USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1204 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 61 TYR OH : rot 82:sc= 1.59 USER MOD Set 1.2: A 64 LYS NZ :NH3+ -114:sc= 0.525 (180deg=0.357) USER MOD Set 1.3: C 230 ASN : amide:sc= -0.63 K(o=1.9,f=-2.3) USER MOD Set 1.4: D 307 TYR OH : rot -149:sc= 0.388 USER MOD Set 2.1: A 30 ASN : amide:sc= 0.957 K(o=2.1,f=-8.9!) USER MOD Set 2.2: C 268 LYS NZ :NH3+ -172:sc= 1.17 (180deg=0) USER MOD Set 3.1: B 107 TYR OH : rot 22:sc= -1.07! USER MOD Set 3.2: C 261 TYR OH : rot -29:sc= 1.04 USER MOD Set 4.1: C 231 THR OG1 : rot -135:sc= 0.756 USER MOD Set 4.2: C 237 GLN : amide:sc= -7.01! C(o=-6.3!,f=-7.1!) USER MOD Set 5.1: B 108 THR OG1 : rot -69:sc= 0.569 USER MOD Set 5.2: C 222 ASN : amide:sc= -3.27! C(o=-3!,f=-13!) USER MOD Set 5.3: C 243 LYS NZ :NH3+ -169:sc= -0.263! (180deg=-1.32!) USER MOD Set 6.1: A 43 LYS NZ :NH3+ 176:sc= 1.21 (180deg=0) USER MOD Set 6.2: D 309 SER OG : rot -139:sc= 0.993 USER MOD Set 7.1: A 31 THR OG1 : rot -102:sc= 0.308 USER MOD Set 7.2: A 37 GLN :FLIP amide:sc= -0.146 F(o=-0.88!,f=0.16) USER MOD Set 8.1: A 22 ASN :FLIP amide:sc= -1.47 F(o=-3,f=-1.4) USER MOD Set 8.2: A 44 ASN : amide:sc= 0.0814 K(o=-1.4,f=-6.2!) USER MOD Single : A 16 SER OG : rot 158:sc= 2.12 USER MOD Single : A 17 HIS : no HE2:sc=-0.00897 K(o=-0.009,f=-3.6!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HE2:sc=-0.00992 K(o=-0.0099,f=-1.8) USER MOD Single : A 27 LYS NZ :NH3+ -147:sc= -0.978 (180deg=-2.51!) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0.33) USER MOD Single : A 45 ASN : amide:sc= -1.82 K(o=-1.8,f=-2.9!) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 54 LYS NZ :NH3+ -124:sc= 0.386 (180deg=-0.109) USER MOD Single : A 56 LYS NZ :NH3+ 164:sc= 1.24 (180deg=1.18) USER MOD Single : A 59 GLN :FLIP amide:sc= -0.234 F(o=-0.77,f=-0.23) USER MOD Single : A 67 ASN :FLIP amide:sc= -0.259 F(o=-2.7!,f=-0.26) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 109 SER OG : rot 180:sc= -0.0596 USER MOD Single : B 111 ASN :FLIP amide:sc= -0.157 F(o=-1,f=-0.16) USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : B 124 MET CE :methyl -109:sc= -0.23 (180deg=-0.439) USER MOD Single : B 125 LYS NZ :NH3+ -136:sc= -0.0844 (180deg=-0.523) USER MOD Single : C 216 SER OG : rot -170:sc= 0.734 USER MOD Single : C 217 HIS : no HE2:sc= -2.15 X(o=-2.2,f=-2.2!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HE2:sc= -1.82 K(o=-1.8,f=-3.7) USER MOD Single : C 227 LYS NZ :NH3+ -135:sc= -0.914 (180deg=-3.11!) USER MOD Single : C 233 ASN :FLIP amide:sc= 0 F(o=-0.64,f=0) USER MOD Single : C 244 ASN : amide:sc= -0.0364 K(o=-0.036,f=-4.4!) USER MOD Single : C 245 ASN : amide:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : C 246 ASN : amide:sc= -0.512 K(o=-0.51,f=-4.4!) USER MOD Single : C 248 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 254 LYS NZ :NH3+ -153:sc= -1.26! (180deg=-3.07!) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN :FLIP amide:sc= -2.56! C(o=-3.5!,f=-2.6!) USER MOD Single : C 264 LYS NZ :NH3+ 166:sc= 1.23 (180deg=1.17) USER MOD Single : C 267 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : D 308 THR OG1 : rot -4:sc= -1.84! USER MOD Single : D 311 ASN : amide:sc= -2.71! C(o=-2.7!,f=-7.3!) USER MOD Single : D 321 TYR OH : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot 180:sc= 0 USER MOD Single : D 324 MET CE :methyl 168:sc= -0.0163 (180deg=-0.217) USER MOD Single : D 325 LYS NZ :NH3+ -165:sc= -0.0772 (180deg=-0.325) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -8.964 -6.057 15.449 1.00 5.41 N ATOM 140 CA CYS A 9 -8.058 -6.013 14.342 1.00 24.01 C ATOM 141 C CYS A 9 -8.822 -6.021 13.021 1.00 3.33 C ATOM 142 O CYS A 9 -9.957 -6.504 12.965 1.00 64.22 O ATOM 143 CB CYS A 9 -7.083 -7.174 14.447 1.00 11.03 C ATOM 144 SG CYS A 9 -6.109 -7.132 15.985 1.00 73.01 S ATOM 0 HA CYS A 9 -7.487 -5.085 14.369 1.00 24.01 H new ATOM 0 HB2 CYS A 9 -7.635 -8.113 14.396 1.00 11.03 H new ATOM 0 HB3 CYS A 9 -6.407 -7.155 13.592 1.00 11.03 H new ATOM 149 N PRO A 10 -8.224 -5.446 11.961 1.00 43.23 N ATOM 150 CA PRO A 10 -8.836 -5.320 10.637 1.00 21.01 C ATOM 151 C PRO A 10 -9.348 -6.617 10.047 1.00 50.33 C ATOM 152 O PRO A 10 -10.542 -6.807 9.926 1.00 51.15 O ATOM 153 CB PRO A 10 -7.706 -4.780 9.772 1.00 61.01 C ATOM 154 CG PRO A 10 -6.475 -4.955 10.566 1.00 55.14 C ATOM 155 CD PRO A 10 -6.903 -4.829 11.981 1.00 54.34 C ATOM 0 HA PRO A 10 -9.721 -4.687 10.695 1.00 21.01 H new ATOM 0 HB2 PRO A 10 -7.643 -5.321 8.828 1.00 61.01 H new ATOM 0 HB3 PRO A 10 -7.868 -3.730 9.527 1.00 61.01 H new ATOM 0 HG2 PRO A 10 -6.020 -5.927 10.377 1.00 55.14 H new ATOM 0 HG3 PRO A 10 -5.731 -4.200 10.311 1.00 55.14 H new ATOM 0 HD2 PRO A 10 -6.223 -5.345 12.659 1.00 54.34 H new ATOM 0 HD3 PRO A 10 -6.945 -3.788 12.302 1.00 54.34 H new ATOM 163 N CYS A 11 -8.449 -7.490 9.680 1.00 44.10 N ATOM 164 CA CYS A 11 -8.825 -8.732 9.068 1.00 40.42 C ATOM 165 C CYS A 11 -8.813 -9.793 10.144 1.00 55.13 C ATOM 166 O CYS A 11 -8.103 -9.636 11.152 1.00 11.54 O ATOM 167 CB CYS A 11 -7.856 -9.071 7.928 1.00 32.32 C ATOM 168 SG CYS A 11 -8.351 -10.498 6.929 1.00 61.12 S ATOM 0 H CYS A 11 -7.444 -7.361 9.796 1.00 44.10 H new ATOM 0 HA CYS A 11 -9.822 -8.669 8.631 1.00 40.42 H new ATOM 0 HB2 CYS A 11 -7.761 -8.202 7.277 1.00 32.32 H new ATOM 0 HB3 CYS A 11 -6.869 -9.262 8.350 1.00 32.32 H new ATOM 173 N ARG A 12 -9.582 -10.845 9.975 1.00 64.40 N ATOM 174 CA ARG A 12 -9.665 -11.829 11.017 1.00 24.35 C ATOM 175 C ARG A 12 -8.484 -12.788 10.933 1.00 74.43 C ATOM 176 O ARG A 12 -7.752 -12.972 11.899 1.00 33.41 O ATOM 177 CB ARG A 12 -10.991 -12.600 10.949 1.00 62.50 C ATOM 178 CG ARG A 12 -11.404 -13.277 12.262 1.00 54.02 C ATOM 179 CD ARG A 12 -11.876 -12.250 13.310 1.00 1.10 C ATOM 180 NE ARG A 12 -10.858 -11.234 13.615 1.00 43.31 N ATOM 181 CZ ARG A 12 -11.019 -9.907 13.427 1.00 51.41 C ATOM 182 NH1 ARG A 12 -12.212 -9.398 13.114 1.00 54.25 N ATOM 183 NH2 ARG A 12 -9.999 -9.109 13.580 1.00 33.22 N ATOM 0 H ARG A 12 -10.144 -11.035 9.145 1.00 64.40 H new ATOM 0 HA ARG A 12 -9.629 -11.311 11.975 1.00 24.35 H new ATOM 0 HB2 ARG A 12 -11.781 -11.913 10.646 1.00 62.50 H new ATOM 0 HB3 ARG A 12 -10.915 -13.360 10.172 1.00 62.50 H new ATOM 0 HG2 ARG A 12 -12.204 -13.991 12.067 1.00 54.02 H new ATOM 0 HG3 ARG A 12 -10.562 -13.842 12.660 1.00 54.02 H new ATOM 0 HD2 ARG A 12 -12.777 -11.756 12.947 1.00 1.10 H new ATOM 0 HD3 ARG A 12 -12.146 -12.773 14.227 1.00 1.10 H new ATOM 0 HE ARG A 12 -9.967 -11.554 13.995 1.00 43.31 H new ATOM 0 HH11 ARG A 12 -13.019 -10.014 13.014 1.00 54.25 H new ATOM 0 HH12 ARG A 12 -12.317 -8.393 12.975 1.00 54.25 H new ATOM 0 HH21 ARG A 12 -9.089 -9.489 13.840 1.00 33.22 H new ATOM 0 HH22 ARG A 12 -10.111 -8.105 13.440 1.00 33.22 H new ATOM 197 N PHE A 13 -8.301 -13.380 9.773 1.00 2.24 N ATOM 198 CA PHE A 13 -7.239 -14.341 9.530 1.00 64.33 C ATOM 199 C PHE A 13 -6.611 -14.036 8.174 1.00 13.30 C ATOM 200 O PHE A 13 -7.192 -13.297 7.396 1.00 32.01 O ATOM 201 CB PHE A 13 -7.759 -15.786 9.578 1.00 52.13 C ATOM 202 CG PHE A 13 -8.424 -16.178 10.870 1.00 30.43 C ATOM 203 CD1 PHE A 13 -7.671 -16.564 11.960 1.00 71.14 C ATOM 204 CD2 PHE A 13 -9.800 -16.164 10.983 1.00 42.35 C ATOM 205 CE1 PHE A 13 -8.278 -16.928 13.147 1.00 12.43 C ATOM 206 CE2 PHE A 13 -10.412 -16.525 12.165 1.00 4.23 C ATOM 207 CZ PHE A 13 -9.651 -16.906 13.248 1.00 61.45 C ATOM 0 H PHE A 13 -8.891 -13.208 8.959 1.00 2.24 H new ATOM 0 HA PHE A 13 -6.490 -14.251 10.317 1.00 64.33 H new ATOM 0 HB2 PHE A 13 -8.469 -15.928 8.763 1.00 52.13 H new ATOM 0 HB3 PHE A 13 -6.925 -16.463 9.396 1.00 52.13 H new ATOM 0 HD1 PHE A 13 -6.594 -16.582 11.885 1.00 71.14 H new ATOM 0 HD2 PHE A 13 -10.403 -15.867 10.137 1.00 42.35 H new ATOM 0 HE1 PHE A 13 -7.677 -17.229 13.993 1.00 12.43 H new ATOM 0 HE2 PHE A 13 -11.489 -16.509 12.242 1.00 4.23 H new ATOM 0 HZ PHE A 13 -10.130 -17.187 14.174 1.00 61.45 H new ATOM 217 N PHE A 14 -5.429 -14.551 7.904 1.00 65.10 N ATOM 218 CA PHE A 14 -4.768 -14.249 6.642 1.00 30.34 C ATOM 219 C PHE A 14 -4.402 -15.500 5.833 1.00 65.53 C ATOM 220 O PHE A 14 -4.117 -16.572 6.387 1.00 21.53 O ATOM 221 CB PHE A 14 -3.522 -13.366 6.860 1.00 4.15 C ATOM 222 CG PHE A 14 -2.499 -13.966 7.787 1.00 64.24 C ATOM 223 CD1 PHE A 14 -1.605 -14.926 7.335 1.00 32.22 C ATOM 224 CD2 PHE A 14 -2.441 -13.577 9.107 1.00 5.45 C ATOM 225 CE1 PHE A 14 -0.680 -15.481 8.186 1.00 74.43 C ATOM 226 CE2 PHE A 14 -1.520 -14.129 9.961 1.00 5.40 C ATOM 227 CZ PHE A 14 -0.637 -15.082 9.504 1.00 20.02 C ATOM 0 H PHE A 14 -4.910 -15.171 8.526 1.00 65.10 H new ATOM 0 HA PHE A 14 -5.497 -13.695 6.051 1.00 30.34 H new ATOM 0 HB2 PHE A 14 -3.053 -13.173 5.895 1.00 4.15 H new ATOM 0 HB3 PHE A 14 -3.838 -12.402 7.260 1.00 4.15 H new ATOM 0 HD1 PHE A 14 -1.637 -15.241 6.302 1.00 32.22 H new ATOM 0 HD2 PHE A 14 -3.128 -12.829 9.474 1.00 5.45 H new ATOM 0 HE1 PHE A 14 0.011 -16.227 7.823 1.00 74.43 H new ATOM 0 HE2 PHE A 14 -1.487 -13.815 10.994 1.00 5.40 H new ATOM 0 HZ PHE A 14 0.088 -15.516 10.177 1.00 20.02 H new ATOM 237 N GLU A 15 -4.401 -15.333 4.536 1.00 34.43 N ATOM 238 CA GLU A 15 -3.995 -16.329 3.581 1.00 25.12 C ATOM 239 C GLU A 15 -2.474 -16.396 3.480 1.00 11.42 C ATOM 240 O GLU A 15 -1.765 -15.407 3.707 1.00 52.55 O ATOM 241 CB GLU A 15 -4.582 -16.024 2.190 1.00 23.05 C ATOM 242 CG GLU A 15 -5.928 -16.674 1.852 1.00 4.45 C ATOM 243 CD GLU A 15 -7.060 -16.332 2.750 1.00 14.50 C ATOM 244 OE1 GLU A 15 -7.763 -15.347 2.462 1.00 42.41 O ATOM 245 OE2 GLU A 15 -7.314 -17.102 3.701 1.00 22.45 O ATOM 0 H GLU A 15 -4.696 -14.460 4.098 1.00 34.43 H new ATOM 0 HA GLU A 15 -4.374 -17.290 3.928 1.00 25.12 H new ATOM 0 HB2 GLU A 15 -4.693 -14.944 2.097 1.00 23.05 H new ATOM 0 HB3 GLU A 15 -3.856 -16.335 1.439 1.00 23.05 H new ATOM 0 HG2 GLU A 15 -6.200 -16.393 0.835 1.00 4.45 H new ATOM 0 HG3 GLU A 15 -5.798 -17.756 1.860 1.00 4.45 H new ATOM 252 N SER A 16 -1.994 -17.548 3.134 1.00 13.23 N ATOM 253 CA SER A 16 -0.599 -17.808 3.004 1.00 2.11 C ATOM 254 C SER A 16 -0.209 -17.988 1.535 1.00 21.50 C ATOM 255 O SER A 16 -0.942 -18.595 0.764 1.00 43.22 O ATOM 256 CB SER A 16 -0.300 -19.044 3.794 1.00 63.22 C ATOM 257 OG SER A 16 -1.282 -20.043 3.496 1.00 45.40 O ATOM 0 H SER A 16 -2.581 -18.356 2.928 1.00 13.23 H new ATOM 0 HA SER A 16 -0.019 -16.966 3.381 1.00 2.11 H new ATOM 0 HB2 SER A 16 0.697 -19.413 3.551 1.00 63.22 H new ATOM 0 HB3 SER A 16 -0.305 -18.819 4.860 1.00 63.22 H new ATOM 0 HG SER A 16 -0.924 -20.929 3.713 1.00 45.40 H new ATOM 263 N HIS A 17 0.945 -17.462 1.168 1.00 54.43 N ATOM 264 CA HIS A 17 1.439 -17.494 -0.216 1.00 4.42 C ATOM 265 C HIS A 17 0.614 -16.637 -1.132 1.00 44.44 C ATOM 266 O HIS A 17 0.891 -15.463 -1.264 1.00 55.13 O ATOM 267 CB HIS A 17 1.634 -18.912 -0.811 1.00 40.13 C ATOM 268 CG HIS A 17 2.825 -19.665 -0.305 1.00 1.33 C ATOM 269 ND1 HIS A 17 3.093 -20.958 -0.669 1.00 0.02 N ATOM 270 CD2 HIS A 17 3.859 -19.286 0.480 1.00 11.22 C ATOM 271 CE1 HIS A 17 4.226 -21.340 -0.156 1.00 64.23 C ATOM 272 NE2 HIS A 17 4.722 -20.354 0.549 1.00 52.11 N ATOM 0 H HIS A 17 1.577 -16.995 1.818 1.00 54.43 H new ATOM 0 HA HIS A 17 2.440 -17.069 -0.147 1.00 4.42 H new ATOM 0 HB2 HIS A 17 0.740 -19.500 -0.604 1.00 40.13 H new ATOM 0 HB3 HIS A 17 1.715 -18.824 -1.894 1.00 40.13 H new ATOM 0 HD1 HIS A 17 2.492 -21.537 -1.256 1.00 0.02 H new ATOM 0 HD2 HIS A 17 3.983 -18.327 0.961 1.00 11.22 H new ATOM 0 HE1 HIS A 17 4.682 -22.310 -0.289 1.00 64.23 H new ATOM 281 N VAL A 18 -0.433 -17.221 -1.720 1.00 14.24 N ATOM 282 CA VAL A 18 -1.299 -16.544 -2.688 1.00 43.41 C ATOM 283 C VAL A 18 -0.527 -16.220 -3.985 1.00 44.31 C ATOM 284 O VAL A 18 0.690 -16.017 -3.982 1.00 45.25 O ATOM 285 CB VAL A 18 -1.977 -15.263 -2.093 1.00 63.04 C ATOM 286 CG1 VAL A 18 -2.898 -14.575 -3.105 1.00 2.22 C ATOM 287 CG2 VAL A 18 -2.756 -15.623 -0.841 1.00 62.11 C ATOM 0 H VAL A 18 -0.706 -18.186 -1.536 1.00 14.24 H new ATOM 0 HA VAL A 18 -2.105 -17.236 -2.933 1.00 43.41 H new ATOM 0 HB VAL A 18 -1.184 -14.559 -1.842 1.00 63.04 H new ATOM 0 HG11 VAL A 18 -3.346 -13.692 -2.648 1.00 2.22 H new ATOM 0 HG12 VAL A 18 -2.320 -14.277 -3.980 1.00 2.22 H new ATOM 0 HG13 VAL A 18 -3.685 -15.265 -3.408 1.00 2.22 H new ATOM 0 HG21 VAL A 18 -3.224 -14.727 -0.434 1.00 62.11 H new ATOM 0 HG22 VAL A 18 -3.526 -16.354 -1.089 1.00 62.11 H new ATOM 0 HG23 VAL A 18 -2.078 -16.047 -0.100 1.00 62.11 H new ATOM 297 N ALA A 19 -1.225 -16.207 -5.080 1.00 41.32 N ATOM 298 CA ALA A 19 -0.606 -15.948 -6.339 1.00 1.24 C ATOM 299 C ALA A 19 -0.462 -14.450 -6.583 1.00 75.13 C ATOM 300 O ALA A 19 -1.451 -13.709 -6.624 1.00 31.33 O ATOM 301 CB ALA A 19 -1.374 -16.612 -7.457 1.00 4.52 C ATOM 0 H ALA A 19 -2.230 -16.374 -5.124 1.00 41.32 H new ATOM 0 HA ALA A 19 0.397 -16.375 -6.318 1.00 1.24 H new ATOM 0 HB1 ALA A 19 -0.886 -16.402 -8.409 1.00 4.52 H new ATOM 0 HB2 ALA A 19 -1.399 -17.689 -7.292 1.00 4.52 H new ATOM 0 HB3 ALA A 19 -2.393 -16.225 -7.479 1.00 4.52 H new ATOM 307 N ARG A 20 0.771 -14.032 -6.759 1.00 53.23 N ATOM 308 CA ARG A 20 1.150 -12.646 -7.028 1.00 15.41 C ATOM 309 C ARG A 20 0.631 -12.201 -8.408 1.00 75.42 C ATOM 310 O ARG A 20 0.538 -11.012 -8.703 1.00 52.22 O ATOM 311 CB ARG A 20 2.701 -12.547 -6.836 1.00 24.12 C ATOM 312 CG ARG A 20 3.473 -11.246 -7.189 1.00 41.01 C ATOM 313 CD ARG A 20 3.661 -11.057 -8.677 1.00 54.44 C ATOM 314 NE ARG A 20 4.679 -10.044 -8.990 1.00 70.13 N ATOM 315 CZ ARG A 20 5.188 -9.835 -10.220 1.00 21.23 C ATOM 316 NH1 ARG A 20 4.698 -10.490 -11.265 1.00 33.14 N ATOM 317 NH2 ARG A 20 6.174 -8.962 -10.395 1.00 42.40 N ATOM 0 H ARG A 20 1.572 -14.662 -6.719 1.00 53.23 H new ATOM 0 HA ARG A 20 0.686 -11.945 -6.334 1.00 15.41 H new ATOM 0 HB2 ARG A 20 2.907 -12.765 -5.788 1.00 24.12 H new ATOM 0 HB3 ARG A 20 3.146 -13.351 -7.422 1.00 24.12 H new ATOM 0 HG2 ARG A 20 2.934 -10.389 -6.785 1.00 41.01 H new ATOM 0 HG3 ARG A 20 4.449 -11.266 -6.705 1.00 41.01 H new ATOM 0 HD2 ARG A 20 3.948 -12.007 -9.128 1.00 54.44 H new ATOM 0 HD3 ARG A 20 2.712 -10.765 -9.126 1.00 54.44 H new ATOM 0 HE ARG A 20 5.022 -9.461 -8.226 1.00 70.13 H new ATOM 0 HH11 ARG A 20 3.934 -11.154 -11.138 1.00 33.14 H new ATOM 0 HH12 ARG A 20 5.085 -10.330 -12.195 1.00 33.14 H new ATOM 0 HH21 ARG A 20 6.548 -8.448 -9.597 1.00 42.40 H new ATOM 0 HH22 ARG A 20 6.557 -8.806 -11.327 1.00 42.40 H new ATOM 331 N ALA A 21 0.281 -13.166 -9.229 1.00 55.34 N ATOM 332 CA ALA A 21 -0.289 -12.900 -10.530 1.00 40.51 C ATOM 333 C ALA A 21 -1.803 -12.626 -10.468 1.00 11.33 C ATOM 334 O ALA A 21 -2.388 -12.143 -11.436 1.00 33.33 O ATOM 335 CB ALA A 21 -0.001 -14.045 -11.489 1.00 43.45 C ATOM 0 H ALA A 21 0.384 -14.158 -9.013 1.00 55.34 H new ATOM 0 HA ALA A 21 0.188 -11.993 -10.901 1.00 40.51 H new ATOM 0 HB1 ALA A 21 -0.439 -13.824 -12.462 1.00 43.45 H new ATOM 0 HB2 ALA A 21 1.077 -14.168 -11.596 1.00 43.45 H new ATOM 0 HB3 ALA A 21 -0.434 -14.965 -11.097 1.00 43.45 H new ATOM 341 N ASN A 22 -2.445 -12.920 -9.342 1.00 63.35 N ATOM 342 CA ASN A 22 -3.910 -12.778 -9.279 1.00 2.40 C ATOM 343 C ASN A 22 -4.319 -11.553 -8.455 1.00 72.51 C ATOM 344 O ASN A 22 -5.495 -11.307 -8.216 1.00 40.04 O ATOM 345 CB ASN A 22 -4.559 -14.047 -8.695 1.00 21.53 C ATOM 346 CG ASN A 22 -6.084 -14.074 -8.872 1.00 65.53 C ATOM 347 OD1 ASN A 22 -6.768 -14.689 -7.955 1.00 4.51 O flip ATOM 348 ND2 ASN A 22 -6.631 -13.529 -9.840 1.00 62.32 N flip ATOM 0 H ASN A 22 -2.001 -13.247 -8.484 1.00 63.35 H new ATOM 0 HA ASN A 22 -4.267 -12.637 -10.299 1.00 2.40 H new ATOM 0 HB2 ASN A 22 -4.127 -14.924 -9.176 1.00 21.53 H new ATOM 0 HB3 ASN A 22 -4.320 -14.116 -7.634 1.00 21.53 H new ATOM 0 HD21 ASN A 22 -6.066 -13.054 -10.544 1.00 62.32 H new ATOM 0 HD22 ASN A 22 -7.646 -13.555 -9.933 1.00 62.32 H new ATOM 355 N VAL A 23 -3.363 -10.785 -8.045 1.00 73.02 N ATOM 356 CA VAL A 23 -3.632 -9.607 -7.248 1.00 14.43 C ATOM 357 C VAL A 23 -3.622 -8.318 -8.098 1.00 24.13 C ATOM 358 O VAL A 23 -2.826 -8.185 -9.017 1.00 22.21 O ATOM 359 CB VAL A 23 -2.664 -9.505 -6.011 1.00 62.32 C ATOM 360 CG1 VAL A 23 -1.233 -9.751 -6.420 1.00 45.34 C ATOM 361 CG2 VAL A 23 -2.739 -8.144 -5.395 1.00 23.12 C ATOM 0 H VAL A 23 -2.376 -10.945 -8.245 1.00 73.02 H new ATOM 0 HA VAL A 23 -4.642 -9.714 -6.853 1.00 14.43 H new ATOM 0 HB VAL A 23 -2.979 -10.263 -5.294 1.00 62.32 H new ATOM 0 HG11 VAL A 23 -0.586 -9.674 -5.546 1.00 45.34 H new ATOM 0 HG12 VAL A 23 -1.144 -10.748 -6.851 1.00 45.34 H new ATOM 0 HG13 VAL A 23 -0.933 -9.008 -7.159 1.00 45.34 H new ATOM 0 HG21 VAL A 23 -2.063 -8.093 -4.542 1.00 23.12 H new ATOM 0 HG22 VAL A 23 -2.450 -7.395 -6.132 1.00 23.12 H new ATOM 0 HG23 VAL A 23 -3.759 -7.951 -5.062 1.00 23.12 H new ATOM 371 N LYS A 24 -4.561 -7.401 -7.812 1.00 54.14 N ATOM 372 CA LYS A 24 -4.595 -6.105 -8.497 1.00 71.01 C ATOM 373 C LYS A 24 -3.861 -5.021 -7.716 1.00 31.11 C ATOM 374 O LYS A 24 -3.277 -4.118 -8.294 1.00 54.23 O ATOM 375 CB LYS A 24 -6.028 -5.650 -8.774 1.00 64.40 C ATOM 376 CG LYS A 24 -6.726 -6.547 -9.762 1.00 43.04 C ATOM 377 CD LYS A 24 -8.120 -6.072 -10.163 1.00 31.21 C ATOM 378 CE LYS A 24 -9.102 -6.086 -9.009 1.00 45.32 C ATOM 379 NZ LYS A 24 -10.444 -5.642 -9.439 1.00 53.23 N ATOM 0 H LYS A 24 -5.297 -7.533 -7.119 1.00 54.14 H new ATOM 0 HA LYS A 24 -4.080 -6.253 -9.446 1.00 71.01 H new ATOM 0 HB2 LYS A 24 -6.590 -5.634 -7.840 1.00 64.40 H new ATOM 0 HB3 LYS A 24 -6.016 -4.629 -9.157 1.00 64.40 H new ATOM 0 HG2 LYS A 24 -6.111 -6.630 -10.658 1.00 43.04 H new ATOM 0 HG3 LYS A 24 -6.804 -7.547 -9.336 1.00 43.04 H new ATOM 0 HD2 LYS A 24 -8.052 -5.061 -10.564 1.00 31.21 H new ATOM 0 HD3 LYS A 24 -8.499 -6.708 -10.964 1.00 31.21 H new ATOM 0 HE2 LYS A 24 -9.165 -7.092 -8.595 1.00 45.32 H new ATOM 0 HE3 LYS A 24 -8.740 -5.436 -8.213 1.00 45.32 H new ATOM 0 HZ1 LYS A 24 -11.093 -5.663 -8.627 1.00 53.23 H new ATOM 0 HZ2 LYS A 24 -10.386 -4.673 -9.812 1.00 53.23 H new ATOM 0 HZ3 LYS A 24 -10.799 -6.278 -10.182 1.00 53.23 H new ATOM 393 N HIS A 25 -3.921 -5.116 -6.396 1.00 22.32 N ATOM 394 CA HIS A 25 -3.280 -4.137 -5.485 1.00 4.52 C ATOM 395 C HIS A 25 -3.346 -4.599 -4.042 1.00 21.04 C ATOM 396 O HIS A 25 -4.192 -5.452 -3.700 1.00 61.31 O ATOM 397 CB HIS A 25 -3.865 -2.707 -5.610 1.00 20.23 C ATOM 398 CG HIS A 25 -5.352 -2.600 -5.476 1.00 63.14 C ATOM 399 ND1 HIS A 25 -6.145 -3.559 -4.884 1.00 3.24 N ATOM 400 CD2 HIS A 25 -6.187 -1.648 -5.900 1.00 32.30 C ATOM 401 CE1 HIS A 25 -7.402 -3.190 -4.970 1.00 45.31 C ATOM 402 NE2 HIS A 25 -7.451 -2.036 -5.580 1.00 51.50 N ATOM 0 H HIS A 25 -4.411 -5.868 -5.912 1.00 22.32 H new ATOM 0 HA HIS A 25 -2.237 -4.085 -5.799 1.00 4.52 H new ATOM 0 HB2 HIS A 25 -3.404 -2.078 -4.849 1.00 20.23 H new ATOM 0 HB3 HIS A 25 -3.576 -2.299 -6.579 1.00 20.23 H new ATOM 0 HD1 HIS A 25 -5.809 -4.418 -4.449 1.00 3.24 H new ATOM 0 HD2 HIS A 25 -5.909 -0.735 -6.406 1.00 32.30 H new ATOM 0 HE1 HIS A 25 -8.251 -3.746 -4.600 1.00 45.31 H new ATOM 411 N LEU A 26 -2.517 -3.997 -3.204 1.00 43.10 N ATOM 412 CA LEU A 26 -2.383 -4.360 -1.795 1.00 4.50 C ATOM 413 C LEU A 26 -2.808 -3.210 -0.895 1.00 61.25 C ATOM 414 O LEU A 26 -2.527 -2.081 -1.177 1.00 44.44 O ATOM 415 CB LEU A 26 -0.898 -4.683 -1.475 1.00 25.22 C ATOM 416 CG LEU A 26 -0.264 -5.861 -2.206 1.00 63.23 C ATOM 417 CD1 LEU A 26 1.188 -6.051 -1.781 1.00 52.21 C ATOM 418 CD2 LEU A 26 -1.046 -7.120 -1.959 1.00 32.02 C ATOM 0 H LEU A 26 -1.907 -3.229 -3.485 1.00 43.10 H new ATOM 0 HA LEU A 26 -3.019 -5.226 -1.614 1.00 4.50 H new ATOM 0 HB2 LEU A 26 -0.306 -3.794 -1.691 1.00 25.22 H new ATOM 0 HB3 LEU A 26 -0.817 -4.868 -0.404 1.00 25.22 H new ATOM 0 HG LEU A 26 -0.282 -5.641 -3.273 1.00 63.23 H new ATOM 0 HD11 LEU A 26 1.616 -6.898 -2.317 1.00 52.21 H new ATOM 0 HD12 LEU A 26 1.756 -5.150 -2.013 1.00 52.21 H new ATOM 0 HD13 LEU A 26 1.231 -6.241 -0.709 1.00 52.21 H new ATOM 0 HD21 LEU A 26 -0.578 -7.949 -2.489 1.00 32.02 H new ATOM 0 HD22 LEU A 26 -1.062 -7.335 -0.891 1.00 32.02 H new ATOM 0 HD23 LEU A 26 -2.067 -6.990 -2.318 1.00 32.02 H new ATOM 430 N LYS A 27 -3.504 -3.511 0.161 1.00 62.10 N ATOM 431 CA LYS A 27 -3.842 -2.535 1.164 1.00 25.43 C ATOM 432 C LYS A 27 -3.130 -2.901 2.431 1.00 71.31 C ATOM 433 O LYS A 27 -3.365 -3.972 2.969 1.00 71.20 O ATOM 434 CB LYS A 27 -5.350 -2.458 1.374 1.00 4.35 C ATOM 435 CG LYS A 27 -5.752 -1.399 2.376 1.00 70.23 C ATOM 436 CD LYS A 27 -7.143 -0.857 2.122 1.00 35.42 C ATOM 437 CE LYS A 27 -8.279 -1.824 2.393 1.00 2.12 C ATOM 438 NZ LYS A 27 -8.304 -3.044 1.547 1.00 31.32 N ATOM 0 H LYS A 27 -3.858 -4.448 0.356 1.00 62.10 H new ATOM 0 HA LYS A 27 -3.525 -1.544 0.838 1.00 25.43 H new ATOM 0 HB2 LYS A 27 -5.834 -2.251 0.420 1.00 4.35 H new ATOM 0 HB3 LYS A 27 -5.715 -3.428 1.712 1.00 4.35 H new ATOM 0 HG2 LYS A 27 -5.707 -1.819 3.381 1.00 70.23 H new ATOM 0 HG3 LYS A 27 -5.034 -0.579 2.341 1.00 70.23 H new ATOM 0 HD2 LYS A 27 -7.288 0.029 2.740 1.00 35.42 H new ATOM 0 HD3 LYS A 27 -7.204 -0.534 1.083 1.00 35.42 H new ATOM 0 HE2 LYS A 27 -8.229 -2.130 3.438 1.00 2.12 H new ATOM 0 HE3 LYS A 27 -9.222 -1.294 2.261 1.00 2.12 H new ATOM 0 HZ1 LYS A 27 -9.290 -3.330 1.380 1.00 31.32 H new ATOM 0 HZ2 LYS A 27 -7.842 -2.845 0.637 1.00 31.32 H new ATOM 0 HZ3 LYS A 27 -7.798 -3.813 2.031 1.00 31.32 H new ATOM 452 N ILE A 28 -2.272 -2.032 2.917 1.00 32.24 N ATOM 453 CA ILE A 28 -1.445 -2.366 4.047 1.00 24.25 C ATOM 454 C ILE A 28 -2.008 -1.726 5.280 1.00 44.34 C ATOM 455 O ILE A 28 -2.403 -0.523 5.266 1.00 3.02 O ATOM 456 CB ILE A 28 0.019 -1.895 3.882 1.00 2.34 C ATOM 457 CG1 ILE A 28 0.613 -2.385 2.570 1.00 30.13 C ATOM 458 CG2 ILE A 28 0.862 -2.418 5.042 1.00 65.53 C ATOM 459 CD1 ILE A 28 2.050 -1.960 2.383 1.00 63.24 C ATOM 0 H ILE A 28 -2.131 -1.092 2.546 1.00 32.24 H new ATOM 0 HA ILE A 28 -1.441 -3.453 4.125 1.00 24.25 H new ATOM 0 HB ILE A 28 0.023 -0.805 3.877 1.00 2.34 H new ATOM 0 HG12 ILE A 28 0.553 -3.473 2.533 1.00 30.13 H new ATOM 0 HG13 ILE A 28 0.016 -2.004 1.741 1.00 30.13 H new ATOM 0 HG21 ILE A 28 1.893 -2.084 4.922 1.00 65.53 H new ATOM 0 HG22 ILE A 28 0.464 -2.036 5.982 1.00 65.53 H new ATOM 0 HG23 ILE A 28 0.832 -3.508 5.051 1.00 65.53 H new ATOM 0 HD11 ILE A 28 2.420 -2.338 1.430 1.00 63.24 H new ATOM 0 HD12 ILE A 28 2.111 -0.872 2.390 1.00 63.24 H new ATOM 0 HD13 ILE A 28 2.657 -2.363 3.194 1.00 63.24 H new ATOM 471 N LEU A 29 -2.057 -2.525 6.329 1.00 51.01 N ATOM 472 CA LEU A 29 -2.621 -2.167 7.582 1.00 12.21 C ATOM 473 C LEU A 29 -1.607 -2.447 8.682 1.00 61.32 C ATOM 474 O LEU A 29 -1.327 -3.614 8.983 1.00 32.44 O ATOM 475 CB LEU A 29 -3.801 -3.086 7.809 1.00 40.13 C ATOM 476 CG LEU A 29 -4.762 -3.214 6.639 1.00 55.52 C ATOM 477 CD1 LEU A 29 -5.776 -4.287 6.918 1.00 4.32 C ATOM 478 CD2 LEU A 29 -5.429 -1.891 6.341 1.00 64.15 C ATOM 0 H LEU A 29 -1.686 -3.475 6.313 1.00 51.01 H new ATOM 0 HA LEU A 29 -2.907 -1.115 7.592 1.00 12.21 H new ATOM 0 HB2 LEU A 29 -3.425 -4.078 8.058 1.00 40.13 H new ATOM 0 HB3 LEU A 29 -4.357 -2.729 8.676 1.00 40.13 H new ATOM 0 HG LEU A 29 -4.197 -3.501 5.752 1.00 55.52 H new ATOM 0 HD11 LEU A 29 -6.460 -4.370 6.073 1.00 4.32 H new ATOM 0 HD12 LEU A 29 -5.267 -5.239 7.068 1.00 4.32 H new ATOM 0 HD13 LEU A 29 -6.339 -4.031 7.816 1.00 4.32 H new ATOM 0 HD21 LEU A 29 -6.112 -2.009 5.500 1.00 64.15 H new ATOM 0 HD22 LEU A 29 -5.986 -1.559 7.217 1.00 64.15 H new ATOM 0 HD23 LEU A 29 -4.670 -1.149 6.091 1.00 64.15 H new ATOM 490 N ASN A 30 -1.033 -1.432 9.251 1.00 11.01 N ATOM 491 CA ASN A 30 -0.130 -1.653 10.364 1.00 64.12 C ATOM 492 C ASN A 30 -0.901 -1.281 11.606 1.00 32.24 C ATOM 493 O ASN A 30 -1.139 -0.100 11.871 1.00 14.41 O ATOM 494 CB ASN A 30 1.158 -0.802 10.259 1.00 23.23 C ATOM 495 CG ASN A 30 2.263 -1.232 11.252 1.00 21.12 C ATOM 496 OD1 ASN A 30 2.000 -1.810 12.305 1.00 23.54 O ATOM 497 ND2 ASN A 30 3.508 -0.928 10.929 1.00 42.43 N ATOM 0 H ASN A 30 -1.162 -0.458 8.979 1.00 11.01 H new ATOM 0 HA ASN A 30 0.200 -2.692 10.377 1.00 64.12 H new ATOM 0 HB2 ASN A 30 1.547 -0.870 9.243 1.00 23.23 H new ATOM 0 HB3 ASN A 30 0.908 0.244 10.436 1.00 23.23 H new ATOM 0 HD21 ASN A 30 4.272 -1.173 11.558 1.00 42.43 H new ATOM 0 HD22 ASN A 30 3.704 -0.448 10.051 1.00 42.43 H new ATOM 504 N THR A 31 -1.333 -2.272 12.322 1.00 23.45 N ATOM 505 CA THR A 31 -2.150 -2.070 13.479 1.00 55.10 C ATOM 506 C THR A 31 -1.326 -2.309 14.766 1.00 2.23 C ATOM 507 O THR A 31 -0.252 -2.902 14.698 1.00 52.43 O ATOM 508 CB THR A 31 -3.404 -2.993 13.394 1.00 63.13 C ATOM 509 OG1 THR A 31 -2.990 -4.364 13.189 1.00 75.35 O ATOM 510 CG2 THR A 31 -4.327 -2.552 12.223 1.00 62.31 C ATOM 0 H THR A 31 -1.128 -3.250 12.119 1.00 23.45 H new ATOM 0 HA THR A 31 -2.498 -1.038 13.515 1.00 55.10 H new ATOM 0 HB THR A 31 -3.957 -2.913 14.330 1.00 63.13 H new ATOM 0 HG1 THR A 31 -3.107 -4.603 12.246 1.00 75.35 H new ATOM 0 HG21 THR A 31 -5.197 -3.207 12.179 1.00 62.31 H new ATOM 0 HG22 THR A 31 -4.654 -1.525 12.385 1.00 62.31 H new ATOM 0 HG23 THR A 31 -3.778 -2.614 11.284 1.00 62.31 H new ATOM 518 N PRO A 32 -1.784 -1.821 15.942 1.00 4.24 N ATOM 519 CA PRO A 32 -1.031 -1.983 17.184 1.00 14.41 C ATOM 520 C PRO A 32 -1.283 -3.323 17.907 1.00 2.11 C ATOM 521 O PRO A 32 -0.350 -3.946 18.399 1.00 31.14 O ATOM 522 CB PRO A 32 -1.514 -0.809 18.034 1.00 2.35 C ATOM 523 CG PRO A 32 -2.916 -0.548 17.578 1.00 43.12 C ATOM 524 CD PRO A 32 -3.015 -1.024 16.140 1.00 3.32 C ATOM 0 HA PRO A 32 0.042 -1.995 16.995 1.00 14.41 H new ATOM 0 HB2 PRO A 32 -1.484 -1.053 19.096 1.00 2.35 H new ATOM 0 HB3 PRO A 32 -0.883 0.068 17.890 1.00 2.35 H new ATOM 0 HG2 PRO A 32 -3.631 -1.077 18.209 1.00 43.12 H new ATOM 0 HG3 PRO A 32 -3.153 0.514 17.649 1.00 43.12 H new ATOM 0 HD2 PRO A 32 -3.910 -1.625 15.979 1.00 3.32 H new ATOM 0 HD3 PRO A 32 -3.064 -0.186 15.445 1.00 3.32 H new ATOM 532 N ASN A 33 -2.537 -3.759 17.951 1.00 44.15 N ATOM 533 CA ASN A 33 -2.911 -4.982 18.691 1.00 73.41 C ATOM 534 C ASN A 33 -2.593 -6.244 17.873 1.00 70.14 C ATOM 535 O ASN A 33 -2.416 -7.346 18.407 1.00 21.43 O ATOM 536 CB ASN A 33 -4.402 -4.921 19.077 1.00 25.41 C ATOM 537 CG ASN A 33 -4.858 -6.100 19.921 1.00 51.21 C ATOM 538 OD1 ASN A 33 -5.317 -7.107 19.403 1.00 11.53 O ATOM 539 ND2 ASN A 33 -4.731 -5.979 21.216 1.00 40.32 N ATOM 0 H ASN A 33 -3.317 -3.293 17.488 1.00 44.15 H new ATOM 0 HA ASN A 33 -2.319 -5.036 19.604 1.00 73.41 H new ATOM 0 HB2 ASN A 33 -4.590 -3.998 19.625 1.00 25.41 H new ATOM 0 HB3 ASN A 33 -5.003 -4.880 18.169 1.00 25.41 H new ATOM 0 HD21 ASN A 33 -5.019 -6.741 21.830 1.00 40.32 H new ATOM 0 HD22 ASN A 33 -4.343 -5.123 21.613 1.00 40.32 H new ATOM 546 N CYS A 34 -2.496 -6.061 16.602 1.00 25.55 N ATOM 547 CA CYS A 34 -2.159 -7.108 15.671 1.00 40.13 C ATOM 548 C CYS A 34 -0.993 -6.675 14.861 1.00 73.31 C ATOM 549 O CYS A 34 -0.685 -5.497 14.839 1.00 33.45 O ATOM 550 CB CYS A 34 -3.350 -7.481 14.781 1.00 32.14 C ATOM 551 SG CYS A 34 -4.631 -8.454 15.644 1.00 42.21 S ATOM 0 H CYS A 34 -2.651 -5.156 16.158 1.00 25.55 H new ATOM 0 HA CYS A 34 -1.898 -8.007 16.228 1.00 40.13 H new ATOM 0 HB2 CYS A 34 -3.800 -6.569 14.390 1.00 32.14 H new ATOM 0 HB3 CYS A 34 -2.989 -8.050 13.925 1.00 32.14 H new ATOM 556 N ALA A 35 -0.318 -7.614 14.232 1.00 72.22 N ATOM 557 CA ALA A 35 0.836 -7.317 13.400 1.00 33.14 C ATOM 558 C ALA A 35 0.406 -6.521 12.150 1.00 41.40 C ATOM 559 O ALA A 35 -0.618 -5.845 12.140 1.00 0.11 O ATOM 560 CB ALA A 35 1.509 -8.627 13.000 1.00 72.40 C ATOM 0 H ALA A 35 -0.551 -8.606 14.281 1.00 72.22 H new ATOM 0 HA ALA A 35 1.543 -6.705 13.959 1.00 33.14 H new ATOM 0 HB1 ALA A 35 2.376 -8.414 12.375 1.00 72.40 H new ATOM 0 HB2 ALA A 35 1.829 -9.160 13.895 1.00 72.40 H new ATOM 0 HB3 ALA A 35 0.803 -9.243 12.443 1.00 72.40 H new ATOM 566 N CYS A 36 1.187 -6.567 11.127 1.00 71.54 N ATOM 567 CA CYS A 36 0.818 -5.885 9.929 1.00 32.23 C ATOM 568 C CYS A 36 -0.099 -6.807 9.131 1.00 31.33 C ATOM 569 O CYS A 36 -0.007 -8.030 9.250 1.00 44.31 O ATOM 570 CB CYS A 36 2.070 -5.501 9.119 1.00 34.05 C ATOM 571 SG CYS A 36 1.753 -4.441 7.671 1.00 74.11 S ATOM 0 H CYS A 36 2.077 -7.064 11.092 1.00 71.54 H new ATOM 0 HA CYS A 36 0.294 -4.958 10.162 1.00 32.23 H new ATOM 0 HB2 CYS A 36 2.769 -4.989 9.780 1.00 34.05 H new ATOM 0 HB3 CYS A 36 2.561 -6.414 8.782 1.00 34.05 H new ATOM 576 N GLN A 37 -1.011 -6.244 8.398 1.00 23.45 N ATOM 577 CA GLN A 37 -1.876 -7.012 7.543 1.00 12.12 C ATOM 578 C GLN A 37 -1.916 -6.377 6.206 1.00 1.32 C ATOM 579 O GLN A 37 -1.859 -5.169 6.102 1.00 4.13 O ATOM 580 CB GLN A 37 -3.332 -7.157 8.064 1.00 14.40 C ATOM 581 CG GLN A 37 -3.505 -7.944 9.351 1.00 4.41 C ATOM 582 CD GLN A 37 -3.583 -7.111 10.630 1.00 12.13 C ATOM 583 OE1 GLN A 37 -2.985 -5.955 10.650 1.00 42.01 O flip ATOM 584 NE2 GLN A 37 -4.226 -7.524 11.591 1.00 31.42 N flip ATOM 0 H GLN A 37 -1.180 -5.238 8.373 1.00 23.45 H new ATOM 0 HA GLN A 37 -1.456 -8.017 7.512 1.00 12.12 H new ATOM 0 HB2 GLN A 37 -3.744 -6.159 8.214 1.00 14.40 H new ATOM 0 HB3 GLN A 37 -3.929 -7.635 7.287 1.00 14.40 H new ATOM 0 HG2 GLN A 37 -4.414 -8.541 9.271 1.00 4.41 H new ATOM 0 HG3 GLN A 37 -2.673 -8.642 9.444 1.00 4.41 H new ATOM 0 HE21 GLN A 37 -4.684 -8.434 11.545 1.00 31.42 H new ATOM 0 HE22 GLN A 37 -4.303 -6.957 12.435 1.00 31.42 H new ATOM 593 N ILE A 38 -1.972 -7.165 5.195 1.00 32.32 N ATOM 594 CA ILE A 38 -2.108 -6.651 3.875 1.00 43.21 C ATOM 595 C ILE A 38 -3.312 -7.298 3.239 1.00 2.41 C ATOM 596 O ILE A 38 -3.513 -8.475 3.380 1.00 11.14 O ATOM 597 CB ILE A 38 -0.834 -6.897 3.018 1.00 24.24 C ATOM 598 CG1 ILE A 38 0.372 -6.191 3.656 1.00 72.11 C ATOM 599 CG2 ILE A 38 -1.043 -6.405 1.598 1.00 53.22 C ATOM 600 CD1 ILE A 38 1.671 -6.361 2.898 1.00 3.23 C ATOM 0 H ILE A 38 -1.925 -8.182 5.255 1.00 32.32 H new ATOM 0 HA ILE A 38 -2.240 -5.570 3.927 1.00 43.21 H new ATOM 0 HB ILE A 38 -0.638 -7.969 2.983 1.00 24.24 H new ATOM 0 HG12 ILE A 38 0.152 -5.127 3.740 1.00 72.11 H new ATOM 0 HG13 ILE A 38 0.505 -6.570 4.669 1.00 72.11 H new ATOM 0 HG21 ILE A 38 -0.141 -6.586 1.014 1.00 53.22 H new ATOM 0 HG22 ILE A 38 -1.880 -6.939 1.148 1.00 53.22 H new ATOM 0 HG23 ILE A 38 -1.259 -5.337 1.611 1.00 53.22 H new ATOM 0 HD11 ILE A 38 2.468 -5.831 3.419 1.00 3.23 H new ATOM 0 HD12 ILE A 38 1.920 -7.420 2.836 1.00 3.23 H new ATOM 0 HD13 ILE A 38 1.561 -5.955 1.893 1.00 3.23 H new ATOM 612 N VAL A 39 -4.133 -6.530 2.603 1.00 25.30 N ATOM 613 CA VAL A 39 -5.284 -7.077 1.935 1.00 45.42 C ATOM 614 C VAL A 39 -5.081 -6.956 0.442 1.00 44.52 C ATOM 615 O VAL A 39 -4.818 -5.867 -0.068 1.00 0.24 O ATOM 616 CB VAL A 39 -6.594 -6.340 2.346 1.00 23.23 C ATOM 617 CG1 VAL A 39 -7.805 -6.950 1.656 1.00 33.21 C ATOM 618 CG2 VAL A 39 -6.779 -6.359 3.860 1.00 21.04 C ATOM 0 H VAL A 39 -4.034 -5.518 2.527 1.00 25.30 H new ATOM 0 HA VAL A 39 -5.389 -8.122 2.226 1.00 45.42 H new ATOM 0 HB VAL A 39 -6.504 -5.303 2.024 1.00 23.23 H new ATOM 0 HG11 VAL A 39 -8.705 -6.416 1.961 1.00 33.21 H new ATOM 0 HG12 VAL A 39 -7.686 -6.872 0.575 1.00 33.21 H new ATOM 0 HG13 VAL A 39 -7.893 -8.000 1.936 1.00 33.21 H new ATOM 0 HG21 VAL A 39 -7.700 -5.838 4.121 1.00 21.04 H new ATOM 0 HG22 VAL A 39 -6.835 -7.391 4.207 1.00 21.04 H new ATOM 0 HG23 VAL A 39 -5.934 -5.862 4.336 1.00 21.04 H new ATOM 628 N ALA A 40 -5.207 -8.047 -0.245 1.00 71.22 N ATOM 629 CA ALA A 40 -5.021 -8.076 -1.661 1.00 75.04 C ATOM 630 C ALA A 40 -6.324 -8.365 -2.323 1.00 52.24 C ATOM 631 O ALA A 40 -7.027 -9.306 -1.946 1.00 64.01 O ATOM 632 CB ALA A 40 -4.010 -9.134 -2.046 1.00 52.34 C ATOM 0 H ALA A 40 -5.444 -8.951 0.165 1.00 71.22 H new ATOM 0 HA ALA A 40 -4.647 -7.105 -1.986 1.00 75.04 H new ATOM 0 HB1 ALA A 40 -3.883 -9.139 -3.129 1.00 52.34 H new ATOM 0 HB2 ALA A 40 -3.054 -8.914 -1.570 1.00 52.34 H new ATOM 0 HB3 ALA A 40 -4.363 -10.111 -1.717 1.00 52.34 H new ATOM 638 N ARG A 41 -6.672 -7.580 -3.289 1.00 71.43 N ATOM 639 CA ARG A 41 -7.897 -7.821 -3.967 1.00 1.12 C ATOM 640 C ARG A 41 -7.623 -8.587 -5.231 1.00 71.22 C ATOM 641 O ARG A 41 -6.913 -8.100 -6.140 1.00 14.10 O ATOM 642 CB ARG A 41 -8.676 -6.543 -4.244 1.00 32.04 C ATOM 643 CG ARG A 41 -10.077 -6.810 -4.776 1.00 55.41 C ATOM 644 CD ARG A 41 -10.849 -5.529 -4.979 1.00 63.31 C ATOM 645 NE ARG A 41 -12.231 -5.784 -5.384 1.00 1.55 N ATOM 646 CZ ARG A 41 -13.228 -4.897 -5.298 1.00 4.31 C ATOM 647 NH1 ARG A 41 -12.993 -3.654 -4.869 1.00 30.44 N ATOM 648 NH2 ARG A 41 -14.452 -5.253 -5.652 1.00 4.24 N ATOM 0 H ARG A 41 -6.134 -6.779 -3.621 1.00 71.43 H new ATOM 0 HA ARG A 41 -8.534 -8.418 -3.315 1.00 1.12 H new ATOM 0 HB2 ARG A 41 -8.746 -5.959 -3.326 1.00 32.04 H new ATOM 0 HB3 ARG A 41 -8.127 -5.938 -4.966 1.00 32.04 H new ATOM 0 HG2 ARG A 41 -10.011 -7.349 -5.721 1.00 55.41 H new ATOM 0 HG3 ARG A 41 -10.615 -7.453 -4.079 1.00 55.41 H new ATOM 0 HD2 ARG A 41 -10.842 -4.951 -4.055 1.00 63.31 H new ATOM 0 HD3 ARG A 41 -10.354 -4.923 -5.738 1.00 63.31 H new ATOM 0 HE ARG A 41 -12.451 -6.706 -5.760 1.00 1.55 H new ATOM 0 HH11 ARG A 41 -12.048 -3.376 -4.604 1.00 30.44 H new ATOM 0 HH12 ARG A 41 -13.759 -2.983 -4.806 1.00 30.44 H new ATOM 0 HH21 ARG A 41 -14.631 -6.199 -5.988 1.00 4.24 H new ATOM 0 HH22 ARG A 41 -15.217 -4.581 -5.589 1.00 4.24 H new ATOM 662 N LEU A 42 -8.140 -9.782 -5.246 1.00 31.21 N ATOM 663 CA LEU A 42 -8.024 -10.719 -6.334 1.00 74.34 C ATOM 664 C LEU A 42 -8.653 -10.151 -7.601 1.00 73.22 C ATOM 665 O LEU A 42 -9.706 -9.510 -7.548 1.00 35.11 O ATOM 666 CB LEU A 42 -8.723 -12.016 -5.920 1.00 3.51 C ATOM 667 CG LEU A 42 -8.168 -12.697 -4.656 1.00 1.14 C ATOM 668 CD1 LEU A 42 -9.016 -13.896 -4.265 1.00 31.33 C ATOM 669 CD2 LEU A 42 -6.716 -13.113 -4.855 1.00 12.23 C ATOM 0 H LEU A 42 -8.681 -10.150 -4.463 1.00 31.21 H new ATOM 0 HA LEU A 42 -6.973 -10.913 -6.549 1.00 74.34 H new ATOM 0 HB2 LEU A 42 -9.780 -11.803 -5.762 1.00 3.51 H new ATOM 0 HB3 LEU A 42 -8.660 -12.722 -6.748 1.00 3.51 H new ATOM 0 HG LEU A 42 -8.208 -11.972 -3.843 1.00 1.14 H new ATOM 0 HD11 LEU A 42 -8.601 -14.358 -3.369 1.00 31.33 H new ATOM 0 HD12 LEU A 42 -10.037 -13.570 -4.066 1.00 31.33 H new ATOM 0 HD13 LEU A 42 -9.019 -14.621 -5.079 1.00 31.33 H new ATOM 0 HD21 LEU A 42 -6.347 -13.592 -3.948 1.00 12.23 H new ATOM 0 HD22 LEU A 42 -6.649 -13.813 -5.688 1.00 12.23 H new ATOM 0 HD23 LEU A 42 -6.112 -12.232 -5.072 1.00 12.23 H new ATOM 681 N LYS A 43 -7.988 -10.375 -8.719 1.00 43.15 N ATOM 682 CA LYS A 43 -8.437 -9.907 -10.016 1.00 41.15 C ATOM 683 C LYS A 43 -9.820 -10.410 -10.375 1.00 43.41 C ATOM 684 O LYS A 43 -10.779 -9.648 -10.375 1.00 44.02 O ATOM 685 CB LYS A 43 -7.438 -10.298 -11.107 1.00 42.01 C ATOM 686 CG LYS A 43 -6.116 -9.541 -11.060 1.00 44.02 C ATOM 687 CD LYS A 43 -5.132 -10.051 -12.098 1.00 31.44 C ATOM 688 CE LYS A 43 -5.752 -10.089 -13.496 1.00 53.10 C ATOM 689 NZ LYS A 43 -4.821 -10.577 -14.525 1.00 70.33 N ATOM 0 H LYS A 43 -7.110 -10.893 -8.752 1.00 43.15 H new ATOM 0 HA LYS A 43 -8.496 -8.821 -9.950 1.00 41.15 H new ATOM 0 HB2 LYS A 43 -7.233 -11.366 -11.027 1.00 42.01 H new ATOM 0 HB3 LYS A 43 -7.901 -10.134 -12.080 1.00 42.01 H new ATOM 0 HG2 LYS A 43 -6.300 -8.479 -11.225 1.00 44.02 H new ATOM 0 HG3 LYS A 43 -5.678 -9.638 -10.067 1.00 44.02 H new ATOM 0 HD2 LYS A 43 -4.250 -9.411 -12.109 1.00 31.44 H new ATOM 0 HD3 LYS A 43 -4.797 -11.051 -11.821 1.00 31.44 H new ATOM 0 HE2 LYS A 43 -6.634 -10.729 -13.479 1.00 53.10 H new ATOM 0 HE3 LYS A 43 -6.090 -9.088 -13.765 1.00 53.10 H new ATOM 0 HZ1 LYS A 43 -5.316 -10.645 -15.437 1.00 70.33 H new ATOM 0 HZ2 LYS A 43 -4.023 -9.916 -14.613 1.00 70.33 H new ATOM 0 HZ3 LYS A 43 -4.465 -11.516 -14.254 1.00 70.33 H new ATOM 703 N ASN A 44 -9.918 -11.681 -10.666 1.00 3.12 N ATOM 704 CA ASN A 44 -11.171 -12.269 -11.130 1.00 61.33 C ATOM 705 C ASN A 44 -11.605 -13.399 -10.228 1.00 54.21 C ATOM 706 O ASN A 44 -12.456 -14.198 -10.587 1.00 2.12 O ATOM 707 CB ASN A 44 -11.007 -12.799 -12.575 1.00 23.03 C ATOM 708 CG ASN A 44 -9.982 -13.938 -12.715 1.00 70.15 C ATOM 709 OD1 ASN A 44 -8.994 -14.026 -11.963 1.00 51.41 O ATOM 710 ND2 ASN A 44 -10.202 -14.802 -13.669 1.00 65.20 N ATOM 0 H ASN A 44 -9.145 -12.342 -10.593 1.00 3.12 H new ATOM 0 HA ASN A 44 -11.935 -11.492 -11.109 1.00 61.33 H new ATOM 0 HB2 ASN A 44 -11.975 -13.150 -12.934 1.00 23.03 H new ATOM 0 HB3 ASN A 44 -10.707 -11.974 -13.221 1.00 23.03 H new ATOM 0 HD21 ASN A 44 -9.555 -15.577 -13.815 1.00 65.20 H new ATOM 0 HD22 ASN A 44 -11.021 -14.702 -14.269 1.00 65.20 H new ATOM 717 N ASN A 45 -11.067 -13.437 -9.038 1.00 23.31 N ATOM 718 CA ASN A 45 -11.352 -14.543 -8.143 1.00 12.05 C ATOM 719 C ASN A 45 -12.294 -14.117 -7.001 1.00 31.04 C ATOM 720 O ASN A 45 -12.111 -14.487 -5.843 1.00 74.03 O ATOM 721 CB ASN A 45 -10.046 -15.147 -7.620 1.00 70.31 C ATOM 722 CG ASN A 45 -10.229 -16.443 -6.825 1.00 54.10 C ATOM 723 OD1 ASN A 45 -9.453 -16.733 -5.910 1.00 13.43 O ATOM 724 ND2 ASN A 45 -11.219 -17.232 -7.175 1.00 44.11 N ATOM 0 H ASN A 45 -10.436 -12.728 -8.663 1.00 23.31 H new ATOM 0 HA ASN A 45 -11.878 -15.317 -8.703 1.00 12.05 H new ATOM 0 HB2 ASN A 45 -9.385 -15.342 -8.464 1.00 70.31 H new ATOM 0 HB3 ASN A 45 -9.547 -14.413 -6.987 1.00 70.31 H new ATOM 0 HD21 ASN A 45 -11.365 -18.115 -6.686 1.00 44.11 H new ATOM 0 HD22 ASN A 45 -11.842 -16.962 -7.936 1.00 44.11 H new ATOM 731 N ASN A 46 -13.311 -13.344 -7.360 1.00 33.41 N ATOM 732 CA ASN A 46 -14.405 -12.932 -6.443 1.00 14.11 C ATOM 733 C ASN A 46 -14.012 -11.960 -5.342 1.00 23.54 C ATOM 734 O ASN A 46 -14.418 -10.798 -5.351 1.00 0.45 O ATOM 735 CB ASN A 46 -15.133 -14.142 -5.772 1.00 43.14 C ATOM 736 CG ASN A 46 -15.937 -15.015 -6.707 1.00 31.00 C ATOM 737 OD1 ASN A 46 -17.122 -14.760 -6.942 1.00 23.55 O ATOM 738 ND2 ASN A 46 -15.340 -16.066 -7.199 1.00 73.11 N ATOM 0 H ASN A 46 -13.415 -12.973 -8.304 1.00 33.41 H new ATOM 0 HA ASN A 46 -15.077 -12.409 -7.124 1.00 14.11 H new ATOM 0 HB2 ASN A 46 -14.387 -14.762 -5.275 1.00 43.14 H new ATOM 0 HB3 ASN A 46 -15.798 -13.760 -4.997 1.00 43.14 H new ATOM 0 HD21 ASN A 46 -15.854 -16.710 -7.800 1.00 73.11 H new ATOM 0 HD22 ASN A 46 -14.359 -16.244 -6.982 1.00 73.11 H new ATOM 745 N ARG A 47 -13.210 -12.419 -4.415 1.00 2.13 N ATOM 746 CA ARG A 47 -13.060 -11.712 -3.171 1.00 54.45 C ATOM 747 C ARG A 47 -11.718 -11.036 -3.013 1.00 52.42 C ATOM 748 O ARG A 47 -10.894 -11.006 -3.924 1.00 33.52 O ATOM 749 CB ARG A 47 -13.238 -12.691 -2.021 1.00 35.45 C ATOM 750 CG ARG A 47 -12.055 -13.593 -1.751 1.00 4.12 C ATOM 751 CD ARG A 47 -12.367 -14.443 -0.579 1.00 61.21 C ATOM 752 NE ARG A 47 -11.173 -15.030 0.050 1.00 21.41 N ATOM 753 CZ ARG A 47 -11.148 -16.169 0.760 1.00 72.55 C ATOM 754 NH1 ARG A 47 -12.215 -16.958 0.784 1.00 54.32 N ATOM 755 NH2 ARG A 47 -10.049 -16.515 1.445 1.00 31.33 N ATOM 0 H ARG A 47 -12.656 -13.271 -4.497 1.00 2.13 H new ATOM 0 HA ARG A 47 -13.819 -10.929 -3.167 1.00 54.45 H new ATOM 0 HB2 ARG A 47 -13.457 -12.126 -1.115 1.00 35.45 H new ATOM 0 HB3 ARG A 47 -14.109 -13.313 -2.227 1.00 35.45 H new ATOM 0 HG2 ARG A 47 -11.845 -14.213 -2.623 1.00 4.12 H new ATOM 0 HG3 ARG A 47 -11.162 -12.998 -1.560 1.00 4.12 H new ATOM 0 HD2 ARG A 47 -12.903 -13.848 0.160 1.00 61.21 H new ATOM 0 HD3 ARG A 47 -13.037 -15.245 -0.889 1.00 61.21 H new ATOM 0 HE ARG A 47 -10.291 -14.530 -0.063 1.00 21.41 H new ATOM 0 HH11 ARG A 47 -13.053 -16.699 0.263 1.00 54.32 H new ATOM 0 HH12 ARG A 47 -12.197 -17.824 1.323 1.00 54.32 H new ATOM 0 HH21 ARG A 47 -9.227 -15.912 1.428 1.00 31.33 H new ATOM 0 HH22 ARG A 47 -10.035 -17.381 1.983 1.00 31.33 H new ATOM 769 N GLN A 48 -11.527 -10.475 -1.845 1.00 24.22 N ATOM 770 CA GLN A 48 -10.265 -9.970 -1.434 1.00 44.45 C ATOM 771 C GLN A 48 -9.713 -10.940 -0.398 1.00 0.34 C ATOM 772 O GLN A 48 -10.477 -11.510 0.397 1.00 3.04 O ATOM 773 CB GLN A 48 -10.391 -8.557 -0.839 1.00 42.53 C ATOM 774 CG GLN A 48 -11.329 -8.458 0.361 1.00 14.31 C ATOM 775 CD GLN A 48 -11.347 -7.078 0.984 1.00 13.12 C ATOM 776 OE1 GLN A 48 -11.139 -6.069 0.302 1.00 60.35 O ATOM 777 NE2 GLN A 48 -11.597 -7.018 2.270 1.00 71.41 N ATOM 0 H GLN A 48 -12.265 -10.360 -1.150 1.00 24.22 H new ATOM 0 HA GLN A 48 -9.595 -9.888 -2.290 1.00 44.45 H new ATOM 0 HB2 GLN A 48 -9.401 -8.213 -0.540 1.00 42.53 H new ATOM 0 HB3 GLN A 48 -10.743 -7.879 -1.616 1.00 42.53 H new ATOM 0 HG2 GLN A 48 -12.339 -8.723 0.049 1.00 14.31 H new ATOM 0 HG3 GLN A 48 -11.026 -9.187 1.113 1.00 14.31 H new ATOM 0 HE21 GLN A 48 -11.763 -7.875 2.798 1.00 71.41 H new ATOM 0 HE22 GLN A 48 -11.625 -6.114 2.742 1.00 71.41 H new ATOM 786 N VAL A 49 -8.446 -11.166 -0.426 1.00 53.23 N ATOM 787 CA VAL A 49 -7.816 -12.038 0.536 1.00 1.42 C ATOM 788 C VAL A 49 -6.858 -11.249 1.381 1.00 35.42 C ATOM 789 O VAL A 49 -6.370 -10.195 0.959 1.00 5.12 O ATOM 790 CB VAL A 49 -7.102 -13.289 -0.107 1.00 35.14 C ATOM 791 CG1 VAL A 49 -8.107 -14.235 -0.710 1.00 21.21 C ATOM 792 CG2 VAL A 49 -6.087 -12.897 -1.165 1.00 44.01 C ATOM 0 H VAL A 49 -7.808 -10.759 -1.110 1.00 53.23 H new ATOM 0 HA VAL A 49 -8.612 -12.448 1.158 1.00 1.42 H new ATOM 0 HB VAL A 49 -6.571 -13.787 0.705 1.00 35.14 H new ATOM 0 HG11 VAL A 49 -7.587 -15.088 -1.146 1.00 21.21 H new ATOM 0 HG12 VAL A 49 -8.790 -14.583 0.065 1.00 21.21 H new ATOM 0 HG13 VAL A 49 -8.672 -13.719 -1.486 1.00 21.21 H new ATOM 0 HG21 VAL A 49 -5.624 -13.794 -1.576 1.00 44.01 H new ATOM 0 HG22 VAL A 49 -6.587 -12.349 -1.963 1.00 44.01 H new ATOM 0 HG23 VAL A 49 -5.320 -12.266 -0.717 1.00 44.01 H new ATOM 802 N CYS A 50 -6.582 -11.728 2.540 1.00 70.42 N ATOM 803 CA CYS A 50 -5.670 -11.053 3.406 1.00 75.14 C ATOM 804 C CYS A 50 -4.377 -11.778 3.326 1.00 44.31 C ATOM 805 O CYS A 50 -4.335 -12.974 3.413 1.00 64.23 O ATOM 806 CB CYS A 50 -6.195 -11.000 4.847 1.00 12.41 C ATOM 807 SG CYS A 50 -7.735 -10.036 5.049 1.00 50.13 S ATOM 0 H CYS A 50 -6.975 -12.590 2.917 1.00 70.42 H new ATOM 0 HA CYS A 50 -5.547 -10.016 3.094 1.00 75.14 H new ATOM 0 HB2 CYS A 50 -6.368 -12.018 5.196 1.00 12.41 H new ATOM 0 HB3 CYS A 50 -5.424 -10.570 5.487 1.00 12.41 H new ATOM 812 N ILE A 51 -3.346 -11.056 3.117 1.00 34.51 N ATOM 813 CA ILE A 51 -2.067 -11.606 2.860 1.00 62.35 C ATOM 814 C ILE A 51 -1.182 -11.430 4.065 1.00 64.51 C ATOM 815 O ILE A 51 -1.276 -10.413 4.780 1.00 64.43 O ATOM 816 CB ILE A 51 -1.404 -10.866 1.661 1.00 60.15 C ATOM 817 CG1 ILE A 51 -2.317 -10.847 0.445 1.00 52.24 C ATOM 818 CG2 ILE A 51 -0.090 -11.507 1.289 1.00 42.21 C ATOM 819 CD1 ILE A 51 -2.679 -12.210 -0.086 1.00 23.33 C ATOM 0 H ILE A 51 -3.365 -10.036 3.119 1.00 34.51 H new ATOM 0 HA ILE A 51 -2.186 -12.665 2.631 1.00 62.35 H new ATOM 0 HB ILE A 51 -1.225 -9.839 1.980 1.00 60.15 H new ATOM 0 HG12 ILE A 51 -3.233 -10.316 0.703 1.00 52.24 H new ATOM 0 HG13 ILE A 51 -1.832 -10.279 -0.349 1.00 52.24 H new ATOM 0 HG21 ILE A 51 0.352 -10.971 0.449 1.00 42.21 H new ATOM 0 HG22 ILE A 51 0.588 -11.468 2.141 1.00 42.21 H new ATOM 0 HG23 ILE A 51 -0.259 -12.546 1.007 1.00 42.21 H new ATOM 0 HD11 ILE A 51 -3.332 -12.101 -0.952 1.00 23.33 H new ATOM 0 HD12 ILE A 51 -1.772 -12.739 -0.379 1.00 23.33 H new ATOM 0 HD13 ILE A 51 -3.195 -12.777 0.689 1.00 23.33 H new ATOM 831 N ASP A 52 -0.358 -12.415 4.301 1.00 35.01 N ATOM 832 CA ASP A 52 0.657 -12.329 5.318 1.00 11.30 C ATOM 833 C ASP A 52 1.732 -11.368 4.828 1.00 12.01 C ATOM 834 O ASP A 52 2.295 -11.560 3.749 1.00 24.21 O ATOM 835 CB ASP A 52 1.257 -13.705 5.596 1.00 30.13 C ATOM 836 CG ASP A 52 2.342 -13.671 6.644 1.00 65.11 C ATOM 837 OD1 ASP A 52 2.024 -13.572 7.847 1.00 41.35 O ATOM 838 OD2 ASP A 52 3.521 -13.777 6.285 1.00 62.13 O ATOM 0 H ASP A 52 -0.371 -13.300 3.794 1.00 35.01 H new ATOM 0 HA ASP A 52 0.223 -11.966 6.250 1.00 11.30 H new ATOM 0 HB2 ASP A 52 0.467 -14.382 5.920 1.00 30.13 H new ATOM 0 HB3 ASP A 52 1.665 -14.112 4.671 1.00 30.13 H new ATOM 843 N PRO A 53 2.028 -10.325 5.598 1.00 33.24 N ATOM 844 CA PRO A 53 2.965 -9.268 5.184 1.00 63.25 C ATOM 845 C PRO A 53 4.418 -9.684 5.319 1.00 41.05 C ATOM 846 O PRO A 53 5.314 -8.888 5.120 1.00 43.40 O ATOM 847 CB PRO A 53 2.660 -8.161 6.175 1.00 34.02 C ATOM 848 CG PRO A 53 2.273 -8.883 7.410 1.00 71.02 C ATOM 849 CD PRO A 53 1.489 -10.077 6.950 1.00 44.52 C ATOM 0 HA PRO A 53 2.842 -8.999 4.135 1.00 63.25 H new ATOM 0 HB2 PRO A 53 3.528 -7.523 6.341 1.00 34.02 H new ATOM 0 HB3 PRO A 53 1.855 -7.518 5.820 1.00 34.02 H new ATOM 0 HG2 PRO A 53 3.152 -9.187 7.978 1.00 71.02 H new ATOM 0 HG3 PRO A 53 1.674 -8.249 8.064 1.00 71.02 H new ATOM 0 HD2 PRO A 53 1.636 -10.934 7.607 1.00 44.52 H new ATOM 0 HD3 PRO A 53 0.419 -9.873 6.927 1.00 44.52 H new ATOM 857 N LYS A 54 4.630 -10.921 5.680 1.00 64.11 N ATOM 858 CA LYS A 54 5.935 -11.448 5.864 1.00 64.32 C ATOM 859 C LYS A 54 6.259 -12.419 4.712 1.00 34.14 C ATOM 860 O LYS A 54 7.273 -13.133 4.734 1.00 15.23 O ATOM 861 CB LYS A 54 5.952 -12.154 7.210 1.00 61.04 C ATOM 862 CG LYS A 54 5.584 -11.247 8.392 1.00 30.21 C ATOM 863 CD LYS A 54 5.432 -12.045 9.680 1.00 2.24 C ATOM 864 CE LYS A 54 6.733 -12.686 10.117 1.00 3.14 C ATOM 865 NZ LYS A 54 7.739 -11.685 10.565 1.00 43.51 N ATOM 0 H LYS A 54 3.883 -11.593 5.855 1.00 64.11 H new ATOM 0 HA LYS A 54 6.692 -10.664 5.855 1.00 64.32 H new ATOM 0 HB2 LYS A 54 5.257 -12.993 7.178 1.00 61.04 H new ATOM 0 HB3 LYS A 54 6.945 -12.569 7.379 1.00 61.04 H new ATOM 0 HG2 LYS A 54 6.354 -10.487 8.522 1.00 30.21 H new ATOM 0 HG3 LYS A 54 4.653 -10.724 8.175 1.00 30.21 H new ATOM 0 HD2 LYS A 54 5.070 -11.388 10.471 1.00 2.24 H new ATOM 0 HD3 LYS A 54 4.678 -12.819 9.538 1.00 2.24 H new ATOM 0 HE2 LYS A 54 6.535 -13.386 10.929 1.00 3.14 H new ATOM 0 HE3 LYS A 54 7.145 -13.265 9.290 1.00 3.14 H new ATOM 0 HZ1 LYS A 54 8.613 -11.799 10.012 1.00 43.51 H new ATOM 0 HZ2 LYS A 54 7.362 -10.726 10.422 1.00 43.51 H new ATOM 0 HZ3 LYS A 54 7.946 -11.829 11.574 1.00 43.51 H new ATOM 879 N LEU A 55 5.380 -12.443 3.720 1.00 33.40 N ATOM 880 CA LEU A 55 5.548 -13.261 2.525 1.00 21.43 C ATOM 881 C LEU A 55 6.659 -12.791 1.626 1.00 51.43 C ATOM 882 O LEU A 55 6.820 -11.614 1.399 1.00 0.25 O ATOM 883 CB LEU A 55 4.253 -13.355 1.742 1.00 35.14 C ATOM 884 CG LEU A 55 3.277 -14.394 2.229 1.00 30.43 C ATOM 885 CD1 LEU A 55 1.955 -14.221 1.535 1.00 2.03 C ATOM 886 CD2 LEU A 55 3.831 -15.750 1.893 1.00 41.14 C ATOM 0 H LEU A 55 4.522 -11.891 3.721 1.00 33.40 H new ATOM 0 HA LEU A 55 5.830 -14.251 2.884 1.00 21.43 H new ATOM 0 HB2 LEU A 55 3.763 -12.382 1.765 1.00 35.14 H new ATOM 0 HB3 LEU A 55 4.493 -13.567 0.700 1.00 35.14 H new ATOM 0 HG LEU A 55 3.131 -14.290 3.304 1.00 30.43 H new ATOM 0 HD11 LEU A 55 1.255 -14.976 1.893 1.00 2.03 H new ATOM 0 HD12 LEU A 55 1.559 -13.228 1.749 1.00 2.03 H new ATOM 0 HD13 LEU A 55 2.091 -14.333 0.459 1.00 2.03 H new ATOM 0 HD21 LEU A 55 3.141 -16.520 2.236 1.00 41.14 H new ATOM 0 HD22 LEU A 55 3.960 -15.833 0.814 1.00 41.14 H new ATOM 0 HD23 LEU A 55 4.795 -15.881 2.385 1.00 41.14 H new ATOM 898 N LYS A 56 7.394 -13.757 1.085 1.00 4.30 N ATOM 899 CA LYS A 56 8.533 -13.525 0.203 1.00 54.42 C ATOM 900 C LYS A 56 8.227 -12.538 -0.931 1.00 14.21 C ATOM 901 O LYS A 56 8.933 -11.549 -1.086 1.00 31.41 O ATOM 902 CB LYS A 56 9.060 -14.864 -0.352 1.00 22.44 C ATOM 903 CG LYS A 56 10.239 -14.739 -1.315 1.00 62.43 C ATOM 904 CD LYS A 56 11.407 -14.000 -0.680 1.00 32.30 C ATOM 905 CE LYS A 56 12.575 -13.902 -1.634 1.00 63.31 C ATOM 906 NZ LYS A 56 13.679 -13.103 -1.062 1.00 4.44 N ATOM 0 H LYS A 56 7.210 -14.746 1.251 1.00 4.30 H new ATOM 0 HA LYS A 56 9.311 -13.057 0.806 1.00 54.42 H new ATOM 0 HB2 LYS A 56 9.358 -15.496 0.485 1.00 22.44 H new ATOM 0 HB3 LYS A 56 8.244 -15.376 -0.863 1.00 22.44 H new ATOM 0 HG2 LYS A 56 10.562 -15.733 -1.626 1.00 62.43 H new ATOM 0 HG3 LYS A 56 9.920 -14.212 -2.214 1.00 62.43 H new ATOM 0 HD2 LYS A 56 11.090 -13.000 -0.384 1.00 32.30 H new ATOM 0 HD3 LYS A 56 11.718 -14.517 0.228 1.00 32.30 H new ATOM 0 HE2 LYS A 56 12.935 -14.903 -1.873 1.00 63.31 H new ATOM 0 HE3 LYS A 56 12.245 -13.450 -2.569 1.00 63.31 H new ATOM 0 HZ1 LYS A 56 14.549 -13.275 -1.604 1.00 4.44 H new ATOM 0 HZ2 LYS A 56 13.436 -12.093 -1.108 1.00 4.44 H new ATOM 0 HZ3 LYS A 56 13.829 -13.378 -0.070 1.00 4.44 H new ATOM 920 N TRP A 57 7.170 -12.789 -1.698 1.00 53.40 N ATOM 921 CA TRP A 57 6.847 -11.892 -2.800 1.00 30.31 C ATOM 922 C TRP A 57 6.396 -10.525 -2.300 1.00 24.11 C ATOM 923 O TRP A 57 6.555 -9.525 -2.989 1.00 63.02 O ATOM 924 CB TRP A 57 5.862 -12.493 -3.824 1.00 52.33 C ATOM 925 CG TRP A 57 4.496 -12.842 -3.318 1.00 33.53 C ATOM 926 CD1 TRP A 57 4.090 -14.013 -2.737 1.00 43.14 C ATOM 927 CD2 TRP A 57 3.334 -12.012 -3.392 1.00 20.44 C ATOM 928 NE1 TRP A 57 2.753 -13.950 -2.471 1.00 11.32 N ATOM 929 CE2 TRP A 57 2.269 -12.741 -2.854 1.00 2.10 C ATOM 930 CE3 TRP A 57 3.093 -10.720 -3.868 1.00 12.43 C ATOM 931 CZ2 TRP A 57 0.984 -12.233 -2.774 1.00 45.42 C ATOM 932 CZ3 TRP A 57 1.815 -10.214 -3.790 1.00 42.50 C ATOM 933 CH2 TRP A 57 0.776 -10.972 -3.248 1.00 3.12 C ATOM 0 H TRP A 57 6.539 -13.582 -1.582 1.00 53.40 H new ATOM 0 HA TRP A 57 7.778 -11.751 -3.349 1.00 30.31 H new ATOM 0 HB2 TRP A 57 5.750 -11.785 -4.645 1.00 52.33 H new ATOM 0 HB3 TRP A 57 6.312 -13.395 -4.240 1.00 52.33 H new ATOM 0 HD1 TRP A 57 4.729 -14.857 -2.522 1.00 43.14 H new ATOM 0 HE1 TRP A 57 2.202 -14.697 -2.049 1.00 11.32 H new ATOM 0 HE3 TRP A 57 3.894 -10.130 -4.289 1.00 12.43 H new ATOM 0 HZ2 TRP A 57 0.177 -12.814 -2.352 1.00 45.42 H new ATOM 0 HZ3 TRP A 57 1.614 -9.217 -4.153 1.00 42.50 H new ATOM 0 HH2 TRP A 57 -0.217 -10.549 -3.203 1.00 3.12 H new ATOM 944 N ILE A 58 5.840 -10.497 -1.098 1.00 0.32 N ATOM 945 CA ILE A 58 5.459 -9.260 -0.451 1.00 63.23 C ATOM 946 C ILE A 58 6.709 -8.463 -0.099 1.00 11.24 C ATOM 947 O ILE A 58 6.783 -7.274 -0.395 1.00 33.43 O ATOM 948 CB ILE A 58 4.591 -9.513 0.822 1.00 31.11 C ATOM 949 CG1 ILE A 58 3.203 -10.068 0.443 1.00 63.00 C ATOM 950 CG2 ILE A 58 4.460 -8.252 1.671 1.00 33.32 C ATOM 951 CD1 ILE A 58 2.357 -9.107 -0.359 1.00 22.12 C ATOM 0 H ILE A 58 5.642 -11.333 -0.548 1.00 0.32 H new ATOM 0 HA ILE A 58 4.846 -8.687 -1.147 1.00 63.23 H new ATOM 0 HB ILE A 58 5.104 -10.263 1.424 1.00 31.11 H new ATOM 0 HG12 ILE A 58 3.334 -10.986 -0.130 1.00 63.00 H new ATOM 0 HG13 ILE A 58 2.668 -10.334 1.355 1.00 63.00 H new ATOM 0 HG21 ILE A 58 3.849 -8.466 2.548 1.00 33.32 H new ATOM 0 HG22 ILE A 58 5.449 -7.923 1.989 1.00 33.32 H new ATOM 0 HG23 ILE A 58 3.987 -7.465 1.083 1.00 33.32 H new ATOM 0 HD11 ILE A 58 1.397 -9.570 -0.586 1.00 22.12 H new ATOM 0 HD12 ILE A 58 2.193 -8.197 0.218 1.00 22.12 H new ATOM 0 HD13 ILE A 58 2.870 -8.859 -1.289 1.00 22.12 H new ATOM 963 N GLN A 59 7.694 -9.136 0.511 1.00 72.24 N ATOM 964 CA GLN A 59 8.971 -8.517 0.877 1.00 4.50 C ATOM 965 C GLN A 59 9.591 -7.844 -0.326 1.00 34.42 C ATOM 966 O GLN A 59 9.926 -6.666 -0.290 1.00 11.54 O ATOM 967 CB GLN A 59 9.972 -9.577 1.360 1.00 10.33 C ATOM 968 CG GLN A 59 9.466 -10.514 2.425 1.00 53.13 C ATOM 969 CD GLN A 59 8.870 -9.796 3.584 1.00 2.25 C ATOM 970 OE1 GLN A 59 9.676 -9.441 4.505 1.00 23.53 O flip ATOM 971 NE2 GLN A 59 7.693 -9.539 3.619 1.00 21.25 N flip ATOM 0 H GLN A 59 7.627 -10.122 0.763 1.00 72.24 H new ATOM 0 HA GLN A 59 8.765 -7.795 1.668 1.00 4.50 H new ATOM 0 HB2 GLN A 59 10.289 -10.169 0.501 1.00 10.33 H new ATOM 0 HB3 GLN A 59 10.857 -9.068 1.740 1.00 10.33 H new ATOM 0 HG2 GLN A 59 8.720 -11.180 1.992 1.00 53.13 H new ATOM 0 HG3 GLN A 59 10.288 -11.139 2.774 1.00 53.13 H new ATOM 0 HE21 GLN A 59 7.082 -9.842 2.860 1.00 21.25 H new ATOM 0 HE22 GLN A 59 7.308 -9.018 4.407 1.00 21.25 H new ATOM 980 N GLU A 60 9.690 -8.598 -1.413 1.00 3.24 N ATOM 981 CA GLU A 60 10.309 -8.114 -2.637 1.00 51.43 C ATOM 982 C GLU A 60 9.486 -6.968 -3.222 1.00 4.23 C ATOM 983 O GLU A 60 10.031 -6.044 -3.838 1.00 11.14 O ATOM 984 CB GLU A 60 10.404 -9.236 -3.674 1.00 71.30 C ATOM 985 CG GLU A 60 11.058 -10.526 -3.182 1.00 11.53 C ATOM 986 CD GLU A 60 12.442 -10.341 -2.625 1.00 55.23 C ATOM 987 OE1 GLU A 60 13.360 -9.986 -3.387 1.00 63.41 O ATOM 988 OE2 GLU A 60 12.647 -10.607 -1.428 1.00 42.44 O ATOM 0 H GLU A 60 9.345 -9.556 -1.470 1.00 3.24 H new ATOM 0 HA GLU A 60 11.312 -7.763 -2.394 1.00 51.43 H new ATOM 0 HB2 GLU A 60 9.399 -9.469 -4.026 1.00 71.30 H new ATOM 0 HB3 GLU A 60 10.965 -8.868 -4.533 1.00 71.30 H new ATOM 0 HG2 GLU A 60 10.426 -10.971 -2.414 1.00 11.53 H new ATOM 0 HG3 GLU A 60 11.103 -11.236 -4.008 1.00 11.53 H new ATOM 995 N TYR A 61 8.175 -7.025 -3.016 1.00 71.11 N ATOM 996 CA TYR A 61 7.293 -6.012 -3.527 1.00 20.11 C ATOM 997 C TYR A 61 7.493 -4.717 -2.744 1.00 2.15 C ATOM 998 O TYR A 61 7.602 -3.624 -3.332 1.00 53.15 O ATOM 999 CB TYR A 61 5.819 -6.457 -3.460 1.00 3.22 C ATOM 1000 CG TYR A 61 4.916 -5.533 -4.221 1.00 2.24 C ATOM 1001 CD1 TYR A 61 4.672 -5.763 -5.561 1.00 62.30 C ATOM 1002 CD2 TYR A 61 4.350 -4.412 -3.624 1.00 22.31 C ATOM 1003 CE1 TYR A 61 3.901 -4.910 -6.301 1.00 25.30 C ATOM 1004 CE2 TYR A 61 3.561 -3.553 -4.350 1.00 3.12 C ATOM 1005 CZ TYR A 61 3.343 -3.803 -5.694 1.00 42.43 C ATOM 1006 OH TYR A 61 2.609 -2.921 -6.441 1.00 53.45 O ATOM 0 H TYR A 61 7.710 -7.769 -2.496 1.00 71.11 H new ATOM 0 HA TYR A 61 7.537 -5.845 -4.576 1.00 20.11 H new ATOM 0 HB2 TYR A 61 5.727 -7.466 -3.862 1.00 3.22 H new ATOM 0 HB3 TYR A 61 5.500 -6.498 -2.418 1.00 3.22 H new ATOM 0 HD1 TYR A 61 5.099 -6.635 -6.034 1.00 62.30 H new ATOM 0 HD2 TYR A 61 4.533 -4.214 -2.578 1.00 22.31 H new ATOM 0 HE1 TYR A 61 3.730 -5.101 -7.350 1.00 25.30 H new ATOM 0 HE2 TYR A 61 3.115 -2.691 -3.877 1.00 3.12 H new ATOM 0 HH TYR A 61 1.698 -3.264 -6.551 1.00 53.45 H new ATOM 1016 N LEU A 62 7.550 -4.847 -1.426 1.00 11.44 N ATOM 1017 CA LEU A 62 7.790 -3.724 -0.542 1.00 64.42 C ATOM 1018 C LEU A 62 9.130 -3.114 -0.869 1.00 75.31 C ATOM 1019 O LEU A 62 9.231 -1.917 -1.122 1.00 1.42 O ATOM 1020 CB LEU A 62 7.761 -4.177 0.931 1.00 13.21 C ATOM 1021 CG LEU A 62 6.444 -4.793 1.430 1.00 62.15 C ATOM 1022 CD1 LEU A 62 6.587 -5.259 2.875 1.00 3.42 C ATOM 1023 CD2 LEU A 62 5.299 -3.796 1.316 1.00 70.50 C ATOM 0 H LEU A 62 7.430 -5.737 -0.943 1.00 11.44 H new ATOM 0 HA LEU A 62 7.004 -2.982 -0.686 1.00 64.42 H new ATOM 0 HB2 LEU A 62 8.557 -4.906 1.080 1.00 13.21 H new ATOM 0 HB3 LEU A 62 7.995 -3.317 1.558 1.00 13.21 H new ATOM 0 HG LEU A 62 6.216 -5.654 0.801 1.00 62.15 H new ATOM 0 HD11 LEU A 62 5.646 -5.692 3.212 1.00 3.42 H new ATOM 0 HD12 LEU A 62 7.375 -6.009 2.939 1.00 3.42 H new ATOM 0 HD13 LEU A 62 6.842 -4.409 3.508 1.00 3.42 H new ATOM 0 HD21 LEU A 62 4.379 -4.256 1.675 1.00 70.50 H new ATOM 0 HD22 LEU A 62 5.523 -2.915 1.917 1.00 70.50 H new ATOM 0 HD23 LEU A 62 5.175 -3.502 0.274 1.00 70.50 H new ATOM 1035 N GLU A 63 10.145 -3.963 -0.935 1.00 13.12 N ATOM 1036 CA GLU A 63 11.494 -3.543 -1.230 1.00 13.22 C ATOM 1037 C GLU A 63 11.637 -2.870 -2.605 1.00 13.40 C ATOM 1038 O GLU A 63 12.393 -1.910 -2.743 1.00 75.02 O ATOM 1039 CB GLU A 63 12.492 -4.696 -1.071 1.00 75.42 C ATOM 1040 CG GLU A 63 12.603 -5.229 0.354 1.00 63.11 C ATOM 1041 CD GLU A 63 13.773 -6.168 0.544 1.00 72.43 C ATOM 1042 OE1 GLU A 63 14.907 -5.683 0.737 1.00 31.35 O ATOM 1043 OE2 GLU A 63 13.593 -7.396 0.504 1.00 43.41 O ATOM 0 H GLU A 63 10.048 -4.967 -0.783 1.00 13.12 H new ATOM 0 HA GLU A 63 11.735 -2.779 -0.490 1.00 13.22 H new ATOM 0 HB2 GLU A 63 12.197 -5.512 -1.731 1.00 75.42 H new ATOM 0 HB3 GLU A 63 13.475 -4.360 -1.400 1.00 75.42 H new ATOM 0 HG2 GLU A 63 12.702 -4.390 1.043 1.00 63.11 H new ATOM 0 HG3 GLU A 63 11.681 -5.749 0.615 1.00 63.11 H new ATOM 1050 N LYS A 64 10.898 -3.345 -3.618 1.00 42.50 N ATOM 1051 CA LYS A 64 11.010 -2.729 -4.942 1.00 11.02 C ATOM 1052 C LYS A 64 10.402 -1.338 -4.945 1.00 11.43 C ATOM 1053 O LYS A 64 10.928 -0.438 -5.576 1.00 20.42 O ATOM 1054 CB LYS A 64 10.446 -3.634 -6.110 1.00 62.22 C ATOM 1055 CG LYS A 64 8.933 -3.848 -6.207 1.00 44.43 C ATOM 1056 CD LYS A 64 8.184 -2.632 -6.746 1.00 55.51 C ATOM 1057 CE LYS A 64 6.712 -2.918 -6.809 1.00 52.24 C ATOM 1058 NZ LYS A 64 5.898 -1.758 -7.296 1.00 70.14 N ATOM 0 H LYS A 64 10.242 -4.123 -3.550 1.00 42.50 H new ATOM 0 HA LYS A 64 12.075 -2.631 -5.151 1.00 11.02 H new ATOM 0 HB2 LYS A 64 10.780 -3.203 -7.054 1.00 62.22 H new ATOM 0 HB3 LYS A 64 10.914 -4.615 -6.024 1.00 62.22 H new ATOM 0 HG2 LYS A 64 8.735 -4.704 -6.853 1.00 44.43 H new ATOM 0 HG3 LYS A 64 8.544 -4.097 -5.220 1.00 44.43 H new ATOM 0 HD2 LYS A 64 8.367 -1.769 -6.106 1.00 55.51 H new ATOM 0 HD3 LYS A 64 8.555 -2.377 -7.739 1.00 55.51 H new ATOM 0 HE2 LYS A 64 6.544 -3.771 -7.466 1.00 52.24 H new ATOM 0 HE3 LYS A 64 6.363 -3.206 -5.817 1.00 52.24 H new ATOM 0 HZ1 LYS A 64 5.285 -1.417 -6.528 1.00 70.14 H new ATOM 0 HZ2 LYS A 64 6.532 -0.991 -7.599 1.00 70.14 H new ATOM 0 HZ3 LYS A 64 5.311 -2.059 -8.100 1.00 70.14 H new ATOM 1072 N CYS A 65 9.313 -1.167 -4.201 1.00 72.40 N ATOM 1073 CA CYS A 65 8.590 0.097 -4.168 1.00 23.32 C ATOM 1074 C CYS A 65 9.358 1.099 -3.316 1.00 75.41 C ATOM 1075 O CYS A 65 9.373 2.287 -3.598 1.00 75.52 O ATOM 1076 CB CYS A 65 7.167 -0.131 -3.621 1.00 21.53 C ATOM 1077 SG CYS A 65 6.041 1.296 -3.754 1.00 22.03 S ATOM 0 H CYS A 65 8.911 -1.894 -3.610 1.00 72.40 H new ATOM 0 HA CYS A 65 8.502 0.502 -5.176 1.00 23.32 H new ATOM 0 HB2 CYS A 65 6.723 -0.973 -4.151 1.00 21.53 H new ATOM 0 HB3 CYS A 65 7.241 -0.418 -2.572 1.00 21.53 H new ATOM 1082 N LEU A 66 10.032 0.565 -2.303 1.00 52.20 N ATOM 1083 CA LEU A 66 10.860 1.299 -1.381 1.00 24.23 C ATOM 1084 C LEU A 66 12.090 1.866 -2.138 1.00 25.24 C ATOM 1085 O LEU A 66 12.687 2.863 -1.735 1.00 53.04 O ATOM 1086 CB LEU A 66 11.259 0.271 -0.278 1.00 64.11 C ATOM 1087 CG LEU A 66 11.941 0.730 1.019 1.00 33.12 C ATOM 1088 CD1 LEU A 66 11.967 -0.431 1.992 1.00 44.51 C ATOM 1089 CD2 LEU A 66 13.357 1.216 0.786 1.00 22.10 C ATOM 0 H LEU A 66 10.008 -0.435 -2.102 1.00 52.20 H new ATOM 0 HA LEU A 66 10.355 2.155 -0.933 1.00 24.23 H new ATOM 0 HB2 LEU A 66 10.351 -0.259 0.009 1.00 64.11 H new ATOM 0 HB3 LEU A 66 11.920 -0.459 -0.745 1.00 64.11 H new ATOM 0 HG LEU A 66 11.370 1.568 1.420 1.00 33.12 H new ATOM 0 HD11 LEU A 66 12.449 -0.119 2.918 1.00 44.51 H new ATOM 0 HD12 LEU A 66 10.947 -0.751 2.204 1.00 44.51 H new ATOM 0 HD13 LEU A 66 12.524 -1.260 1.555 1.00 44.51 H new ATOM 0 HD21 LEU A 66 13.795 1.529 1.734 1.00 22.10 H new ATOM 0 HD22 LEU A 66 13.953 0.409 0.360 1.00 22.10 H new ATOM 0 HD23 LEU A 66 13.343 2.060 0.096 1.00 22.10 H new ATOM 1101 N ASN A 67 12.444 1.227 -3.238 1.00 2.52 N ATOM 1102 CA ASN A 67 13.588 1.659 -4.029 1.00 55.32 C ATOM 1103 C ASN A 67 13.128 2.559 -5.178 1.00 4.53 C ATOM 1104 O ASN A 67 13.233 3.790 -5.091 1.00 55.54 O ATOM 1105 CB ASN A 67 14.375 0.421 -4.569 1.00 25.14 C ATOM 1106 CG ASN A 67 15.727 0.716 -5.295 1.00 63.01 C ATOM 1107 OD1 ASN A 67 15.868 1.844 -5.967 1.00 74.54 O flip ATOM 1108 ND2 ASN A 67 16.641 -0.118 -5.255 1.00 12.32 N flip ATOM 0 H ASN A 67 11.959 0.409 -3.606 1.00 2.52 H new ATOM 0 HA ASN A 67 14.259 2.235 -3.392 1.00 55.32 H new ATOM 0 HB2 ASN A 67 14.576 -0.247 -3.732 1.00 25.14 H new ATOM 0 HB3 ASN A 67 13.728 -0.120 -5.260 1.00 25.14 H new ATOM 0 HD21 ASN A 67 16.518 -0.985 -4.732 1.00 12.32 H new ATOM 0 HD22 ASN A 67 17.517 0.062 -5.745 1.00 12.32 H new ATOM 1115 N LYS A 68 12.611 1.924 -6.241 1.00 55.41 N ATOM 1116 CA LYS A 68 12.193 2.594 -7.500 1.00 11.41 C ATOM 1117 C LYS A 68 13.091 3.763 -7.908 1.00 0.20 C ATOM 1118 O LYS A 68 14.328 3.613 -8.013 1.00 70.41 O ATOM 1119 CB LYS A 68 10.701 2.985 -7.525 1.00 21.11 C ATOM 1120 CG LYS A 68 9.736 1.798 -7.401 1.00 0.12 C ATOM 1121 CD LYS A 68 10.053 0.679 -8.412 1.00 12.31 C ATOM 1122 CE LYS A 68 9.952 1.129 -9.862 1.00 71.21 C ATOM 1123 NZ LYS A 68 10.476 0.098 -10.780 1.00 40.23 N ATOM 0 H LYS A 68 12.466 0.915 -6.259 1.00 55.41 H new ATOM 0 HA LYS A 68 12.327 1.827 -8.263 1.00 11.41 H new ATOM 0 HB2 LYS A 68 10.507 3.683 -6.711 1.00 21.11 H new ATOM 0 HB3 LYS A 68 10.491 3.513 -8.455 1.00 21.11 H new ATOM 0 HG2 LYS A 68 9.787 1.396 -6.389 1.00 0.12 H new ATOM 0 HG3 LYS A 68 8.714 2.145 -7.555 1.00 0.12 H new ATOM 0 HD2 LYS A 68 11.059 0.305 -8.225 1.00 12.31 H new ATOM 0 HD3 LYS A 68 9.368 -0.153 -8.249 1.00 12.31 H new ATOM 0 HE2 LYS A 68 8.912 1.343 -10.107 1.00 71.21 H new ATOM 0 HE3 LYS A 68 10.509 2.056 -9.997 1.00 71.21 H new ATOM 0 HZ1 LYS A 68 10.394 0.433 -11.761 1.00 40.23 H new ATOM 0 HZ2 LYS A 68 11.475 -0.087 -10.560 1.00 40.23 H new ATOM 0 HZ3 LYS A 68 9.928 -0.779 -10.667 1.00 40.23 H new ATOM 1207 N ILE B 106 0.090 2.755 14.724 1.00 54.32 N ATOM 1208 CA ILE B 106 -1.261 2.936 14.368 1.00 11.33 C ATOM 1209 C ILE B 106 -1.345 4.290 13.711 1.00 13.23 C ATOM 1210 O ILE B 106 -0.548 5.180 14.025 1.00 25.24 O ATOM 1211 CB ILE B 106 -2.234 2.809 15.592 1.00 31.14 C ATOM 1212 CG1 ILE B 106 -3.701 2.887 15.135 1.00 45.23 C ATOM 1213 CG2 ILE B 106 -1.936 3.867 16.649 1.00 74.41 C ATOM 1214 CD1 ILE B 106 -4.706 2.648 16.240 1.00 53.52 C ATOM 0 HA ILE B 106 -1.584 2.149 13.686 1.00 11.33 H new ATOM 0 HB ILE B 106 -2.071 1.832 16.047 1.00 31.14 H new ATOM 0 HG12 ILE B 106 -3.883 3.870 14.699 1.00 45.23 H new ATOM 0 HG13 ILE B 106 -3.864 2.153 14.346 1.00 45.23 H new ATOM 0 HG21 ILE B 106 -2.627 3.752 17.484 1.00 74.41 H new ATOM 0 HG22 ILE B 106 -0.913 3.747 17.006 1.00 74.41 H new ATOM 0 HG23 ILE B 106 -2.054 4.859 16.214 1.00 74.41 H new ATOM 0 HD11 ILE B 106 -5.716 2.720 15.835 1.00 53.52 H new ATOM 0 HD12 ILE B 106 -4.554 1.654 16.661 1.00 53.52 H new ATOM 0 HD13 ILE B 106 -4.573 3.397 17.021 1.00 53.52 H new ATOM 1226 N TYR B 107 -2.240 4.423 12.787 1.00 11.31 N ATOM 1227 CA TYR B 107 -2.393 5.627 12.018 1.00 60.42 C ATOM 1228 C TYR B 107 -2.840 6.777 12.922 1.00 31.44 C ATOM 1229 O TYR B 107 -2.275 7.867 12.890 1.00 22.12 O ATOM 1230 CB TYR B 107 -3.415 5.365 10.930 1.00 43.04 C ATOM 1231 CG TYR B 107 -3.131 4.137 10.128 1.00 22.43 C ATOM 1232 CD1 TYR B 107 -2.318 4.198 9.026 1.00 52.44 C ATOM 1233 CD2 TYR B 107 -3.690 2.915 10.470 1.00 13.41 C ATOM 1234 CE1 TYR B 107 -2.057 3.105 8.281 1.00 74.44 C ATOM 1235 CE2 TYR B 107 -3.441 1.800 9.724 1.00 11.21 C ATOM 1236 CZ TYR B 107 -2.622 1.900 8.628 1.00 54.31 C ATOM 1237 OH TYR B 107 -2.387 0.809 7.871 1.00 42.23 O ATOM 0 H TYR B 107 -2.900 3.687 12.537 1.00 11.31 H new ATOM 0 HA TYR B 107 -1.443 5.913 11.567 1.00 60.42 H new ATOM 0 HB2 TYR B 107 -4.402 5.273 11.384 1.00 43.04 H new ATOM 0 HB3 TYR B 107 -3.451 6.225 10.262 1.00 43.04 H new ATOM 0 HD1 TYR B 107 -1.876 5.144 8.748 1.00 52.44 H new ATOM 0 HD2 TYR B 107 -4.330 2.845 11.337 1.00 13.41 H new ATOM 0 HE1 TYR B 107 -1.410 3.175 7.419 1.00 74.44 H new ATOM 0 HE2 TYR B 107 -3.883 0.852 9.993 1.00 11.21 H new ATOM 0 HH TYR B 107 -1.563 0.939 7.357 1.00 42.23 H new ATOM 1247 N THR B 108 -3.847 6.523 13.730 1.00 21.23 N ATOM 1248 CA THR B 108 -4.339 7.505 14.681 1.00 14.30 C ATOM 1249 C THR B 108 -5.002 6.778 15.836 1.00 44.34 C ATOM 1250 O THR B 108 -4.518 6.782 16.969 1.00 23.52 O ATOM 1251 CB THR B 108 -5.396 8.438 14.041 1.00 74.52 C ATOM 1252 OG1 THR B 108 -4.883 9.004 12.845 1.00 35.21 O ATOM 1253 CG2 THR B 108 -5.776 9.561 15.004 1.00 52.33 C ATOM 0 H THR B 108 -4.348 5.635 13.749 1.00 21.23 H new ATOM 0 HA THR B 108 -3.492 8.104 15.014 1.00 14.30 H new ATOM 0 HB THR B 108 -6.283 7.845 13.817 1.00 74.52 H new ATOM 0 HG1 THR B 108 -4.169 9.639 13.063 1.00 35.21 H new ATOM 0 HG21 THR B 108 -6.520 10.206 14.536 1.00 52.33 H new ATOM 0 HG22 THR B 108 -6.190 9.133 15.917 1.00 52.33 H new ATOM 0 HG23 THR B 108 -4.890 10.147 15.248 1.00 52.33 H new ATOM 1261 N SER B 109 -6.106 6.147 15.525 1.00 24.52 N ATOM 1262 CA SER B 109 -6.907 5.413 16.457 1.00 73.13 C ATOM 1263 C SER B 109 -7.727 4.438 15.648 1.00 65.04 C ATOM 1264 O SER B 109 -7.508 4.318 14.432 1.00 21.54 O ATOM 1265 CB SER B 109 -7.837 6.367 17.223 1.00 45.24 C ATOM 1266 OG SER B 109 -7.098 7.358 17.932 1.00 40.24 O ATOM 0 H SER B 109 -6.482 6.133 14.577 1.00 24.52 H new ATOM 0 HA SER B 109 -6.283 4.897 17.187 1.00 73.13 H new ATOM 0 HB2 SER B 109 -8.519 6.851 16.524 1.00 45.24 H new ATOM 0 HB3 SER B 109 -8.448 5.797 17.923 1.00 45.24 H new ATOM 0 HG SER B 109 -7.717 7.950 18.408 1.00 40.24 H new ATOM 1272 N ASP B 110 -8.633 3.748 16.285 1.00 53.50 N ATOM 1273 CA ASP B 110 -9.503 2.813 15.602 1.00 11.00 C ATOM 1274 C ASP B 110 -10.448 3.557 14.662 1.00 34.25 C ATOM 1275 O ASP B 110 -11.020 4.593 15.020 1.00 41.11 O ATOM 1276 CB ASP B 110 -10.319 1.989 16.604 1.00 13.32 C ATOM 1277 CG ASP B 110 -11.295 2.827 17.411 1.00 43.13 C ATOM 1278 OD1 ASP B 110 -10.892 3.419 18.431 1.00 24.31 O ATOM 1279 OD2 ASP B 110 -12.489 2.889 17.031 1.00 11.22 O ATOM 0 H ASP B 110 -8.794 3.813 17.290 1.00 53.50 H new ATOM 0 HA ASP B 110 -8.876 2.136 15.022 1.00 11.00 H new ATOM 0 HB2 ASP B 110 -10.870 1.217 16.067 1.00 13.32 H new ATOM 0 HB3 ASP B 110 -9.638 1.479 17.285 1.00 13.32 H new ATOM 1284 N ASN B 111 -10.569 3.049 13.459 1.00 71.31 N ATOM 1285 CA ASN B 111 -11.473 3.598 12.444 1.00 14.43 C ATOM 1286 C ASN B 111 -11.478 2.630 11.275 1.00 33.21 C ATOM 1287 O ASN B 111 -11.734 2.984 10.127 1.00 60.30 O ATOM 1288 CB ASN B 111 -10.989 5.011 12.003 1.00 62.53 C ATOM 1289 CG ASN B 111 -11.952 5.758 11.060 1.00 54.52 C ATOM 1290 OD1 ASN B 111 -13.236 5.483 11.148 1.00 62.24 O flip ATOM 1291 ND2 ASN B 111 -11.532 6.590 10.263 1.00 10.23 N flip ATOM 0 H ASN B 111 -10.043 2.235 13.142 1.00 71.31 H new ATOM 0 HA ASN B 111 -12.483 3.713 12.838 1.00 14.43 H new ATOM 0 HB2 ASN B 111 -10.830 5.619 12.893 1.00 62.53 H new ATOM 0 HB3 ASN B 111 -10.023 4.911 11.508 1.00 62.53 H new ATOM 0 HD21 ASN B 111 -10.533 6.788 10.211 1.00 10.23 H new ATOM 0 HD22 ASN B 111 -12.182 7.084 9.652 1.00 10.23 H new ATOM 1417 N TYR B 121 -4.294 -20.495 2.614 1.00 60.51 N ATOM 1418 CA TYR B 121 -4.321 -20.587 1.203 1.00 3.43 C ATOM 1419 C TYR B 121 -3.394 -21.708 0.762 1.00 52.25 C ATOM 1420 O TYR B 121 -3.770 -22.557 -0.053 1.00 74.04 O ATOM 1421 CB TYR B 121 -3.841 -19.263 0.631 1.00 33.41 C ATOM 1422 CG TYR B 121 -4.085 -19.059 -0.826 1.00 61.13 C ATOM 1423 CD1 TYR B 121 -3.293 -19.656 -1.765 1.00 30.23 C ATOM 1424 CD2 TYR B 121 -5.109 -18.239 -1.249 1.00 55.33 C ATOM 1425 CE1 TYR B 121 -3.508 -19.455 -3.114 1.00 11.11 C ATOM 1426 CE2 TYR B 121 -5.347 -18.017 -2.581 1.00 60.44 C ATOM 1427 CZ TYR B 121 -4.539 -18.629 -3.518 1.00 35.25 C ATOM 1428 OH TYR B 121 -4.773 -18.433 -4.861 1.00 45.01 O ATOM 0 HA TYR B 121 -5.330 -20.799 0.849 1.00 3.43 H new ATOM 0 HB2 TYR B 121 -4.327 -18.455 1.178 1.00 33.41 H new ATOM 0 HB3 TYR B 121 -2.771 -19.175 0.817 1.00 33.41 H new ATOM 0 HD1 TYR B 121 -2.484 -20.297 -1.447 1.00 30.23 H new ATOM 0 HD2 TYR B 121 -5.739 -17.760 -0.514 1.00 55.33 H new ATOM 0 HE1 TYR B 121 -2.877 -19.938 -3.845 1.00 11.11 H new ATOM 0 HE2 TYR B 121 -6.155 -17.372 -2.893 1.00 60.44 H new ATOM 0 HH TYR B 121 -5.534 -17.826 -4.975 1.00 45.01 H new ATOM 1438 N ASP B 122 -2.192 -21.709 1.312 1.00 70.14 N ATOM 1439 CA ASP B 122 -1.165 -22.662 0.927 1.00 41.03 C ATOM 1440 C ASP B 122 -0.143 -22.732 2.093 1.00 65.53 C ATOM 1441 O ASP B 122 -0.528 -22.560 3.248 1.00 3.22 O ATOM 1442 CB ASP B 122 -0.510 -22.129 -0.361 1.00 63.10 C ATOM 1443 CG ASP B 122 0.364 -23.128 -1.060 1.00 43.50 C ATOM 1444 OD1 ASP B 122 -0.168 -23.966 -1.811 1.00 71.34 O ATOM 1445 OD2 ASP B 122 1.583 -23.091 -0.869 1.00 33.34 O ATOM 0 H ASP B 122 -1.901 -21.052 2.036 1.00 70.14 H new ATOM 0 HA ASP B 122 -1.559 -23.661 0.739 1.00 41.03 H new ATOM 0 HB2 ASP B 122 -1.293 -21.804 -1.047 1.00 63.10 H new ATOM 0 HB3 ASP B 122 0.085 -21.249 -0.116 1.00 63.10 H new ATOM 1450 N SER B 123 1.119 -22.993 1.809 1.00 0.11 N ATOM 1451 CA SER B 123 2.141 -23.023 2.841 1.00 22.24 C ATOM 1452 C SER B 123 2.579 -21.570 3.188 1.00 43.44 C ATOM 1453 O SER B 123 2.116 -20.613 2.556 1.00 0.31 O ATOM 1454 CB SER B 123 3.327 -23.851 2.343 1.00 2.21 C ATOM 1455 OG SER B 123 2.896 -25.157 1.961 1.00 41.40 O ATOM 0 H SER B 123 1.463 -23.188 0.869 1.00 0.11 H new ATOM 0 HA SER B 123 1.747 -23.483 3.747 1.00 22.24 H new ATOM 0 HB2 SER B 123 3.796 -23.353 1.494 1.00 2.21 H new ATOM 0 HB3 SER B 123 4.082 -23.925 3.126 1.00 2.21 H new ATOM 0 HG SER B 123 3.665 -25.675 1.643 1.00 41.40 H new ATOM 1461 N MET B 124 3.452 -21.393 4.165 1.00 34.13 N ATOM 1462 CA MET B 124 3.882 -20.046 4.545 1.00 23.32 C ATOM 1463 C MET B 124 5.394 -19.922 4.724 1.00 20.45 C ATOM 1464 O MET B 124 6.098 -20.918 4.847 1.00 11.22 O ATOM 1465 CB MET B 124 3.100 -19.522 5.789 1.00 41.53 C ATOM 1466 CG MET B 124 3.164 -20.399 7.057 1.00 24.55 C ATOM 1467 SD MET B 124 4.804 -20.512 7.832 1.00 12.42 S ATOM 1468 CE MET B 124 5.089 -18.804 8.305 1.00 5.30 C ATOM 0 H MET B 124 3.875 -22.148 4.706 1.00 34.13 H new ATOM 0 HA MET B 124 3.632 -19.400 3.704 1.00 23.32 H new ATOM 0 HB2 MET B 124 3.479 -18.531 6.039 1.00 41.53 H new ATOM 0 HB3 MET B 124 2.053 -19.401 5.509 1.00 41.53 H new ATOM 0 HG2 MET B 124 2.459 -20.004 7.789 1.00 24.55 H new ATOM 0 HG3 MET B 124 2.829 -21.405 6.802 1.00 24.55 H new ATOM 0 HE1 MET B 124 5.862 -18.374 7.668 1.00 5.30 H new ATOM 0 HE2 MET B 124 4.166 -18.236 8.189 1.00 5.30 H new ATOM 0 HE3 MET B 124 5.412 -18.764 9.345 1.00 5.30 H new ATOM 1478 N LYS B 125 5.868 -18.685 4.715 1.00 11.24 N ATOM 1479 CA LYS B 125 7.275 -18.335 4.914 1.00 25.05 C ATOM 1480 C LYS B 125 7.341 -17.074 5.737 1.00 11.25 C ATOM 1481 O LYS B 125 6.300 -16.507 6.059 1.00 33.22 O ATOM 1482 CB LYS B 125 8.011 -18.089 3.592 1.00 23.52 C ATOM 1483 CG LYS B 125 8.255 -19.301 2.738 1.00 12.41 C ATOM 1484 CD LYS B 125 9.116 -18.929 1.546 1.00 32.21 C ATOM 1485 CE LYS B 125 9.534 -20.147 0.757 1.00 12.21 C ATOM 1486 NZ LYS B 125 10.303 -21.101 1.585 1.00 70.33 N ATOM 0 H LYS B 125 5.272 -17.871 4.565 1.00 11.24 H new ATOM 0 HA LYS B 125 7.759 -19.174 5.414 1.00 25.05 H new ATOM 0 HB2 LYS B 125 7.438 -17.368 3.009 1.00 23.52 H new ATOM 0 HB3 LYS B 125 8.973 -17.627 3.815 1.00 23.52 H new ATOM 0 HG2 LYS B 125 8.747 -20.077 3.325 1.00 12.41 H new ATOM 0 HG3 LYS B 125 7.305 -19.713 2.397 1.00 12.41 H new ATOM 0 HD2 LYS B 125 8.565 -18.247 0.898 1.00 32.21 H new ATOM 0 HD3 LYS B 125 10.003 -18.396 1.890 1.00 32.21 H new ATOM 0 HE2 LYS B 125 8.649 -20.643 0.358 1.00 12.21 H new ATOM 0 HE3 LYS B 125 10.138 -19.838 -0.096 1.00 12.21 H new ATOM 0 HZ1 LYS B 125 11.125 -21.442 1.048 1.00 70.33 H new ATOM 0 HZ2 LYS B 125 10.628 -20.626 2.451 1.00 70.33 H new ATOM 0 HZ3 LYS B 125 9.697 -21.907 1.839 1.00 70.33 H new ATOM 1500 N GLU B 126 8.542 -16.623 6.055 1.00 22.24 N ATOM 1501 CA GLU B 126 8.744 -15.450 6.833 1.00 1.43 C ATOM 1502 C GLU B 126 10.172 -14.915 6.621 1.00 41.20 C ATOM 1503 O GLU B 126 11.098 -15.687 6.333 1.00 23.31 O ATOM 1504 CB GLU B 126 8.453 -15.728 8.307 1.00 34.12 C ATOM 1505 CG GLU B 126 9.284 -16.822 8.925 1.00 14.22 C ATOM 1506 CD GLU B 126 8.872 -17.065 10.338 1.00 24.33 C ATOM 1507 OE1 GLU B 126 9.405 -16.408 11.237 1.00 75.42 O ATOM 1508 OE2 GLU B 126 7.967 -17.896 10.571 1.00 55.24 O ATOM 0 H GLU B 126 9.407 -17.081 5.767 1.00 22.24 H new ATOM 0 HA GLU B 126 8.048 -14.678 6.505 1.00 1.43 H new ATOM 0 HB2 GLU B 126 8.610 -14.809 8.872 1.00 34.12 H new ATOM 0 HB3 GLU B 126 7.400 -15.990 8.411 1.00 34.12 H new ATOM 0 HG2 GLU B 126 9.174 -17.739 8.346 1.00 14.22 H new ATOM 0 HG3 GLU B 126 10.338 -16.548 8.891 1.00 14.22 H new ATOM 1515 N PRO B 127 10.346 -13.598 6.727 1.00 31.23 N ATOM 1516 CA PRO B 127 11.622 -12.915 6.525 1.00 72.21 C ATOM 1517 C PRO B 127 12.602 -13.116 7.674 1.00 3.43 C ATOM 1518 O PRO B 127 12.737 -12.276 8.576 1.00 43.11 O ATOM 1519 CB PRO B 127 11.221 -11.455 6.442 1.00 42.33 C ATOM 1520 CG PRO B 127 10.041 -11.400 7.322 1.00 22.20 C ATOM 1521 CD PRO B 127 9.297 -12.656 7.037 1.00 15.04 C ATOM 0 HA PRO B 127 12.141 -13.297 5.646 1.00 72.21 H new ATOM 0 HB2 PRO B 127 12.017 -10.795 6.788 1.00 42.33 H new ATOM 0 HB3 PRO B 127 10.981 -11.157 5.421 1.00 42.33 H new ATOM 0 HG2 PRO B 127 10.332 -11.342 8.371 1.00 22.20 H new ATOM 0 HG3 PRO B 127 9.431 -10.522 7.111 1.00 22.20 H new ATOM 0 HD2 PRO B 127 8.707 -12.978 7.895 1.00 15.04 H new ATOM 0 HD3 PRO B 127 8.606 -12.534 6.203 1.00 15.04 H new ATOM 1846 N CYS C 209 -1.918 6.965 -14.305 1.00 45.02 N ATOM 1847 CA CYS C 209 -1.563 6.864 -12.922 1.00 33.31 C ATOM 1848 C CYS C 209 -2.722 7.466 -12.115 1.00 25.44 C ATOM 1849 O CYS C 209 -3.478 8.264 -12.663 1.00 73.53 O ATOM 1850 CB CYS C 209 -0.233 7.598 -12.678 1.00 13.33 C ATOM 1851 SG CYS C 209 1.119 6.962 -13.721 1.00 71.42 S ATOM 0 HA CYS C 209 -1.411 5.830 -12.612 1.00 33.31 H new ATOM 0 HB2 CYS C 209 -0.368 8.662 -12.873 1.00 13.33 H new ATOM 0 HB3 CYS C 209 0.045 7.499 -11.629 1.00 13.33 H new ATOM 1856 N PRO C 210 -2.912 7.063 -10.834 1.00 24.54 N ATOM 1857 CA PRO C 210 -4.037 7.519 -9.998 1.00 34.33 C ATOM 1858 C PRO C 210 -4.214 9.031 -9.938 1.00 14.43 C ATOM 1859 O PRO C 210 -5.203 9.570 -10.420 1.00 73.55 O ATOM 1860 CB PRO C 210 -3.678 6.989 -8.609 1.00 22.45 C ATOM 1861 CG PRO C 210 -2.256 6.590 -8.695 1.00 4.35 C ATOM 1862 CD PRO C 210 -2.065 6.137 -10.097 1.00 53.04 C ATOM 0 HA PRO C 210 -4.982 7.159 -10.405 1.00 34.33 H new ATOM 0 HB2 PRO C 210 -3.826 7.754 -7.847 1.00 22.45 H new ATOM 0 HB3 PRO C 210 -4.308 6.142 -8.337 1.00 22.45 H new ATOM 0 HG2 PRO C 210 -1.597 7.425 -8.457 1.00 4.35 H new ATOM 0 HG3 PRO C 210 -2.027 5.792 -7.988 1.00 4.35 H new ATOM 0 HD2 PRO C 210 -1.022 6.202 -10.408 1.00 53.04 H new ATOM 0 HD3 PRO C 210 -2.375 5.101 -10.237 1.00 53.04 H new ATOM 1870 N CYS C 211 -3.266 9.690 -9.358 1.00 31.23 N ATOM 1871 CA CYS C 211 -3.327 11.100 -9.177 1.00 32.13 C ATOM 1872 C CYS C 211 -2.536 11.820 -10.242 1.00 61.44 C ATOM 1873 O CYS C 211 -1.582 11.258 -10.809 1.00 55.30 O ATOM 1874 CB CYS C 211 -2.811 11.440 -7.788 1.00 64.34 C ATOM 1875 SG CYS C 211 -1.160 10.722 -7.390 1.00 53.31 S ATOM 0 H CYS C 211 -2.417 9.258 -8.992 1.00 31.23 H new ATOM 0 HA CYS C 211 -4.361 11.431 -9.269 1.00 32.13 H new ATOM 0 HB2 CYS C 211 -2.755 12.524 -7.690 1.00 64.34 H new ATOM 0 HB3 CYS C 211 -3.533 11.090 -7.050 1.00 64.34 H new ATOM 1880 N ARG C 212 -2.929 13.044 -10.536 1.00 21.23 N ATOM 1881 CA ARG C 212 -2.191 13.860 -11.473 1.00 52.44 C ATOM 1882 C ARG C 212 -0.961 14.386 -10.741 1.00 60.04 C ATOM 1883 O ARG C 212 0.155 14.357 -11.260 1.00 13.40 O ATOM 1884 CB ARG C 212 -3.062 15.030 -11.963 1.00 1.25 C ATOM 1885 CG ARG C 212 -2.434 15.942 -13.027 1.00 42.41 C ATOM 1886 CD ARG C 212 -2.345 15.281 -14.399 1.00 31.24 C ATOM 1887 NE ARG C 212 -1.503 14.079 -14.422 1.00 5.05 N ATOM 1888 CZ ARG C 212 -1.846 12.918 -14.997 1.00 34.31 C ATOM 1889 NH1 ARG C 212 -3.034 12.778 -15.584 1.00 41.14 N ATOM 1890 NH2 ARG C 212 -1.007 11.904 -14.979 1.00 52.12 N ATOM 0 H ARG C 212 -3.754 13.493 -10.139 1.00 21.23 H new ATOM 0 HA ARG C 212 -1.900 13.277 -12.347 1.00 52.44 H new ATOM 0 HB2 ARG C 212 -3.989 14.622 -12.365 1.00 1.25 H new ATOM 0 HB3 ARG C 212 -3.330 15.642 -11.102 1.00 1.25 H new ATOM 0 HG2 ARG C 212 -3.022 16.856 -13.107 1.00 42.41 H new ATOM 0 HG3 ARG C 212 -1.434 16.233 -12.704 1.00 42.41 H new ATOM 0 HD2 ARG C 212 -3.349 15.017 -14.731 1.00 31.24 H new ATOM 0 HD3 ARG C 212 -1.952 16.003 -15.115 1.00 31.24 H new ATOM 0 HE ARG C 212 -0.591 14.131 -13.968 1.00 5.05 H new ATOM 0 HH11 ARG C 212 -3.691 13.558 -15.598 1.00 41.14 H new ATOM 0 HH12 ARG C 212 -3.286 11.891 -16.019 1.00 41.14 H new ATOM 0 HH21 ARG C 212 -0.097 12.003 -14.528 1.00 52.12 H new ATOM 0 HH22 ARG C 212 -1.266 11.020 -15.416 1.00 52.12 H new ATOM 1904 N PHE C 213 -1.182 14.839 -9.522 1.00 41.31 N ATOM 1905 CA PHE C 213 -0.122 15.298 -8.651 1.00 73.13 C ATOM 1906 C PHE C 213 -0.233 14.556 -7.344 1.00 2.35 C ATOM 1907 O PHE C 213 -1.315 14.455 -6.785 1.00 40.35 O ATOM 1908 CB PHE C 213 -0.211 16.812 -8.412 1.00 53.11 C ATOM 1909 CG PHE C 213 -0.088 17.628 -9.666 1.00 43.15 C ATOM 1910 CD1 PHE C 213 1.155 17.984 -10.158 1.00 30.21 C ATOM 1911 CD2 PHE C 213 -1.214 18.029 -10.354 1.00 74.00 C ATOM 1912 CE1 PHE C 213 1.267 18.727 -11.315 1.00 21.22 C ATOM 1913 CE2 PHE C 213 -1.110 18.769 -11.507 1.00 11.20 C ATOM 1914 CZ PHE C 213 0.132 19.120 -11.992 1.00 64.14 C ATOM 0 H PHE C 213 -2.112 14.899 -9.106 1.00 41.31 H new ATOM 0 HA PHE C 213 0.842 15.101 -9.120 1.00 73.13 H new ATOM 0 HB2 PHE C 213 -1.163 17.040 -7.932 1.00 53.11 H new ATOM 0 HB3 PHE C 213 0.575 17.108 -7.717 1.00 53.11 H new ATOM 0 HD1 PHE C 213 2.046 17.677 -9.631 1.00 30.21 H new ATOM 0 HD2 PHE C 213 -2.191 17.758 -9.981 1.00 74.00 H new ATOM 0 HE1 PHE C 213 2.242 19.000 -11.690 1.00 21.22 H new ATOM 0 HE2 PHE C 213 -2.002 19.076 -12.034 1.00 11.20 H new ATOM 0 HZ PHE C 213 0.216 19.701 -12.899 1.00 64.14 H new ATOM 1924 N PHE C 214 0.859 14.022 -6.880 1.00 51.02 N ATOM 1925 CA PHE C 214 0.858 13.240 -5.665 1.00 0.31 C ATOM 1926 C PHE C 214 1.336 14.052 -4.475 1.00 25.12 C ATOM 1927 O PHE C 214 2.156 14.974 -4.616 1.00 61.35 O ATOM 1928 CB PHE C 214 1.696 11.953 -5.833 1.00 22.44 C ATOM 1929 CG PHE C 214 3.117 12.193 -6.256 1.00 52.54 C ATOM 1930 CD1 PHE C 214 4.109 12.386 -5.316 1.00 51.01 C ATOM 1931 CD2 PHE C 214 3.455 12.237 -7.600 1.00 63.10 C ATOM 1932 CE1 PHE C 214 5.406 12.616 -5.697 1.00 21.33 C ATOM 1933 CE2 PHE C 214 4.753 12.469 -7.991 1.00 2.33 C ATOM 1934 CZ PHE C 214 5.731 12.660 -7.039 1.00 63.03 C ATOM 0 H PHE C 214 1.772 14.112 -7.325 1.00 51.02 H new ATOM 0 HA PHE C 214 -0.173 12.948 -5.466 1.00 0.31 H new ATOM 0 HB2 PHE C 214 1.697 11.408 -4.889 1.00 22.44 H new ATOM 0 HB3 PHE C 214 1.213 11.312 -6.570 1.00 22.44 H new ATOM 0 HD1 PHE C 214 3.860 12.355 -4.265 1.00 51.01 H new ATOM 0 HD2 PHE C 214 2.691 12.087 -8.348 1.00 63.10 H new ATOM 0 HE1 PHE C 214 6.172 12.762 -4.950 1.00 21.33 H new ATOM 0 HE2 PHE C 214 5.005 12.501 -9.041 1.00 2.33 H new ATOM 0 HZ PHE C 214 6.751 12.844 -7.342 1.00 63.03 H new ATOM 1944 N GLU C 215 0.827 13.704 -3.326 1.00 33.40 N ATOM 1945 CA GLU C 215 1.159 14.331 -2.088 1.00 35.22 C ATOM 1946 C GLU C 215 2.534 13.946 -1.589 1.00 1.44 C ATOM 1947 O GLU C 215 2.959 12.786 -1.649 1.00 24.30 O ATOM 1948 CB GLU C 215 0.105 14.065 -1.012 1.00 15.15 C ATOM 1949 CG GLU C 215 -1.169 14.899 -1.108 1.00 10.31 C ATOM 1950 CD GLU C 215 -1.954 14.717 -2.384 1.00 44.10 C ATOM 1951 OE1 GLU C 215 -2.600 13.679 -2.558 1.00 51.51 O ATOM 1952 OE2 GLU C 215 -1.974 15.639 -3.193 1.00 74.35 O ATOM 0 H GLU C 215 0.147 12.950 -3.228 1.00 33.40 H new ATOM 0 HA GLU C 215 1.175 15.402 -2.292 1.00 35.22 H new ATOM 0 HB2 GLU C 215 -0.170 13.011 -1.052 1.00 15.15 H new ATOM 0 HB3 GLU C 215 0.558 14.239 -0.036 1.00 15.15 H new ATOM 0 HG2 GLU C 215 -1.813 14.651 -0.264 1.00 10.31 H new ATOM 0 HG3 GLU C 215 -0.905 15.952 -1.008 1.00 10.31 H new ATOM 1959 N SER C 216 3.196 14.930 -1.103 1.00 23.11 N ATOM 1960 CA SER C 216 4.508 14.857 -0.594 1.00 72.11 C ATOM 1961 C SER C 216 4.469 15.140 0.923 1.00 21.42 C ATOM 1962 O SER C 216 3.577 15.826 1.387 1.00 73.22 O ATOM 1963 CB SER C 216 5.266 15.909 -1.340 1.00 34.32 C ATOM 1964 OG SER C 216 4.499 17.111 -1.362 1.00 52.21 O ATOM 0 H SER C 216 2.805 15.871 -1.048 1.00 23.11 H new ATOM 0 HA SER C 216 4.976 13.881 -0.722 1.00 72.11 H new ATOM 0 HB2 SER C 216 6.230 16.087 -0.863 1.00 34.32 H new ATOM 0 HB3 SER C 216 5.470 15.575 -2.357 1.00 34.32 H new ATOM 0 HG SER C 216 4.912 17.751 -1.978 1.00 52.21 H new ATOM 1970 N HIS C 217 5.432 14.620 1.675 1.00 23.35 N ATOM 1971 CA HIS C 217 5.416 14.699 3.160 1.00 23.24 C ATOM 1972 C HIS C 217 4.223 13.967 3.752 1.00 41.24 C ATOM 1973 O HIS C 217 4.314 12.790 4.008 1.00 13.15 O ATOM 1974 CB HIS C 217 5.552 16.133 3.741 1.00 51.24 C ATOM 1975 CG HIS C 217 6.951 16.678 3.766 1.00 1.54 C ATOM 1976 ND1 HIS C 217 7.487 17.289 4.871 1.00 25.33 N ATOM 1977 CD2 HIS C 217 7.914 16.724 2.821 1.00 44.24 C ATOM 1978 CE1 HIS C 217 8.707 17.681 4.613 1.00 44.42 C ATOM 1979 NE2 HIS C 217 8.999 17.352 3.371 1.00 33.31 N ATOM 0 H HIS C 217 6.244 14.134 1.294 1.00 23.35 H new ATOM 0 HA HIS C 217 6.325 14.185 3.471 1.00 23.24 H new ATOM 0 HB2 HIS C 217 4.926 16.807 3.156 1.00 51.24 H new ATOM 0 HB3 HIS C 217 5.159 16.136 4.758 1.00 51.24 H new ATOM 0 HD1 HIS C 217 7.006 17.418 5.761 1.00 25.33 H new ATOM 0 HD2 HIS C 217 7.842 16.336 1.816 1.00 44.24 H new ATOM 0 HE1 HIS C 217 9.365 18.189 5.302 1.00 44.42 H new ATOM 1988 N VAL C 218 3.093 14.669 3.911 1.00 22.04 N ATOM 1989 CA VAL C 218 1.836 14.103 4.467 1.00 40.20 C ATOM 1990 C VAL C 218 1.991 13.682 5.943 1.00 12.24 C ATOM 1991 O VAL C 218 3.082 13.371 6.416 1.00 1.14 O ATOM 1992 CB VAL C 218 1.293 12.904 3.612 1.00 63.32 C ATOM 1993 CG1 VAL C 218 -0.052 12.377 4.141 1.00 75.23 C ATOM 1994 CG2 VAL C 218 1.156 13.316 2.167 1.00 70.20 C ATOM 0 H VAL C 218 3.015 15.654 3.658 1.00 22.04 H new ATOM 0 HA VAL C 218 1.101 14.907 4.420 1.00 40.20 H new ATOM 0 HB VAL C 218 2.016 12.093 3.693 1.00 63.32 H new ATOM 0 HG11 VAL C 218 -0.388 11.548 3.518 1.00 75.23 H new ATOM 0 HG12 VAL C 218 0.071 12.033 5.168 1.00 75.23 H new ATOM 0 HG13 VAL C 218 -0.793 13.176 4.112 1.00 75.23 H new ATOM 0 HG21 VAL C 218 0.779 12.476 1.583 1.00 70.20 H new ATOM 0 HG22 VAL C 218 0.461 14.152 2.091 1.00 70.20 H new ATOM 0 HG23 VAL C 218 2.130 13.618 1.781 1.00 70.20 H new ATOM 2004 N ALA C 219 0.906 13.692 6.657 1.00 4.51 N ATOM 2005 CA ALA C 219 0.919 13.326 8.025 1.00 42.54 C ATOM 2006 C ALA C 219 0.572 11.856 8.191 1.00 53.12 C ATOM 2007 O ALA C 219 -0.522 11.411 7.829 1.00 61.53 O ATOM 2008 CB ALA C 219 -0.036 14.193 8.806 1.00 25.14 C ATOM 0 H ALA C 219 -0.012 13.956 6.298 1.00 4.51 H new ATOM 0 HA ALA C 219 1.925 13.481 8.416 1.00 42.54 H new ATOM 0 HB1 ALA C 219 -0.016 13.901 9.856 1.00 25.14 H new ATOM 0 HB2 ALA C 219 0.262 15.237 8.714 1.00 25.14 H new ATOM 0 HB3 ALA C 219 -1.045 14.068 8.413 1.00 25.14 H new ATOM 2014 N ARG C 220 1.502 11.127 8.757 1.00 22.25 N ATOM 2015 CA ARG C 220 1.369 9.703 9.060 1.00 0.42 C ATOM 2016 C ARG C 220 0.343 9.531 10.193 1.00 51.23 C ATOM 2017 O ARG C 220 -0.184 8.454 10.430 1.00 41.13 O ATOM 2018 CB ARG C 220 2.794 9.180 9.392 1.00 50.33 C ATOM 2019 CG ARG C 220 3.011 7.687 9.706 1.00 53.14 C ATOM 2020 CD ARG C 220 2.678 7.264 11.122 1.00 51.53 C ATOM 2021 NE ARG C 220 3.091 5.858 11.327 1.00 24.41 N ATOM 2022 CZ ARG C 220 3.318 5.255 12.504 1.00 15.33 C ATOM 2023 NH1 ARG C 220 3.094 5.883 13.652 1.00 55.41 N ATOM 2024 NH2 ARG C 220 3.784 4.006 12.515 1.00 34.23 N ATOM 0 H ARG C 220 2.406 11.511 9.033 1.00 22.25 H new ATOM 0 HA ARG C 220 0.987 9.114 8.227 1.00 0.42 H new ATOM 0 HB2 ARG C 220 3.437 9.431 8.548 1.00 50.33 H new ATOM 0 HB3 ARG C 220 3.157 9.748 10.249 1.00 50.33 H new ATOM 0 HG2 ARG C 220 2.406 7.097 9.017 1.00 53.14 H new ATOM 0 HG3 ARG C 220 4.054 7.439 9.507 1.00 53.14 H new ATOM 0 HD2 ARG C 220 3.187 7.912 11.836 1.00 51.53 H new ATOM 0 HD3 ARG C 220 1.608 7.370 11.303 1.00 51.53 H new ATOM 0 HE ARG C 220 3.216 5.290 10.489 1.00 24.41 H new ATOM 0 HH11 ARG C 220 2.743 6.841 13.649 1.00 55.41 H new ATOM 0 HH12 ARG C 220 3.273 5.408 14.537 1.00 55.41 H new ATOM 0 HH21 ARG C 220 3.963 3.521 11.636 1.00 34.23 H new ATOM 0 HH22 ARG C 220 3.961 3.536 13.403 1.00 34.23 H new ATOM 2038 N ALA C 221 0.084 10.629 10.860 1.00 41.14 N ATOM 2039 CA ALA C 221 -0.908 10.732 11.899 1.00 72.45 C ATOM 2040 C ALA C 221 -2.335 10.957 11.335 1.00 52.14 C ATOM 2041 O ALA C 221 -3.298 10.955 12.081 1.00 12.42 O ATOM 2042 CB ALA C 221 -0.538 11.852 12.863 1.00 70.34 C ATOM 0 H ALA C 221 0.576 11.506 10.687 1.00 41.14 H new ATOM 0 HA ALA C 221 -0.922 9.781 12.431 1.00 72.45 H new ATOM 0 HB1 ALA C 221 -1.293 11.923 13.645 1.00 70.34 H new ATOM 0 HB2 ALA C 221 0.432 11.639 13.313 1.00 70.34 H new ATOM 0 HB3 ALA C 221 -0.487 12.796 12.321 1.00 70.34 H new ATOM 2048 N ASN C 222 -2.478 11.213 10.026 1.00 73.11 N ATOM 2049 CA ASN C 222 -3.821 11.551 9.507 1.00 11.32 C ATOM 2050 C ASN C 222 -4.368 10.501 8.513 1.00 54.42 C ATOM 2051 O ASN C 222 -5.409 10.692 7.890 1.00 35.10 O ATOM 2052 CB ASN C 222 -3.821 12.931 8.852 1.00 65.11 C ATOM 2053 CG ASN C 222 -5.235 13.469 8.692 1.00 1.21 C ATOM 2054 OD1 ASN C 222 -6.124 13.165 9.501 1.00 4.23 O ATOM 2055 ND2 ASN C 222 -5.459 14.243 7.681 1.00 24.13 N ATOM 0 H ASN C 222 -1.728 11.196 9.335 1.00 73.11 H new ATOM 0 HA ASN C 222 -4.485 11.556 10.371 1.00 11.32 H new ATOM 0 HB2 ASN C 222 -3.233 13.622 9.456 1.00 65.11 H new ATOM 0 HB3 ASN C 222 -3.340 12.872 7.876 1.00 65.11 H new ATOM 0 HD21 ASN C 222 -6.392 14.625 7.528 1.00 24.13 H new ATOM 0 HD22 ASN C 222 -4.703 14.471 7.036 1.00 24.13 H new ATOM 2062 N VAL C 223 -3.712 9.407 8.421 1.00 74.34 N ATOM 2063 CA VAL C 223 -4.084 8.352 7.484 1.00 75.00 C ATOM 2064 C VAL C 223 -4.993 7.267 8.158 1.00 64.12 C ATOM 2065 O VAL C 223 -5.003 7.156 9.360 1.00 72.11 O ATOM 2066 CB VAL C 223 -2.782 7.722 6.866 1.00 1.00 C ATOM 2067 CG1 VAL C 223 -1.771 7.429 7.944 1.00 24.01 C ATOM 2068 CG2 VAL C 223 -3.081 6.459 6.147 1.00 3.23 C ATOM 0 H VAL C 223 -2.891 9.191 8.987 1.00 74.34 H new ATOM 0 HA VAL C 223 -4.678 8.789 6.681 1.00 75.00 H new ATOM 0 HB VAL C 223 -2.378 8.450 6.162 1.00 1.00 H new ATOM 0 HG11 VAL C 223 -0.878 6.994 7.496 1.00 24.01 H new ATOM 0 HG12 VAL C 223 -1.506 8.354 8.456 1.00 24.01 H new ATOM 0 HG13 VAL C 223 -2.197 6.727 8.661 1.00 24.01 H new ATOM 0 HG21 VAL C 223 -2.160 6.050 5.732 1.00 3.23 H new ATOM 0 HG22 VAL C 223 -3.517 5.740 6.840 1.00 3.23 H new ATOM 0 HG23 VAL C 223 -3.786 6.658 5.340 1.00 3.23 H new ATOM 2078 N LYS C 224 -5.831 6.554 7.361 1.00 5.43 N ATOM 2079 CA LYS C 224 -6.604 5.403 7.875 1.00 75.21 C ATOM 2080 C LYS C 224 -5.911 4.076 7.543 1.00 64.11 C ATOM 2081 O LYS C 224 -6.045 3.105 8.267 1.00 51.52 O ATOM 2082 CB LYS C 224 -8.035 5.365 7.311 1.00 24.01 C ATOM 2083 CG LYS C 224 -8.859 6.590 7.644 1.00 34.11 C ATOM 2084 CD LYS C 224 -10.327 6.445 7.233 1.00 22.21 C ATOM 2085 CE LYS C 224 -10.514 6.241 5.742 1.00 31.11 C ATOM 2086 NZ LYS C 224 -11.949 6.104 5.396 1.00 51.04 N ATOM 0 H LYS C 224 -5.985 6.756 6.373 1.00 5.43 H new ATOM 0 HA LYS C 224 -6.656 5.533 8.956 1.00 75.21 H new ATOM 0 HB2 LYS C 224 -7.985 5.257 6.228 1.00 24.01 H new ATOM 0 HB3 LYS C 224 -8.544 4.481 7.697 1.00 24.01 H new ATOM 0 HG2 LYS C 224 -8.803 6.780 8.716 1.00 34.11 H new ATOM 0 HG3 LYS C 224 -8.430 7.458 7.144 1.00 34.11 H new ATOM 0 HD2 LYS C 224 -10.765 5.601 7.766 1.00 22.21 H new ATOM 0 HD3 LYS C 224 -10.874 7.336 7.542 1.00 22.21 H new ATOM 0 HE2 LYS C 224 -10.085 7.084 5.200 1.00 31.11 H new ATOM 0 HE3 LYS C 224 -9.974 5.350 5.424 1.00 31.11 H new ATOM 0 HZ1 LYS C 224 -12.047 5.966 4.370 1.00 51.04 H new ATOM 0 HZ2 LYS C 224 -12.350 5.285 5.896 1.00 51.04 H new ATOM 0 HZ3 LYS C 224 -12.458 6.965 5.679 1.00 51.04 H new ATOM 2100 N HIS C 225 -5.197 4.058 6.415 1.00 74.31 N ATOM 2101 CA HIS C 225 -4.453 2.868 5.906 1.00 23.51 C ATOM 2102 C HIS C 225 -3.804 3.194 4.583 1.00 2.01 C ATOM 2103 O HIS C 225 -4.112 4.238 3.997 1.00 22.55 O ATOM 2104 CB HIS C 225 -5.356 1.626 5.734 1.00 23.11 C ATOM 2105 CG HIS C 225 -6.591 1.824 4.893 1.00 20.21 C ATOM 2106 ND1 HIS C 225 -6.730 2.804 3.927 1.00 23.44 N ATOM 2107 CD2 HIS C 225 -7.761 1.184 4.921 1.00 13.21 C ATOM 2108 CE1 HIS C 225 -7.934 2.743 3.424 1.00 12.44 C ATOM 2109 NE2 HIS C 225 -8.574 1.772 4.005 1.00 43.21 N ATOM 0 H HIS C 225 -5.108 4.874 5.809 1.00 74.31 H new ATOM 0 HA HIS C 225 -3.698 2.626 6.654 1.00 23.51 H new ATOM 0 HB2 HIS C 225 -4.762 0.827 5.291 1.00 23.11 H new ATOM 0 HB3 HIS C 225 -5.663 1.284 6.722 1.00 23.11 H new ATOM 0 HD1 HIS C 225 -6.007 3.469 3.651 1.00 23.44 H new ATOM 0 HD2 HIS C 225 -8.016 0.349 5.557 1.00 13.21 H new ATOM 0 HE1 HIS C 225 -8.331 3.390 2.655 1.00 12.44 H new ATOM 2118 N LEU C 226 -2.967 2.304 4.078 1.00 60.43 N ATOM 2119 CA LEU C 226 -2.306 2.554 2.802 1.00 45.54 C ATOM 2120 C LEU C 226 -2.731 1.525 1.784 1.00 23.53 C ATOM 2121 O LEU C 226 -3.001 0.399 2.130 1.00 1.21 O ATOM 2122 CB LEU C 226 -0.769 2.502 2.939 1.00 33.44 C ATOM 2123 CG LEU C 226 -0.100 3.527 3.859 1.00 52.31 C ATOM 2124 CD1 LEU C 226 1.411 3.379 3.800 1.00 60.03 C ATOM 2125 CD2 LEU C 226 -0.491 4.925 3.467 1.00 71.34 C ATOM 0 H LEU C 226 -2.730 1.416 4.520 1.00 60.43 H new ATOM 0 HA LEU C 226 -2.599 3.552 2.477 1.00 45.54 H new ATOM 0 HB2 LEU C 226 -0.498 1.507 3.292 1.00 33.44 H new ATOM 0 HB3 LEU C 226 -0.340 2.615 1.943 1.00 33.44 H new ATOM 0 HG LEU C 226 -0.437 3.342 4.879 1.00 52.31 H new ATOM 0 HD11 LEU C 226 1.875 4.114 4.459 1.00 60.03 H new ATOM 0 HD12 LEU C 226 1.691 2.376 4.121 1.00 60.03 H new ATOM 0 HD13 LEU C 226 1.753 3.541 2.778 1.00 60.03 H new ATOM 0 HD21 LEU C 226 -0.005 5.639 4.133 1.00 71.34 H new ATOM 0 HD22 LEU C 226 -0.179 5.116 2.440 1.00 71.34 H new ATOM 0 HD23 LEU C 226 -1.573 5.035 3.544 1.00 71.34 H new ATOM 2137 N LYS C 227 -2.831 1.921 0.545 1.00 62.13 N ATOM 2138 CA LYS C 227 -3.088 0.988 -0.513 1.00 62.13 C ATOM 2139 C LYS C 227 -2.056 1.175 -1.573 1.00 10.43 C ATOM 2140 O LYS C 227 -1.918 2.274 -2.102 1.00 5.24 O ATOM 2141 CB LYS C 227 -4.469 1.161 -1.098 1.00 42.00 C ATOM 2142 CG LYS C 227 -4.826 0.006 -2.013 1.00 64.33 C ATOM 2143 CD LYS C 227 -6.259 0.003 -2.445 1.00 24.11 C ATOM 2144 CE LYS C 227 -6.591 1.124 -3.383 1.00 31.41 C ATOM 2145 NZ LYS C 227 -6.660 2.476 -2.771 1.00 64.14 N ATOM 0 H LYS C 227 -2.737 2.891 0.244 1.00 62.13 H new ATOM 0 HA LYS C 227 -3.039 -0.021 -0.105 1.00 62.13 H new ATOM 0 HB2 LYS C 227 -5.201 1.231 -0.294 1.00 42.00 H new ATOM 0 HB3 LYS C 227 -4.516 2.097 -1.654 1.00 42.00 H new ATOM 0 HG2 LYS C 227 -4.189 0.044 -2.897 1.00 64.33 H new ATOM 0 HG3 LYS C 227 -4.607 -0.932 -1.502 1.00 64.33 H new ATOM 0 HD2 LYS C 227 -6.485 -0.947 -2.929 1.00 24.11 H new ATOM 0 HD3 LYS C 227 -6.898 0.072 -1.565 1.00 24.11 H new ATOM 0 HE2 LYS C 227 -5.844 1.142 -4.177 1.00 31.41 H new ATOM 0 HE3 LYS C 227 -7.551 0.908 -3.853 1.00 31.41 H new ATOM 0 HZ1 LYS C 227 -7.506 2.971 -3.118 1.00 64.14 H new ATOM 0 HZ2 LYS C 227 -6.711 2.386 -1.736 1.00 64.14 H new ATOM 0 HZ3 LYS C 227 -5.811 3.018 -3.030 1.00 64.14 H new ATOM 2159 N ILE C 228 -1.342 0.127 -1.897 1.00 65.01 N ATOM 2160 CA ILE C 228 -0.307 0.220 -2.874 1.00 33.04 C ATOM 2161 C ILE C 228 -0.855 -0.358 -4.128 1.00 54.32 C ATOM 2162 O ILE C 228 -1.546 -1.383 -4.101 1.00 75.51 O ATOM 2163 CB ILE C 228 0.978 -0.595 -2.508 1.00 44.21 C ATOM 2164 CG1 ILE C 228 1.470 -0.283 -1.098 1.00 51.42 C ATOM 2165 CG2 ILE C 228 2.093 -0.299 -3.516 1.00 32.51 C ATOM 2166 CD1 ILE C 228 2.789 -0.955 -0.755 1.00 45.51 C ATOM 0 H ILE C 228 -1.465 -0.801 -1.492 1.00 65.01 H new ATOM 0 HA ILE C 228 -0.013 1.267 -2.954 1.00 33.04 H new ATOM 0 HB ILE C 228 0.714 -1.652 -2.545 1.00 44.21 H new ATOM 0 HG12 ILE C 228 1.582 0.796 -0.991 1.00 51.42 H new ATOM 0 HG13 ILE C 228 0.713 -0.598 -0.379 1.00 51.42 H new ATOM 0 HG21 ILE C 228 2.983 -0.871 -3.253 1.00 32.51 H new ATOM 0 HG22 ILE C 228 1.764 -0.581 -4.516 1.00 32.51 H new ATOM 0 HG23 ILE C 228 2.327 0.765 -3.497 1.00 32.51 H new ATOM 0 HD11 ILE C 228 3.079 -0.690 0.262 1.00 45.51 H new ATOM 0 HD12 ILE C 228 2.677 -2.037 -0.830 1.00 45.51 H new ATOM 0 HD13 ILE C 228 3.559 -0.621 -1.451 1.00 45.51 H new ATOM 2178 N LEU C 229 -0.608 0.297 -5.193 1.00 34.14 N ATOM 2179 CA LEU C 229 -1.022 -0.151 -6.460 1.00 24.43 C ATOM 2180 C LEU C 229 0.069 0.141 -7.444 1.00 71.31 C ATOM 2181 O LEU C 229 0.908 1.041 -7.221 1.00 33.45 O ATOM 2182 CB LEU C 229 -2.409 0.457 -6.898 1.00 50.52 C ATOM 2183 CG LEU C 229 -2.583 1.993 -7.004 1.00 5.01 C ATOM 2184 CD1 LEU C 229 -2.392 2.721 -5.709 1.00 32.44 C ATOM 2185 CD2 LEU C 229 -1.770 2.617 -8.115 1.00 62.24 C ATOM 0 H LEU C 229 -0.100 1.181 -5.208 1.00 34.14 H new ATOM 0 HA LEU C 229 -1.193 -1.227 -6.420 1.00 24.43 H new ATOM 0 HB2 LEU C 229 -2.655 0.035 -7.873 1.00 50.52 H new ATOM 0 HB3 LEU C 229 -3.159 0.094 -6.195 1.00 50.52 H new ATOM 0 HG LEU C 229 -3.632 2.118 -7.271 1.00 5.01 H new ATOM 0 HD11 LEU C 229 -2.531 3.790 -5.869 1.00 32.44 H new ATOM 0 HD12 LEU C 229 -3.121 2.365 -4.981 1.00 32.44 H new ATOM 0 HD13 LEU C 229 -1.385 2.538 -5.334 1.00 32.44 H new ATOM 0 HD21 LEU C 229 -1.941 3.693 -8.130 1.00 62.24 H new ATOM 0 HD22 LEU C 229 -0.711 2.420 -7.946 1.00 62.24 H new ATOM 0 HD23 LEU C 229 -2.071 2.188 -9.071 1.00 62.24 H new ATOM 2197 N ASN C 230 0.097 -0.581 -8.499 1.00 32.21 N ATOM 2198 CA ASN C 230 1.098 -0.361 -9.473 1.00 11.01 C ATOM 2199 C ASN C 230 0.400 -0.088 -10.781 1.00 10.23 C ATOM 2200 O ASN C 230 -0.568 -0.767 -11.121 1.00 62.43 O ATOM 2201 CB ASN C 230 1.989 -1.580 -9.593 1.00 73.33 C ATOM 2202 CG ASN C 230 3.315 -1.272 -10.250 1.00 74.24 C ATOM 2203 OD1 ASN C 230 4.308 -1.009 -9.552 1.00 54.43 O ATOM 2204 ND2 ASN C 230 3.353 -1.265 -11.551 1.00 4.34 N ATOM 0 H ASN C 230 -0.562 -1.330 -8.712 1.00 32.21 H new ATOM 0 HA ASN C 230 1.729 0.483 -9.194 1.00 11.01 H new ATOM 0 HB2 ASN C 230 2.168 -1.993 -8.600 1.00 73.33 H new ATOM 0 HB3 ASN C 230 1.472 -2.347 -10.170 1.00 73.33 H new ATOM 0 HD21 ASN C 230 4.222 -1.037 -12.035 1.00 4.34 H new ATOM 0 HD22 ASN C 230 2.514 -1.487 -12.087 1.00 4.34 H new ATOM 2211 N THR C 231 0.858 0.886 -11.494 1.00 4.01 N ATOM 2212 CA THR C 231 0.255 1.253 -12.736 1.00 14.41 C ATOM 2213 C THR C 231 1.258 0.976 -13.846 1.00 0.00 C ATOM 2214 O THR C 231 2.443 0.835 -13.570 1.00 62.23 O ATOM 2215 CB THR C 231 -0.129 2.754 -12.721 1.00 61.01 C ATOM 2216 OG1 THR C 231 1.040 3.534 -12.430 1.00 75.30 O ATOM 2217 CG2 THR C 231 -1.208 3.034 -11.665 1.00 50.33 C ATOM 0 H THR C 231 1.664 1.454 -11.233 1.00 4.01 H new ATOM 0 HA THR C 231 -0.655 0.675 -12.899 1.00 14.41 H new ATOM 0 HB THR C 231 -0.528 3.024 -13.699 1.00 61.01 H new ATOM 0 HG1 THR C 231 0.817 4.224 -11.771 1.00 75.30 H new ATOM 0 HG21 THR C 231 -1.460 4.094 -11.675 1.00 50.33 H new ATOM 0 HG22 THR C 231 -2.099 2.447 -11.890 1.00 50.33 H new ATOM 0 HG23 THR C 231 -0.832 2.759 -10.679 1.00 50.33 H new ATOM 2225 N PRO C 232 0.825 0.876 -15.106 1.00 73.01 N ATOM 2226 CA PRO C 232 1.744 0.641 -16.211 1.00 61.22 C ATOM 2227 C PRO C 232 2.376 1.945 -16.725 1.00 30.03 C ATOM 2228 O PRO C 232 2.947 1.980 -17.813 1.00 11.11 O ATOM 2229 CB PRO C 232 0.841 0.023 -17.279 1.00 73.15 C ATOM 2230 CG PRO C 232 -0.511 0.611 -17.031 1.00 72.15 C ATOM 2231 CD PRO C 232 -0.585 0.943 -15.558 1.00 30.01 C ATOM 0 HA PRO C 232 2.587 0.011 -15.926 1.00 61.22 H new ATOM 0 HB2 PRO C 232 1.197 0.260 -18.282 1.00 73.15 H new ATOM 0 HB3 PRO C 232 0.820 -1.064 -17.197 1.00 73.15 H new ATOM 0 HG2 PRO C 232 -0.659 1.506 -17.636 1.00 72.15 H new ATOM 0 HG3 PRO C 232 -1.295 -0.094 -17.307 1.00 72.15 H new ATOM 0 HD2 PRO C 232 -1.011 1.933 -15.392 1.00 30.01 H new ATOM 0 HD3 PRO C 232 -1.211 0.232 -15.019 1.00 30.01 H new ATOM 2239 N ASN C 233 2.292 3.000 -15.933 1.00 51.42 N ATOM 2240 CA ASN C 233 2.809 4.300 -16.351 1.00 60.23 C ATOM 2241 C ASN C 233 3.682 4.929 -15.254 1.00 41.01 C ATOM 2242 O ASN C 233 4.526 5.795 -15.524 1.00 65.41 O ATOM 2243 CB ASN C 233 1.643 5.229 -16.710 1.00 45.14 C ATOM 2244 CG ASN C 233 2.058 6.570 -17.322 1.00 34.15 C ATOM 2245 OD1 ASN C 233 3.129 6.586 -18.093 1.00 53.20 O flip ATOM 2246 ND2 ASN C 233 1.379 7.580 -17.134 1.00 23.52 N flip ATOM 0 H ASN C 233 1.874 2.987 -15.002 1.00 51.42 H new ATOM 0 HA ASN C 233 3.436 4.157 -17.231 1.00 60.23 H new ATOM 0 HB2 ASN C 233 0.987 4.713 -17.411 1.00 45.14 H new ATOM 0 HB3 ASN C 233 1.059 5.421 -15.810 1.00 45.14 H new ATOM 0 HD21 ASN C 233 0.556 7.537 -16.533 1.00 23.52 H new ATOM 0 HD22 ASN C 233 1.639 8.460 -17.580 1.00 23.52 H new ATOM 2253 N CYS C 234 3.499 4.484 -14.034 1.00 4.33 N ATOM 2254 CA CYS C 234 4.253 5.004 -12.918 1.00 45.43 C ATOM 2255 C CYS C 234 4.946 3.883 -12.159 1.00 24.43 C ATOM 2256 O CYS C 234 4.534 2.729 -12.233 1.00 72.43 O ATOM 2257 CB CYS C 234 3.366 5.851 -12.003 1.00 45.23 C ATOM 2258 SG CYS C 234 2.805 7.433 -12.717 1.00 10.21 S ATOM 0 H CYS C 234 2.828 3.756 -13.787 1.00 4.33 H new ATOM 0 HA CYS C 234 5.032 5.659 -13.308 1.00 45.43 H new ATOM 0 HB2 CYS C 234 2.490 5.264 -11.727 1.00 45.23 H new ATOM 0 HB3 CYS C 234 3.913 6.059 -11.083 1.00 45.23 H new ATOM 2263 N ALA C 235 5.984 4.248 -11.429 1.00 75.41 N ATOM 2264 CA ALA C 235 6.871 3.313 -10.747 1.00 22.41 C ATOM 2265 C ALA C 235 6.174 2.507 -9.652 1.00 44.43 C ATOM 2266 O ALA C 235 6.366 1.285 -9.543 1.00 34.20 O ATOM 2267 CB ALA C 235 8.031 4.082 -10.156 1.00 53.20 C ATOM 0 H ALA C 235 6.243 5.225 -11.288 1.00 75.41 H new ATOM 0 HA ALA C 235 7.215 2.592 -11.488 1.00 22.41 H new ATOM 0 HB1 ALA C 235 8.701 3.392 -9.643 1.00 53.20 H new ATOM 0 HB2 ALA C 235 8.574 4.591 -10.953 1.00 53.20 H new ATOM 0 HB3 ALA C 235 7.655 4.818 -9.446 1.00 53.20 H new ATOM 2273 N CYS C 236 5.409 3.192 -8.831 1.00 0.44 N ATOM 2274 CA CYS C 236 4.689 2.585 -7.727 1.00 3.21 C ATOM 2275 C CYS C 236 3.885 3.691 -7.062 1.00 63.31 C ATOM 2276 O CYS C 236 4.339 4.831 -7.017 1.00 34.44 O ATOM 2277 CB CYS C 236 5.689 1.965 -6.713 1.00 63.25 C ATOM 2278 SG CYS C 236 4.932 0.918 -5.421 1.00 23.13 S ATOM 0 H CYS C 236 5.266 4.199 -8.910 1.00 0.44 H new ATOM 0 HA CYS C 236 4.036 1.787 -8.079 1.00 3.21 H new ATOM 0 HB2 CYS C 236 6.417 1.368 -7.263 1.00 63.25 H new ATOM 0 HB3 CYS C 236 6.239 2.772 -6.229 1.00 63.25 H new ATOM 2283 N GLN C 237 2.683 3.394 -6.600 1.00 75.15 N ATOM 2284 CA GLN C 237 1.876 4.414 -5.952 1.00 71.23 C ATOM 2285 C GLN C 237 1.248 3.875 -4.716 1.00 4.25 C ATOM 2286 O GLN C 237 0.866 2.705 -4.668 1.00 40.21 O ATOM 2287 CB GLN C 237 0.736 4.996 -6.820 1.00 52.34 C ATOM 2288 CG GLN C 237 1.103 5.732 -8.108 1.00 50.23 C ATOM 2289 CD GLN C 237 1.230 4.858 -9.351 1.00 24.52 C ATOM 2290 OE1 GLN C 237 0.944 5.311 -10.441 1.00 3.45 O ATOM 2291 NE2 GLN C 237 1.638 3.634 -9.215 1.00 23.23 N ATOM 0 H GLN C 237 2.250 2.472 -6.659 1.00 75.15 H new ATOM 0 HA GLN C 237 2.582 5.218 -5.746 1.00 71.23 H new ATOM 0 HB2 GLN C 237 0.070 4.175 -7.086 1.00 52.34 H new ATOM 0 HB3 GLN C 237 0.163 5.683 -6.197 1.00 52.34 H new ATOM 0 HG2 GLN C 237 0.348 6.495 -8.297 1.00 50.23 H new ATOM 0 HG3 GLN C 237 2.049 6.251 -7.952 1.00 50.23 H new ATOM 0 HE21 GLN C 237 1.873 3.275 -8.290 1.00 23.23 H new ATOM 0 HE22 GLN C 237 1.724 3.031 -10.033 1.00 23.23 H new ATOM 2300 N ILE C 238 1.145 4.711 -3.730 1.00 32.32 N ATOM 2301 CA ILE C 238 0.477 4.372 -2.518 1.00 61.22 C ATOM 2302 C ILE C 238 -0.584 5.423 -2.266 1.00 32.23 C ATOM 2303 O ILE C 238 -0.306 6.592 -2.336 1.00 62.14 O ATOM 2304 CB ILE C 238 1.464 4.303 -1.323 1.00 43.24 C ATOM 2305 CG1 ILE C 238 2.563 3.274 -1.621 1.00 54.12 C ATOM 2306 CG2 ILE C 238 0.723 3.941 -0.042 1.00 24.20 C ATOM 2307 CD1 ILE C 238 3.569 3.069 -0.510 1.00 21.55 C ATOM 0 H ILE C 238 1.527 5.657 -3.747 1.00 32.32 H new ATOM 0 HA ILE C 238 0.027 3.384 -2.614 1.00 61.22 H new ATOM 0 HB ILE C 238 1.924 5.281 -1.183 1.00 43.24 H new ATOM 0 HG12 ILE C 238 2.092 2.317 -1.845 1.00 54.12 H new ATOM 0 HG13 ILE C 238 3.096 3.585 -2.520 1.00 54.12 H new ATOM 0 HG21 ILE C 238 1.429 3.897 0.787 1.00 24.20 H new ATOM 0 HG22 ILE C 238 -0.034 4.697 0.166 1.00 24.20 H new ATOM 0 HG23 ILE C 238 0.243 2.970 -0.162 1.00 24.20 H new ATOM 0 HD11 ILE C 238 4.303 2.324 -0.817 1.00 21.55 H new ATOM 0 HD12 ILE C 238 4.075 4.011 -0.299 1.00 21.55 H new ATOM 0 HD13 ILE C 238 3.055 2.724 0.387 1.00 21.55 H new ATOM 2319 N VAL C 239 -1.786 5.013 -2.029 1.00 32.23 N ATOM 2320 CA VAL C 239 -2.853 5.954 -1.759 1.00 50.24 C ATOM 2321 C VAL C 239 -3.310 5.822 -0.320 1.00 73.14 C ATOM 2322 O VAL C 239 -3.593 4.702 0.159 1.00 34.02 O ATOM 2323 CB VAL C 239 -4.052 5.778 -2.739 1.00 43.23 C ATOM 2324 CG1 VAL C 239 -5.189 6.742 -2.404 1.00 5.10 C ATOM 2325 CG2 VAL C 239 -3.590 6.006 -4.170 1.00 12.14 C ATOM 0 H VAL C 239 -2.067 4.033 -2.014 1.00 32.23 H new ATOM 0 HA VAL C 239 -2.459 6.958 -1.918 1.00 50.24 H new ATOM 0 HB VAL C 239 -4.427 4.760 -2.633 1.00 43.23 H new ATOM 0 HG11 VAL C 239 -6.010 6.594 -3.106 1.00 5.10 H new ATOM 0 HG12 VAL C 239 -5.540 6.552 -1.390 1.00 5.10 H new ATOM 0 HG13 VAL C 239 -4.829 7.768 -2.477 1.00 5.10 H new ATOM 0 HG21 VAL C 239 -4.434 5.881 -4.849 1.00 12.14 H new ATOM 0 HG22 VAL C 239 -3.192 7.016 -4.267 1.00 12.14 H new ATOM 0 HG23 VAL C 239 -2.813 5.284 -4.421 1.00 12.14 H new ATOM 2335 N ALA C 240 -3.379 6.939 0.364 1.00 41.00 N ATOM 2336 CA ALA C 240 -3.763 6.971 1.746 1.00 71.25 C ATOM 2337 C ALA C 240 -5.010 7.788 1.921 1.00 72.25 C ATOM 2338 O ALA C 240 -5.090 8.933 1.484 1.00 42.32 O ATOM 2339 CB ALA C 240 -2.652 7.558 2.590 1.00 35.03 C ATOM 0 H ALA C 240 -3.168 7.856 -0.030 1.00 41.00 H new ATOM 0 HA ALA C 240 -3.955 5.948 2.071 1.00 71.25 H new ATOM 0 HB1 ALA C 240 -2.960 7.575 3.636 1.00 35.03 H new ATOM 0 HB2 ALA C 240 -1.755 6.948 2.486 1.00 35.03 H new ATOM 0 HB3 ALA C 240 -2.441 8.574 2.257 1.00 35.03 H new ATOM 2345 N ARG C 241 -5.984 7.222 2.538 1.00 14.22 N ATOM 2346 CA ARG C 241 -7.170 7.959 2.805 1.00 30.05 C ATOM 2347 C ARG C 241 -7.134 8.507 4.191 1.00 73.45 C ATOM 2348 O ARG C 241 -6.990 7.761 5.157 1.00 24.55 O ATOM 2349 CB ARG C 241 -8.442 7.156 2.544 1.00 3.21 C ATOM 2350 CG ARG C 241 -8.647 6.821 1.080 1.00 34.14 C ATOM 2351 CD ARG C 241 -9.986 6.173 0.839 1.00 51.35 C ATOM 2352 NE ARG C 241 -10.240 5.979 -0.597 1.00 43.53 N ATOM 2353 CZ ARG C 241 -11.434 5.691 -1.136 1.00 72.23 C ATOM 2354 NH1 ARG C 241 -12.494 5.514 -0.359 1.00 14.41 N ATOM 2355 NH2 ARG C 241 -11.556 5.586 -2.460 1.00 54.52 N ATOM 0 H ARG C 241 -5.986 6.256 2.867 1.00 14.22 H new ATOM 0 HA ARG C 241 -7.201 8.792 2.102 1.00 30.05 H new ATOM 0 HB2 ARG C 241 -8.405 6.231 3.120 1.00 3.21 H new ATOM 0 HB3 ARG C 241 -9.301 7.722 2.904 1.00 3.21 H new ATOM 0 HG2 ARG C 241 -8.570 7.731 0.484 1.00 34.14 H new ATOM 0 HG3 ARG C 241 -7.854 6.153 0.745 1.00 34.14 H new ATOM 0 HD2 ARG C 241 -10.023 5.211 1.349 1.00 51.35 H new ATOM 0 HD3 ARG C 241 -10.774 6.792 1.269 1.00 51.35 H new ATOM 0 HE ARG C 241 -9.447 6.071 -1.232 1.00 43.53 H new ATOM 0 HH11 ARG C 241 -12.404 5.597 0.654 1.00 14.41 H new ATOM 0 HH12 ARG C 241 -13.400 5.295 -0.774 1.00 14.41 H new ATOM 0 HH21 ARG C 241 -10.743 5.725 -3.060 1.00 54.52 H new ATOM 0 HH22 ARG C 241 -12.463 5.367 -2.873 1.00 54.52 H new ATOM 2369 N LEU C 242 -7.207 9.812 4.260 1.00 71.24 N ATOM 2370 CA LEU C 242 -7.224 10.570 5.500 1.00 41.31 C ATOM 2371 C LEU C 242 -8.493 10.218 6.273 1.00 51.21 C ATOM 2372 O LEU C 242 -9.501 9.843 5.652 1.00 40.23 O ATOM 2373 CB LEU C 242 -7.208 12.071 5.157 1.00 40.15 C ATOM 2374 CG LEU C 242 -6.040 12.543 4.260 1.00 20.54 C ATOM 2375 CD1 LEU C 242 -6.219 14.002 3.832 1.00 33.43 C ATOM 2376 CD2 LEU C 242 -4.703 12.350 4.959 1.00 42.03 C ATOM 0 H LEU C 242 -7.258 10.403 3.430 1.00 71.24 H new ATOM 0 HA LEU C 242 -6.355 10.331 6.112 1.00 41.31 H new ATOM 0 HB2 LEU C 242 -8.146 12.321 4.662 1.00 40.15 H new ATOM 0 HB3 LEU C 242 -7.178 12.637 6.088 1.00 40.15 H new ATOM 0 HG LEU C 242 -6.048 11.927 3.361 1.00 20.54 H new ATOM 0 HD11 LEU C 242 -5.381 14.302 3.203 1.00 33.43 H new ATOM 0 HD12 LEU C 242 -7.148 14.106 3.272 1.00 33.43 H new ATOM 0 HD13 LEU C 242 -6.255 14.639 4.716 1.00 33.43 H new ATOM 0 HD21 LEU C 242 -3.899 12.690 4.306 1.00 42.03 H new ATOM 0 HD22 LEU C 242 -4.689 12.928 5.883 1.00 42.03 H new ATOM 0 HD23 LEU C 242 -4.562 11.294 5.189 1.00 42.03 H new ATOM 2388 N LYS C 243 -8.464 10.331 7.599 1.00 52.13 N ATOM 2389 CA LYS C 243 -9.625 9.926 8.401 1.00 10.14 C ATOM 2390 C LYS C 243 -10.849 10.782 8.123 1.00 70.14 C ATOM 2391 O LYS C 243 -11.758 10.372 7.411 1.00 44.33 O ATOM 2392 CB LYS C 243 -9.373 9.905 9.929 1.00 0.42 C ATOM 2393 CG LYS C 243 -8.193 9.075 10.407 1.00 73.42 C ATOM 2394 CD LYS C 243 -6.961 9.933 10.623 1.00 31.23 C ATOM 2395 CE LYS C 243 -7.170 10.912 11.784 1.00 72.53 C ATOM 2396 NZ LYS C 243 -5.984 11.752 12.043 1.00 71.02 N ATOM 0 H LYS C 243 -7.673 10.690 8.134 1.00 52.13 H new ATOM 0 HA LYS C 243 -9.809 8.900 8.081 1.00 10.14 H new ATOM 0 HB2 LYS C 243 -9.228 10.931 10.266 1.00 0.42 H new ATOM 0 HB3 LYS C 243 -10.273 9.533 10.419 1.00 0.42 H new ATOM 0 HG2 LYS C 243 -8.454 8.571 11.338 1.00 73.42 H new ATOM 0 HG3 LYS C 243 -7.973 8.298 9.675 1.00 73.42 H new ATOM 0 HD2 LYS C 243 -6.101 9.296 10.830 1.00 31.23 H new ATOM 0 HD3 LYS C 243 -6.735 10.487 9.712 1.00 31.23 H new ATOM 0 HE2 LYS C 243 -8.023 11.554 11.563 1.00 72.53 H new ATOM 0 HE3 LYS C 243 -7.417 10.352 12.686 1.00 72.53 H new ATOM 0 HZ1 LYS C 243 -6.107 12.258 12.943 1.00 71.02 H new ATOM 0 HZ2 LYS C 243 -5.137 11.150 12.097 1.00 71.02 H new ATOM 0 HZ3 LYS C 243 -5.871 12.440 11.272 1.00 71.02 H new ATOM 2410 N ASN C 244 -10.851 11.964 8.667 1.00 1.30 N ATOM 2411 CA ASN C 244 -12.001 12.851 8.596 1.00 35.21 C ATOM 2412 C ASN C 244 -11.573 14.245 8.195 1.00 70.14 C ATOM 2413 O ASN C 244 -12.255 15.227 8.490 1.00 61.12 O ATOM 2414 CB ASN C 244 -12.697 12.898 9.980 1.00 43.44 C ATOM 2415 CG ASN C 244 -11.799 13.425 11.114 1.00 23.52 C ATOM 2416 OD1 ASN C 244 -10.569 13.263 11.101 1.00 1.12 O ATOM 2417 ND2 ASN C 244 -12.402 14.044 12.095 1.00 73.43 N ATOM 0 H ASN C 244 -10.057 12.352 9.177 1.00 1.30 H new ATOM 0 HA ASN C 244 -12.694 12.472 7.845 1.00 35.21 H new ATOM 0 HB2 ASN C 244 -13.583 13.529 9.909 1.00 43.44 H new ATOM 0 HB3 ASN C 244 -13.040 11.896 10.237 1.00 43.44 H new ATOM 0 HD21 ASN C 244 -11.859 14.409 12.878 1.00 73.43 H new ATOM 0 HD22 ASN C 244 -13.415 14.162 12.078 1.00 73.43 H new ATOM 2424 N ASN C 245 -10.479 14.341 7.490 1.00 44.04 N ATOM 2425 CA ASN C 245 -9.972 15.642 7.121 1.00 63.13 C ATOM 2426 C ASN C 245 -9.896 15.834 5.619 1.00 24.51 C ATOM 2427 O ASN C 245 -8.988 15.319 4.960 1.00 51.32 O ATOM 2428 CB ASN C 245 -8.611 15.929 7.778 1.00 55.33 C ATOM 2429 CG ASN C 245 -8.054 17.318 7.439 1.00 20.33 C ATOM 2430 OD1 ASN C 245 -8.345 18.296 8.123 1.00 71.34 O ATOM 2431 ND2 ASN C 245 -7.244 17.407 6.412 1.00 4.32 N ATOM 0 H ASN C 245 -9.926 13.549 7.162 1.00 44.04 H new ATOM 0 HA ASN C 245 -10.692 16.367 7.501 1.00 63.13 H new ATOM 0 HB2 ASN C 245 -8.712 15.840 8.860 1.00 55.33 H new ATOM 0 HB3 ASN C 245 -7.895 15.171 7.461 1.00 55.33 H new ATOM 0 HD21 ASN C 245 -6.836 18.307 6.161 1.00 4.32 H new ATOM 0 HD22 ASN C 245 -7.022 16.576 5.864 1.00 4.32 H new ATOM 2438 N ASN C 246 -10.890 16.530 5.094 1.00 74.35 N ATOM 2439 CA ASN C 246 -10.937 17.014 3.700 1.00 23.04 C ATOM 2440 C ASN C 246 -11.103 15.910 2.637 1.00 44.21 C ATOM 2441 O ASN C 246 -12.174 15.778 2.031 1.00 74.23 O ATOM 2442 CB ASN C 246 -9.705 17.927 3.401 1.00 3.11 C ATOM 2443 CG ASN C 246 -9.698 18.608 2.018 1.00 32.53 C ATOM 2444 OD1 ASN C 246 -10.203 18.090 1.031 1.00 72.21 O ATOM 2445 ND2 ASN C 246 -9.130 19.783 1.958 1.00 64.15 N ATOM 0 H ASN C 246 -11.718 16.788 5.631 1.00 74.35 H new ATOM 0 HA ASN C 246 -11.851 17.603 3.619 1.00 23.04 H new ATOM 0 HB2 ASN C 246 -9.655 18.701 4.167 1.00 3.11 H new ATOM 0 HB3 ASN C 246 -8.800 17.327 3.495 1.00 3.11 H new ATOM 0 HD21 ASN C 246 -9.100 20.291 1.074 1.00 64.15 H new ATOM 0 HD22 ASN C 246 -8.716 20.193 2.795 1.00 64.15 H new ATOM 2452 N ARG C 247 -10.076 15.118 2.421 1.00 3.20 N ATOM 2453 CA ARG C 247 -10.068 14.201 1.298 1.00 63.34 C ATOM 2454 C ARG C 247 -9.186 12.989 1.528 1.00 70.13 C ATOM 2455 O ARG C 247 -8.847 12.656 2.646 1.00 33.25 O ATOM 2456 CB ARG C 247 -9.539 14.927 0.077 1.00 4.10 C ATOM 2457 CG ARG C 247 -8.168 15.555 0.250 1.00 54.40 C ATOM 2458 CD ARG C 247 -7.581 15.745 -1.096 1.00 52.41 C ATOM 2459 NE ARG C 247 -6.309 16.470 -1.117 1.00 1.32 N ATOM 2460 CZ ARG C 247 -5.195 16.037 -1.745 1.00 62.14 C ATOM 2461 NH1 ARG C 247 -5.116 14.774 -2.177 1.00 4.45 N ATOM 2462 NH2 ARG C 247 -4.144 16.844 -1.889 1.00 71.44 N ATOM 0 H ARG C 247 -9.239 15.089 3.003 1.00 3.20 H new ATOM 0 HA ARG C 247 -11.093 13.855 1.164 1.00 63.34 H new ATOM 0 HB2 ARG C 247 -9.498 14.225 -0.756 1.00 4.10 H new ATOM 0 HB3 ARG C 247 -10.248 15.708 -0.199 1.00 4.10 H new ATOM 0 HG2 ARG C 247 -8.249 16.510 0.769 1.00 54.40 H new ATOM 0 HG3 ARG C 247 -7.529 14.915 0.858 1.00 54.40 H new ATOM 0 HD2 ARG C 247 -7.432 14.767 -1.553 1.00 52.41 H new ATOM 0 HD3 ARG C 247 -8.299 16.281 -1.717 1.00 52.41 H new ATOM 0 HE ARG C 247 -6.261 17.362 -0.624 1.00 1.32 H new ATOM 0 HH11 ARG C 247 -5.898 14.136 -2.032 1.00 4.45 H new ATOM 0 HH12 ARG C 247 -4.273 14.449 -2.651 1.00 4.45 H new ATOM 0 HH21 ARG C 247 -4.178 17.796 -1.524 1.00 71.44 H new ATOM 0 HH22 ARG C 247 -3.306 16.510 -2.365 1.00 71.44 H new ATOM 2476 N GLN C 248 -8.876 12.311 0.437 1.00 50.42 N ATOM 2477 CA GLN C 248 -7.909 11.247 0.407 1.00 50.24 C ATOM 2478 C GLN C 248 -6.663 11.787 -0.280 1.00 53.13 C ATOM 2479 O GLN C 248 -6.764 12.656 -1.156 1.00 11.03 O ATOM 2480 CB GLN C 248 -8.449 10.045 -0.371 1.00 34.31 C ATOM 2481 CG GLN C 248 -8.914 10.377 -1.780 1.00 34.14 C ATOM 2482 CD GLN C 248 -9.325 9.165 -2.575 1.00 70.44 C ATOM 2483 OE1 GLN C 248 -10.483 8.743 -2.539 1.00 54.24 O ATOM 2484 NE2 GLN C 248 -8.401 8.617 -3.321 1.00 12.41 N ATOM 0 H GLN C 248 -9.304 12.496 -0.470 1.00 50.42 H new ATOM 0 HA GLN C 248 -7.686 10.913 1.420 1.00 50.24 H new ATOM 0 HB2 GLN C 248 -7.672 9.283 -0.426 1.00 34.31 H new ATOM 0 HB3 GLN C 248 -9.282 9.612 0.183 1.00 34.31 H new ATOM 0 HG2 GLN C 248 -9.755 11.068 -1.724 1.00 34.14 H new ATOM 0 HG3 GLN C 248 -8.112 10.893 -2.307 1.00 34.14 H new ATOM 0 HE21 GLN C 248 -7.454 8.997 -3.322 1.00 12.41 H new ATOM 0 HE22 GLN C 248 -8.627 7.810 -3.902 1.00 12.41 H new ATOM 2493 N VAL C 249 -5.518 11.304 0.087 1.00 33.51 N ATOM 2494 CA VAL C 249 -4.302 11.788 -0.505 1.00 11.11 C ATOM 2495 C VAL C 249 -3.535 10.687 -1.223 1.00 71.01 C ATOM 2496 O VAL C 249 -3.667 9.498 -0.910 1.00 20.32 O ATOM 2497 CB VAL C 249 -3.395 12.579 0.497 1.00 43.23 C ATOM 2498 CG1 VAL C 249 -4.061 13.878 0.909 1.00 63.41 C ATOM 2499 CG2 VAL C 249 -3.081 11.770 1.735 1.00 41.23 C ATOM 0 H VAL C 249 -5.395 10.577 0.792 1.00 33.51 H new ATOM 0 HA VAL C 249 -4.610 12.511 -1.260 1.00 11.11 H new ATOM 0 HB VAL C 249 -2.461 12.791 -0.023 1.00 43.23 H new ATOM 0 HG11 VAL C 249 -3.415 14.413 1.605 1.00 63.41 H new ATOM 0 HG12 VAL C 249 -4.233 14.494 0.027 1.00 63.41 H new ATOM 0 HG13 VAL C 249 -5.014 13.661 1.392 1.00 63.41 H new ATOM 0 HG21 VAL C 249 -2.450 12.357 2.403 1.00 41.23 H new ATOM 0 HG22 VAL C 249 -4.009 11.512 2.246 1.00 41.23 H new ATOM 0 HG23 VAL C 249 -2.558 10.857 1.450 1.00 41.23 H new ATOM 2509 N CYS C 250 -2.764 11.079 -2.173 1.00 70.23 N ATOM 2510 CA CYS C 250 -1.996 10.177 -2.976 1.00 3.34 C ATOM 2511 C CYS C 250 -0.586 10.299 -2.463 1.00 0.53 C ATOM 2512 O CYS C 250 -0.072 11.377 -2.383 1.00 2.23 O ATOM 2513 CB CYS C 250 -2.092 10.664 -4.427 1.00 14.10 C ATOM 2514 SG CYS C 250 -1.437 9.537 -5.728 1.00 32.41 S ATOM 0 H CYS C 250 -2.642 12.060 -2.425 1.00 70.23 H new ATOM 0 HA CYS C 250 -2.335 9.142 -2.931 1.00 3.34 H new ATOM 0 HB2 CYS C 250 -3.140 10.866 -4.649 1.00 14.10 H new ATOM 0 HB3 CYS C 250 -1.562 11.613 -4.502 1.00 14.10 H new ATOM 2519 N ILE C 251 0.028 9.215 -2.119 1.00 14.31 N ATOM 2520 CA ILE C 251 1.291 9.279 -1.423 1.00 1.25 C ATOM 2521 C ILE C 251 2.460 8.890 -2.304 1.00 14.52 C ATOM 2522 O ILE C 251 2.371 7.951 -3.116 1.00 0.31 O ATOM 2523 CB ILE C 251 1.288 8.333 -0.181 1.00 2.23 C ATOM 2524 CG1 ILE C 251 0.103 8.609 0.730 1.00 42.51 C ATOM 2525 CG2 ILE C 251 2.565 8.485 0.615 1.00 63.01 C ATOM 2526 CD1 ILE C 251 0.061 10.012 1.285 1.00 64.44 C ATOM 0 H ILE C 251 -0.315 8.272 -2.303 1.00 14.31 H new ATOM 0 HA ILE C 251 1.411 10.318 -1.116 1.00 1.25 H new ATOM 0 HB ILE C 251 1.212 7.314 -0.560 1.00 2.23 H new ATOM 0 HG12 ILE C 251 -0.817 8.422 0.177 1.00 42.51 H new ATOM 0 HG13 ILE C 251 0.125 7.903 1.560 1.00 42.51 H new ATOM 0 HG21 ILE C 251 2.539 7.816 1.475 1.00 63.01 H new ATOM 0 HG22 ILE C 251 3.418 8.234 -0.015 1.00 63.01 H new ATOM 0 HG23 ILE C 251 2.659 9.515 0.959 1.00 63.01 H new ATOM 0 HD11 ILE C 251 -0.815 10.124 1.924 1.00 64.44 H new ATOM 0 HD12 ILE C 251 0.962 10.200 1.869 1.00 64.44 H new ATOM 0 HD13 ILE C 251 0.005 10.727 0.464 1.00 64.44 H new ATOM 2538 N ASP C 252 3.541 9.627 -2.146 1.00 11.23 N ATOM 2539 CA ASP C 252 4.809 9.287 -2.751 1.00 22.32 C ATOM 2540 C ASP C 252 5.380 8.095 -1.980 1.00 15.04 C ATOM 2541 O ASP C 252 5.628 8.195 -0.777 1.00 23.44 O ATOM 2542 CB ASP C 252 5.777 10.480 -2.670 1.00 52.14 C ATOM 2543 CG ASP C 252 7.143 10.208 -3.280 1.00 1.13 C ATOM 2544 OD1 ASP C 252 7.291 10.271 -4.528 1.00 22.24 O ATOM 2545 OD2 ASP C 252 8.080 9.972 -2.545 1.00 62.21 O ATOM 0 H ASP C 252 3.563 10.483 -1.591 1.00 11.23 H new ATOM 0 HA ASP C 252 4.674 9.037 -3.803 1.00 22.32 H new ATOM 0 HB2 ASP C 252 5.328 11.335 -3.176 1.00 52.14 H new ATOM 0 HB3 ASP C 252 5.906 10.760 -1.625 1.00 52.14 H new ATOM 2550 N PRO C 253 5.593 6.961 -2.649 1.00 74.33 N ATOM 2551 CA PRO C 253 6.047 5.700 -1.997 1.00 34.32 C ATOM 2552 C PRO C 253 7.528 5.723 -1.625 1.00 20.24 C ATOM 2553 O PRO C 253 8.117 4.703 -1.314 1.00 31.20 O ATOM 2554 CB PRO C 253 5.820 4.669 -3.097 1.00 33.12 C ATOM 2555 CG PRO C 253 6.007 5.434 -4.360 1.00 12.32 C ATOM 2556 CD PRO C 253 5.422 6.792 -4.103 1.00 71.52 C ATOM 0 HA PRO C 253 5.520 5.511 -1.062 1.00 34.32 H new ATOM 0 HB2 PRO C 253 6.529 3.845 -3.022 1.00 33.12 H new ATOM 0 HB3 PRO C 253 4.821 4.237 -3.038 1.00 33.12 H new ATOM 0 HG2 PRO C 253 7.063 5.506 -4.622 1.00 12.32 H new ATOM 0 HG3 PRO C 253 5.505 4.943 -5.193 1.00 12.32 H new ATOM 0 HD2 PRO C 253 5.944 7.568 -4.663 1.00 71.52 H new ATOM 0 HD3 PRO C 253 4.373 6.840 -4.394 1.00 71.52 H new ATOM 2564 N LYS C 254 8.093 6.888 -1.676 1.00 4.43 N ATOM 2565 CA LYS C 254 9.473 7.116 -1.449 1.00 4.15 C ATOM 2566 C LYS C 254 9.687 8.046 -0.240 1.00 2.14 C ATOM 2567 O LYS C 254 10.800 8.516 0.018 1.00 12.53 O ATOM 2568 CB LYS C 254 9.957 7.724 -2.724 1.00 22.54 C ATOM 2569 CG LYS C 254 10.009 6.762 -3.873 1.00 55.15 C ATOM 2570 CD LYS C 254 9.720 7.432 -5.204 1.00 33.52 C ATOM 2571 CE LYS C 254 10.546 8.679 -5.479 1.00 4.40 C ATOM 2572 NZ LYS C 254 10.054 9.875 -4.736 1.00 32.32 N ATOM 0 H LYS C 254 7.575 7.741 -1.887 1.00 4.43 H new ATOM 0 HA LYS C 254 10.020 6.206 -1.204 1.00 4.15 H new ATOM 0 HB2 LYS C 254 9.305 8.557 -2.989 1.00 22.54 H new ATOM 0 HB3 LYS C 254 10.953 8.137 -2.563 1.00 22.54 H new ATOM 0 HG2 LYS C 254 10.994 6.298 -3.910 1.00 55.15 H new ATOM 0 HG3 LYS C 254 9.286 5.963 -3.707 1.00 55.15 H new ATOM 0 HD2 LYS C 254 9.896 6.712 -6.004 1.00 33.52 H new ATOM 0 HD3 LYS C 254 8.663 7.697 -5.240 1.00 33.52 H new ATOM 0 HE2 LYS C 254 11.584 8.489 -5.206 1.00 4.40 H new ATOM 0 HE3 LYS C 254 10.531 8.890 -6.548 1.00 4.40 H new ATOM 0 HZ1 LYS C 254 10.308 10.737 -5.259 1.00 32.32 H new ATOM 0 HZ2 LYS C 254 9.020 9.822 -4.638 1.00 32.32 H new ATOM 0 HZ3 LYS C 254 10.490 9.901 -3.792 1.00 32.32 H new ATOM 2586 N LEU C 255 8.601 8.320 0.478 1.00 24.21 N ATOM 2587 CA LEU C 255 8.642 9.102 1.722 1.00 34.21 C ATOM 2588 C LEU C 255 9.342 8.354 2.830 1.00 34.34 C ATOM 2589 O LEU C 255 9.187 7.161 2.952 1.00 11.34 O ATOM 2590 CB LEU C 255 7.232 9.446 2.175 1.00 33.03 C ATOM 2591 CG LEU C 255 6.525 10.510 1.380 1.00 64.54 C ATOM 2592 CD1 LEU C 255 5.081 10.604 1.809 1.00 75.34 C ATOM 2593 CD2 LEU C 255 7.203 11.818 1.635 1.00 51.11 C ATOM 0 H LEU C 255 7.665 8.009 0.218 1.00 24.21 H new ATOM 0 HA LEU C 255 9.201 10.014 1.511 1.00 34.21 H new ATOM 0 HB2 LEU C 255 6.630 8.538 2.145 1.00 33.03 H new ATOM 0 HB3 LEU C 255 7.274 9.766 3.216 1.00 33.03 H new ATOM 0 HG LEU C 255 6.561 10.262 0.319 1.00 64.54 H new ATOM 0 HD11 LEU C 255 4.578 11.377 1.228 1.00 75.34 H new ATOM 0 HD12 LEU C 255 4.589 9.646 1.642 1.00 75.34 H new ATOM 0 HD13 LEU C 255 5.032 10.857 2.868 1.00 75.34 H new ATOM 0 HD21 LEU C 255 6.704 12.603 1.067 1.00 51.11 H new ATOM 0 HD22 LEU C 255 7.153 12.052 2.698 1.00 51.11 H new ATOM 0 HD23 LEU C 255 8.246 11.753 1.326 1.00 51.11 H new ATOM 2605 N LYS C 256 10.069 9.083 3.677 1.00 41.15 N ATOM 2606 CA LYS C 256 10.823 8.484 4.784 1.00 50.20 C ATOM 2607 C LYS C 256 9.912 7.693 5.724 1.00 45.51 C ATOM 2608 O LYS C 256 10.272 6.597 6.162 1.00 52.44 O ATOM 2609 CB LYS C 256 11.626 9.556 5.561 1.00 51.22 C ATOM 2610 CG LYS C 256 12.373 9.041 6.805 1.00 65.01 C ATOM 2611 CD LYS C 256 13.412 7.967 6.478 1.00 1.04 C ATOM 2612 CE LYS C 256 14.084 7.460 7.754 1.00 55.32 C ATOM 2613 NZ LYS C 256 15.093 6.412 7.490 1.00 5.42 N ATOM 0 H LYS C 256 10.153 10.098 3.618 1.00 41.15 H new ATOM 0 HA LYS C 256 11.534 7.782 4.349 1.00 50.20 H new ATOM 0 HB2 LYS C 256 12.350 10.007 4.883 1.00 51.22 H new ATOM 0 HB3 LYS C 256 10.942 10.347 5.869 1.00 51.22 H new ATOM 0 HG2 LYS C 256 12.867 9.878 7.297 1.00 65.01 H new ATOM 0 HG3 LYS C 256 11.651 8.636 7.514 1.00 65.01 H new ATOM 0 HD2 LYS C 256 12.933 7.137 5.959 1.00 1.04 H new ATOM 0 HD3 LYS C 256 14.164 8.375 5.802 1.00 1.04 H new ATOM 0 HE2 LYS C 256 14.560 8.296 8.266 1.00 55.32 H new ATOM 0 HE3 LYS C 256 13.324 7.065 8.428 1.00 55.32 H new ATOM 0 HZ1 LYS C 256 15.517 6.104 8.388 1.00 5.42 H new ATOM 0 HZ2 LYS C 256 14.637 5.600 7.026 1.00 5.42 H new ATOM 0 HZ3 LYS C 256 15.835 6.793 6.869 1.00 5.42 H new ATOM 2627 N TRP C 257 8.729 8.222 6.016 1.00 21.43 N ATOM 2628 CA TRP C 257 7.822 7.496 6.887 1.00 43.32 C ATOM 2629 C TRP C 257 7.225 6.292 6.176 1.00 2.52 C ATOM 2630 O TRP C 257 6.851 5.309 6.818 1.00 1.14 O ATOM 2631 CB TRP C 257 6.744 8.371 7.551 1.00 11.22 C ATOM 2632 CG TRP C 257 5.757 9.047 6.645 1.00 43.23 C ATOM 2633 CD1 TRP C 257 5.872 10.266 6.040 1.00 32.24 C ATOM 2634 CD2 TRP C 257 4.466 8.546 6.285 1.00 42.10 C ATOM 2635 NE1 TRP C 257 4.726 10.547 5.355 1.00 1.20 N ATOM 2636 CE2 TRP C 257 3.854 9.513 5.482 1.00 40.15 C ATOM 2637 CE3 TRP C 257 3.769 7.370 6.570 1.00 33.23 C ATOM 2638 CZ2 TRP C 257 2.578 9.349 4.962 1.00 15.32 C ATOM 2639 CZ3 TRP C 257 2.504 7.209 6.057 1.00 44.12 C ATOM 2640 CH2 TRP C 257 1.922 8.194 5.262 1.00 15.51 C ATOM 0 H TRP C 257 8.386 9.120 5.675 1.00 21.43 H new ATOM 0 HA TRP C 257 8.432 7.136 7.715 1.00 43.32 H new ATOM 0 HB2 TRP C 257 6.188 7.749 8.252 1.00 11.22 H new ATOM 0 HB3 TRP C 257 7.247 9.140 8.137 1.00 11.22 H new ATOM 0 HD1 TRP C 257 6.738 10.909 6.095 1.00 32.24 H new ATOM 0 HE1 TRP C 257 4.551 11.403 4.828 1.00 1.20 H new ATOM 0 HE3 TRP C 257 4.216 6.601 7.182 1.00 33.23 H new ATOM 0 HZ2 TRP C 257 2.123 10.108 4.343 1.00 15.32 H new ATOM 0 HZ3 TRP C 257 1.953 6.306 6.273 1.00 44.12 H new ATOM 0 HH2 TRP C 257 0.926 8.038 4.874 1.00 15.51 H new ATOM 2651 N ILE C 258 7.135 6.379 4.854 1.00 13.24 N ATOM 2652 CA ILE C 258 6.681 5.264 4.042 1.00 21.04 C ATOM 2653 C ILE C 258 7.747 4.180 4.023 1.00 44.12 C ATOM 2654 O ILE C 258 7.429 3.011 4.190 1.00 11.24 O ATOM 2655 CB ILE C 258 6.292 5.689 2.583 1.00 24.24 C ATOM 2656 CG1 ILE C 258 5.021 6.564 2.579 1.00 30.20 C ATOM 2657 CG2 ILE C 258 6.106 4.470 1.680 1.00 30.11 C ATOM 2658 CD1 ILE C 258 3.791 5.850 3.074 1.00 62.43 C ATOM 0 H ILE C 258 7.373 7.216 4.322 1.00 13.24 H new ATOM 0 HA ILE C 258 5.770 4.876 4.498 1.00 21.04 H new ATOM 0 HB ILE C 258 7.116 6.281 2.185 1.00 24.24 H new ATOM 0 HG12 ILE C 258 5.194 7.443 3.200 1.00 30.20 H new ATOM 0 HG13 ILE C 258 4.840 6.921 1.565 1.00 30.20 H new ATOM 0 HG21 ILE C 258 5.837 4.799 0.676 1.00 30.11 H new ATOM 0 HG22 ILE C 258 7.036 3.902 1.639 1.00 30.11 H new ATOM 0 HG23 ILE C 258 5.313 3.839 2.080 1.00 30.11 H new ATOM 0 HD11 ILE C 258 2.939 6.529 3.042 1.00 62.43 H new ATOM 0 HD12 ILE C 258 3.591 4.987 2.439 1.00 62.43 H new ATOM 0 HD13 ILE C 258 3.951 5.517 4.099 1.00 62.43 H new ATOM 2670 N GLN C 259 9.014 4.583 3.840 1.00 60.40 N ATOM 2671 CA GLN C 259 10.142 3.650 3.870 1.00 33.33 C ATOM 2672 C GLN C 259 10.103 2.862 5.151 1.00 3.21 C ATOM 2673 O GLN C 259 10.120 1.635 5.130 1.00 21.14 O ATOM 2674 CB GLN C 259 11.483 4.388 3.787 1.00 24.00 C ATOM 2675 CG GLN C 259 11.592 5.370 2.640 1.00 15.42 C ATOM 2676 CD GLN C 259 11.168 4.777 1.332 1.00 33.41 C ATOM 2677 OE1 GLN C 259 12.067 4.167 0.665 1.00 74.03 O flip ATOM 2678 NE2 GLN C 259 10.020 4.856 0.951 1.00 52.10 N flip ATOM 0 H GLN C 259 9.280 5.553 3.669 1.00 60.40 H new ATOM 0 HA GLN C 259 10.055 2.989 3.007 1.00 33.33 H new ATOM 0 HB2 GLN C 259 11.647 4.923 4.723 1.00 24.00 H new ATOM 0 HB3 GLN C 259 12.282 3.653 3.696 1.00 24.00 H new ATOM 0 HG2 GLN C 259 10.977 6.244 2.855 1.00 15.42 H new ATOM 0 HG3 GLN C 259 12.622 5.717 2.560 1.00 15.42 H new ATOM 0 HE21 GLN C 259 9.329 5.353 1.513 1.00 52.10 H new ATOM 0 HE22 GLN C 259 9.745 4.425 0.068 1.00 52.10 H new ATOM 2687 N GLU C 260 9.997 3.581 6.275 1.00 43.55 N ATOM 2688 CA GLU C 260 9.845 2.944 7.566 1.00 62.53 C ATOM 2689 C GLU C 260 8.650 2.047 7.576 1.00 71.44 C ATOM 2690 O GLU C 260 8.770 0.908 7.909 1.00 61.25 O ATOM 2691 CB GLU C 260 9.741 3.958 8.709 1.00 51.10 C ATOM 2692 CG GLU C 260 11.063 4.515 9.182 1.00 62.54 C ATOM 2693 CD GLU C 260 11.938 3.427 9.775 1.00 13.14 C ATOM 2694 OE1 GLU C 260 11.658 2.967 10.908 1.00 4.12 O ATOM 2695 OE2 GLU C 260 12.915 3.013 9.130 1.00 1.13 O ATOM 0 H GLU C 260 10.015 4.600 6.305 1.00 43.55 H new ATOM 0 HA GLU C 260 10.745 2.352 7.730 1.00 62.53 H new ATOM 0 HB2 GLU C 260 9.109 4.785 8.386 1.00 51.10 H new ATOM 0 HB3 GLU C 260 9.240 3.484 9.553 1.00 51.10 H new ATOM 0 HG2 GLU C 260 11.581 4.987 8.347 1.00 62.54 H new ATOM 0 HG3 GLU C 260 10.888 5.291 9.928 1.00 62.54 H new ATOM 2702 N TYR C 261 7.515 2.563 7.154 1.00 0.14 N ATOM 2703 CA TYR C 261 6.264 1.818 7.166 1.00 11.55 C ATOM 2704 C TYR C 261 6.409 0.478 6.415 1.00 50.33 C ATOM 2705 O TYR C 261 5.976 -0.577 6.910 1.00 11.14 O ATOM 2706 CB TYR C 261 5.152 2.666 6.546 1.00 23.13 C ATOM 2707 CG TYR C 261 3.787 2.069 6.675 1.00 40.01 C ATOM 2708 CD1 TYR C 261 3.296 1.199 5.720 1.00 52.24 C ATOM 2709 CD2 TYR C 261 2.985 2.375 7.759 1.00 11.05 C ATOM 2710 CE1 TYR C 261 2.051 0.652 5.843 1.00 32.11 C ATOM 2711 CE2 TYR C 261 1.735 1.829 7.889 1.00 64.03 C ATOM 2712 CZ TYR C 261 1.275 0.966 6.925 1.00 20.01 C ATOM 2713 OH TYR C 261 0.037 0.416 7.045 1.00 4.24 O ATOM 0 H TYR C 261 7.429 3.512 6.791 1.00 0.14 H new ATOM 0 HA TYR C 261 6.004 1.591 8.200 1.00 11.55 H new ATOM 0 HB2 TYR C 261 5.153 3.649 7.017 1.00 23.13 H new ATOM 0 HB3 TYR C 261 5.372 2.819 5.489 1.00 23.13 H new ATOM 0 HD1 TYR C 261 3.906 0.948 4.864 1.00 52.24 H new ATOM 0 HD2 TYR C 261 3.349 3.055 8.515 1.00 11.05 H new ATOM 0 HE1 TYR C 261 1.680 -0.026 5.089 1.00 32.11 H new ATOM 0 HE2 TYR C 261 1.118 2.075 8.741 1.00 64.03 H new ATOM 0 HH TYR C 261 -0.326 0.231 6.154 1.00 4.24 H new ATOM 2723 N LEU C 262 7.033 0.532 5.245 1.00 71.31 N ATOM 2724 CA LEU C 262 7.282 -0.650 4.438 1.00 3.31 C ATOM 2725 C LEU C 262 8.213 -1.591 5.180 1.00 43.43 C ATOM 2726 O LEU C 262 7.904 -2.760 5.357 1.00 1.50 O ATOM 2727 CB LEU C 262 7.890 -0.258 3.077 1.00 5.44 C ATOM 2728 CG LEU C 262 7.030 0.652 2.186 1.00 35.14 C ATOM 2729 CD1 LEU C 262 7.767 1.000 0.904 1.00 1.51 C ATOM 2730 CD2 LEU C 262 5.694 -0.003 1.864 1.00 41.04 C ATOM 0 H LEU C 262 7.380 1.397 4.831 1.00 71.31 H new ATOM 0 HA LEU C 262 6.335 -1.157 4.255 1.00 3.31 H new ATOM 0 HB2 LEU C 262 8.842 0.241 3.258 1.00 5.44 H new ATOM 0 HB3 LEU C 262 8.109 -1.171 2.524 1.00 5.44 H new ATOM 0 HG LEU C 262 6.836 1.572 2.738 1.00 35.14 H new ATOM 0 HD11 LEU C 262 7.140 1.645 0.288 1.00 1.51 H new ATOM 0 HD12 LEU C 262 8.694 1.519 1.147 1.00 1.51 H new ATOM 0 HD13 LEU C 262 7.996 0.086 0.356 1.00 1.51 H new ATOM 0 HD21 LEU C 262 5.105 0.662 1.232 1.00 41.04 H new ATOM 0 HD22 LEU C 262 5.867 -0.943 1.339 1.00 41.04 H new ATOM 0 HD23 LEU C 262 5.152 -0.198 2.789 1.00 41.04 H new ATOM 2742 N GLU C 263 9.322 -1.047 5.659 1.00 73.03 N ATOM 2743 CA GLU C 263 10.325 -1.807 6.398 1.00 14.32 C ATOM 2744 C GLU C 263 9.763 -2.405 7.695 1.00 22.11 C ATOM 2745 O GLU C 263 10.152 -3.502 8.096 1.00 41.35 O ATOM 2746 CB GLU C 263 11.545 -0.928 6.702 1.00 55.25 C ATOM 2747 CG GLU C 263 12.302 -0.465 5.467 1.00 40.42 C ATOM 2748 CD GLU C 263 13.482 0.417 5.797 1.00 2.20 C ATOM 2749 OE1 GLU C 263 14.491 -0.086 6.375 1.00 3.23 O ATOM 2750 OE2 GLU C 263 13.428 1.619 5.517 1.00 73.53 O ATOM 0 H GLU C 263 9.555 -0.060 5.546 1.00 73.03 H new ATOM 0 HA GLU C 263 10.630 -2.639 5.764 1.00 14.32 H new ATOM 0 HB2 GLU C 263 11.218 -0.053 7.263 1.00 55.25 H new ATOM 0 HB3 GLU C 263 12.227 -1.483 7.346 1.00 55.25 H new ATOM 0 HG2 GLU C 263 12.650 -1.337 4.913 1.00 40.42 H new ATOM 0 HG3 GLU C 263 11.621 0.078 4.812 1.00 40.42 H new ATOM 2757 N LYS C 264 8.847 -1.690 8.344 1.00 15.31 N ATOM 2758 CA LYS C 264 8.272 -2.166 9.599 1.00 11.24 C ATOM 2759 C LYS C 264 7.365 -3.343 9.322 1.00 70.33 C ATOM 2760 O LYS C 264 7.406 -4.327 10.029 1.00 32.45 O ATOM 2761 CB LYS C 264 7.436 -1.095 10.356 1.00 31.44 C ATOM 2762 CG LYS C 264 8.036 0.306 10.631 1.00 1.05 C ATOM 2763 CD LYS C 264 9.385 0.346 11.355 1.00 1.12 C ATOM 2764 CE LYS C 264 10.549 -0.038 10.451 1.00 0.23 C ATOM 2765 NZ LYS C 264 11.847 0.249 11.070 1.00 75.03 N ATOM 0 H LYS C 264 8.490 -0.789 8.026 1.00 15.31 H new ATOM 0 HA LYS C 264 9.118 -2.434 10.232 1.00 11.24 H new ATOM 0 HB2 LYS C 264 6.514 -0.948 9.794 1.00 31.44 H new ATOM 0 HB3 LYS C 264 7.158 -1.523 11.319 1.00 31.44 H new ATOM 0 HG2 LYS C 264 8.146 0.822 9.677 1.00 1.05 H new ATOM 0 HG3 LYS C 264 7.317 0.875 11.220 1.00 1.05 H new ATOM 0 HD2 LYS C 264 9.552 1.349 11.749 1.00 1.12 H new ATOM 0 HD3 LYS C 264 9.355 -0.331 12.209 1.00 1.12 H new ATOM 0 HE2 LYS C 264 10.488 -1.100 10.214 1.00 0.23 H new ATOM 0 HE3 LYS C 264 10.470 0.504 9.509 1.00 0.23 H new ATOM 0 HZ1 LYS C 264 12.599 -0.235 10.539 1.00 75.03 H new ATOM 0 HZ2 LYS C 264 12.019 1.275 11.057 1.00 75.03 H new ATOM 0 HZ3 LYS C 264 11.845 -0.089 12.054 1.00 75.03 H new ATOM 2779 N CYS C 265 6.559 -3.232 8.266 1.00 11.33 N ATOM 2780 CA CYS C 265 5.594 -4.269 7.908 1.00 70.12 C ATOM 2781 C CYS C 265 6.321 -5.508 7.398 1.00 13.14 C ATOM 2782 O CYS C 265 5.936 -6.640 7.698 1.00 62.12 O ATOM 2783 CB CYS C 265 4.615 -3.728 6.852 1.00 0.44 C ATOM 2784 SG CYS C 265 3.269 -4.870 6.383 1.00 22.02 S ATOM 0 H CYS C 265 6.557 -2.427 7.640 1.00 11.33 H new ATOM 0 HA CYS C 265 5.023 -4.552 8.792 1.00 70.12 H new ATOM 0 HB2 CYS C 265 4.173 -2.806 7.228 1.00 0.44 H new ATOM 0 HB3 CYS C 265 5.179 -3.469 5.956 1.00 0.44 H new ATOM 2789 N LEU C 266 7.404 -5.257 6.672 1.00 64.51 N ATOM 2790 CA LEU C 266 8.277 -6.254 6.094 1.00 61.23 C ATOM 2791 C LEU C 266 8.886 -7.130 7.209 1.00 23.43 C ATOM 2792 O LEU C 266 9.230 -8.290 6.992 1.00 31.10 O ATOM 2793 CB LEU C 266 9.356 -5.448 5.306 1.00 52.25 C ATOM 2794 CG LEU C 266 10.348 -6.150 4.379 1.00 30.04 C ATOM 2795 CD1 LEU C 266 10.986 -5.106 3.472 1.00 32.24 C ATOM 2796 CD2 LEU C 266 11.448 -6.851 5.158 1.00 2.44 C ATOM 0 H LEU C 266 7.706 -4.305 6.464 1.00 64.51 H new ATOM 0 HA LEU C 266 7.757 -6.943 5.428 1.00 61.23 H new ATOM 0 HB2 LEU C 266 8.826 -4.710 4.704 1.00 52.25 H new ATOM 0 HB3 LEU C 266 9.942 -4.898 6.042 1.00 52.25 H new ATOM 0 HG LEU C 266 9.806 -6.900 3.804 1.00 30.04 H new ATOM 0 HD11 LEU C 266 11.697 -5.591 2.803 1.00 32.24 H new ATOM 0 HD12 LEU C 266 10.212 -4.614 2.883 1.00 32.24 H new ATOM 0 HD13 LEU C 266 11.506 -4.365 4.079 1.00 32.24 H new ATOM 0 HD21 LEU C 266 12.132 -7.338 4.463 1.00 2.44 H new ATOM 0 HD22 LEU C 266 11.995 -6.120 5.754 1.00 2.44 H new ATOM 0 HD23 LEU C 266 11.007 -7.599 5.817 1.00 2.44 H new ATOM 2808 N ASN C 267 8.987 -6.578 8.401 1.00 14.01 N ATOM 2809 CA ASN C 267 9.568 -7.293 9.515 1.00 11.44 C ATOM 2810 C ASN C 267 8.517 -7.670 10.576 1.00 51.54 C ATOM 2811 O ASN C 267 8.164 -8.853 10.722 1.00 32.14 O ATOM 2812 CB ASN C 267 10.692 -6.467 10.152 1.00 44.40 C ATOM 2813 CG ASN C 267 11.358 -7.174 11.320 1.00 41.15 C ATOM 2814 OD1 ASN C 267 10.929 -7.047 12.461 1.00 34.55 O ATOM 2815 ND2 ASN C 267 12.406 -7.900 11.050 1.00 32.04 N ATOM 0 H ASN C 267 8.673 -5.633 8.622 1.00 14.01 H new ATOM 0 HA ASN C 267 9.982 -8.222 9.122 1.00 11.44 H new ATOM 0 HB2 ASN C 267 11.443 -6.241 9.395 1.00 44.40 H new ATOM 0 HB3 ASN C 267 10.287 -5.515 10.494 1.00 44.40 H new ATOM 0 HD21 ASN C 267 12.897 -8.385 11.801 1.00 32.04 H new ATOM 0 HD22 ASN C 267 12.735 -7.983 10.088 1.00 32.04 H new ATOM 2822 N LYS C 268 7.998 -6.651 11.280 1.00 3.22 N ATOM 2823 CA LYS C 268 7.081 -6.818 12.429 1.00 4.22 C ATOM 2824 C LYS C 268 7.625 -7.810 13.457 1.00 22.41 C ATOM 2825 O LYS C 268 7.064 -7.961 14.548 1.00 41.11 O ATOM 2826 CB LYS C 268 5.647 -7.200 12.004 1.00 73.24 C ATOM 2827 CG LYS C 268 4.921 -6.153 11.151 1.00 12.41 C ATOM 2828 CD LYS C 268 4.723 -4.797 11.875 1.00 72.10 C ATOM 2829 CE LYS C 268 3.857 -4.913 13.132 1.00 20.50 C ATOM 2830 NZ LYS C 268 3.632 -3.592 13.780 1.00 31.13 N ATOM 0 H LYS C 268 8.203 -5.675 11.068 1.00 3.22 H new ATOM 0 HA LYS C 268 7.023 -5.838 12.903 1.00 4.22 H new ATOM 0 HB2 LYS C 268 5.687 -8.136 11.447 1.00 73.24 H new ATOM 0 HB3 LYS C 268 5.057 -7.388 12.901 1.00 73.24 H new ATOM 0 HG2 LYS C 268 5.486 -5.987 10.234 1.00 12.41 H new ATOM 0 HG3 LYS C 268 3.947 -6.546 10.859 1.00 12.41 H new ATOM 0 HD2 LYS C 268 5.697 -4.391 12.147 1.00 72.10 H new ATOM 0 HD3 LYS C 268 4.263 -4.088 11.187 1.00 72.10 H new ATOM 0 HE2 LYS C 268 2.896 -5.356 12.870 1.00 20.50 H new ATOM 0 HE3 LYS C 268 4.337 -5.587 13.841 1.00 20.50 H new ATOM 0 HZ1 LYS C 268 3.159 -3.731 14.696 1.00 31.13 H new ATOM 0 HZ2 LYS C 268 4.546 -3.119 13.931 1.00 31.13 H new ATOM 0 HZ3 LYS C 268 3.034 -3.002 13.167 1.00 31.13 H new ATOM 2914 N ILE D 306 5.192 -4.612 -10.791 1.00 1.34 N ATOM 2915 CA ILE D 306 3.745 -4.651 -10.924 1.00 25.21 C ATOM 2916 C ILE D 306 3.267 -5.994 -10.379 1.00 31.05 C ATOM 2917 O ILE D 306 4.081 -6.854 -10.100 1.00 4.54 O ATOM 2918 CB ILE D 306 3.255 -4.466 -12.412 1.00 65.52 C ATOM 2919 CG1 ILE D 306 1.723 -4.261 -12.457 1.00 1.01 C ATOM 2920 CG2 ILE D 306 3.679 -5.652 -13.288 1.00 72.13 C ATOM 2921 CD1 ILE D 306 1.152 -3.956 -13.811 1.00 63.15 C ATOM 0 HA ILE D 306 3.324 -3.817 -10.363 1.00 25.21 H new ATOM 0 HB ILE D 306 3.731 -3.573 -12.817 1.00 65.52 H new ATOM 0 HG12 ILE D 306 1.242 -5.161 -12.073 1.00 1.01 H new ATOM 0 HG13 ILE D 306 1.463 -3.447 -11.780 1.00 1.01 H new ATOM 0 HG21 ILE D 306 3.327 -5.495 -14.308 1.00 72.13 H new ATOM 0 HG22 ILE D 306 4.766 -5.734 -13.288 1.00 72.13 H new ATOM 0 HG23 ILE D 306 3.246 -6.570 -12.892 1.00 72.13 H new ATOM 0 HD11 ILE D 306 0.072 -3.831 -13.731 1.00 63.15 H new ATOM 0 HD12 ILE D 306 1.596 -3.038 -14.195 1.00 63.15 H new ATOM 0 HD13 ILE D 306 1.372 -4.778 -14.492 1.00 63.15 H new ATOM 2933 N TYR D 307 1.978 -6.143 -10.181 1.00 50.11 N ATOM 2934 CA TYR D 307 1.409 -7.393 -9.783 1.00 52.13 C ATOM 2935 C TYR D 307 1.321 -8.256 -11.015 1.00 33.30 C ATOM 2936 O TYR D 307 1.997 -9.259 -11.119 1.00 5.20 O ATOM 2937 CB TYR D 307 0.025 -7.155 -9.203 1.00 43.22 C ATOM 2938 CG TYR D 307 0.031 -6.227 -8.060 1.00 61.12 C ATOM 2939 CD1 TYR D 307 0.300 -6.693 -6.802 1.00 20.11 C ATOM 2940 CD2 TYR D 307 -0.232 -4.890 -8.234 1.00 32.44 C ATOM 2941 CE1 TYR D 307 0.306 -5.871 -5.736 1.00 65.24 C ATOM 2942 CE2 TYR D 307 -0.235 -4.039 -7.177 1.00 33.41 C ATOM 2943 CZ TYR D 307 0.034 -4.535 -5.912 1.00 33.24 C ATOM 2944 OH TYR D 307 0.035 -3.693 -4.837 1.00 24.11 O ATOM 0 H TYR D 307 1.298 -5.392 -10.294 1.00 50.11 H new ATOM 0 HA TYR D 307 2.018 -7.881 -9.022 1.00 52.13 H new ATOM 0 HB2 TYR D 307 -0.626 -6.758 -9.982 1.00 43.22 H new ATOM 0 HB3 TYR D 307 -0.399 -8.108 -8.888 1.00 43.22 H new ATOM 0 HD1 TYR D 307 0.512 -7.743 -6.661 1.00 20.11 H new ATOM 0 HD2 TYR D 307 -0.439 -4.512 -9.224 1.00 32.44 H new ATOM 0 HE1 TYR D 307 0.523 -6.258 -4.751 1.00 65.24 H new ATOM 0 HE2 TYR D 307 -0.444 -2.989 -7.320 1.00 33.41 H new ATOM 0 HH TYR D 307 -0.608 -2.969 -4.988 1.00 24.11 H new ATOM 2954 N THR D 308 0.496 -7.816 -11.964 1.00 72.42 N ATOM 2955 CA THR D 308 0.322 -8.459 -13.264 1.00 53.11 C ATOM 2956 C THR D 308 -0.489 -7.555 -14.194 1.00 52.33 C ATOM 2957 O THR D 308 -0.105 -7.327 -15.338 1.00 21.03 O ATOM 2958 CB THR D 308 -0.380 -9.865 -13.183 1.00 24.35 C ATOM 2959 OG1 THR D 308 0.412 -10.768 -12.424 1.00 61.23 O ATOM 2960 CG2 THR D 308 -0.592 -10.460 -14.573 1.00 20.31 C ATOM 0 H THR D 308 -0.082 -6.984 -11.847 1.00 72.42 H new ATOM 0 HA THR D 308 1.327 -8.620 -13.655 1.00 53.11 H new ATOM 0 HB THR D 308 -1.348 -9.717 -12.704 1.00 24.35 H new ATOM 0 HG1 THR D 308 1.253 -10.333 -12.172 1.00 61.23 H new ATOM 0 HG21 THR D 308 -1.079 -11.431 -14.483 1.00 20.31 H new ATOM 0 HG22 THR D 308 -1.220 -9.792 -15.163 1.00 20.31 H new ATOM 0 HG23 THR D 308 0.372 -10.582 -15.067 1.00 20.31 H new ATOM 2968 N SER D 309 -1.585 -7.017 -13.701 1.00 14.04 N ATOM 2969 CA SER D 309 -2.466 -6.259 -14.552 1.00 33.11 C ATOM 2970 C SER D 309 -2.782 -4.872 -13.980 1.00 21.33 C ATOM 2971 O SER D 309 -2.255 -4.485 -12.929 1.00 41.31 O ATOM 2972 CB SER D 309 -3.740 -7.060 -14.761 1.00 43.15 C ATOM 2973 OG SER D 309 -3.437 -8.359 -15.268 1.00 1.15 O ATOM 0 H SER D 309 -1.881 -7.091 -12.728 1.00 14.04 H new ATOM 0 HA SER D 309 -1.966 -6.087 -15.505 1.00 33.11 H new ATOM 0 HB2 SER D 309 -4.280 -7.148 -13.818 1.00 43.15 H new ATOM 0 HB3 SER D 309 -4.396 -6.536 -15.456 1.00 43.15 H new ATOM 0 HG SER D 309 -4.088 -8.601 -15.959 1.00 1.15 H new ATOM 2979 N ASP D 310 -3.633 -4.148 -14.694 1.00 40.10 N ATOM 2980 CA ASP D 310 -4.064 -2.799 -14.334 1.00 61.00 C ATOM 2981 C ASP D 310 -5.312 -2.848 -13.458 1.00 13.23 C ATOM 2982 O ASP D 310 -5.824 -3.936 -13.161 1.00 62.51 O ATOM 2983 CB ASP D 310 -4.354 -1.984 -15.607 1.00 1.10 C ATOM 2984 CG ASP D 310 -5.456 -2.597 -16.453 1.00 31.43 C ATOM 2985 OD1 ASP D 310 -5.182 -3.600 -17.168 1.00 60.32 O ATOM 2986 OD2 ASP D 310 -6.592 -2.094 -16.437 1.00 64.02 O ATOM 0 H ASP D 310 -4.054 -4.487 -15.559 1.00 40.10 H new ATOM 0 HA ASP D 310 -3.263 -2.319 -13.772 1.00 61.00 H new ATOM 0 HB2 ASP D 310 -4.637 -0.969 -15.328 1.00 1.10 H new ATOM 0 HB3 ASP D 310 -3.443 -1.909 -16.201 1.00 1.10 H new ATOM 2991 N ASN D 311 -5.813 -1.668 -13.073 1.00 53.34 N ATOM 2992 CA ASN D 311 -6.962 -1.547 -12.152 1.00 62.22 C ATOM 2993 C ASN D 311 -7.189 -0.091 -11.810 1.00 33.13 C ATOM 2994 O ASN D 311 -8.326 0.392 -11.784 1.00 30.21 O ATOM 2995 CB ASN D 311 -6.646 -2.293 -10.795 1.00 44.14 C ATOM 2996 CG ASN D 311 -7.761 -2.273 -9.681 1.00 73.32 C ATOM 2997 OD1 ASN D 311 -7.838 -3.180 -8.867 1.00 12.10 O ATOM 2998 ND2 ASN D 311 -8.597 -1.273 -9.629 1.00 62.23 N ATOM 0 H ASN D 311 -5.440 -0.772 -13.386 1.00 53.34 H new ATOM 0 HA ASN D 311 -7.836 -1.979 -12.639 1.00 62.22 H new ATOM 0 HB2 ASN D 311 -6.420 -3.334 -11.027 1.00 44.14 H new ATOM 0 HB3 ASN D 311 -5.740 -1.857 -10.373 1.00 44.14 H new ATOM 0 HD21 ASN D 311 -9.317 -1.247 -8.907 1.00 62.23 H new ATOM 0 HD22 ASN D 311 -8.530 -0.517 -10.310 1.00 62.23 H new ATOM 3124 N TYR D 321 1.110 17.938 -1.283 1.00 13.33 N ATOM 3125 CA TYR D 321 0.905 18.346 0.064 1.00 21.41 C ATOM 3126 C TYR D 321 1.957 19.396 0.450 1.00 74.31 C ATOM 3127 O TYR D 321 1.596 20.506 0.868 1.00 60.04 O ATOM 3128 CB TYR D 321 1.023 17.118 0.940 1.00 22.12 C ATOM 3129 CG TYR D 321 0.361 17.186 2.284 1.00 42.14 C ATOM 3130 CD1 TYR D 321 0.908 17.893 3.340 1.00 31.50 C ATOM 3131 CD2 TYR D 321 -0.820 16.506 2.486 1.00 65.11 C ATOM 3132 CE1 TYR D 321 0.279 17.924 4.577 1.00 65.35 C ATOM 3133 CE2 TYR D 321 -1.462 16.518 3.699 1.00 61.11 C ATOM 3134 CZ TYR D 321 -0.911 17.235 4.754 1.00 12.42 C ATOM 3135 OH TYR D 321 -1.543 17.255 5.984 1.00 44.14 O ATOM 0 HA TYR D 321 -0.080 18.796 0.191 1.00 21.41 H new ATOM 0 HB2 TYR D 321 0.605 16.271 0.397 1.00 22.12 H new ATOM 0 HB3 TYR D 321 2.082 16.908 1.092 1.00 22.12 H new ATOM 0 HD1 TYR D 321 1.836 18.427 3.200 1.00 31.50 H new ATOM 0 HD2 TYR D 321 -1.252 15.949 1.668 1.00 65.11 H new ATOM 0 HE1 TYR D 321 0.713 18.480 5.395 1.00 65.35 H new ATOM 0 HE2 TYR D 321 -2.386 15.976 3.832 1.00 61.11 H new ATOM 0 HH TYR D 321 -2.365 16.723 5.938 1.00 44.14 H new ATOM 3145 N ASP D 322 3.255 19.043 0.302 1.00 71.30 N ATOM 3146 CA ASP D 322 4.369 19.962 0.619 1.00 45.42 C ATOM 3147 C ASP D 322 5.732 19.309 0.389 1.00 22.43 C ATOM 3148 O ASP D 322 6.164 18.508 1.203 1.00 4.41 O ATOM 3149 CB ASP D 322 4.314 20.434 2.082 1.00 72.20 C ATOM 3150 CG ASP D 322 5.386 21.458 2.410 1.00 23.24 C ATOM 3151 OD1 ASP D 322 5.121 22.679 2.254 1.00 74.52 O ATOM 3152 OD2 ASP D 322 6.492 21.080 2.853 1.00 51.51 O ATOM 0 H ASP D 322 3.555 18.128 -0.035 1.00 71.30 H new ATOM 0 HA ASP D 322 4.252 20.812 -0.053 1.00 45.42 H new ATOM 0 HB2 ASP D 322 3.333 20.864 2.284 1.00 72.20 H new ATOM 0 HB3 ASP D 322 4.426 19.573 2.741 1.00 72.20 H new ATOM 3157 N SER D 323 6.363 19.628 -0.742 1.00 72.11 N ATOM 3158 CA SER D 323 7.760 19.237 -1.072 1.00 73.41 C ATOM 3159 C SER D 323 8.036 17.700 -1.148 1.00 2.51 C ATOM 3160 O SER D 323 7.909 16.965 -0.167 1.00 43.03 O ATOM 3161 CB SER D 323 8.722 19.924 -0.118 1.00 0.43 C ATOM 3162 OG SER D 323 8.540 21.338 -0.170 1.00 33.34 O ATOM 0 H SER D 323 5.919 20.177 -1.478 1.00 72.11 H new ATOM 0 HA SER D 323 7.925 19.579 -2.094 1.00 73.41 H new ATOM 0 HB2 SER D 323 8.556 19.566 0.898 1.00 0.43 H new ATOM 0 HB3 SER D 323 9.749 19.672 -0.381 1.00 0.43 H new ATOM 0 HG SER D 323 9.164 21.771 0.450 1.00 33.34 H new ATOM 3168 N MET D 324 8.450 17.237 -2.315 1.00 44.34 N ATOM 3169 CA MET D 324 8.726 15.806 -2.527 1.00 72.33 C ATOM 3170 C MET D 324 10.117 15.374 -2.022 1.00 72.23 C ATOM 3171 O MET D 324 10.989 16.221 -1.777 1.00 25.25 O ATOM 3172 CB MET D 324 8.481 15.390 -4.004 1.00 51.42 C ATOM 3173 CG MET D 324 9.190 16.237 -5.082 1.00 40.12 C ATOM 3174 SD MET D 324 11.002 16.188 -5.035 1.00 42.21 S ATOM 3175 CE MET D 324 11.327 14.458 -5.377 1.00 72.11 C ATOM 0 H MET D 324 8.606 17.822 -3.136 1.00 44.34 H new ATOM 0 HA MET D 324 8.010 15.261 -1.911 1.00 72.33 H new ATOM 0 HB2 MET D 324 8.795 14.353 -4.123 1.00 51.42 H new ATOM 0 HB3 MET D 324 7.408 15.423 -4.195 1.00 51.42 H new ATOM 0 HG2 MET D 324 8.859 15.898 -6.064 1.00 40.12 H new ATOM 0 HG3 MET D 324 8.868 17.273 -4.977 1.00 40.12 H new ATOM 0 HE1 MET D 324 12.387 14.322 -5.589 1.00 72.11 H new ATOM 0 HE2 MET D 324 11.051 13.858 -4.510 1.00 72.11 H new ATOM 0 HE3 MET D 324 10.741 14.141 -6.240 1.00 72.11 H new ATOM 3185 N LYS D 325 10.298 14.051 -1.844 1.00 42.52 N ATOM 3186 CA LYS D 325 11.566 13.444 -1.401 1.00 44.52 C ATOM 3187 C LYS D 325 11.798 12.113 -2.115 1.00 32.30 C ATOM 3188 O LYS D 325 11.052 11.760 -3.033 1.00 23.04 O ATOM 3189 CB LYS D 325 11.610 13.229 0.130 1.00 23.15 C ATOM 3190 CG LYS D 325 11.633 14.506 0.946 1.00 42.44 C ATOM 3191 CD LYS D 325 11.850 14.226 2.423 1.00 42.02 C ATOM 3192 CE LYS D 325 11.911 15.520 3.232 1.00 73.35 C ATOM 3193 NZ LYS D 325 12.977 16.438 2.759 1.00 71.42 N ATOM 0 H LYS D 325 9.559 13.367 -2.006 1.00 42.52 H new ATOM 0 HA LYS D 325 12.361 14.143 -1.661 1.00 44.52 H new ATOM 0 HB2 LYS D 325 10.742 12.640 0.426 1.00 23.15 H new ATOM 0 HB3 LYS D 325 12.494 12.640 0.376 1.00 23.15 H new ATOM 0 HG2 LYS D 325 12.426 15.158 0.579 1.00 42.44 H new ATOM 0 HG3 LYS D 325 10.693 15.041 0.811 1.00 42.44 H new ATOM 0 HD2 LYS D 325 11.042 13.598 2.798 1.00 42.02 H new ATOM 0 HD3 LYS D 325 12.776 13.667 2.557 1.00 42.02 H new ATOM 0 HE2 LYS D 325 10.948 16.027 3.173 1.00 73.35 H new ATOM 0 HE3 LYS D 325 12.082 15.280 4.282 1.00 73.35 H new ATOM 0 HZ1 LYS D 325 13.149 17.170 3.478 1.00 71.42 H new ATOM 0 HZ2 LYS D 325 13.852 15.900 2.597 1.00 71.42 H new ATOM 0 HZ3 LYS D 325 12.678 16.888 1.871 1.00 71.42 H new ATOM 3207 N GLU D 326 12.809 11.390 -1.682 1.00 23.01 N ATOM 3208 CA GLU D 326 13.218 10.157 -2.246 1.00 2.55 C ATOM 3209 C GLU D 326 13.919 9.374 -1.140 1.00 13.23 C ATOM 3210 O GLU D 326 14.393 9.979 -0.168 1.00 32.14 O ATOM 3211 CB GLU D 326 14.195 10.414 -3.413 1.00 31.24 C ATOM 3212 CG GLU D 326 15.476 11.133 -3.006 1.00 63.23 C ATOM 3213 CD GLU D 326 16.384 11.384 -4.170 1.00 34.15 C ATOM 3214 OE1 GLU D 326 16.216 12.431 -4.840 1.00 12.10 O ATOM 3215 OE2 GLU D 326 17.269 10.545 -4.440 1.00 35.45 O ATOM 0 H GLU D 326 13.384 11.675 -0.889 1.00 23.01 H new ATOM 0 HA GLU D 326 12.365 9.601 -2.636 1.00 2.55 H new ATOM 0 HB2 GLU D 326 14.456 9.460 -3.871 1.00 31.24 H new ATOM 0 HB3 GLU D 326 13.686 11.004 -4.175 1.00 31.24 H new ATOM 0 HG2 GLU D 326 15.222 12.083 -2.535 1.00 63.23 H new ATOM 0 HG3 GLU D 326 16.002 10.538 -2.260 1.00 63.23 H new ATOM 3222 N PRO D 327 13.966 8.054 -1.247 1.00 72.23 N ATOM 3223 CA PRO D 327 14.647 7.208 -0.290 1.00 63.42 C ATOM 3224 C PRO D 327 16.128 7.401 -0.375 1.00 12.34 C ATOM 3225 O PRO D 327 16.685 7.642 -1.462 1.00 25.51 O ATOM 3226 CB PRO D 327 14.292 5.802 -0.737 1.00 53.33 C ATOM 3227 CG PRO D 327 14.015 5.957 -2.167 1.00 4.14 C ATOM 3228 CD PRO D 327 13.339 7.279 -2.285 1.00 53.14 C ATOM 0 HA PRO D 327 14.357 7.424 0.738 1.00 63.42 H new ATOM 0 HB2 PRO D 327 15.112 5.106 -0.560 1.00 53.33 H new ATOM 0 HB3 PRO D 327 13.425 5.417 -0.200 1.00 53.33 H new ATOM 0 HG2 PRO D 327 14.934 5.929 -2.753 1.00 4.14 H new ATOM 0 HG3 PRO D 327 13.378 5.153 -2.535 1.00 4.14 H new ATOM 0 HD2 PRO D 327 13.490 7.724 -3.269 1.00 53.14 H new ATOM 0 HD3 PRO D 327 12.263 7.197 -2.134 1.00 53.14 H new