USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=34 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 24 LYS NZ :NH3+ -116:sc= 0.26 (180deg=-0.454) USER MOD Set 1.2: D 311 ASN : amide:sc= 0.447 K(o=0.71,f=-4.4) USER MOD Set 2.1: B 108 THR OG1 : rot 100:sc= 0.519 USER MOD Set 2.2: C 224 LYS NZ :NH3+ 159:sc= 0.343 (180deg=-0.144) USER MOD Set 3.1: A 68 LYS NZ :NH3+ 170:sc= 1.31 (180deg=0) USER MOD Set 3.2: C 230 ASN : amide:sc= -2.5! C(o=-1.2!,f=-6.1!) USER MOD Set 4.1: A 44 ASN : amide:sc= 0.305 K(o=0.97,f=-3!) USER MOD Set 4.2: A 45 ASN :FLIP amide:sc= 0.663 F(o=-0.3,f=0.97) USER MOD Set 5.1: A 30 ASN : amide:sc= -0.227 K(o=0.95,f=-11!) USER MOD Set 5.2: C 268 LYS NZ :NH3+ -148:sc= 1.17 (180deg=0) USER MOD Single : A 16 SER OG : rot -38:sc= 0.044 USER MOD Single : A 17 HIS : no HE2:sc= 0.75 K(o=0.75,f=-2.7!) USER MOD Single : A 22 ASN :FLIP amide:sc= -0.808 F(o=-4!,f=-0.81) USER MOD Single : A 25 HIS : no HD1:sc= -0.545 K(o=-0.55,f=-2.3) USER MOD Single : A 27 LYS NZ :NH3+ -142:sc= -0.611 (180deg=-2.36!) USER MOD Single : A 31 THR OG1 : rot 34:sc= 1.01 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 37 GLN : amide:sc= -0.78 K(o=-0.78,f=-2.6) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 ASN : amide:sc= -1.38 K(o=-1.4,f=-6.5!) USER MOD Single : A 48 GLN : amide:sc= 0.00936 K(o=0.0094,f=-0.56) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ -171:sc=-0.00769 (180deg=-0.164) USER MOD Single : A 59 GLN : amide:sc= -3.89! C(o=-3.9!,f=-4.8!) USER MOD Single : A 61 TYR OH : rot 150:sc= -0.435 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD Single : B 107 TYR OH : rot -133:sc= -1.12! USER MOD Single : B 109 SER OG : rot 42:sc= 0.086 USER MOD Single : B 111 ASN : amide:sc= 0 X(o=0,f=-0.035) USER MOD Single : B 121 TYR OH : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot 180:sc= 0.475 USER MOD Single : B 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 125 LYS NZ :NH3+ -165:sc= -0.0754 (180deg=-0.378) USER MOD Single : C 216 SER OG : rot 143:sc= -0.226 USER MOD Single : C 217 HIS : no HD1:sc= -0.0742 X(o=-0.074,f=0) USER MOD Single : C 222 ASN :FLIP amide:sc= -0.224 F(o=-2.9!,f=-0.22) USER MOD Single : C 225 HIS : no HD1:sc= -0.851 X(o=-0.85,f=-1.2) USER MOD Single : C 227 LYS NZ :NH3+ -168:sc= -1.31 (180deg=-1.61) USER MOD Single : C 231 THR OG1 : rot 16:sc= 0.306 USER MOD Single : C 233 ASN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : C 237 GLN :FLIP amide:sc= -0.0952 F(o=-1,f=-0.095) USER MOD Single : C 243 LYS NZ :NH3+ 148:sc= 0.0251 (180deg=0) USER MOD Single : C 244 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : C 245 ASN : amide:sc= -0.558 K(o=-0.56,f=-2.2!) USER MOD Single : C 246 ASN : amide:sc= -0.404 K(o=-0.4,f=-6.1!) USER MOD Single : C 248 GLN :FLIP amide:sc= 0 F(o=-0.73,f=0) USER MOD Single : C 254 LYS NZ :NH3+ 170:sc= 0.472 (180deg=0.103) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN : amide:sc= -3.77 K(o=-3.8,f=-5.6!) USER MOD Single : C 261 TYR OH : rot 180:sc= 0 USER MOD Single : C 264 LYS NZ :NH3+ -157:sc= 1.14 (180deg=0.124) USER MOD Single : C 267 ASN : amide:sc= 0.57 K(o=0.57,f=0) USER MOD Single : D 307 TYR OH : rot -162:sc= -0.209! USER MOD Single : D 308 THR OG1 : rot 26:sc= -3.42! USER MOD Single : D 309 SER OG : rot 34:sc= 0.241 USER MOD Single : D 321 TYR OH : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot 180:sc= -0.141 USER MOD Single : D 324 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 325 LYS NZ :NH3+ -173:sc= 0.815 (180deg=0.756) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -7.935 -11.463 12.334 1.00 34.45 N ATOM 140 CA CYS A 9 -7.356 -10.143 12.231 1.00 41.35 C ATOM 141 C CYS A 9 -8.169 -9.368 11.177 1.00 71.14 C ATOM 142 O CYS A 9 -9.134 -9.931 10.634 1.00 65.25 O ATOM 143 CB CYS A 9 -5.889 -10.289 11.772 1.00 50.24 C ATOM 144 SG CYS A 9 -4.824 -11.268 12.896 1.00 23.13 S ATOM 0 HA CYS A 9 -7.379 -9.614 13.184 1.00 41.35 H new ATOM 0 HB2 CYS A 9 -5.876 -10.754 10.786 1.00 50.24 H new ATOM 0 HB3 CYS A 9 -5.457 -9.294 11.661 1.00 50.24 H new ATOM 149 N PRO A 10 -7.872 -8.045 10.895 1.00 32.24 N ATOM 150 CA PRO A 10 -8.510 -7.331 9.766 1.00 4.03 C ATOM 151 C PRO A 10 -8.397 -8.146 8.468 1.00 24.01 C ATOM 152 O PRO A 10 -9.179 -7.985 7.526 1.00 62.33 O ATOM 153 CB PRO A 10 -7.754 -6.008 9.709 1.00 72.04 C ATOM 154 CG PRO A 10 -7.290 -5.795 11.098 1.00 60.41 C ATOM 155 CD PRO A 10 -6.971 -7.152 11.654 1.00 42.12 C ATOM 0 HA PRO A 10 -9.581 -7.176 9.894 1.00 4.03 H new ATOM 0 HB2 PRO A 10 -6.917 -6.057 9.013 1.00 72.04 H new ATOM 0 HB3 PRO A 10 -8.399 -5.195 9.375 1.00 72.04 H new ATOM 0 HG2 PRO A 10 -6.411 -5.151 11.119 1.00 60.41 H new ATOM 0 HG3 PRO A 10 -8.060 -5.303 11.693 1.00 60.41 H new ATOM 0 HD2 PRO A 10 -5.924 -7.413 11.503 1.00 42.12 H new ATOM 0 HD3 PRO A 10 -7.161 -7.203 12.726 1.00 42.12 H new ATOM 163 N CYS A 11 -7.423 -9.017 8.452 1.00 41.53 N ATOM 164 CA CYS A 11 -7.297 -10.045 7.481 1.00 44.21 C ATOM 165 C CYS A 11 -8.059 -11.287 7.932 1.00 35.31 C ATOM 166 O CYS A 11 -7.630 -11.992 8.852 1.00 32.42 O ATOM 167 CB CYS A 11 -5.847 -10.375 7.280 1.00 1.23 C ATOM 168 SG CYS A 11 -4.960 -9.082 6.381 1.00 71.51 S ATOM 0 H CYS A 11 -6.674 -9.021 9.144 1.00 41.53 H new ATOM 0 HA CYS A 11 -7.719 -9.699 6.537 1.00 44.21 H new ATOM 0 HB2 CYS A 11 -5.375 -10.527 8.250 1.00 1.23 H new ATOM 0 HB3 CYS A 11 -5.764 -11.315 6.734 1.00 1.23 H new ATOM 173 N ARG A 12 -9.209 -11.519 7.318 1.00 31.42 N ATOM 174 CA ARG A 12 -10.021 -12.691 7.632 1.00 43.15 C ATOM 175 C ARG A 12 -9.441 -13.943 6.967 1.00 21.14 C ATOM 176 O ARG A 12 -9.463 -15.025 7.539 1.00 33.44 O ATOM 177 CB ARG A 12 -11.495 -12.469 7.235 1.00 22.33 C ATOM 178 CG ARG A 12 -11.707 -12.130 5.768 1.00 73.41 C ATOM 179 CD ARG A 12 -13.174 -11.944 5.438 1.00 55.35 C ATOM 180 NE ARG A 12 -13.369 -11.619 4.022 1.00 64.33 N ATOM 181 CZ ARG A 12 -14.530 -11.254 3.466 1.00 13.10 C ATOM 182 NH1 ARG A 12 -15.639 -11.180 4.197 1.00 25.40 N ATOM 183 NH2 ARG A 12 -14.574 -10.963 2.178 1.00 62.32 N ATOM 0 H ARG A 12 -9.604 -10.913 6.599 1.00 31.42 H new ATOM 0 HA ARG A 12 -9.996 -12.845 8.711 1.00 43.15 H new ATOM 0 HB2 ARG A 12 -12.062 -13.369 7.473 1.00 22.33 H new ATOM 0 HB3 ARG A 12 -11.905 -11.664 7.844 1.00 22.33 H new ATOM 0 HG2 ARG A 12 -11.161 -11.219 5.523 1.00 73.41 H new ATOM 0 HG3 ARG A 12 -11.293 -12.925 5.148 1.00 73.41 H new ATOM 0 HD2 ARG A 12 -13.721 -12.855 5.682 1.00 55.35 H new ATOM 0 HD3 ARG A 12 -13.589 -11.147 6.056 1.00 55.35 H new ATOM 0 HE ARG A 12 -12.554 -11.676 3.411 1.00 64.33 H new ATOM 0 HH11 ARG A 12 -15.610 -11.403 5.192 1.00 25.40 H new ATOM 0 HH12 ARG A 12 -16.519 -10.901 3.763 1.00 25.40 H new ATOM 0 HH21 ARG A 12 -13.726 -11.017 1.614 1.00 62.32 H new ATOM 0 HH22 ARG A 12 -15.456 -10.684 1.748 1.00 62.32 H new ATOM 197 N PHE A 13 -8.950 -13.783 5.747 1.00 3.11 N ATOM 198 CA PHE A 13 -8.260 -14.845 5.037 1.00 1.25 C ATOM 199 C PHE A 13 -7.046 -14.257 4.370 1.00 11.13 C ATOM 200 O PHE A 13 -7.172 -13.261 3.656 1.00 62.33 O ATOM 201 CB PHE A 13 -9.136 -15.458 3.919 1.00 54.04 C ATOM 202 CG PHE A 13 -10.396 -16.142 4.350 1.00 34.11 C ATOM 203 CD1 PHE A 13 -10.367 -17.449 4.796 1.00 25.33 C ATOM 204 CD2 PHE A 13 -11.611 -15.492 4.275 1.00 10.15 C ATOM 205 CE1 PHE A 13 -11.526 -18.092 5.162 1.00 21.30 C ATOM 206 CE2 PHE A 13 -12.774 -16.125 4.644 1.00 24.43 C ATOM 207 CZ PHE A 13 -12.733 -17.429 5.088 1.00 30.33 C ATOM 0 H PHE A 13 -9.020 -12.911 5.222 1.00 3.11 H new ATOM 0 HA PHE A 13 -8.009 -15.621 5.760 1.00 1.25 H new ATOM 0 HB2 PHE A 13 -9.402 -14.664 3.221 1.00 54.04 H new ATOM 0 HB3 PHE A 13 -8.530 -16.177 3.368 1.00 54.04 H new ATOM 0 HD1 PHE A 13 -9.424 -17.971 4.858 1.00 25.33 H new ATOM 0 HD2 PHE A 13 -11.649 -14.472 3.922 1.00 10.15 H new ATOM 0 HE1 PHE A 13 -11.491 -19.115 5.507 1.00 21.30 H new ATOM 0 HE2 PHE A 13 -13.717 -15.602 4.586 1.00 24.43 H new ATOM 0 HZ PHE A 13 -13.644 -17.931 5.377 1.00 30.33 H new ATOM 217 N PHE A 14 -5.896 -14.848 4.576 1.00 3.03 N ATOM 218 CA PHE A 14 -4.712 -14.431 3.863 1.00 1.45 C ATOM 219 C PHE A 14 -4.162 -15.636 3.130 1.00 41.13 C ATOM 220 O PHE A 14 -4.140 -16.736 3.688 1.00 52.44 O ATOM 221 CB PHE A 14 -3.622 -13.828 4.805 1.00 35.43 C ATOM 222 CG PHE A 14 -2.885 -14.828 5.676 1.00 43.42 C ATOM 223 CD1 PHE A 14 -1.749 -15.462 5.191 1.00 12.03 C ATOM 224 CD2 PHE A 14 -3.317 -15.133 6.951 1.00 74.43 C ATOM 225 CE1 PHE A 14 -1.062 -16.374 5.946 1.00 20.24 C ATOM 226 CE2 PHE A 14 -2.630 -16.054 7.726 1.00 21.33 C ATOM 227 CZ PHE A 14 -1.501 -16.677 7.221 1.00 75.25 C ATOM 0 H PHE A 14 -5.753 -15.618 5.230 1.00 3.03 H new ATOM 0 HA PHE A 14 -4.986 -13.638 3.167 1.00 1.45 H new ATOM 0 HB2 PHE A 14 -2.892 -13.297 4.194 1.00 35.43 H new ATOM 0 HB3 PHE A 14 -4.094 -13.088 5.451 1.00 35.43 H new ATOM 0 HD1 PHE A 14 -1.400 -15.230 4.196 1.00 12.03 H new ATOM 0 HD2 PHE A 14 -4.198 -14.650 7.348 1.00 74.43 H new ATOM 0 HE1 PHE A 14 -0.181 -16.855 5.547 1.00 20.24 H new ATOM 0 HE2 PHE A 14 -2.975 -16.286 8.723 1.00 21.33 H new ATOM 0 HZ PHE A 14 -0.965 -17.397 7.822 1.00 75.25 H new ATOM 237 N GLU A 15 -3.777 -15.483 1.901 1.00 22.51 N ATOM 238 CA GLU A 15 -3.180 -16.598 1.209 1.00 13.15 C ATOM 239 C GLU A 15 -1.738 -16.290 0.927 1.00 20.30 C ATOM 240 O GLU A 15 -1.413 -15.214 0.424 1.00 13.12 O ATOM 241 CB GLU A 15 -3.925 -16.966 -0.087 1.00 54.23 C ATOM 242 CG GLU A 15 -3.416 -18.263 -0.740 1.00 55.42 C ATOM 243 CD GLU A 15 -4.289 -18.837 -1.848 1.00 3.42 C ATOM 244 OE1 GLU A 15 -4.282 -18.308 -2.953 1.00 72.22 O ATOM 245 OE2 GLU A 15 -4.948 -19.875 -1.621 1.00 12.31 O ATOM 0 H GLU A 15 -3.859 -14.622 1.361 1.00 22.51 H new ATOM 0 HA GLU A 15 -3.254 -17.471 1.858 1.00 13.15 H new ATOM 0 HB2 GLU A 15 -4.988 -17.071 0.131 1.00 54.23 H new ATOM 0 HB3 GLU A 15 -3.826 -16.147 -0.799 1.00 54.23 H new ATOM 0 HG2 GLU A 15 -2.422 -18.076 -1.147 1.00 55.42 H new ATOM 0 HG3 GLU A 15 -3.305 -19.019 0.037 1.00 55.42 H new ATOM 252 N SER A 16 -0.880 -17.215 1.246 1.00 15.23 N ATOM 253 CA SER A 16 0.524 -17.057 1.010 1.00 41.21 C ATOM 254 C SER A 16 0.822 -17.471 -0.454 1.00 43.14 C ATOM 255 O SER A 16 1.934 -17.330 -0.956 1.00 3.53 O ATOM 256 CB SER A 16 1.310 -17.938 1.995 1.00 54.52 C ATOM 257 OG SER A 16 2.705 -17.665 1.965 1.00 60.51 O ATOM 0 H SER A 16 -1.136 -18.103 1.678 1.00 15.23 H new ATOM 0 HA SER A 16 0.826 -16.021 1.162 1.00 41.21 H new ATOM 0 HB2 SER A 16 0.932 -17.778 3.005 1.00 54.52 H new ATOM 0 HB3 SER A 16 1.142 -18.988 1.755 1.00 54.52 H new ATOM 0 HG SER A 16 2.985 -17.493 1.042 1.00 60.51 H new ATOM 263 N HIS A 17 -0.188 -18.004 -1.115 1.00 30.34 N ATOM 264 CA HIS A 17 -0.072 -18.444 -2.500 1.00 74.33 C ATOM 265 C HIS A 17 -0.998 -17.665 -3.454 1.00 13.14 C ATOM 266 O HIS A 17 -1.151 -18.048 -4.620 1.00 33.22 O ATOM 267 CB HIS A 17 -0.319 -19.962 -2.625 1.00 35.32 C ATOM 268 CG HIS A 17 0.653 -20.804 -1.847 1.00 65.34 C ATOM 269 ND1 HIS A 17 0.290 -21.921 -1.129 1.00 2.44 N ATOM 270 CD2 HIS A 17 1.993 -20.695 -1.697 1.00 0.00 C ATOM 271 CE1 HIS A 17 1.353 -22.452 -0.578 1.00 12.23 C ATOM 272 NE2 HIS A 17 2.396 -21.730 -0.906 1.00 31.34 N ATOM 0 H HIS A 17 -1.114 -18.146 -0.711 1.00 30.34 H new ATOM 0 HA HIS A 17 0.952 -18.229 -2.805 1.00 74.33 H new ATOM 0 HB2 HIS A 17 -1.330 -20.185 -2.285 1.00 35.32 H new ATOM 0 HB3 HIS A 17 -0.267 -20.243 -3.677 1.00 35.32 H new ATOM 0 HD1 HIS A 17 -0.661 -22.280 -1.040 1.00 2.44 H new ATOM 0 HD2 HIS A 17 2.626 -19.931 -2.124 1.00 0.00 H new ATOM 0 HE1 HIS A 17 1.367 -23.336 0.042 1.00 12.23 H new ATOM 281 N VAL A 18 -1.620 -16.575 -2.970 1.00 65.44 N ATOM 282 CA VAL A 18 -2.429 -15.722 -3.857 1.00 4.33 C ATOM 283 C VAL A 18 -1.595 -15.149 -5.016 1.00 54.41 C ATOM 284 O VAL A 18 -0.421 -14.779 -4.840 1.00 64.11 O ATOM 285 CB VAL A 18 -3.299 -14.641 -3.099 1.00 73.42 C ATOM 286 CG1 VAL A 18 -3.523 -13.398 -3.961 1.00 43.22 C ATOM 287 CG2 VAL A 18 -4.677 -15.228 -2.833 1.00 21.22 C ATOM 0 H VAL A 18 -1.581 -16.270 -1.997 1.00 65.44 H new ATOM 0 HA VAL A 18 -3.173 -16.378 -4.309 1.00 4.33 H new ATOM 0 HB VAL A 18 -2.770 -14.371 -2.185 1.00 73.42 H new ATOM 0 HG11 VAL A 18 -4.125 -12.676 -3.409 1.00 43.22 H new ATOM 0 HG12 VAL A 18 -2.561 -12.952 -4.213 1.00 43.22 H new ATOM 0 HG13 VAL A 18 -4.043 -13.679 -4.877 1.00 43.22 H new ATOM 0 HG21 VAL A 18 -5.290 -14.494 -2.310 1.00 21.22 H new ATOM 0 HG22 VAL A 18 -5.151 -15.488 -3.780 1.00 21.22 H new ATOM 0 HG23 VAL A 18 -4.579 -16.123 -2.218 1.00 21.22 H new ATOM 297 N ALA A 19 -2.199 -15.119 -6.191 1.00 21.33 N ATOM 298 CA ALA A 19 -1.529 -14.737 -7.407 1.00 24.33 C ATOM 299 C ALA A 19 -1.262 -13.237 -7.492 1.00 1.22 C ATOM 300 O ALA A 19 -2.182 -12.413 -7.547 1.00 5.43 O ATOM 301 CB ALA A 19 -2.309 -15.221 -8.621 1.00 21.20 C ATOM 0 H ALA A 19 -3.181 -15.363 -6.322 1.00 21.33 H new ATOM 0 HA ALA A 19 -0.553 -15.223 -7.396 1.00 24.33 H new ATOM 0 HB1 ALA A 19 -1.788 -14.923 -9.531 1.00 21.20 H new ATOM 0 HB2 ALA A 19 -2.393 -16.307 -8.590 1.00 21.20 H new ATOM 0 HB3 ALA A 19 -3.306 -14.780 -8.613 1.00 21.20 H new ATOM 307 N ARG A 20 0.002 -12.919 -7.535 1.00 60.22 N ATOM 308 CA ARG A 20 0.524 -11.565 -7.657 1.00 31.41 C ATOM 309 C ARG A 20 0.213 -11.002 -9.058 1.00 14.12 C ATOM 310 O ARG A 20 0.210 -9.799 -9.277 1.00 43.14 O ATOM 311 CB ARG A 20 2.037 -11.652 -7.324 1.00 25.51 C ATOM 312 CG ARG A 20 2.957 -10.411 -7.443 1.00 4.51 C ATOM 313 CD ARG A 20 3.241 -9.995 -8.867 1.00 54.11 C ATOM 314 NE ARG A 20 4.531 -9.321 -8.955 1.00 74.43 N ATOM 315 CZ ARG A 20 5.134 -8.981 -10.085 1.00 2.15 C ATOM 316 NH1 ARG A 20 4.487 -9.052 -11.245 1.00 32.20 N ATOM 317 NH2 ARG A 20 6.375 -8.549 -10.054 1.00 74.30 N ATOM 0 H ARG A 20 0.739 -13.622 -7.484 1.00 60.22 H new ATOM 0 HA ARG A 20 0.055 -10.863 -6.967 1.00 31.41 H new ATOM 0 HB2 ARG A 20 2.117 -12.010 -6.298 1.00 25.51 H new ATOM 0 HB3 ARG A 20 2.460 -12.425 -7.966 1.00 25.51 H new ATOM 0 HG2 ARG A 20 2.495 -9.576 -6.916 1.00 4.51 H new ATOM 0 HG3 ARG A 20 3.901 -10.621 -6.941 1.00 4.51 H new ATOM 0 HD2 ARG A 20 3.237 -10.871 -9.516 1.00 54.11 H new ATOM 0 HD3 ARG A 20 2.453 -9.332 -9.222 1.00 54.11 H new ATOM 0 HE ARG A 20 5.005 -9.094 -8.081 1.00 74.43 H new ATOM 0 HH11 ARG A 20 3.518 -9.370 -11.270 1.00 32.20 H new ATOM 0 HH12 ARG A 20 4.960 -8.788 -12.110 1.00 32.20 H new ATOM 0 HH21 ARG A 20 6.868 -8.477 -9.164 1.00 74.30 H new ATOM 0 HH22 ARG A 20 6.845 -8.286 -10.920 1.00 74.30 H new ATOM 331 N ALA A 21 -0.041 -11.882 -9.987 1.00 11.03 N ATOM 332 CA ALA A 21 -0.436 -11.486 -11.329 1.00 53.40 C ATOM 333 C ALA A 21 -1.941 -11.189 -11.408 1.00 52.53 C ATOM 334 O ALA A 21 -2.426 -10.639 -12.404 1.00 45.12 O ATOM 335 CB ALA A 21 -0.069 -12.569 -12.320 1.00 24.44 C ATOM 0 H ALA A 21 0.017 -12.891 -9.846 1.00 11.03 H new ATOM 0 HA ALA A 21 0.100 -10.570 -11.579 1.00 53.40 H new ATOM 0 HB1 ALA A 21 -0.369 -12.262 -13.322 1.00 24.44 H new ATOM 0 HB2 ALA A 21 1.008 -12.732 -12.298 1.00 24.44 H new ATOM 0 HB3 ALA A 21 -0.582 -13.494 -12.055 1.00 24.44 H new ATOM 341 N ASN A 22 -2.676 -11.553 -10.362 1.00 62.10 N ATOM 342 CA ASN A 22 -4.139 -11.435 -10.376 1.00 11.03 C ATOM 343 C ASN A 22 -4.588 -10.280 -9.456 1.00 63.02 C ATOM 344 O ASN A 22 -5.777 -9.985 -9.334 1.00 34.11 O ATOM 345 CB ASN A 22 -4.755 -12.786 -9.908 1.00 2.32 C ATOM 346 CG ASN A 22 -6.253 -12.947 -10.201 1.00 55.43 C ATOM 347 OD1 ASN A 22 -7.087 -12.641 -9.255 1.00 33.13 O flip ATOM 348 ND2 ASN A 22 -6.642 -13.400 -11.273 1.00 63.33 N flip ATOM 0 H ASN A 22 -2.290 -11.931 -9.497 1.00 62.10 H new ATOM 0 HA ASN A 22 -4.484 -11.212 -11.386 1.00 11.03 H new ATOM 0 HB2 ASN A 22 -4.215 -13.601 -10.390 1.00 2.32 H new ATOM 0 HB3 ASN A 22 -4.596 -12.889 -8.835 1.00 2.32 H new ATOM 0 HD21 ASN A 22 -5.968 -13.634 -12.003 1.00 63.33 H new ATOM 0 HD22 ASN A 22 -7.639 -13.543 -11.435 1.00 63.33 H new ATOM 355 N VAL A 23 -3.630 -9.615 -8.843 1.00 54.31 N ATOM 356 CA VAL A 23 -3.909 -8.541 -7.887 1.00 41.54 C ATOM 357 C VAL A 23 -3.878 -7.155 -8.545 1.00 45.03 C ATOM 358 O VAL A 23 -3.104 -6.903 -9.472 1.00 52.23 O ATOM 359 CB VAL A 23 -2.936 -8.596 -6.650 1.00 40.14 C ATOM 360 CG1 VAL A 23 -1.512 -8.658 -7.102 1.00 14.04 C ATOM 361 CG2 VAL A 23 -3.101 -7.385 -5.750 1.00 65.34 C ATOM 0 H VAL A 23 -2.637 -9.796 -8.987 1.00 54.31 H new ATOM 0 HA VAL A 23 -4.924 -8.706 -7.525 1.00 41.54 H new ATOM 0 HB VAL A 23 -3.192 -9.494 -6.088 1.00 40.14 H new ATOM 0 HG11 VAL A 23 -0.856 -8.695 -6.233 1.00 14.04 H new ATOM 0 HG12 VAL A 23 -1.361 -9.551 -7.709 1.00 14.04 H new ATOM 0 HG13 VAL A 23 -1.279 -7.773 -7.694 1.00 14.04 H new ATOM 0 HG21 VAL A 23 -2.412 -7.461 -4.908 1.00 65.34 H new ATOM 0 HG22 VAL A 23 -2.884 -6.479 -6.316 1.00 65.34 H new ATOM 0 HG23 VAL A 23 -4.125 -7.345 -5.378 1.00 65.34 H new ATOM 371 N LYS A 24 -4.756 -6.283 -8.084 1.00 52.53 N ATOM 372 CA LYS A 24 -4.819 -4.928 -8.566 1.00 61.03 C ATOM 373 C LYS A 24 -3.954 -4.000 -7.715 1.00 11.14 C ATOM 374 O LYS A 24 -3.127 -3.262 -8.219 1.00 22.54 O ATOM 375 CB LYS A 24 -6.252 -4.430 -8.518 1.00 3.11 C ATOM 376 CG LYS A 24 -7.202 -5.228 -9.377 1.00 41.54 C ATOM 377 CD LYS A 24 -8.640 -4.799 -9.172 1.00 25.40 C ATOM 378 CE LYS A 24 -8.840 -3.365 -9.518 1.00 31.35 C ATOM 379 NZ LYS A 24 -8.570 -3.070 -10.960 1.00 33.04 N ATOM 0 H LYS A 24 -5.444 -6.501 -7.363 1.00 52.53 H new ATOM 0 HA LYS A 24 -4.448 -4.922 -9.591 1.00 61.03 H new ATOM 0 HB2 LYS A 24 -6.601 -4.455 -7.486 1.00 3.11 H new ATOM 0 HB3 LYS A 24 -6.276 -3.388 -8.837 1.00 3.11 H new ATOM 0 HG2 LYS A 24 -6.933 -5.107 -10.426 1.00 41.54 H new ATOM 0 HG3 LYS A 24 -7.102 -6.288 -9.142 1.00 41.54 H new ATOM 0 HD2 LYS A 24 -9.295 -5.417 -9.786 1.00 25.40 H new ATOM 0 HD3 LYS A 24 -8.925 -4.966 -8.133 1.00 25.40 H new ATOM 0 HE2 LYS A 24 -9.864 -3.079 -9.280 1.00 31.35 H new ATOM 0 HE3 LYS A 24 -8.185 -2.752 -8.898 1.00 31.35 H new ATOM 0 HZ1 LYS A 24 -7.759 -2.424 -11.036 1.00 33.04 H new ATOM 0 HZ2 LYS A 24 -8.356 -3.956 -11.461 1.00 33.04 H new ATOM 0 HZ3 LYS A 24 -9.408 -2.625 -11.386 1.00 33.04 H new ATOM 393 N HIS A 25 -4.167 -4.055 -6.414 1.00 62.53 N ATOM 394 CA HIS A 25 -3.490 -3.180 -5.463 1.00 71.33 C ATOM 395 C HIS A 25 -3.631 -3.725 -4.068 1.00 31.11 C ATOM 396 O HIS A 25 -4.449 -4.623 -3.841 1.00 5.04 O ATOM 397 CB HIS A 25 -4.027 -1.728 -5.526 1.00 70.33 C ATOM 398 CG HIS A 25 -5.516 -1.556 -5.326 1.00 33.32 C ATOM 399 ND1 HIS A 25 -6.336 -2.492 -4.721 1.00 42.34 N ATOM 400 CD2 HIS A 25 -6.332 -0.553 -5.703 1.00 45.20 C ATOM 401 CE1 HIS A 25 -7.578 -2.074 -4.757 1.00 51.22 C ATOM 402 NE2 HIS A 25 -7.602 -0.903 -5.340 1.00 74.54 N ATOM 0 H HIS A 25 -4.817 -4.710 -5.980 1.00 62.53 H new ATOM 0 HA HIS A 25 -2.435 -3.151 -5.737 1.00 71.33 H new ATOM 0 HB2 HIS A 25 -3.510 -1.139 -4.769 1.00 70.33 H new ATOM 0 HB3 HIS A 25 -3.761 -1.306 -6.495 1.00 70.33 H new ATOM 0 HD2 HIS A 25 -6.037 0.359 -6.200 1.00 45.20 H new ATOM 0 HE1 HIS A 25 -8.435 -2.606 -4.371 1.00 51.22 H new ATOM 0 HE2 HIS A 25 -8.437 -0.340 -5.499 1.00 74.54 H new ATOM 411 N LEU A 26 -2.894 -3.158 -3.148 1.00 62.33 N ATOM 412 CA LEU A 26 -2.870 -3.611 -1.770 1.00 42.44 C ATOM 413 C LEU A 26 -3.369 -2.502 -0.831 1.00 64.13 C ATOM 414 O LEU A 26 -3.228 -1.335 -1.135 1.00 60.41 O ATOM 415 CB LEU A 26 -1.419 -3.953 -1.389 1.00 61.10 C ATOM 416 CG LEU A 26 -0.698 -4.997 -2.256 1.00 12.32 C ATOM 417 CD1 LEU A 26 0.730 -5.182 -1.787 1.00 63.14 C ATOM 418 CD2 LEU A 26 -1.429 -6.320 -2.226 1.00 64.12 C ATOM 0 H LEU A 26 -2.285 -2.360 -3.330 1.00 62.33 H new ATOM 0 HA LEU A 26 -3.516 -4.483 -1.672 1.00 42.44 H new ATOM 0 HB2 LEU A 26 -0.836 -3.032 -1.413 1.00 61.10 H new ATOM 0 HB3 LEU A 26 -1.414 -4.307 -0.358 1.00 61.10 H new ATOM 0 HG LEU A 26 -0.687 -4.632 -3.283 1.00 12.32 H new ATOM 0 HD11 LEU A 26 1.225 -5.925 -2.412 1.00 63.14 H new ATOM 0 HD12 LEU A 26 1.262 -4.234 -1.859 1.00 63.14 H new ATOM 0 HD13 LEU A 26 0.732 -5.521 -0.751 1.00 63.14 H new ATOM 0 HD21 LEU A 26 -0.899 -7.042 -2.847 1.00 64.12 H new ATOM 0 HD22 LEU A 26 -1.475 -6.687 -1.201 1.00 64.12 H new ATOM 0 HD23 LEU A 26 -2.441 -6.185 -2.609 1.00 64.12 H new ATOM 430 N LYS A 27 -3.973 -2.879 0.272 1.00 63.33 N ATOM 431 CA LYS A 27 -4.334 -1.949 1.323 1.00 14.04 C ATOM 432 C LYS A 27 -3.686 -2.410 2.582 1.00 62.25 C ATOM 433 O LYS A 27 -3.967 -3.506 3.045 1.00 13.14 O ATOM 434 CB LYS A 27 -5.844 -1.834 1.529 1.00 71.12 C ATOM 435 CG LYS A 27 -6.183 -0.810 2.599 1.00 42.50 C ATOM 436 CD LYS A 27 -7.603 -0.325 2.541 1.00 51.02 C ATOM 437 CE LYS A 27 -8.652 -1.350 2.908 1.00 32.22 C ATOM 438 NZ LYS A 27 -8.800 -2.486 1.953 1.00 54.11 N ATOM 0 H LYS A 27 -4.231 -3.846 0.469 1.00 63.33 H new ATOM 0 HA LYS A 27 -3.990 -0.956 1.034 1.00 14.04 H new ATOM 0 HB2 LYS A 27 -6.320 -1.552 0.590 1.00 71.12 H new ATOM 0 HB3 LYS A 27 -6.249 -2.806 1.812 1.00 71.12 H new ATOM 0 HG2 LYS A 27 -5.997 -1.247 3.580 1.00 42.50 H new ATOM 0 HG3 LYS A 27 -5.512 0.043 2.498 1.00 42.50 H new ATOM 0 HD2 LYS A 27 -7.705 0.530 3.209 1.00 51.02 H new ATOM 0 HD3 LYS A 27 -7.806 0.033 1.532 1.00 51.02 H new ATOM 0 HE2 LYS A 27 -8.412 -1.754 3.892 1.00 32.22 H new ATOM 0 HE3 LYS A 27 -9.614 -0.845 2.997 1.00 32.22 H new ATOM 0 HZ1 LYS A 27 -9.805 -2.737 1.866 1.00 54.11 H new ATOM 0 HZ2 LYS A 27 -8.431 -2.207 1.022 1.00 54.11 H new ATOM 0 HZ3 LYS A 27 -8.267 -3.307 2.305 1.00 54.11 H new ATOM 452 N ILE A 28 -2.826 -1.601 3.126 1.00 42.34 N ATOM 453 CA ILE A 28 -2.090 -1.968 4.301 1.00 73.13 C ATOM 454 C ILE A 28 -2.619 -1.194 5.483 1.00 63.22 C ATOM 455 O ILE A 28 -2.871 0.030 5.384 1.00 43.23 O ATOM 456 CB ILE A 28 -0.578 -1.648 4.174 1.00 20.35 C ATOM 457 CG1 ILE A 28 0.000 -2.189 2.864 1.00 53.43 C ATOM 458 CG2 ILE A 28 0.185 -2.257 5.356 1.00 4.14 C ATOM 459 CD1 ILE A 28 1.471 -1.881 2.695 1.00 1.15 C ATOM 0 H ILE A 28 -2.614 -0.669 2.769 1.00 42.34 H new ATOM 0 HA ILE A 28 -2.213 -3.043 4.431 1.00 73.13 H new ATOM 0 HB ILE A 28 -0.465 -0.564 4.177 1.00 20.35 H new ATOM 0 HG12 ILE A 28 -0.146 -3.269 2.827 1.00 53.43 H new ATOM 0 HG13 ILE A 28 -0.553 -1.764 2.026 1.00 53.43 H new ATOM 0 HG21 ILE A 28 1.246 -2.028 5.260 1.00 4.14 H new ATOM 0 HG22 ILE A 28 -0.194 -1.838 6.288 1.00 4.14 H new ATOM 0 HG23 ILE A 28 0.046 -3.338 5.361 1.00 4.14 H new ATOM 0 HD11 ILE A 28 1.822 -2.290 1.748 1.00 1.15 H new ATOM 0 HD12 ILE A 28 1.620 -0.801 2.701 1.00 1.15 H new ATOM 0 HD13 ILE A 28 2.033 -2.329 3.514 1.00 1.15 H new ATOM 471 N LEU A 29 -2.810 -1.881 6.566 1.00 24.51 N ATOM 472 CA LEU A 29 -3.201 -1.271 7.787 1.00 32.24 C ATOM 473 C LEU A 29 -2.500 -1.989 8.928 1.00 22.42 C ATOM 474 O LEU A 29 -2.426 -3.222 8.955 1.00 2.14 O ATOM 475 CB LEU A 29 -4.746 -1.237 7.915 1.00 2.43 C ATOM 476 CG LEU A 29 -5.333 -0.496 9.120 1.00 63.11 C ATOM 477 CD1 LEU A 29 -6.747 -0.140 8.824 1.00 32.30 C ATOM 478 CD2 LEU A 29 -5.337 -1.385 10.332 1.00 60.10 C ATOM 0 H LEU A 29 -2.696 -2.893 6.622 1.00 24.51 H new ATOM 0 HA LEU A 29 -2.893 -0.226 7.818 1.00 32.24 H new ATOM 0 HB2 LEU A 29 -5.150 -0.783 7.010 1.00 2.43 H new ATOM 0 HB3 LEU A 29 -5.105 -2.266 7.943 1.00 2.43 H new ATOM 0 HG LEU A 29 -4.729 0.391 9.310 1.00 63.11 H new ATOM 0 HD11 LEU A 29 -7.175 0.388 9.676 1.00 32.30 H new ATOM 0 HD12 LEU A 29 -6.784 0.501 7.943 1.00 32.30 H new ATOM 0 HD13 LEU A 29 -7.319 -1.048 8.636 1.00 32.30 H new ATOM 0 HD21 LEU A 29 -5.757 -0.843 11.179 1.00 60.10 H new ATOM 0 HD22 LEU A 29 -5.941 -2.270 10.132 1.00 60.10 H new ATOM 0 HD23 LEU A 29 -4.316 -1.687 10.565 1.00 60.10 H new ATOM 490 N ASN A 30 -1.958 -1.228 9.834 1.00 63.41 N ATOM 491 CA ASN A 30 -1.192 -1.776 10.924 1.00 72.43 C ATOM 492 C ASN A 30 -1.972 -1.699 12.223 1.00 12.42 C ATOM 493 O ASN A 30 -2.220 -0.606 12.749 1.00 72.35 O ATOM 494 CB ASN A 30 0.137 -1.027 11.054 1.00 1.23 C ATOM 495 CG ASN A 30 1.037 -1.602 12.118 1.00 32.34 C ATOM 496 OD1 ASN A 30 1.830 -2.479 11.849 1.00 64.50 O ATOM 497 ND2 ASN A 30 0.942 -1.095 13.307 1.00 72.13 N ATOM 0 H ASN A 30 -2.032 -0.211 9.841 1.00 63.41 H new ATOM 0 HA ASN A 30 -0.989 -2.826 10.714 1.00 72.43 H new ATOM 0 HB2 ASN A 30 0.656 -1.050 10.096 1.00 1.23 H new ATOM 0 HB3 ASN A 30 -0.063 0.020 11.282 1.00 1.23 H new ATOM 0 HD21 ASN A 30 1.547 -1.433 14.055 1.00 72.13 H new ATOM 0 HD22 ASN A 30 0.262 -0.358 13.494 1.00 72.13 H new ATOM 504 N THR A 31 -2.362 -2.846 12.726 1.00 12.41 N ATOM 505 CA THR A 31 -3.116 -2.931 13.954 1.00 40.40 C ATOM 506 C THR A 31 -2.208 -3.300 15.130 1.00 13.32 C ATOM 507 O THR A 31 -1.143 -3.878 14.933 1.00 35.41 O ATOM 508 CB THR A 31 -4.239 -3.986 13.828 1.00 65.24 C ATOM 509 OG1 THR A 31 -3.694 -5.242 13.374 1.00 62.51 O ATOM 510 CG2 THR A 31 -5.321 -3.523 12.879 1.00 12.42 C ATOM 0 H THR A 31 -2.165 -3.749 12.294 1.00 12.41 H new ATOM 0 HA THR A 31 -3.557 -1.952 14.140 1.00 40.40 H new ATOM 0 HB THR A 31 -4.684 -4.121 14.814 1.00 65.24 H new ATOM 0 HG1 THR A 31 -2.790 -5.356 13.735 1.00 62.51 H new ATOM 0 HG21 THR A 31 -6.096 -4.286 12.811 1.00 12.42 H new ATOM 0 HG22 THR A 31 -5.757 -2.595 13.249 1.00 12.42 H new ATOM 0 HG23 THR A 31 -4.891 -3.354 11.892 1.00 12.42 H new ATOM 518 N PRO A 32 -2.608 -2.966 16.366 1.00 73.20 N ATOM 519 CA PRO A 32 -1.836 -3.334 17.549 1.00 13.03 C ATOM 520 C PRO A 32 -2.165 -4.759 18.021 1.00 42.42 C ATOM 521 O PRO A 32 -1.410 -5.369 18.786 1.00 42.03 O ATOM 522 CB PRO A 32 -2.293 -2.308 18.587 1.00 14.32 C ATOM 523 CG PRO A 32 -3.701 -1.968 18.206 1.00 14.10 C ATOM 524 CD PRO A 32 -3.810 -2.160 16.710 1.00 31.55 C ATOM 0 HA PRO A 32 -0.761 -3.330 17.368 1.00 13.03 H new ATOM 0 HB2 PRO A 32 -2.246 -2.719 19.595 1.00 14.32 H new ATOM 0 HB3 PRO A 32 -1.656 -1.423 18.574 1.00 14.32 H new ATOM 0 HG2 PRO A 32 -4.409 -2.610 18.730 1.00 14.10 H new ATOM 0 HG3 PRO A 32 -3.938 -0.940 18.482 1.00 14.10 H new ATOM 0 HD2 PRO A 32 -4.730 -2.678 16.439 1.00 31.55 H new ATOM 0 HD3 PRO A 32 -3.815 -1.205 16.184 1.00 31.55 H new ATOM 532 N ASN A 33 -3.281 -5.285 17.535 1.00 72.24 N ATOM 533 CA ASN A 33 -3.765 -6.610 17.941 1.00 71.33 C ATOM 534 C ASN A 33 -3.186 -7.709 17.069 1.00 42.31 C ATOM 535 O ASN A 33 -3.115 -8.867 17.475 1.00 61.23 O ATOM 536 CB ASN A 33 -5.310 -6.674 17.901 1.00 35.13 C ATOM 537 CG ASN A 33 -5.974 -5.730 18.890 1.00 62.31 C ATOM 538 OD1 ASN A 33 -5.427 -5.443 19.945 1.00 61.41 O ATOM 539 ND2 ASN A 33 -7.155 -5.248 18.562 1.00 71.43 N ATOM 0 H ASN A 33 -3.877 -4.815 16.853 1.00 72.24 H new ATOM 0 HA ASN A 33 -3.429 -6.770 18.965 1.00 71.33 H new ATOM 0 HB2 ASN A 33 -5.651 -6.434 16.894 1.00 35.13 H new ATOM 0 HB3 ASN A 33 -5.631 -7.694 18.111 1.00 35.13 H new ATOM 0 HD21 ASN A 33 -7.641 -4.615 19.196 1.00 71.43 H new ATOM 0 HD22 ASN A 33 -7.583 -5.508 17.673 1.00 71.43 H new ATOM 546 N CYS A 34 -2.780 -7.353 15.879 1.00 51.31 N ATOM 547 CA CYS A 34 -2.259 -8.313 14.938 1.00 32.33 C ATOM 548 C CYS A 34 -1.177 -7.615 14.099 1.00 54.51 C ATOM 549 O CYS A 34 -1.338 -6.440 13.768 1.00 44.33 O ATOM 550 CB CYS A 34 -3.428 -8.833 14.084 1.00 30.41 C ATOM 551 SG CYS A 34 -3.060 -10.235 12.969 1.00 71.44 S ATOM 0 H CYS A 34 -2.800 -6.393 15.534 1.00 51.31 H new ATOM 0 HA CYS A 34 -1.801 -9.171 15.430 1.00 32.33 H new ATOM 0 HB2 CYS A 34 -4.234 -9.132 14.754 1.00 30.41 H new ATOM 0 HB3 CYS A 34 -3.805 -8.007 13.481 1.00 30.41 H new ATOM 556 N ALA A 35 -0.107 -8.344 13.757 1.00 70.51 N ATOM 557 CA ALA A 35 1.117 -7.793 13.109 1.00 23.42 C ATOM 558 C ALA A 35 0.886 -6.781 11.953 1.00 24.13 C ATOM 559 O ALA A 35 0.965 -5.575 12.163 1.00 51.13 O ATOM 560 CB ALA A 35 2.041 -8.911 12.670 1.00 31.52 C ATOM 0 H ALA A 35 -0.054 -9.350 13.920 1.00 70.51 H new ATOM 0 HA ALA A 35 1.587 -7.197 13.891 1.00 23.42 H new ATOM 0 HB1 ALA A 35 2.928 -8.486 12.200 1.00 31.52 H new ATOM 0 HB2 ALA A 35 2.337 -9.500 13.538 1.00 31.52 H new ATOM 0 HB3 ALA A 35 1.523 -9.552 11.956 1.00 31.52 H new ATOM 566 N CYS A 36 0.624 -7.256 10.760 1.00 55.12 N ATOM 567 CA CYS A 36 0.444 -6.356 9.615 1.00 70.22 C ATOM 568 C CYS A 36 -0.662 -6.919 8.740 1.00 54.24 C ATOM 569 O CYS A 36 -0.798 -8.143 8.633 1.00 24.40 O ATOM 570 CB CYS A 36 1.789 -6.190 8.834 1.00 44.53 C ATOM 571 SG CYS A 36 1.775 -4.958 7.478 1.00 74.04 S ATOM 0 H CYS A 36 0.529 -8.248 10.543 1.00 55.12 H new ATOM 0 HA CYS A 36 0.156 -5.360 9.950 1.00 70.22 H new ATOM 0 HB2 CYS A 36 2.568 -5.912 9.544 1.00 44.53 H new ATOM 0 HB3 CYS A 36 2.068 -7.158 8.418 1.00 44.53 H new ATOM 576 N GLN A 37 -1.474 -6.053 8.157 1.00 52.41 N ATOM 577 CA GLN A 37 -2.644 -6.488 7.399 1.00 60.43 C ATOM 578 C GLN A 37 -2.563 -5.919 5.998 1.00 64.42 C ATOM 579 O GLN A 37 -2.498 -4.695 5.833 1.00 53.44 O ATOM 580 CB GLN A 37 -3.913 -5.933 8.073 1.00 34.10 C ATOM 581 CG GLN A 37 -3.923 -6.121 9.578 1.00 11.15 C ATOM 582 CD GLN A 37 -3.926 -7.561 10.019 1.00 34.14 C ATOM 583 OE1 GLN A 37 -4.490 -8.429 9.380 1.00 12.34 O ATOM 584 NE2 GLN A 37 -3.257 -7.822 11.091 1.00 52.34 N ATOM 0 H GLN A 37 -1.347 -5.042 8.192 1.00 52.41 H new ATOM 0 HA GLN A 37 -2.676 -7.577 7.366 1.00 60.43 H new ATOM 0 HB2 GLN A 37 -4.002 -4.871 7.846 1.00 34.10 H new ATOM 0 HB3 GLN A 37 -4.787 -6.424 7.646 1.00 34.10 H new ATOM 0 HG2 GLN A 37 -3.050 -5.625 10.001 1.00 11.15 H new ATOM 0 HG3 GLN A 37 -4.802 -5.625 9.989 1.00 11.15 H new ATOM 0 HE21 GLN A 37 -2.797 -7.068 11.601 1.00 52.34 H new ATOM 0 HE22 GLN A 37 -3.188 -8.782 11.428 1.00 52.34 H new ATOM 593 N ILE A 38 -2.541 -6.778 4.996 1.00 63.22 N ATOM 594 CA ILE A 38 -2.509 -6.317 3.622 1.00 54.11 C ATOM 595 C ILE A 38 -3.657 -6.932 2.840 1.00 64.03 C ATOM 596 O ILE A 38 -3.695 -8.125 2.634 1.00 41.22 O ATOM 597 CB ILE A 38 -1.163 -6.651 2.909 1.00 2.14 C ATOM 598 CG1 ILE A 38 0.016 -6.043 3.687 1.00 1.33 C ATOM 599 CG2 ILE A 38 -1.187 -6.115 1.487 1.00 0.10 C ATOM 600 CD1 ILE A 38 1.358 -6.218 3.016 1.00 51.22 C ATOM 0 H ILE A 38 -2.545 -7.792 5.107 1.00 63.22 H new ATOM 0 HA ILE A 38 -2.608 -5.232 3.650 1.00 54.11 H new ATOM 0 HB ILE A 38 -1.037 -7.733 2.878 1.00 2.14 H new ATOM 0 HG12 ILE A 38 -0.169 -4.979 3.831 1.00 1.33 H new ATOM 0 HG13 ILE A 38 0.056 -6.497 4.677 1.00 1.33 H new ATOM 0 HG21 ILE A 38 -0.244 -6.351 0.993 1.00 0.10 H new ATOM 0 HG22 ILE A 38 -2.009 -6.575 0.939 1.00 0.10 H new ATOM 0 HG23 ILE A 38 -1.325 -5.034 1.508 1.00 0.10 H new ATOM 0 HD11 ILE A 38 2.134 -5.761 3.630 1.00 51.22 H new ATOM 0 HD12 ILE A 38 1.569 -7.281 2.896 1.00 51.22 H new ATOM 0 HD13 ILE A 38 1.341 -5.739 2.037 1.00 51.22 H new ATOM 612 N VAL A 39 -4.558 -6.116 2.371 1.00 62.41 N ATOM 613 CA VAL A 39 -5.718 -6.613 1.659 1.00 50.32 C ATOM 614 C VAL A 39 -5.607 -6.267 0.188 1.00 72.11 C ATOM 615 O VAL A 39 -5.420 -5.109 -0.179 1.00 30.13 O ATOM 616 CB VAL A 39 -7.039 -6.031 2.242 1.00 53.03 C ATOM 617 CG1 VAL A 39 -8.259 -6.590 1.510 1.00 44.24 C ATOM 618 CG2 VAL A 39 -7.136 -6.321 3.736 1.00 32.05 C ATOM 0 H VAL A 39 -4.518 -5.101 2.465 1.00 62.41 H new ATOM 0 HA VAL A 39 -5.747 -7.696 1.779 1.00 50.32 H new ATOM 0 HB VAL A 39 -7.024 -4.951 2.095 1.00 53.03 H new ATOM 0 HG11 VAL A 39 -9.167 -6.166 1.939 1.00 44.24 H new ATOM 0 HG12 VAL A 39 -8.201 -6.329 0.453 1.00 44.24 H new ATOM 0 HG13 VAL A 39 -8.281 -7.675 1.615 1.00 44.24 H new ATOM 0 HG21 VAL A 39 -8.065 -5.907 4.127 1.00 32.05 H new ATOM 0 HG22 VAL A 39 -7.121 -7.399 3.899 1.00 32.05 H new ATOM 0 HG23 VAL A 39 -6.291 -5.865 4.251 1.00 32.05 H new ATOM 628 N ALA A 40 -5.736 -7.261 -0.635 1.00 2.35 N ATOM 629 CA ALA A 40 -5.589 -7.129 -2.049 1.00 61.12 C ATOM 630 C ALA A 40 -6.910 -7.388 -2.746 1.00 71.52 C ATOM 631 O ALA A 40 -7.600 -8.379 -2.453 1.00 1.41 O ATOM 632 CB ALA A 40 -4.542 -8.128 -2.548 1.00 32.14 C ATOM 0 H ALA A 40 -5.952 -8.211 -0.333 1.00 2.35 H new ATOM 0 HA ALA A 40 -5.267 -6.113 -2.276 1.00 61.12 H new ATOM 0 HB1 ALA A 40 -4.429 -8.028 -3.628 1.00 32.14 H new ATOM 0 HB2 ALA A 40 -3.587 -7.927 -2.063 1.00 32.14 H new ATOM 0 HB3 ALA A 40 -4.864 -9.142 -2.309 1.00 32.14 H new ATOM 638 N ARG A 41 -7.284 -6.505 -3.640 1.00 3.33 N ATOM 639 CA ARG A 41 -8.427 -6.746 -4.445 1.00 0.05 C ATOM 640 C ARG A 41 -7.942 -7.297 -5.744 1.00 31.04 C ATOM 641 O ARG A 41 -7.015 -6.740 -6.360 1.00 53.14 O ATOM 642 CB ARG A 41 -9.274 -5.487 -4.679 1.00 23.30 C ATOM 643 CG ARG A 41 -10.455 -5.748 -5.615 1.00 44.45 C ATOM 644 CD ARG A 41 -11.307 -4.523 -5.853 1.00 1.12 C ATOM 645 NE ARG A 41 -12.349 -4.789 -6.860 1.00 73.12 N ATOM 646 CZ ARG A 41 -13.391 -3.990 -7.119 1.00 40.01 C ATOM 647 NH1 ARG A 41 -13.564 -2.870 -6.428 1.00 64.12 N ATOM 648 NH2 ARG A 41 -14.246 -4.310 -8.080 1.00 32.34 N ATOM 0 H ARG A 41 -6.807 -5.621 -3.818 1.00 3.33 H new ATOM 0 HA ARG A 41 -9.082 -7.448 -3.930 1.00 0.05 H new ATOM 0 HB2 ARG A 41 -9.646 -5.119 -3.723 1.00 23.30 H new ATOM 0 HB3 ARG A 41 -8.646 -4.702 -5.100 1.00 23.30 H new ATOM 0 HG2 ARG A 41 -10.079 -6.113 -6.571 1.00 44.45 H new ATOM 0 HG3 ARG A 41 -11.076 -6.539 -5.194 1.00 44.45 H new ATOM 0 HD2 ARG A 41 -11.772 -4.212 -4.917 1.00 1.12 H new ATOM 0 HD3 ARG A 41 -10.678 -3.698 -6.186 1.00 1.12 H new ATOM 0 HE ARG A 41 -12.270 -5.649 -7.402 1.00 73.12 H new ATOM 0 HH11 ARG A 41 -12.901 -2.615 -5.696 1.00 64.12 H new ATOM 0 HH12 ARG A 41 -14.360 -2.264 -6.629 1.00 64.12 H new ATOM 0 HH21 ARG A 41 -14.109 -5.164 -8.621 1.00 32.34 H new ATOM 0 HH22 ARG A 41 -15.041 -3.702 -8.279 1.00 32.34 H new ATOM 662 N LEU A 42 -8.513 -8.384 -6.135 1.00 11.04 N ATOM 663 CA LEU A 42 -8.147 -9.037 -7.347 1.00 23.31 C ATOM 664 C LEU A 42 -8.816 -8.353 -8.540 1.00 30.24 C ATOM 665 O LEU A 42 -9.887 -7.757 -8.399 1.00 50.52 O ATOM 666 CB LEU A 42 -8.488 -10.538 -7.300 1.00 64.23 C ATOM 667 CG LEU A 42 -7.791 -11.421 -6.218 1.00 63.54 C ATOM 668 CD1 LEU A 42 -6.278 -11.243 -6.212 1.00 10.45 C ATOM 669 CD2 LEU A 42 -8.370 -11.200 -4.838 1.00 62.31 C ATOM 0 H LEU A 42 -9.257 -8.851 -5.616 1.00 11.04 H new ATOM 0 HA LEU A 42 -7.067 -8.956 -7.466 1.00 23.31 H new ATOM 0 HB2 LEU A 42 -9.565 -10.630 -7.161 1.00 64.23 H new ATOM 0 HB3 LEU A 42 -8.255 -10.963 -8.276 1.00 64.23 H new ATOM 0 HG LEU A 42 -7.995 -12.455 -6.496 1.00 63.54 H new ATOM 0 HD11 LEU A 42 -5.840 -11.878 -5.442 1.00 10.45 H new ATOM 0 HD12 LEU A 42 -5.875 -11.522 -7.185 1.00 10.45 H new ATOM 0 HD13 LEU A 42 -6.035 -10.201 -6.004 1.00 10.45 H new ATOM 0 HD21 LEU A 42 -7.853 -11.836 -4.120 1.00 62.31 H new ATOM 0 HD22 LEU A 42 -8.244 -10.155 -4.554 1.00 62.31 H new ATOM 0 HD23 LEU A 42 -9.431 -11.449 -4.845 1.00 62.31 H new ATOM 681 N LYS A 43 -8.149 -8.427 -9.681 1.00 0.35 N ATOM 682 CA LYS A 43 -8.560 -7.804 -10.943 1.00 62.23 C ATOM 683 C LYS A 43 -10.044 -7.953 -11.302 1.00 70.22 C ATOM 684 O LYS A 43 -10.607 -9.059 -11.334 1.00 13.00 O ATOM 685 CB LYS A 43 -7.605 -8.202 -12.073 1.00 75.55 C ATOM 686 CG LYS A 43 -6.191 -7.645 -11.833 1.00 51.20 C ATOM 687 CD LYS A 43 -5.158 -8.127 -12.841 1.00 11.21 C ATOM 688 CE LYS A 43 -5.508 -7.757 -14.273 1.00 74.03 C ATOM 689 NZ LYS A 43 -4.473 -8.217 -15.225 1.00 13.43 N ATOM 0 H LYS A 43 -7.272 -8.941 -9.763 1.00 0.35 H new ATOM 0 HA LYS A 43 -8.472 -6.728 -10.791 1.00 62.23 H new ATOM 0 HB2 LYS A 43 -7.562 -9.288 -12.150 1.00 75.55 H new ATOM 0 HB3 LYS A 43 -7.988 -7.830 -13.023 1.00 75.55 H new ATOM 0 HG2 LYS A 43 -6.231 -6.556 -11.861 1.00 51.20 H new ATOM 0 HG3 LYS A 43 -5.866 -7.926 -10.832 1.00 51.20 H new ATOM 0 HD2 LYS A 43 -4.186 -7.702 -12.589 1.00 11.21 H new ATOM 0 HD3 LYS A 43 -5.062 -9.210 -12.765 1.00 11.21 H new ATOM 0 HE2 LYS A 43 -6.469 -8.198 -14.539 1.00 74.03 H new ATOM 0 HE3 LYS A 43 -5.621 -6.676 -14.352 1.00 74.03 H new ATOM 0 HZ1 LYS A 43 -4.746 -7.947 -16.192 1.00 13.43 H new ATOM 0 HZ2 LYS A 43 -3.562 -7.776 -14.987 1.00 13.43 H new ATOM 0 HZ3 LYS A 43 -4.383 -9.251 -15.167 1.00 13.43 H new ATOM 703 N ASN A 44 -10.643 -6.786 -11.565 1.00 55.22 N ATOM 704 CA ASN A 44 -12.066 -6.579 -11.855 1.00 23.42 C ATOM 705 C ASN A 44 -12.936 -6.957 -10.649 1.00 5.20 C ATOM 706 O ASN A 44 -13.094 -6.165 -9.720 1.00 20.25 O ATOM 707 CB ASN A 44 -12.536 -7.285 -13.160 1.00 23.12 C ATOM 708 CG ASN A 44 -13.949 -6.876 -13.620 1.00 42.41 C ATOM 709 OD1 ASN A 44 -14.806 -6.506 -12.831 1.00 2.35 O ATOM 710 ND2 ASN A 44 -14.188 -6.945 -14.890 1.00 12.25 N ATOM 0 H ASN A 44 -10.118 -5.912 -11.582 1.00 55.22 H new ATOM 0 HA ASN A 44 -12.194 -5.512 -12.039 1.00 23.42 H new ATOM 0 HB2 ASN A 44 -11.827 -7.062 -13.957 1.00 23.12 H new ATOM 0 HB3 ASN A 44 -12.513 -8.364 -13.006 1.00 23.12 H new ATOM 0 HD21 ASN A 44 -15.107 -6.688 -15.251 1.00 12.25 H new ATOM 0 HD22 ASN A 44 -13.458 -7.257 -15.530 1.00 12.25 H new ATOM 717 N ASN A 45 -13.445 -8.166 -10.646 1.00 74.05 N ATOM 718 CA ASN A 45 -14.279 -8.682 -9.574 1.00 31.13 C ATOM 719 C ASN A 45 -14.095 -10.150 -9.445 1.00 62.14 C ATOM 720 O ASN A 45 -14.727 -10.943 -10.145 1.00 23.52 O ATOM 721 CB ASN A 45 -15.783 -8.342 -9.724 1.00 3.32 C ATOM 722 CG ASN A 45 -16.121 -6.901 -9.393 1.00 54.12 C ATOM 723 OD1 ASN A 45 -16.423 -6.650 -8.136 1.00 4.34 O flip ATOM 724 ND2 ASN A 45 -16.107 -6.021 -10.253 1.00 15.34 N flip ATOM 0 H ASN A 45 -13.291 -8.835 -11.400 1.00 74.05 H new ATOM 0 HA ASN A 45 -13.947 -8.179 -8.666 1.00 31.13 H new ATOM 0 HB2 ASN A 45 -16.093 -8.552 -10.748 1.00 3.32 H new ATOM 0 HB3 ASN A 45 -16.361 -8.999 -9.075 1.00 3.32 H new ATOM 0 HD21 ASN A 45 -15.868 -6.254 -11.217 1.00 15.34 H new ATOM 0 HD22 ASN A 45 -16.334 -5.059 -10.002 1.00 15.34 H new ATOM 731 N ASN A 46 -13.209 -10.512 -8.597 1.00 65.10 N ATOM 732 CA ASN A 46 -12.898 -11.888 -8.354 1.00 0.33 C ATOM 733 C ASN A 46 -13.245 -12.199 -6.892 1.00 12.21 C ATOM 734 O ASN A 46 -14.323 -12.714 -6.608 1.00 21.43 O ATOM 735 CB ASN A 46 -11.418 -12.139 -8.747 1.00 25.12 C ATOM 736 CG ASN A 46 -10.906 -13.544 -8.538 1.00 71.31 C ATOM 737 OD1 ASN A 46 -10.333 -13.852 -7.508 1.00 31.31 O ATOM 738 ND2 ASN A 46 -11.094 -14.390 -9.511 1.00 5.30 N ATOM 0 H ASN A 46 -12.664 -9.857 -8.037 1.00 65.10 H new ATOM 0 HA ASN A 46 -13.485 -12.575 -8.964 1.00 0.33 H new ATOM 0 HB2 ASN A 46 -11.293 -11.881 -9.799 1.00 25.12 H new ATOM 0 HB3 ASN A 46 -10.790 -11.456 -8.175 1.00 25.12 H new ATOM 0 HD21 ASN A 46 -10.757 -15.349 -9.426 1.00 5.30 H new ATOM 0 HD22 ASN A 46 -11.579 -14.094 -10.358 1.00 5.30 H new ATOM 745 N ARG A 47 -12.363 -11.870 -5.980 1.00 2.54 N ATOM 746 CA ARG A 47 -12.665 -11.857 -4.562 1.00 40.34 C ATOM 747 C ARG A 47 -11.886 -10.703 -3.976 1.00 12.01 C ATOM 748 O ARG A 47 -11.241 -9.944 -4.718 1.00 72.40 O ATOM 749 CB ARG A 47 -12.212 -13.139 -3.792 1.00 70.43 C ATOM 750 CG ARG A 47 -12.731 -14.489 -4.260 1.00 62.01 C ATOM 751 CD ARG A 47 -11.973 -15.010 -5.451 1.00 43.15 C ATOM 752 NE ARG A 47 -12.374 -16.357 -5.847 1.00 4.32 N ATOM 753 CZ ARG A 47 -11.597 -17.209 -6.541 1.00 11.41 C ATOM 754 NH1 ARG A 47 -10.385 -16.831 -6.960 1.00 71.44 N ATOM 755 NH2 ARG A 47 -12.040 -18.425 -6.824 1.00 4.13 N ATOM 0 H ARG A 47 -11.404 -11.600 -6.200 1.00 2.54 H new ATOM 0 HA ARG A 47 -13.748 -11.787 -4.458 1.00 40.34 H new ATOM 0 HB2 ARG A 47 -11.123 -13.175 -3.820 1.00 70.43 H new ATOM 0 HB3 ARG A 47 -12.500 -13.017 -2.748 1.00 70.43 H new ATOM 0 HG2 ARG A 47 -12.658 -15.207 -3.443 1.00 62.01 H new ATOM 0 HG3 ARG A 47 -13.787 -14.402 -4.514 1.00 62.01 H new ATOM 0 HD2 ARG A 47 -12.121 -14.332 -6.292 1.00 43.15 H new ATOM 0 HD3 ARG A 47 -10.907 -15.008 -5.224 1.00 43.15 H new ATOM 0 HE ARG A 47 -13.306 -16.674 -5.580 1.00 4.32 H new ATOM 0 HH11 ARG A 47 -10.044 -15.892 -6.754 1.00 71.44 H new ATOM 0 HH12 ARG A 47 -9.801 -17.482 -7.486 1.00 71.44 H new ATOM 0 HH21 ARG A 47 -12.968 -18.714 -6.516 1.00 4.13 H new ATOM 0 HH22 ARG A 47 -11.453 -19.072 -7.350 1.00 4.13 H new ATOM 769 N GLN A 48 -11.949 -10.552 -2.692 1.00 54.53 N ATOM 770 CA GLN A 48 -11.071 -9.667 -2.001 1.00 40.24 C ATOM 771 C GLN A 48 -10.393 -10.523 -0.973 1.00 45.01 C ATOM 772 O GLN A 48 -11.051 -11.337 -0.317 1.00 12.14 O ATOM 773 CB GLN A 48 -11.806 -8.404 -1.442 1.00 22.33 C ATOM 774 CG GLN A 48 -12.866 -8.597 -0.346 1.00 21.13 C ATOM 775 CD GLN A 48 -12.300 -8.634 1.076 1.00 72.30 C ATOM 776 OE1 GLN A 48 -11.962 -9.681 1.614 1.00 60.21 O ATOM 777 NE2 GLN A 48 -12.206 -7.477 1.689 1.00 25.11 N ATOM 0 H GLN A 48 -12.613 -11.041 -2.092 1.00 54.53 H new ATOM 0 HA GLN A 48 -10.326 -9.215 -2.657 1.00 40.24 H new ATOM 0 HB2 GLN A 48 -11.048 -7.724 -1.054 1.00 22.33 H new ATOM 0 HB3 GLN A 48 -12.285 -7.901 -2.282 1.00 22.33 H new ATOM 0 HG2 GLN A 48 -13.594 -7.789 -0.414 1.00 21.13 H new ATOM 0 HG3 GLN A 48 -13.403 -9.526 -0.535 1.00 21.13 H new ATOM 0 HE21 GLN A 48 -12.496 -6.623 1.213 1.00 25.11 H new ATOM 0 HE22 GLN A 48 -11.843 -7.432 2.641 1.00 25.11 H new ATOM 786 N VAL A 49 -9.105 -10.432 -0.887 1.00 73.33 N ATOM 787 CA VAL A 49 -8.342 -11.346 -0.064 1.00 2.31 C ATOM 788 C VAL A 49 -7.216 -10.622 0.600 1.00 41.21 C ATOM 789 O VAL A 49 -6.824 -9.550 0.167 1.00 50.33 O ATOM 790 CB VAL A 49 -7.757 -12.561 -0.884 1.00 60.33 C ATOM 791 CG1 VAL A 49 -8.836 -13.335 -1.624 1.00 13.44 C ATOM 792 CG2 VAL A 49 -6.662 -12.132 -1.842 1.00 0.04 C ATOM 0 H VAL A 49 -8.546 -9.733 -1.376 1.00 73.33 H new ATOM 0 HA VAL A 49 -9.032 -11.746 0.680 1.00 2.31 H new ATOM 0 HB VAL A 49 -7.315 -13.231 -0.146 1.00 60.33 H new ATOM 0 HG11 VAL A 49 -8.381 -14.160 -2.172 1.00 13.44 H new ATOM 0 HG12 VAL A 49 -9.557 -13.729 -0.908 1.00 13.44 H new ATOM 0 HG13 VAL A 49 -9.345 -12.672 -2.323 1.00 13.44 H new ATOM 0 HG21 VAL A 49 -6.291 -13.002 -2.383 1.00 0.04 H new ATOM 0 HG22 VAL A 49 -7.062 -11.407 -2.551 1.00 0.04 H new ATOM 0 HG23 VAL A 49 -5.845 -11.678 -1.281 1.00 0.04 H new ATOM 802 N CYS A 50 -6.726 -11.167 1.646 1.00 51.32 N ATOM 803 CA CYS A 50 -5.603 -10.601 2.291 1.00 54.12 C ATOM 804 C CYS A 50 -4.390 -11.389 1.926 1.00 52.43 C ATOM 805 O CYS A 50 -4.468 -12.584 1.582 1.00 23.30 O ATOM 806 CB CYS A 50 -5.786 -10.565 3.794 1.00 4.53 C ATOM 807 SG CYS A 50 -4.285 -10.057 4.747 1.00 55.12 S ATOM 0 H CYS A 50 -7.089 -12.016 2.080 1.00 51.32 H new ATOM 0 HA CYS A 50 -5.486 -9.569 1.959 1.00 54.12 H new ATOM 0 HB2 CYS A 50 -6.599 -9.878 4.030 1.00 4.53 H new ATOM 0 HB3 CYS A 50 -6.096 -11.554 4.132 1.00 4.53 H new ATOM 812 N ILE A 51 -3.299 -10.733 1.946 1.00 4.45 N ATOM 813 CA ILE A 51 -2.075 -11.302 1.586 1.00 72.13 C ATOM 814 C ILE A 51 -1.217 -11.363 2.814 1.00 61.14 C ATOM 815 O ILE A 51 -1.310 -10.483 3.668 1.00 2.24 O ATOM 816 CB ILE A 51 -1.363 -10.420 0.548 1.00 4.04 C ATOM 817 CG1 ILE A 51 -2.293 -10.048 -0.606 1.00 33.03 C ATOM 818 CG2 ILE A 51 -0.159 -11.132 0.025 1.00 54.52 C ATOM 819 CD1 ILE A 51 -2.873 -11.232 -1.352 1.00 10.02 C ATOM 0 H ILE A 51 -3.236 -9.753 2.223 1.00 4.45 H new ATOM 0 HA ILE A 51 -2.243 -12.293 1.163 1.00 72.13 H new ATOM 0 HB ILE A 51 -1.059 -9.496 1.040 1.00 4.04 H new ATOM 0 HG12 ILE A 51 -3.112 -9.444 -0.216 1.00 33.03 H new ATOM 0 HG13 ILE A 51 -1.744 -9.424 -1.311 1.00 33.03 H new ATOM 0 HG21 ILE A 51 0.344 -10.504 -0.711 1.00 54.52 H new ATOM 0 HG22 ILE A 51 0.524 -11.345 0.848 1.00 54.52 H new ATOM 0 HG23 ILE A 51 -0.465 -12.067 -0.444 1.00 54.52 H new ATOM 0 HD11 ILE A 51 -3.520 -10.876 -2.153 1.00 10.02 H new ATOM 0 HD12 ILE A 51 -2.064 -11.826 -1.776 1.00 10.02 H new ATOM 0 HD13 ILE A 51 -3.453 -11.847 -0.664 1.00 10.02 H new ATOM 831 N ASP A 52 -0.409 -12.389 2.921 1.00 60.23 N ATOM 832 CA ASP A 52 0.507 -12.489 4.037 1.00 15.40 C ATOM 833 C ASP A 52 1.527 -11.367 3.898 1.00 44.13 C ATOM 834 O ASP A 52 2.195 -11.271 2.881 1.00 14.34 O ATOM 835 CB ASP A 52 1.221 -13.852 4.058 1.00 64.53 C ATOM 836 CG ASP A 52 2.077 -14.038 5.304 1.00 51.11 C ATOM 837 OD1 ASP A 52 1.518 -14.072 6.430 1.00 61.45 O ATOM 838 OD2 ASP A 52 3.303 -14.125 5.183 1.00 43.30 O ATOM 0 H ASP A 52 -0.364 -13.162 2.257 1.00 60.23 H new ATOM 0 HA ASP A 52 -0.045 -12.401 4.973 1.00 15.40 H new ATOM 0 HB2 ASP A 52 0.479 -14.649 4.008 1.00 64.53 H new ATOM 0 HB3 ASP A 52 1.849 -13.944 3.172 1.00 64.53 H new ATOM 843 N PRO A 53 1.654 -10.492 4.895 1.00 40.44 N ATOM 844 CA PRO A 53 2.572 -9.334 4.827 1.00 23.53 C ATOM 845 C PRO A 53 4.043 -9.749 4.863 1.00 31.25 C ATOM 846 O PRO A 53 4.946 -8.926 4.729 1.00 24.13 O ATOM 847 CB PRO A 53 2.216 -8.540 6.081 1.00 73.03 C ATOM 848 CG PRO A 53 1.642 -9.544 7.017 1.00 45.21 C ATOM 849 CD PRO A 53 0.909 -10.531 6.163 1.00 52.20 C ATOM 0 HA PRO A 53 2.459 -8.777 3.897 1.00 23.53 H new ATOM 0 HB2 PRO A 53 3.096 -8.059 6.508 1.00 73.03 H new ATOM 0 HB3 PRO A 53 1.498 -7.751 5.859 1.00 73.03 H new ATOM 0 HG2 PRO A 53 2.427 -10.034 7.594 1.00 45.21 H new ATOM 0 HG3 PRO A 53 0.969 -9.071 7.732 1.00 45.21 H new ATOM 0 HD2 PRO A 53 0.915 -11.528 6.604 1.00 52.20 H new ATOM 0 HD3 PRO A 53 -0.135 -10.249 6.026 1.00 52.20 H new ATOM 857 N LYS A 54 4.261 -11.018 5.036 1.00 33.44 N ATOM 858 CA LYS A 54 5.575 -11.582 5.105 1.00 50.33 C ATOM 859 C LYS A 54 5.847 -12.387 3.838 1.00 53.11 C ATOM 860 O LYS A 54 6.912 -12.954 3.668 1.00 33.34 O ATOM 861 CB LYS A 54 5.630 -12.485 6.321 1.00 21.11 C ATOM 862 CG LYS A 54 5.364 -11.763 7.629 1.00 61.53 C ATOM 863 CD LYS A 54 5.126 -12.719 8.795 1.00 42.13 C ATOM 864 CE LYS A 54 3.892 -13.585 8.545 1.00 62.42 C ATOM 865 NZ LYS A 54 3.527 -14.403 9.717 1.00 31.54 N ATOM 0 H LYS A 54 3.514 -11.705 5.135 1.00 33.44 H new ATOM 0 HA LYS A 54 6.329 -10.799 5.187 1.00 50.33 H new ATOM 0 HB2 LYS A 54 4.899 -13.285 6.202 1.00 21.11 H new ATOM 0 HB3 LYS A 54 6.612 -12.956 6.369 1.00 21.11 H new ATOM 0 HG2 LYS A 54 6.211 -11.118 7.861 1.00 61.53 H new ATOM 0 HG3 LYS A 54 4.494 -11.117 7.512 1.00 61.53 H new ATOM 0 HD2 LYS A 54 6.000 -13.355 8.933 1.00 42.13 H new ATOM 0 HD3 LYS A 54 4.996 -12.151 9.716 1.00 42.13 H new ATOM 0 HE2 LYS A 54 3.051 -12.945 8.277 1.00 62.42 H new ATOM 0 HE3 LYS A 54 4.078 -14.239 7.693 1.00 62.42 H new ATOM 0 HZ1 LYS A 54 2.685 -14.971 9.495 1.00 31.54 H new ATOM 0 HZ2 LYS A 54 4.317 -15.035 9.959 1.00 31.54 H new ATOM 0 HZ3 LYS A 54 3.322 -13.781 10.525 1.00 31.54 H new ATOM 879 N LEU A 55 4.869 -12.417 2.952 1.00 31.01 N ATOM 880 CA LEU A 55 4.947 -13.172 1.724 1.00 23.53 C ATOM 881 C LEU A 55 6.090 -12.652 0.859 1.00 22.14 C ATOM 882 O LEU A 55 6.267 -11.451 0.739 1.00 41.22 O ATOM 883 CB LEU A 55 3.639 -13.022 0.971 1.00 13.54 C ATOM 884 CG LEU A 55 3.032 -14.291 0.427 1.00 73.52 C ATOM 885 CD1 LEU A 55 1.717 -13.999 -0.248 1.00 62.03 C ATOM 886 CD2 LEU A 55 3.969 -15.003 -0.513 1.00 35.32 C ATOM 0 H LEU A 55 3.991 -11.911 3.070 1.00 31.01 H new ATOM 0 HA LEU A 55 5.129 -14.221 1.956 1.00 23.53 H new ATOM 0 HB2 LEU A 55 2.913 -12.553 1.636 1.00 13.54 H new ATOM 0 HB3 LEU A 55 3.800 -12.336 0.140 1.00 13.54 H new ATOM 0 HG LEU A 55 2.852 -14.958 1.270 1.00 73.52 H new ATOM 0 HD11 LEU A 55 1.293 -14.926 -0.635 1.00 62.03 H new ATOM 0 HD12 LEU A 55 1.028 -13.558 0.472 1.00 62.03 H new ATOM 0 HD13 LEU A 55 1.877 -13.302 -1.071 1.00 62.03 H new ATOM 0 HD21 LEU A 55 3.493 -15.912 -0.882 1.00 35.32 H new ATOM 0 HD22 LEU A 55 4.206 -14.351 -1.353 1.00 35.32 H new ATOM 0 HD23 LEU A 55 4.886 -15.263 0.015 1.00 35.32 H new ATOM 898 N LYS A 56 6.841 -13.569 0.253 1.00 25.45 N ATOM 899 CA LYS A 56 7.994 -13.227 -0.592 1.00 73.12 C ATOM 900 C LYS A 56 7.676 -12.157 -1.649 1.00 23.14 C ATOM 901 O LYS A 56 8.418 -11.181 -1.779 1.00 53.14 O ATOM 902 CB LYS A 56 8.587 -14.476 -1.262 1.00 50.03 C ATOM 903 CG LYS A 56 9.741 -14.177 -2.225 1.00 65.00 C ATOM 904 CD LYS A 56 10.928 -13.517 -1.527 1.00 2.02 C ATOM 905 CE LYS A 56 12.013 -13.129 -2.522 1.00 24.14 C ATOM 906 NZ LYS A 56 12.492 -14.281 -3.314 1.00 12.51 N ATOM 0 H LYS A 56 6.671 -14.572 0.331 1.00 25.45 H new ATOM 0 HA LYS A 56 8.736 -12.798 0.081 1.00 73.12 H new ATOM 0 HB2 LYS A 56 8.940 -15.158 -0.488 1.00 50.03 H new ATOM 0 HB3 LYS A 56 7.797 -14.993 -1.807 1.00 50.03 H new ATOM 0 HG2 LYS A 56 10.069 -15.105 -2.693 1.00 65.00 H new ATOM 0 HG3 LYS A 56 9.385 -13.526 -3.023 1.00 65.00 H new ATOM 0 HD2 LYS A 56 10.590 -12.630 -0.991 1.00 2.02 H new ATOM 0 HD3 LYS A 56 11.341 -14.200 -0.784 1.00 2.02 H new ATOM 0 HE2 LYS A 56 11.627 -12.364 -3.196 1.00 24.14 H new ATOM 0 HE3 LYS A 56 12.852 -12.687 -1.985 1.00 24.14 H new ATOM 0 HZ1 LYS A 56 13.329 -14.000 -3.864 1.00 12.51 H new ATOM 0 HZ2 LYS A 56 12.744 -15.061 -2.674 1.00 12.51 H new ATOM 0 HZ3 LYS A 56 11.741 -14.593 -3.962 1.00 12.51 H new ATOM 920 N TRP A 57 6.577 -12.319 -2.388 1.00 61.41 N ATOM 921 CA TRP A 57 6.254 -11.334 -3.408 1.00 52.41 C ATOM 922 C TRP A 57 5.882 -9.979 -2.813 1.00 11.15 C ATOM 923 O TRP A 57 6.090 -8.933 -3.439 1.00 4.32 O ATOM 924 CB TRP A 57 5.272 -11.838 -4.490 1.00 50.21 C ATOM 925 CG TRP A 57 3.898 -12.309 -4.054 1.00 64.21 C ATOM 926 CD1 TRP A 57 3.509 -13.589 -3.791 1.00 52.01 C ATOM 927 CD2 TRP A 57 2.725 -11.501 -3.901 1.00 51.35 C ATOM 928 NE1 TRP A 57 2.165 -13.619 -3.489 1.00 20.34 N ATOM 929 CE2 TRP A 57 1.664 -12.346 -3.550 1.00 15.10 C ATOM 930 CE3 TRP A 57 2.478 -10.151 -4.026 1.00 20.13 C ATOM 931 CZ2 TRP A 57 0.365 -11.858 -3.332 1.00 35.22 C ATOM 932 CZ3 TRP A 57 1.209 -9.678 -3.814 1.00 3.24 C ATOM 933 CH2 TRP A 57 0.174 -10.526 -3.473 1.00 2.31 C ATOM 0 H TRP A 57 5.920 -13.095 -2.302 1.00 61.41 H new ATOM 0 HA TRP A 57 7.180 -11.171 -3.959 1.00 52.41 H new ATOM 0 HB2 TRP A 57 5.133 -11.034 -5.213 1.00 50.21 H new ATOM 0 HB3 TRP A 57 5.753 -12.662 -5.017 1.00 50.21 H new ATOM 0 HD1 TRP A 57 4.158 -14.452 -3.816 1.00 52.01 H new ATOM 0 HE1 TRP A 57 1.629 -14.455 -3.257 1.00 20.34 H new ATOM 0 HE3 TRP A 57 3.276 -9.472 -4.288 1.00 20.13 H new ATOM 0 HZ2 TRP A 57 -0.447 -12.518 -3.063 1.00 35.22 H new ATOM 0 HZ3 TRP A 57 1.015 -8.620 -3.916 1.00 3.24 H new ATOM 0 HH2 TRP A 57 -0.812 -10.116 -3.315 1.00 2.31 H new ATOM 944 N ILE A 58 5.365 -10.013 -1.597 1.00 65.12 N ATOM 945 CA ILE A 58 5.072 -8.815 -0.829 1.00 43.43 C ATOM 946 C ILE A 58 6.370 -8.157 -0.366 1.00 45.52 C ATOM 947 O ILE A 58 6.512 -6.943 -0.452 1.00 35.03 O ATOM 948 CB ILE A 58 4.148 -9.138 0.394 1.00 30.30 C ATOM 949 CG1 ILE A 58 2.715 -9.394 -0.065 1.00 63.22 C ATOM 950 CG2 ILE A 58 4.185 -8.043 1.454 1.00 5.45 C ATOM 951 CD1 ILE A 58 2.023 -8.178 -0.625 1.00 2.10 C ATOM 0 H ILE A 58 5.135 -10.880 -1.111 1.00 65.12 H new ATOM 0 HA ILE A 58 4.536 -8.119 -1.474 1.00 43.43 H new ATOM 0 HB ILE A 58 4.537 -10.045 0.857 1.00 30.30 H new ATOM 0 HG12 ILE A 58 2.722 -10.177 -0.824 1.00 63.22 H new ATOM 0 HG13 ILE A 58 2.137 -9.772 0.778 1.00 63.22 H new ATOM 0 HG21 ILE A 58 3.528 -8.314 2.280 1.00 5.45 H new ATOM 0 HG22 ILE A 58 5.204 -7.928 1.823 1.00 5.45 H new ATOM 0 HG23 ILE A 58 3.849 -7.102 1.017 1.00 5.45 H new ATOM 0 HD11 ILE A 58 1.010 -8.443 -0.928 1.00 2.10 H new ATOM 0 HD12 ILE A 58 1.982 -7.400 0.137 1.00 2.10 H new ATOM 0 HD13 ILE A 58 2.576 -7.810 -1.489 1.00 2.10 H new ATOM 963 N GLN A 59 7.320 -8.982 0.099 1.00 13.20 N ATOM 964 CA GLN A 59 8.625 -8.500 0.582 1.00 0.31 C ATOM 965 C GLN A 59 9.290 -7.661 -0.492 1.00 41.32 C ATOM 966 O GLN A 59 9.665 -6.518 -0.256 1.00 61.14 O ATOM 967 CB GLN A 59 9.543 -9.691 0.921 1.00 31.24 C ATOM 968 CG GLN A 59 8.993 -10.652 1.965 1.00 53.13 C ATOM 969 CD GLN A 59 8.784 -10.019 3.316 1.00 23.43 C ATOM 970 OE1 GLN A 59 9.675 -10.026 4.150 1.00 61.25 O ATOM 971 NE2 GLN A 59 7.621 -9.469 3.544 1.00 12.13 N ATOM 0 H GLN A 59 7.208 -9.994 0.151 1.00 13.20 H new ATOM 0 HA GLN A 59 8.463 -7.900 1.478 1.00 0.31 H new ATOM 0 HB2 GLN A 59 9.742 -10.248 0.006 1.00 31.24 H new ATOM 0 HB3 GLN A 59 10.499 -9.304 1.273 1.00 31.24 H new ATOM 0 HG2 GLN A 59 8.044 -11.056 1.611 1.00 53.13 H new ATOM 0 HG3 GLN A 59 9.678 -11.493 2.069 1.00 53.13 H new ATOM 0 HE21 GLN A 59 6.900 -9.483 2.822 1.00 12.13 H new ATOM 0 HE22 GLN A 59 7.434 -9.026 4.444 1.00 12.13 H new ATOM 980 N GLU A 60 9.369 -8.231 -1.688 1.00 42.31 N ATOM 981 CA GLU A 60 9.956 -7.557 -2.833 1.00 51.21 C ATOM 982 C GLU A 60 9.189 -6.282 -3.155 1.00 23.22 C ATOM 983 O GLU A 60 9.776 -5.235 -3.276 1.00 34.22 O ATOM 984 CB GLU A 60 9.950 -8.477 -4.057 1.00 41.11 C ATOM 985 CG GLU A 60 10.801 -9.729 -3.933 1.00 44.34 C ATOM 986 CD GLU A 60 12.278 -9.431 -3.823 1.00 44.44 C ATOM 987 OE1 GLU A 60 12.893 -9.073 -4.844 1.00 62.51 O ATOM 988 OE2 GLU A 60 12.846 -9.546 -2.725 1.00 5.41 O ATOM 0 H GLU A 60 9.028 -9.171 -1.888 1.00 42.31 H new ATOM 0 HA GLU A 60 10.985 -7.300 -2.582 1.00 51.21 H new ATOM 0 HB2 GLU A 60 8.922 -8.775 -4.261 1.00 41.11 H new ATOM 0 HB3 GLU A 60 10.294 -7.908 -4.920 1.00 41.11 H new ATOM 0 HG2 GLU A 60 10.483 -10.292 -3.055 1.00 44.34 H new ATOM 0 HG3 GLU A 60 10.628 -10.366 -4.800 1.00 44.34 H new ATOM 995 N TYR A 61 7.879 -6.393 -3.267 1.00 15.11 N ATOM 996 CA TYR A 61 7.015 -5.268 -3.621 1.00 32.42 C ATOM 997 C TYR A 61 7.208 -4.100 -2.659 1.00 72.34 C ATOM 998 O TYR A 61 7.396 -2.947 -3.095 1.00 3.33 O ATOM 999 CB TYR A 61 5.569 -5.715 -3.616 1.00 14.00 C ATOM 1000 CG TYR A 61 4.604 -4.721 -4.207 1.00 63.12 C ATOM 1001 CD1 TYR A 61 4.467 -4.630 -5.572 1.00 12.03 C ATOM 1002 CD2 TYR A 61 3.807 -3.911 -3.413 1.00 30.13 C ATOM 1003 CE1 TYR A 61 3.573 -3.773 -6.152 1.00 0.11 C ATOM 1004 CE2 TYR A 61 2.905 -3.034 -3.980 1.00 21.35 C ATOM 1005 CZ TYR A 61 2.788 -2.970 -5.354 1.00 73.54 C ATOM 1006 OH TYR A 61 1.884 -2.107 -5.925 1.00 64.45 O ATOM 0 H TYR A 61 7.376 -7.267 -3.116 1.00 15.11 H new ATOM 0 HA TYR A 61 7.286 -4.927 -4.620 1.00 32.42 H new ATOM 0 HB2 TYR A 61 5.490 -6.651 -4.168 1.00 14.00 H new ATOM 0 HB3 TYR A 61 5.271 -5.925 -2.589 1.00 14.00 H new ATOM 0 HD1 TYR A 61 5.083 -5.253 -6.204 1.00 12.03 H new ATOM 0 HD2 TYR A 61 3.893 -3.967 -2.338 1.00 30.13 H new ATOM 0 HE1 TYR A 61 3.483 -3.726 -7.227 1.00 0.11 H new ATOM 0 HE2 TYR A 61 2.294 -2.402 -3.353 1.00 21.35 H new ATOM 0 HH TYR A 61 1.123 -1.984 -5.320 1.00 64.45 H new ATOM 1016 N LEU A 62 7.181 -4.400 -1.362 1.00 61.30 N ATOM 1017 CA LEU A 62 7.392 -3.391 -0.341 1.00 21.41 C ATOM 1018 C LEU A 62 8.767 -2.784 -0.518 1.00 33.44 C ATOM 1019 O LEU A 62 8.898 -1.571 -0.626 1.00 11.02 O ATOM 1020 CB LEU A 62 7.263 -3.989 1.075 1.00 31.24 C ATOM 1021 CG LEU A 62 5.895 -4.573 1.475 1.00 65.43 C ATOM 1022 CD1 LEU A 62 5.967 -5.188 2.867 1.00 42.25 C ATOM 1023 CD2 LEU A 62 4.826 -3.505 1.450 1.00 30.11 C ATOM 0 H LEU A 62 7.014 -5.338 -0.998 1.00 61.30 H new ATOM 0 HA LEU A 62 6.627 -2.623 -0.451 1.00 21.41 H new ATOM 0 HB2 LEU A 62 8.009 -4.777 1.177 1.00 31.24 H new ATOM 0 HB3 LEU A 62 7.521 -3.211 1.794 1.00 31.24 H new ATOM 0 HG LEU A 62 5.636 -5.347 0.752 1.00 65.43 H new ATOM 0 HD11 LEU A 62 4.993 -5.596 3.135 1.00 42.25 H new ATOM 0 HD12 LEU A 62 6.709 -5.986 2.874 1.00 42.25 H new ATOM 0 HD13 LEU A 62 6.251 -4.422 3.589 1.00 42.25 H new ATOM 0 HD21 LEU A 62 3.869 -3.941 1.736 1.00 30.11 H new ATOM 0 HD22 LEU A 62 5.087 -2.712 2.151 1.00 30.11 H new ATOM 0 HD23 LEU A 62 4.750 -3.090 0.445 1.00 30.11 H new ATOM 1035 N GLU A 63 9.784 -3.653 -0.617 1.00 72.13 N ATOM 1036 CA GLU A 63 11.169 -3.233 -0.782 1.00 61.32 C ATOM 1037 C GLU A 63 11.409 -2.437 -2.072 1.00 70.54 C ATOM 1038 O GLU A 63 12.293 -1.587 -2.131 1.00 45.02 O ATOM 1039 CB GLU A 63 12.141 -4.411 -0.646 1.00 31.25 C ATOM 1040 CG GLU A 63 12.190 -4.980 0.766 1.00 65.10 C ATOM 1041 CD GLU A 63 13.252 -6.039 0.959 1.00 50.05 C ATOM 1042 OE1 GLU A 63 13.071 -7.167 0.496 1.00 3.21 O ATOM 1043 OE2 GLU A 63 14.298 -5.742 1.587 1.00 12.01 O ATOM 0 H GLU A 63 9.661 -4.665 -0.584 1.00 72.13 H new ATOM 0 HA GLU A 63 11.375 -2.543 0.037 1.00 61.32 H new ATOM 0 HB2 GLU A 63 11.848 -5.199 -1.340 1.00 31.25 H new ATOM 0 HB3 GLU A 63 13.140 -4.086 -0.936 1.00 31.25 H new ATOM 0 HG2 GLU A 63 12.368 -4.167 1.470 1.00 65.10 H new ATOM 0 HG3 GLU A 63 11.217 -5.405 1.011 1.00 65.10 H new ATOM 1050 N LYS A 64 10.637 -2.714 -3.085 1.00 55.02 N ATOM 1051 CA LYS A 64 10.710 -1.986 -4.328 1.00 24.41 C ATOM 1052 C LYS A 64 10.141 -0.573 -4.214 1.00 55.15 C ATOM 1053 O LYS A 64 10.767 0.370 -4.672 1.00 63.43 O ATOM 1054 CB LYS A 64 9.996 -2.767 -5.444 1.00 21.31 C ATOM 1055 CG LYS A 64 10.839 -3.760 -6.302 1.00 22.14 C ATOM 1056 CD LYS A 64 11.652 -4.837 -5.561 1.00 4.50 C ATOM 1057 CE LYS A 64 12.859 -4.276 -4.820 1.00 11.41 C ATOM 1058 NZ LYS A 64 13.684 -5.340 -4.226 1.00 22.35 N ATOM 0 H LYS A 64 9.935 -3.454 -3.075 1.00 55.02 H new ATOM 0 HA LYS A 64 11.766 -1.882 -4.579 1.00 24.41 H new ATOM 0 HB2 LYS A 64 9.181 -3.329 -4.988 1.00 21.31 H new ATOM 0 HB3 LYS A 64 9.544 -2.042 -6.121 1.00 21.31 H new ATOM 0 HG2 LYS A 64 10.162 -4.266 -6.991 1.00 22.14 H new ATOM 0 HG3 LYS A 64 11.531 -3.175 -6.908 1.00 22.14 H new ATOM 0 HD2 LYS A 64 11.003 -5.348 -4.850 1.00 4.50 H new ATOM 0 HD3 LYS A 64 11.990 -5.585 -6.278 1.00 4.50 H new ATOM 0 HE2 LYS A 64 13.466 -3.688 -5.508 1.00 11.41 H new ATOM 0 HE3 LYS A 64 12.521 -3.599 -4.036 1.00 11.41 H new ATOM 0 HZ1 LYS A 64 14.494 -4.916 -3.731 1.00 22.35 H new ATOM 0 HZ2 LYS A 64 13.113 -5.886 -3.550 1.00 22.35 H new ATOM 0 HZ3 LYS A 64 14.029 -5.972 -4.977 1.00 22.35 H new ATOM 1072 N CYS A 65 8.993 -0.429 -3.565 1.00 4.34 N ATOM 1073 CA CYS A 65 8.302 0.864 -3.479 1.00 31.25 C ATOM 1074 C CYS A 65 9.071 1.939 -2.644 1.00 30.31 C ATOM 1075 O CYS A 65 8.731 3.113 -2.716 1.00 44.42 O ATOM 1076 CB CYS A 65 6.815 0.682 -3.036 1.00 3.34 C ATOM 1077 SG CYS A 65 5.799 2.209 -2.984 1.00 72.32 S ATOM 0 H CYS A 65 8.514 -1.192 -3.086 1.00 4.34 H new ATOM 0 HA CYS A 65 8.288 1.275 -4.488 1.00 31.25 H new ATOM 0 HB2 CYS A 65 6.338 -0.025 -3.715 1.00 3.34 H new ATOM 0 HB3 CYS A 65 6.805 0.229 -2.045 1.00 3.34 H new ATOM 1082 N LEU A 66 10.123 1.524 -1.876 1.00 24.33 N ATOM 1083 CA LEU A 66 11.004 2.503 -1.144 1.00 63.44 C ATOM 1084 C LEU A 66 11.470 3.624 -2.070 1.00 15.54 C ATOM 1085 O LEU A 66 11.213 4.797 -1.810 1.00 11.34 O ATOM 1086 CB LEU A 66 12.264 1.845 -0.507 1.00 71.12 C ATOM 1087 CG LEU A 66 12.113 1.006 0.782 1.00 31.13 C ATOM 1088 CD1 LEU A 66 11.591 1.827 1.912 1.00 30.30 C ATOM 1089 CD2 LEU A 66 11.246 -0.167 0.579 1.00 61.20 C ATOM 0 H LEU A 66 10.382 0.546 -1.746 1.00 24.33 H new ATOM 0 HA LEU A 66 10.382 2.900 -0.341 1.00 63.44 H new ATOM 0 HB2 LEU A 66 12.716 1.203 -1.264 1.00 71.12 H new ATOM 0 HB3 LEU A 66 12.978 2.641 -0.297 1.00 71.12 H new ATOM 0 HG LEU A 66 13.112 0.653 1.036 1.00 31.13 H new ATOM 0 HD11 LEU A 66 11.498 1.204 2.802 1.00 30.30 H new ATOM 0 HD12 LEU A 66 12.280 2.647 2.114 1.00 30.30 H new ATOM 0 HD13 LEU A 66 10.614 2.230 1.647 1.00 30.30 H new ATOM 0 HD21 LEU A 66 11.168 -0.728 1.511 1.00 61.20 H new ATOM 0 HD22 LEU A 66 10.254 0.163 0.270 1.00 61.20 H new ATOM 0 HD23 LEU A 66 11.673 -0.806 -0.194 1.00 61.20 H new ATOM 1101 N ASN A 67 12.174 3.266 -3.138 1.00 54.11 N ATOM 1102 CA ASN A 67 12.596 4.268 -4.107 1.00 30.34 C ATOM 1103 C ASN A 67 11.517 4.391 -5.170 1.00 43.33 C ATOM 1104 O ASN A 67 11.252 5.466 -5.688 1.00 23.03 O ATOM 1105 CB ASN A 67 13.931 3.915 -4.763 1.00 75.21 C ATOM 1106 CG ASN A 67 14.506 5.084 -5.558 1.00 35.52 C ATOM 1107 OD1 ASN A 67 14.191 5.279 -6.732 1.00 0.44 O ATOM 1108 ND2 ASN A 67 15.386 5.839 -4.939 1.00 2.42 N ATOM 0 H ASN A 67 12.459 2.310 -3.352 1.00 54.11 H new ATOM 0 HA ASN A 67 12.739 5.214 -3.584 1.00 30.34 H new ATOM 0 HB2 ASN A 67 14.644 3.614 -3.995 1.00 75.21 H new ATOM 0 HB3 ASN A 67 13.795 3.059 -5.424 1.00 75.21 H new ATOM 0 HD21 ASN A 67 15.830 6.614 -5.432 1.00 2.42 H new ATOM 0 HD22 ASN A 67 15.625 5.650 -3.965 1.00 2.42 H new ATOM 1115 N LYS A 68 10.899 3.266 -5.497 1.00 54.52 N ATOM 1116 CA LYS A 68 9.763 3.244 -6.400 1.00 45.35 C ATOM 1117 C LYS A 68 8.528 3.814 -5.720 1.00 11.53 C ATOM 1118 O LYS A 68 8.008 4.863 -6.115 1.00 71.22 O ATOM 1119 CB LYS A 68 9.506 1.814 -6.936 1.00 13.43 C ATOM 1120 CG LYS A 68 8.108 1.596 -7.486 1.00 13.32 C ATOM 1121 CD LYS A 68 7.935 0.253 -8.164 1.00 53.44 C ATOM 1122 CE LYS A 68 6.487 0.081 -8.644 1.00 32.43 C ATOM 1123 NZ LYS A 68 6.258 -1.171 -9.402 1.00 32.02 N ATOM 0 H LYS A 68 11.171 2.348 -5.145 1.00 54.52 H new ATOM 0 HA LYS A 68 9.995 3.876 -7.257 1.00 45.35 H new ATOM 0 HB2 LYS A 68 10.231 1.597 -7.721 1.00 13.43 H new ATOM 0 HB3 LYS A 68 9.683 1.100 -6.132 1.00 13.43 H new ATOM 0 HG2 LYS A 68 7.388 1.680 -6.672 1.00 13.32 H new ATOM 0 HG3 LYS A 68 7.878 2.388 -8.199 1.00 13.32 H new ATOM 0 HD2 LYS A 68 8.618 0.175 -9.010 1.00 53.44 H new ATOM 0 HD3 LYS A 68 8.193 -0.548 -7.471 1.00 53.44 H new ATOM 0 HE2 LYS A 68 5.822 0.100 -7.780 1.00 32.43 H new ATOM 0 HE3 LYS A 68 6.218 0.930 -9.272 1.00 32.43 H new ATOM 0 HZ1 LYS A 68 5.237 -1.307 -9.548 1.00 32.02 H new ATOM 0 HZ2 LYS A 68 6.735 -1.111 -10.324 1.00 32.02 H new ATOM 0 HZ3 LYS A 68 6.641 -1.976 -8.866 1.00 32.02 H new ATOM 1207 N ILE B 106 -0.130 3.133 14.553 1.00 45.41 N ATOM 1208 CA ILE B 106 -1.492 2.653 14.513 1.00 10.43 C ATOM 1209 C ILE B 106 -2.367 3.620 13.778 1.00 35.43 C ATOM 1210 O ILE B 106 -2.613 4.747 14.235 1.00 42.40 O ATOM 1211 CB ILE B 106 -2.055 2.379 15.923 1.00 53.04 C ATOM 1212 CG1 ILE B 106 -1.130 1.414 16.658 1.00 22.33 C ATOM 1213 CG2 ILE B 106 -3.481 1.824 15.856 1.00 61.13 C ATOM 1214 CD1 ILE B 106 -0.892 0.105 15.938 1.00 54.45 C ATOM 0 HA ILE B 106 -1.484 1.703 13.978 1.00 10.43 H new ATOM 0 HB ILE B 106 -2.101 3.320 16.471 1.00 53.04 H new ATOM 0 HG12 ILE B 106 -0.170 1.904 16.822 1.00 22.33 H new ATOM 0 HG13 ILE B 106 -1.552 1.203 17.640 1.00 22.33 H new ATOM 0 HG21 ILE B 106 -3.848 1.642 16.866 1.00 61.13 H new ATOM 0 HG22 ILE B 106 -4.129 2.546 15.359 1.00 61.13 H new ATOM 0 HG23 ILE B 106 -3.482 0.889 15.296 1.00 61.13 H new ATOM 0 HD11 ILE B 106 -0.224 -0.520 16.531 1.00 54.45 H new ATOM 0 HD12 ILE B 106 -1.842 -0.411 15.797 1.00 54.45 H new ATOM 0 HD13 ILE B 106 -0.439 0.301 14.966 1.00 54.45 H new ATOM 1226 N TYR B 107 -2.794 3.204 12.635 1.00 72.13 N ATOM 1227 CA TYR B 107 -3.625 3.979 11.799 1.00 31.23 C ATOM 1228 C TYR B 107 -5.020 3.371 11.895 1.00 41.33 C ATOM 1229 O TYR B 107 -5.233 2.254 11.428 1.00 51.31 O ATOM 1230 CB TYR B 107 -3.108 3.938 10.336 1.00 62.21 C ATOM 1231 CG TYR B 107 -1.650 4.346 10.089 1.00 1.52 C ATOM 1232 CD1 TYR B 107 -0.765 4.646 11.121 1.00 31.15 C ATOM 1233 CD2 TYR B 107 -1.172 4.407 8.799 1.00 12.34 C ATOM 1234 CE1 TYR B 107 0.541 4.991 10.870 1.00 11.05 C ATOM 1235 CE2 TYR B 107 0.130 4.755 8.537 1.00 53.50 C ATOM 1236 CZ TYR B 107 0.985 5.046 9.571 1.00 31.41 C ATOM 1237 OH TYR B 107 2.287 5.388 9.298 1.00 32.22 O ATOM 0 H TYR B 107 -2.564 2.287 12.251 1.00 72.13 H new ATOM 0 HA TYR B 107 -3.633 5.025 12.107 1.00 31.23 H new ATOM 0 HB2 TYR B 107 -3.242 2.924 9.960 1.00 62.21 H new ATOM 0 HB3 TYR B 107 -3.745 4.587 9.736 1.00 62.21 H new ATOM 0 HD1 TYR B 107 -1.113 4.607 12.143 1.00 31.15 H new ATOM 0 HD2 TYR B 107 -1.834 4.177 7.977 1.00 12.34 H new ATOM 0 HE1 TYR B 107 1.212 5.217 11.686 1.00 11.05 H new ATOM 0 HE2 TYR B 107 0.482 4.800 7.517 1.00 53.50 H new ATOM 0 HH TYR B 107 2.306 6.063 8.588 1.00 32.22 H new ATOM 1247 N THR B 108 -5.935 4.102 12.526 1.00 22.22 N ATOM 1248 CA THR B 108 -7.289 3.630 12.838 1.00 75.44 C ATOM 1249 C THR B 108 -7.242 2.672 14.044 1.00 53.23 C ATOM 1250 O THR B 108 -6.914 1.498 13.919 1.00 33.31 O ATOM 1251 CB THR B 108 -8.008 2.951 11.629 1.00 10.42 C ATOM 1252 OG1 THR B 108 -7.993 3.833 10.493 1.00 25.43 O ATOM 1253 CG2 THR B 108 -9.449 2.623 11.971 1.00 64.22 C ATOM 0 H THR B 108 -5.757 5.055 12.842 1.00 22.22 H new ATOM 0 HA THR B 108 -7.881 4.512 13.083 1.00 75.44 H new ATOM 0 HB THR B 108 -7.476 2.028 11.396 1.00 10.42 H new ATOM 0 HG1 THR B 108 -7.280 3.562 9.878 1.00 25.43 H new ATOM 0 HG21 THR B 108 -9.928 2.151 11.113 1.00 64.22 H new ATOM 0 HG22 THR B 108 -9.475 1.942 12.821 1.00 64.22 H new ATOM 0 HG23 THR B 108 -9.981 3.540 12.224 1.00 64.22 H new ATOM 1261 N SER B 109 -7.527 3.201 15.207 1.00 42.05 N ATOM 1262 CA SER B 109 -7.495 2.429 16.420 1.00 65.15 C ATOM 1263 C SER B 109 -8.904 2.022 16.859 1.00 32.43 C ATOM 1264 O SER B 109 -9.685 2.860 17.345 1.00 74.33 O ATOM 1265 CB SER B 109 -6.748 3.216 17.508 1.00 22.44 C ATOM 1266 OG SER B 109 -7.241 4.559 17.598 1.00 25.51 O ATOM 0 H SER B 109 -7.787 4.178 15.338 1.00 42.05 H new ATOM 0 HA SER B 109 -6.954 1.500 16.240 1.00 65.15 H new ATOM 0 HB2 SER B 109 -6.866 2.716 18.469 1.00 22.44 H new ATOM 0 HB3 SER B 109 -5.681 3.230 17.284 1.00 22.44 H new ATOM 0 HG SER B 109 -8.219 4.553 17.535 1.00 25.51 H new ATOM 1272 N ASP B 110 -9.224 0.749 16.653 1.00 62.21 N ATOM 1273 CA ASP B 110 -10.535 0.171 16.986 1.00 53.33 C ATOM 1274 C ASP B 110 -11.660 0.860 16.261 1.00 64.22 C ATOM 1275 O ASP B 110 -12.340 1.741 16.810 1.00 31.32 O ATOM 1276 CB ASP B 110 -10.810 0.062 18.503 1.00 4.32 C ATOM 1277 CG ASP B 110 -9.927 -0.950 19.197 1.00 13.35 C ATOM 1278 OD1 ASP B 110 -8.811 -0.585 19.661 1.00 24.05 O ATOM 1279 OD2 ASP B 110 -10.329 -2.124 19.303 1.00 63.13 O ATOM 0 H ASP B 110 -8.576 0.075 16.245 1.00 62.21 H new ATOM 0 HA ASP B 110 -10.490 -0.857 16.626 1.00 53.33 H new ATOM 0 HB2 ASP B 110 -10.663 1.039 18.963 1.00 4.32 H new ATOM 0 HB3 ASP B 110 -11.854 -0.210 18.658 1.00 4.32 H new ATOM 1284 N ASN B 111 -11.815 0.492 15.001 1.00 61.33 N ATOM 1285 CA ASN B 111 -12.827 1.070 14.112 1.00 44.55 C ATOM 1286 C ASN B 111 -12.825 0.362 12.771 1.00 72.31 C ATOM 1287 O ASN B 111 -13.856 0.289 12.089 1.00 24.13 O ATOM 1288 CB ASN B 111 -12.579 2.580 13.901 1.00 50.53 C ATOM 1289 CG ASN B 111 -13.577 3.231 12.945 1.00 23.14 C ATOM 1290 OD1 ASN B 111 -13.347 3.303 11.737 1.00 52.34 O ATOM 1291 ND2 ASN B 111 -14.685 3.695 13.473 1.00 33.31 N ATOM 0 H ASN B 111 -11.240 -0.223 14.555 1.00 61.33 H new ATOM 0 HA ASN B 111 -13.800 0.937 14.585 1.00 44.55 H new ATOM 0 HB2 ASN B 111 -12.627 3.087 14.865 1.00 50.53 H new ATOM 0 HB3 ASN B 111 -11.570 2.724 13.515 1.00 50.53 H new ATOM 0 HD21 ASN B 111 -15.389 4.132 12.879 1.00 33.31 H new ATOM 0 HD22 ASN B 111 -14.842 3.618 14.478 1.00 33.31 H new ATOM 1417 N TYR B 121 -6.274 -18.272 4.188 1.00 11.01 N ATOM 1418 CA TYR B 121 -6.948 -18.698 3.003 1.00 51.35 C ATOM 1419 C TYR B 121 -6.360 -20.076 2.731 1.00 61.42 C ATOM 1420 O TYR B 121 -7.060 -21.043 2.446 1.00 75.44 O ATOM 1421 CB TYR B 121 -6.597 -17.699 1.852 1.00 51.23 C ATOM 1422 CG TYR B 121 -7.368 -17.848 0.551 1.00 23.11 C ATOM 1423 CD1 TYR B 121 -7.702 -19.081 0.048 1.00 53.11 C ATOM 1424 CD2 TYR B 121 -7.756 -16.729 -0.157 1.00 73.14 C ATOM 1425 CE1 TYR B 121 -8.403 -19.211 -1.130 1.00 52.12 C ATOM 1426 CE2 TYR B 121 -8.462 -16.836 -1.340 1.00 10.44 C ATOM 1427 CZ TYR B 121 -8.783 -18.085 -1.824 1.00 41.31 C ATOM 1428 OH TYR B 121 -9.496 -18.211 -3.004 1.00 24.43 O ATOM 0 HA TYR B 121 -8.034 -18.730 3.088 1.00 51.35 H new ATOM 0 HB2 TYR B 121 -6.752 -16.686 2.224 1.00 51.23 H new ATOM 0 HB3 TYR B 121 -5.535 -17.798 1.630 1.00 51.23 H new ATOM 0 HD1 TYR B 121 -7.408 -19.969 0.588 1.00 53.11 H new ATOM 0 HD2 TYR B 121 -7.503 -15.750 0.221 1.00 73.14 H new ATOM 0 HE1 TYR B 121 -8.653 -20.191 -1.507 1.00 52.12 H new ATOM 0 HE2 TYR B 121 -8.759 -15.949 -1.880 1.00 10.44 H new ATOM 0 HH TYR B 121 -9.687 -17.321 -3.368 1.00 24.43 H new ATOM 1438 N ASP B 122 -5.063 -20.136 2.908 1.00 15.34 N ATOM 1439 CA ASP B 122 -4.250 -21.319 2.779 1.00 32.32 C ATOM 1440 C ASP B 122 -3.012 -21.088 3.637 1.00 51.12 C ATOM 1441 O ASP B 122 -2.703 -19.932 3.942 1.00 14.23 O ATOM 1442 CB ASP B 122 -3.913 -21.578 1.296 1.00 13.44 C ATOM 1443 CG ASP B 122 -2.917 -22.691 1.064 1.00 31.10 C ATOM 1444 OD1 ASP B 122 -3.129 -23.816 1.531 1.00 41.14 O ATOM 1445 OD2 ASP B 122 -1.912 -22.449 0.370 1.00 14.12 O ATOM 0 H ASP B 122 -4.516 -19.313 3.160 1.00 15.34 H new ATOM 0 HA ASP B 122 -4.769 -22.214 3.122 1.00 32.32 H new ATOM 0 HB2 ASP B 122 -4.834 -21.815 0.763 1.00 13.44 H new ATOM 0 HB3 ASP B 122 -3.520 -20.659 0.860 1.00 13.44 H new ATOM 1450 N SER B 123 -2.339 -22.148 4.044 1.00 42.41 N ATOM 1451 CA SER B 123 -1.218 -22.056 4.985 1.00 70.21 C ATOM 1452 C SER B 123 0.057 -21.409 4.336 1.00 13.53 C ATOM 1453 O SER B 123 -0.018 -20.798 3.261 1.00 15.04 O ATOM 1454 CB SER B 123 -0.924 -23.467 5.555 1.00 53.33 C ATOM 1455 OG SER B 123 -0.018 -23.434 6.668 1.00 60.14 O ATOM 0 H SER B 123 -2.547 -23.099 3.738 1.00 42.41 H new ATOM 0 HA SER B 123 -1.500 -21.390 5.801 1.00 70.21 H new ATOM 0 HB2 SER B 123 -1.860 -23.931 5.866 1.00 53.33 H new ATOM 0 HB3 SER B 123 -0.504 -24.093 4.768 1.00 53.33 H new ATOM 0 HG SER B 123 0.134 -24.346 6.993 1.00 60.14 H new ATOM 1461 N MET B 124 1.206 -21.580 5.013 1.00 53.34 N ATOM 1462 CA MET B 124 2.508 -20.959 4.674 1.00 54.11 C ATOM 1463 C MET B 124 2.628 -19.554 5.253 1.00 4.24 C ATOM 1464 O MET B 124 1.631 -18.844 5.408 1.00 64.23 O ATOM 1465 CB MET B 124 2.920 -21.042 3.180 1.00 60.45 C ATOM 1466 CG MET B 124 3.334 -22.436 2.694 1.00 63.04 C ATOM 1467 SD MET B 124 2.031 -23.689 2.788 1.00 32.31 S ATOM 1468 CE MET B 124 2.932 -25.131 2.226 1.00 60.12 C ATOM 0 H MET B 124 1.260 -22.174 5.840 1.00 53.34 H new ATOM 0 HA MET B 124 3.252 -21.584 5.167 1.00 54.11 H new ATOM 0 HB2 MET B 124 2.086 -20.695 2.570 1.00 60.45 H new ATOM 0 HB3 MET B 124 3.748 -20.354 3.009 1.00 60.45 H new ATOM 0 HG2 MET B 124 3.672 -22.360 1.660 1.00 63.04 H new ATOM 0 HG3 MET B 124 4.186 -22.773 3.284 1.00 63.04 H new ATOM 0 HE1 MET B 124 2.269 -25.996 2.225 1.00 60.12 H new ATOM 0 HE2 MET B 124 3.304 -24.957 1.216 1.00 60.12 H new ATOM 0 HE3 MET B 124 3.772 -25.318 2.895 1.00 60.12 H new ATOM 1478 N LYS B 125 3.842 -19.159 5.582 1.00 3.34 N ATOM 1479 CA LYS B 125 4.068 -17.939 6.331 1.00 1.11 C ATOM 1480 C LYS B 125 5.508 -17.466 6.194 1.00 13.43 C ATOM 1481 O LYS B 125 6.370 -18.229 5.747 1.00 63.34 O ATOM 1482 CB LYS B 125 3.843 -18.279 7.804 1.00 32.12 C ATOM 1483 CG LYS B 125 4.795 -19.367 8.277 1.00 31.11 C ATOM 1484 CD LYS B 125 4.585 -19.765 9.705 1.00 72.44 C ATOM 1485 CE LYS B 125 5.622 -20.796 10.104 1.00 65.51 C ATOM 1486 NZ LYS B 125 5.565 -22.016 9.258 1.00 0.30 N ATOM 0 H LYS B 125 4.692 -19.669 5.341 1.00 3.34 H new ATOM 0 HA LYS B 125 3.402 -17.159 5.961 1.00 1.11 H new ATOM 0 HB2 LYS B 125 3.982 -17.384 8.410 1.00 32.12 H new ATOM 0 HB3 LYS B 125 2.814 -18.606 7.950 1.00 32.12 H new ATOM 0 HG2 LYS B 125 4.675 -20.245 7.642 1.00 31.11 H new ATOM 0 HG3 LYS B 125 5.821 -19.021 8.152 1.00 31.11 H new ATOM 0 HD2 LYS B 125 4.660 -18.891 10.351 1.00 72.44 H new ATOM 0 HD3 LYS B 125 3.583 -20.173 9.836 1.00 72.44 H new ATOM 0 HE2 LYS B 125 6.616 -20.354 10.032 1.00 65.51 H new ATOM 0 HE3 LYS B 125 5.471 -21.074 11.147 1.00 65.51 H new ATOM 0 HZ1 LYS B 125 6.102 -22.781 9.715 1.00 0.30 H new ATOM 0 HZ2 LYS B 125 4.575 -22.311 9.140 1.00 0.30 H new ATOM 0 HZ3 LYS B 125 5.978 -21.812 8.326 1.00 0.30 H new ATOM 1500 N GLU B 126 5.745 -16.202 6.564 1.00 64.12 N ATOM 1501 CA GLU B 126 7.086 -15.638 6.744 1.00 1.15 C ATOM 1502 C GLU B 126 7.860 -15.389 5.445 1.00 15.03 C ATOM 1503 O GLU B 126 7.614 -16.036 4.414 1.00 62.11 O ATOM 1504 CB GLU B 126 7.905 -16.448 7.772 1.00 41.34 C ATOM 1505 CG GLU B 126 7.278 -16.452 9.157 1.00 22.44 C ATOM 1506 CD GLU B 126 8.146 -17.113 10.187 1.00 14.51 C ATOM 1507 OE1 GLU B 126 9.044 -16.434 10.725 1.00 3.23 O ATOM 1508 OE2 GLU B 126 7.951 -18.302 10.483 1.00 74.24 O ATOM 0 H GLU B 126 4.998 -15.533 6.749 1.00 64.12 H new ATOM 0 HA GLU B 126 6.925 -14.640 7.151 1.00 1.15 H new ATOM 0 HB2 GLU B 126 8.005 -17.475 7.421 1.00 41.34 H new ATOM 0 HB3 GLU B 126 8.911 -16.033 7.835 1.00 41.34 H new ATOM 0 HG2 GLU B 126 7.077 -15.425 9.463 1.00 22.44 H new ATOM 0 HG3 GLU B 126 6.318 -16.966 9.114 1.00 22.44 H new ATOM 1515 N PRO B 127 8.792 -14.402 5.472 1.00 61.24 N ATOM 1516 CA PRO B 127 9.629 -14.057 4.332 1.00 41.51 C ATOM 1517 C PRO B 127 10.482 -15.223 3.894 1.00 61.30 C ATOM 1518 O PRO B 127 11.415 -15.659 4.586 1.00 21.41 O ATOM 1519 CB PRO B 127 10.508 -12.933 4.864 1.00 41.51 C ATOM 1520 CG PRO B 127 10.506 -13.181 6.305 1.00 61.15 C ATOM 1521 CD PRO B 127 9.102 -13.524 6.607 1.00 13.33 C ATOM 0 HA PRO B 127 9.041 -13.776 3.459 1.00 41.51 H new ATOM 0 HB2 PRO B 127 11.514 -12.974 4.447 1.00 41.51 H new ATOM 0 HB3 PRO B 127 10.102 -11.951 4.621 1.00 41.51 H new ATOM 0 HG2 PRO B 127 11.181 -13.994 6.571 1.00 61.15 H new ATOM 0 HG3 PRO B 127 10.831 -12.302 6.862 1.00 61.15 H new ATOM 0 HD2 PRO B 127 8.996 -14.032 7.565 1.00 13.33 H new ATOM 0 HD3 PRO B 127 8.458 -12.645 6.639 1.00 13.33 H new ATOM 1846 N CYS C 209 -2.989 9.940 -13.205 1.00 73.02 N ATOM 1847 CA CYS C 209 -2.919 8.651 -12.572 1.00 22.31 C ATOM 1848 C CYS C 209 -4.016 8.607 -11.488 1.00 63.14 C ATOM 1849 O CYS C 209 -4.654 9.637 -11.218 1.00 72.45 O ATOM 1850 CB CYS C 209 -1.485 8.396 -11.950 1.00 21.23 C ATOM 1851 SG CYS C 209 -0.145 7.982 -13.152 1.00 13.15 S ATOM 0 HA CYS C 209 -3.082 7.860 -13.304 1.00 22.31 H new ATOM 0 HB2 CYS C 209 -1.187 9.286 -11.396 1.00 21.23 H new ATOM 0 HB3 CYS C 209 -1.563 7.583 -11.228 1.00 21.23 H new ATOM 1856 N PRO C 210 -4.310 7.412 -10.904 1.00 64.14 N ATOM 1857 CA PRO C 210 -5.270 7.242 -9.778 1.00 14.23 C ATOM 1858 C PRO C 210 -5.051 8.248 -8.636 1.00 53.41 C ATOM 1859 O PRO C 210 -5.972 8.564 -7.874 1.00 52.24 O ATOM 1860 CB PRO C 210 -4.962 5.819 -9.301 1.00 41.22 C ATOM 1861 CG PRO C 210 -3.723 5.432 -10.014 1.00 23.21 C ATOM 1862 CD PRO C 210 -3.791 6.126 -11.310 1.00 42.11 C ATOM 0 HA PRO C 210 -6.301 7.409 -10.089 1.00 14.23 H new ATOM 0 HB2 PRO C 210 -4.821 5.787 -8.221 1.00 41.22 H new ATOM 0 HB3 PRO C 210 -5.781 5.139 -9.536 1.00 41.22 H new ATOM 0 HG2 PRO C 210 -2.837 5.730 -9.454 1.00 23.21 H new ATOM 0 HG3 PRO C 210 -3.667 4.352 -10.148 1.00 23.21 H new ATOM 0 HD2 PRO C 210 -2.814 6.207 -11.787 1.00 42.11 H new ATOM 0 HD3 PRO C 210 -4.449 5.619 -12.016 1.00 42.11 H new ATOM 1870 N CYS C 211 -3.841 8.730 -8.525 1.00 71.34 N ATOM 1871 CA CYS C 211 -3.517 9.746 -7.589 1.00 15.32 C ATOM 1872 C CYS C 211 -3.685 11.108 -8.178 1.00 33.23 C ATOM 1873 O CYS C 211 -2.942 11.524 -9.065 1.00 40.35 O ATOM 1874 CB CYS C 211 -2.145 9.542 -7.003 1.00 11.13 C ATOM 1875 SG CYS C 211 -2.125 8.188 -5.814 1.00 31.11 S ATOM 0 H CYS C 211 -3.053 8.418 -9.092 1.00 71.34 H new ATOM 0 HA CYS C 211 -4.225 9.671 -6.764 1.00 15.32 H new ATOM 0 HB2 CYS C 211 -1.434 9.335 -7.803 1.00 11.13 H new ATOM 0 HB3 CYS C 211 -1.817 10.460 -6.515 1.00 11.13 H new ATOM 1880 N ARG C 212 -4.689 11.789 -7.688 1.00 3.45 N ATOM 1881 CA ARG C 212 -5.021 13.116 -8.142 1.00 32.14 C ATOM 1882 C ARG C 212 -4.043 14.080 -7.513 1.00 43.15 C ATOM 1883 O ARG C 212 -3.478 14.944 -8.174 1.00 45.32 O ATOM 1884 CB ARG C 212 -6.428 13.473 -7.665 1.00 55.13 C ATOM 1885 CG ARG C 212 -7.458 12.401 -7.929 1.00 15.13 C ATOM 1886 CD ARG C 212 -8.811 12.802 -7.396 1.00 51.32 C ATOM 1887 NE ARG C 212 -9.791 11.715 -7.476 1.00 24.53 N ATOM 1888 CZ ARG C 212 -11.027 11.773 -6.970 1.00 21.13 C ATOM 1889 NH1 ARG C 212 -11.480 12.904 -6.442 1.00 61.44 N ATOM 1890 NH2 ARG C 212 -11.813 10.709 -7.007 1.00 1.34 N ATOM 0 H ARG C 212 -5.305 11.435 -6.956 1.00 3.45 H new ATOM 0 HA ARG C 212 -4.976 13.167 -9.230 1.00 32.14 H new ATOM 0 HB2 ARG C 212 -6.397 13.676 -6.595 1.00 55.13 H new ATOM 0 HB3 ARG C 212 -6.744 14.394 -8.155 1.00 55.13 H new ATOM 0 HG2 ARG C 212 -7.527 12.215 -9.001 1.00 15.13 H new ATOM 0 HG3 ARG C 212 -7.143 11.467 -7.463 1.00 15.13 H new ATOM 0 HD2 ARG C 212 -8.709 13.120 -6.358 1.00 51.32 H new ATOM 0 HD3 ARG C 212 -9.179 13.661 -7.957 1.00 51.32 H new ATOM 0 HE ARG C 212 -9.511 10.856 -7.950 1.00 24.53 H new ATOM 0 HH11 ARG C 212 -10.884 13.732 -6.422 1.00 61.44 H new ATOM 0 HH12 ARG C 212 -12.424 12.945 -6.057 1.00 61.44 H new ATOM 0 HH21 ARG C 212 -11.476 9.840 -7.423 1.00 1.34 H new ATOM 0 HH22 ARG C 212 -12.755 10.757 -6.620 1.00 1.34 H new ATOM 1904 N PHE C 213 -3.868 13.922 -6.216 1.00 21.13 N ATOM 1905 CA PHE C 213 -2.972 14.735 -5.448 1.00 32.34 C ATOM 1906 C PHE C 213 -2.193 13.859 -4.498 1.00 32.30 C ATOM 1907 O PHE C 213 -2.789 13.053 -3.769 1.00 54.12 O ATOM 1908 CB PHE C 213 -3.759 15.761 -4.622 1.00 61.14 C ATOM 1909 CG PHE C 213 -4.559 16.746 -5.419 1.00 73.40 C ATOM 1910 CD1 PHE C 213 -5.876 16.476 -5.786 1.00 54.44 C ATOM 1911 CD2 PHE C 213 -4.003 17.951 -5.786 1.00 65.41 C ATOM 1912 CE1 PHE C 213 -6.608 17.398 -6.506 1.00 13.52 C ATOM 1913 CE2 PHE C 213 -4.729 18.877 -6.503 1.00 3.44 C ATOM 1914 CZ PHE C 213 -6.034 18.602 -6.865 1.00 21.34 C ATOM 0 H PHE C 213 -4.355 13.213 -5.667 1.00 21.13 H new ATOM 0 HA PHE C 213 -2.299 15.253 -6.132 1.00 32.34 H new ATOM 0 HB2 PHE C 213 -4.434 15.225 -3.955 1.00 61.14 H new ATOM 0 HB3 PHE C 213 -3.059 16.311 -3.993 1.00 61.14 H new ATOM 0 HD1 PHE C 213 -6.328 15.536 -5.504 1.00 54.44 H new ATOM 0 HD2 PHE C 213 -2.983 18.174 -5.508 1.00 65.41 H new ATOM 0 HE1 PHE C 213 -7.627 17.179 -6.788 1.00 13.52 H new ATOM 0 HE2 PHE C 213 -4.278 19.818 -6.782 1.00 3.44 H new ATOM 0 HZ PHE C 213 -6.604 19.327 -7.427 1.00 21.34 H new ATOM 1924 N PHE C 214 -0.899 13.990 -4.491 1.00 34.03 N ATOM 1925 CA PHE C 214 -0.106 13.289 -3.514 1.00 53.31 C ATOM 1926 C PHE C 214 0.617 14.317 -2.674 1.00 43.43 C ATOM 1927 O PHE C 214 1.137 15.297 -3.208 1.00 33.04 O ATOM 1928 CB PHE C 214 0.910 12.285 -4.152 1.00 4.34 C ATOM 1929 CG PHE C 214 2.145 12.897 -4.781 1.00 25.12 C ATOM 1930 CD1 PHE C 214 2.164 13.288 -6.104 1.00 23.23 C ATOM 1931 CD2 PHE C 214 3.297 13.072 -4.016 1.00 53.51 C ATOM 1932 CE1 PHE C 214 3.304 13.847 -6.656 1.00 2.11 C ATOM 1933 CE2 PHE C 214 4.431 13.624 -4.553 1.00 11.35 C ATOM 1934 CZ PHE C 214 4.440 14.016 -5.879 1.00 53.23 C ATOM 0 H PHE C 214 -0.370 14.569 -5.143 1.00 34.03 H new ATOM 0 HA PHE C 214 -0.773 12.683 -2.901 1.00 53.31 H new ATOM 0 HB2 PHE C 214 1.229 11.583 -3.381 1.00 4.34 H new ATOM 0 HB3 PHE C 214 0.388 11.706 -4.914 1.00 4.34 H new ATOM 0 HD1 PHE C 214 1.282 13.157 -6.714 1.00 23.23 H new ATOM 0 HD2 PHE C 214 3.296 12.767 -2.980 1.00 53.51 H new ATOM 0 HE1 PHE C 214 3.309 14.152 -7.692 1.00 2.11 H new ATOM 0 HE2 PHE C 214 5.313 13.752 -3.943 1.00 11.35 H new ATOM 0 HZ PHE C 214 5.330 14.453 -6.308 1.00 53.23 H new ATOM 1944 N GLU C 215 0.623 14.154 -1.395 1.00 1.11 N ATOM 1945 CA GLU C 215 1.344 15.065 -0.582 1.00 62.44 C ATOM 1946 C GLU C 215 2.480 14.323 0.029 1.00 35.13 C ATOM 1947 O GLU C 215 2.295 13.252 0.604 1.00 72.23 O ATOM 1948 CB GLU C 215 0.502 15.681 0.532 1.00 62.14 C ATOM 1949 CG GLU C 215 1.130 16.964 1.085 1.00 34.45 C ATOM 1950 CD GLU C 215 0.349 17.641 2.196 1.00 41.14 C ATOM 1951 OE1 GLU C 215 -0.553 18.418 1.907 1.00 24.11 O ATOM 1952 OE2 GLU C 215 0.666 17.430 3.370 1.00 45.40 O ATOM 0 H GLU C 215 0.141 13.406 -0.896 1.00 1.11 H new ATOM 0 HA GLU C 215 1.675 15.888 -1.215 1.00 62.44 H new ATOM 0 HB2 GLU C 215 -0.496 15.900 0.153 1.00 62.14 H new ATOM 0 HB3 GLU C 215 0.384 14.958 1.339 1.00 62.14 H new ATOM 0 HG2 GLU C 215 2.128 16.730 1.455 1.00 34.45 H new ATOM 0 HG3 GLU C 215 1.252 17.672 0.265 1.00 34.45 H new ATOM 1959 N SER C 216 3.630 14.866 -0.086 1.00 63.11 N ATOM 1960 CA SER C 216 4.796 14.281 0.477 1.00 70.22 C ATOM 1961 C SER C 216 4.993 14.856 1.899 1.00 3.13 C ATOM 1962 O SER C 216 6.035 14.743 2.515 1.00 35.25 O ATOM 1963 CB SER C 216 5.965 14.607 -0.424 1.00 43.53 C ATOM 1964 OG SER C 216 7.137 13.946 -0.027 1.00 5.14 O ATOM 0 H SER C 216 3.797 15.743 -0.580 1.00 63.11 H new ATOM 0 HA SER C 216 4.709 13.197 0.556 1.00 70.22 H new ATOM 0 HB2 SER C 216 5.721 14.328 -1.449 1.00 43.53 H new ATOM 0 HB3 SER C 216 6.137 15.683 -0.419 1.00 43.53 H new ATOM 0 HG SER C 216 7.640 13.666 -0.820 1.00 5.14 H new ATOM 1970 N HIS C 217 3.962 15.488 2.395 1.00 23.33 N ATOM 1971 CA HIS C 217 3.983 16.075 3.715 1.00 75.34 C ATOM 1972 C HIS C 217 2.775 15.670 4.538 1.00 12.32 C ATOM 1973 O HIS C 217 2.627 16.114 5.668 1.00 40.02 O ATOM 1974 CB HIS C 217 4.125 17.613 3.664 1.00 55.05 C ATOM 1975 CG HIS C 217 5.505 18.113 3.313 1.00 31.54 C ATOM 1976 ND1 HIS C 217 6.260 18.873 4.171 1.00 53.42 N ATOM 1977 CD2 HIS C 217 6.250 17.979 2.190 1.00 53.51 C ATOM 1978 CE1 HIS C 217 7.403 19.182 3.600 1.00 73.42 C ATOM 1979 NE2 HIS C 217 7.424 18.652 2.397 1.00 33.30 N ATOM 0 H HIS C 217 3.081 15.612 1.897 1.00 23.33 H new ATOM 0 HA HIS C 217 4.868 15.679 4.212 1.00 75.34 H new ATOM 0 HB2 HIS C 217 3.416 18.005 2.934 1.00 55.05 H new ATOM 0 HB3 HIS C 217 3.842 18.022 4.634 1.00 55.05 H new ATOM 0 HD2 HIS C 217 5.970 17.441 1.297 1.00 53.51 H new ATOM 0 HE1 HIS C 217 8.191 19.772 4.044 1.00 73.42 H new ATOM 0 HE2 HIS C 217 8.190 18.730 1.728 1.00 33.30 H new ATOM 1988 N VAL C 218 1.903 14.828 3.971 1.00 60.34 N ATOM 1989 CA VAL C 218 0.751 14.331 4.716 1.00 42.33 C ATOM 1990 C VAL C 218 1.176 13.531 5.957 1.00 52.11 C ATOM 1991 O VAL C 218 2.153 12.776 5.926 1.00 15.53 O ATOM 1992 CB VAL C 218 -0.316 13.622 3.811 1.00 4.44 C ATOM 1993 CG1 VAL C 218 -1.196 12.674 4.614 1.00 53.04 C ATOM 1994 CG2 VAL C 218 -1.229 14.684 3.237 1.00 12.52 C ATOM 0 H VAL C 218 1.974 14.484 3.014 1.00 60.34 H new ATOM 0 HA VAL C 218 0.220 15.201 5.101 1.00 42.33 H new ATOM 0 HB VAL C 218 0.215 13.060 3.043 1.00 4.44 H new ATOM 0 HG11 VAL C 218 -1.922 12.203 3.952 1.00 53.04 H new ATOM 0 HG12 VAL C 218 -0.576 11.907 5.078 1.00 53.04 H new ATOM 0 HG13 VAL C 218 -1.721 13.233 5.389 1.00 53.04 H new ATOM 0 HG21 VAL C 218 -1.981 14.214 2.603 1.00 12.52 H new ATOM 0 HG22 VAL C 218 -1.722 15.218 4.049 1.00 12.52 H new ATOM 0 HG23 VAL C 218 -0.643 15.386 2.645 1.00 12.52 H new ATOM 2004 N ALA C 219 0.449 13.736 7.035 1.00 13.13 N ATOM 2005 CA ALA C 219 0.831 13.253 8.338 1.00 20.11 C ATOM 2006 C ALA C 219 0.519 11.785 8.597 1.00 0.13 C ATOM 2007 O ALA C 219 -0.585 11.296 8.349 1.00 43.34 O ATOM 2008 CB ALA C 219 0.221 14.124 9.425 1.00 14.34 C ATOM 0 H ALA C 219 -0.433 14.249 7.027 1.00 13.13 H new ATOM 0 HA ALA C 219 1.918 13.323 8.362 1.00 20.11 H new ATOM 0 HB1 ALA C 219 0.519 13.747 10.403 1.00 14.34 H new ATOM 0 HB2 ALA C 219 0.572 15.149 9.309 1.00 14.34 H new ATOM 0 HB3 ALA C 219 -0.866 14.101 9.342 1.00 14.34 H new ATOM 2014 N ARG C 220 1.510 11.132 9.160 1.00 41.41 N ATOM 2015 CA ARG C 220 1.488 9.734 9.599 1.00 12.13 C ATOM 2016 C ARG C 220 0.510 9.581 10.775 1.00 34.10 C ATOM 2017 O ARG C 220 -0.049 8.518 11.015 1.00 73.31 O ATOM 2018 CB ARG C 220 2.963 9.405 9.971 1.00 2.14 C ATOM 2019 CG ARG C 220 3.367 8.040 10.584 1.00 72.41 C ATOM 2020 CD ARG C 220 2.874 7.831 12.001 1.00 11.11 C ATOM 2021 NE ARG C 220 3.716 6.868 12.728 1.00 73.13 N ATOM 2022 CZ ARG C 220 3.561 6.532 14.019 1.00 34.32 C ATOM 2023 NH1 ARG C 220 2.455 6.875 14.680 1.00 54.35 N ATOM 2024 NH2 ARG C 220 4.506 5.827 14.636 1.00 25.01 N ATOM 0 H ARG C 220 2.410 11.578 9.339 1.00 41.41 H new ATOM 0 HA ARG C 220 1.135 9.039 8.837 1.00 12.13 H new ATOM 0 HB2 ARG C 220 3.552 9.529 9.062 1.00 2.14 H new ATOM 0 HB3 ARG C 220 3.290 10.174 10.671 1.00 2.14 H new ATOM 0 HG2 ARG C 220 2.978 7.241 9.953 1.00 72.41 H new ATOM 0 HG3 ARG C 220 4.454 7.955 10.572 1.00 72.41 H new ATOM 0 HD2 ARG C 220 2.869 8.784 12.530 1.00 11.11 H new ATOM 0 HD3 ARG C 220 1.845 7.473 11.980 1.00 11.11 H new ATOM 0 HE ARG C 220 4.475 6.422 12.213 1.00 73.13 H new ATOM 0 HH11 ARG C 220 1.718 7.397 14.205 1.00 54.35 H new ATOM 0 HH12 ARG C 220 2.346 6.616 15.660 1.00 54.35 H new ATOM 0 HH21 ARG C 220 5.344 5.544 14.128 1.00 25.01 H new ATOM 0 HH22 ARG C 220 4.392 5.570 15.616 1.00 25.01 H new ATOM 2038 N ALA C 221 0.312 10.661 11.491 1.00 50.10 N ATOM 2039 CA ALA C 221 -0.607 10.693 12.621 1.00 44.30 C ATOM 2040 C ALA C 221 -2.059 10.914 12.172 1.00 74.22 C ATOM 2041 O ALA C 221 -2.994 10.757 12.962 1.00 22.43 O ATOM 2042 CB ALA C 221 -0.193 11.792 13.587 1.00 54.02 C ATOM 0 H ALA C 221 0.781 11.549 11.312 1.00 50.10 H new ATOM 0 HA ALA C 221 -0.558 9.724 13.118 1.00 44.30 H new ATOM 0 HB1 ALA C 221 -0.882 11.813 14.431 1.00 54.02 H new ATOM 0 HB2 ALA C 221 0.817 11.598 13.948 1.00 54.02 H new ATOM 0 HB3 ALA C 221 -0.216 12.754 13.075 1.00 54.02 H new ATOM 2048 N ASN C 222 -2.246 11.267 10.908 1.00 21.15 N ATOM 2049 CA ASN C 222 -3.568 11.672 10.424 1.00 21.31 C ATOM 2050 C ASN C 222 -4.092 10.688 9.349 1.00 51.33 C ATOM 2051 O ASN C 222 -5.103 10.928 8.694 1.00 31.24 O ATOM 2052 CB ASN C 222 -3.464 13.136 9.897 1.00 45.02 C ATOM 2053 CG ASN C 222 -4.795 13.805 9.566 1.00 74.23 C ATOM 2054 OD1 ASN C 222 -5.148 13.840 8.317 1.00 1.42 O flip ATOM 2055 ND2 ASN C 222 -5.459 14.361 10.449 1.00 54.43 N flip ATOM 0 H ASN C 222 -1.510 11.283 10.202 1.00 21.15 H new ATOM 0 HA ASN C 222 -4.296 11.641 11.234 1.00 21.31 H new ATOM 0 HB2 ASN C 222 -2.949 13.739 10.645 1.00 45.02 H new ATOM 0 HB3 ASN C 222 -2.842 13.139 9.002 1.00 45.02 H new ATOM 0 HD21 ASN C 222 -5.154 14.315 11.421 1.00 54.43 H new ATOM 0 HD22 ASN C 222 -6.311 14.866 10.205 1.00 54.43 H new ATOM 2062 N VAL C 223 -3.433 9.555 9.227 1.00 1.14 N ATOM 2063 CA VAL C 223 -3.796 8.551 8.225 1.00 72.23 C ATOM 2064 C VAL C 223 -4.495 7.317 8.839 1.00 70.45 C ATOM 2065 O VAL C 223 -4.179 6.897 9.943 1.00 10.11 O ATOM 2066 CB VAL C 223 -2.561 8.120 7.383 1.00 41.43 C ATOM 2067 CG1 VAL C 223 -1.435 7.711 8.287 1.00 62.15 C ATOM 2068 CG2 VAL C 223 -2.910 6.962 6.474 1.00 44.22 C ATOM 0 H VAL C 223 -2.636 9.297 9.809 1.00 1.14 H new ATOM 0 HA VAL C 223 -4.518 9.029 7.563 1.00 72.23 H new ATOM 0 HB VAL C 223 -2.254 8.971 6.776 1.00 41.43 H new ATOM 0 HG11 VAL C 223 -0.576 7.411 7.686 1.00 62.15 H new ATOM 0 HG12 VAL C 223 -1.157 8.550 8.924 1.00 62.15 H new ATOM 0 HG13 VAL C 223 -1.753 6.874 8.908 1.00 62.15 H new ATOM 0 HG21 VAL C 223 -2.032 6.677 5.894 1.00 44.22 H new ATOM 0 HG22 VAL C 223 -3.239 6.114 7.075 1.00 44.22 H new ATOM 0 HG23 VAL C 223 -3.711 7.259 5.797 1.00 44.22 H new ATOM 2078 N LYS C 224 -5.468 6.777 8.107 1.00 32.15 N ATOM 2079 CA LYS C 224 -6.210 5.591 8.512 1.00 11.50 C ATOM 2080 C LYS C 224 -5.619 4.306 7.966 1.00 15.11 C ATOM 2081 O LYS C 224 -5.700 3.282 8.607 1.00 70.05 O ATOM 2082 CB LYS C 224 -7.633 5.699 8.042 1.00 0.24 C ATOM 2083 CG LYS C 224 -8.367 6.843 8.674 1.00 54.02 C ATOM 2084 CD LYS C 224 -9.765 6.980 8.140 1.00 35.02 C ATOM 2085 CE LYS C 224 -10.545 5.715 8.323 1.00 33.21 C ATOM 2086 NZ LYS C 224 -10.643 5.288 9.752 1.00 12.23 N ATOM 0 H LYS C 224 -5.764 7.157 7.208 1.00 32.15 H new ATOM 0 HA LYS C 224 -6.155 5.547 9.600 1.00 11.50 H new ATOM 0 HB2 LYS C 224 -7.645 5.819 6.959 1.00 0.24 H new ATOM 0 HB3 LYS C 224 -8.156 4.769 8.265 1.00 0.24 H new ATOM 0 HG2 LYS C 224 -8.404 6.697 9.754 1.00 54.02 H new ATOM 0 HG3 LYS C 224 -7.819 7.768 8.496 1.00 54.02 H new ATOM 0 HD2 LYS C 224 -10.272 7.799 8.650 1.00 35.02 H new ATOM 0 HD3 LYS C 224 -9.728 7.237 7.081 1.00 35.02 H new ATOM 0 HE2 LYS C 224 -11.549 5.853 7.922 1.00 33.21 H new ATOM 0 HE3 LYS C 224 -10.077 4.919 7.744 1.00 33.21 H new ATOM 0 HZ1 LYS C 224 -11.454 4.647 9.868 1.00 12.23 H new ATOM 0 HZ2 LYS C 224 -9.770 4.795 10.028 1.00 12.23 H new ATOM 0 HZ3 LYS C 224 -10.774 6.124 10.356 1.00 12.23 H new ATOM 2100 N HIS C 225 -5.077 4.369 6.769 1.00 52.11 N ATOM 2101 CA HIS C 225 -4.460 3.211 6.091 1.00 35.34 C ATOM 2102 C HIS C 225 -3.896 3.612 4.765 1.00 65.42 C ATOM 2103 O HIS C 225 -4.209 4.693 4.268 1.00 53.32 O ATOM 2104 CB HIS C 225 -5.413 1.981 5.925 1.00 60.32 C ATOM 2105 CG HIS C 225 -6.779 2.239 5.321 1.00 31.42 C ATOM 2106 ND1 HIS C 225 -7.065 3.264 4.443 1.00 4.03 N ATOM 2107 CD2 HIS C 225 -7.957 1.607 5.535 1.00 24.15 C ATOM 2108 CE1 HIS C 225 -8.355 3.252 4.162 1.00 22.01 C ATOM 2109 NE2 HIS C 225 -8.914 2.262 4.808 1.00 24.11 N ATOM 0 H HIS C 225 -5.044 5.228 6.219 1.00 52.11 H new ATOM 0 HA HIS C 225 -3.657 2.882 6.751 1.00 35.34 H new ATOM 0 HB2 HIS C 225 -4.905 1.241 5.307 1.00 60.32 H new ATOM 0 HB3 HIS C 225 -5.558 1.531 6.907 1.00 60.32 H new ATOM 0 HD2 HIS C 225 -8.113 0.743 6.165 1.00 24.15 H new ATOM 0 HE1 HIS C 225 -8.864 3.944 3.508 1.00 22.01 H new ATOM 0 HE2 HIS C 225 -9.904 2.017 4.775 1.00 24.11 H new ATOM 2118 N LEU C 226 -3.109 2.737 4.187 1.00 71.15 N ATOM 2119 CA LEU C 226 -2.439 2.989 2.922 1.00 13.21 C ATOM 2120 C LEU C 226 -2.926 2.030 1.856 1.00 60.24 C ATOM 2121 O LEU C 226 -3.179 0.870 2.125 1.00 14.31 O ATOM 2122 CB LEU C 226 -0.892 2.835 3.054 1.00 60.21 C ATOM 2123 CG LEU C 226 -0.070 3.970 3.719 1.00 24.01 C ATOM 2124 CD1 LEU C 226 -0.501 4.249 5.136 1.00 35.15 C ATOM 2125 CD2 LEU C 226 1.424 3.635 3.679 1.00 53.01 C ATOM 0 H LEU C 226 -2.910 1.818 4.582 1.00 71.15 H new ATOM 0 HA LEU C 226 -2.676 4.014 2.638 1.00 13.21 H new ATOM 0 HB2 LEU C 226 -0.701 1.920 3.615 1.00 60.21 H new ATOM 0 HB3 LEU C 226 -0.491 2.684 2.052 1.00 60.21 H new ATOM 0 HG LEU C 226 -0.259 4.877 3.144 1.00 24.01 H new ATOM 0 HD11 LEU C 226 0.109 5.052 5.550 1.00 35.15 H new ATOM 0 HD12 LEU C 226 -1.549 4.548 5.145 1.00 35.15 H new ATOM 0 HD13 LEU C 226 -0.375 3.350 5.739 1.00 35.15 H new ATOM 0 HD21 LEU C 226 1.990 4.439 4.149 1.00 53.01 H new ATOM 0 HD22 LEU C 226 1.603 2.704 4.217 1.00 53.01 H new ATOM 0 HD23 LEU C 226 1.744 3.523 2.643 1.00 53.01 H new ATOM 2137 N LYS C 227 -3.088 2.537 0.677 1.00 21.42 N ATOM 2138 CA LYS C 227 -3.423 1.754 -0.479 1.00 3.24 C ATOM 2139 C LYS C 227 -2.234 1.825 -1.391 1.00 60.41 C ATOM 2140 O LYS C 227 -1.883 2.902 -1.817 1.00 53.34 O ATOM 2141 CB LYS C 227 -4.607 2.394 -1.239 1.00 75.24 C ATOM 2142 CG LYS C 227 -5.065 1.601 -2.468 1.00 50.14 C ATOM 2143 CD LYS C 227 -5.857 0.366 -2.088 1.00 43.30 C ATOM 2144 CE LYS C 227 -7.347 0.676 -1.895 1.00 2.42 C ATOM 2145 NZ LYS C 227 -7.637 1.746 -0.904 1.00 65.42 N ATOM 0 H LYS C 227 -2.989 3.533 0.481 1.00 21.42 H new ATOM 0 HA LYS C 227 -3.685 0.739 -0.182 1.00 3.24 H new ATOM 0 HB2 LYS C 227 -5.449 2.501 -0.555 1.00 75.24 H new ATOM 0 HB3 LYS C 227 -4.323 3.398 -1.553 1.00 75.24 H new ATOM 0 HG2 LYS C 227 -5.676 2.241 -3.105 1.00 50.14 H new ATOM 0 HG3 LYS C 227 -4.194 1.307 -3.054 1.00 50.14 H new ATOM 0 HD2 LYS C 227 -5.742 -0.391 -2.863 1.00 43.30 H new ATOM 0 HD3 LYS C 227 -5.452 -0.055 -1.168 1.00 43.30 H new ATOM 0 HE2 LYS C 227 -7.771 0.966 -2.856 1.00 2.42 H new ATOM 0 HE3 LYS C 227 -7.856 -0.236 -1.584 1.00 2.42 H new ATOM 0 HZ1 LYS C 227 -8.654 1.751 -0.686 1.00 65.42 H new ATOM 0 HZ2 LYS C 227 -7.097 1.568 -0.033 1.00 65.42 H new ATOM 0 HZ3 LYS C 227 -7.363 2.668 -1.299 1.00 65.42 H new ATOM 2159 N ILE C 228 -1.618 0.730 -1.689 1.00 62.44 N ATOM 2160 CA ILE C 228 -0.515 0.775 -2.600 1.00 53.43 C ATOM 2161 C ILE C 228 -1.005 0.257 -3.916 1.00 0.34 C ATOM 2162 O ILE C 228 -1.417 -0.911 -4.027 1.00 22.11 O ATOM 2163 CB ILE C 228 0.714 -0.053 -2.141 1.00 50.15 C ATOM 2164 CG1 ILE C 228 1.143 0.348 -0.726 1.00 70.31 C ATOM 2165 CG2 ILE C 228 1.873 0.180 -3.111 1.00 24.41 C ATOM 2166 CD1 ILE C 228 2.395 -0.360 -0.243 1.00 44.40 C ATOM 0 H ILE C 228 -1.851 -0.194 -1.325 1.00 62.44 H new ATOM 0 HA ILE C 228 -0.169 1.807 -2.660 1.00 53.43 H new ATOM 0 HB ILE C 228 0.440 -1.108 -2.134 1.00 50.15 H new ATOM 0 HG12 ILE C 228 1.312 1.424 -0.699 1.00 70.31 H new ATOM 0 HG13 ILE C 228 0.327 0.136 -0.035 1.00 70.31 H new ATOM 0 HG21 ILE C 228 2.738 -0.401 -2.791 1.00 24.41 H new ATOM 0 HG22 ILE C 228 1.577 -0.132 -4.113 1.00 24.41 H new ATOM 0 HG23 ILE C 228 2.131 1.239 -3.122 1.00 24.41 H new ATOM 0 HD11 ILE C 228 2.636 -0.025 0.766 1.00 44.40 H new ATOM 0 HD12 ILE C 228 2.225 -1.437 -0.237 1.00 44.40 H new ATOM 0 HD13 ILE C 228 3.225 -0.128 -0.911 1.00 44.40 H new ATOM 2178 N LEU C 229 -1.017 1.110 -4.886 1.00 21.32 N ATOM 2179 CA LEU C 229 -1.482 0.765 -6.182 1.00 55.41 C ATOM 2180 C LEU C 229 -0.377 0.946 -7.207 1.00 64.31 C ATOM 2181 O LEU C 229 0.396 1.918 -7.160 1.00 11.24 O ATOM 2182 CB LEU C 229 -2.817 1.517 -6.498 1.00 2.24 C ATOM 2183 CG LEU C 229 -2.824 3.038 -6.370 1.00 23.10 C ATOM 2184 CD1 LEU C 229 -2.151 3.697 -7.546 1.00 64.44 C ATOM 2185 CD2 LEU C 229 -4.229 3.541 -6.193 1.00 43.11 C ATOM 0 H LEU C 229 -0.700 2.075 -4.797 1.00 21.32 H new ATOM 0 HA LEU C 229 -1.736 -0.294 -6.227 1.00 55.41 H new ATOM 0 HB2 LEU C 229 -3.110 1.265 -7.517 1.00 2.24 H new ATOM 0 HB3 LEU C 229 -3.589 1.122 -5.837 1.00 2.24 H new ATOM 0 HG LEU C 229 -2.249 3.305 -5.483 1.00 23.10 H new ATOM 0 HD11 LEU C 229 -2.175 4.779 -7.420 1.00 64.44 H new ATOM 0 HD12 LEU C 229 -1.116 3.362 -7.607 1.00 64.44 H new ATOM 0 HD13 LEU C 229 -2.675 3.427 -8.463 1.00 64.44 H new ATOM 0 HD21 LEU C 229 -4.218 4.627 -6.103 1.00 43.11 H new ATOM 0 HD22 LEU C 229 -4.830 3.254 -7.056 1.00 43.11 H new ATOM 0 HD23 LEU C 229 -4.660 3.107 -5.291 1.00 43.11 H new ATOM 2197 N ASN C 230 -0.278 0.007 -8.091 1.00 62.50 N ATOM 2198 CA ASN C 230 0.769 -0.005 -9.064 1.00 22.21 C ATOM 2199 C ASN C 230 0.272 0.455 -10.400 1.00 3.11 C ATOM 2200 O ASN C 230 -0.625 -0.142 -10.978 1.00 53.01 O ATOM 2201 CB ASN C 230 1.358 -1.407 -9.189 1.00 23.54 C ATOM 2202 CG ASN C 230 2.387 -1.510 -10.296 1.00 64.21 C ATOM 2203 OD1 ASN C 230 3.582 -1.300 -10.079 1.00 21.12 O ATOM 2204 ND2 ASN C 230 1.932 -1.841 -11.484 1.00 14.11 N ATOM 0 H ASN C 230 -0.925 -0.779 -8.160 1.00 62.50 H new ATOM 0 HA ASN C 230 1.544 0.684 -8.729 1.00 22.21 H new ATOM 0 HB2 ASN C 230 1.819 -1.689 -8.242 1.00 23.54 H new ATOM 0 HB3 ASN C 230 0.555 -2.119 -9.377 1.00 23.54 H new ATOM 0 HD21 ASN C 230 2.576 -1.933 -12.269 1.00 14.11 H new ATOM 0 HD22 ASN C 230 0.935 -2.006 -11.620 1.00 14.11 H new ATOM 2211 N THR C 231 0.824 1.522 -10.867 1.00 1.30 N ATOM 2212 CA THR C 231 0.512 1.997 -12.170 1.00 32.35 C ATOM 2213 C THR C 231 1.767 1.931 -13.036 1.00 62.14 C ATOM 2214 O THR C 231 2.857 2.154 -12.533 1.00 71.23 O ATOM 2215 CB THR C 231 -0.026 3.436 -12.109 1.00 2.33 C ATOM 2216 OG1 THR C 231 0.941 4.300 -11.491 1.00 53.43 O ATOM 2217 CG2 THR C 231 -1.307 3.481 -11.301 1.00 71.32 C ATOM 0 H THR C 231 1.503 2.088 -10.358 1.00 1.30 H new ATOM 0 HA THR C 231 -0.265 1.370 -12.607 1.00 32.35 H new ATOM 0 HB THR C 231 -0.222 3.772 -13.127 1.00 2.33 H new ATOM 0 HG1 THR C 231 1.815 3.858 -11.481 1.00 53.43 H new ATOM 0 HG21 THR C 231 -1.679 4.505 -11.265 1.00 71.32 H new ATOM 0 HG22 THR C 231 -2.055 2.840 -11.768 1.00 71.32 H new ATOM 0 HG23 THR C 231 -1.111 3.130 -10.288 1.00 71.32 H new ATOM 2225 N PRO C 232 1.659 1.611 -14.331 1.00 12.03 N ATOM 2226 CA PRO C 232 2.820 1.588 -15.225 1.00 5.54 C ATOM 2227 C PRO C 232 3.201 3.006 -15.693 1.00 1.14 C ATOM 2228 O PRO C 232 4.162 3.194 -16.438 1.00 14.22 O ATOM 2229 CB PRO C 232 2.339 0.738 -16.425 1.00 12.23 C ATOM 2230 CG PRO C 232 0.970 0.245 -16.051 1.00 25.30 C ATOM 2231 CD PRO C 232 0.442 1.210 -15.035 1.00 50.05 C ATOM 0 HA PRO C 232 3.709 1.187 -14.738 1.00 5.54 H new ATOM 0 HB2 PRO C 232 2.305 1.333 -17.338 1.00 12.23 H new ATOM 0 HB3 PRO C 232 3.017 -0.094 -16.612 1.00 12.23 H new ATOM 0 HG2 PRO C 232 0.319 0.204 -16.924 1.00 25.30 H new ATOM 0 HG3 PRO C 232 1.018 -0.764 -15.642 1.00 25.30 H new ATOM 0 HD2 PRO C 232 -0.058 2.059 -15.501 1.00 50.05 H new ATOM 0 HD3 PRO C 232 -0.281 0.743 -14.366 1.00 50.05 H new ATOM 2239 N ASN C 233 2.437 3.991 -15.241 1.00 75.44 N ATOM 2240 CA ASN C 233 2.641 5.388 -15.638 1.00 50.52 C ATOM 2241 C ASN C 233 3.284 6.190 -14.518 1.00 52.34 C ATOM 2242 O ASN C 233 4.093 7.087 -14.764 1.00 4.21 O ATOM 2243 CB ASN C 233 1.308 6.027 -16.018 1.00 24.03 C ATOM 2244 CG ASN C 233 0.605 5.300 -17.143 1.00 42.02 C ATOM 2245 OD1 ASN C 233 -0.171 4.378 -16.907 1.00 42.20 O ATOM 2246 ND2 ASN C 233 0.865 5.699 -18.367 1.00 5.04 N ATOM 0 H ASN C 233 1.662 3.852 -14.593 1.00 75.44 H new ATOM 0 HA ASN C 233 3.310 5.395 -16.499 1.00 50.52 H new ATOM 0 HB2 ASN C 233 0.658 6.047 -15.143 1.00 24.03 H new ATOM 0 HB3 ASN C 233 1.478 7.063 -16.312 1.00 24.03 H new ATOM 0 HD21 ASN C 233 0.417 5.239 -19.159 1.00 5.04 H new ATOM 0 HD22 ASN C 233 1.515 6.469 -18.525 1.00 5.04 H new ATOM 2253 N CYS C 234 2.958 5.841 -13.304 1.00 33.24 N ATOM 2254 CA CYS C 234 3.478 6.513 -12.138 1.00 1.20 C ATOM 2255 C CYS C 234 4.149 5.464 -11.248 1.00 42.53 C ATOM 2256 O CYS C 234 3.614 4.375 -11.080 1.00 73.40 O ATOM 2257 CB CYS C 234 2.329 7.266 -11.392 1.00 21.41 C ATOM 2258 SG CYS C 234 1.588 8.686 -12.321 1.00 1.35 S ATOM 0 H CYS C 234 2.318 5.076 -13.091 1.00 33.24 H new ATOM 0 HA CYS C 234 4.216 7.265 -12.419 1.00 1.20 H new ATOM 0 HB2 CYS C 234 1.539 6.552 -11.160 1.00 21.41 H new ATOM 0 HB3 CYS C 234 2.715 7.635 -10.442 1.00 21.41 H new ATOM 2263 N ALA C 235 5.330 5.811 -10.703 1.00 54.33 N ATOM 2264 CA ALA C 235 6.212 4.879 -9.956 1.00 63.11 C ATOM 2265 C ALA C 235 5.469 3.997 -8.953 1.00 71.51 C ATOM 2266 O ALA C 235 5.274 2.811 -9.188 1.00 74.51 O ATOM 2267 CB ALA C 235 7.344 5.649 -9.274 1.00 13.00 C ATOM 0 H ALA C 235 5.708 6.756 -10.767 1.00 54.33 H new ATOM 0 HA ALA C 235 6.631 4.196 -10.695 1.00 63.11 H new ATOM 0 HB1 ALA C 235 7.982 4.952 -8.730 1.00 13.00 H new ATOM 0 HB2 ALA C 235 7.935 6.170 -10.027 1.00 13.00 H new ATOM 0 HB3 ALA C 235 6.923 6.374 -8.578 1.00 13.00 H new ATOM 2273 N CYS C 236 5.072 4.567 -7.864 1.00 3.22 N ATOM 2274 CA CYS C 236 4.324 3.858 -6.861 1.00 22.40 C ATOM 2275 C CYS C 236 3.439 4.872 -6.219 1.00 22.14 C ATOM 2276 O CYS C 236 3.903 5.958 -5.852 1.00 71.24 O ATOM 2277 CB CYS C 236 5.282 3.202 -5.833 1.00 54.11 C ATOM 2278 SG CYS C 236 4.523 2.105 -4.582 1.00 61.02 S ATOM 0 H CYS C 236 5.255 5.544 -7.637 1.00 3.22 H new ATOM 0 HA CYS C 236 3.735 3.047 -7.289 1.00 22.40 H new ATOM 0 HB2 CYS C 236 6.027 2.626 -6.382 1.00 54.11 H new ATOM 0 HB3 CYS C 236 5.815 3.996 -5.310 1.00 54.11 H new ATOM 2283 N GLN C 237 2.187 4.582 -6.145 1.00 52.34 N ATOM 2284 CA GLN C 237 1.250 5.504 -5.603 1.00 13.02 C ATOM 2285 C GLN C 237 0.544 4.905 -4.438 1.00 21.30 C ATOM 2286 O GLN C 237 -0.069 3.833 -4.536 1.00 63.03 O ATOM 2287 CB GLN C 237 0.266 5.982 -6.662 1.00 15.14 C ATOM 2288 CG GLN C 237 0.883 6.842 -7.754 1.00 42.01 C ATOM 2289 CD GLN C 237 1.492 8.120 -7.204 1.00 4.42 C ATOM 2290 OE1 GLN C 237 2.512 8.606 -7.845 1.00 43.11 O flip ATOM 2291 NE2 GLN C 237 1.041 8.664 -6.197 1.00 32.01 N flip ATOM 0 H GLN C 237 1.783 3.699 -6.458 1.00 52.34 H new ATOM 0 HA GLN C 237 1.798 6.379 -5.254 1.00 13.02 H new ATOM 0 HB2 GLN C 237 -0.203 5.113 -7.123 1.00 15.14 H new ATOM 0 HB3 GLN C 237 -0.526 6.550 -6.174 1.00 15.14 H new ATOM 0 HG2 GLN C 237 1.652 6.270 -8.274 1.00 42.01 H new ATOM 0 HG3 GLN C 237 0.120 7.093 -8.491 1.00 42.01 H new ATOM 0 HE21 GLN C 237 0.239 8.259 -5.715 1.00 32.01 H new ATOM 0 HE22 GLN C 237 1.469 9.520 -5.845 1.00 32.01 H new ATOM 2300 N ILE C 238 0.652 5.572 -3.335 1.00 13.53 N ATOM 2301 CA ILE C 238 0.048 5.135 -2.133 1.00 65.44 C ATOM 2302 C ILE C 238 -1.050 6.099 -1.763 1.00 15.24 C ATOM 2303 O ILE C 238 -0.816 7.289 -1.692 1.00 71.34 O ATOM 2304 CB ILE C 238 1.089 5.049 -0.990 1.00 64.45 C ATOM 2305 CG1 ILE C 238 2.206 4.062 -1.375 1.00 52.04 C ATOM 2306 CG2 ILE C 238 0.418 4.629 0.301 1.00 52.33 C ATOM 2307 CD1 ILE C 238 3.264 3.853 -0.309 1.00 53.30 C ATOM 0 H ILE C 238 1.170 6.446 -3.250 1.00 13.53 H new ATOM 0 HA ILE C 238 -0.366 4.138 -2.282 1.00 65.44 H new ATOM 0 HB ILE C 238 1.533 6.032 -0.835 1.00 64.45 H new ATOM 0 HG12 ILE C 238 1.755 3.099 -1.613 1.00 52.04 H new ATOM 0 HG13 ILE C 238 2.691 4.420 -2.283 1.00 52.04 H new ATOM 0 HG21 ILE C 238 1.162 4.573 1.096 1.00 52.33 H new ATOM 0 HG22 ILE C 238 -0.345 5.360 0.569 1.00 52.33 H new ATOM 0 HG23 ILE C 238 -0.046 3.652 0.169 1.00 52.33 H new ATOM 0 HD11 ILE C 238 4.008 3.143 -0.669 1.00 53.30 H new ATOM 0 HD12 ILE C 238 3.748 4.804 -0.085 1.00 53.30 H new ATOM 0 HD13 ILE C 238 2.797 3.462 0.595 1.00 53.30 H new ATOM 2319 N VAL C 239 -2.227 5.589 -1.518 1.00 53.22 N ATOM 2320 CA VAL C 239 -3.354 6.428 -1.182 1.00 11.20 C ATOM 2321 C VAL C 239 -3.679 6.233 0.282 1.00 64.13 C ATOM 2322 O VAL C 239 -3.867 5.111 0.744 1.00 42.44 O ATOM 2323 CB VAL C 239 -4.619 6.065 -2.018 1.00 45.23 C ATOM 2324 CG1 VAL C 239 -5.745 7.053 -1.767 1.00 1.21 C ATOM 2325 CG2 VAL C 239 -4.303 5.961 -3.500 1.00 15.31 C ATOM 0 H VAL C 239 -2.435 4.591 -1.544 1.00 53.22 H new ATOM 0 HA VAL C 239 -3.084 7.461 -1.400 1.00 11.20 H new ATOM 0 HB VAL C 239 -4.954 5.082 -1.687 1.00 45.23 H new ATOM 0 HG11 VAL C 239 -6.614 6.774 -2.364 1.00 1.21 H new ATOM 0 HG12 VAL C 239 -6.011 7.040 -0.710 1.00 1.21 H new ATOM 0 HG13 VAL C 239 -5.419 8.055 -2.047 1.00 1.21 H new ATOM 0 HG21 VAL C 239 -5.210 5.707 -4.048 1.00 15.31 H new ATOM 0 HG22 VAL C 239 -3.918 6.916 -3.858 1.00 15.31 H new ATOM 0 HG23 VAL C 239 -3.554 5.186 -3.659 1.00 15.31 H new ATOM 2335 N ALA C 240 -3.744 7.299 0.993 1.00 74.14 N ATOM 2336 CA ALA C 240 -4.012 7.277 2.388 1.00 61.23 C ATOM 2337 C ALA C 240 -5.305 8.013 2.652 1.00 45.02 C ATOM 2338 O ALA C 240 -5.506 9.132 2.168 1.00 53.04 O ATOM 2339 CB ALA C 240 -2.861 7.924 3.141 1.00 52.43 C ATOM 0 H ALA C 240 -3.609 8.236 0.613 1.00 74.14 H new ATOM 0 HA ALA C 240 -4.112 6.248 2.734 1.00 61.23 H new ATOM 0 HB1 ALA C 240 -3.070 7.905 4.211 1.00 52.43 H new ATOM 0 HB2 ALA C 240 -1.941 7.375 2.941 1.00 52.43 H new ATOM 0 HB3 ALA C 240 -2.746 8.957 2.812 1.00 52.43 H new ATOM 2345 N ARG C 241 -6.190 7.395 3.385 1.00 42.23 N ATOM 2346 CA ARG C 241 -7.421 8.031 3.708 1.00 74.03 C ATOM 2347 C ARG C 241 -7.271 8.633 5.085 1.00 54.11 C ATOM 2348 O ARG C 241 -6.813 7.965 6.014 1.00 0.43 O ATOM 2349 CB ARG C 241 -8.584 7.042 3.636 1.00 13.32 C ATOM 2350 CG ARG C 241 -9.944 7.694 3.756 1.00 13.10 C ATOM 2351 CD ARG C 241 -11.060 6.692 3.574 1.00 60.42 C ATOM 2352 NE ARG C 241 -12.378 7.331 3.568 1.00 14.02 N ATOM 2353 CZ ARG C 241 -13.539 6.663 3.468 1.00 0.32 C ATOM 2354 NH1 ARG C 241 -13.539 5.345 3.412 1.00 5.31 N ATOM 2355 NH2 ARG C 241 -14.694 7.323 3.413 1.00 21.41 N ATOM 0 H ARG C 241 -6.075 6.455 3.765 1.00 42.23 H new ATOM 0 HA ARG C 241 -7.651 8.816 2.988 1.00 74.03 H new ATOM 0 HB2 ARG C 241 -8.532 6.502 2.691 1.00 13.32 H new ATOM 0 HB3 ARG C 241 -8.473 6.305 4.431 1.00 13.32 H new ATOM 0 HG2 ARG C 241 -10.036 8.168 4.733 1.00 13.10 H new ATOM 0 HG3 ARG C 241 -10.037 8.483 3.009 1.00 13.10 H new ATOM 0 HD2 ARG C 241 -10.914 6.154 2.637 1.00 60.42 H new ATOM 0 HD3 ARG C 241 -11.019 5.954 4.375 1.00 60.42 H new ATOM 0 HE ARG C 241 -12.417 8.347 3.645 1.00 14.02 H new ATOM 0 HH11 ARG C 241 -12.657 4.833 3.445 1.00 5.31 H new ATOM 0 HH12 ARG C 241 -14.421 4.838 3.336 1.00 5.31 H new ATOM 0 HH21 ARG C 241 -14.701 8.342 3.447 1.00 21.41 H new ATOM 0 HH22 ARG C 241 -15.572 6.809 3.337 1.00 21.41 H new ATOM 2369 N LEU C 242 -7.602 9.879 5.192 1.00 24.31 N ATOM 2370 CA LEU C 242 -7.405 10.650 6.406 1.00 44.21 C ATOM 2371 C LEU C 242 -8.417 10.320 7.510 1.00 4.13 C ATOM 2372 O LEU C 242 -9.626 10.185 7.258 1.00 65.03 O ATOM 2373 CB LEU C 242 -7.396 12.168 6.119 1.00 14.23 C ATOM 2374 CG LEU C 242 -6.347 12.713 5.123 1.00 61.42 C ATOM 2375 CD1 LEU C 242 -4.954 12.159 5.392 1.00 21.13 C ATOM 2376 CD2 LEU C 242 -6.766 12.504 3.683 1.00 30.12 C ATOM 0 H LEU C 242 -8.026 10.412 4.432 1.00 24.31 H new ATOM 0 HA LEU C 242 -6.425 10.357 6.781 1.00 44.21 H new ATOM 0 HB2 LEU C 242 -8.383 12.443 5.748 1.00 14.23 H new ATOM 0 HB3 LEU C 242 -7.256 12.686 7.068 1.00 14.23 H new ATOM 0 HG LEU C 242 -6.296 13.789 5.287 1.00 61.42 H new ATOM 0 HD11 LEU C 242 -4.252 12.571 4.667 1.00 21.13 H new ATOM 0 HD12 LEU C 242 -4.640 12.436 6.398 1.00 21.13 H new ATOM 0 HD13 LEU C 242 -4.971 11.073 5.304 1.00 21.13 H new ATOM 0 HD21 LEU C 242 -5.999 12.902 3.019 1.00 30.12 H new ATOM 0 HD22 LEU C 242 -6.893 11.438 3.492 1.00 30.12 H new ATOM 0 HD23 LEU C 242 -7.708 13.021 3.500 1.00 30.12 H new ATOM 2388 N LYS C 243 -7.882 10.171 8.725 1.00 71.14 N ATOM 2389 CA LYS C 243 -8.624 9.897 9.969 1.00 40.44 C ATOM 2390 C LYS C 243 -9.803 10.828 10.190 1.00 1.34 C ATOM 2391 O LYS C 243 -9.625 11.992 10.568 1.00 3.43 O ATOM 2392 CB LYS C 243 -7.679 9.946 11.175 1.00 35.35 C ATOM 2393 CG LYS C 243 -6.637 8.836 11.186 1.00 34.54 C ATOM 2394 CD LYS C 243 -5.619 8.998 12.312 1.00 33.51 C ATOM 2395 CE LYS C 243 -6.266 9.029 13.680 1.00 20.44 C ATOM 2396 NZ LYS C 243 -5.265 9.149 14.760 1.00 71.11 N ATOM 0 H LYS C 243 -6.876 10.240 8.880 1.00 71.14 H new ATOM 0 HA LYS C 243 -9.038 8.894 9.862 1.00 40.44 H new ATOM 0 HB2 LYS C 243 -7.170 10.910 11.186 1.00 35.35 H new ATOM 0 HB3 LYS C 243 -8.269 9.886 12.090 1.00 35.35 H new ATOM 0 HG2 LYS C 243 -7.138 7.873 11.290 1.00 34.54 H new ATOM 0 HG3 LYS C 243 -6.116 8.823 10.229 1.00 34.54 H new ATOM 0 HD2 LYS C 243 -4.903 8.177 12.271 1.00 33.51 H new ATOM 0 HD3 LYS C 243 -5.057 9.919 12.159 1.00 33.51 H new ATOM 0 HE2 LYS C 243 -6.961 9.867 13.734 1.00 20.44 H new ATOM 0 HE3 LYS C 243 -6.850 8.121 13.826 1.00 20.44 H new ATOM 0 HZ1 LYS C 243 -5.672 9.686 15.552 1.00 71.11 H new ATOM 0 HZ2 LYS C 243 -4.993 8.200 15.088 1.00 71.11 H new ATOM 0 HZ3 LYS C 243 -4.424 9.645 14.401 1.00 71.11 H new ATOM 2410 N ASN C 244 -10.986 10.284 9.898 1.00 74.01 N ATOM 2411 CA ASN C 244 -12.323 10.907 10.034 1.00 44.32 C ATOM 2412 C ASN C 244 -13.186 10.209 9.009 1.00 15.15 C ATOM 2413 O ASN C 244 -14.219 9.633 9.313 1.00 52.30 O ATOM 2414 CB ASN C 244 -12.303 12.424 9.687 1.00 65.31 C ATOM 2415 CG ASN C 244 -13.654 13.108 9.854 1.00 35.21 C ATOM 2416 OD1 ASN C 244 -14.458 13.150 8.925 1.00 64.22 O ATOM 2417 ND2 ASN C 244 -13.898 13.680 11.007 1.00 24.04 N ATOM 0 H ASN C 244 -11.050 9.333 9.535 1.00 74.01 H new ATOM 0 HA ASN C 244 -12.679 10.812 11.060 1.00 44.32 H new ATOM 0 HB2 ASN C 244 -11.572 12.923 10.323 1.00 65.31 H new ATOM 0 HB3 ASN C 244 -11.968 12.548 8.657 1.00 65.31 H new ATOM 0 HD21 ASN C 244 -14.776 14.178 11.153 1.00 24.04 H new ATOM 0 HD22 ASN C 244 -13.210 13.627 11.758 1.00 24.04 H new ATOM 2424 N ASN C 245 -12.657 10.270 7.795 1.00 44.10 N ATOM 2425 CA ASN C 245 -13.137 9.739 6.500 1.00 12.03 C ATOM 2426 C ASN C 245 -12.539 10.642 5.506 1.00 65.33 C ATOM 2427 O ASN C 245 -11.841 10.211 4.592 1.00 24.23 O ATOM 2428 CB ASN C 245 -14.677 9.716 6.301 1.00 65.22 C ATOM 2429 CG ASN C 245 -15.338 8.487 6.894 1.00 54.24 C ATOM 2430 OD1 ASN C 245 -14.730 7.407 6.967 1.00 33.15 O ATOM 2431 ND2 ASN C 245 -16.573 8.618 7.296 1.00 73.02 N ATOM 0 H ASN C 245 -11.767 10.752 7.665 1.00 44.10 H new ATOM 0 HA ASN C 245 -12.852 8.690 6.422 1.00 12.03 H new ATOM 0 HB2 ASN C 245 -15.109 10.608 6.755 1.00 65.22 H new ATOM 0 HB3 ASN C 245 -14.900 9.762 5.235 1.00 65.22 H new ATOM 0 HD21 ASN C 245 -17.070 7.817 7.686 1.00 73.02 H new ATOM 0 HD22 ASN C 245 -17.041 9.521 7.221 1.00 73.02 H new ATOM 2438 N ASN C 246 -12.823 11.938 5.732 1.00 10.54 N ATOM 2439 CA ASN C 246 -12.232 13.067 5.031 1.00 3.24 C ATOM 2440 C ASN C 246 -12.177 12.811 3.520 1.00 33.33 C ATOM 2441 O ASN C 246 -13.219 12.647 2.879 1.00 61.34 O ATOM 2442 CB ASN C 246 -10.840 13.360 5.658 1.00 12.23 C ATOM 2443 CG ASN C 246 -10.146 14.633 5.183 1.00 34.42 C ATOM 2444 OD1 ASN C 246 -9.405 14.623 4.216 1.00 61.51 O ATOM 2445 ND2 ASN C 246 -10.371 15.723 5.878 1.00 51.10 N ATOM 0 H ASN C 246 -13.499 12.227 6.439 1.00 10.54 H new ATOM 0 HA ASN C 246 -12.851 13.957 5.149 1.00 3.24 H new ATOM 0 HB2 ASN C 246 -10.956 13.415 6.740 1.00 12.23 H new ATOM 0 HB3 ASN C 246 -10.185 12.514 5.450 1.00 12.23 H new ATOM 0 HD21 ASN C 246 -9.919 16.599 5.614 1.00 51.10 H new ATOM 0 HD22 ASN C 246 -10.998 15.695 6.682 1.00 51.10 H new ATOM 2452 N ARG C 247 -10.999 12.738 2.963 1.00 34.44 N ATOM 2453 CA ARG C 247 -10.826 12.426 1.572 1.00 63.04 C ATOM 2454 C ARG C 247 -9.732 11.403 1.468 1.00 62.43 C ATOM 2455 O ARG C 247 -9.263 10.874 2.492 1.00 33.02 O ATOM 2456 CB ARG C 247 -10.430 13.672 0.712 1.00 41.22 C ATOM 2457 CG ARG C 247 -11.421 14.838 0.697 1.00 1.11 C ATOM 2458 CD ARG C 247 -11.397 15.645 1.980 1.00 23.02 C ATOM 2459 NE ARG C 247 -12.429 16.673 2.001 1.00 74.12 N ATOM 2460 CZ ARG C 247 -12.566 17.601 2.949 1.00 24.15 C ATOM 2461 NH1 ARG C 247 -11.657 17.714 3.916 1.00 3.03 N ATOM 2462 NH2 ARG C 247 -13.598 18.429 2.913 1.00 54.45 N ATOM 0 H ARG C 247 -10.126 12.895 3.466 1.00 34.44 H new ATOM 0 HA ARG C 247 -11.777 12.059 1.186 1.00 63.04 H new ATOM 0 HB2 ARG C 247 -9.471 14.044 1.073 1.00 41.22 H new ATOM 0 HB3 ARG C 247 -10.277 13.342 -0.315 1.00 41.22 H new ATOM 0 HG2 ARG C 247 -11.192 15.493 -0.143 1.00 1.11 H new ATOM 0 HG3 ARG C 247 -12.427 14.452 0.535 1.00 1.11 H new ATOM 0 HD2 ARG C 247 -11.534 14.977 2.830 1.00 23.02 H new ATOM 0 HD3 ARG C 247 -10.419 16.112 2.096 1.00 23.02 H new ATOM 0 HE ARG C 247 -13.098 16.684 1.231 1.00 74.12 H new ATOM 0 HH11 ARG C 247 -10.851 17.089 3.934 1.00 3.03 H new ATOM 0 HH12 ARG C 247 -11.767 18.426 4.639 1.00 3.03 H new ATOM 0 HH21 ARG C 247 -14.285 18.356 2.162 1.00 54.45 H new ATOM 0 HH22 ARG C 247 -13.707 19.140 3.636 1.00 54.45 H new ATOM 2476 N GLN C 248 -9.336 11.108 0.275 1.00 3.34 N ATOM 2477 CA GLN C 248 -8.222 10.255 0.065 1.00 0.54 C ATOM 2478 C GLN C 248 -7.131 11.076 -0.580 1.00 55.21 C ATOM 2479 O GLN C 248 -7.379 11.816 -1.539 1.00 5.01 O ATOM 2480 CB GLN C 248 -8.590 9.040 -0.810 1.00 22.02 C ATOM 2481 CG GLN C 248 -9.152 9.398 -2.182 1.00 60.44 C ATOM 2482 CD GLN C 248 -9.399 8.195 -3.074 1.00 61.34 C ATOM 2483 OE1 GLN C 248 -9.701 7.060 -2.489 1.00 65.34 O flip ATOM 2484 NE2 GLN C 248 -9.316 8.296 -4.299 1.00 23.30 N flip ATOM 0 H GLN C 248 -9.777 11.452 -0.578 1.00 3.34 H new ATOM 0 HA GLN C 248 -7.882 9.853 1.019 1.00 0.54 H new ATOM 0 HB2 GLN C 248 -7.702 8.422 -0.945 1.00 22.02 H new ATOM 0 HB3 GLN C 248 -9.323 8.433 -0.278 1.00 22.02 H new ATOM 0 HG2 GLN C 248 -10.088 9.940 -2.051 1.00 60.44 H new ATOM 0 HG3 GLN C 248 -8.460 10.074 -2.683 1.00 60.44 H new ATOM 0 HE21 GLN C 248 -9.079 9.193 -4.722 1.00 23.30 H new ATOM 0 HE22 GLN C 248 -9.484 7.482 -4.890 1.00 23.30 H new ATOM 2493 N VAL C 249 -5.963 10.985 -0.054 1.00 62.14 N ATOM 2494 CA VAL C 249 -4.843 11.695 -0.590 1.00 23.24 C ATOM 2495 C VAL C 249 -3.754 10.716 -0.812 1.00 61.32 C ATOM 2496 O VAL C 249 -3.737 9.667 -0.191 1.00 32.02 O ATOM 2497 CB VAL C 249 -4.342 12.866 0.330 1.00 72.41 C ATOM 2498 CG1 VAL C 249 -5.425 13.913 0.533 1.00 33.21 C ATOM 2499 CG2 VAL C 249 -3.810 12.358 1.675 1.00 20.14 C ATOM 0 H VAL C 249 -5.749 10.415 0.764 1.00 62.14 H new ATOM 0 HA VAL C 249 -5.154 12.168 -1.521 1.00 23.24 H new ATOM 0 HB VAL C 249 -3.508 13.339 -0.188 1.00 72.41 H new ATOM 0 HG11 VAL C 249 -5.046 14.709 1.174 1.00 33.21 H new ATOM 0 HG12 VAL C 249 -5.713 14.330 -0.432 1.00 33.21 H new ATOM 0 HG13 VAL C 249 -6.294 13.452 1.003 1.00 33.21 H new ATOM 0 HG21 VAL C 249 -3.475 13.203 2.276 1.00 20.14 H new ATOM 0 HG22 VAL C 249 -4.603 11.828 2.203 1.00 20.14 H new ATOM 0 HG23 VAL C 249 -2.973 11.681 1.503 1.00 20.14 H new ATOM 2509 N CYS C 250 -2.869 11.010 -1.668 1.00 73.44 N ATOM 2510 CA CYS C 250 -1.817 10.104 -1.898 1.00 71.20 C ATOM 2511 C CYS C 250 -0.590 10.563 -1.214 1.00 73.03 C ATOM 2512 O CYS C 250 -0.415 11.746 -0.953 1.00 13.23 O ATOM 2513 CB CYS C 250 -1.591 9.865 -3.374 1.00 11.05 C ATOM 2514 SG CYS C 250 -2.987 9.049 -4.196 1.00 2.12 S ATOM 0 H CYS C 250 -2.845 11.866 -2.223 1.00 73.44 H new ATOM 0 HA CYS C 250 -2.098 9.140 -1.474 1.00 71.20 H new ATOM 0 HB2 CYS C 250 -1.399 10.820 -3.863 1.00 11.05 H new ATOM 0 HB3 CYS C 250 -0.697 9.255 -3.503 1.00 11.05 H new ATOM 2519 N ILE C 251 0.214 9.638 -0.872 1.00 21.53 N ATOM 2520 CA ILE C 251 1.401 9.891 -0.152 1.00 61.33 C ATOM 2521 C ILE C 251 2.554 9.615 -1.065 1.00 30.54 C ATOM 2522 O ILE C 251 2.427 8.804 -1.998 1.00 31.10 O ATOM 2523 CB ILE C 251 1.498 8.924 1.063 1.00 64.23 C ATOM 2524 CG1 ILE C 251 0.224 8.963 1.901 1.00 14.53 C ATOM 2525 CG2 ILE C 251 2.681 9.276 1.928 1.00 32.21 C ATOM 2526 CD1 ILE C 251 -0.097 10.320 2.469 1.00 11.34 C ATOM 0 H ILE C 251 0.064 8.653 -1.090 1.00 21.53 H new ATOM 0 HA ILE C 251 1.410 10.922 0.203 1.00 61.33 H new ATOM 0 HB ILE C 251 1.627 7.915 0.671 1.00 64.23 H new ATOM 0 HG12 ILE C 251 -0.613 8.631 1.286 1.00 14.53 H new ATOM 0 HG13 ILE C 251 0.319 8.251 2.721 1.00 14.53 H new ATOM 0 HG21 ILE C 251 2.732 8.589 2.772 1.00 32.21 H new ATOM 0 HG22 ILE C 251 3.596 9.199 1.341 1.00 32.21 H new ATOM 0 HG23 ILE C 251 2.572 10.296 2.297 1.00 32.21 H new ATOM 0 HD11 ILE C 251 -1.017 10.262 3.051 1.00 11.34 H new ATOM 0 HD12 ILE C 251 0.720 10.648 3.112 1.00 11.34 H new ATOM 0 HD13 ILE C 251 -0.227 11.034 1.655 1.00 11.34 H new ATOM 2538 N ASP C 252 3.647 10.285 -0.854 1.00 21.44 N ATOM 2539 CA ASP C 252 4.829 9.960 -1.608 1.00 34.23 C ATOM 2540 C ASP C 252 5.471 8.747 -0.942 1.00 44.32 C ATOM 2541 O ASP C 252 5.813 8.794 0.237 1.00 71.12 O ATOM 2542 CB ASP C 252 5.817 11.121 -1.686 1.00 52.32 C ATOM 2543 CG ASP C 252 6.984 10.794 -2.593 1.00 42.25 C ATOM 2544 OD1 ASP C 252 7.958 10.198 -2.132 1.00 50.14 O ATOM 2545 OD2 ASP C 252 6.914 11.096 -3.806 1.00 23.22 O ATOM 0 H ASP C 252 3.750 11.045 -0.182 1.00 21.44 H new ATOM 0 HA ASP C 252 4.549 9.743 -2.639 1.00 34.23 H new ATOM 0 HB2 ASP C 252 5.306 12.011 -2.054 1.00 52.32 H new ATOM 0 HB3 ASP C 252 6.185 11.355 -0.687 1.00 52.32 H new ATOM 2550 N PRO C 253 5.625 7.642 -1.672 1.00 42.13 N ATOM 2551 CA PRO C 253 6.125 6.376 -1.110 1.00 73.14 C ATOM 2552 C PRO C 253 7.596 6.422 -0.724 1.00 31.03 C ATOM 2553 O PRO C 253 8.128 5.484 -0.156 1.00 62.51 O ATOM 2554 CB PRO C 253 5.923 5.389 -2.247 1.00 20.04 C ATOM 2555 CG PRO C 253 5.957 6.216 -3.475 1.00 65.00 C ATOM 2556 CD PRO C 253 5.325 7.518 -3.103 1.00 13.13 C ATOM 0 HA PRO C 253 5.604 6.123 -0.187 1.00 73.14 H new ATOM 0 HB2 PRO C 253 6.707 4.632 -2.258 1.00 20.04 H new ATOM 0 HB3 PRO C 253 4.973 4.863 -2.150 1.00 20.04 H new ATOM 0 HG2 PRO C 253 6.980 6.362 -3.820 1.00 65.00 H new ATOM 0 HG3 PRO C 253 5.412 5.734 -4.287 1.00 65.00 H new ATOM 0 HD2 PRO C 253 5.743 8.346 -3.675 1.00 13.13 H new ATOM 0 HD3 PRO C 253 4.251 7.512 -3.290 1.00 13.13 H new ATOM 2564 N LYS C 254 8.227 7.520 -1.009 1.00 53.24 N ATOM 2565 CA LYS C 254 9.623 7.680 -0.765 1.00 42.33 C ATOM 2566 C LYS C 254 9.840 8.474 0.534 1.00 22.45 C ATOM 2567 O LYS C 254 10.961 8.852 0.876 1.00 33.42 O ATOM 2568 CB LYS C 254 10.251 8.347 -1.987 1.00 10.10 C ATOM 2569 CG LYS C 254 10.074 7.511 -3.272 1.00 40.03 C ATOM 2570 CD LYS C 254 10.499 8.249 -4.549 1.00 4.41 C ATOM 2571 CE LYS C 254 9.626 9.467 -4.813 1.00 22.50 C ATOM 2572 NZ LYS C 254 8.206 9.108 -4.992 1.00 43.44 N ATOM 0 H LYS C 254 7.779 8.338 -1.422 1.00 53.24 H new ATOM 0 HA LYS C 254 10.112 6.717 -0.620 1.00 42.33 H new ATOM 0 HB2 LYS C 254 9.802 9.330 -2.132 1.00 10.10 H new ATOM 0 HB3 LYS C 254 11.314 8.506 -1.804 1.00 10.10 H new ATOM 0 HG2 LYS C 254 10.656 6.594 -3.182 1.00 40.03 H new ATOM 0 HG3 LYS C 254 9.028 7.217 -3.363 1.00 40.03 H new ATOM 0 HD2 LYS C 254 11.540 8.560 -4.460 1.00 4.41 H new ATOM 0 HD3 LYS C 254 10.441 7.569 -5.399 1.00 4.41 H new ATOM 0 HE2 LYS C 254 9.720 10.166 -3.982 1.00 22.50 H new ATOM 0 HE3 LYS C 254 9.984 9.982 -5.705 1.00 22.50 H new ATOM 0 HZ1 LYS C 254 7.628 9.972 -5.000 1.00 43.44 H new ATOM 0 HZ2 LYS C 254 8.086 8.603 -5.893 1.00 43.44 H new ATOM 0 HZ3 LYS C 254 7.902 8.495 -4.209 1.00 43.44 H new ATOM 2586 N LEU C 255 8.742 8.720 1.248 1.00 11.13 N ATOM 2587 CA LEU C 255 8.779 9.347 2.572 1.00 24.44 C ATOM 2588 C LEU C 255 9.369 8.414 3.593 1.00 45.11 C ATOM 2589 O LEU C 255 9.106 7.217 3.552 1.00 1.23 O ATOM 2590 CB LEU C 255 7.383 9.761 3.015 1.00 3.22 C ATOM 2591 CG LEU C 255 6.808 10.967 2.324 1.00 32.23 C ATOM 2592 CD1 LEU C 255 5.388 11.202 2.775 1.00 62.51 C ATOM 2593 CD2 LEU C 255 7.637 12.149 2.680 1.00 35.04 C ATOM 0 H LEU C 255 7.801 8.491 0.926 1.00 11.13 H new ATOM 0 HA LEU C 255 9.408 10.234 2.496 1.00 24.44 H new ATOM 0 HB2 LEU C 255 6.708 8.920 2.858 1.00 3.22 H new ATOM 0 HB3 LEU C 255 7.405 9.956 4.087 1.00 3.22 H new ATOM 0 HG LEU C 255 6.810 10.806 1.246 1.00 32.23 H new ATOM 0 HD11 LEU C 255 4.985 12.078 2.267 1.00 62.51 H new ATOM 0 HD12 LEU C 255 4.780 10.330 2.533 1.00 62.51 H new ATOM 0 HD13 LEU C 255 5.371 11.368 3.852 1.00 62.51 H new ATOM 0 HD21 LEU C 255 7.237 13.036 2.188 1.00 35.04 H new ATOM 0 HD22 LEU C 255 7.619 12.294 3.760 1.00 35.04 H new ATOM 0 HD23 LEU C 255 8.664 11.985 2.353 1.00 35.04 H new ATOM 2605 N LYS C 256 10.130 8.963 4.533 1.00 73.21 N ATOM 2606 CA LYS C 256 10.794 8.173 5.543 1.00 14.13 C ATOM 2607 C LYS C 256 9.807 7.439 6.440 1.00 11.44 C ATOM 2608 O LYS C 256 10.049 6.288 6.818 1.00 44.23 O ATOM 2609 CB LYS C 256 11.757 9.005 6.362 1.00 32.55 C ATOM 2610 CG LYS C 256 12.516 8.183 7.373 1.00 41.12 C ATOM 2611 CD LYS C 256 13.464 9.025 8.142 1.00 31.22 C ATOM 2612 CE LYS C 256 14.151 8.220 9.215 1.00 2.52 C ATOM 2613 NZ LYS C 256 15.086 9.033 10.007 1.00 3.40 N ATOM 0 H LYS C 256 10.299 9.966 4.610 1.00 73.21 H new ATOM 0 HA LYS C 256 11.374 7.417 5.013 1.00 14.13 H new ATOM 0 HB2 LYS C 256 12.464 9.498 5.695 1.00 32.55 H new ATOM 0 HB3 LYS C 256 11.205 9.791 6.878 1.00 32.55 H new ATOM 0 HG2 LYS C 256 11.815 7.703 8.056 1.00 41.12 H new ATOM 0 HG3 LYS C 256 13.061 7.388 6.864 1.00 41.12 H new ATOM 0 HD2 LYS C 256 14.208 9.450 7.468 1.00 31.22 H new ATOM 0 HD3 LYS C 256 12.930 9.860 8.595 1.00 31.22 H new ATOM 0 HE2 LYS C 256 13.402 7.784 9.876 1.00 2.52 H new ATOM 0 HE3 LYS C 256 14.691 7.392 8.756 1.00 2.52 H new ATOM 0 HZ1 LYS C 256 15.535 8.438 10.732 1.00 3.40 H new ATOM 0 HZ2 LYS C 256 15.817 9.428 9.382 1.00 3.40 H new ATOM 0 HZ3 LYS C 256 14.568 9.808 10.467 1.00 3.40 H new ATOM 2627 N TRP C 257 8.676 8.073 6.766 1.00 64.23 N ATOM 2628 CA TRP C 257 7.688 7.377 7.578 1.00 65.33 C ATOM 2629 C TRP C 257 7.065 6.219 6.798 1.00 13.51 C ATOM 2630 O TRP C 257 6.628 5.227 7.383 1.00 64.40 O ATOM 2631 CB TRP C 257 6.624 8.299 8.226 1.00 13.22 C ATOM 2632 CG TRP C 257 5.691 9.043 7.307 1.00 73.12 C ATOM 2633 CD1 TRP C 257 5.894 10.256 6.715 1.00 44.40 C ATOM 2634 CD2 TRP C 257 4.371 8.634 6.932 1.00 75.12 C ATOM 2635 NE1 TRP C 257 4.780 10.616 5.997 1.00 41.41 N ATOM 2636 CE2 TRP C 257 3.836 9.638 6.113 1.00 62.25 C ATOM 2637 CE3 TRP C 257 3.592 7.510 7.213 1.00 33.13 C ATOM 2638 CZ2 TRP C 257 2.556 9.554 5.574 1.00 4.25 C ATOM 2639 CZ3 TRP C 257 2.328 7.431 6.681 1.00 40.34 C ATOM 2640 CH2 TRP C 257 1.824 8.445 5.873 1.00 34.21 C ATOM 0 H TRP C 257 8.433 9.025 6.492 1.00 64.23 H new ATOM 0 HA TRP C 257 8.231 6.964 8.428 1.00 65.33 H new ATOM 0 HB2 TRP C 257 6.019 7.692 8.899 1.00 13.22 H new ATOM 0 HB3 TRP C 257 7.145 9.033 8.841 1.00 13.22 H new ATOM 0 HD1 TRP C 257 6.796 10.845 6.799 1.00 44.40 H new ATOM 0 HE1 TRP C 257 4.675 11.478 5.462 1.00 41.41 H new ATOM 0 HE3 TRP C 257 3.976 6.717 7.837 1.00 33.13 H new ATOM 0 HZ2 TRP C 257 2.159 10.336 4.944 1.00 4.25 H new ATOM 0 HZ3 TRP C 257 1.715 6.567 6.894 1.00 40.34 H new ATOM 0 HH2 TRP C 257 0.826 8.350 5.472 1.00 34.21 H new ATOM 2651 N ILE C 258 7.043 6.349 5.474 1.00 31.44 N ATOM 2652 CA ILE C 258 6.587 5.274 4.613 1.00 55.44 C ATOM 2653 C ILE C 258 7.659 4.191 4.547 1.00 25.15 C ATOM 2654 O ILE C 258 7.342 3.005 4.594 1.00 44.45 O ATOM 2655 CB ILE C 258 6.227 5.762 3.172 1.00 73.30 C ATOM 2656 CG1 ILE C 258 5.081 6.780 3.210 1.00 52.12 C ATOM 2657 CG2 ILE C 258 5.859 4.580 2.276 1.00 42.31 C ATOM 2658 CD1 ILE C 258 3.809 6.223 3.789 1.00 71.41 C ATOM 0 H ILE C 258 7.337 7.191 4.979 1.00 31.44 H new ATOM 0 HA ILE C 258 5.670 4.874 5.046 1.00 55.44 H new ATOM 0 HB ILE C 258 7.107 6.251 2.754 1.00 73.30 H new ATOM 0 HG12 ILE C 258 5.391 7.644 3.797 1.00 52.12 H new ATOM 0 HG13 ILE C 258 4.886 7.135 2.198 1.00 52.12 H new ATOM 0 HG21 ILE C 258 5.612 4.943 1.278 1.00 42.31 H new ATOM 0 HG22 ILE C 258 6.704 3.894 2.214 1.00 42.31 H new ATOM 0 HG23 ILE C 258 4.998 4.059 2.696 1.00 42.31 H new ATOM 0 HD11 ILE C 258 3.039 6.995 3.786 1.00 71.41 H new ATOM 0 HD12 ILE C 258 3.476 5.377 3.188 1.00 71.41 H new ATOM 0 HD13 ILE C 258 3.989 5.893 4.812 1.00 71.41 H new ATOM 2670 N GLN C 259 8.936 4.621 4.467 1.00 72.42 N ATOM 2671 CA GLN C 259 10.077 3.693 4.430 1.00 21.32 C ATOM 2672 C GLN C 259 9.985 2.770 5.639 1.00 22.42 C ATOM 2673 O GLN C 259 9.996 1.550 5.508 1.00 10.21 O ATOM 2674 CB GLN C 259 11.421 4.458 4.502 1.00 71.13 C ATOM 2675 CG GLN C 259 11.640 5.563 3.457 1.00 33.14 C ATOM 2676 CD GLN C 259 11.627 5.100 2.020 1.00 53.22 C ATOM 2677 OE1 GLN C 259 12.656 4.734 1.470 1.00 23.33 O ATOM 2678 NE2 GLN C 259 10.479 5.143 1.398 1.00 13.32 N ATOM 0 H GLN C 259 9.199 5.606 4.427 1.00 72.42 H new ATOM 0 HA GLN C 259 10.042 3.132 3.496 1.00 21.32 H new ATOM 0 HB2 GLN C 259 11.506 4.904 5.493 1.00 71.13 H new ATOM 0 HB3 GLN C 259 12.231 3.734 4.407 1.00 71.13 H new ATOM 0 HG2 GLN C 259 10.867 6.320 3.585 1.00 33.14 H new ATOM 0 HG3 GLN C 259 12.596 6.046 3.658 1.00 33.14 H new ATOM 0 HE21 GLN C 259 9.643 5.454 1.892 1.00 13.32 H new ATOM 0 HE22 GLN C 259 10.419 4.865 0.418 1.00 13.32 H new ATOM 2687 N GLU C 260 9.832 3.388 6.809 1.00 71.44 N ATOM 2688 CA GLU C 260 9.658 2.676 8.068 1.00 64.14 C ATOM 2689 C GLU C 260 8.473 1.750 8.024 1.00 20.42 C ATOM 2690 O GLU C 260 8.602 0.595 8.322 1.00 40.31 O ATOM 2691 CB GLU C 260 9.487 3.668 9.220 1.00 72.23 C ATOM 2692 CG GLU C 260 10.758 4.348 9.649 1.00 73.10 C ATOM 2693 CD GLU C 260 11.692 3.377 10.328 1.00 45.33 C ATOM 2694 OE1 GLU C 260 12.367 2.611 9.645 1.00 51.12 O ATOM 2695 OE2 GLU C 260 11.742 3.362 11.583 1.00 65.10 O ATOM 0 H GLU C 260 9.826 4.403 6.908 1.00 71.44 H new ATOM 0 HA GLU C 260 10.554 2.077 8.229 1.00 64.14 H new ATOM 0 HB2 GLU C 260 8.765 4.429 8.924 1.00 72.23 H new ATOM 0 HB3 GLU C 260 9.064 3.142 10.076 1.00 72.23 H new ATOM 0 HG2 GLU C 260 11.251 4.785 8.781 1.00 73.10 H new ATOM 0 HG3 GLU C 260 10.524 5.168 10.328 1.00 73.10 H new ATOM 2702 N TYR C 261 7.337 2.268 7.626 1.00 14.33 N ATOM 2703 CA TYR C 261 6.095 1.505 7.586 1.00 31.44 C ATOM 2704 C TYR C 261 6.274 0.228 6.739 1.00 44.30 C ATOM 2705 O TYR C 261 5.854 -0.869 7.142 1.00 53.23 O ATOM 2706 CB TYR C 261 4.991 2.385 7.007 1.00 63.32 C ATOM 2707 CG TYR C 261 3.598 1.886 7.260 1.00 51.02 C ATOM 2708 CD1 TYR C 261 2.950 2.232 8.430 1.00 2.20 C ATOM 2709 CD2 TYR C 261 2.921 1.099 6.342 1.00 44.12 C ATOM 2710 CE1 TYR C 261 1.672 1.817 8.692 1.00 13.25 C ATOM 2711 CE2 TYR C 261 1.633 0.670 6.597 1.00 24.23 C ATOM 2712 CZ TYR C 261 1.012 1.034 7.776 1.00 34.44 C ATOM 2713 OH TYR C 261 -0.278 0.629 8.034 1.00 63.44 O ATOM 0 H TYR C 261 7.238 3.235 7.317 1.00 14.33 H new ATOM 0 HA TYR C 261 5.821 1.200 8.596 1.00 31.44 H new ATOM 0 HB2 TYR C 261 5.086 3.387 7.426 1.00 63.32 H new ATOM 0 HB3 TYR C 261 5.142 2.474 5.931 1.00 63.32 H new ATOM 0 HD1 TYR C 261 3.464 2.845 9.156 1.00 2.20 H new ATOM 0 HD2 TYR C 261 3.405 0.818 5.418 1.00 44.12 H new ATOM 0 HE1 TYR C 261 1.186 2.103 9.613 1.00 13.25 H new ATOM 0 HE2 TYR C 261 1.114 0.053 5.878 1.00 24.23 H new ATOM 0 HH TYR C 261 -0.605 0.083 7.289 1.00 63.44 H new ATOM 2723 N LEU C 262 6.935 0.377 5.594 1.00 4.54 N ATOM 2724 CA LEU C 262 7.214 -0.744 4.706 1.00 0.54 C ATOM 2725 C LEU C 262 8.192 -1.710 5.379 1.00 64.30 C ATOM 2726 O LEU C 262 7.917 -2.907 5.497 1.00 2.33 O ATOM 2727 CB LEU C 262 7.824 -0.234 3.381 1.00 74.14 C ATOM 2728 CG LEU C 262 6.950 0.705 2.529 1.00 53.42 C ATOM 2729 CD1 LEU C 262 7.740 1.231 1.345 1.00 3.35 C ATOM 2730 CD2 LEU C 262 5.717 -0.016 2.030 1.00 21.31 C ATOM 0 H LEU C 262 7.290 1.273 5.259 1.00 4.54 H new ATOM 0 HA LEU C 262 6.280 -1.263 4.493 1.00 0.54 H new ATOM 0 HB2 LEU C 262 8.754 0.285 3.613 1.00 74.14 H new ATOM 0 HB3 LEU C 262 8.086 -1.100 2.772 1.00 74.14 H new ATOM 0 HG LEU C 262 6.641 1.540 3.158 1.00 53.42 H new ATOM 0 HD11 LEU C 262 7.109 1.893 0.752 1.00 3.35 H new ATOM 0 HD12 LEU C 262 8.609 1.783 1.704 1.00 3.35 H new ATOM 0 HD13 LEU C 262 8.070 0.395 0.728 1.00 3.35 H new ATOM 0 HD21 LEU C 262 5.114 0.666 1.431 1.00 21.31 H new ATOM 0 HD22 LEU C 262 6.016 -0.868 1.420 1.00 21.31 H new ATOM 0 HD23 LEU C 262 5.131 -0.366 2.880 1.00 21.31 H new ATOM 2742 N GLU C 263 9.303 -1.166 5.869 1.00 54.23 N ATOM 2743 CA GLU C 263 10.359 -1.947 6.516 1.00 34.24 C ATOM 2744 C GLU C 263 9.864 -2.651 7.787 1.00 33.05 C ATOM 2745 O GLU C 263 10.252 -3.783 8.084 1.00 54.21 O ATOM 2746 CB GLU C 263 11.577 -1.061 6.805 1.00 64.31 C ATOM 2747 CG GLU C 263 12.273 -0.554 5.548 1.00 30.30 C ATOM 2748 CD GLU C 263 13.526 0.231 5.847 1.00 24.40 C ATOM 2749 OE1 GLU C 263 13.437 1.410 6.186 1.00 50.23 O ATOM 2750 OE2 GLU C 263 14.640 -0.347 5.744 1.00 61.30 O ATOM 0 H GLU C 263 9.499 -0.166 5.829 1.00 54.23 H new ATOM 0 HA GLU C 263 10.660 -2.733 5.824 1.00 34.24 H new ATOM 0 HB2 GLU C 263 11.261 -0.208 7.405 1.00 64.31 H new ATOM 0 HB3 GLU C 263 12.292 -1.625 7.404 1.00 64.31 H new ATOM 0 HG2 GLU C 263 12.525 -1.402 4.911 1.00 30.30 H new ATOM 0 HG3 GLU C 263 11.583 0.074 4.985 1.00 30.30 H new ATOM 2757 N LYS C 264 9.006 -1.988 8.519 1.00 53.41 N ATOM 2758 CA LYS C 264 8.405 -2.556 9.702 1.00 64.23 C ATOM 2759 C LYS C 264 7.492 -3.731 9.342 1.00 40.05 C ATOM 2760 O LYS C 264 7.555 -4.770 9.974 1.00 24.44 O ATOM 2761 CB LYS C 264 7.645 -1.482 10.520 1.00 71.35 C ATOM 2762 CG LYS C 264 8.443 -0.632 11.579 1.00 65.05 C ATOM 2763 CD LYS C 264 9.683 0.159 11.097 1.00 35.35 C ATOM 2764 CE LYS C 264 10.876 -0.724 10.751 1.00 12.14 C ATOM 2765 NZ LYS C 264 12.093 0.062 10.427 1.00 54.34 N ATOM 0 H LYS C 264 8.703 -1.036 8.312 1.00 53.41 H new ATOM 0 HA LYS C 264 9.208 -2.938 10.333 1.00 64.23 H new ATOM 0 HB2 LYS C 264 7.192 -0.787 9.813 1.00 71.35 H new ATOM 0 HB3 LYS C 264 6.830 -1.981 11.044 1.00 71.35 H new ATOM 0 HG2 LYS C 264 7.748 0.078 12.027 1.00 65.05 H new ATOM 0 HG3 LYS C 264 8.766 -1.306 12.372 1.00 65.05 H new ATOM 0 HD2 LYS C 264 9.410 0.746 10.220 1.00 35.35 H new ATOM 0 HD3 LYS C 264 9.978 0.865 11.874 1.00 35.35 H new ATOM 0 HE2 LYS C 264 11.089 -1.386 11.590 1.00 12.14 H new ATOM 0 HE3 LYS C 264 10.620 -1.357 9.902 1.00 12.14 H new ATOM 0 HZ1 LYS C 264 12.732 -0.513 9.842 1.00 54.34 H new ATOM 0 HZ2 LYS C 264 11.823 0.920 9.904 1.00 54.34 H new ATOM 0 HZ3 LYS C 264 12.577 0.331 11.307 1.00 54.34 H new ATOM 2779 N CYS C 265 6.675 -3.571 8.295 1.00 20.53 N ATOM 2780 CA CYS C 265 5.780 -4.642 7.858 1.00 12.04 C ATOM 2781 C CYS C 265 6.584 -5.835 7.273 1.00 73.15 C ATOM 2782 O CYS C 265 6.184 -6.990 7.443 1.00 2.13 O ATOM 2783 CB CYS C 265 4.687 -4.126 6.882 1.00 24.13 C ATOM 2784 SG CYS C 265 3.449 -5.383 6.381 1.00 14.32 S ATOM 0 H CYS C 265 6.617 -2.717 7.740 1.00 20.53 H new ATOM 0 HA CYS C 265 5.250 -5.010 8.736 1.00 12.04 H new ATOM 0 HB2 CYS C 265 4.167 -3.290 7.350 1.00 24.13 H new ATOM 0 HB3 CYS C 265 5.173 -3.738 5.987 1.00 24.13 H new ATOM 2789 N LEU C 266 7.745 -5.537 6.615 1.00 2.31 N ATOM 2790 CA LEU C 266 8.705 -6.582 6.116 1.00 41.43 C ATOM 2791 C LEU C 266 8.983 -7.643 7.172 1.00 61.42 C ATOM 2792 O LEU C 266 9.007 -8.834 6.888 1.00 45.32 O ATOM 2793 CB LEU C 266 10.082 -5.949 5.765 1.00 13.25 C ATOM 2794 CG LEU C 266 10.469 -5.757 4.290 1.00 22.43 C ATOM 2795 CD1 LEU C 266 10.577 -7.088 3.567 1.00 71.33 C ATOM 2796 CD2 LEU C 266 9.516 -4.832 3.583 1.00 13.03 C ATOM 0 H LEU C 266 8.042 -4.582 6.416 1.00 2.31 H new ATOM 0 HA LEU C 266 8.234 -7.026 5.239 1.00 41.43 H new ATOM 0 HB2 LEU C 266 10.124 -4.971 6.244 1.00 13.25 H new ATOM 0 HB3 LEU C 266 10.853 -6.565 6.228 1.00 13.25 H new ATOM 0 HG LEU C 266 11.453 -5.289 4.273 1.00 22.43 H new ATOM 0 HD11 LEU C 266 10.852 -6.916 2.526 1.00 71.33 H new ATOM 0 HD12 LEU C 266 11.339 -7.702 4.047 1.00 71.33 H new ATOM 0 HD13 LEU C 266 9.617 -7.603 3.608 1.00 71.33 H new ATOM 0 HD21 LEU C 266 9.822 -4.720 2.543 1.00 13.03 H new ATOM 0 HD22 LEU C 266 8.509 -5.247 3.623 1.00 13.03 H new ATOM 0 HD23 LEU C 266 9.526 -3.857 4.071 1.00 13.03 H new ATOM 2808 N ASN C 267 9.185 -7.197 8.381 1.00 75.15 N ATOM 2809 CA ASN C 267 9.588 -8.078 9.461 1.00 42.30 C ATOM 2810 C ASN C 267 8.400 -8.561 10.269 1.00 74.14 C ATOM 2811 O ASN C 267 8.563 -9.157 11.338 1.00 31.12 O ATOM 2812 CB ASN C 267 10.608 -7.374 10.367 1.00 5.51 C ATOM 2813 CG ASN C 267 11.908 -7.044 9.645 1.00 12.15 C ATOM 2814 OD1 ASN C 267 12.851 -7.839 9.633 1.00 0.15 O ATOM 2815 ND2 ASN C 267 11.974 -5.879 9.035 1.00 64.24 N ATOM 0 H ASN C 267 9.078 -6.220 8.653 1.00 75.15 H new ATOM 0 HA ASN C 267 10.055 -8.956 9.016 1.00 42.30 H new ATOM 0 HB2 ASN C 267 10.169 -6.455 10.755 1.00 5.51 H new ATOM 0 HB3 ASN C 267 10.825 -8.010 11.225 1.00 5.51 H new ATOM 0 HD21 ASN C 267 12.822 -5.613 8.535 1.00 64.24 H new ATOM 0 HD22 ASN C 267 11.177 -5.243 9.063 1.00 64.24 H new ATOM 2822 N LYS C 268 7.210 -8.330 9.761 1.00 11.10 N ATOM 2823 CA LYS C 268 6.014 -8.749 10.454 1.00 20.24 C ATOM 2824 C LYS C 268 4.853 -8.939 9.487 1.00 65.33 C ATOM 2825 O LYS C 268 3.782 -9.426 9.867 1.00 73.54 O ATOM 2826 CB LYS C 268 5.648 -7.736 11.514 1.00 64.23 C ATOM 2827 CG LYS C 268 5.185 -6.418 10.985 1.00 2.12 C ATOM 2828 CD LYS C 268 5.012 -5.483 12.114 1.00 43.44 C ATOM 2829 CE LYS C 268 4.386 -4.176 11.700 1.00 15.50 C ATOM 2830 NZ LYS C 268 4.209 -3.276 12.859 1.00 34.33 N ATOM 0 H LYS C 268 7.046 -7.856 8.873 1.00 11.10 H new ATOM 0 HA LYS C 268 6.217 -9.709 10.929 1.00 20.24 H new ATOM 0 HB2 LYS C 268 4.863 -8.156 12.143 1.00 64.23 H new ATOM 0 HB3 LYS C 268 6.515 -7.571 12.154 1.00 64.23 H new ATOM 0 HG2 LYS C 268 5.910 -6.021 10.275 1.00 2.12 H new ATOM 0 HG3 LYS C 268 4.245 -6.537 10.447 1.00 2.12 H new ATOM 0 HD2 LYS C 268 4.391 -5.953 12.877 1.00 43.44 H new ATOM 0 HD3 LYS C 268 5.983 -5.287 12.570 1.00 43.44 H new ATOM 0 HE2 LYS C 268 5.013 -3.691 10.952 1.00 15.50 H new ATOM 0 HE3 LYS C 268 3.420 -4.365 11.232 1.00 15.50 H new ATOM 0 HZ1 LYS C 268 3.363 -2.688 12.716 1.00 34.33 H new ATOM 0 HZ2 LYS C 268 4.095 -3.842 13.724 1.00 34.33 H new ATOM 0 HZ3 LYS C 268 5.044 -2.664 12.954 1.00 34.33 H new ATOM 2914 N ILE D 306 4.924 -5.394 -11.164 1.00 2.11 N ATOM 2915 CA ILE D 306 3.720 -4.801 -11.731 1.00 33.31 C ATOM 2916 C ILE D 306 2.463 -5.564 -11.387 1.00 61.12 C ATOM 2917 O ILE D 306 2.343 -6.763 -11.651 1.00 31.44 O ATOM 2918 CB ILE D 306 3.843 -4.654 -13.276 1.00 63.55 C ATOM 2919 CG1 ILE D 306 5.035 -3.768 -13.619 1.00 63.34 C ATOM 2920 CG2 ILE D 306 2.556 -4.113 -13.916 1.00 23.10 C ATOM 2921 CD1 ILE D 306 4.989 -2.405 -12.972 1.00 13.42 C ATOM 0 HA ILE D 306 3.632 -3.814 -11.278 1.00 33.31 H new ATOM 0 HB ILE D 306 4.003 -5.649 -13.692 1.00 63.55 H new ATOM 0 HG12 ILE D 306 5.951 -4.274 -13.314 1.00 63.34 H new ATOM 0 HG13 ILE D 306 5.084 -3.645 -14.701 1.00 63.34 H new ATOM 0 HG21 ILE D 306 2.693 -4.029 -14.994 1.00 23.10 H new ATOM 0 HG22 ILE D 306 1.731 -4.795 -13.707 1.00 23.10 H new ATOM 0 HG23 ILE D 306 2.329 -3.131 -13.501 1.00 23.10 H new ATOM 0 HD11 ILE D 306 5.870 -1.834 -13.264 1.00 13.42 H new ATOM 0 HD12 ILE D 306 4.092 -1.878 -13.296 1.00 13.42 H new ATOM 0 HD13 ILE D 306 4.972 -2.517 -11.888 1.00 13.42 H new ATOM 2933 N TYR D 307 1.550 -4.855 -10.775 1.00 23.24 N ATOM 2934 CA TYR D 307 0.245 -5.331 -10.435 1.00 2.15 C ATOM 2935 C TYR D 307 -0.680 -4.427 -11.168 1.00 34.31 C ATOM 2936 O TYR D 307 -0.668 -3.230 -10.893 1.00 41.45 O ATOM 2937 CB TYR D 307 -0.038 -5.146 -8.922 1.00 53.23 C ATOM 2938 CG TYR D 307 0.882 -5.849 -7.957 1.00 35.12 C ATOM 2939 CD1 TYR D 307 2.142 -6.249 -8.323 1.00 1.43 C ATOM 2940 CD2 TYR D 307 0.480 -6.085 -6.661 1.00 72.42 C ATOM 2941 CE1 TYR D 307 2.973 -6.860 -7.470 1.00 15.10 C ATOM 2942 CE2 TYR D 307 1.306 -6.707 -5.772 1.00 74.32 C ATOM 2943 CZ TYR D 307 2.560 -7.100 -6.185 1.00 25.33 C ATOM 2944 OH TYR D 307 3.406 -7.711 -5.315 1.00 45.35 O ATOM 0 H TYR D 307 1.708 -3.889 -10.490 1.00 23.24 H new ATOM 0 HA TYR D 307 0.138 -6.388 -10.679 1.00 2.15 H new ATOM 0 HB2 TYR D 307 -0.008 -4.079 -8.701 1.00 53.23 H new ATOM 0 HB3 TYR D 307 -1.056 -5.484 -8.725 1.00 53.23 H new ATOM 0 HD1 TYR D 307 2.475 -6.065 -9.334 1.00 1.43 H new ATOM 0 HD2 TYR D 307 -0.504 -5.773 -6.344 1.00 72.42 H new ATOM 0 HE1 TYR D 307 3.959 -7.161 -7.791 1.00 15.10 H new ATOM 0 HE2 TYR D 307 0.982 -6.889 -4.758 1.00 74.32 H new ATOM 0 HH TYR D 307 2.896 -8.066 -4.557 1.00 45.35 H new ATOM 2954 N THR D 308 -1.418 -4.951 -12.124 1.00 71.30 N ATOM 2955 CA THR D 308 -2.339 -4.140 -12.884 1.00 55.24 C ATOM 2956 C THR D 308 -1.663 -3.214 -13.921 1.00 31.33 C ATOM 2957 O THR D 308 -0.730 -2.453 -13.628 1.00 42.15 O ATOM 2958 CB THR D 308 -3.319 -3.384 -11.947 1.00 22.33 C ATOM 2959 OG1 THR D 308 -4.250 -4.312 -11.388 1.00 62.01 O ATOM 2960 CG2 THR D 308 -4.032 -2.228 -12.621 1.00 31.34 C ATOM 0 H THR D 308 -1.396 -5.935 -12.391 1.00 71.30 H new ATOM 0 HA THR D 308 -2.925 -4.831 -13.490 1.00 55.24 H new ATOM 0 HB THR D 308 -2.725 -2.931 -11.153 1.00 22.33 H new ATOM 0 HG1 THR D 308 -3.848 -5.206 -11.366 1.00 62.01 H new ATOM 0 HG21 THR D 308 -4.700 -1.746 -11.907 1.00 31.34 H new ATOM 0 HG22 THR D 308 -3.298 -1.505 -12.976 1.00 31.34 H new ATOM 0 HG23 THR D 308 -4.612 -2.601 -13.466 1.00 31.34 H new ATOM 2968 N SER D 309 -2.119 -3.345 -15.142 1.00 11.11 N ATOM 2969 CA SER D 309 -1.708 -2.516 -16.223 1.00 40.42 C ATOM 2970 C SER D 309 -2.938 -2.163 -17.050 1.00 5.14 C ATOM 2971 O SER D 309 -3.553 -3.045 -17.671 1.00 14.51 O ATOM 2972 CB SER D 309 -0.630 -3.227 -17.055 1.00 72.33 C ATOM 2973 OG SER D 309 -1.055 -4.532 -17.451 1.00 3.15 O ATOM 0 H SER D 309 -2.804 -4.053 -15.408 1.00 11.11 H new ATOM 0 HA SER D 309 -1.261 -1.593 -15.855 1.00 40.42 H new ATOM 0 HB2 SER D 309 -0.400 -2.633 -17.940 1.00 72.33 H new ATOM 0 HB3 SER D 309 0.289 -3.302 -16.474 1.00 72.33 H new ATOM 0 HG SER D 309 -2.021 -4.526 -17.614 1.00 3.15 H new ATOM 2979 N ASP D 310 -3.350 -0.895 -16.969 1.00 33.23 N ATOM 2980 CA ASP D 310 -4.538 -0.366 -17.685 1.00 43.25 C ATOM 2981 C ASP D 310 -5.797 -1.019 -17.171 1.00 45.52 C ATOM 2982 O ASP D 310 -6.820 -1.083 -17.865 1.00 53.12 O ATOM 2983 CB ASP D 310 -4.442 -0.526 -19.214 1.00 2.34 C ATOM 2984 CG ASP D 310 -3.373 0.326 -19.845 1.00 2.22 C ATOM 2985 OD1 ASP D 310 -3.572 1.548 -19.965 1.00 43.35 O ATOM 2986 OD2 ASP D 310 -2.324 -0.212 -20.244 1.00 3.02 O ATOM 0 H ASP D 310 -2.872 -0.193 -16.403 1.00 33.23 H new ATOM 0 HA ASP D 310 -4.572 0.704 -17.482 1.00 43.25 H new ATOM 0 HB2 ASP D 310 -4.247 -1.572 -19.450 1.00 2.34 H new ATOM 0 HB3 ASP D 310 -5.405 -0.274 -19.658 1.00 2.34 H new ATOM 2991 N ASN D 311 -5.746 -1.456 -15.938 1.00 75.22 N ATOM 2992 CA ASN D 311 -6.861 -2.155 -15.335 1.00 31.50 C ATOM 2993 C ASN D 311 -7.349 -1.398 -14.102 1.00 61.34 C ATOM 2994 O ASN D 311 -8.256 -1.829 -13.412 1.00 12.04 O ATOM 2995 CB ASN D 311 -6.461 -3.643 -15.006 1.00 50.32 C ATOM 2996 CG ASN D 311 -7.591 -4.524 -14.443 1.00 33.15 C ATOM 2997 OD1 ASN D 311 -7.800 -4.607 -13.218 1.00 32.12 O ATOM 2998 ND2 ASN D 311 -8.283 -5.215 -15.315 1.00 70.42 N ATOM 0 H ASN D 311 -4.939 -1.340 -15.325 1.00 75.22 H new ATOM 0 HA ASN D 311 -7.690 -2.195 -16.041 1.00 31.50 H new ATOM 0 HB2 ASN D 311 -6.080 -4.108 -15.915 1.00 50.32 H new ATOM 0 HB3 ASN D 311 -5.642 -3.630 -14.287 1.00 50.32 H new ATOM 0 HD21 ASN D 311 -9.019 -5.845 -14.997 1.00 70.42 H new ATOM 0 HD22 ASN D 311 -8.085 -5.123 -16.311 1.00 70.42 H new ATOM 3124 N TYR D 321 -0.199 17.473 -3.969 1.00 11.22 N ATOM 3125 CA TYR D 321 -0.863 18.247 -2.967 1.00 52.54 C ATOM 3126 C TYR D 321 0.210 19.201 -2.435 1.00 33.12 C ATOM 3127 O TYR D 321 -0.020 20.390 -2.233 1.00 65.34 O ATOM 3128 CB TYR D 321 -1.344 17.259 -1.867 1.00 63.40 C ATOM 3129 CG TYR D 321 -2.243 17.816 -0.791 1.00 61.24 C ATOM 3130 CD1 TYR D 321 -2.306 19.164 -0.509 1.00 65.45 C ATOM 3131 CD2 TYR D 321 -3.020 16.956 -0.046 1.00 2.20 C ATOM 3132 CE1 TYR D 321 -3.122 19.648 0.489 1.00 21.24 C ATOM 3133 CE2 TYR D 321 -3.837 17.417 0.957 1.00 71.14 C ATOM 3134 CZ TYR D 321 -3.885 18.767 1.223 1.00 41.40 C ATOM 3135 OH TYR D 321 -4.692 19.232 2.239 1.00 22.25 O ATOM 0 HA TYR D 321 -1.727 18.806 -3.325 1.00 52.54 H new ATOM 0 HB2 TYR D 321 -1.869 16.438 -2.355 1.00 63.40 H new ATOM 0 HB3 TYR D 321 -0.464 16.833 -1.386 1.00 63.40 H new ATOM 0 HD1 TYR D 321 -1.704 19.854 -1.082 1.00 65.45 H new ATOM 0 HD2 TYR D 321 -2.986 15.897 -0.255 1.00 2.20 H new ATOM 0 HE1 TYR D 321 -3.163 20.708 0.694 1.00 21.24 H new ATOM 0 HE2 TYR D 321 -4.436 16.727 1.532 1.00 71.14 H new ATOM 0 HH TYR D 321 -5.162 18.479 2.654 1.00 22.25 H new ATOM 3145 N ASP D 322 1.389 18.630 -2.269 1.00 63.24 N ATOM 3146 CA ASP D 322 2.612 19.313 -1.881 1.00 5.34 C ATOM 3147 C ASP D 322 3.738 18.318 -2.044 1.00 35.32 C ATOM 3148 O ASP D 322 3.701 17.234 -1.452 1.00 23.34 O ATOM 3149 CB ASP D 322 2.548 19.883 -0.458 1.00 33.12 C ATOM 3150 CG ASP D 322 3.827 20.562 -0.061 1.00 61.41 C ATOM 3151 OD1 ASP D 322 4.145 21.635 -0.619 1.00 0.22 O ATOM 3152 OD2 ASP D 322 4.525 20.054 0.828 1.00 52.11 O ATOM 0 H ASP D 322 1.528 17.629 -2.408 1.00 63.24 H new ATOM 0 HA ASP D 322 2.771 20.184 -2.517 1.00 5.34 H new ATOM 0 HB2 ASP D 322 1.725 20.594 -0.390 1.00 33.12 H new ATOM 0 HB3 ASP D 322 2.333 19.078 0.245 1.00 33.12 H new ATOM 3157 N SER D 323 4.710 18.658 -2.845 1.00 75.21 N ATOM 3158 CA SER D 323 5.702 17.700 -3.266 1.00 74.33 C ATOM 3159 C SER D 323 7.005 17.716 -2.433 1.00 11.20 C ATOM 3160 O SER D 323 7.298 18.659 -1.683 1.00 61.42 O ATOM 3161 CB SER D 323 5.989 17.876 -4.771 1.00 30.33 C ATOM 3162 OG SER D 323 6.842 16.855 -5.267 1.00 22.24 O ATOM 0 H SER D 323 4.839 19.597 -3.223 1.00 75.21 H new ATOM 0 HA SER D 323 5.276 16.713 -3.084 1.00 74.33 H new ATOM 0 HB2 SER D 323 5.050 17.866 -5.324 1.00 30.33 H new ATOM 0 HB3 SER D 323 6.449 18.849 -4.942 1.00 30.33 H new ATOM 0 HG SER D 323 7.001 16.997 -6.224 1.00 22.24 H new ATOM 3168 N MET D 324 7.732 16.635 -2.608 1.00 4.13 N ATOM 3169 CA MET D 324 9.011 16.266 -2.016 1.00 35.04 C ATOM 3170 C MET D 324 9.207 14.834 -2.440 1.00 41.11 C ATOM 3171 O MET D 324 8.249 14.073 -2.446 1.00 72.50 O ATOM 3172 CB MET D 324 9.012 16.378 -0.472 1.00 4.30 C ATOM 3173 CG MET D 324 10.245 15.770 0.208 1.00 73.11 C ATOM 3174 SD MET D 324 11.804 16.487 -0.354 1.00 33.41 S ATOM 3175 CE MET D 324 12.982 15.521 0.601 1.00 51.34 C ATOM 0 H MET D 324 7.408 15.905 -3.242 1.00 4.13 H new ATOM 0 HA MET D 324 9.808 16.933 -2.346 1.00 35.04 H new ATOM 0 HB2 MET D 324 8.942 17.430 -0.196 1.00 4.30 H new ATOM 0 HB3 MET D 324 8.119 15.887 -0.084 1.00 4.30 H new ATOM 0 HG2 MET D 324 10.160 15.906 1.286 1.00 73.11 H new ATOM 0 HG3 MET D 324 10.260 14.696 0.022 1.00 73.11 H new ATOM 0 HE1 MET D 324 13.995 15.846 0.365 1.00 51.34 H new ATOM 0 HE2 MET D 324 12.793 15.665 1.665 1.00 51.34 H new ATOM 0 HE3 MET D 324 12.873 14.465 0.353 1.00 51.34 H new ATOM 3185 N LYS D 325 10.377 14.455 -2.828 1.00 72.30 N ATOM 3186 CA LYS D 325 10.535 13.130 -3.339 1.00 2.31 C ATOM 3187 C LYS D 325 11.882 12.542 -3.055 1.00 71.23 C ATOM 3188 O LYS D 325 12.866 13.269 -2.916 1.00 72.54 O ATOM 3189 CB LYS D 325 10.218 13.114 -4.846 1.00 65.24 C ATOM 3190 CG LYS D 325 11.001 14.135 -5.677 1.00 43.53 C ATOM 3191 CD LYS D 325 10.517 14.162 -7.123 1.00 13.44 C ATOM 3192 CE LYS D 325 10.832 12.877 -7.878 1.00 42.44 C ATOM 3193 NZ LYS D 325 12.291 12.685 -8.085 1.00 63.34 N ATOM 0 H LYS D 325 11.222 15.026 -2.804 1.00 72.30 H new ATOM 0 HA LYS D 325 9.824 12.492 -2.814 1.00 2.31 H new ATOM 0 HB2 LYS D 325 10.422 12.117 -5.235 1.00 65.24 H new ATOM 0 HB3 LYS D 325 9.152 13.297 -4.981 1.00 65.24 H new ATOM 0 HG2 LYS D 325 10.892 15.126 -5.236 1.00 43.53 H new ATOM 0 HG3 LYS D 325 12.063 13.890 -5.651 1.00 43.53 H new ATOM 0 HD2 LYS D 325 9.440 14.331 -7.137 1.00 13.44 H new ATOM 0 HD3 LYS D 325 10.979 15.003 -7.640 1.00 13.44 H new ATOM 0 HE2 LYS D 325 10.431 12.027 -7.326 1.00 42.44 H new ATOM 0 HE3 LYS D 325 10.330 12.895 -8.845 1.00 42.44 H new ATOM 0 HZ1 LYS D 325 12.449 11.863 -8.703 1.00 63.34 H new ATOM 0 HZ2 LYS D 325 12.693 13.535 -8.530 1.00 63.34 H new ATOM 0 HZ3 LYS D 325 12.753 12.522 -7.168 1.00 63.34 H new ATOM 3207 N GLU D 326 11.884 11.206 -2.941 1.00 14.41 N ATOM 3208 CA GLU D 326 13.073 10.366 -2.775 1.00 32.50 C ATOM 3209 C GLU D 326 13.523 10.269 -1.322 1.00 13.40 C ATOM 3210 O GLU D 326 13.636 11.285 -0.623 1.00 73.41 O ATOM 3211 CB GLU D 326 14.164 10.732 -3.786 1.00 31.53 C ATOM 3212 CG GLU D 326 13.642 10.556 -5.208 1.00 52.24 C ATOM 3213 CD GLU D 326 14.571 11.021 -6.275 1.00 24.55 C ATOM 3214 OE1 GLU D 326 14.501 12.215 -6.650 1.00 22.23 O ATOM 3215 OE2 GLU D 326 15.338 10.195 -6.798 1.00 60.24 O ATOM 0 H GLU D 326 11.021 10.662 -2.963 1.00 14.41 H new ATOM 0 HA GLU D 326 12.804 9.339 -3.022 1.00 32.50 H new ATOM 0 HB2 GLU D 326 14.482 11.763 -3.632 1.00 31.53 H new ATOM 0 HB3 GLU D 326 15.040 10.102 -3.631 1.00 31.53 H new ATOM 0 HG2 GLU D 326 13.422 9.501 -5.372 1.00 52.24 H new ATOM 0 HG3 GLU D 326 12.700 11.097 -5.304 1.00 52.24 H new ATOM 3222 N PRO D 327 13.760 9.016 -0.841 1.00 50.31 N ATOM 3223 CA PRO D 327 14.021 8.725 0.567 1.00 55.44 C ATOM 3224 C PRO D 327 15.207 9.434 1.152 1.00 42.32 C ATOM 3225 O PRO D 327 16.264 9.589 0.525 1.00 32.02 O ATOM 3226 CB PRO D 327 14.269 7.221 0.585 1.00 23.31 C ATOM 3227 CG PRO D 327 14.718 6.936 -0.778 1.00 30.42 C ATOM 3228 CD PRO D 327 13.829 7.766 -1.631 1.00 24.31 C ATOM 0 HA PRO D 327 13.183 9.066 1.175 1.00 55.44 H new ATOM 0 HB2 PRO D 327 15.023 6.947 1.322 1.00 23.31 H new ATOM 0 HB3 PRO D 327 13.364 6.667 0.834 1.00 23.31 H new ATOM 0 HG2 PRO D 327 15.766 7.202 -0.917 1.00 30.42 H new ATOM 0 HG3 PRO D 327 14.624 5.876 -1.016 1.00 30.42 H new ATOM 0 HD2 PRO D 327 14.247 7.929 -2.624 1.00 24.31 H new ATOM 0 HD3 PRO D 327 12.848 7.311 -1.768 1.00 24.31 H new