 3.37 C ATOM 2251 NE ARG A 137 2.190 10.512 -10.916 1.00 4.75 N ATOM 2252 CZ ARG A 137 2.328 11.792 -11.217 1.00 5.77 C ATOM 2253 NH1 ARG A 137 3.110 12.614 -10.554 1.00 5.86 N ATOM 2254 NH2 ARG A 137 1.630 12.228 -12.237 1.00 7.20 N ATOM 0 H ARG A 137 3.889 4.135 -10.083 1.00 0.51 H new ATOM 0 HA ARG A 137 1.783 5.961 -11.075 1.00 0.60 H new ATOM 0 HB2 ARG A 137 2.540 7.114 -9.142 1.00 0.91 H new ATOM 0 HB3 ARG A 137 4.222 6.845 -9.552 1.00 0.91 H new ATOM 0 HG2 ARG A 137 4.226 8.422 -11.250 1.00 2.45 H new ATOM 0 HG3 ARG A 137 2.512 8.250 -11.572 1.00 2.45 H new ATOM 0 HD2 ARG A 137 2.431 9.448 -9.098 1.00 3.37 H new ATOM 0 HD3 ARG A 137 3.913 10.127 -9.741 1.00 3.37 H new ATOM 0 HE ARG A 137 1.409 10.048 -11.380 1.00 4.75 H new ATOM 0 HH11 ARG A 137 3.652 12.273 -9.760 1.00 5.86 H new ATOM 0 HH12 ARG A 137 3.175 13.593 -10.834 1.00 5.86 H new ATOM 0 HH21 ARG A 137 1.023 11.589 -12.750 1.00 7.20 H new ATOM 0 HH22 ARG A 137 1.694 13.206 -12.518 1.00 7.20 H new ATOM 2268 N CYS A 138 2.952 6.343 -13.182 1.00 0.69 N ATOM 2269 CA CYS A 138 3.471 6.527 -14.543 1.00 0.87 C ATOM 2270 C CYS A 138 4.864 7.185 -14.621 1.00 0.89 C ATOM 2271 O CYS A 138 5.456 7.272 -15.694 1.00 1.07 O ATOM 2272 CB CYS A 138 2.421 7.363 -15.290 1.00 1.22 C ATOM 2273 SG CYS A 138 2.278 9.016 -14.535 1.00 3.07 S ATOM 0 H CYS A 138 2.067 6.832 -13.047 1.00 0.69 H new ATOM 0 HA CYS A 138 3.626 5.547 -14.995 1.00 0.87 H new ATOM 0 HB2 CYS A 138 2.700 7.458 -16.339 1.00 1.22 H new ATOM 0 HB3 CYS A 138 1.456 6.858 -15.261 1.00 1.22 H new ATOM 0 HG CYS A 138 1.555 8.940 -13.458 1.00 3.07 H new ATOM 2279 N SER A 139 5.403 7.642 -13.494 1.00 0.92 N ATOM 2280 CA SER A 139 6.770 8.131 -13.360 1.00 1.04 C ATOM 2281 C SER A 139 7.797 7.017 -13.582 1.00 0.69 C ATOM 2282 O SER A 139 8.030 6.178 -12.717 1.00 0.85 O ATOM 2283 CB SER A 139 6.983 8.783 -11.986 1.00 1.50 C ATOM 2284 OG SER A 139 6.588 7.934 -10.916 1.00 2.81 O ATOM 0 H SER A 139 4.881 7.683 -12.619 1.00 0.92 H new ATOM 0 HA SER A 139 6.921 8.883 -14.135 1.00 1.04 H new ATOM 0 HB2 SER A 139 8.035 9.044 -11.870 1.00 1.50 H new ATOM 0 HB3 SER A 139 6.417 9.713 -11.936 1.00 1.50 H new ATOM 0 HG SER A 139 6.835 7.009 -11.124 1.00 2.81 H new ATOM 2290 N ALA A 140 8.473 7.067 -14.729 1.00 0.59 N ATOM 2291 CA ALA A 140 9.706 6.319 -15.008 1.00 0.74 C ATOM 2292 C ALA A 140 10.952 7.025 -14.439 1.00 0.98 C ATOM 2293 O ALA A 140 12.088 6.685 -14.781 1.00 1.39 O ATOM 2294 CB ALA A 140 9.814 6.146 -16.526 1.00 0.92 C ATOM 0 H ALA A 140 8.173 7.644 -15.514 1.00 0.59 H new ATOM 0 HA ALA A 140 9.661 5.347 -14.517 1.00 0.74 H new ATOM 0 HB1 ALA A 140 10.722 5.593 -16.765 1.00 0.92 H new ATOM 0 HB2 ALA A 140 8.947 5.596 -16.892 1.00 0.92 H new ATOM 0 HB3 ALA A 140 9.850 7.126 -17.002 1.00 0.92 H new ATOM 2300 N ARG A 141 10.724 8.044 -13.604 1.00 0.82 N ATOM 2301 CA ARG A 141 11.748 8.847 -12.958 1.00 0.88 C ATOM 2302 C ARG A 141 12.536 7.992 -11.950 1.00 0.98 C ATOM 2303 O ARG A 141 12.059 6.960 -11.474 1.00 1.20 O ATOM 2304 CB ARG A 141 11.097 10.054 -12.248 1.00 0.77 C ATOM 2305 CG ARG A 141 10.690 11.237 -13.146 1.00 1.10 C ATOM 2306 CD ARG A 141 9.439 11.045 -14.016 1.00 1.79 C ATOM 2307 NE ARG A 141 9.120 12.297 -14.732 1.00 2.53 N ATOM 2308 CZ ARG A 141 7.937 12.722 -15.169 1.00 3.55 C ATOM 2309 NH1 ARG A 141 6.832 12.015 -15.054 1.00 4.53 N ATOM 2310 NH2 ARG A 141 7.847 13.902 -15.744 1.00 4.12 N ATOM 0 H ARG A 141 9.780 8.338 -13.355 1.00 0.82 H new ATOM 0 HA ARG A 141 12.441 9.216 -13.714 1.00 0.88 H new ATOM 0 HB2 ARG A 141 10.209 9.703 -11.722 1.00 0.77 H new ATOM 0 HB3 ARG A 141 11.791 10.421 -11.492 1.00 0.77 H new ATOM 0 HG2 ARG A 141 10.532 12.108 -12.510 1.00 1.10 H new ATOM 0 HG3 ARG A 141 11.528 11.470 -13.802 1.00 1.10 H new ATOM 0 HD2 ARG A 141 9.605 10.240 -14.732 1.00 1.79 H new ATOM 0 HD3 ARG A 141 8.595 10.749 -13.393 1.00 1.79 H new ATOM 0 HE ARG A 141 9.909 12.917 -14.915 1.00 2.53 H new ATOM 0 HH11 ARG A 141 6.858 11.096 -14.613 1.00 4.53 H new ATOM 0 HH12 ARG A 141 5.950 12.387 -15.406 1.00 4.53 H new ATOM 0 HH21 ARG A 141 8.679 14.482 -15.851 1.00 4.12 H new ATOM 0 HH22 ARG A 141 6.945 14.237 -16.082 1.00 4.12 H new ATOM 2324 N GLU A 142 13.731 8.447 -11.594 1.00 0.99 N ATOM 2325 CA GLU A 142 14.542 7.864 -10.519 1.00 1.00 C ATOM 2326 C GLU A 142 13.868 8.063 -9.142 1.00 0.83 C ATOM 2327 O GLU A 142 13.121 9.023 -8.938 1.00 0.74 O ATOM 2328 CB GLU A 142 15.941 8.500 -10.576 1.00 1.10 C ATOM 2329 CG GLU A 142 16.996 7.754 -9.745 1.00 1.40 C ATOM 2330 CD GLU A 142 18.422 8.316 -9.916 1.00 2.23 C ATOM 2331 OE1 GLU A 142 18.632 9.320 -10.640 1.00 3.10 O ATOM 2332 OE2 GLU A 142 19.360 7.745 -9.311 1.00 2.85 O ATOM 0 H GLU A 142 14.176 9.244 -12.048 1.00 0.99 H new ATOM 0 HA GLU A 142 14.633 6.787 -10.658 1.00 1.00 H new ATOM 0 HB2 GLU A 142 16.270 8.538 -11.614 1.00 1.10 H new ATOM 0 HB3 GLU A 142 15.876 9.530 -10.224 1.00 1.10 H new ATOM 0 HG2 GLU A 142 16.719 7.802 -8.692 1.00 1.40 H new ATOM 0 HG3 GLU A 142 16.992 6.701 -10.028 1.00 1.40 H new ATOM 2339 N ILE A 143 14.142 7.173 -8.181 1.00 0.93 N ATOM 2340 CA ILE A 143 13.690 7.290 -6.781 1.00 0.90 C ATOM 2341 C ILE A 143 14.872 7.720 -5.878 1.00 0.87 C ATOM 2342 O ILE A 143 15.879 7.002 -5.840 1.00 1.03 O ATOM 2343 CB ILE A 143 13.040 5.954 -6.328 1.00 1.12 C ATOM 2344 CG1 ILE A 143 11.602 5.797 -6.884 1.00 1.04 C ATOM 2345 CG2 ILE A 143 13.031 5.765 -4.807 1.00 1.46 C ATOM 2346 CD1 ILE A 143 10.525 6.623 -6.157 1.00 1.37 C ATOM 0 H ILE A 143 14.695 6.333 -8.354 1.00 0.93 H new ATOM 0 HA ILE A 143 12.928 8.064 -6.695 1.00 0.90 H new ATOM 0 HB ILE A 143 13.673 5.173 -6.748 1.00 1.12 H new ATOM 0 HG12 ILE A 143 11.604 6.078 -7.937 1.00 1.04 H new ATOM 0 HG13 ILE A 143 11.324 4.744 -6.836 1.00 1.04 H new ATOM 0 HG21 ILE A 143 12.563 4.812 -4.562 1.00 1.46 H new ATOM 0 HG22 ILE A 143 14.055 5.773 -4.433 1.00 1.46 H new ATOM 0 HG23 ILE A 143 12.469 6.575 -4.343 1.00 1.46 H new ATOM 0 HD11 ILE A 143 9.555 6.444 -6.621 1.00 1.37 H new ATOM 0 HD12 ILE A 143 10.486 6.328 -5.108 1.00 1.37 H new ATOM 0 HD13 ILE A 143 10.771 7.683 -6.227 1.00 1.37 H new ATOM 2358 N PRO A 144 14.766 8.855 -5.149 1.00 0.82 N ATOM 2359 CA PRO A 144 15.671 9.238 -4.066 1.00 0.86 C ATOM 2360 C PRO A 144 15.170 8.587 -2.762 1.00 0.99 C ATOM 2361 O PRO A 144 14.935 7.385 -2.726 1.00 1.94 O ATOM 2362 CB PRO A 144 15.646 10.774 -4.100 1.00 1.03 C ATOM 2363 CG PRO A 144 14.189 11.082 -4.445 1.00 1.06 C ATOM 2364 CD PRO A 144 13.802 9.930 -5.377 1.00 0.89 C ATOM 0 HA PRO A 144 16.703 8.899 -4.156 1.00 0.86 H new ATOM 0 HB2 PRO A 144 15.934 11.204 -3.141 1.00 1.03 H new ATOM 0 HB3 PRO A 144 16.332 11.173 -4.847 1.00 1.03 H new ATOM 0 HG2 PRO A 144 13.561 11.109 -3.555 1.00 1.06 H new ATOM 0 HG3 PRO A 144 14.087 12.050 -4.936 1.00 1.06 H new ATOM 0 HD2 PRO A 144 12.788 9.589 -5.169 1.00 0.89 H new ATOM 0 HD3 PRO A 144 13.823 10.252 -6.418 1.00 0.89 H new ATOM 2372 N ILE A 145 14.935 9.362 -1.699 1.00 0.72 N ATOM 2373 CA ILE A 145 14.228 8.967 -0.459 1.00 0.73 C ATOM 2374 C ILE A 145 12.696 8.930 -0.676 1.00 0.79 C ATOM 2375 O ILE A 145 11.915 9.387 0.151 1.00 1.34 O ATOM 2376 CB ILE A 145 14.739 9.900 0.670 1.00 0.83 C ATOM 2377 CG1 ILE A 145 14.541 9.413 2.129 1.00 1.04 C ATOM 2378 CG2 ILE A 145 14.339 11.376 0.452 1.00 0.91 C ATOM 2379 CD1 ILE A 145 13.156 9.531 2.782 1.00 1.32 C ATOM 0 H ILE A 145 15.245 10.333 -1.670 1.00 0.72 H new ATOM 0 HA ILE A 145 14.450 7.944 -0.156 1.00 0.73 H new ATOM 0 HB ILE A 145 15.822 9.839 0.561 1.00 0.83 H new ATOM 0 HG12 ILE A 145 14.831 8.363 2.166 1.00 1.04 H new ATOM 0 HG13 ILE A 145 15.245 9.961 2.755 1.00 1.04 H new ATOM 0 HG21 ILE A 145 14.723 11.982 1.272 1.00 0.91 H new ATOM 0 HG22 ILE A 145 14.758 11.731 -0.489 1.00 0.91 H new ATOM 0 HG23 ILE A 145 13.253 11.457 0.419 1.00 0.91 H new ATOM 0 HD11 ILE A 145 13.200 9.144 3.800 1.00 1.32 H new ATOM 0 HD12 ILE A 145 12.852 10.578 2.804 1.00 1.32 H new ATOM 0 HD13 ILE A 145 12.432 8.955 2.206 1.00 1.32 H new ATOM 2391 N LEU A 146 12.271 8.483 -1.865 1.00 0.93 N ATOM 2392 CA LEU A 146 10.947 8.601 -2.519 1.00 1.06 C ATOM 2393 C LEU A 146 10.351 10.027 -2.640 1.00 0.88 C ATOM 2394 O LEU A 146 9.600 10.281 -3.578 1.00 1.03 O ATOM 2395 CB LEU A 146 9.948 7.496 -2.099 1.00 1.75 C ATOM 2396 CG LEU A 146 9.412 7.545 -0.659 1.00 0.96 C ATOM 2397 CD1 LEU A 146 7.973 7.014 -0.600 1.00 1.51 C ATOM 2398 CD2 LEU A 146 10.218 6.673 0.320 1.00 2.81 C ATOM 0 H LEU A 146 12.916 7.970 -2.466 1.00 0.93 H new ATOM 0 HA LEU A 146 11.171 8.393 -3.565 1.00 1.06 H new ATOM 0 HB2 LEU A 146 9.096 7.535 -2.778 1.00 1.75 H new ATOM 0 HB3 LEU A 146 10.431 6.530 -2.247 1.00 1.75 H new ATOM 0 HG LEU A 146 9.484 8.593 -0.368 1.00 0.96 H new ATOM 0 HD11 LEU A 146 7.611 7.057 0.427 1.00 1.51 H new ATOM 0 HD12 LEU A 146 7.333 7.626 -1.236 1.00 1.51 H new ATOM 0 HD13 LEU A 146 7.951 5.982 -0.950 1.00 1.51 H new ATOM 0 HD21 LEU A 146 9.787 6.753 1.318 1.00 2.81 H new ATOM 0 HD22 LEU A 146 10.186 5.634 -0.007 1.00 2.81 H new ATOM 0 HD23 LEU A 146 11.253 7.014 0.343 1.00 2.81 H new ATOM 2410 N SER A 147 10.751 10.938 -1.753 1.00 0.73 N ATOM 2411 CA SER A 147 10.491 12.382 -1.555 1.00 0.71 C ATOM 2412 C SER A 147 9.914 12.552 -0.143 1.00 0.71 C ATOM 2413 O SER A 147 8.940 11.882 0.188 1.00 0.72 O ATOM 2414 CB SER A 147 9.560 13.045 -2.585 1.00 0.70 C ATOM 2415 OG SER A 147 10.104 13.009 -3.896 1.00 1.30 O ATOM 0 H SER A 147 11.384 10.625 -1.017 1.00 0.73 H new ATOM 0 HA SER A 147 11.443 12.895 -1.693 1.00 0.71 H new ATOM 0 HB2 SER A 147 8.595 12.539 -2.579 1.00 0.70 H new ATOM 0 HB3 SER A 147 9.379 14.080 -2.296 1.00 0.70 H new ATOM 0 HG SER A 147 10.043 12.098 -4.251 1.00 1.30 H new ATOM 2421 N ASP A 148 10.470 13.410 0.723 1.00 0.75 N ATOM 2422 CA ASP A 148 10.096 13.397 2.152 1.00 0.82 C ATOM 2423 C ASP A 148 8.634 13.797 2.422 1.00 0.75 C ATOM 2424 O ASP A 148 8.009 13.272 3.341 1.00 0.82 O ATOM 2425 CB ASP A 148 11.061 14.234 3.009 1.00 1.03 C ATOM 2426 CG ASP A 148 12.156 13.371 3.658 1.00 3.06 C ATOM 2427 OD1 ASP A 148 11.831 12.592 4.587 1.00 4.39 O ATOM 2428 OD2 ASP A 148 13.335 13.499 3.252 1.00 4.08 O ATOM 0 H ASP A 148 11.167 14.111 0.471 1.00 0.75 H new ATOM 0 HA ASP A 148 10.185 12.353 2.454 1.00 0.82 H new ATOM 0 HB2 ASP A 148 11.525 15.000 2.388 1.00 1.03 H new ATOM 0 HB3 ASP A 148 10.499 14.751 3.787 1.00 1.03 H new ATOM 2433 N GLU A 149 8.054 14.657 1.583 1.00 0.72 N ATOM 2434 CA GLU A 149 6.625 14.986 1.624 1.00 0.78 C ATOM 2435 C GLU A 149 5.744 13.794 1.221 1.00 0.79 C ATOM 2436 O GLU A 149 4.621 13.687 1.704 1.00 1.03 O ATOM 2437 CB GLU A 149 6.322 16.235 0.772 1.00 0.91 C ATOM 2438 CG GLU A 149 6.181 17.504 1.626 1.00 1.85 C ATOM 2439 CD GLU A 149 4.806 17.590 2.307 1.00 2.85 C ATOM 2440 OE1 GLU A 149 3.856 18.140 1.701 1.00 3.61 O ATOM 2441 OE2 GLU A 149 4.653 17.111 3.454 1.00 4.02 O ATOM 0 H GLU A 149 8.565 15.149 0.850 1.00 0.72 H new ATOM 0 HA GLU A 149 6.374 15.220 2.659 1.00 0.78 H new ATOM 0 HB2 GLU A 149 7.120 16.377 0.043 1.00 0.91 H new ATOM 0 HB3 GLU A 149 5.402 16.074 0.210 1.00 0.91 H new ATOM 0 HG2 GLU A 149 6.963 17.519 2.385 1.00 1.85 H new ATOM 0 HG3 GLU A 149 6.330 18.382 0.998 1.00 1.85 H new ATOM 2448 N LEU A 150 6.225 12.887 0.361 1.00 0.68 N ATOM 2449 CA LEU A 150 5.554 11.611 0.107 1.00 0.59 C ATOM 2450 C LEU A 150 5.844 10.595 1.219 1.00 0.50 C ATOM 2451 O LEU A 150 4.911 9.942 1.665 1.00 0.47 O ATOM 2452 CB LEU A 150 5.936 11.097 -1.299 1.00 0.63 C ATOM 2453 CG LEU A 150 5.383 9.700 -1.657 1.00 0.86 C ATOM 2454 CD1 LEU A 150 3.853 9.605 -1.655 1.00 1.51 C ATOM 2455 CD2 LEU A 150 5.900 9.281 -3.041 1.00 1.84 C ATOM 0 H LEU A 150 7.084 13.018 -0.173 1.00 0.68 H new ATOM 0 HA LEU A 150 4.474 11.760 0.121 1.00 0.59 H new ATOM 0 HB2 LEU A 150 5.580 11.813 -2.040 1.00 0.63 H new ATOM 0 HB3 LEU A 150 7.023 11.072 -1.377 1.00 0.63 H new ATOM 0 HG LEU A 150 5.739 9.032 -0.873 1.00 0.86 H new ATOM 0 HD11 LEU A 150 3.551 8.591 -1.917 1.00 1.51 H new ATOM 0 HD12 LEU A 150 3.474 9.852 -0.663 1.00 1.51 H new ATOM 0 HD13 LEU A 150 3.444 10.305 -2.384 1.00 1.51 H new ATOM 0 HD21 LEU A 150 5.509 8.295 -3.292 1.00 1.84 H new ATOM 0 HD22 LEU A 150 5.569 10.004 -3.787 1.00 1.84 H new ATOM 0 HD23 LEU A 150 6.989 9.247 -3.027 1.00 1.84 H new ATOM 2467 N GLN A 151 7.088 10.441 1.683 1.00 0.53 N ATOM 2468 CA GLN A 151 7.455 9.419 2.678 1.00 0.54 C ATOM 2469 C GLN A 151 6.740 9.630 4.024 1.00 0.50 C ATOM 2470 O GLN A 151 6.225 8.675 4.608 1.00 0.49 O ATOM 2471 CB GLN A 151 8.985 9.261 2.786 1.00 0.71 C ATOM 2472 CG GLN A 151 9.705 10.176 3.789 1.00 0.75 C ATOM 2473 CD GLN A 151 9.897 9.634 5.208 1.00 1.23 C ATOM 2474 OE1 GLN A 151 9.336 8.634 5.638 1.00 1.72 O ATOM 2475 NE2 GLN A 151 10.724 10.293 5.993 1.00 2.09 N ATOM 0 H GLN A 151 7.872 11.020 1.382 1.00 0.53 H new ATOM 0 HA GLN A 151 7.087 8.457 2.322 1.00 0.54 H new ATOM 0 HB2 GLN A 151 9.202 8.227 3.053 1.00 0.71 H new ATOM 0 HB3 GLN A 151 9.415 9.433 1.799 1.00 0.71 H new ATOM 0 HG2 GLN A 151 10.687 10.418 3.383 1.00 0.75 H new ATOM 0 HG3 GLN A 151 9.148 11.111 3.855 1.00 0.75 H new ATOM 0 HE21 GLN A 151 11.198 11.128 5.648 1.00 2.09 H new ATOM 0 HE22 GLN A 151 10.890 9.969 6.946 1.00 2.09 H new ATOM 2484 N LEU A 152 6.646 10.884 4.488 1.00 0.53 N ATOM 2485 CA LEU A 152 5.998 11.230 5.755 1.00 0.56 C ATOM 2486 C LEU A 152 4.482 11.095 5.634 1.00 0.52 C ATOM 2487 O LEU A 152 3.848 10.519 6.520 1.00 0.55 O ATOM 2488 CB LEU A 152 6.412 12.647 6.195 1.00 0.65 C ATOM 2489 CG LEU A 152 7.894 12.780 6.612 1.00 0.75 C ATOM 2490 CD1 LEU A 152 8.232 14.260 6.838 1.00 0.87 C ATOM 2491 CD2 LEU A 152 8.208 11.986 7.892 1.00 0.82 C ATOM 0 H LEU A 152 7.021 11.691 3.989 1.00 0.53 H new ATOM 0 HA LEU A 152 6.328 10.533 6.526 1.00 0.56 H new ATOM 0 HB2 LEU A 152 6.214 13.340 5.377 1.00 0.65 H new ATOM 0 HB3 LEU A 152 5.783 12.952 7.031 1.00 0.65 H new ATOM 0 HG LEU A 152 8.502 12.368 5.806 1.00 0.75 H new ATOM 0 HD11 LEU A 152 9.277 14.354 7.132 1.00 0.87 H new ATOM 0 HD12 LEU A 152 8.063 14.817 5.916 1.00 0.87 H new ATOM 0 HD13 LEU A 152 7.596 14.662 7.626 1.00 0.87 H new ATOM 0 HD21 LEU A 152 9.261 12.109 8.147 1.00 0.82 H new ATOM 0 HD22 LEU A 152 7.591 12.356 8.710 1.00 0.82 H new ATOM 0 HD23 LEU A 152 7.996 10.930 7.726 1.00 0.82 H new ATOM 2503 N LYS A 153 3.897 11.545 4.516 1.00 0.49 N ATOM 2504 CA LYS A 153 2.486 11.266 4.234 1.00 0.47 C ATOM 2505 C LYS A 153 2.224 9.762 4.117 1.00 0.42 C ATOM 2506 O LYS A 153 1.232 9.306 4.657 1.00 0.44 O ATOM 2507 CB LYS A 153 1.988 12.008 2.987 1.00 0.55 C ATOM 2508 CG LYS A 153 1.859 13.520 3.220 1.00 1.86 C ATOM 2509 CD LYS A 153 1.175 14.194 2.016 1.00 1.76 C ATOM 2510 CE LYS A 153 1.780 15.555 1.652 1.00 2.59 C ATOM 2511 NZ LYS A 153 1.777 16.523 2.776 1.00 3.13 N ATOM 0 H LYS A 153 4.373 12.096 3.802 1.00 0.49 H new ATOM 0 HA LYS A 153 1.916 11.642 5.084 1.00 0.47 H new ATOM 0 HB2 LYS A 153 2.676 11.828 2.161 1.00 0.55 H new ATOM 0 HB3 LYS A 153 1.020 11.605 2.690 1.00 0.55 H new ATOM 0 HG2 LYS A 153 1.281 13.707 4.125 1.00 1.86 H new ATOM 0 HG3 LYS A 153 2.846 13.956 3.376 1.00 1.86 H new ATOM 0 HD2 LYS A 153 1.243 13.532 1.152 1.00 1.76 H new ATOM 0 HD3 LYS A 153 0.115 14.323 2.236 1.00 1.76 H new ATOM 0 HE2 LYS A 153 2.805 15.409 1.311 1.00 2.59 H new ATOM 0 HE3 LYS A 153 1.224 15.979 0.816 1.00 2.59 H new ATOM 0 HZ1 LYS A 153 2.289 17.383 2.495 1.00 3.13 H new ATOM 0 HZ2 LYS A 153 0.796 16.768 3.020 1.00 3.13 H new ATOM 0 HZ3 LYS A 153 2.244 16.097 3.602 1.00 3.13 H new ATOM 2525 N MET A 154 3.110 8.966 3.512 1.00 0.40 N ATOM 2526 CA MET A 154 2.996 7.501 3.440 1.00 0.38 C ATOM 2527 C MET A 154 3.046 6.832 4.816 1.00 0.41 C ATOM 2528 O MET A 154 2.258 5.919 5.061 1.00 0.44 O ATOM 2529 CB MET A 154 4.034 6.905 2.486 1.00 0.40 C ATOM 2530 CG MET A 154 3.551 7.016 1.038 1.00 1.35 C ATOM 2531 SD MET A 154 4.568 6.106 -0.140 1.00 1.90 S ATOM 2532 CE MET A 154 3.995 4.424 0.212 1.00 0.77 C ATOM 0 H MET A 154 3.944 9.326 3.048 1.00 0.40 H new ATOM 0 HA MET A 154 2.007 7.289 3.033 1.00 0.38 H new ATOM 0 HB2 MET A 154 4.984 7.426 2.600 1.00 0.40 H new ATOM 0 HB3 MET A 154 4.211 5.860 2.738 1.00 0.40 H new ATOM 0 HG2 MET A 154 2.526 6.650 0.978 1.00 1.35 H new ATOM 0 HG3 MET A 154 3.532 8.067 0.751 1.00 1.35 H new ATOM 0 HE1 MET A 154 4.854 3.776 0.387 1.00 0.77 H new ATOM 0 HE2 MET A 154 3.361 4.434 1.099 1.00 0.77 H new ATOM 0 HE3 MET A 154 3.425 4.049 -0.638 1.00 0.77 H new ATOM 2542 N GLN A 155 3.928 7.269 5.716 1.00 0.44 N ATOM 2543 CA GLN A 155 3.963 6.764 7.094 1.00 0.48 C ATOM 2544 C GLN A 155 2.636 7.067 7.818 1.00 0.45 C ATOM 2545 O GLN A 155 2.053 6.177 8.435 1.00 0.50 O ATOM 2546 CB GLN A 155 5.181 7.359 7.830 1.00 0.58 C ATOM 2547 CG GLN A 155 5.644 6.533 9.046 1.00 0.93 C ATOM 2548 CD GLN A 155 4.630 6.444 10.191 1.00 2.33 C ATOM 2549 OE1 GLN A 155 4.198 7.440 10.760 1.00 2.93 O ATOM 2550 NE2 GLN A 155 4.218 5.254 10.582 1.00 3.88 N ATOM 0 H GLN A 155 4.634 7.977 5.515 1.00 0.44 H new ATOM 0 HA GLN A 155 4.074 5.680 7.085 1.00 0.48 H new ATOM 0 HB2 GLN A 155 6.009 7.448 7.127 1.00 0.58 H new ATOM 0 HB3 GLN A 155 4.935 8.368 8.161 1.00 0.58 H new ATOM 0 HG2 GLN A 155 5.881 5.523 8.711 1.00 0.93 H new ATOM 0 HG3 GLN A 155 6.567 6.967 9.431 1.00 0.93 H new ATOM 0 HE21 GLN A 155 4.568 4.415 10.119 1.00 3.88 H new ATOM 0 HE22 GLN A 155 3.549 5.172 11.348 1.00 3.88 H new ATOM 2559 N LEU A 156 2.107 8.287 7.676 1.00 0.45 N ATOM 2560 CA LEU A 156 0.783 8.659 8.189 1.00 0.46 C ATOM 2561 C LEU A 156 -0.317 7.785 7.563 1.00 0.41 C ATOM 2562 O LEU A 156 -1.112 7.168 8.276 1.00 0.42 O ATOM 2563 CB LEU A 156 0.599 10.173 7.950 1.00 0.54 C ATOM 2564 CG LEU A 156 -0.764 10.800 8.304 1.00 0.68 C ATOM 2565 CD1 LEU A 156 -1.833 10.627 7.214 1.00 1.22 C ATOM 2566 CD2 LEU A 156 -1.309 10.293 9.635 1.00 1.71 C ATOM 0 H LEU A 156 2.588 9.049 7.199 1.00 0.45 H new ATOM 0 HA LEU A 156 0.703 8.472 9.260 1.00 0.46 H new ATOM 0 HB2 LEU A 156 1.366 10.697 8.520 1.00 0.54 H new ATOM 0 HB3 LEU A 156 0.794 10.371 6.896 1.00 0.54 H new ATOM 0 HG LEU A 156 -0.553 11.866 8.387 1.00 0.68 H new ATOM 0 HD11 LEU A 156 -2.762 11.095 7.538 1.00 1.22 H new ATOM 0 HD12 LEU A 156 -1.492 11.098 6.292 1.00 1.22 H new ATOM 0 HD13 LEU A 156 -2.004 9.565 7.037 1.00 1.22 H new ATOM 0 HD21 LEU A 156 -2.270 10.765 9.838 1.00 1.71 H new ATOM 0 HD22 LEU A 156 -1.439 9.212 9.587 1.00 1.71 H new ATOM 0 HD23 LEU A 156 -0.608 10.539 10.433 1.00 1.71 H new ATOM 2578 N LEU A 157 -0.323 7.681 6.234 1.00 0.40 N ATOM 2579 CA LEU A 157 -1.264 6.895 5.443 1.00 0.44 C ATOM 2580 C LEU A 157 -1.263 5.443 5.900 1.00 0.44 C ATOM 2581 O LEU A 157 -2.336 4.931 6.201 1.00 0.46 O ATOM 2582 CB LEU A 157 -0.918 7.015 3.941 1.00 0.57 C ATOM 2583 CG LEU A 157 -1.747 8.006 3.094 1.00 0.72 C ATOM 2584 CD1 LEU A 157 -3.116 7.392 2.827 1.00 2.13 C ATOM 2585 CD2 LEU A 157 -1.953 9.403 3.698 1.00 1.91 C ATOM 0 H LEU A 157 0.362 8.166 5.654 1.00 0.40 H new ATOM 0 HA LEU A 157 -2.270 7.286 5.593 1.00 0.44 H new ATOM 0 HB2 LEU A 157 0.131 7.299 3.859 1.00 0.57 H new ATOM 0 HB3 LEU A 157 -1.016 6.026 3.493 1.00 0.57 H new ATOM 0 HG LEU A 157 -1.161 8.165 2.189 1.00 0.72 H new ATOM 0 HD11 LEU A 157 -3.713 8.081 2.229 1.00 2.13 H new ATOM 0 HD12 LEU A 157 -2.995 6.454 2.286 1.00 2.13 H new ATOM 0 HD13 LEU A 157 -3.621 7.202 3.774 1.00 2.13 H new ATOM 0 HD21 LEU A 157 -2.548 10.010 3.016 1.00 1.91 H new ATOM 0 HD22 LEU A 157 -2.473 9.314 4.652 1.00 1.91 H new ATOM 0 HD23 LEU A 157 -0.985 9.878 3.855 1.00 1.91 H new ATOM 2597 N VAL A 158 -0.107 4.787 6.019 1.00 0.45 N ATOM 2598 CA VAL A 158 -0.063 3.402 6.509 1.00 0.48 C ATOM 2599 C VAL A 158 -0.576 3.293 7.937 1.00 0.48 C ATOM 2600 O VAL A 158 -1.350 2.381 8.199 1.00 0.52 O ATOM 2601 CB VAL A 158 1.288 2.680 6.325 1.00 0.56 C ATOM 2602 CG1 VAL A 158 2.410 3.095 7.281 1.00 0.57 C ATOM 2603 CG2 VAL A 158 1.087 1.158 6.454 1.00 0.69 C ATOM 0 H VAL A 158 0.803 5.184 5.787 1.00 0.45 H new ATOM 0 HA VAL A 158 -0.747 2.860 5.855 1.00 0.48 H new ATOM 0 HB VAL A 158 1.617 2.979 5.330 1.00 0.56 H new ATOM 0 HG11 VAL A 158 3.309 2.521 7.057 1.00 0.57 H new ATOM 0 HG12 VAL A 158 2.618 4.158 7.159 1.00 0.57 H new ATOM 0 HG13 VAL A 158 2.103 2.901 8.309 1.00 0.57 H new ATOM 0 HG21 VAL A 158 2.044 0.652 6.323 1.00 0.69 H new ATOM 0 HG22 VAL A 158 0.686 0.926 7.441 1.00 0.69 H new ATOM 0 HG23 VAL A 158 0.389 0.817 5.689 1.00 0.69 H new ATOM 2613 N ARG A 159 -0.223 4.216 8.844 1.00 0.48 N ATOM 2614 CA ARG A 159 -0.741 4.166 10.217 1.00 0.53 C ATOM 2615 C ARG A 159 -2.267 4.202 10.221 1.00 0.49 C ATOM 2616 O ARG A 159 -2.908 3.322 10.798 1.00 0.53 O ATOM 2617 CB ARG A 159 -0.124 5.311 11.072 1.00 0.61 C ATOM 2618 CG ARG A 159 -1.068 5.865 12.163 1.00 1.05 C ATOM 2619 CD ARG A 159 -0.473 6.926 13.101 1.00 1.43 C ATOM 2620 NE ARG A 159 0.351 6.339 14.175 1.00 1.69 N ATOM 2621 CZ ARG A 159 -0.090 5.658 15.230 1.00 2.31 C ATOM 2622 NH1 ARG A 159 -1.362 5.350 15.393 1.00 2.89 N ATOM 2623 NH2 ARG A 159 0.759 5.272 16.157 1.00 3.16 N ATOM 0 H ARG A 159 0.409 4.994 8.655 1.00 0.48 H new ATOM 0 HA ARG A 159 -0.443 3.222 10.673 1.00 0.53 H new ATOM 0 HB2 ARG A 159 0.786 4.945 11.547 1.00 0.61 H new ATOM 0 HB3 ARG A 159 0.167 6.127 10.411 1.00 0.61 H new ATOM 0 HG2 ARG A 159 -1.943 6.293 11.674 1.00 1.05 H new ATOM 0 HG3 ARG A 159 -1.418 5.030 12.769 1.00 1.05 H new ATOM 0 HD2 ARG A 159 0.135 7.619 12.520 1.00 1.43 H new ATOM 0 HD3 ARG A 159 -1.281 7.507 13.545 1.00 1.43 H new ATOM 0 HE ARG A 159 1.360 6.468 14.102 1.00 1.69 H new ATOM 0 HH11 ARG A 159 -2.049 5.635 14.695 1.00 2.89 H new ATOM 0 HH12 ARG A 159 -1.658 4.826 16.217 1.00 2.89 H new ATOM 0 HH21 ARG A 159 1.750 5.495 16.065 1.00 3.16 H new ATOM 0 HH22 ARG A 159 0.426 4.750 16.968 1.00 3.16 H new ATOM 2637 N GLU A 160 -2.839 5.206 9.566 1.00 0.46 N ATOM 2638 CA GLU A 160 -4.259 5.490 9.720 1.00 0.47 C ATOM 2639 C GLU A 160 -5.131 4.620 8.814 1.00 0.52 C ATOM 2640 O GLU A 160 -6.199 4.195 9.243 1.00 0.61 O ATOM 2641 CB GLU A 160 -4.516 6.997 9.618 1.00 0.59 C ATOM 2642 CG GLU A 160 -4.631 7.613 11.025 1.00 1.51 C ATOM 2643 CD GLU A 160 -4.079 9.037 11.121 1.00 1.80 C ATOM 2644 OE1 GLU A 160 -4.536 9.904 10.344 1.00 2.85 O ATOM 2645 OE2 GLU A 160 -3.221 9.276 12.004 1.00 2.53 O ATOM 0 H GLU A 160 -2.346 5.831 8.929 1.00 0.46 H new ATOM 0 HA GLU A 160 -4.570 5.202 10.724 1.00 0.47 H new ATOM 0 HB2 GLU A 160 -3.705 7.475 9.069 1.00 0.59 H new ATOM 0 HB3 GLU A 160 -5.432 7.180 9.057 1.00 0.59 H new ATOM 0 HG2 GLU A 160 -5.679 7.618 11.325 1.00 1.51 H new ATOM 0 HG3 GLU A 160 -4.100 6.978 11.734 1.00 1.51 H new ATOM 2652 N SER A 161 -4.664 4.256 7.619 1.00 0.51 N ATOM 2653 CA SER A 161 -5.359 3.269 6.786 1.00 0.54 C ATOM 2654 C SER A 161 -5.347 1.879 7.424 1.00 0.56 C ATOM 2655 O SER A 161 -6.396 1.239 7.473 1.00 0.63 O ATOM 2656 CB SER A 161 -4.797 3.207 5.357 1.00 0.60 C ATOM 2657 OG SER A 161 -3.476 2.702 5.297 1.00 2.10 O ATOM 0 H SER A 161 -3.809 4.628 7.205 1.00 0.51 H new ATOM 0 HA SER A 161 -6.393 3.606 6.719 1.00 0.54 H new ATOM 0 HB2 SER A 161 -5.446 2.581 4.745 1.00 0.60 H new ATOM 0 HB3 SER A 161 -4.817 4.206 4.922 1.00 0.60 H new ATOM 0 HG SER A 161 -2.869 3.317 5.760 1.00 2.10 H new ATOM 2663 N LEU A 162 -4.206 1.417 7.965 1.00 0.56 N ATOM 2664 CA LEU A 162 -4.097 0.082 8.555 1.00 0.65 C ATOM 2665 C LEU A 162 -5.036 -0.036 9.748 1.00 0.64 C ATOM 2666 O LEU A 162 -5.857 -0.948 9.788 1.00 0.73 O ATOM 2667 CB LEU A 162 -2.625 -0.185 8.911 1.00 0.76 C ATOM 2668 CG LEU A 162 -2.310 -1.569 9.509 1.00 1.14 C ATOM 2669 CD1 LEU A 162 -0.906 -1.979 9.049 1.00 1.68 C ATOM 2670 CD2 LEU A 162 -2.334 -1.561 11.046 1.00 2.75 C ATOM 0 H LEU A 162 -3.342 1.958 8.003 1.00 0.56 H new ATOM 0 HA LEU A 162 -4.406 -0.685 7.845 1.00 0.65 H new ATOM 0 HB2 LEU A 162 -2.026 -0.057 8.009 1.00 0.76 H new ATOM 0 HB3 LEU A 162 -2.301 0.577 9.620 1.00 0.76 H new ATOM 0 HG LEU A 162 -3.074 -2.268 9.167 1.00 1.14 H new ATOM 0 HD11 LEU A 162 -0.660 -2.958 9.461 1.00 1.68 H new ATOM 0 HD12 LEU A 162 -0.879 -2.026 7.960 1.00 1.68 H new ATOM 0 HD13 LEU A 162 -0.180 -1.245 9.399 1.00 1.68 H new ATOM 0 HD21 LEU A 162 -2.106 -2.560 11.419 1.00 2.75 H new ATOM 0 HD22 LEU A 162 -1.590 -0.856 11.418 1.00 2.75 H new ATOM 0 HD23 LEU A 162 -3.323 -1.261 11.393 1.00 2.75 H new ATOM 2682 N MET A 163 -4.966 0.906 10.691 1.00 0.59 N ATOM 2683 CA MET A 163 -5.788 0.851 11.899 1.00 0.68 C ATOM 2684 C MET A 163 -7.278 1.032 11.595 1.00 0.66 C ATOM 2685 O MET A 163 -8.094 0.320 12.174 1.00 0.73 O ATOM 2686 CB MET A 163 -5.250 1.798 12.979 1.00 0.80 C ATOM 2687 CG MET A 163 -5.603 3.261 12.727 1.00 0.94 C ATOM 2688 SD MET A 163 -4.745 4.418 13.812 1.00 1.64 S ATOM 2689 CE MET A 163 -5.964 5.743 13.709 1.00 0.95 C ATOM 0 H MET A 163 -4.348 1.716 10.640 1.00 0.59 H new ATOM 0 HA MET A 163 -5.710 -0.153 12.315 1.00 0.68 H new ATOM 0 HB2 MET A 163 -5.648 1.497 13.948 1.00 0.80 H new ATOM 0 HB3 MET A 163 -4.166 1.697 13.034 1.00 0.80 H new ATOM 0 HG2 MET A 163 -5.369 3.508 11.691 1.00 0.94 H new ATOM 0 HG3 MET A 163 -6.678 3.392 12.851 1.00 0.94 H new ATOM 0 HE1 MET A 163 -5.534 6.664 14.103 1.00 0.95 H new ATOM 0 HE2 MET A 163 -6.252 5.893 12.668 1.00 0.95 H new ATOM 0 HE3 MET A 163 -6.844 5.474 14.294 1.00 0.95 H new ATOM 2699 N ALA A 164 -7.652 1.947 10.691 1.00 0.59 N ATOM 2700 CA ALA A 164 -9.052 2.190 10.346 1.00 0.60 C ATOM 2701 C ALA A 164 -9.671 0.990 9.620 1.00 0.65 C ATOM 2702 O ALA A 164 -10.776 0.579 9.969 1.00 0.70 O ATOM 2703 CB ALA A 164 -9.167 3.473 9.509 1.00 0.57 C ATOM 0 H ALA A 164 -6.993 2.536 10.182 1.00 0.59 H new ATOM 0 HA ALA A 164 -9.617 2.324 11.269 1.00 0.60 H new ATOM 0 HB1 ALA A 164 -10.212 3.649 9.255 1.00 0.57 H new ATOM 0 HB2 ALA A 164 -8.786 4.317 10.083 1.00 0.57 H new ATOM 0 HB3 ALA A 164 -8.585 3.364 8.594 1.00 0.57 H new ATOM 2709 N LEU A 165 -8.949 0.391 8.665 1.00 0.65 N ATOM 2710 CA LEU A 165 -9.406 -0.791 7.923 1.00 0.72 C ATOM 2711 C LEU A 165 -9.500 -1.990 8.876 1.00 0.79 C ATOM 2712 O LEU A 165 -10.506 -2.701 8.873 1.00 0.84 O ATOM 2713 CB LEU A 165 -8.453 -1.013 6.722 1.00 0.71 C ATOM 2714 CG LEU A 165 -8.944 -1.817 5.500 1.00 0.82 C ATOM 2715 CD1 LEU A 165 -9.427 -3.231 5.830 1.00 1.29 C ATOM 2716 CD2 LEU A 165 -10.014 -1.051 4.705 1.00 1.85 C ATOM 0 H LEU A 165 -8.024 0.715 8.383 1.00 0.65 H new ATOM 0 HA LEU A 165 -10.408 -0.652 7.516 1.00 0.72 H new ATOM 0 HB2 LEU A 165 -8.145 -0.031 6.364 1.00 0.71 H new ATOM 0 HB3 LEU A 165 -7.560 -1.509 7.101 1.00 0.71 H new ATOM 0 HG LEU A 165 -8.060 -1.938 4.874 1.00 0.82 H new ATOM 0 HD11 LEU A 165 -9.754 -3.726 4.916 1.00 1.29 H new ATOM 0 HD12 LEU A 165 -8.612 -3.799 6.278 1.00 1.29 H new ATOM 0 HD13 LEU A 165 -10.260 -3.177 6.531 1.00 1.29 H new ATOM 0 HD21 LEU A 165 -10.333 -1.651 3.853 1.00 1.85 H new ATOM 0 HD22 LEU A 165 -10.871 -0.850 5.348 1.00 1.85 H new ATOM 0 HD23 LEU A 165 -9.598 -0.108 4.349 1.00 1.85 H new ATOM 2728 N MET A 166 -8.517 -2.157 9.772 1.00 0.80 N ATOM 2729 CA MET A 166 -8.570 -3.186 10.819 1.00 0.89 C ATOM 2730 C MET A 166 -9.787 -3.014 11.736 1.00 0.88 C ATOM 2731 O MET A 166 -10.498 -3.988 11.960 1.00 0.93 O ATOM 2732 CB MET A 166 -7.279 -3.212 11.653 1.00 0.93 C ATOM 2733 CG MET A 166 -6.097 -3.901 10.950 1.00 2.14 C ATOM 2734 SD MET A 166 -6.340 -5.598 10.354 1.00 3.04 S ATOM 2735 CE MET A 166 -7.155 -6.348 11.788 1.00 1.83 C ATOM 0 H MET A 166 -7.671 -1.588 9.792 1.00 0.80 H new ATOM 0 HA MET A 166 -8.669 -4.142 10.305 1.00 0.89 H new ATOM 0 HB2 MET A 166 -6.996 -2.188 11.899 1.00 0.93 H new ATOM 0 HB3 MET A 166 -7.477 -3.723 12.595 1.00 0.93 H new ATOM 0 HG2 MET A 166 -5.808 -3.285 10.098 1.00 2.14 H new ATOM 0 HG3 MET A 166 -5.253 -3.906 11.640 1.00 2.14 H new ATOM 0 HE1 MET A 166 -7.226 -7.426 11.643 1.00 1.83 H new ATOM 0 HE2 MET A 166 -6.574 -6.140 12.687 1.00 1.83 H new ATOM 0 HE3 MET A 166 -8.155 -5.930 11.898 1.00 1.83 H new ATOM 2745 N ARG A 167 -10.062 -1.805 12.247 1.00 0.82 N ATOM 2746 CA ARG A 167 -11.227 -1.548 13.117 1.00 0.86 C ATOM 2747 C ARG A 167 -12.592 -1.678 12.425 1.00 0.82 C ATOM 2748 O ARG A 167 -13.627 -1.769 13.087 1.00 0.87 O ATOM 2749 CB ARG A 167 -11.106 -0.191 13.841 1.00 0.89 C ATOM 2750 CG ARG A 167 -11.134 -0.387 15.361 1.00 1.29 C ATOM 2751 CD ARG A 167 -12.457 -0.965 15.893 1.00 2.04 C ATOM 2752 NE ARG A 167 -12.375 -1.275 17.332 1.00 2.46 N ATOM 2753 CZ ARG A 167 -12.800 -2.387 17.926 1.00 3.71 C ATOM 2754 NH1 ARG A 167 -13.359 -3.377 17.266 1.00 4.76 N ATOM 2755 NH2 ARG A 167 -12.659 -2.531 19.225 1.00 4.33 N ATOM 0 H ARG A 167 -9.489 -0.980 12.072 1.00 0.82 H new ATOM 0 HA ARG A 167 -11.199 -2.350 13.854 1.00 0.86 H new ATOM 0 HB2 ARG A 167 -10.178 0.302 13.549 1.00 0.89 H new ATOM 0 HB3 ARG A 167 -11.923 0.463 13.538 1.00 0.89 H new ATOM 0 HG2 ARG A 167 -10.318 -1.051 15.646 1.00 1.29 H new ATOM 0 HG3 ARG A 167 -10.948 0.572 15.844 1.00 1.29 H new ATOM 0 HD2 ARG A 167 -13.262 -0.251 15.719 1.00 2.04 H new ATOM 0 HD3 ARG A 167 -12.708 -1.870 15.339 1.00 2.04 H new ATOM 0 HE ARG A 167 -11.951 -0.567 17.931 1.00 2.46 H new ATOM 0 HH11 ARG A 167 -13.482 -3.311 16.256 1.00 4.76 H new ATOM 0 HH12 ARG A 167 -13.670 -4.211 17.764 1.00 4.76 H new ATOM 0 HH21 ARG A 167 -12.224 -1.791 19.776 1.00 4.33 H new ATOM 0 HH22 ARG A 167 -12.984 -3.383 19.682 1.00 4.33 H new ATOM 2769 N LEU A 168 -12.604 -1.657 11.096 1.00 0.79 N ATOM 2770 CA LEU A 168 -13.800 -1.870 10.280 1.00 0.83 C ATOM 2771 C LEU A 168 -14.060 -3.372 10.071 1.00 0.89 C ATOM 2772 O LEU A 168 -15.194 -3.830 10.212 1.00 1.05 O ATOM 2773 CB LEU A 168 -13.615 -1.093 8.963 1.00 0.83 C ATOM 2774 CG LEU A 168 -14.886 -0.484 8.359 1.00 1.13 C ATOM 2775 CD1 LEU A 168 -15.942 -1.538 8.005 1.00 2.69 C ATOM 2776 CD2 LEU A 168 -15.509 0.624 9.217 1.00 1.55 C ATOM 0 H LEU A 168 -11.765 -1.488 10.541 1.00 0.79 H new ATOM 0 HA LEU A 168 -14.691 -1.492 10.782 1.00 0.83 H new ATOM 0 HB2 LEU A 168 -12.898 -0.291 9.135 1.00 0.83 H new ATOM 0 HB3 LEU A 168 -13.172 -1.764 8.227 1.00 0.83 H new ATOM 0 HG LEU A 168 -14.545 -0.020 7.433 1.00 1.13 H new ATOM 0 HD11 LEU A 168 -16.818 -1.047 7.582 1.00 2.69 H new ATOM 0 HD12 LEU A 168 -15.530 -2.236 7.276 1.00 2.69 H new ATOM 0 HD13 LEU A 168 -16.230 -2.081 8.905 1.00 2.69 H new ATOM 0 HD21 LEU A 168 -16.404 1.006 8.725 1.00 1.55 H new ATOM 0 HD22 LEU A 168 -15.776 0.221 10.194 1.00 1.55 H new ATOM 0 HD23 LEU A 168 -14.791 1.434 9.343 1.00 1.55 H new ATOM 2788 N ASN A 169 -13.011 -4.155 9.804 1.00 0.97 N ATOM 2789 CA ASN A 169 -13.104 -5.611 9.672 1.00 1.01 C ATOM 2790 C ASN A 169 -13.289 -6.340 11.019 1.00 1.03 C ATOM 2791 O ASN A 169 -14.068 -7.291 11.102 1.00 1.13 O ATOM 2792 CB ASN A 169 -11.807 -6.147 9.047 1.00 1.07 C ATOM 2793 CG ASN A 169 -11.708 -6.047 7.530 1.00 1.66 C ATOM 2794 OD1 ASN A 169 -12.275 -5.175 6.881 1.00 2.42 O ATOM 2795 ND2 ASN A 169 -10.986 -6.975 6.926 1.00 2.31 N ATOM 0 H ASN A 169 -12.066 -3.793 9.672 1.00 0.97 H new ATOM 0 HA ASN A 169 -13.980 -5.803 9.053 1.00 1.01 H new ATOM 0 HB2 ASN A 169 -10.966 -5.607 9.483 1.00 1.07 H new ATOM 0 HB3 ASN A 169 -11.695 -7.193 9.331 1.00 1.07 H new ATOM 0 HD21 ASN A 169 -10.896 -6.970 5.910 1.00 2.31 H new ATOM 0 HD22 ASN A 169 -10.519 -7.696 7.476 1.00 2.31 H new