USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=36 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: C 222 ASN : amide:sc= -0.0928 K(o=-0.093,f=-5.6!) USER MOD Set 1.2: D 321 TYR OH : rot 130:sc= 0 USER MOD Set 2.1: B 108 THR OG1 : rot -5:sc= 1.23 USER MOD Set 2.2: C 243 LYS NZ :NH3+ 180:sc= 0.598 (180deg=0.388) USER MOD Set 3.1: B 107 TYR OH : rot 112:sc= 1.04 USER MOD Set 3.2: C 261 TYR OH : rot 59:sc= 1.07 USER MOD Set 4.1: A 61 TYR OH : rot 68:sc= 0.714 USER MOD Set 4.2: D 307 TYR OH : rot 147:sc= -0.0637! USER MOD Set 5.1: A 22 ASN : amide:sc= -0.887! C(o=-0.78!,f=-4.5!) USER MOD Set 5.2: A 45 ASN : amide:sc= 0 X(o=-0.78,f=-1.3) USER MOD Set 5.3: B 121 TYR OH : rot 30:sc= 0.103 USER MOD Set 6.1: A 43 LYS NZ :NH3+ -162:sc= 1.19 (180deg=0.0587) USER MOD Set 6.2: D 308 THR OG1 : rot -10:sc= 2.16 USER MOD Single : A 16 SER OG : rot -170:sc= 0 USER MOD Single : A 17 HIS : no HE2:sc= -0.636 K(o=-0.64,f=-2.5!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -3.01 K(o=-3,f=-3.6) USER MOD Single : A 27 LYS NZ :NH3+ 154:sc= -2.63 (180deg=-3.59!) USER MOD Single : A 30 ASN : amide:sc= -1.42 K(o=-1.4,f=-4.2!) USER MOD Single : A 31 THR OG1 : rot 37:sc= -0.0206 USER MOD Single : A 33 ASN : amide:sc= 1.25 K(o=1.3,f=-0.067) USER MOD Single : A 37 GLN :FLIP amide:sc= -0.18 F(o=-1.4!,f=-0.18) USER MOD Single : A 44 ASN : amide:sc= -0.443 X(o=-0.44,f=0) USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ 145:sc= 0.392 (180deg=0.0444) USER MOD Single : A 56 LYS NZ :NH3+ -171:sc=-0.000847 (180deg=-0.0486) USER MOD Single : A 59 GLN :FLIP amide:sc= -5.14! C(o=-5.8!,f=-5.1!) USER MOD Single : A 64 LYS NZ :NH3+ -160:sc= 1.41 (180deg=0.728) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.0066) USER MOD Single : A 68 LYS NZ :NH3+ -164:sc= -0.027 (180deg=-0.302) USER MOD Single : B 109 SER OG : rot 40:sc= -0.026 USER MOD Single : B 111 ASN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : B 124 MET CE :methyl 156:sc= -0.237 (180deg=-0.88) USER MOD Single : B 125 LYS NZ :NH3+ -108:sc= -0.987 (180deg=-3.23!) USER MOD Single : C 216 SER OG : rot 114:sc= -1.76! USER MOD Single : C 217 HIS : no HD1:sc= 0.977 K(o=0.98,f=-5.8!) USER MOD Single : C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 225 HIS : no HD1:sc= -2.36 K(o=-2.4,f=-3.7) USER MOD Single : C 227 LYS NZ :NH3+ -135:sc= -3.75! (180deg=-4.09!) USER MOD Single : C 230 ASN :FLIP amide:sc= -1.31 F(o=-2.8!,f=-1.3) USER MOD Single : C 231 THR OG1 : rot -101:sc= -2.22! USER MOD Single : C 233 ASN : amide:sc= 1.17 K(o=1.2,f=-0.18) USER MOD Single : C 237 GLN :FLIP amide:sc= -0.0817 F(o=-1.4!,f=-0.082) USER MOD Single : C 244 ASN : amide:sc= -0.488 X(o=-0.49,f=0) USER MOD Single : C 245 ASN : amide:sc= -0.0128 K(o=-0.013,f=-1.3) USER MOD Single : C 246 ASN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : C 248 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 254 LYS NZ :NH3+ -145:sc= 1.07 (180deg=0.612) USER MOD Single : C 256 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00681) USER MOD Single : C 259 GLN :FLIP amide:sc= -6.86! C(o=-7.6!,f=-6.9!) USER MOD Single : C 264 LYS NZ :NH3+ 177:sc= 1.07 (180deg=1.06) USER MOD Single : C 267 ASN : amide:sc= 0 X(o=0,f=-0.0028) USER MOD Single : C 268 LYS NZ :NH3+ -163:sc= -0.0578 (180deg=-0.332) USER MOD Single : D 309 SER OG : rot -140:sc= 0 USER MOD Single : D 311 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : D 323 SER OG : rot 180:sc= 0 USER MOD Single : D 324 MET CE :methyl 151:sc= -0.236 (180deg=-0.89) USER MOD Single : D 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -7.265 -6.206 15.576 1.00 3.12 N ATOM 140 CA CYS A 9 -6.556 -6.566 14.381 1.00 0.15 C ATOM 141 C CYS A 9 -7.500 -6.365 13.194 1.00 14.35 C ATOM 142 O CYS A 9 -8.709 -6.234 13.390 1.00 52.52 O ATOM 143 CB CYS A 9 -6.136 -8.028 14.498 1.00 73.42 C ATOM 144 SG CYS A 9 -5.126 -8.373 15.967 1.00 73.22 S ATOM 0 HA CYS A 9 -5.666 -5.953 14.239 1.00 0.15 H new ATOM 0 HB2 CYS A 9 -7.028 -8.654 14.525 1.00 73.42 H new ATOM 0 HB3 CYS A 9 -5.576 -8.310 13.607 1.00 73.42 H new ATOM 149 N PRO A 10 -6.987 -6.330 11.951 1.00 5.54 N ATOM 150 CA PRO A 10 -7.801 -5.969 10.808 1.00 0.32 C ATOM 151 C PRO A 10 -8.636 -7.137 10.269 1.00 31.13 C ATOM 152 O PRO A 10 -9.845 -7.012 10.036 1.00 2.34 O ATOM 153 CB PRO A 10 -6.746 -5.504 9.802 1.00 73.11 C ATOM 154 CG PRO A 10 -5.529 -6.306 10.095 1.00 64.22 C ATOM 155 CD PRO A 10 -5.594 -6.679 11.552 1.00 34.34 C ATOM 0 HA PRO A 10 -8.554 -5.216 11.042 1.00 0.32 H new ATOM 0 HB2 PRO A 10 -7.084 -5.665 8.778 1.00 73.11 H new ATOM 0 HB3 PRO A 10 -6.547 -4.438 9.908 1.00 73.11 H new ATOM 0 HG2 PRO A 10 -5.494 -7.198 9.469 1.00 64.22 H new ATOM 0 HG3 PRO A 10 -4.627 -5.732 9.883 1.00 64.22 H new ATOM 0 HD2 PRO A 10 -5.389 -7.739 11.702 1.00 34.34 H new ATOM 0 HD3 PRO A 10 -4.860 -6.126 12.139 1.00 34.34 H new ATOM 163 N CYS A 11 -7.978 -8.227 10.038 1.00 4.24 N ATOM 164 CA CYS A 11 -8.583 -9.426 9.555 1.00 22.31 C ATOM 165 C CYS A 11 -8.787 -10.370 10.732 1.00 55.44 C ATOM 166 O CYS A 11 -8.164 -10.179 11.790 1.00 70.13 O ATOM 167 CB CYS A 11 -7.631 -10.036 8.552 1.00 51.42 C ATOM 168 SG CYS A 11 -7.043 -8.829 7.312 1.00 71.54 S ATOM 0 H CYS A 11 -6.972 -8.310 10.185 1.00 4.24 H new ATOM 0 HA CYS A 11 -9.548 -9.234 9.085 1.00 22.31 H new ATOM 0 HB2 CYS A 11 -6.774 -10.455 9.079 1.00 51.42 H new ATOM 0 HB3 CYS A 11 -8.127 -10.862 8.042 1.00 51.42 H new ATOM 173 N ARG A 12 -9.640 -11.366 10.584 1.00 64.04 N ATOM 174 CA ARG A 12 -9.783 -12.358 11.636 1.00 21.33 C ATOM 175 C ARG A 12 -8.696 -13.427 11.382 1.00 15.14 C ATOM 176 O ARG A 12 -7.999 -13.868 12.296 1.00 21.21 O ATOM 177 CB ARG A 12 -11.212 -12.971 11.618 1.00 34.35 C ATOM 178 CG ARG A 12 -11.651 -13.695 12.914 1.00 5.12 C ATOM 179 CD ARG A 12 -10.754 -14.859 13.272 1.00 15.45 C ATOM 180 NE ARG A 12 -11.118 -15.508 14.530 1.00 42.13 N ATOM 181 CZ ARG A 12 -10.249 -16.178 15.303 1.00 23.11 C ATOM 182 NH1 ARG A 12 -8.950 -16.212 14.981 1.00 20.11 N ATOM 183 NH2 ARG A 12 -10.667 -16.790 16.400 1.00 71.12 N ATOM 0 H ARG A 12 -10.232 -11.510 9.766 1.00 64.04 H new ATOM 0 HA ARG A 12 -9.654 -11.916 12.624 1.00 21.33 H new ATOM 0 HB2 ARG A 12 -11.926 -12.174 11.410 1.00 34.35 H new ATOM 0 HB3 ARG A 12 -11.273 -13.678 10.791 1.00 34.35 H new ATOM 0 HG2 ARG A 12 -11.658 -12.982 13.738 1.00 5.12 H new ATOM 0 HG3 ARG A 12 -12.673 -14.054 12.795 1.00 5.12 H new ATOM 0 HD2 ARG A 12 -10.789 -15.595 12.469 1.00 15.45 H new ATOM 0 HD3 ARG A 12 -9.724 -14.508 13.338 1.00 15.45 H new ATOM 0 HE ARG A 12 -12.088 -15.448 14.838 1.00 42.13 H new ATOM 0 HH11 ARG A 12 -8.619 -15.728 14.147 1.00 20.11 H new ATOM 0 HH12 ARG A 12 -8.292 -16.722 15.570 1.00 20.11 H new ATOM 0 HH21 ARG A 12 -11.653 -16.753 16.660 1.00 71.12 H new ATOM 0 HH22 ARG A 12 -10.004 -17.298 16.985 1.00 71.12 H new ATOM 197 N PHE A 13 -8.585 -13.827 10.131 1.00 3.42 N ATOM 198 CA PHE A 13 -7.539 -14.719 9.664 1.00 31.40 C ATOM 199 C PHE A 13 -6.854 -14.063 8.489 1.00 60.20 C ATOM 200 O PHE A 13 -7.413 -13.143 7.888 1.00 21.44 O ATOM 201 CB PHE A 13 -8.081 -16.092 9.231 1.00 60.42 C ATOM 202 CG PHE A 13 -8.655 -16.941 10.330 1.00 33.21 C ATOM 203 CD1 PHE A 13 -7.816 -17.650 11.174 1.00 74.12 C ATOM 204 CD2 PHE A 13 -10.020 -17.041 10.513 1.00 5.30 C ATOM 205 CE1 PHE A 13 -8.330 -18.443 12.180 1.00 34.13 C ATOM 206 CE2 PHE A 13 -10.541 -17.835 11.517 1.00 41.13 C ATOM 207 CZ PHE A 13 -9.694 -18.537 12.351 1.00 62.03 C ATOM 0 H PHE A 13 -9.230 -13.537 9.396 1.00 3.42 H new ATOM 0 HA PHE A 13 -6.847 -14.894 10.488 1.00 31.40 H new ATOM 0 HB2 PHE A 13 -8.852 -15.936 8.476 1.00 60.42 H new ATOM 0 HB3 PHE A 13 -7.274 -16.646 8.752 1.00 60.42 H new ATOM 0 HD1 PHE A 13 -6.746 -17.581 11.043 1.00 74.12 H new ATOM 0 HD2 PHE A 13 -10.688 -16.493 9.865 1.00 5.30 H new ATOM 0 HE1 PHE A 13 -7.664 -18.989 12.832 1.00 34.13 H new ATOM 0 HE2 PHE A 13 -11.611 -17.906 11.649 1.00 41.13 H new ATOM 0 HZ PHE A 13 -10.100 -19.158 13.136 1.00 62.03 H new ATOM 217 N PHE A 14 -5.668 -14.506 8.169 1.00 35.31 N ATOM 218 CA PHE A 14 -4.933 -13.952 7.056 1.00 24.33 C ATOM 219 C PHE A 14 -4.466 -15.068 6.147 1.00 33.52 C ATOM 220 O PHE A 14 -4.227 -16.190 6.606 1.00 14.12 O ATOM 221 CB PHE A 14 -3.732 -13.107 7.535 1.00 23.42 C ATOM 222 CG PHE A 14 -2.687 -13.881 8.301 1.00 72.34 C ATOM 223 CD1 PHE A 14 -2.782 -14.037 9.671 1.00 44.43 C ATOM 224 CD2 PHE A 14 -1.611 -14.454 7.640 1.00 63.41 C ATOM 225 CE1 PHE A 14 -1.828 -14.749 10.365 1.00 41.53 C ATOM 226 CE2 PHE A 14 -0.657 -15.167 8.328 1.00 3.23 C ATOM 227 CZ PHE A 14 -0.762 -15.315 9.691 1.00 12.13 C ATOM 0 H PHE A 14 -5.184 -15.254 8.665 1.00 35.31 H new ATOM 0 HA PHE A 14 -5.599 -13.290 6.502 1.00 24.33 H new ATOM 0 HB2 PHE A 14 -3.260 -12.645 6.668 1.00 23.42 H new ATOM 0 HB3 PHE A 14 -4.102 -12.298 8.166 1.00 23.42 H new ATOM 0 HD1 PHE A 14 -3.612 -13.596 10.203 1.00 44.43 H new ATOM 0 HD2 PHE A 14 -1.521 -14.339 6.570 1.00 63.41 H new ATOM 0 HE1 PHE A 14 -1.913 -14.865 11.435 1.00 41.53 H new ATOM 0 HE2 PHE A 14 0.173 -15.610 7.798 1.00 3.23 H new ATOM 0 HZ PHE A 14 -0.013 -15.872 10.234 1.00 12.13 H new ATOM 237 N GLU A 15 -4.344 -14.772 4.889 1.00 4.01 N ATOM 238 CA GLU A 15 -3.910 -15.719 3.903 1.00 62.12 C ATOM 239 C GLU A 15 -2.454 -15.446 3.630 1.00 44.31 C ATOM 240 O GLU A 15 -2.041 -14.302 3.596 1.00 53.42 O ATOM 241 CB GLU A 15 -4.656 -15.491 2.582 1.00 61.14 C ATOM 242 CG GLU A 15 -6.172 -15.363 2.680 1.00 62.04 C ATOM 243 CD GLU A 15 -6.857 -16.507 3.380 1.00 5.00 C ATOM 244 OE1 GLU A 15 -6.908 -16.512 4.629 1.00 63.44 O ATOM 245 OE2 GLU A 15 -7.376 -17.387 2.705 1.00 30.23 O ATOM 0 H GLU A 15 -4.547 -13.847 4.510 1.00 4.01 H new ATOM 0 HA GLU A 15 -4.092 -16.731 4.266 1.00 62.12 H new ATOM 0 HB2 GLU A 15 -4.265 -14.585 2.119 1.00 61.14 H new ATOM 0 HB3 GLU A 15 -4.424 -16.318 1.910 1.00 61.14 H new ATOM 0 HG2 GLU A 15 -6.412 -14.438 3.205 1.00 62.04 H new ATOM 0 HG3 GLU A 15 -6.581 -15.274 1.674 1.00 62.04 H new ATOM 252 N SER A 16 -1.677 -16.447 3.445 1.00 54.23 N ATOM 253 CA SER A 16 -0.320 -16.204 3.096 1.00 44.32 C ATOM 254 C SER A 16 -0.191 -16.394 1.625 1.00 53.45 C ATOM 255 O SER A 16 0.011 -15.464 0.877 1.00 70.53 O ATOM 256 CB SER A 16 0.632 -17.183 3.771 1.00 33.03 C ATOM 257 OG SER A 16 1.976 -16.721 3.737 1.00 23.04 O ATOM 0 H SER A 16 -1.946 -17.428 3.526 1.00 54.23 H new ATOM 0 HA SER A 16 -0.060 -15.195 3.417 1.00 44.32 H new ATOM 0 HB2 SER A 16 0.325 -17.333 4.806 1.00 33.03 H new ATOM 0 HB3 SER A 16 0.568 -18.152 3.276 1.00 33.03 H new ATOM 0 HG SER A 16 2.576 -17.437 4.034 1.00 23.04 H new ATOM 263 N HIS A 17 -0.405 -17.603 1.193 1.00 44.54 N ATOM 264 CA HIS A 17 -0.039 -17.941 -0.116 1.00 42.21 C ATOM 265 C HIS A 17 -1.147 -17.647 -1.126 1.00 15.43 C ATOM 266 O HIS A 17 -1.976 -18.495 -1.438 1.00 2.14 O ATOM 267 CB HIS A 17 0.448 -19.374 -0.158 1.00 45.41 C ATOM 268 CG HIS A 17 1.423 -19.587 -1.206 1.00 63.04 C ATOM 269 ND1 HIS A 17 1.320 -20.528 -2.189 1.00 55.33 N ATOM 270 CD2 HIS A 17 2.563 -18.954 -1.394 1.00 40.35 C ATOM 271 CE1 HIS A 17 2.379 -20.457 -2.959 1.00 35.22 C ATOM 272 NE2 HIS A 17 3.158 -19.500 -2.496 1.00 22.04 N ATOM 0 H HIS A 17 -0.829 -18.354 1.738 1.00 44.54 H new ATOM 0 HA HIS A 17 0.789 -17.302 -0.422 1.00 42.21 H new ATOM 0 HB2 HIS A 17 0.888 -19.635 0.804 1.00 45.41 H new ATOM 0 HB3 HIS A 17 -0.401 -20.040 -0.312 1.00 45.41 H new ATOM 0 HD1 HIS A 17 0.545 -21.181 -2.306 1.00 55.33 H new ATOM 0 HD2 HIS A 17 2.955 -18.151 -0.788 1.00 40.35 H new ATOM 0 HE1 HIS A 17 2.578 -21.075 -3.822 1.00 35.22 H new ATOM 281 N VAL A 18 -1.175 -16.413 -1.559 1.00 1.02 N ATOM 282 CA VAL A 18 -2.124 -15.914 -2.529 1.00 0.52 C ATOM 283 C VAL A 18 -1.420 -15.686 -3.861 1.00 51.32 C ATOM 284 O VAL A 18 -0.227 -15.367 -3.891 1.00 21.41 O ATOM 285 CB VAL A 18 -2.773 -14.588 -2.017 1.00 64.42 C ATOM 286 CG1 VAL A 18 -3.695 -13.950 -3.060 1.00 55.43 C ATOM 287 CG2 VAL A 18 -3.539 -14.849 -0.729 1.00 25.52 C ATOM 0 H VAL A 18 -0.518 -15.702 -1.238 1.00 1.02 H new ATOM 0 HA VAL A 18 -2.916 -16.650 -2.669 1.00 0.52 H new ATOM 0 HB VAL A 18 -1.965 -13.881 -1.827 1.00 64.42 H new ATOM 0 HG11 VAL A 18 -4.121 -13.032 -2.656 1.00 55.43 H new ATOM 0 HG12 VAL A 18 -3.123 -13.720 -3.959 1.00 55.43 H new ATOM 0 HG13 VAL A 18 -4.498 -14.644 -3.309 1.00 55.43 H new ATOM 0 HG21 VAL A 18 -3.988 -13.920 -0.378 1.00 25.52 H new ATOM 0 HG22 VAL A 18 -4.322 -15.584 -0.914 1.00 25.52 H new ATOM 0 HG23 VAL A 18 -2.856 -15.230 0.030 1.00 25.52 H new ATOM 297 N ALA A 19 -2.144 -15.878 -4.945 1.00 51.22 N ATOM 298 CA ALA A 19 -1.596 -15.715 -6.270 1.00 21.33 C ATOM 299 C ALA A 19 -1.408 -14.242 -6.603 1.00 63.34 C ATOM 300 O ALA A 19 -2.369 -13.476 -6.660 1.00 44.11 O ATOM 301 CB ALA A 19 -2.474 -16.398 -7.302 1.00 62.22 C ATOM 0 H ALA A 19 -3.127 -16.151 -4.929 1.00 51.22 H new ATOM 0 HA ALA A 19 -0.615 -16.191 -6.293 1.00 21.33 H new ATOM 0 HB1 ALA A 19 -2.042 -16.263 -8.294 1.00 62.22 H new ATOM 0 HB2 ALA A 19 -2.539 -17.462 -7.077 1.00 62.22 H new ATOM 0 HB3 ALA A 19 -3.472 -15.960 -7.278 1.00 62.22 H new ATOM 307 N ARG A 20 -0.176 -13.874 -6.834 1.00 4.30 N ATOM 308 CA ARG A 20 0.229 -12.496 -7.104 1.00 63.35 C ATOM 309 C ARG A 20 -0.279 -12.018 -8.484 1.00 63.42 C ATOM 310 O ARG A 20 -0.314 -10.831 -8.773 1.00 1.35 O ATOM 311 CB ARG A 20 1.757 -12.433 -6.923 1.00 42.33 C ATOM 312 CG ARG A 20 2.468 -11.078 -6.970 1.00 12.14 C ATOM 313 CD ARG A 20 2.730 -10.515 -8.352 1.00 22.23 C ATOM 314 NE ARG A 20 3.658 -9.386 -8.237 1.00 72.55 N ATOM 315 CZ ARG A 20 4.987 -9.538 -8.036 1.00 25.14 C ATOM 316 NH1 ARG A 20 5.555 -10.749 -8.140 1.00 64.02 N ATOM 317 NH2 ARG A 20 5.754 -8.481 -7.778 1.00 2.24 N ATOM 0 H ARG A 20 0.603 -14.532 -6.843 1.00 4.30 H new ATOM 0 HA ARG A 20 -0.228 -11.795 -6.406 1.00 63.35 H new ATOM 0 HB2 ARG A 20 1.991 -12.891 -5.962 1.00 42.33 H new ATOM 0 HB3 ARG A 20 2.203 -13.062 -7.693 1.00 42.33 H new ATOM 0 HG2 ARG A 20 1.871 -10.357 -6.412 1.00 12.14 H new ATOM 0 HG3 ARG A 20 3.422 -11.172 -6.450 1.00 12.14 H new ATOM 0 HD2 ARG A 20 3.151 -11.285 -8.999 1.00 22.23 H new ATOM 0 HD3 ARG A 20 1.796 -10.190 -8.810 1.00 22.23 H new ATOM 0 HE ARG A 20 3.283 -8.440 -8.312 1.00 72.55 H new ATOM 0 HH11 ARG A 20 4.984 -11.562 -8.372 1.00 64.02 H new ATOM 0 HH12 ARG A 20 6.558 -10.857 -7.987 1.00 64.02 H new ATOM 0 HH21 ARG A 20 5.340 -7.550 -7.731 1.00 2.24 H new ATOM 0 HH22 ARG A 20 6.756 -8.602 -7.627 1.00 2.24 H new ATOM 331 N ALA A 21 -0.652 -12.958 -9.321 1.00 13.43 N ATOM 332 CA ALA A 21 -1.255 -12.652 -10.610 1.00 63.50 C ATOM 333 C ALA A 21 -2.773 -12.403 -10.489 1.00 12.44 C ATOM 334 O ALA A 21 -3.407 -11.942 -11.429 1.00 71.34 O ATOM 335 CB ALA A 21 -0.984 -13.770 -11.594 1.00 74.04 C ATOM 0 H ALA A 21 -0.549 -13.955 -9.134 1.00 13.43 H new ATOM 0 HA ALA A 21 -0.799 -11.732 -10.977 1.00 63.50 H new ATOM 0 HB1 ALA A 21 -1.440 -13.528 -12.554 1.00 74.04 H new ATOM 0 HB2 ALA A 21 0.092 -13.888 -11.723 1.00 74.04 H new ATOM 0 HB3 ALA A 21 -1.408 -14.700 -11.214 1.00 74.04 H new ATOM 341 N ASN A 22 -3.344 -12.726 -9.334 1.00 21.55 N ATOM 342 CA ASN A 22 -4.809 -12.640 -9.131 1.00 11.44 C ATOM 343 C ASN A 22 -5.164 -11.429 -8.258 1.00 34.02 C ATOM 344 O ASN A 22 -6.277 -11.279 -7.796 1.00 15.41 O ATOM 345 CB ASN A 22 -5.312 -13.942 -8.456 1.00 51.35 C ATOM 346 CG ASN A 22 -6.835 -14.018 -8.279 1.00 1.51 C ATOM 347 OD1 ASN A 22 -7.620 -13.486 -9.080 1.00 10.31 O ATOM 348 ND2 ASN A 22 -7.260 -14.685 -7.232 1.00 0.22 N ATOM 0 H ASN A 22 -2.827 -13.051 -8.517 1.00 21.55 H new ATOM 0 HA ASN A 22 -5.293 -12.519 -10.100 1.00 11.44 H new ATOM 0 HB2 ASN A 22 -4.985 -14.795 -9.051 1.00 51.35 H new ATOM 0 HB3 ASN A 22 -4.840 -14.035 -7.478 1.00 51.35 H new ATOM 0 HD21 ASN A 22 -8.261 -14.778 -7.058 1.00 0.22 H new ATOM 0 HD22 ASN A 22 -6.590 -15.111 -6.592 1.00 0.22 H new ATOM 355 N VAL A 23 -4.230 -10.571 -8.070 1.00 0.33 N ATOM 356 CA VAL A 23 -4.414 -9.405 -7.231 1.00 34.13 C ATOM 357 C VAL A 23 -4.275 -8.121 -8.057 1.00 64.22 C ATOM 358 O VAL A 23 -3.646 -8.129 -9.091 1.00 50.40 O ATOM 359 CB VAL A 23 -3.423 -9.448 -6.009 1.00 3.51 C ATOM 360 CG1 VAL A 23 -2.056 -9.816 -6.472 1.00 50.51 C ATOM 361 CG2 VAL A 23 -3.346 -8.122 -5.290 1.00 13.03 C ATOM 0 H VAL A 23 -3.303 -10.642 -8.489 1.00 0.33 H new ATOM 0 HA VAL A 23 -5.425 -9.411 -6.823 1.00 34.13 H new ATOM 0 HB VAL A 23 -3.808 -10.195 -5.315 1.00 3.51 H new ATOM 0 HG11 VAL A 23 -1.378 -9.843 -5.619 1.00 50.51 H new ATOM 0 HG12 VAL A 23 -2.084 -10.798 -6.945 1.00 50.51 H new ATOM 0 HG13 VAL A 23 -1.704 -9.077 -7.192 1.00 50.51 H new ATOM 0 HG21 VAL A 23 -2.650 -8.201 -4.455 1.00 13.03 H new ATOM 0 HG22 VAL A 23 -2.999 -7.353 -5.980 1.00 13.03 H new ATOM 0 HG23 VAL A 23 -4.334 -7.853 -4.915 1.00 13.03 H new ATOM 371 N LYS A 24 -4.932 -7.043 -7.628 1.00 63.13 N ATOM 372 CA LYS A 24 -4.813 -5.761 -8.306 1.00 30.24 C ATOM 373 C LYS A 24 -3.865 -4.822 -7.561 1.00 12.32 C ATOM 374 O LYS A 24 -3.192 -4.009 -8.174 1.00 52.20 O ATOM 375 CB LYS A 24 -6.174 -5.081 -8.460 1.00 2.12 C ATOM 376 CG LYS A 24 -7.181 -5.899 -9.237 1.00 53.44 C ATOM 377 CD LYS A 24 -8.466 -5.132 -9.516 1.00 33.53 C ATOM 378 CE LYS A 24 -9.183 -4.691 -8.252 1.00 74.43 C ATOM 379 NZ LYS A 24 -10.416 -3.923 -8.562 1.00 11.35 N ATOM 0 H LYS A 24 -5.549 -7.036 -6.816 1.00 63.13 H new ATOM 0 HA LYS A 24 -4.405 -5.968 -9.295 1.00 30.24 H new ATOM 0 HB2 LYS A 24 -6.578 -4.870 -7.470 1.00 2.12 H new ATOM 0 HB3 LYS A 24 -6.036 -4.122 -8.959 1.00 2.12 H new ATOM 0 HG2 LYS A 24 -6.737 -6.213 -10.182 1.00 53.44 H new ATOM 0 HG3 LYS A 24 -7.417 -6.805 -8.678 1.00 53.44 H new ATOM 0 HD2 LYS A 24 -8.235 -4.255 -10.120 1.00 33.53 H new ATOM 0 HD3 LYS A 24 -9.135 -5.758 -10.106 1.00 33.53 H new ATOM 0 HE2 LYS A 24 -9.439 -5.566 -7.654 1.00 74.43 H new ATOM 0 HE3 LYS A 24 -8.514 -4.078 -7.649 1.00 74.43 H new ATOM 0 HZ1 LYS A 24 -10.880 -3.638 -7.676 1.00 11.35 H new ATOM 0 HZ2 LYS A 24 -10.168 -3.075 -9.111 1.00 11.35 H new ATOM 0 HZ3 LYS A 24 -11.065 -4.517 -9.117 1.00 11.35 H new ATOM 393 N HIS A 25 -3.828 -4.945 -6.227 1.00 32.24 N ATOM 394 CA HIS A 25 -3.005 -4.057 -5.355 1.00 42.21 C ATOM 395 C HIS A 25 -3.095 -4.457 -3.885 1.00 30.53 C ATOM 396 O HIS A 25 -3.960 -5.267 -3.510 1.00 0.14 O ATOM 397 CB HIS A 25 -3.394 -2.571 -5.510 1.00 65.12 C ATOM 398 CG HIS A 25 -4.859 -2.273 -5.366 1.00 2.24 C ATOM 399 ND1 HIS A 25 -5.720 -3.015 -4.583 1.00 61.13 N ATOM 400 CD2 HIS A 25 -5.618 -1.341 -5.956 1.00 54.24 C ATOM 401 CE1 HIS A 25 -6.937 -2.545 -4.716 1.00 51.22 C ATOM 402 NE2 HIS A 25 -6.901 -1.535 -5.540 1.00 50.34 N ATOM 0 H HIS A 25 -4.357 -5.651 -5.714 1.00 32.24 H new ATOM 0 HA HIS A 25 -1.975 -4.183 -5.688 1.00 42.21 H new ATOM 0 HB2 HIS A 25 -2.847 -1.990 -4.767 1.00 65.12 H new ATOM 0 HB3 HIS A 25 -3.065 -2.226 -6.490 1.00 65.12 H new ATOM 0 HD2 HIS A 25 -5.276 -0.576 -6.637 1.00 54.24 H new ATOM 0 HE1 HIS A 25 -7.819 -2.929 -4.226 1.00 51.22 H new ATOM 0 HE2 HIS A 25 -7.706 -0.978 -5.828 1.00 50.34 H new ATOM 411 N LEU A 26 -2.277 -3.813 -3.058 1.00 74.23 N ATOM 412 CA LEU A 26 -2.167 -4.128 -1.627 1.00 21.14 C ATOM 413 C LEU A 26 -2.623 -2.947 -0.772 1.00 2.34 C ATOM 414 O LEU A 26 -2.450 -1.812 -1.158 1.00 61.05 O ATOM 415 CB LEU A 26 -0.682 -4.393 -1.277 1.00 43.32 C ATOM 416 CG LEU A 26 0.013 -5.559 -1.966 1.00 42.04 C ATOM 417 CD1 LEU A 26 1.465 -5.632 -1.520 1.00 50.45 C ATOM 418 CD2 LEU A 26 -0.700 -6.858 -1.667 1.00 33.44 C ATOM 0 H LEU A 26 -1.666 -3.053 -3.358 1.00 74.23 H new ATOM 0 HA LEU A 26 -2.792 -4.999 -1.426 1.00 21.14 H new ATOM 0 HB2 LEU A 26 -0.118 -3.487 -1.501 1.00 43.32 H new ATOM 0 HB3 LEU A 26 -0.615 -4.552 -0.201 1.00 43.32 H new ATOM 0 HG LEU A 26 -0.017 -5.398 -3.044 1.00 42.04 H new ATOM 0 HD11 LEU A 26 1.957 -6.469 -2.017 1.00 50.45 H new ATOM 0 HD12 LEU A 26 1.973 -4.704 -1.783 1.00 50.45 H new ATOM 0 HD13 LEU A 26 1.507 -5.776 -0.440 1.00 50.45 H new ATOM 0 HD21 LEU A 26 -0.187 -7.678 -2.169 1.00 33.44 H new ATOM 0 HD22 LEU A 26 -0.700 -7.034 -0.591 1.00 33.44 H new ATOM 0 HD23 LEU A 26 -1.728 -6.800 -2.025 1.00 33.44 H new ATOM 430 N LYS A 27 -3.230 -3.229 0.371 1.00 23.04 N ATOM 431 CA LYS A 27 -3.566 -2.204 1.337 1.00 61.32 C ATOM 432 C LYS A 27 -2.905 -2.541 2.656 1.00 43.41 C ATOM 433 O LYS A 27 -3.186 -3.587 3.233 1.00 5.51 O ATOM 434 CB LYS A 27 -5.065 -2.066 1.520 1.00 33.42 C ATOM 435 CG LYS A 27 -5.382 -0.859 2.352 1.00 45.20 C ATOM 436 CD LYS A 27 -6.825 -0.487 2.346 1.00 60.11 C ATOM 437 CE LYS A 27 -7.723 -1.482 3.031 1.00 34.13 C ATOM 438 NZ LYS A 27 -8.031 -2.704 2.256 1.00 23.11 N ATOM 0 H LYS A 27 -3.501 -4.172 0.651 1.00 23.04 H new ATOM 0 HA LYS A 27 -3.201 -1.246 0.966 1.00 61.32 H new ATOM 0 HB2 LYS A 27 -5.550 -1.983 0.548 1.00 33.42 H new ATOM 0 HB3 LYS A 27 -5.463 -2.960 1.999 1.00 33.42 H new ATOM 0 HG2 LYS A 27 -5.068 -1.045 3.379 1.00 45.20 H new ATOM 0 HG3 LYS A 27 -4.797 -0.014 1.988 1.00 45.20 H new ATOM 0 HD2 LYS A 27 -6.940 0.483 2.830 1.00 60.11 H new ATOM 0 HD3 LYS A 27 -7.154 -0.369 1.313 1.00 60.11 H new ATOM 0 HE2 LYS A 27 -7.258 -1.777 3.971 1.00 34.13 H new ATOM 0 HE3 LYS A 27 -8.661 -0.986 3.281 1.00 34.13 H new ATOM 0 HZ1 LYS A 27 -8.254 -3.482 2.909 1.00 23.11 H new ATOM 0 HZ2 LYS A 27 -8.848 -2.526 1.637 1.00 23.11 H new ATOM 0 HZ3 LYS A 27 -7.208 -2.964 1.676 1.00 23.11 H new ATOM 452 N ILE A 28 -2.032 -1.673 3.132 1.00 63.32 N ATOM 453 CA ILE A 28 -1.258 -1.959 4.325 1.00 41.41 C ATOM 454 C ILE A 28 -1.772 -1.162 5.508 1.00 62.25 C ATOM 455 O ILE A 28 -2.020 0.070 5.388 1.00 24.41 O ATOM 456 CB ILE A 28 0.238 -1.588 4.150 1.00 10.34 C ATOM 457 CG1 ILE A 28 0.817 -2.179 2.872 1.00 2.30 C ATOM 458 CG2 ILE A 28 1.038 -2.080 5.351 1.00 73.23 C ATOM 459 CD1 ILE A 28 2.287 -1.880 2.690 1.00 61.01 C ATOM 0 H ILE A 28 -1.841 -0.764 2.711 1.00 63.32 H new ATOM 0 HA ILE A 28 -1.360 -3.030 4.498 1.00 41.41 H new ATOM 0 HB ILE A 28 0.306 -0.502 4.080 1.00 10.34 H new ATOM 0 HG12 ILE A 28 0.671 -3.259 2.880 1.00 2.30 H new ATOM 0 HG13 ILE A 28 0.265 -1.789 2.017 1.00 2.30 H new ATOM 0 HG21 ILE A 28 2.088 -1.816 5.222 1.00 73.23 H new ATOM 0 HG22 ILE A 28 0.656 -1.613 6.259 1.00 73.23 H new ATOM 0 HG23 ILE A 28 0.943 -3.163 5.432 1.00 73.23 H new ATOM 0 HD11 ILE A 28 2.637 -2.329 1.761 1.00 61.01 H new ATOM 0 HD12 ILE A 28 2.437 -0.801 2.650 1.00 61.01 H new ATOM 0 HD13 ILE A 28 2.849 -2.294 3.527 1.00 61.01 H new ATOM 471 N LEU A 29 -1.930 -1.843 6.639 1.00 33.11 N ATOM 472 CA LEU A 29 -2.298 -1.212 7.874 1.00 31.51 C ATOM 473 C LEU A 29 -1.677 -1.984 9.046 1.00 34.00 C ATOM 474 O LEU A 29 -1.861 -3.198 9.173 1.00 44.32 O ATOM 475 CB LEU A 29 -3.839 -1.058 7.988 1.00 1.15 C ATOM 476 CG LEU A 29 -4.394 -0.227 9.175 1.00 13.14 C ATOM 477 CD1 LEU A 29 -5.832 0.118 8.923 1.00 22.02 C ATOM 478 CD2 LEU A 29 -4.322 -1.001 10.474 1.00 20.15 C ATOM 0 H LEU A 29 -1.803 -2.852 6.711 1.00 33.11 H new ATOM 0 HA LEU A 29 -1.900 -0.198 7.902 1.00 31.51 H new ATOM 0 HB2 LEU A 29 -4.200 -0.606 7.064 1.00 1.15 H new ATOM 0 HB3 LEU A 29 -4.273 -2.056 8.046 1.00 1.15 H new ATOM 0 HG LEU A 29 -3.784 0.673 9.258 1.00 13.14 H new ATOM 0 HD11 LEU A 29 -6.218 0.702 9.759 1.00 22.02 H new ATOM 0 HD12 LEU A 29 -5.911 0.702 8.006 1.00 22.02 H new ATOM 0 HD13 LEU A 29 -6.414 -0.798 8.821 1.00 22.02 H new ATOM 0 HD21 LEU A 29 -4.719 -0.389 11.284 1.00 20.15 H new ATOM 0 HD22 LEU A 29 -4.911 -1.914 10.387 1.00 20.15 H new ATOM 0 HD23 LEU A 29 -3.284 -1.258 10.688 1.00 20.15 H new ATOM 490 N ASN A 30 -0.917 -1.287 9.869 1.00 21.01 N ATOM 491 CA ASN A 30 -0.279 -1.908 11.025 1.00 11.13 C ATOM 492 C ASN A 30 -1.148 -1.754 12.260 1.00 32.12 C ATOM 493 O ASN A 30 -1.381 -0.640 12.736 1.00 35.43 O ATOM 494 CB ASN A 30 1.117 -1.314 11.290 1.00 42.14 C ATOM 495 CG ASN A 30 1.865 -2.018 12.428 1.00 20.04 C ATOM 496 OD1 ASN A 30 2.619 -2.957 12.204 1.00 51.14 O ATOM 497 ND2 ASN A 30 1.654 -1.583 13.642 1.00 3.10 N ATOM 0 H ASN A 30 -0.724 -0.291 9.763 1.00 21.01 H new ATOM 0 HA ASN A 30 -0.159 -2.968 10.800 1.00 11.13 H new ATOM 0 HB2 ASN A 30 1.711 -1.378 10.379 1.00 42.14 H new ATOM 0 HB3 ASN A 30 1.015 -0.256 11.530 1.00 42.14 H new ATOM 0 HD21 ASN A 30 2.122 -2.027 14.432 1.00 3.10 H new ATOM 0 HD22 ASN A 30 1.021 -0.799 13.800 1.00 3.10 H new ATOM 504 N THR A 31 -1.618 -2.860 12.764 1.00 52.24 N ATOM 505 CA THR A 31 -2.445 -2.878 13.946 1.00 33.33 C ATOM 506 C THR A 31 -1.588 -3.043 15.214 1.00 24.11 C ATOM 507 O THR A 31 -0.422 -3.384 15.125 1.00 12.34 O ATOM 508 CB THR A 31 -3.503 -3.996 13.859 1.00 42.45 C ATOM 509 OG1 THR A 31 -2.862 -5.257 13.571 1.00 52.23 O ATOM 510 CG2 THR A 31 -4.529 -3.675 12.782 1.00 61.41 C ATOM 0 H THR A 31 -1.439 -3.782 12.367 1.00 52.24 H new ATOM 0 HA THR A 31 -2.963 -1.921 14.007 1.00 33.33 H new ATOM 0 HB THR A 31 -4.017 -4.067 14.818 1.00 42.45 H new ATOM 0 HG1 THR A 31 -2.001 -5.300 14.037 1.00 52.23 H new ATOM 0 HG21 THR A 31 -5.268 -4.474 12.734 1.00 61.41 H new ATOM 0 HG22 THR A 31 -5.026 -2.735 13.022 1.00 61.41 H new ATOM 0 HG23 THR A 31 -4.029 -3.585 11.818 1.00 61.41 H new ATOM 518 N PRO A 32 -2.129 -2.744 16.402 1.00 64.20 N ATOM 519 CA PRO A 32 -1.396 -2.916 17.657 1.00 15.50 C ATOM 520 C PRO A 32 -1.364 -4.393 18.147 1.00 51.23 C ATOM 521 O PRO A 32 -0.301 -4.930 18.500 1.00 44.22 O ATOM 522 CB PRO A 32 -2.190 -2.042 18.655 1.00 45.44 C ATOM 523 CG PRO A 32 -3.219 -1.317 17.832 1.00 50.34 C ATOM 524 CD PRO A 32 -3.457 -2.165 16.630 1.00 2.24 C ATOM 0 HA PRO A 32 -0.348 -2.635 17.549 1.00 15.50 H new ATOM 0 HB2 PRO A 32 -2.663 -2.655 19.422 1.00 45.44 H new ATOM 0 HB3 PRO A 32 -1.534 -1.340 19.169 1.00 45.44 H new ATOM 0 HG2 PRO A 32 -4.140 -1.174 18.397 1.00 50.34 H new ATOM 0 HG3 PRO A 32 -2.863 -0.327 17.547 1.00 50.34 H new ATOM 0 HD2 PRO A 32 -4.211 -2.931 16.813 1.00 2.24 H new ATOM 0 HD3 PRO A 32 -3.799 -1.578 15.777 1.00 2.24 H new ATOM 532 N ASN A 33 -2.529 -5.048 18.134 1.00 40.04 N ATOM 533 CA ASN A 33 -2.677 -6.416 18.685 1.00 32.32 C ATOM 534 C ASN A 33 -2.127 -7.487 17.718 1.00 4.02 C ATOM 535 O ASN A 33 -1.908 -8.637 18.094 1.00 70.11 O ATOM 536 CB ASN A 33 -4.163 -6.682 19.051 1.00 33.34 C ATOM 537 CG ASN A 33 -4.408 -8.024 19.753 1.00 11.12 C ATOM 538 OD1 ASN A 33 -4.313 -8.120 20.976 1.00 11.45 O ATOM 539 ND2 ASN A 33 -4.745 -9.050 18.999 1.00 42.52 N ATOM 0 H ASN A 33 -3.390 -4.660 17.749 1.00 40.04 H new ATOM 0 HA ASN A 33 -2.080 -6.485 19.594 1.00 32.32 H new ATOM 0 HB2 ASN A 33 -4.516 -5.878 19.696 1.00 33.34 H new ATOM 0 HB3 ASN A 33 -4.762 -6.646 18.141 1.00 33.34 H new ATOM 0 HD21 ASN A 33 -4.936 -9.956 19.427 1.00 42.52 H new ATOM 0 HD22 ASN A 33 -4.815 -8.938 17.988 1.00 42.52 H new ATOM 546 N CYS A 34 -1.890 -7.088 16.500 1.00 41.50 N ATOM 547 CA CYS A 34 -1.346 -7.959 15.474 1.00 32.12 C ATOM 548 C CYS A 34 -0.273 -7.219 14.727 1.00 64.34 C ATOM 549 O CYS A 34 -0.234 -6.006 14.794 1.00 13.22 O ATOM 550 CB CYS A 34 -2.452 -8.430 14.518 1.00 1.34 C ATOM 551 SG CYS A 34 -3.658 -9.577 15.271 1.00 74.31 S ATOM 0 H CYS A 34 -2.069 -6.137 16.179 1.00 41.50 H new ATOM 0 HA CYS A 34 -0.916 -8.846 15.940 1.00 32.12 H new ATOM 0 HB2 CYS A 34 -2.985 -7.558 14.140 1.00 1.34 H new ATOM 0 HB3 CYS A 34 -1.991 -8.918 13.660 1.00 1.34 H new ATOM 556 N ALA A 35 0.605 -7.933 14.038 1.00 1.13 N ATOM 557 CA ALA A 35 1.679 -7.297 13.273 1.00 71.02 C ATOM 558 C ALA A 35 1.122 -6.488 12.097 1.00 32.13 C ATOM 559 O ALA A 35 -0.115 -6.426 11.892 1.00 32.33 O ATOM 560 CB ALA A 35 2.659 -8.349 12.767 1.00 33.40 C ATOM 0 H ALA A 35 0.599 -8.952 13.990 1.00 1.13 H new ATOM 0 HA ALA A 35 2.202 -6.610 13.938 1.00 71.02 H new ATOM 0 HB1 ALA A 35 3.453 -7.864 12.200 1.00 33.40 H new ATOM 0 HB2 ALA A 35 3.092 -8.881 13.614 1.00 33.40 H new ATOM 0 HB3 ALA A 35 2.134 -9.056 12.125 1.00 33.40 H new ATOM 566 N CYS A 36 2.026 -5.868 11.334 1.00 30.50 N ATOM 567 CA CYS A 36 1.653 -5.100 10.157 1.00 5.54 C ATOM 568 C CYS A 36 0.888 -6.019 9.246 1.00 43.20 C ATOM 569 O CYS A 36 1.284 -7.150 9.060 1.00 33.05 O ATOM 570 CB CYS A 36 2.900 -4.549 9.439 1.00 45.24 C ATOM 571 SG CYS A 36 2.534 -3.346 8.105 1.00 12.03 S ATOM 0 H CYS A 36 3.029 -5.887 11.518 1.00 30.50 H new ATOM 0 HA CYS A 36 1.043 -4.244 10.445 1.00 5.54 H new ATOM 0 HB2 CYS A 36 3.547 -4.072 10.175 1.00 45.24 H new ATOM 0 HB3 CYS A 36 3.459 -5.383 9.016 1.00 45.24 H new ATOM 576 N GLN A 37 -0.213 -5.582 8.724 1.00 65.14 N ATOM 577 CA GLN A 37 -1.011 -6.475 7.965 1.00 44.24 C ATOM 578 C GLN A 37 -1.296 -5.868 6.624 1.00 25.41 C ATOM 579 O GLN A 37 -1.447 -4.642 6.503 1.00 44.14 O ATOM 580 CB GLN A 37 -2.309 -6.742 8.701 1.00 34.44 C ATOM 581 CG GLN A 37 -2.863 -8.144 8.493 1.00 2.12 C ATOM 582 CD GLN A 37 -1.952 -9.218 9.103 1.00 22.34 C ATOM 583 OE1 GLN A 37 -1.245 -8.870 10.159 1.00 11.35 O flip ATOM 584 NE2 GLN A 37 -1.891 -10.347 8.633 1.00 33.23 N flip ATOM 0 H GLN A 37 -0.571 -4.631 8.809 1.00 65.14 H new ATOM 0 HA GLN A 37 -0.480 -7.417 7.826 1.00 44.24 H new ATOM 0 HB2 GLN A 37 -2.150 -6.580 9.767 1.00 34.44 H new ATOM 0 HB3 GLN A 37 -3.055 -6.016 8.376 1.00 34.44 H new ATOM 0 HG2 GLN A 37 -3.854 -8.212 8.941 1.00 2.12 H new ATOM 0 HG3 GLN A 37 -2.982 -8.332 7.426 1.00 2.12 H new ATOM 0 HE21 GLN A 37 -2.449 -10.590 7.815 1.00 33.23 H new ATOM 0 HE22 GLN A 37 -1.282 -11.045 9.060 1.00 33.23 H new ATOM 593 N ILE A 38 -1.350 -6.692 5.624 1.00 12.21 N ATOM 594 CA ILE A 38 -1.615 -6.242 4.296 1.00 42.05 C ATOM 595 C ILE A 38 -2.798 -7.007 3.760 1.00 73.40 C ATOM 596 O ILE A 38 -2.837 -8.197 3.861 1.00 52.53 O ATOM 597 CB ILE A 38 -0.389 -6.472 3.372 1.00 32.04 C ATOM 598 CG1 ILE A 38 0.847 -5.771 3.952 1.00 15.55 C ATOM 599 CG2 ILE A 38 -0.679 -5.967 1.964 1.00 53.02 C ATOM 600 CD1 ILE A 38 2.101 -5.919 3.117 1.00 10.44 C ATOM 0 H ILE A 38 -1.211 -7.699 5.708 1.00 12.21 H new ATOM 0 HA ILE A 38 -1.825 -5.173 4.318 1.00 42.05 H new ATOM 0 HB ILE A 38 -0.189 -7.542 3.316 1.00 32.04 H new ATOM 0 HG12 ILE A 38 0.626 -4.710 4.069 1.00 15.55 H new ATOM 0 HG13 ILE A 38 1.040 -6.168 4.949 1.00 15.55 H new ATOM 0 HG21 ILE A 38 0.191 -6.136 1.330 1.00 53.02 H new ATOM 0 HG22 ILE A 38 -1.536 -6.502 1.555 1.00 53.02 H new ATOM 0 HG23 ILE A 38 -0.901 -4.900 1.998 1.00 53.02 H new ATOM 0 HD11 ILE A 38 2.924 -5.393 3.601 1.00 10.44 H new ATOM 0 HD12 ILE A 38 2.352 -6.975 3.021 1.00 10.44 H new ATOM 0 HD13 ILE A 38 1.931 -5.495 2.127 1.00 10.44 H new ATOM 612 N VAL A 39 -3.753 -6.324 3.234 1.00 4.20 N ATOM 613 CA VAL A 39 -4.907 -6.967 2.652 1.00 65.12 C ATOM 614 C VAL A 39 -4.968 -6.653 1.154 1.00 4.14 C ATOM 615 O VAL A 39 -4.858 -5.488 0.744 1.00 1.44 O ATOM 616 CB VAL A 39 -6.223 -6.587 3.411 1.00 33.01 C ATOM 617 CG1 VAL A 39 -6.381 -5.096 3.501 1.00 70.14 C ATOM 618 CG2 VAL A 39 -7.455 -7.211 2.763 1.00 74.12 C ATOM 0 H VAL A 39 -3.769 -5.305 3.189 1.00 4.20 H new ATOM 0 HA VAL A 39 -4.809 -8.047 2.761 1.00 65.12 H new ATOM 0 HB VAL A 39 -6.137 -6.992 4.419 1.00 33.01 H new ATOM 0 HG11 VAL A 39 -7.303 -4.859 4.033 1.00 70.14 H new ATOM 0 HG12 VAL A 39 -5.533 -4.672 4.039 1.00 70.14 H new ATOM 0 HG13 VAL A 39 -6.422 -4.673 2.497 1.00 70.14 H new ATOM 0 HG21 VAL A 39 -8.346 -6.922 3.321 1.00 74.12 H new ATOM 0 HG22 VAL A 39 -7.542 -6.861 1.734 1.00 74.12 H new ATOM 0 HG23 VAL A 39 -7.359 -8.297 2.770 1.00 74.12 H new ATOM 628 N ALA A 40 -5.120 -7.676 0.348 1.00 14.50 N ATOM 629 CA ALA A 40 -5.064 -7.525 -1.086 1.00 51.42 C ATOM 630 C ALA A 40 -6.418 -7.730 -1.723 1.00 22.13 C ATOM 631 O ALA A 40 -7.232 -8.537 -1.258 1.00 62.12 O ATOM 632 CB ALA A 40 -4.055 -8.496 -1.685 1.00 64.41 C ATOM 0 H ALA A 40 -5.285 -8.631 0.665 1.00 14.50 H new ATOM 0 HA ALA A 40 -4.746 -6.503 -1.294 1.00 51.42 H new ATOM 0 HB1 ALA A 40 -4.026 -8.369 -2.767 1.00 64.41 H new ATOM 0 HB2 ALA A 40 -3.067 -8.297 -1.269 1.00 64.41 H new ATOM 0 HB3 ALA A 40 -4.349 -9.518 -1.448 1.00 64.41 H new ATOM 638 N ARG A 41 -6.665 -6.989 -2.778 1.00 14.51 N ATOM 639 CA ARG A 41 -7.880 -7.147 -3.533 1.00 51.11 C ATOM 640 C ARG A 41 -7.605 -7.865 -4.822 1.00 61.22 C ATOM 641 O ARG A 41 -6.698 -7.492 -5.579 1.00 13.13 O ATOM 642 CB ARG A 41 -8.639 -5.848 -3.762 1.00 15.15 C ATOM 643 CG ARG A 41 -9.204 -5.225 -2.495 1.00 23.14 C ATOM 644 CD ARG A 41 -10.107 -4.066 -2.840 1.00 11.44 C ATOM 645 NE ARG A 41 -10.726 -3.457 -1.671 1.00 73.33 N ATOM 646 CZ ARG A 41 -11.811 -2.683 -1.727 1.00 62.51 C ATOM 647 NH1 ARG A 41 -12.413 -2.462 -2.894 1.00 51.42 N ATOM 648 NH2 ARG A 41 -12.301 -2.147 -0.620 1.00 32.31 N ATOM 0 H ARG A 41 -6.036 -6.268 -3.132 1.00 14.51 H new ATOM 0 HA ARG A 41 -8.546 -7.758 -2.923 1.00 51.11 H new ATOM 0 HB2 ARG A 41 -7.973 -5.130 -4.240 1.00 15.15 H new ATOM 0 HB3 ARG A 41 -9.457 -6.036 -4.457 1.00 15.15 H new ATOM 0 HG2 ARG A 41 -9.761 -5.973 -1.930 1.00 23.14 H new ATOM 0 HG3 ARG A 41 -8.390 -4.883 -1.855 1.00 23.14 H new ATOM 0 HD2 ARG A 41 -9.531 -3.310 -3.374 1.00 11.44 H new ATOM 0 HD3 ARG A 41 -10.887 -4.410 -3.519 1.00 11.44 H new ATOM 0 HE ARG A 41 -10.306 -3.632 -0.758 1.00 73.33 H new ATOM 0 HH11 ARG A 41 -12.045 -2.885 -3.746 1.00 51.42 H new ATOM 0 HH12 ARG A 41 -13.243 -1.870 -2.936 1.00 51.42 H new ATOM 0 HH21 ARG A 41 -11.849 -2.326 0.277 1.00 32.31 H new ATOM 0 HH22 ARG A 41 -13.131 -1.555 -0.664 1.00 32.31 H new ATOM 662 N LEU A 42 -8.396 -8.850 -5.047 1.00 23.41 N ATOM 663 CA LEU A 42 -8.282 -9.809 -6.108 1.00 12.35 C ATOM 664 C LEU A 42 -8.934 -9.321 -7.396 1.00 52.01 C ATOM 665 O LEU A 42 -9.788 -8.423 -7.376 1.00 31.24 O ATOM 666 CB LEU A 42 -8.947 -11.092 -5.613 1.00 14.05 C ATOM 667 CG LEU A 42 -8.347 -11.669 -4.330 1.00 72.30 C ATOM 668 CD1 LEU A 42 -9.163 -12.830 -3.845 1.00 15.33 C ATOM 669 CD2 LEU A 42 -6.900 -12.096 -4.551 1.00 25.13 C ATOM 0 H LEU A 42 -9.206 -9.029 -4.453 1.00 23.41 H new ATOM 0 HA LEU A 42 -7.232 -9.975 -6.351 1.00 12.35 H new ATOM 0 HB2 LEU A 42 -10.006 -10.895 -5.446 1.00 14.05 H new ATOM 0 HB3 LEU A 42 -8.883 -11.845 -6.399 1.00 14.05 H new ATOM 0 HG LEU A 42 -8.361 -10.889 -3.569 1.00 72.30 H new ATOM 0 HD11 LEU A 42 -8.722 -13.228 -2.931 1.00 15.33 H new ATOM 0 HD12 LEU A 42 -10.182 -12.499 -3.642 1.00 15.33 H new ATOM 0 HD13 LEU A 42 -9.180 -13.607 -4.609 1.00 15.33 H new ATOM 0 HD21 LEU A 42 -6.495 -12.503 -3.624 1.00 25.13 H new ATOM 0 HD22 LEU A 42 -6.860 -12.858 -5.330 1.00 25.13 H new ATOM 0 HD23 LEU A 42 -6.309 -11.233 -4.857 1.00 25.13 H new ATOM 681 N LYS A 43 -8.513 -9.906 -8.503 1.00 23.53 N ATOM 682 CA LYS A 43 -9.013 -9.568 -9.818 1.00 74.11 C ATOM 683 C LYS A 43 -10.254 -10.376 -10.170 1.00 61.45 C ATOM 684 O LYS A 43 -11.375 -9.851 -10.178 1.00 62.24 O ATOM 685 CB LYS A 43 -7.946 -9.845 -10.876 1.00 12.31 C ATOM 686 CG LYS A 43 -6.665 -9.054 -10.722 1.00 52.34 C ATOM 687 CD LYS A 43 -5.617 -9.510 -11.723 1.00 15.53 C ATOM 688 CE LYS A 43 -6.071 -9.310 -13.167 1.00 24.23 C ATOM 689 NZ LYS A 43 -5.082 -9.823 -14.138 1.00 62.11 N ATOM 0 H LYS A 43 -7.804 -10.639 -8.511 1.00 23.53 H new ATOM 0 HA LYS A 43 -9.269 -8.509 -9.801 1.00 74.11 H new ATOM 0 HB2 LYS A 43 -7.703 -10.907 -10.854 1.00 12.31 H new ATOM 0 HB3 LYS A 43 -8.368 -9.635 -11.859 1.00 12.31 H new ATOM 0 HG2 LYS A 43 -6.870 -7.993 -10.863 1.00 52.34 H new ATOM 0 HG3 LYS A 43 -6.281 -9.172 -9.709 1.00 52.34 H new ATOM 0 HD2 LYS A 43 -4.692 -8.958 -11.555 1.00 15.53 H new ATOM 0 HD3 LYS A 43 -5.393 -10.564 -11.557 1.00 15.53 H new ATOM 0 HE2 LYS A 43 -7.024 -9.816 -13.320 1.00 24.23 H new ATOM 0 HE3 LYS A 43 -6.240 -8.249 -13.349 1.00 24.23 H new ATOM 0 HZ1 LYS A 43 -5.267 -9.409 -15.074 1.00 62.11 H new ATOM 0 HZ2 LYS A 43 -4.124 -9.563 -13.828 1.00 62.11 H new ATOM 0 HZ3 LYS A 43 -5.158 -10.859 -14.196 1.00 62.11 H new ATOM 703 N ASN A 44 -10.059 -11.653 -10.442 1.00 35.52 N ATOM 704 CA ASN A 44 -11.142 -12.503 -10.916 1.00 62.11 C ATOM 705 C ASN A 44 -11.530 -13.555 -9.898 1.00 42.13 C ATOM 706 O ASN A 44 -12.704 -13.689 -9.555 1.00 21.02 O ATOM 707 CB ASN A 44 -10.752 -13.172 -12.245 1.00 10.12 C ATOM 708 CG ASN A 44 -11.838 -14.084 -12.826 1.00 13.22 C ATOM 709 OD1 ASN A 44 -11.530 -15.086 -13.482 1.00 21.13 O ATOM 710 ND2 ASN A 44 -13.088 -13.736 -12.639 1.00 11.32 N ATOM 0 H ASN A 44 -9.161 -12.127 -10.344 1.00 35.52 H new ATOM 0 HA ASN A 44 -12.011 -11.863 -11.073 1.00 62.11 H new ATOM 0 HB2 ASN A 44 -10.514 -12.397 -12.974 1.00 10.12 H new ATOM 0 HB3 ASN A 44 -9.844 -13.756 -12.093 1.00 10.12 H new ATOM 0 HD21 ASN A 44 -13.839 -14.298 -13.040 1.00 11.32 H new ATOM 0 HD22 ASN A 44 -13.309 -12.904 -12.093 1.00 11.32 H new ATOM 717 N ASN A 45 -10.561 -14.297 -9.415 1.00 11.55 N ATOM 718 CA ASN A 45 -10.840 -15.362 -8.468 1.00 3.42 C ATOM 719 C ASN A 45 -10.958 -14.788 -7.068 1.00 4.14 C ATOM 720 O ASN A 45 -9.948 -14.458 -6.443 1.00 2.15 O ATOM 721 CB ASN A 45 -9.750 -16.447 -8.530 1.00 34.13 C ATOM 722 CG ASN A 45 -9.992 -17.597 -7.565 1.00 12.12 C ATOM 723 OD1 ASN A 45 -11.127 -17.943 -7.259 1.00 2.43 O ATOM 724 ND2 ASN A 45 -8.929 -18.187 -7.078 1.00 43.40 N ATOM 0 H ASN A 45 -9.576 -14.187 -9.658 1.00 11.55 H new ATOM 0 HA ASN A 45 -11.788 -15.831 -8.733 1.00 3.42 H new ATOM 0 HB2 ASN A 45 -9.695 -16.839 -9.545 1.00 34.13 H new ATOM 0 HB3 ASN A 45 -8.783 -15.994 -8.310 1.00 34.13 H new ATOM 0 HD21 ASN A 45 -9.031 -18.961 -6.422 1.00 43.40 H new ATOM 0 HD22 ASN A 45 -7.999 -17.872 -7.355 1.00 43.40 H new ATOM 731 N ASN A 46 -12.198 -14.656 -6.605 1.00 62.32 N ATOM 732 CA ASN A 46 -12.549 -14.065 -5.305 1.00 73.23 C ATOM 733 C ASN A 46 -12.437 -12.523 -5.326 1.00 5.01 C ATOM 734 O ASN A 46 -12.357 -11.917 -6.403 1.00 64.02 O ATOM 735 CB ASN A 46 -11.823 -14.723 -4.104 1.00 45.30 C ATOM 736 CG ASN A 46 -12.237 -16.164 -3.855 1.00 5.22 C ATOM 737 OD1 ASN A 46 -13.197 -16.431 -3.134 1.00 14.10 O ATOM 738 ND2 ASN A 46 -11.516 -17.094 -4.421 1.00 40.12 N ATOM 0 H ASN A 46 -13.014 -14.964 -7.134 1.00 62.32 H new ATOM 0 HA ASN A 46 -13.601 -14.296 -5.139 1.00 73.23 H new ATOM 0 HB2 ASN A 46 -10.747 -14.688 -4.277 1.00 45.30 H new ATOM 0 HB3 ASN A 46 -12.020 -14.137 -3.206 1.00 45.30 H new ATOM 0 HD21 ASN A 46 -11.743 -18.077 -4.271 1.00 40.12 H new ATOM 0 HD22 ASN A 46 -10.726 -16.837 -5.013 1.00 40.12 H new ATOM 745 N ARG A 47 -12.456 -11.882 -4.152 1.00 13.32 N ATOM 746 CA ARG A 47 -12.585 -10.414 -4.080 1.00 64.04 C ATOM 747 C ARG A 47 -11.480 -9.804 -3.270 1.00 2.42 C ATOM 748 O ARG A 47 -10.651 -9.104 -3.786 1.00 72.10 O ATOM 749 CB ARG A 47 -13.920 -9.972 -3.447 1.00 71.41 C ATOM 750 CG ARG A 47 -15.188 -10.530 -4.067 1.00 60.02 C ATOM 751 CD ARG A 47 -15.350 -12.018 -3.797 1.00 63.43 C ATOM 752 NE ARG A 47 -15.417 -12.316 -2.357 1.00 4.12 N ATOM 753 CZ ARG A 47 -16.143 -13.299 -1.814 1.00 41.02 C ATOM 754 NH1 ARG A 47 -16.917 -14.068 -2.578 1.00 12.33 N ATOM 755 NH2 ARG A 47 -16.086 -13.514 -0.509 1.00 72.41 N ATOM 0 H ARG A 47 -12.385 -12.346 -3.246 1.00 13.32 H new ATOM 0 HA ARG A 47 -12.538 -10.069 -5.113 1.00 64.04 H new ATOM 0 HB2 ARG A 47 -13.905 -10.251 -2.393 1.00 71.41 H new ATOM 0 HB3 ARG A 47 -13.972 -8.884 -3.488 1.00 71.41 H new ATOM 0 HG2 ARG A 47 -16.051 -9.994 -3.671 1.00 60.02 H new ATOM 0 HG3 ARG A 47 -15.171 -10.357 -5.143 1.00 60.02 H new ATOM 0 HD2 ARG A 47 -16.257 -12.378 -4.284 1.00 63.43 H new ATOM 0 HD3 ARG A 47 -14.514 -12.559 -4.240 1.00 63.43 H new ATOM 0 HE ARG A 47 -14.869 -11.730 -1.727 1.00 4.12 H new ATOM 0 HH11 ARG A 47 -16.959 -13.909 -3.585 1.00 12.33 H new ATOM 0 HH12 ARG A 47 -17.468 -14.816 -2.156 1.00 12.33 H new ATOM 0 HH21 ARG A 47 -15.490 -12.931 0.078 1.00 72.41 H new ATOM 0 HH22 ARG A 47 -16.638 -14.263 -0.091 1.00 72.41 H new ATOM 769 N GLN A 48 -11.507 -10.023 -1.994 1.00 73.12 N ATOM 770 CA GLN A 48 -10.468 -9.519 -1.136 1.00 21.25 C ATOM 771 C GLN A 48 -10.059 -10.555 -0.130 1.00 1.13 C ATOM 772 O GLN A 48 -10.907 -11.249 0.454 1.00 14.15 O ATOM 773 CB GLN A 48 -10.843 -8.191 -0.457 1.00 33.30 C ATOM 774 CG GLN A 48 -12.083 -8.237 0.405 1.00 55.11 C ATOM 775 CD GLN A 48 -12.343 -6.926 1.104 1.00 54.34 C ATOM 776 OE1 GLN A 48 -13.023 -6.055 0.583 1.00 23.31 O ATOM 777 NE2 GLN A 48 -11.821 -6.783 2.293 1.00 65.13 N ATOM 0 H GLN A 48 -12.238 -10.549 -1.516 1.00 73.12 H new ATOM 0 HA GLN A 48 -9.611 -9.300 -1.773 1.00 21.25 H new ATOM 0 HB2 GLN A 48 -10.004 -7.866 0.158 1.00 33.30 H new ATOM 0 HB3 GLN A 48 -10.984 -7.434 -1.228 1.00 33.30 H new ATOM 0 HG2 GLN A 48 -12.943 -8.493 -0.213 1.00 55.11 H new ATOM 0 HG3 GLN A 48 -11.977 -9.028 1.148 1.00 55.11 H new ATOM 0 HE21 GLN A 48 -11.258 -7.532 2.696 1.00 65.13 H new ATOM 0 HE22 GLN A 48 -11.976 -5.922 2.818 1.00 65.13 H new ATOM 786 N VAL A 49 -8.787 -10.669 0.053 1.00 20.13 N ATOM 787 CA VAL A 49 -8.195 -11.589 0.987 1.00 64.31 C ATOM 788 C VAL A 49 -7.121 -10.875 1.756 1.00 52.21 C ATOM 789 O VAL A 49 -6.578 -9.877 1.285 1.00 1.31 O ATOM 790 CB VAL A 49 -7.626 -12.880 0.316 1.00 44.43 C ATOM 791 CG1 VAL A 49 -8.750 -13.749 -0.231 1.00 61.21 C ATOM 792 CG2 VAL A 49 -6.643 -12.534 -0.795 1.00 22.13 C ATOM 0 H VAL A 49 -8.102 -10.110 -0.456 1.00 20.13 H new ATOM 0 HA VAL A 49 -8.984 -11.930 1.657 1.00 64.31 H new ATOM 0 HB VAL A 49 -7.094 -13.442 1.083 1.00 44.43 H new ATOM 0 HG11 VAL A 49 -8.328 -14.641 -0.693 1.00 61.21 H new ATOM 0 HG12 VAL A 49 -9.413 -14.041 0.583 1.00 61.21 H new ATOM 0 HG13 VAL A 49 -9.315 -13.188 -0.975 1.00 61.21 H new ATOM 0 HG21 VAL A 49 -6.263 -13.452 -1.244 1.00 22.13 H new ATOM 0 HG22 VAL A 49 -7.149 -11.940 -1.556 1.00 22.13 H new ATOM 0 HG23 VAL A 49 -5.813 -11.962 -0.381 1.00 22.13 H new ATOM 802 N CYS A 50 -6.801 -11.361 2.893 1.00 60.23 N ATOM 803 CA CYS A 50 -5.862 -10.689 3.747 1.00 65.42 C ATOM 804 C CYS A 50 -4.561 -11.413 3.585 1.00 44.41 C ATOM 805 O CYS A 50 -4.566 -12.595 3.437 1.00 13.10 O ATOM 806 CB CYS A 50 -6.368 -10.801 5.172 1.00 73.11 C ATOM 807 SG CYS A 50 -5.507 -9.782 6.394 1.00 61.04 S ATOM 0 H CYS A 50 -7.173 -12.232 3.271 1.00 60.23 H new ATOM 0 HA CYS A 50 -5.740 -9.634 3.503 1.00 65.42 H new ATOM 0 HB2 CYS A 50 -7.425 -10.535 5.184 1.00 73.11 H new ATOM 0 HB3 CYS A 50 -6.298 -11.844 5.482 1.00 73.11 H new ATOM 812 N ILE A 51 -3.461 -10.715 3.574 1.00 41.03 N ATOM 813 CA ILE A 51 -2.201 -11.334 3.233 1.00 33.04 C ATOM 814 C ILE A 51 -1.212 -11.251 4.388 1.00 52.14 C ATOM 815 O ILE A 51 -1.212 -10.283 5.160 1.00 20.23 O ATOM 816 CB ILE A 51 -1.525 -10.625 2.014 1.00 71.55 C ATOM 817 CG1 ILE A 51 -2.498 -10.349 0.874 1.00 22.52 C ATOM 818 CG2 ILE A 51 -0.402 -11.484 1.482 1.00 12.14 C ATOM 819 CD1 ILE A 51 -3.148 -11.575 0.283 1.00 30.33 C ATOM 0 H ILE A 51 -3.405 -9.721 3.795 1.00 41.03 H new ATOM 0 HA ILE A 51 -2.433 -12.372 2.995 1.00 33.04 H new ATOM 0 HB ILE A 51 -1.152 -9.668 2.379 1.00 71.55 H new ATOM 0 HG12 ILE A 51 -3.279 -9.680 1.236 1.00 22.52 H new ATOM 0 HG13 ILE A 51 -1.967 -9.820 0.083 1.00 22.52 H new ATOM 0 HG21 ILE A 51 0.066 -10.986 0.633 1.00 12.14 H new ATOM 0 HG22 ILE A 51 0.340 -11.639 2.265 1.00 12.14 H new ATOM 0 HG23 ILE A 51 -0.800 -12.447 1.163 1.00 12.14 H new ATOM 0 HD11 ILE A 51 -3.823 -11.278 -0.520 1.00 30.33 H new ATOM 0 HD12 ILE A 51 -2.380 -12.238 -0.115 1.00 30.33 H new ATOM 0 HD13 ILE A 51 -3.712 -12.096 1.056 1.00 30.33 H new ATOM 831 N ASP A 52 -0.387 -12.272 4.499 1.00 61.15 N ATOM 832 CA ASP A 52 0.730 -12.264 5.411 1.00 52.25 C ATOM 833 C ASP A 52 1.807 -11.389 4.793 1.00 64.30 C ATOM 834 O ASP A 52 2.279 -11.670 3.683 1.00 51.55 O ATOM 835 CB ASP A 52 1.283 -13.679 5.615 1.00 22.14 C ATOM 836 CG ASP A 52 2.394 -13.727 6.653 1.00 12.40 C ATOM 837 OD1 ASP A 52 2.117 -13.450 7.844 1.00 3.31 O ATOM 838 OD2 ASP A 52 3.543 -14.080 6.308 1.00 35.43 O ATOM 0 H ASP A 52 -0.476 -13.131 3.956 1.00 61.15 H new ATOM 0 HA ASP A 52 0.413 -11.886 6.383 1.00 52.25 H new ATOM 0 HB2 ASP A 52 0.474 -14.341 5.923 1.00 22.14 H new ATOM 0 HB3 ASP A 52 1.661 -14.058 4.665 1.00 22.14 H new ATOM 843 N PRO A 53 2.219 -10.327 5.476 1.00 52.32 N ATOM 844 CA PRO A 53 3.181 -9.359 4.935 1.00 64.12 C ATOM 845 C PRO A 53 4.594 -9.919 4.862 1.00 62.42 C ATOM 846 O PRO A 53 5.521 -9.251 4.410 1.00 20.13 O ATOM 847 CB PRO A 53 3.129 -8.222 5.958 1.00 12.43 C ATOM 848 CG PRO A 53 2.776 -8.902 7.222 1.00 53.00 C ATOM 849 CD PRO A 53 1.801 -9.973 6.846 1.00 52.51 C ATOM 0 HA PRO A 53 2.934 -9.066 3.915 1.00 64.12 H new ATOM 0 HB2 PRO A 53 4.087 -7.708 6.034 1.00 12.43 H new ATOM 0 HB3 PRO A 53 2.386 -7.472 5.686 1.00 12.43 H new ATOM 0 HG2 PRO A 53 3.660 -9.327 7.698 1.00 53.00 H new ATOM 0 HG3 PRO A 53 2.335 -8.203 7.933 1.00 53.00 H new ATOM 0 HD2 PRO A 53 1.858 -10.828 7.520 1.00 52.51 H new ATOM 0 HD3 PRO A 53 0.773 -9.613 6.875 1.00 52.51 H new ATOM 857 N LYS A 54 4.757 -11.138 5.295 1.00 53.43 N ATOM 858 CA LYS A 54 6.033 -11.712 5.337 1.00 22.41 C ATOM 859 C LYS A 54 6.297 -12.651 4.148 1.00 2.31 C ATOM 860 O LYS A 54 7.315 -13.299 4.088 1.00 13.33 O ATOM 861 CB LYS A 54 6.261 -12.353 6.699 1.00 41.55 C ATOM 862 CG LYS A 54 5.982 -11.369 7.833 1.00 3.14 C ATOM 863 CD LYS A 54 6.490 -11.843 9.177 1.00 1.22 C ATOM 864 CE LYS A 54 7.997 -11.964 9.153 1.00 44.12 C ATOM 865 NZ LYS A 54 8.561 -12.201 10.495 1.00 62.43 N ATOM 0 H LYS A 54 4.002 -11.741 5.622 1.00 53.43 H new ATOM 0 HA LYS A 54 6.779 -10.926 5.221 1.00 22.41 H new ATOM 0 HB2 LYS A 54 5.615 -13.225 6.805 1.00 41.55 H new ATOM 0 HB3 LYS A 54 7.289 -12.708 6.768 1.00 41.55 H new ATOM 0 HG2 LYS A 54 6.444 -10.411 7.595 1.00 3.14 H new ATOM 0 HG3 LYS A 54 4.908 -11.197 7.899 1.00 3.14 H new ATOM 0 HD2 LYS A 54 6.186 -11.143 9.956 1.00 1.22 H new ATOM 0 HD3 LYS A 54 6.044 -12.807 9.423 1.00 1.22 H new ATOM 0 HE2 LYS A 54 8.283 -12.782 8.492 1.00 44.12 H new ATOM 0 HE3 LYS A 54 8.426 -11.052 8.737 1.00 44.12 H new ATOM 0 HZ1 LYS A 54 9.387 -12.828 10.419 1.00 62.43 H new ATOM 0 HZ2 LYS A 54 8.852 -11.295 10.914 1.00 62.43 H new ATOM 0 HZ3 LYS A 54 7.842 -12.647 11.100 1.00 62.43 H new ATOM 879 N LEU A 55 5.374 -12.685 3.189 1.00 23.24 N ATOM 880 CA LEU A 55 5.583 -13.433 1.925 1.00 63.15 C ATOM 881 C LEU A 55 6.801 -12.936 1.190 1.00 42.42 C ATOM 882 O LEU A 55 7.101 -11.750 1.237 1.00 22.35 O ATOM 883 CB LEU A 55 4.419 -13.235 0.998 1.00 64.02 C ATOM 884 CG LEU A 55 3.153 -13.950 1.321 1.00 2.12 C ATOM 885 CD1 LEU A 55 2.085 -13.439 0.408 1.00 11.34 C ATOM 886 CD2 LEU A 55 3.346 -15.434 1.086 1.00 14.21 C ATOM 0 H LEU A 55 4.474 -12.209 3.251 1.00 23.24 H new ATOM 0 HA LEU A 55 5.700 -14.481 2.200 1.00 63.15 H new ATOM 0 HB2 LEU A 55 4.201 -12.168 0.955 1.00 64.02 H new ATOM 0 HB3 LEU A 55 4.730 -13.537 -0.002 1.00 64.02 H new ATOM 0 HG LEU A 55 2.874 -13.783 2.361 1.00 2.12 H new ATOM 0 HD11 LEU A 55 1.146 -13.948 0.625 1.00 11.34 H new ATOM 0 HD12 LEU A 55 1.960 -12.367 0.559 1.00 11.34 H new ATOM 0 HD13 LEU A 55 2.370 -13.629 -0.627 1.00 11.34 H new ATOM 0 HD21 LEU A 55 2.422 -15.963 1.321 1.00 14.21 H new ATOM 0 HD22 LEU A 55 3.607 -15.606 0.042 1.00 14.21 H new ATOM 0 HD23 LEU A 55 4.148 -15.802 1.726 1.00 14.21 H new ATOM 898 N LYS A 56 7.463 -13.824 0.460 1.00 23.11 N ATOM 899 CA LYS A 56 8.643 -13.465 -0.302 1.00 4.43 C ATOM 900 C LYS A 56 8.315 -12.411 -1.356 1.00 52.51 C ATOM 901 O LYS A 56 9.079 -11.454 -1.533 1.00 34.52 O ATOM 902 CB LYS A 56 9.313 -14.697 -0.950 1.00 74.53 C ATOM 903 CG LYS A 56 10.535 -14.352 -1.794 1.00 13.35 C ATOM 904 CD LYS A 56 11.642 -13.715 -0.961 1.00 10.00 C ATOM 905 CE LYS A 56 12.752 -13.176 -1.844 1.00 2.24 C ATOM 906 NZ LYS A 56 13.368 -14.210 -2.692 1.00 22.11 N ATOM 0 H LYS A 56 7.197 -14.805 0.382 1.00 23.11 H new ATOM 0 HA LYS A 56 9.359 -13.039 0.401 1.00 4.43 H new ATOM 0 HB2 LYS A 56 9.608 -15.394 -0.166 1.00 74.53 H new ATOM 0 HB3 LYS A 56 8.583 -15.211 -1.575 1.00 74.53 H new ATOM 0 HG2 LYS A 56 10.914 -15.256 -2.270 1.00 13.35 H new ATOM 0 HG3 LYS A 56 10.243 -13.670 -2.592 1.00 13.35 H new ATOM 0 HD2 LYS A 56 11.228 -12.906 -0.359 1.00 10.00 H new ATOM 0 HD3 LYS A 56 12.050 -14.452 -0.269 1.00 10.00 H new ATOM 0 HE2 LYS A 56 12.352 -12.385 -2.478 1.00 2.24 H new ATOM 0 HE3 LYS A 56 13.520 -12.724 -1.217 1.00 2.24 H new ATOM 0 HZ1 LYS A 56 14.213 -13.820 -3.156 1.00 22.11 H new ATOM 0 HZ2 LYS A 56 13.640 -15.024 -2.105 1.00 22.11 H new ATOM 0 HZ3 LYS A 56 12.686 -14.517 -3.415 1.00 22.11 H new ATOM 920 N TRP A 57 7.177 -12.556 -2.043 1.00 53.05 N ATOM 921 CA TRP A 57 6.820 -11.550 -3.033 1.00 43.32 C ATOM 922 C TRP A 57 6.480 -10.222 -2.385 1.00 13.41 C ATOM 923 O TRP A 57 6.671 -9.176 -2.983 1.00 0.13 O ATOM 924 CB TRP A 57 5.762 -12.004 -4.088 1.00 73.22 C ATOM 925 CG TRP A 57 4.387 -12.438 -3.601 1.00 43.20 C ATOM 926 CD1 TRP A 57 4.010 -13.689 -3.196 1.00 1.40 C ATOM 927 CD2 TRP A 57 3.192 -11.626 -3.540 1.00 54.34 C ATOM 928 NE1 TRP A 57 2.665 -13.707 -2.901 1.00 53.32 N ATOM 929 CE2 TRP A 57 2.143 -12.456 -3.092 1.00 33.55 C ATOM 930 CE3 TRP A 57 2.911 -10.282 -3.816 1.00 35.52 C ATOM 931 CZ2 TRP A 57 0.832 -11.986 -2.919 1.00 30.12 C ATOM 932 CZ3 TRP A 57 1.613 -9.823 -3.645 1.00 3.43 C ATOM 933 CH2 TRP A 57 0.593 -10.679 -3.200 1.00 1.13 C ATOM 0 H TRP A 57 6.517 -13.326 -1.936 1.00 53.05 H new ATOM 0 HA TRP A 57 7.723 -11.404 -3.627 1.00 43.32 H new ATOM 0 HB2 TRP A 57 5.620 -11.182 -4.790 1.00 73.22 H new ATOM 0 HB3 TRP A 57 6.191 -12.833 -4.651 1.00 73.22 H new ATOM 0 HD1 TRP A 57 4.671 -14.539 -3.119 1.00 1.40 H new ATOM 0 HE1 TRP A 57 2.140 -14.524 -2.589 1.00 53.32 H new ATOM 0 HE3 TRP A 57 3.690 -9.616 -4.156 1.00 35.52 H new ATOM 0 HZ2 TRP A 57 0.043 -12.639 -2.575 1.00 30.12 H new ATOM 0 HZ3 TRP A 57 1.383 -8.789 -3.858 1.00 3.43 H new ATOM 0 HH2 TRP A 57 -0.406 -10.288 -3.078 1.00 1.13 H new ATOM 944 N ILE A 58 6.004 -10.271 -1.151 1.00 12.43 N ATOM 945 CA ILE A 58 5.739 -9.062 -0.398 1.00 44.43 C ATOM 946 C ILE A 58 7.074 -8.440 0.086 1.00 50.33 C ATOM 947 O ILE A 58 7.242 -7.220 0.044 1.00 30.42 O ATOM 948 CB ILE A 58 4.770 -9.301 0.817 1.00 54.30 C ATOM 949 CG1 ILE A 58 3.366 -9.786 0.346 1.00 70.41 C ATOM 950 CG2 ILE A 58 4.631 -8.026 1.639 1.00 43.12 C ATOM 951 CD1 ILE A 58 2.619 -8.780 -0.485 1.00 21.44 C ATOM 0 H ILE A 58 5.794 -11.136 -0.652 1.00 12.43 H new ATOM 0 HA ILE A 58 5.232 -8.368 -1.068 1.00 44.43 H new ATOM 0 HB ILE A 58 5.205 -10.085 1.437 1.00 54.30 H new ATOM 0 HG12 ILE A 58 3.484 -10.703 -0.231 1.00 70.41 H new ATOM 0 HG13 ILE A 58 2.767 -10.036 1.221 1.00 70.41 H new ATOM 0 HG21 ILE A 58 3.957 -8.205 2.477 1.00 43.12 H new ATOM 0 HG22 ILE A 58 5.609 -7.728 2.017 1.00 43.12 H new ATOM 0 HG23 ILE A 58 4.227 -7.231 1.012 1.00 43.12 H new ATOM 0 HD11 ILE A 58 1.652 -9.192 -0.773 1.00 21.44 H new ATOM 0 HD12 ILE A 58 2.467 -7.870 0.095 1.00 21.44 H new ATOM 0 HD13 ILE A 58 3.196 -8.547 -1.380 1.00 21.44 H new ATOM 963 N GLN A 59 8.032 -9.308 0.509 1.00 1.44 N ATOM 964 CA GLN A 59 9.361 -8.858 1.006 1.00 20.23 C ATOM 965 C GLN A 59 10.036 -7.988 -0.040 1.00 74.34 C ATOM 966 O GLN A 59 10.421 -6.852 0.227 1.00 42.14 O ATOM 967 CB GLN A 59 10.306 -10.066 1.254 1.00 2.44 C ATOM 968 CG GLN A 59 9.828 -11.141 2.224 1.00 50.41 C ATOM 969 CD GLN A 59 9.640 -10.665 3.640 1.00 13.24 C ATOM 970 OE1 GLN A 59 8.462 -10.236 3.965 1.00 12.24 O flip ATOM 971 NE2 GLN A 59 10.557 -10.715 4.441 1.00 43.32 N flip ATOM 0 H GLN A 59 7.909 -10.321 0.516 1.00 1.44 H new ATOM 0 HA GLN A 59 9.189 -8.313 1.934 1.00 20.23 H new ATOM 0 HB2 GLN A 59 10.504 -10.542 0.294 1.00 2.44 H new ATOM 0 HB3 GLN A 59 11.257 -9.680 1.620 1.00 2.44 H new ATOM 0 HG2 GLN A 59 8.883 -11.545 1.861 1.00 50.41 H new ATOM 0 HG3 GLN A 59 10.547 -11.960 2.222 1.00 50.41 H new ATOM 0 HE21 GLN A 59 11.472 -11.059 4.148 1.00 43.32 H new ATOM 0 HE22 GLN A 59 10.410 -10.413 5.404 1.00 43.32 H new ATOM 980 N GLU A 60 10.113 -8.518 -1.249 1.00 3.34 N ATOM 981 CA GLU A 60 10.765 -7.839 -2.351 1.00 52.24 C ATOM 982 C GLU A 60 9.992 -6.630 -2.763 1.00 13.25 C ATOM 983 O GLU A 60 10.575 -5.592 -3.078 1.00 22.13 O ATOM 984 CB GLU A 60 10.907 -8.771 -3.551 1.00 14.52 C ATOM 985 CG GLU A 60 11.769 -9.978 -3.304 1.00 71.21 C ATOM 986 CD GLU A 60 13.146 -9.595 -2.847 1.00 64.43 C ATOM 987 OE1 GLU A 60 13.887 -8.959 -3.620 1.00 65.53 O ATOM 988 OE2 GLU A 60 13.498 -9.897 -1.711 1.00 14.33 O ATOM 0 H GLU A 60 9.725 -9.430 -1.492 1.00 3.34 H new ATOM 0 HA GLU A 60 11.754 -7.534 -2.009 1.00 52.24 H new ATOM 0 HB2 GLU A 60 9.915 -9.105 -3.855 1.00 14.52 H new ATOM 0 HB3 GLU A 60 11.324 -8.207 -4.386 1.00 14.52 H new ATOM 0 HG2 GLU A 60 11.300 -10.612 -2.552 1.00 71.21 H new ATOM 0 HG3 GLU A 60 11.840 -10.567 -4.218 1.00 71.21 H new ATOM 995 N TYR A 61 8.682 -6.758 -2.753 1.00 45.12 N ATOM 996 CA TYR A 61 7.813 -5.697 -3.174 1.00 32.04 C ATOM 997 C TYR A 61 8.040 -4.486 -2.295 1.00 53.22 C ATOM 998 O TYR A 61 8.253 -3.400 -2.790 1.00 40.42 O ATOM 999 CB TYR A 61 6.350 -6.141 -3.096 1.00 4.44 C ATOM 1000 CG TYR A 61 5.383 -5.205 -3.771 1.00 21.21 C ATOM 1001 CD1 TYR A 61 4.873 -4.087 -3.117 1.00 71.44 C ATOM 1002 CD2 TYR A 61 4.967 -5.451 -5.072 1.00 42.24 C ATOM 1003 CE1 TYR A 61 3.991 -3.246 -3.742 1.00 51.40 C ATOM 1004 CE2 TYR A 61 4.085 -4.615 -5.705 1.00 12.11 C ATOM 1005 CZ TYR A 61 3.602 -3.505 -5.033 1.00 72.25 C ATOM 1006 OH TYR A 61 2.700 -2.673 -5.644 1.00 52.41 O ATOM 0 H TYR A 61 8.197 -7.603 -2.452 1.00 45.12 H new ATOM 0 HA TYR A 61 8.037 -5.440 -4.209 1.00 32.04 H new ATOM 0 HB2 TYR A 61 6.257 -7.129 -3.548 1.00 4.44 H new ATOM 0 HB3 TYR A 61 6.068 -6.242 -2.048 1.00 4.44 H new ATOM 0 HD1 TYR A 61 5.177 -3.880 -2.102 1.00 71.44 H new ATOM 0 HD2 TYR A 61 5.345 -6.317 -5.595 1.00 42.24 H new ATOM 0 HE1 TYR A 61 3.603 -2.383 -3.222 1.00 51.40 H new ATOM 0 HE2 TYR A 61 3.770 -4.820 -6.718 1.00 12.11 H new ATOM 0 HH TYR A 61 3.113 -1.797 -5.794 1.00 52.41 H new ATOM 1016 N LEU A 62 8.033 -4.702 -0.990 1.00 34.35 N ATOM 1017 CA LEU A 62 8.221 -3.628 -0.039 1.00 22.40 C ATOM 1018 C LEU A 62 9.642 -3.087 -0.072 1.00 32.34 C ATOM 1019 O LEU A 62 9.832 -1.879 -0.194 1.00 4.21 O ATOM 1020 CB LEU A 62 7.813 -4.058 1.380 1.00 14.43 C ATOM 1021 CG LEU A 62 6.336 -4.454 1.560 1.00 61.13 C ATOM 1022 CD1 LEU A 62 6.044 -4.846 2.994 1.00 41.43 C ATOM 1023 CD2 LEU A 62 5.414 -3.328 1.127 1.00 11.40 C ATOM 0 H LEU A 62 7.898 -5.620 -0.566 1.00 34.35 H new ATOM 0 HA LEU A 62 7.562 -2.813 -0.337 1.00 22.40 H new ATOM 0 HB2 LEU A 62 8.435 -4.903 1.677 1.00 14.43 H new ATOM 0 HB3 LEU A 62 8.037 -3.241 2.066 1.00 14.43 H new ATOM 0 HG LEU A 62 6.150 -5.319 0.924 1.00 61.13 H new ATOM 0 HD11 LEU A 62 4.993 -5.120 3.089 1.00 41.43 H new ATOM 0 HD12 LEU A 62 6.668 -5.695 3.273 1.00 41.43 H new ATOM 0 HD13 LEU A 62 6.261 -4.005 3.652 1.00 41.43 H new ATOM 0 HD21 LEU A 62 4.377 -3.634 1.264 1.00 11.40 H new ATOM 0 HD22 LEU A 62 5.614 -2.442 1.730 1.00 11.40 H new ATOM 0 HD23 LEU A 62 5.588 -3.099 0.076 1.00 11.40 H new ATOM 1035 N GLU A 63 10.635 -3.984 -0.010 1.00 21.12 N ATOM 1036 CA GLU A 63 12.047 -3.577 -0.018 1.00 2.11 C ATOM 1037 C GLU A 63 12.419 -2.760 -1.231 1.00 4.42 C ATOM 1038 O GLU A 63 13.093 -1.739 -1.125 1.00 61.22 O ATOM 1039 CB GLU A 63 12.996 -4.766 0.014 1.00 54.25 C ATOM 1040 CG GLU A 63 13.059 -5.558 1.288 1.00 41.20 C ATOM 1041 CD GLU A 63 14.267 -6.458 1.278 1.00 71.05 C ATOM 1042 OE1 GLU A 63 14.673 -6.927 0.177 1.00 35.33 O ATOM 1043 OE2 GLU A 63 14.868 -6.678 2.348 1.00 0.53 O ATOM 0 H GLU A 63 10.488 -4.992 0.046 1.00 21.12 H new ATOM 0 HA GLU A 63 12.152 -2.976 0.885 1.00 2.11 H new ATOM 0 HB2 GLU A 63 12.716 -5.444 -0.792 1.00 54.25 H new ATOM 0 HB3 GLU A 63 14.000 -4.404 -0.209 1.00 54.25 H new ATOM 0 HG2 GLU A 63 13.105 -4.883 2.143 1.00 41.20 H new ATOM 0 HG3 GLU A 63 12.153 -6.153 1.401 1.00 41.20 H new ATOM 1050 N LYS A 64 12.001 -3.201 -2.382 1.00 70.25 N ATOM 1051 CA LYS A 64 12.446 -2.561 -3.577 1.00 21.15 C ATOM 1052 C LYS A 64 11.500 -1.425 -3.991 1.00 1.14 C ATOM 1053 O LYS A 64 11.838 -0.625 -4.841 1.00 4.21 O ATOM 1054 CB LYS A 64 12.630 -3.577 -4.709 1.00 42.53 C ATOM 1055 CG LYS A 64 13.447 -4.842 -4.337 1.00 62.20 C ATOM 1056 CD LYS A 64 14.813 -4.519 -3.752 1.00 1.20 C ATOM 1057 CE LYS A 64 15.660 -5.785 -3.526 1.00 33.44 C ATOM 1058 NZ LYS A 64 15.029 -6.798 -2.609 1.00 33.21 N ATOM 0 H LYS A 64 11.364 -3.987 -2.514 1.00 70.25 H new ATOM 0 HA LYS A 64 13.418 -2.114 -3.371 1.00 21.15 H new ATOM 0 HB2 LYS A 64 11.646 -3.890 -5.058 1.00 42.53 H new ATOM 0 HB3 LYS A 64 13.122 -3.080 -5.545 1.00 42.53 H new ATOM 0 HG2 LYS A 64 12.881 -5.434 -3.618 1.00 62.20 H new ATOM 0 HG3 LYS A 64 13.576 -5.459 -5.227 1.00 62.20 H new ATOM 0 HD2 LYS A 64 15.344 -3.843 -4.423 1.00 1.20 H new ATOM 0 HD3 LYS A 64 14.687 -3.994 -2.805 1.00 1.20 H new ATOM 0 HE2 LYS A 64 15.853 -6.256 -4.490 1.00 33.44 H new ATOM 0 HE3 LYS A 64 16.626 -5.493 -3.115 1.00 33.44 H new ATOM 0 HZ1 LYS A 64 15.762 -7.436 -2.240 1.00 33.21 H new ATOM 0 HZ2 LYS A 64 14.566 -6.308 -1.817 1.00 33.21 H new ATOM 0 HZ3 LYS A 64 14.322 -7.350 -3.136 1.00 33.21 H new ATOM 1072 N CYS A 65 10.323 -1.367 -3.367 1.00 70.53 N ATOM 1073 CA CYS A 65 9.326 -0.309 -3.619 1.00 41.51 C ATOM 1074 C CYS A 65 9.925 1.068 -3.411 1.00 4.42 C ATOM 1075 O CYS A 65 9.883 1.906 -4.311 1.00 41.41 O ATOM 1076 CB CYS A 65 8.091 -0.484 -2.711 1.00 64.13 C ATOM 1077 SG CYS A 65 6.817 0.825 -2.851 1.00 15.02 S ATOM 0 H CYS A 65 10.027 -2.051 -2.670 1.00 70.53 H new ATOM 0 HA CYS A 65 9.012 -0.399 -4.659 1.00 41.51 H new ATOM 0 HB2 CYS A 65 7.627 -1.444 -2.939 1.00 64.13 H new ATOM 0 HB3 CYS A 65 8.427 -0.530 -1.675 1.00 64.13 H new ATOM 1082 N LEU A 66 10.526 1.290 -2.244 1.00 1.45 N ATOM 1083 CA LEU A 66 11.093 2.595 -1.942 1.00 40.25 C ATOM 1084 C LEU A 66 12.398 2.843 -2.687 1.00 50.51 C ATOM 1085 O LEU A 66 12.888 3.970 -2.760 1.00 25.14 O ATOM 1086 CB LEU A 66 11.205 2.889 -0.405 1.00 74.21 C ATOM 1087 CG LEU A 66 12.117 2.033 0.536 1.00 53.10 C ATOM 1088 CD1 LEU A 66 11.754 0.568 0.560 1.00 33.02 C ATOM 1089 CD2 LEU A 66 13.605 2.254 0.270 1.00 13.31 C ATOM 0 H LEU A 66 10.630 0.594 -1.506 1.00 1.45 H new ATOM 0 HA LEU A 66 10.376 3.324 -2.319 1.00 40.25 H new ATOM 0 HB2 LEU A 66 11.533 3.924 -0.305 1.00 74.21 H new ATOM 0 HB3 LEU A 66 10.195 2.834 0.001 1.00 74.21 H new ATOM 0 HG LEU A 66 11.917 2.402 1.542 1.00 53.10 H new ATOM 0 HD11 LEU A 66 12.428 0.037 1.233 1.00 33.02 H new ATOM 0 HD12 LEU A 66 10.728 0.453 0.909 1.00 33.02 H new ATOM 0 HD13 LEU A 66 11.844 0.154 -0.444 1.00 33.02 H new ATOM 0 HD21 LEU A 66 14.192 1.636 0.950 1.00 13.31 H new ATOM 0 HD22 LEU A 66 13.835 1.980 -0.760 1.00 13.31 H new ATOM 0 HD23 LEU A 66 13.851 3.304 0.430 1.00 13.31 H new ATOM 1101 N ASN A 67 12.951 1.786 -3.240 1.00 31.24 N ATOM 1102 CA ASN A 67 14.177 1.873 -4.015 1.00 33.54 C ATOM 1103 C ASN A 67 13.858 2.304 -5.447 1.00 11.41 C ATOM 1104 O ASN A 67 14.713 2.846 -6.161 1.00 65.21 O ATOM 1105 CB ASN A 67 14.920 0.523 -3.994 1.00 75.24 C ATOM 1106 CG ASN A 67 16.196 0.522 -4.822 1.00 23.12 C ATOM 1107 OD1 ASN A 67 16.181 0.190 -6.005 1.00 20.43 O ATOM 1108 ND2 ASN A 67 17.295 0.906 -4.222 1.00 71.52 N ATOM 0 H ASN A 67 12.568 0.843 -3.168 1.00 31.24 H new ATOM 0 HA ASN A 67 14.831 2.623 -3.569 1.00 33.54 H new ATOM 0 HB2 ASN A 67 15.165 0.268 -2.963 1.00 75.24 H new ATOM 0 HB3 ASN A 67 14.254 -0.256 -4.366 1.00 75.24 H new ATOM 0 HD21 ASN A 67 18.174 0.936 -4.738 1.00 71.52 H new ATOM 0 HD22 ASN A 67 17.272 1.175 -3.238 1.00 71.52 H new ATOM 1115 N LYS A 68 12.618 2.082 -5.851 1.00 14.15 N ATOM 1116 CA LYS A 68 12.153 2.463 -7.177 1.00 54.42 C ATOM 1117 C LYS A 68 11.974 3.974 -7.291 1.00 51.25 C ATOM 1118 O LYS A 68 11.901 4.685 -6.278 1.00 23.12 O ATOM 1119 CB LYS A 68 10.844 1.748 -7.529 1.00 70.32 C ATOM 1120 CG LYS A 68 10.972 0.239 -7.670 1.00 23.21 C ATOM 1121 CD LYS A 68 9.651 -0.382 -8.084 1.00 73.13 C ATOM 1122 CE LYS A 68 9.800 -1.865 -8.417 1.00 21.31 C ATOM 1123 NZ LYS A 68 10.678 -2.086 -9.594 1.00 72.14 N ATOM 0 H LYS A 68 11.907 1.634 -5.273 1.00 14.15 H new ATOM 0 HA LYS A 68 12.919 2.155 -7.889 1.00 54.42 H new ATOM 0 HB2 LYS A 68 10.105 1.968 -6.758 1.00 70.32 H new ATOM 0 HB3 LYS A 68 10.460 2.157 -8.464 1.00 70.32 H new ATOM 0 HG2 LYS A 68 11.737 0.003 -8.410 1.00 23.21 H new ATOM 0 HG3 LYS A 68 11.300 -0.192 -6.724 1.00 23.21 H new ATOM 0 HD2 LYS A 68 8.925 -0.261 -7.280 1.00 73.13 H new ATOM 0 HD3 LYS A 68 9.257 0.147 -8.951 1.00 73.13 H new ATOM 0 HE2 LYS A 68 10.211 -2.391 -7.555 1.00 21.31 H new ATOM 0 HE3 LYS A 68 8.817 -2.293 -8.613 1.00 21.31 H new ATOM 0 HZ1 LYS A 68 10.542 -3.053 -9.952 1.00 72.14 H new ATOM 0 HZ2 LYS A 68 10.436 -1.403 -10.340 1.00 72.14 H new ATOM 0 HZ3 LYS A 68 11.672 -1.957 -9.315 1.00 72.14 H new ATOM 1207 N ILE B 106 2.587 4.868 13.703 1.00 35.53 N ATOM 1208 CA ILE B 106 1.417 4.264 13.117 1.00 45.34 C ATOM 1209 C ILE B 106 0.615 5.381 12.449 1.00 35.41 C ATOM 1210 O ILE B 106 0.879 6.555 12.691 1.00 14.15 O ATOM 1211 CB ILE B 106 0.548 3.554 14.224 1.00 34.41 C ATOM 1212 CG1 ILE B 106 1.432 2.653 15.114 1.00 42.24 C ATOM 1213 CG2 ILE B 106 -0.580 2.712 13.606 1.00 62.33 C ATOM 1214 CD1 ILE B 106 2.187 1.571 14.365 1.00 50.50 C ATOM 0 HA ILE B 106 1.703 3.506 12.388 1.00 45.34 H new ATOM 0 HB ILE B 106 0.099 4.339 14.833 1.00 34.41 H new ATOM 0 HG12 ILE B 106 2.150 3.280 15.642 1.00 42.24 H new ATOM 0 HG13 ILE B 106 0.803 2.182 15.870 1.00 42.24 H new ATOM 0 HG21 ILE B 106 -1.157 2.238 14.400 1.00 62.33 H new ATOM 0 HG22 ILE B 106 -1.233 3.355 13.017 1.00 62.33 H new ATOM 0 HG23 ILE B 106 -0.150 1.944 12.962 1.00 62.33 H new ATOM 0 HD11 ILE B 106 2.781 0.988 15.069 1.00 50.50 H new ATOM 0 HD12 ILE B 106 1.478 0.916 13.859 1.00 50.50 H new ATOM 0 HD13 ILE B 106 2.846 2.031 13.628 1.00 50.50 H new ATOM 1226 N TYR B 107 -0.348 5.026 11.610 1.00 54.00 N ATOM 1227 CA TYR B 107 -1.215 6.012 10.977 1.00 42.34 C ATOM 1228 C TYR B 107 -2.230 6.494 12.016 1.00 11.32 C ATOM 1229 O TYR B 107 -2.956 7.450 11.804 1.00 1.43 O ATOM 1230 CB TYR B 107 -2.039 5.361 9.887 1.00 40.11 C ATOM 1231 CG TYR B 107 -1.350 4.520 8.876 1.00 32.34 C ATOM 1232 CD1 TYR B 107 -0.683 5.076 7.810 1.00 43.33 C ATOM 1233 CD2 TYR B 107 -1.446 3.156 8.948 1.00 51.12 C ATOM 1234 CE1 TYR B 107 -0.133 4.298 6.842 1.00 64.50 C ATOM 1235 CE2 TYR B 107 -0.886 2.369 7.998 1.00 72.22 C ATOM 1236 CZ TYR B 107 -0.237 2.934 6.943 1.00 33.42 C ATOM 1237 OH TYR B 107 0.289 2.133 5.975 1.00 20.41 O ATOM 0 H TYR B 107 -0.550 4.060 11.351 1.00 54.00 H new ATOM 0 HA TYR B 107 -0.594 6.814 10.579 1.00 42.34 H new ATOM 0 HB2 TYR B 107 -2.796 4.743 10.370 1.00 40.11 H new ATOM 0 HB3 TYR B 107 -2.566 6.153 9.354 1.00 40.11 H new ATOM 0 HD1 TYR B 107 -0.595 6.150 7.741 1.00 43.33 H new ATOM 0 HD2 TYR B 107 -1.975 2.702 9.773 1.00 51.12 H new ATOM 0 HE1 TYR B 107 0.379 4.747 6.004 1.00 64.50 H new ATOM 0 HE2 TYR B 107 -0.954 1.294 8.078 1.00 72.22 H new ATOM 0 HH TYR B 107 1.050 1.635 6.340 1.00 20.41 H new ATOM 1247 N THR B 108 -2.238 5.792 13.137 1.00 25.44 N ATOM 1248 CA THR B 108 -3.216 5.903 14.190 1.00 20.24 C ATOM 1249 C THR B 108 -4.578 5.452 13.695 1.00 52.20 C ATOM 1250 O THR B 108 -5.503 6.247 13.485 1.00 12.24 O ATOM 1251 CB THR B 108 -3.247 7.268 14.979 1.00 25.01 C ATOM 1252 OG1 THR B 108 -3.497 8.382 14.110 1.00 1.02 O ATOM 1253 CG2 THR B 108 -1.929 7.486 15.698 1.00 10.35 C ATOM 0 H THR B 108 -1.522 5.095 13.341 1.00 25.44 H new ATOM 0 HA THR B 108 -2.883 5.216 14.968 1.00 20.24 H new ATOM 0 HB THR B 108 -4.062 7.206 15.700 1.00 25.01 H new ATOM 0 HG1 THR B 108 -3.517 8.073 13.180 1.00 1.02 H new ATOM 0 HG21 THR B 108 -1.962 8.431 16.239 1.00 10.35 H new ATOM 0 HG22 THR B 108 -1.759 6.671 16.401 1.00 10.35 H new ATOM 0 HG23 THR B 108 -1.118 7.513 14.971 1.00 10.35 H new ATOM 1261 N SER B 109 -4.644 4.172 13.421 1.00 50.45 N ATOM 1262 CA SER B 109 -5.807 3.528 12.920 1.00 3.31 C ATOM 1263 C SER B 109 -6.637 2.962 14.062 1.00 25.22 C ATOM 1264 O SER B 109 -6.164 2.131 14.856 1.00 65.41 O ATOM 1265 CB SER B 109 -5.362 2.449 11.948 1.00 72.25 C ATOM 1266 OG SER B 109 -4.320 1.673 12.528 1.00 45.45 O ATOM 0 H SER B 109 -3.855 3.538 13.549 1.00 50.45 H new ATOM 0 HA SER B 109 -6.446 4.239 12.396 1.00 3.31 H new ATOM 0 HB2 SER B 109 -6.205 1.808 11.692 1.00 72.25 H new ATOM 0 HB3 SER B 109 -5.015 2.904 11.020 1.00 72.25 H new ATOM 0 HG SER B 109 -4.518 1.515 13.475 1.00 45.45 H new ATOM 1272 N ASP B 110 -7.841 3.426 14.153 1.00 32.40 N ATOM 1273 CA ASP B 110 -8.749 3.048 15.216 1.00 22.22 C ATOM 1274 C ASP B 110 -9.973 2.355 14.632 1.00 34.44 C ATOM 1275 O ASP B 110 -10.484 1.392 15.188 1.00 23.35 O ATOM 1276 CB ASP B 110 -9.148 4.310 15.990 1.00 30.23 C ATOM 1277 CG ASP B 110 -10.095 4.074 17.143 1.00 24.02 C ATOM 1278 OD1 ASP B 110 -9.649 3.567 18.198 1.00 71.53 O ATOM 1279 OD2 ASP B 110 -11.271 4.471 17.042 1.00 14.04 O ATOM 0 H ASP B 110 -8.238 4.089 13.487 1.00 32.40 H new ATOM 0 HA ASP B 110 -8.263 2.349 15.897 1.00 22.22 H new ATOM 0 HB2 ASP B 110 -8.245 4.786 16.372 1.00 30.23 H new ATOM 0 HB3 ASP B 110 -9.610 5.013 15.297 1.00 30.23 H new ATOM 1284 N ASN B 111 -10.407 2.837 13.491 1.00 43.35 N ATOM 1285 CA ASN B 111 -11.576 2.298 12.809 1.00 62.04 C ATOM 1286 C ASN B 111 -11.156 1.421 11.633 1.00 55.14 C ATOM 1287 O ASN B 111 -10.705 1.942 10.597 1.00 71.14 O ATOM 1288 CB ASN B 111 -12.462 3.454 12.309 1.00 12.23 C ATOM 1289 CG ASN B 111 -13.706 2.991 11.569 1.00 41.20 C ATOM 1290 OD1 ASN B 111 -13.691 2.800 10.360 1.00 0.01 O ATOM 1291 ND2 ASN B 111 -14.781 2.829 12.280 1.00 54.32 N ATOM 0 H ASN B 111 -9.964 3.615 13.003 1.00 43.35 H new ATOM 0 HA ASN B 111 -12.140 1.685 13.513 1.00 62.04 H new ATOM 0 HB2 ASN B 111 -12.762 4.065 13.160 1.00 12.23 H new ATOM 0 HB3 ASN B 111 -11.874 4.093 11.650 1.00 12.23 H new ATOM 0 HD21 ASN B 111 -15.649 2.534 11.833 1.00 54.32 H new ATOM 0 HD22 ASN B 111 -14.757 2.997 13.286 1.00 54.32 H new ATOM 1417 N TYR B 121 -5.647 -19.609 2.072 1.00 55.44 N ATOM 1418 CA TYR B 121 -5.841 -19.587 0.645 1.00 32.51 C ATOM 1419 C TYR B 121 -4.959 -20.691 0.061 1.00 54.32 C ATOM 1420 O TYR B 121 -5.235 -21.248 -1.012 1.00 61.54 O ATOM 1421 CB TYR B 121 -5.384 -18.217 0.145 1.00 43.42 C ATOM 1422 CG TYR B 121 -5.831 -17.821 -1.235 1.00 74.43 C ATOM 1423 CD1 TYR B 121 -7.027 -17.156 -1.399 1.00 41.34 C ATOM 1424 CD2 TYR B 121 -5.056 -18.070 -2.354 1.00 14.32 C ATOM 1425 CE1 TYR B 121 -7.454 -16.741 -2.641 1.00 10.12 C ATOM 1426 CE2 TYR B 121 -5.475 -17.666 -3.612 1.00 2.24 C ATOM 1427 CZ TYR B 121 -6.679 -16.998 -3.746 1.00 4.52 C ATOM 1428 OH TYR B 121 -7.101 -16.565 -4.987 1.00 0.43 O ATOM 0 HA TYR B 121 -6.879 -19.750 0.356 1.00 32.51 H new ATOM 0 HB2 TYR B 121 -5.738 -17.462 0.847 1.00 43.42 H new ATOM 0 HB3 TYR B 121 -4.295 -18.191 0.171 1.00 43.42 H new ATOM 0 HD1 TYR B 121 -7.643 -16.956 -0.535 1.00 41.34 H new ATOM 0 HD2 TYR B 121 -4.113 -18.585 -2.246 1.00 14.32 H new ATOM 0 HE1 TYR B 121 -8.392 -16.217 -2.746 1.00 10.12 H new ATOM 0 HE2 TYR B 121 -4.867 -17.871 -4.480 1.00 2.24 H new ATOM 0 HH TYR B 121 -7.635 -15.750 -4.885 1.00 0.43 H new ATOM 1438 N ASP B 122 -3.905 -20.984 0.820 1.00 51.30 N ATOM 1439 CA ASP B 122 -2.897 -22.020 0.565 1.00 22.33 C ATOM 1440 C ASP B 122 -1.859 -21.929 1.696 1.00 44.15 C ATOM 1441 O ASP B 122 -1.379 -20.832 2.018 1.00 34.32 O ATOM 1442 CB ASP B 122 -2.251 -21.859 -0.815 1.00 75.23 C ATOM 1443 CG ASP B 122 -1.170 -22.869 -1.083 1.00 21.14 C ATOM 1444 OD1 ASP B 122 -1.491 -24.013 -1.446 1.00 42.03 O ATOM 1445 OD2 ASP B 122 0.012 -22.539 -0.941 1.00 52.41 O ATOM 0 H ASP B 122 -3.717 -20.475 1.684 1.00 51.30 H new ATOM 0 HA ASP B 122 -3.361 -23.006 0.555 1.00 22.33 H new ATOM 0 HB2 ASP B 122 -3.020 -21.947 -1.582 1.00 75.23 H new ATOM 0 HB3 ASP B 122 -1.832 -20.856 -0.898 1.00 75.23 H new ATOM 1450 N SER B 123 -1.541 -23.043 2.308 1.00 4.44 N ATOM 1451 CA SER B 123 -0.760 -23.050 3.542 1.00 21.22 C ATOM 1452 C SER B 123 0.728 -22.709 3.402 1.00 34.41 C ATOM 1453 O SER B 123 1.489 -23.443 2.770 1.00 62.14 O ATOM 1454 CB SER B 123 -0.949 -24.371 4.266 1.00 3.01 C ATOM 1455 OG SER B 123 -2.323 -24.582 4.556 1.00 13.04 O ATOM 0 H SER B 123 -1.809 -23.969 1.976 1.00 4.44 H new ATOM 0 HA SER B 123 -1.160 -22.225 4.132 1.00 21.22 H new ATOM 0 HB2 SER B 123 -0.570 -25.188 3.651 1.00 3.01 H new ATOM 0 HB3 SER B 123 -0.371 -24.373 5.190 1.00 3.01 H new ATOM 0 HG SER B 123 -2.431 -25.438 5.021 1.00 13.04 H new ATOM 1461 N MET B 124 1.107 -21.577 4.032 1.00 2.33 N ATOM 1462 CA MET B 124 2.492 -21.062 4.200 1.00 74.53 C ATOM 1463 C MET B 124 2.453 -19.923 5.210 1.00 41.53 C ATOM 1464 O MET B 124 1.357 -19.471 5.577 1.00 13.31 O ATOM 1465 CB MET B 124 3.163 -20.531 2.896 1.00 11.23 C ATOM 1466 CG MET B 124 3.514 -21.573 1.846 1.00 13.41 C ATOM 1467 SD MET B 124 4.460 -20.893 0.470 1.00 5.32 S ATOM 1468 CE MET B 124 5.955 -20.362 1.314 1.00 33.51 C ATOM 0 H MET B 124 0.419 -20.959 4.463 1.00 2.33 H new ATOM 0 HA MET B 124 3.094 -21.910 4.527 1.00 74.53 H new ATOM 0 HB2 MET B 124 2.495 -19.799 2.442 1.00 11.23 H new ATOM 0 HB3 MET B 124 4.076 -20.002 3.172 1.00 11.23 H new ATOM 0 HG2 MET B 124 4.087 -22.374 2.314 1.00 13.41 H new ATOM 0 HG3 MET B 124 2.596 -22.019 1.464 1.00 13.41 H new ATOM 0 HE1 MET B 124 6.780 -20.323 0.603 1.00 33.51 H new ATOM 0 HE2 MET B 124 5.798 -19.372 1.743 1.00 33.51 H new ATOM 0 HE3 MET B 124 6.195 -21.069 2.109 1.00 33.51 H new ATOM 1478 N LYS B 125 3.628 -19.494 5.678 1.00 23.32 N ATOM 1479 CA LYS B 125 3.808 -18.333 6.562 1.00 71.15 C ATOM 1480 C LYS B 125 5.256 -17.911 6.447 1.00 54.05 C ATOM 1481 O LYS B 125 6.117 -18.787 6.251 1.00 62.35 O ATOM 1482 CB LYS B 125 3.624 -18.698 8.054 1.00 22.44 C ATOM 1483 CG LYS B 125 2.318 -19.300 8.474 1.00 40.32 C ATOM 1484 CD LYS B 125 2.246 -19.570 9.991 1.00 15.54 C ATOM 1485 CE LYS B 125 3.315 -20.563 10.530 1.00 51.04 C ATOM 1486 NZ LYS B 125 4.713 -20.017 10.617 1.00 51.10 N ATOM 0 H LYS B 125 4.507 -19.956 5.447 1.00 23.32 H new ATOM 0 HA LYS B 125 3.081 -17.575 6.270 1.00 71.15 H new ATOM 0 HB2 LYS B 125 4.416 -19.395 8.328 1.00 22.44 H new ATOM 0 HB3 LYS B 125 3.779 -17.793 8.641 1.00 22.44 H new ATOM 0 HG2 LYS B 125 1.506 -18.631 8.190 1.00 40.32 H new ATOM 0 HG3 LYS B 125 2.164 -20.235 7.935 1.00 40.32 H new ATOM 0 HD2 LYS B 125 2.352 -18.623 10.519 1.00 15.54 H new ATOM 0 HD3 LYS B 125 1.256 -19.959 10.230 1.00 15.54 H new ATOM 0 HE2 LYS B 125 3.010 -20.896 11.522 1.00 51.04 H new ATOM 0 HE3 LYS B 125 3.326 -21.444 9.888 1.00 51.04 H new ATOM 0 HZ1 LYS B 125 5.301 -20.448 9.875 1.00 51.10 H new ATOM 0 HZ2 LYS B 125 4.692 -18.986 10.486 1.00 51.10 H new ATOM 0 HZ3 LYS B 125 5.115 -20.239 11.550 1.00 51.10 H new ATOM 1500 N GLU B 126 5.541 -16.596 6.548 1.00 23.23 N ATOM 1501 CA GLU B 126 6.914 -16.097 6.679 1.00 32.41 C ATOM 1502 C GLU B 126 7.767 -16.261 5.403 1.00 23.15 C ATOM 1503 O GLU B 126 7.492 -17.115 4.551 1.00 62.45 O ATOM 1504 CB GLU B 126 7.556 -16.715 7.935 1.00 50.43 C ATOM 1505 CG GLU B 126 6.856 -16.255 9.202 1.00 71.00 C ATOM 1506 CD GLU B 126 7.271 -17.000 10.422 1.00 61.14 C ATOM 1507 OE1 GLU B 126 8.409 -16.818 10.890 1.00 61.32 O ATOM 1508 OE2 GLU B 126 6.457 -17.787 10.938 1.00 62.33 O ATOM 0 H GLU B 126 4.831 -15.863 6.541 1.00 23.23 H new ATOM 0 HA GLU B 126 6.871 -15.015 6.807 1.00 32.41 H new ATOM 0 HB2 GLU B 126 7.514 -17.802 7.869 1.00 50.43 H new ATOM 0 HB3 GLU B 126 8.610 -16.439 7.980 1.00 50.43 H new ATOM 0 HG2 GLU B 126 7.055 -15.194 9.351 1.00 71.00 H new ATOM 0 HG3 GLU B 126 5.779 -16.363 9.071 1.00 71.00 H new ATOM 1515 N PRO B 127 8.808 -15.426 5.251 1.00 2.11 N ATOM 1516 CA PRO B 127 9.636 -15.402 4.056 1.00 40.24 C ATOM 1517 C PRO B 127 10.470 -16.640 3.854 1.00 74.03 C ATOM 1518 O PRO B 127 10.719 -17.429 4.779 1.00 43.11 O ATOM 1519 CB PRO B 127 10.565 -14.211 4.294 1.00 71.04 C ATOM 1520 CG PRO B 127 10.639 -14.118 5.767 1.00 74.33 C ATOM 1521 CD PRO B 127 9.255 -14.403 6.217 1.00 71.54 C ATOM 0 HA PRO B 127 9.011 -15.339 3.165 1.00 40.24 H new ATOM 0 HB2 PRO B 127 11.548 -14.375 3.853 1.00 71.04 H new ATOM 0 HB3 PRO B 127 10.166 -13.297 3.854 1.00 71.04 H new ATOM 0 HG2 PRO B 127 11.348 -14.838 6.177 1.00 74.33 H new ATOM 0 HG3 PRO B 127 10.967 -13.129 6.088 1.00 74.33 H new ATOM 0 HD2 PRO B 127 9.230 -14.774 7.242 1.00 71.54 H new ATOM 0 HD3 PRO B 127 8.627 -13.513 6.185 1.00 71.54 H new ATOM 1846 N CYS C 209 -0.575 5.953 -14.962 1.00 13.31 N ATOM 1847 CA CYS C 209 -0.123 5.856 -13.621 1.00 35.23 C ATOM 1848 C CYS C 209 -1.351 6.067 -12.719 1.00 14.32 C ATOM 1849 O CYS C 209 -2.357 6.597 -13.192 1.00 63.32 O ATOM 1850 CB CYS C 209 0.981 6.881 -13.407 1.00 3.23 C ATOM 1851 SG CYS C 209 2.367 6.611 -14.566 1.00 32.11 S ATOM 0 HA CYS C 209 0.309 4.885 -13.380 1.00 35.23 H new ATOM 0 HB2 CYS C 209 0.580 7.885 -13.543 1.00 3.23 H new ATOM 0 HB3 CYS C 209 1.344 6.819 -12.381 1.00 3.23 H new ATOM 1856 N PRO C 210 -1.311 5.682 -11.435 1.00 25.31 N ATOM 1857 CA PRO C 210 -2.507 5.703 -10.596 1.00 3.13 C ATOM 1858 C PRO C 210 -2.894 7.115 -10.171 1.00 5.43 C ATOM 1859 O PRO C 210 -4.076 7.472 -10.116 1.00 73.41 O ATOM 1860 CB PRO C 210 -2.074 4.855 -9.395 1.00 72.03 C ATOM 1861 CG PRO C 210 -0.626 5.089 -9.272 1.00 22.23 C ATOM 1862 CD PRO C 210 -0.114 5.253 -10.675 1.00 54.11 C ATOM 0 HA PRO C 210 -3.394 5.328 -11.107 1.00 3.13 H new ATOM 0 HB2 PRO C 210 -2.601 5.154 -8.489 1.00 72.03 H new ATOM 0 HB3 PRO C 210 -2.292 3.799 -9.557 1.00 72.03 H new ATOM 0 HG2 PRO C 210 -0.424 5.979 -8.676 1.00 22.23 H new ATOM 0 HG3 PRO C 210 -0.136 4.253 -8.773 1.00 22.23 H new ATOM 0 HD2 PRO C 210 0.682 5.996 -10.727 1.00 54.11 H new ATOM 0 HD3 PRO C 210 0.295 4.321 -11.064 1.00 54.11 H new ATOM 1870 N CYS C 211 -1.907 7.876 -9.832 1.00 11.51 N ATOM 1871 CA CYS C 211 -2.077 9.215 -9.411 1.00 41.21 C ATOM 1872 C CYS C 211 -1.746 10.177 -10.529 1.00 63.14 C ATOM 1873 O CYS C 211 -0.926 9.869 -11.402 1.00 42.32 O ATOM 1874 CB CYS C 211 -1.169 9.451 -8.238 1.00 43.01 C ATOM 1875 SG CYS C 211 -1.404 8.218 -6.927 1.00 61.11 S ATOM 0 H CYS C 211 -0.934 7.569 -9.843 1.00 11.51 H new ATOM 0 HA CYS C 211 -3.116 9.384 -9.129 1.00 41.21 H new ATOM 0 HB2 CYS C 211 -0.132 9.428 -8.573 1.00 43.01 H new ATOM 0 HB3 CYS C 211 -1.352 10.447 -7.834 1.00 43.01 H new ATOM 1880 N ARG C 212 -2.404 11.301 -10.536 1.00 62.42 N ATOM 1881 CA ARG C 212 -2.028 12.384 -11.410 1.00 5.15 C ATOM 1882 C ARG C 212 -1.263 13.372 -10.515 1.00 3.32 C ATOM 1883 O ARG C 212 -0.261 13.966 -10.911 1.00 53.03 O ATOM 1884 CB ARG C 212 -3.299 13.045 -12.005 1.00 44.12 C ATOM 1885 CG ARG C 212 -3.098 13.969 -13.231 1.00 12.34 C ATOM 1886 CD ARG C 212 -2.198 15.167 -12.974 1.00 65.12 C ATOM 1887 NE ARG C 212 -2.092 16.040 -14.145 1.00 74.32 N ATOM 1888 CZ ARG C 212 -1.399 17.183 -14.190 1.00 60.52 C ATOM 1889 NH1 ARG C 212 -0.637 17.553 -13.162 1.00 63.35 N ATOM 1890 NH2 ARG C 212 -1.435 17.935 -15.277 1.00 64.33 N ATOM 0 H ARG C 212 -3.210 11.496 -9.943 1.00 62.42 H new ATOM 0 HA ARG C 212 -1.419 12.052 -12.251 1.00 5.15 H new ATOM 0 HB2 ARG C 212 -3.993 12.253 -12.287 1.00 44.12 H new ATOM 0 HB3 ARG C 212 -3.780 13.625 -11.218 1.00 44.12 H new ATOM 0 HG2 ARG C 212 -2.677 13.382 -14.048 1.00 12.34 H new ATOM 0 HG3 ARG C 212 -4.072 14.327 -13.565 1.00 12.34 H new ATOM 0 HD2 ARG C 212 -2.588 15.738 -12.131 1.00 65.12 H new ATOM 0 HD3 ARG C 212 -1.205 14.819 -12.691 1.00 65.12 H new ATOM 0 HE ARG C 212 -2.585 15.754 -14.991 1.00 74.32 H new ATOM 0 HH11 ARG C 212 -0.579 16.963 -12.332 1.00 63.35 H new ATOM 0 HH12 ARG C 212 -0.112 18.426 -13.205 1.00 63.35 H new ATOM 0 HH21 ARG C 212 -1.991 17.643 -16.081 1.00 64.33 H new ATOM 0 HH22 ARG C 212 -0.907 18.807 -15.312 1.00 64.33 H new ATOM 1904 N PHE C 213 -1.746 13.499 -9.286 1.00 4.33 N ATOM 1905 CA PHE C 213 -1.149 14.364 -8.285 1.00 43.41 C ATOM 1906 C PHE C 213 -0.836 13.531 -7.061 1.00 21.05 C ATOM 1907 O PHE C 213 -1.585 12.596 -6.748 1.00 33.32 O ATOM 1908 CB PHE C 213 -2.120 15.473 -7.868 1.00 10.13 C ATOM 1909 CG PHE C 213 -2.603 16.359 -8.973 1.00 54.32 C ATOM 1910 CD1 PHE C 213 -1.864 17.455 -9.366 1.00 23.13 C ATOM 1911 CD2 PHE C 213 -3.808 16.104 -9.610 1.00 11.21 C ATOM 1912 CE1 PHE C 213 -2.310 18.279 -10.373 1.00 64.31 C ATOM 1913 CE2 PHE C 213 -4.257 16.926 -10.615 1.00 54.10 C ATOM 1914 CZ PHE C 213 -3.510 18.013 -10.998 1.00 73.10 C ATOM 0 H PHE C 213 -2.571 12.998 -8.956 1.00 4.33 H new ATOM 0 HA PHE C 213 -0.251 14.817 -8.704 1.00 43.41 H new ATOM 0 HB2 PHE C 213 -2.985 15.013 -7.391 1.00 10.13 H new ATOM 0 HB3 PHE C 213 -1.633 16.093 -7.115 1.00 10.13 H new ATOM 0 HD1 PHE C 213 -0.925 17.669 -8.878 1.00 23.13 H new ATOM 0 HD2 PHE C 213 -4.400 15.251 -9.313 1.00 11.21 H new ATOM 0 HE1 PHE C 213 -1.721 19.133 -10.674 1.00 64.31 H new ATOM 0 HE2 PHE C 213 -5.197 16.717 -11.104 1.00 54.10 H new ATOM 0 HZ PHE C 213 -3.862 18.659 -11.788 1.00 73.10 H new ATOM 1924 N PHE C 214 0.260 13.832 -6.399 1.00 51.41 N ATOM 1925 CA PHE C 214 0.631 13.137 -5.179 1.00 75.05 C ATOM 1926 C PHE C 214 1.094 14.128 -4.112 1.00 55.54 C ATOM 1927 O PHE C 214 1.668 15.189 -4.434 1.00 44.55 O ATOM 1928 CB PHE C 214 1.709 12.062 -5.440 1.00 31.41 C ATOM 1929 CG PHE C 214 3.006 12.598 -5.981 1.00 15.45 C ATOM 1930 CD1 PHE C 214 3.998 13.021 -5.120 1.00 42.35 C ATOM 1931 CD2 PHE C 214 3.229 12.673 -7.343 1.00 33.14 C ATOM 1932 CE1 PHE C 214 5.186 13.512 -5.597 1.00 40.43 C ATOM 1933 CE2 PHE C 214 4.420 13.164 -7.833 1.00 34.45 C ATOM 1934 CZ PHE C 214 5.400 13.584 -6.957 1.00 1.02 C ATOM 0 H PHE C 214 0.916 14.559 -6.685 1.00 51.41 H new ATOM 0 HA PHE C 214 -0.257 12.624 -4.809 1.00 75.05 H new ATOM 0 HB2 PHE C 214 1.910 11.533 -4.508 1.00 31.41 H new ATOM 0 HB3 PHE C 214 1.311 11.330 -6.143 1.00 31.41 H new ATOM 0 HD1 PHE C 214 3.836 12.964 -4.054 1.00 42.35 H new ATOM 0 HD2 PHE C 214 2.463 12.344 -8.030 1.00 33.14 H new ATOM 0 HE1 PHE C 214 5.951 13.841 -4.910 1.00 40.43 H new ATOM 0 HE2 PHE C 214 4.586 13.220 -8.899 1.00 34.45 H new ATOM 0 HZ PHE C 214 6.335 13.969 -7.337 1.00 1.02 H new ATOM 1944 N GLU C 215 0.860 13.783 -2.871 1.00 52.32 N ATOM 1945 CA GLU C 215 1.237 14.592 -1.749 1.00 20.54 C ATOM 1946 C GLU C 215 2.572 14.125 -1.252 1.00 61.01 C ATOM 1947 O GLU C 215 2.862 12.923 -1.278 1.00 53.54 O ATOM 1948 CB GLU C 215 0.224 14.410 -0.600 1.00 33.32 C ATOM 1949 CG GLU C 215 -1.242 14.603 -0.979 1.00 14.01 C ATOM 1950 CD GLU C 215 -1.571 15.977 -1.553 1.00 34.32 C ATOM 1951 OE1 GLU C 215 -0.686 16.634 -2.144 1.00 22.42 O ATOM 1952 OE2 GLU C 215 -2.704 16.439 -1.354 1.00 14.11 O ATOM 0 H GLU C 215 0.393 12.914 -2.612 1.00 52.32 H new ATOM 0 HA GLU C 215 1.268 15.637 -2.058 1.00 20.54 H new ATOM 0 HB2 GLU C 215 0.346 13.409 -0.187 1.00 33.32 H new ATOM 0 HB3 GLU C 215 0.472 15.114 0.194 1.00 33.32 H new ATOM 0 HG2 GLU C 215 -1.519 13.842 -1.709 1.00 14.01 H new ATOM 0 HG3 GLU C 215 -1.858 14.435 -0.095 1.00 14.01 H new ATOM 1959 N SER C 216 3.390 15.031 -0.819 1.00 50.01 N ATOM 1960 CA SER C 216 4.609 14.637 -0.224 1.00 54.22 C ATOM 1961 C SER C 216 4.424 14.620 1.280 1.00 24.41 C ATOM 1962 O SER C 216 4.150 13.582 1.859 1.00 64.35 O ATOM 1963 CB SER C 216 5.753 15.538 -0.633 1.00 70.13 C ATOM 1964 OG SER C 216 6.964 15.114 -0.047 1.00 22.51 O ATOM 0 H SER C 216 3.231 16.037 -0.869 1.00 50.01 H new ATOM 0 HA SER C 216 4.874 13.638 -0.572 1.00 54.22 H new ATOM 0 HB2 SER C 216 5.850 15.538 -1.719 1.00 70.13 H new ATOM 0 HB3 SER C 216 5.539 16.563 -0.332 1.00 70.13 H new ATOM 0 HG SER C 216 7.575 14.803 -0.747 1.00 22.51 H new ATOM 1970 N HIS C 217 4.494 15.777 1.919 1.00 10.14 N ATOM 1971 CA HIS C 217 4.292 15.808 3.348 1.00 75.44 C ATOM 1972 C HIS C 217 2.840 15.781 3.685 1.00 74.21 C ATOM 1973 O HIS C 217 2.207 16.810 3.850 1.00 70.05 O ATOM 1974 CB HIS C 217 4.979 16.969 4.064 1.00 11.01 C ATOM 1975 CG HIS C 217 6.466 16.888 4.162 1.00 74.32 C ATOM 1976 ND1 HIS C 217 7.122 16.735 5.362 1.00 42.40 N ATOM 1977 CD2 HIS C 217 7.430 16.997 3.228 1.00 30.32 C ATOM 1978 CE1 HIS C 217 8.415 16.758 5.165 1.00 63.22 C ATOM 1979 NE2 HIS C 217 8.632 16.912 3.881 1.00 12.41 N ATOM 0 H HIS C 217 4.684 16.679 1.482 1.00 10.14 H new ATOM 0 HA HIS C 217 4.774 14.903 3.718 1.00 75.44 H new ATOM 0 HB2 HIS C 217 4.718 17.893 3.549 1.00 11.01 H new ATOM 0 HB3 HIS C 217 4.571 17.041 5.072 1.00 11.01 H new ATOM 0 HD2 HIS C 217 7.284 17.127 2.166 1.00 30.32 H new ATOM 0 HE1 HIS C 217 9.173 16.666 5.928 1.00 63.22 H new ATOM 0 HE2 HIS C 217 9.550 16.961 3.438 1.00 12.41 H new ATOM 1988 N VAL C 218 2.305 14.608 3.692 1.00 64.01 N ATOM 1989 CA VAL C 218 0.967 14.391 4.084 1.00 11.41 C ATOM 1990 C VAL C 218 1.036 14.011 5.555 1.00 44.13 C ATOM 1991 O VAL C 218 2.035 13.431 5.993 1.00 30.14 O ATOM 1992 CB VAL C 218 0.333 13.227 3.264 1.00 60.32 C ATOM 1993 CG1 VAL C 218 0.901 11.873 3.658 1.00 65.33 C ATOM 1994 CG2 VAL C 218 -1.188 13.244 3.304 1.00 30.42 C ATOM 0 H VAL C 218 2.801 13.760 3.419 1.00 64.01 H new ATOM 0 HA VAL C 218 0.352 15.274 3.913 1.00 11.41 H new ATOM 0 HB VAL C 218 0.614 13.397 2.225 1.00 60.32 H new ATOM 0 HG11 VAL C 218 0.430 11.093 3.060 1.00 65.33 H new ATOM 0 HG12 VAL C 218 1.977 11.865 3.482 1.00 65.33 H new ATOM 0 HG13 VAL C 218 0.705 11.689 4.714 1.00 65.33 H new ATOM 0 HG21 VAL C 218 -1.577 12.412 2.717 1.00 30.42 H new ATOM 0 HG22 VAL C 218 -1.526 13.149 4.336 1.00 30.42 H new ATOM 0 HG23 VAL C 218 -1.552 14.183 2.888 1.00 30.42 H new ATOM 2004 N ALA C 219 0.055 14.339 6.314 1.00 14.11 N ATOM 2005 CA ALA C 219 0.115 13.988 7.705 1.00 15.24 C ATOM 2006 C ALA C 219 -0.204 12.517 7.887 1.00 42.01 C ATOM 2007 O ALA C 219 -1.277 12.053 7.499 1.00 72.02 O ATOM 2008 CB ALA C 219 -0.788 14.870 8.539 1.00 61.53 C ATOM 0 H ALA C 219 -0.784 14.837 6.017 1.00 14.11 H new ATOM 0 HA ALA C 219 1.131 14.159 8.061 1.00 15.24 H new ATOM 0 HB1 ALA C 219 -0.717 14.576 9.586 1.00 61.53 H new ATOM 0 HB2 ALA C 219 -0.480 15.910 8.432 1.00 61.53 H new ATOM 0 HB3 ALA C 219 -1.818 14.760 8.200 1.00 61.53 H new ATOM 2014 N ARG C 220 0.732 11.797 8.476 1.00 43.43 N ATOM 2015 CA ARG C 220 0.602 10.363 8.703 1.00 11.22 C ATOM 2016 C ARG C 220 -0.472 10.112 9.753 1.00 33.41 C ATOM 2017 O ARG C 220 -1.085 9.064 9.804 1.00 71.24 O ATOM 2018 CB ARG C 220 1.893 9.810 9.221 1.00 52.40 C ATOM 2019 CG ARG C 220 2.001 8.294 9.205 1.00 33.43 C ATOM 2020 CD ARG C 220 3.101 7.899 10.108 1.00 53.31 C ATOM 2021 NE ARG C 220 3.750 6.623 9.752 1.00 60.33 N ATOM 2022 CZ ARG C 220 5.091 6.395 9.872 1.00 23.34 C ATOM 2023 NH1 ARG C 220 5.895 7.328 10.386 1.00 32.44 N ATOM 2024 NH2 ARG C 220 5.615 5.245 9.475 1.00 10.23 N ATOM 0 H ARG C 220 1.611 12.189 8.814 1.00 43.43 H new ATOM 0 HA ARG C 220 0.338 9.882 7.761 1.00 11.22 H new ATOM 0 HB2 ARG C 220 2.710 10.223 8.629 1.00 52.40 H new ATOM 0 HB3 ARG C 220 2.034 10.157 10.244 1.00 52.40 H new ATOM 0 HG2 ARG C 220 1.063 7.843 9.529 1.00 33.43 H new ATOM 0 HG3 ARG C 220 2.194 7.937 8.193 1.00 33.43 H new ATOM 0 HD2 ARG C 220 3.854 8.687 10.111 1.00 53.31 H new ATOM 0 HD3 ARG C 220 2.713 7.825 11.124 1.00 53.31 H new ATOM 0 HE ARG C 220 3.164 5.868 9.396 1.00 60.33 H new ATOM 0 HH11 ARG C 220 5.509 8.221 10.693 1.00 32.44 H new ATOM 0 HH12 ARG C 220 6.895 7.148 10.472 1.00 32.44 H new ATOM 0 HH21 ARG C 220 5.016 4.522 9.076 1.00 10.23 H new ATOM 0 HH22 ARG C 220 6.618 5.082 9.568 1.00 10.23 H new ATOM 2038 N ALA C 221 -0.675 11.087 10.596 1.00 3.11 N ATOM 2039 CA ALA C 221 -1.683 11.009 11.621 1.00 43.25 C ATOM 2040 C ALA C 221 -3.064 11.221 11.015 1.00 24.12 C ATOM 2041 O ALA C 221 -4.086 11.012 11.673 1.00 64.34 O ATOM 2042 CB ALA C 221 -1.408 12.023 12.709 1.00 5.42 C ATOM 0 H ALA C 221 -0.146 11.959 10.593 1.00 3.11 H new ATOM 0 HA ALA C 221 -1.654 10.016 12.070 1.00 43.25 H new ATOM 0 HB1 ALA C 221 -2.179 11.951 13.476 1.00 5.42 H new ATOM 0 HB2 ALA C 221 -0.433 11.824 13.154 1.00 5.42 H new ATOM 0 HB3 ALA C 221 -1.414 13.026 12.282 1.00 5.42 H new ATOM 2048 N ASN C 222 -3.089 11.650 9.760 1.00 40.33 N ATOM 2049 CA ASN C 222 -4.331 11.889 9.063 1.00 50.25 C ATOM 2050 C ASN C 222 -4.608 10.751 8.069 1.00 30.50 C ATOM 2051 O ASN C 222 -5.586 10.787 7.335 1.00 44.52 O ATOM 2052 CB ASN C 222 -4.309 13.261 8.333 1.00 53.43 C ATOM 2053 CG ASN C 222 -5.674 13.663 7.746 1.00 40.34 C ATOM 2054 OD1 ASN C 222 -6.726 13.279 8.261 1.00 53.25 O ATOM 2055 ND2 ASN C 222 -5.665 14.446 6.688 1.00 62.22 N ATOM 0 H ASN C 222 -2.253 11.839 9.207 1.00 40.33 H new ATOM 0 HA ASN C 222 -5.135 11.916 9.798 1.00 50.25 H new ATOM 0 HB2 ASN C 222 -3.981 14.031 9.032 1.00 53.43 H new ATOM 0 HB3 ASN C 222 -3.573 13.225 7.530 1.00 53.43 H new ATOM 0 HD21 ASN C 222 -6.545 14.751 6.272 1.00 62.22 H new ATOM 0 HD22 ASN C 222 -4.778 14.747 6.284 1.00 62.22 H new ATOM 2062 N VAL C 223 -3.761 9.730 8.039 1.00 51.54 N ATOM 2063 CA VAL C 223 -4.040 8.610 7.145 1.00 73.42 C ATOM 2064 C VAL C 223 -4.517 7.381 7.933 1.00 32.15 C ATOM 2065 O VAL C 223 -4.121 7.185 9.051 1.00 34.32 O ATOM 2066 CB VAL C 223 -2.826 8.281 6.206 1.00 14.51 C ATOM 2067 CG1 VAL C 223 -1.570 8.219 6.988 1.00 23.32 C ATOM 2068 CG2 VAL C 223 -3.015 6.965 5.495 1.00 61.20 C ATOM 0 H VAL C 223 -2.910 9.651 8.596 1.00 51.54 H new ATOM 0 HA VAL C 223 -4.855 8.913 6.488 1.00 73.42 H new ATOM 0 HB VAL C 223 -2.769 9.079 5.465 1.00 14.51 H new ATOM 0 HG11 VAL C 223 -0.738 7.990 6.322 1.00 23.32 H new ATOM 0 HG12 VAL C 223 -1.394 9.180 7.471 1.00 23.32 H new ATOM 0 HG13 VAL C 223 -1.652 7.441 7.747 1.00 23.32 H new ATOM 0 HG21 VAL C 223 -2.155 6.771 4.854 1.00 61.20 H new ATOM 0 HG22 VAL C 223 -3.108 6.165 6.229 1.00 61.20 H new ATOM 0 HG23 VAL C 223 -3.919 7.007 4.887 1.00 61.20 H new ATOM 2078 N LYS C 224 -5.437 6.608 7.355 1.00 22.34 N ATOM 2079 CA LYS C 224 -5.906 5.373 7.990 1.00 75.13 C ATOM 2080 C LYS C 224 -5.049 4.179 7.569 1.00 13.41 C ATOM 2081 O LYS C 224 -4.799 3.280 8.351 1.00 62.42 O ATOM 2082 CB LYS C 224 -7.376 5.084 7.636 1.00 72.40 C ATOM 2083 CG LYS C 224 -8.348 6.162 8.078 1.00 61.31 C ATOM 2084 CD LYS C 224 -9.803 5.790 7.800 1.00 31.40 C ATOM 2085 CE LYS C 224 -10.080 5.583 6.320 1.00 43.21 C ATOM 2086 NZ LYS C 224 -11.480 5.182 6.083 1.00 23.32 N ATOM 0 H LYS C 224 -5.871 6.812 6.455 1.00 22.34 H new ATOM 0 HA LYS C 224 -5.821 5.518 9.067 1.00 75.13 H new ATOM 0 HB2 LYS C 224 -7.459 4.956 6.557 1.00 72.40 H new ATOM 0 HB3 LYS C 224 -7.668 4.138 8.092 1.00 72.40 H new ATOM 0 HG2 LYS C 224 -8.221 6.345 9.145 1.00 61.31 H new ATOM 0 HG3 LYS C 224 -8.110 7.093 7.564 1.00 61.31 H new ATOM 0 HD2 LYS C 224 -10.051 4.878 8.343 1.00 31.40 H new ATOM 0 HD3 LYS C 224 -10.455 6.576 8.181 1.00 31.40 H new ATOM 0 HE2 LYS C 224 -9.867 6.504 5.777 1.00 43.21 H new ATOM 0 HE3 LYS C 224 -9.410 4.819 5.927 1.00 43.21 H new ATOM 0 HZ1 LYS C 224 -11.635 5.049 5.063 1.00 23.32 H new ATOM 0 HZ2 LYS C 224 -11.675 4.291 6.582 1.00 23.32 H new ATOM 0 HZ3 LYS C 224 -12.118 5.923 6.436 1.00 23.32 H new ATOM 2100 N HIS C 225 -4.616 4.188 6.311 1.00 4.44 N ATOM 2101 CA HIS C 225 -3.842 3.081 5.712 1.00 4.42 C ATOM 2102 C HIS C 225 -3.385 3.426 4.311 1.00 24.22 C ATOM 2103 O HIS C 225 -3.910 4.378 3.702 1.00 4.23 O ATOM 2104 CB HIS C 225 -4.647 1.761 5.680 1.00 33.33 C ATOM 2105 CG HIS C 225 -6.032 1.866 5.096 1.00 73.22 C ATOM 2106 ND1 HIS C 225 -6.370 2.714 4.057 1.00 13.22 N ATOM 2107 CD2 HIS C 225 -7.175 1.263 5.460 1.00 2.13 C ATOM 2108 CE1 HIS C 225 -7.663 2.623 3.827 1.00 3.54 C ATOM 2109 NE2 HIS C 225 -8.172 1.751 4.662 1.00 35.12 N ATOM 0 H HIS C 225 -4.788 4.961 5.668 1.00 4.44 H new ATOM 0 HA HIS C 225 -2.969 2.936 6.348 1.00 4.42 H new ATOM 0 HB2 HIS C 225 -4.084 1.025 5.107 1.00 33.33 H new ATOM 0 HB3 HIS C 225 -4.728 1.379 6.698 1.00 33.33 H new ATOM 0 HD2 HIS C 225 -7.287 0.526 6.242 1.00 2.13 H new ATOM 0 HE1 HIS C 225 -8.211 3.174 3.077 1.00 3.54 H new ATOM 0 HE2 HIS C 225 -9.154 1.480 4.709 1.00 35.12 H new ATOM 2118 N LEU C 226 -2.512 2.599 3.767 1.00 23.34 N ATOM 2119 CA LEU C 226 -1.913 2.840 2.453 1.00 11.14 C ATOM 2120 C LEU C 226 -2.336 1.764 1.480 1.00 10.42 C ATOM 2121 O LEU C 226 -2.508 0.628 1.863 1.00 5.02 O ATOM 2122 CB LEU C 226 -0.368 2.788 2.550 1.00 21.22 C ATOM 2123 CG LEU C 226 0.321 3.825 3.426 1.00 42.44 C ATOM 2124 CD1 LEU C 226 1.833 3.612 3.410 1.00 3.30 C ATOM 2125 CD2 LEU C 226 -0.026 5.227 2.983 1.00 73.20 C ATOM 0 H LEU C 226 -2.194 1.741 4.217 1.00 23.34 H new ATOM 0 HA LEU C 226 -2.245 3.821 2.112 1.00 11.14 H new ATOM 0 HB2 LEU C 226 -0.088 1.800 2.916 1.00 21.22 H new ATOM 0 HB3 LEU C 226 0.035 2.880 1.541 1.00 21.22 H new ATOM 0 HG LEU C 226 -0.037 3.700 4.448 1.00 42.44 H new ATOM 0 HD11 LEU C 226 2.313 4.361 4.041 1.00 3.30 H new ATOM 0 HD12 LEU C 226 2.064 2.616 3.789 1.00 3.30 H new ATOM 0 HD13 LEU C 226 2.203 3.707 2.389 1.00 3.30 H new ATOM 0 HD21 LEU C 226 0.480 5.947 3.626 1.00 73.20 H new ATOM 0 HD22 LEU C 226 0.295 5.373 1.952 1.00 73.20 H new ATOM 0 HD23 LEU C 226 -1.104 5.374 3.051 1.00 73.20 H new ATOM 2137 N LYS C 227 -2.540 2.139 0.246 1.00 73.24 N ATOM 2138 CA LYS C 227 -2.806 1.203 -0.805 1.00 64.40 C ATOM 2139 C LYS C 227 -1.730 1.342 -1.840 1.00 75.32 C ATOM 2140 O LYS C 227 -1.556 2.420 -2.414 1.00 44.52 O ATOM 2141 CB LYS C 227 -4.173 1.409 -1.416 1.00 54.51 C ATOM 2142 CG LYS C 227 -4.491 0.341 -2.441 1.00 34.31 C ATOM 2143 CD LYS C 227 -5.945 0.258 -2.787 1.00 31.24 C ATOM 2144 CE LYS C 227 -6.459 1.419 -3.590 1.00 71.32 C ATOM 2145 NZ LYS C 227 -6.492 2.707 -2.877 1.00 51.04 N ATOM 0 H LYS C 227 -2.525 3.113 -0.058 1.00 73.24 H new ATOM 0 HA LYS C 227 -2.805 0.194 -0.393 1.00 64.40 H new ATOM 0 HB2 LYS C 227 -4.929 1.397 -0.631 1.00 54.51 H new ATOM 0 HB3 LYS C 227 -4.218 2.391 -1.887 1.00 54.51 H new ATOM 0 HG2 LYS C 227 -3.921 0.539 -3.349 1.00 34.31 H new ATOM 0 HG3 LYS C 227 -4.161 -0.626 -2.061 1.00 34.31 H new ATOM 0 HD2 LYS C 227 -6.121 -0.661 -3.346 1.00 31.24 H new ATOM 0 HD3 LYS C 227 -6.522 0.186 -1.865 1.00 31.24 H new ATOM 0 HE2 LYS C 227 -5.838 1.529 -4.479 1.00 71.32 H new ATOM 0 HE3 LYS C 227 -7.467 1.185 -3.933 1.00 71.32 H new ATOM 0 HZ1 LYS C 227 -7.399 3.182 -3.060 1.00 51.04 H new ATOM 0 HZ2 LYS C 227 -6.388 2.541 -1.856 1.00 51.04 H new ATOM 0 HZ3 LYS C 227 -5.713 3.309 -3.211 1.00 51.04 H new ATOM 2159 N ILE C 228 -0.998 0.288 -2.067 1.00 1.01 N ATOM 2160 CA ILE C 228 0.132 0.343 -2.953 1.00 42.04 C ATOM 2161 C ILE C 228 -0.191 -0.371 -4.240 1.00 11.42 C ATOM 2162 O ILE C 228 -0.803 -1.462 -4.219 1.00 3.41 O ATOM 2163 CB ILE C 228 1.375 -0.334 -2.334 1.00 71.22 C ATOM 2164 CG1 ILE C 228 1.644 0.179 -0.923 1.00 63.40 C ATOM 2165 CG2 ILE C 228 2.594 -0.086 -3.211 1.00 52.24 C ATOM 2166 CD1 ILE C 228 2.887 -0.413 -0.305 1.00 31.51 C ATOM 0 H ILE C 228 -1.165 -0.627 -1.648 1.00 1.01 H new ATOM 0 HA ILE C 228 0.349 1.396 -3.134 1.00 42.04 H new ATOM 0 HB ILE C 228 1.178 -1.404 -2.275 1.00 71.22 H new ATOM 0 HG12 ILE C 228 1.740 1.264 -0.950 1.00 63.40 H new ATOM 0 HG13 ILE C 228 0.787 -0.050 -0.290 1.00 63.40 H new ATOM 0 HG21 ILE C 228 3.466 -0.567 -2.767 1.00 52.24 H new ATOM 0 HG22 ILE C 228 2.418 -0.500 -4.204 1.00 52.24 H new ATOM 0 HG23 ILE C 228 2.773 0.986 -3.291 1.00 52.24 H new ATOM 0 HD11 ILE C 228 3.023 -0.008 0.698 1.00 31.51 H new ATOM 0 HD12 ILE C 228 2.784 -1.497 -0.248 1.00 31.51 H new ATOM 0 HD13 ILE C 228 3.753 -0.162 -0.918 1.00 31.51 H new ATOM 2178 N LEU C 229 0.181 0.229 -5.345 1.00 25.12 N ATOM 2179 CA LEU C 229 0.017 -0.389 -6.617 1.00 24.33 C ATOM 2180 C LEU C 229 1.160 0.024 -7.531 1.00 32.31 C ATOM 2181 O LEU C 229 1.309 1.206 -7.874 1.00 54.20 O ATOM 2182 CB LEU C 229 -1.395 -0.077 -7.229 1.00 22.21 C ATOM 2183 CG LEU C 229 -1.807 -0.839 -8.529 1.00 13.52 C ATOM 2184 CD1 LEU C 229 -3.289 -0.708 -8.752 1.00 35.02 C ATOM 2185 CD2 LEU C 229 -1.112 -0.273 -9.746 1.00 52.50 C ATOM 0 H LEU C 229 0.604 1.157 -5.377 1.00 25.12 H new ATOM 0 HA LEU C 229 0.056 -1.472 -6.500 1.00 24.33 H new ATOM 0 HB2 LEU C 229 -2.145 -0.286 -6.466 1.00 22.21 H new ATOM 0 HB3 LEU C 229 -1.441 0.992 -7.438 1.00 22.21 H new ATOM 0 HG LEU C 229 -1.520 -1.882 -8.396 1.00 13.52 H new ATOM 0 HD11 LEU C 229 -3.569 -1.242 -9.660 1.00 35.02 H new ATOM 0 HD12 LEU C 229 -3.824 -1.132 -7.902 1.00 35.02 H new ATOM 0 HD13 LEU C 229 -3.550 0.345 -8.855 1.00 35.02 H new ATOM 0 HD21 LEU C 229 -1.422 -0.827 -10.632 1.00 52.50 H new ATOM 0 HD22 LEU C 229 -1.380 0.777 -9.862 1.00 52.50 H new ATOM 0 HD23 LEU C 229 -0.033 -0.361 -9.622 1.00 52.50 H new ATOM 2197 N ASN C 230 1.977 -0.937 -7.910 1.00 51.22 N ATOM 2198 CA ASN C 230 3.042 -0.684 -8.854 1.00 12.13 C ATOM 2199 C ASN C 230 2.383 -0.741 -10.203 1.00 3.31 C ATOM 2200 O ASN C 230 1.946 -1.792 -10.657 1.00 73.10 O ATOM 2201 CB ASN C 230 4.152 -1.756 -8.748 1.00 51.52 C ATOM 2202 CG ASN C 230 5.444 -1.431 -9.543 1.00 74.41 C ATOM 2203 OD1 ASN C 230 5.344 -0.689 -10.626 1.00 22.21 O flip ATOM 2204 ND2 ASN C 230 6.535 -1.861 -9.163 1.00 22.32 N flip ATOM 0 H ASN C 230 1.923 -1.900 -7.578 1.00 51.22 H new ATOM 0 HA ASN C 230 3.526 0.275 -8.668 1.00 12.13 H new ATOM 0 HB2 ASN C 230 4.411 -1.888 -7.698 1.00 51.52 H new ATOM 0 HB3 ASN C 230 3.754 -2.708 -9.101 1.00 51.52 H new ATOM 0 HD21 ASN C 230 6.592 -2.434 -8.321 1.00 22.32 H new ATOM 0 HD22 ASN C 230 7.381 -1.643 -9.690 1.00 22.32 H new ATOM 2211 N THR C 231 2.274 0.396 -10.798 1.00 45.15 N ATOM 2212 CA THR C 231 1.513 0.578 -11.995 1.00 24.11 C ATOM 2213 C THR C 231 2.384 0.245 -13.225 1.00 41.54 C ATOM 2214 O THR C 231 3.566 0.517 -13.217 1.00 34.11 O ATOM 2215 CB THR C 231 1.094 2.045 -12.007 1.00 53.42 C ATOM 2216 OG1 THR C 231 0.872 2.435 -10.644 1.00 33.21 O ATOM 2217 CG2 THR C 231 -0.214 2.233 -12.744 1.00 14.14 C ATOM 0 H THR C 231 2.721 1.249 -10.461 1.00 45.15 H new ATOM 0 HA THR C 231 0.643 -0.077 -12.029 1.00 24.11 H new ATOM 0 HB THR C 231 1.869 2.634 -12.497 1.00 53.42 H new ATOM 0 HG1 THR C 231 -0.090 2.439 -10.458 1.00 33.21 H new ATOM 0 HG21 THR C 231 -0.488 3.288 -12.736 1.00 14.14 H new ATOM 0 HG22 THR C 231 -0.103 1.894 -13.774 1.00 14.14 H new ATOM 0 HG23 THR C 231 -0.995 1.652 -12.253 1.00 14.14 H new ATOM 2225 N PRO C 232 1.808 -0.346 -14.295 1.00 15.52 N ATOM 2226 CA PRO C 232 2.569 -0.746 -15.516 1.00 75.25 C ATOM 2227 C PRO C 232 3.282 0.413 -16.281 1.00 53.41 C ATOM 2228 O PRO C 232 3.895 0.177 -17.325 1.00 11.00 O ATOM 2229 CB PRO C 232 1.491 -1.389 -16.412 1.00 72.33 C ATOM 2230 CG PRO C 232 0.198 -0.862 -15.891 1.00 35.13 C ATOM 2231 CD PRO C 232 0.385 -0.726 -14.413 1.00 72.33 C ATOM 0 HA PRO C 232 3.396 -1.399 -15.237 1.00 75.25 H new ATOM 0 HB2 PRO C 232 1.635 -1.120 -17.458 1.00 72.33 H new ATOM 0 HB3 PRO C 232 1.527 -2.477 -16.355 1.00 72.33 H new ATOM 0 HG2 PRO C 232 -0.045 0.098 -16.345 1.00 35.13 H new ATOM 0 HG3 PRO C 232 -0.623 -1.541 -16.121 1.00 35.13 H new ATOM 0 HD2 PRO C 232 -0.273 0.034 -13.991 1.00 72.33 H new ATOM 0 HD3 PRO C 232 0.171 -1.659 -13.891 1.00 72.33 H new ATOM 2239 N ASN C 233 3.202 1.635 -15.775 1.00 24.43 N ATOM 2240 CA ASN C 233 3.854 2.778 -16.438 1.00 43.44 C ATOM 2241 C ASN C 233 4.659 3.630 -15.436 1.00 51.34 C ATOM 2242 O ASN C 233 5.455 4.482 -15.819 1.00 54.43 O ATOM 2243 CB ASN C 233 2.801 3.636 -17.175 1.00 41.43 C ATOM 2244 CG ASN C 233 3.391 4.800 -17.980 1.00 22.32 C ATOM 2245 OD1 ASN C 233 3.775 4.631 -19.132 1.00 74.51 O ATOM 2246 ND2 ASN C 233 3.436 5.978 -17.400 1.00 14.34 N ATOM 0 H ASN C 233 2.701 1.869 -14.918 1.00 24.43 H new ATOM 0 HA ASN C 233 4.561 2.388 -17.170 1.00 43.44 H new ATOM 0 HB2 ASN C 233 2.233 2.994 -17.848 1.00 41.43 H new ATOM 0 HB3 ASN C 233 2.097 4.034 -16.444 1.00 41.43 H new ATOM 0 HD21 ASN C 233 3.798 6.784 -17.910 1.00 14.34 H new ATOM 0 HD22 ASN C 233 3.109 6.087 -16.440 1.00 14.34 H new ATOM 2253 N CYS C 234 4.482 3.354 -14.170 1.00 10.32 N ATOM 2254 CA CYS C 234 5.109 4.124 -13.097 1.00 71.33 C ATOM 2255 C CYS C 234 5.664 3.230 -12.025 1.00 71.12 C ATOM 2256 O CYS C 234 5.306 2.060 -11.946 1.00 43.55 O ATOM 2257 CB CYS C 234 4.144 5.173 -12.498 1.00 24.14 C ATOM 2258 SG CYS C 234 4.030 6.745 -13.433 1.00 5.43 S ATOM 0 H CYS C 234 3.897 2.586 -13.840 1.00 10.32 H new ATOM 0 HA CYS C 234 5.943 4.665 -13.545 1.00 71.33 H new ATOM 0 HB2 CYS C 234 3.149 4.733 -12.433 1.00 24.14 H new ATOM 0 HB3 CYS C 234 4.461 5.396 -11.479 1.00 24.14 H new ATOM 2263 N ALA C 235 6.563 3.769 -11.218 1.00 71.12 N ATOM 2264 CA ALA C 235 7.155 3.036 -10.117 1.00 44.34 C ATOM 2265 C ALA C 235 6.091 2.680 -9.072 1.00 32.22 C ATOM 2266 O ALA C 235 4.900 3.034 -9.224 1.00 60.10 O ATOM 2267 CB ALA C 235 8.270 3.868 -9.468 1.00 23.55 C ATOM 0 H ALA C 235 6.901 4.727 -11.310 1.00 71.12 H new ATOM 0 HA ALA C 235 7.581 2.112 -10.507 1.00 44.34 H new ATOM 0 HB1 ALA C 235 8.708 3.308 -8.642 1.00 23.55 H new ATOM 0 HB2 ALA C 235 9.040 4.085 -10.208 1.00 23.55 H new ATOM 0 HB3 ALA C 235 7.855 4.803 -9.092 1.00 23.55 H new ATOM 2273 N CYS C 236 6.519 1.980 -8.041 1.00 14.12 N ATOM 2274 CA CYS C 236 5.670 1.600 -6.925 1.00 31.54 C ATOM 2275 C CYS C 236 5.033 2.870 -6.381 1.00 31.52 C ATOM 2276 O CYS C 236 5.731 3.751 -5.934 1.00 63.25 O ATOM 2277 CB CYS C 236 6.552 0.949 -5.854 1.00 14.33 C ATOM 2278 SG CYS C 236 5.677 0.261 -4.431 1.00 34.33 S ATOM 0 H CYS C 236 7.481 1.653 -7.952 1.00 14.12 H new ATOM 0 HA CYS C 236 4.894 0.897 -7.227 1.00 31.54 H new ATOM 0 HB2 CYS C 236 7.131 0.152 -6.321 1.00 14.33 H new ATOM 0 HB3 CYS C 236 7.264 1.692 -5.495 1.00 14.33 H new ATOM 2283 N GLN C 237 3.727 2.980 -6.476 1.00 24.02 N ATOM 2284 CA GLN C 237 3.062 4.204 -6.114 1.00 45.44 C ATOM 2285 C GLN C 237 2.124 3.908 -4.960 1.00 21.44 C ATOM 2286 O GLN C 237 1.546 2.809 -4.895 1.00 64.14 O ATOM 2287 CB GLN C 237 2.262 4.699 -7.305 1.00 12.14 C ATOM 2288 CG GLN C 237 2.160 6.216 -7.424 1.00 5.03 C ATOM 2289 CD GLN C 237 3.490 6.870 -7.812 1.00 63.24 C ATOM 2290 OE1 GLN C 237 4.314 6.153 -8.562 1.00 51.54 O flip ATOM 2291 NE2 GLN C 237 3.765 8.012 -7.451 1.00 73.04 N flip ATOM 0 H GLN C 237 3.108 2.237 -6.800 1.00 24.02 H new ATOM 0 HA GLN C 237 3.786 4.965 -5.823 1.00 45.44 H new ATOM 0 HB2 GLN C 237 2.714 4.307 -8.216 1.00 12.14 H new ATOM 0 HB3 GLN C 237 1.255 4.285 -7.245 1.00 12.14 H new ATOM 0 HG2 GLN C 237 1.405 6.468 -8.169 1.00 5.03 H new ATOM 0 HG3 GLN C 237 1.820 6.629 -6.474 1.00 5.03 H new ATOM 0 HE21 GLN C 237 3.108 8.537 -6.874 1.00 73.04 H new ATOM 0 HE22 GLN C 237 4.650 8.435 -7.729 1.00 73.04 H new ATOM 2300 N ILE C 238 1.962 4.855 -4.060 1.00 1.42 N ATOM 2301 CA ILE C 238 1.155 4.633 -2.882 1.00 1.03 C ATOM 2302 C ILE C 238 0.063 5.698 -2.745 1.00 14.44 C ATOM 2303 O ILE C 238 0.317 6.878 -2.920 1.00 62.41 O ATOM 2304 CB ILE C 238 2.042 4.628 -1.607 1.00 13.20 C ATOM 2305 CG1 ILE C 238 3.138 3.555 -1.731 1.00 44.42 C ATOM 2306 CG2 ILE C 238 1.197 4.389 -0.367 1.00 64.23 C ATOM 2307 CD1 ILE C 238 4.053 3.451 -0.535 1.00 2.51 C ATOM 0 H ILE C 238 2.378 5.784 -4.123 1.00 1.42 H new ATOM 0 HA ILE C 238 0.676 3.660 -2.991 1.00 1.03 H new ATOM 0 HB ILE C 238 2.518 5.604 -1.509 1.00 13.20 H new ATOM 0 HG12 ILE C 238 2.664 2.587 -1.895 1.00 44.42 H new ATOM 0 HG13 ILE C 238 3.739 3.769 -2.615 1.00 44.42 H new ATOM 0 HG21 ILE C 238 1.837 4.389 0.515 1.00 64.23 H new ATOM 0 HG22 ILE C 238 0.453 5.180 -0.276 1.00 64.23 H new ATOM 0 HG23 ILE C 238 0.694 3.426 -0.450 1.00 64.23 H new ATOM 0 HD11 ILE C 238 4.793 2.670 -0.710 1.00 2.51 H new ATOM 0 HD12 ILE C 238 4.560 4.404 -0.381 1.00 2.51 H new ATOM 0 HD13 ILE C 238 3.468 3.204 0.351 1.00 2.51 H new ATOM 2319 N VAL C 239 -1.137 5.265 -2.444 1.00 43.11 N ATOM 2320 CA VAL C 239 -2.248 6.167 -2.206 1.00 13.12 C ATOM 2321 C VAL C 239 -2.771 5.957 -0.769 1.00 65.33 C ATOM 2322 O VAL C 239 -2.815 4.820 -0.275 1.00 61.44 O ATOM 2323 CB VAL C 239 -3.380 5.971 -3.269 1.00 12.34 C ATOM 2324 CG1 VAL C 239 -3.898 4.558 -3.256 1.00 34.41 C ATOM 2325 CG2 VAL C 239 -4.520 6.964 -3.077 1.00 40.35 C ATOM 0 H VAL C 239 -1.376 4.277 -2.356 1.00 43.11 H new ATOM 0 HA VAL C 239 -1.903 7.196 -2.308 1.00 13.12 H new ATOM 0 HB VAL C 239 -2.937 6.166 -4.246 1.00 12.34 H new ATOM 0 HG11 VAL C 239 -4.683 4.451 -4.004 1.00 34.41 H new ATOM 0 HG12 VAL C 239 -3.084 3.870 -3.484 1.00 34.41 H new ATOM 0 HG13 VAL C 239 -4.303 4.328 -2.270 1.00 34.41 H new ATOM 0 HG21 VAL C 239 -5.284 6.793 -3.836 1.00 40.35 H new ATOM 0 HG22 VAL C 239 -4.956 6.831 -2.087 1.00 40.35 H new ATOM 0 HG23 VAL C 239 -4.137 7.980 -3.171 1.00 40.35 H new ATOM 2335 N ALA C 240 -3.149 7.027 -0.106 1.00 10.33 N ATOM 2336 CA ALA C 240 -3.556 6.969 1.284 1.00 63.13 C ATOM 2337 C ALA C 240 -4.968 7.501 1.474 1.00 13.33 C ATOM 2338 O ALA C 240 -5.403 8.411 0.770 1.00 20.40 O ATOM 2339 CB ALA C 240 -2.589 7.769 2.135 1.00 32.05 C ATOM 0 H ALA C 240 -3.184 7.962 -0.513 1.00 10.33 H new ATOM 0 HA ALA C 240 -3.545 5.924 1.595 1.00 63.13 H new ATOM 0 HB1 ALA C 240 -2.899 7.723 3.179 1.00 32.05 H new ATOM 0 HB2 ALA C 240 -1.586 7.353 2.035 1.00 32.05 H new ATOM 0 HB3 ALA C 240 -2.586 8.807 1.803 1.00 32.05 H new ATOM 2345 N ARG C 241 -5.693 6.922 2.412 1.00 22.15 N ATOM 2346 CA ARG C 241 -7.026 7.407 2.710 1.00 33.31 C ATOM 2347 C ARG C 241 -7.060 8.196 4.002 1.00 61.12 C ATOM 2348 O ARG C 241 -6.565 7.742 5.041 1.00 12.43 O ATOM 2349 CB ARG C 241 -8.109 6.324 2.654 1.00 32.02 C ATOM 2350 CG ARG C 241 -8.315 5.753 1.260 1.00 20.32 C ATOM 2351 CD ARG C 241 -9.567 4.903 1.179 1.00 52.31 C ATOM 2352 NE ARG C 241 -9.805 4.397 -0.177 1.00 34.54 N ATOM 2353 CZ ARG C 241 -11.017 4.310 -0.757 1.00 51.53 C ATOM 2354 NH1 ARG C 241 -12.104 4.697 -0.095 1.00 12.12 N ATOM 2355 NH2 ARG C 241 -11.128 3.836 -1.986 1.00 32.40 N ATOM 0 H ARG C 241 -5.387 6.127 2.973 1.00 22.15 H new ATOM 0 HA ARG C 241 -7.278 8.094 1.902 1.00 33.31 H new ATOM 0 HB2 ARG C 241 -7.841 5.516 3.334 1.00 32.02 H new ATOM 0 HB3 ARG C 241 -9.050 6.742 3.011 1.00 32.02 H new ATOM 0 HG2 ARG C 241 -8.382 6.568 0.540 1.00 20.32 H new ATOM 0 HG3 ARG C 241 -7.449 5.152 0.982 1.00 20.32 H new ATOM 0 HD2 ARG C 241 -9.479 4.063 1.868 1.00 52.31 H new ATOM 0 HD3 ARG C 241 -10.426 5.492 1.501 1.00 52.31 H new ATOM 0 HE ARG C 241 -8.997 4.090 -0.718 1.00 34.54 H new ATOM 0 HH11 ARG C 241 -12.021 5.061 0.854 1.00 12.12 H new ATOM 0 HH12 ARG C 241 -13.021 4.630 -0.537 1.00 12.12 H new ATOM 0 HH21 ARG C 241 -10.296 3.536 -2.494 1.00 32.40 H new ATOM 0 HH22 ARG C 241 -12.046 3.770 -2.426 1.00 32.40 H new ATOM 2369 N LEU C 242 -7.659 9.354 3.898 1.00 43.31 N ATOM 2370 CA LEU C 242 -7.726 10.384 4.928 1.00 34.15 C ATOM 2371 C LEU C 242 -8.666 10.036 6.085 1.00 5.10 C ATOM 2372 O LEU C 242 -9.677 9.344 5.904 1.00 0.32 O ATOM 2373 CB LEU C 242 -8.179 11.688 4.254 1.00 72.03 C ATOM 2374 CG LEU C 242 -7.242 12.239 3.189 1.00 4.11 C ATOM 2375 CD1 LEU C 242 -7.858 13.448 2.545 1.00 43.13 C ATOM 2376 CD2 LEU C 242 -5.894 12.595 3.795 1.00 75.34 C ATOM 0 H LEU C 242 -8.145 9.629 3.045 1.00 43.31 H new ATOM 0 HA LEU C 242 -6.736 10.481 5.374 1.00 34.15 H new ATOM 0 HB2 LEU C 242 -9.156 11.521 3.801 1.00 72.03 H new ATOM 0 HB3 LEU C 242 -8.310 12.447 5.025 1.00 72.03 H new ATOM 0 HG LEU C 242 -7.084 11.472 2.431 1.00 4.11 H new ATOM 0 HD11 LEU C 242 -7.183 13.838 1.783 1.00 43.13 H new ATOM 0 HD12 LEU C 242 -8.805 13.171 2.083 1.00 43.13 H new ATOM 0 HD13 LEU C 242 -8.033 14.213 3.301 1.00 43.13 H new ATOM 0 HD21 LEU C 242 -5.238 12.987 3.018 1.00 75.34 H new ATOM 0 HD22 LEU C 242 -6.031 13.350 4.569 1.00 75.34 H new ATOM 0 HD23 LEU C 242 -5.445 11.703 4.233 1.00 75.34 H new ATOM 2388 N LYS C 243 -8.306 10.517 7.266 1.00 31.11 N ATOM 2389 CA LYS C 243 -9.094 10.351 8.476 1.00 71.20 C ATOM 2390 C LYS C 243 -9.968 11.566 8.756 1.00 11.20 C ATOM 2391 O LYS C 243 -11.187 11.493 8.672 1.00 4.12 O ATOM 2392 CB LYS C 243 -8.175 10.180 9.683 1.00 44.44 C ATOM 2393 CG LYS C 243 -7.336 8.931 9.698 1.00 52.14 C ATOM 2394 CD LYS C 243 -6.326 8.977 10.827 1.00 2.21 C ATOM 2395 CE LYS C 243 -6.984 9.120 12.194 1.00 3.23 C ATOM 2396 NZ LYS C 243 -5.983 9.260 13.268 1.00 55.20 N ATOM 0 H LYS C 243 -7.444 11.042 7.412 1.00 31.11 H new ATOM 0 HA LYS C 243 -9.720 9.472 8.320 1.00 71.20 H new ATOM 0 HB2 LYS C 243 -7.510 11.042 9.734 1.00 44.44 H new ATOM 0 HB3 LYS C 243 -8.786 10.195 10.586 1.00 44.44 H new ATOM 0 HG2 LYS C 243 -7.978 8.057 9.813 1.00 52.14 H new ATOM 0 HG3 LYS C 243 -6.819 8.823 8.745 1.00 52.14 H new ATOM 0 HD2 LYS C 243 -5.725 8.068 10.810 1.00 2.21 H new ATOM 0 HD3 LYS C 243 -5.644 9.812 10.666 1.00 2.21 H new ATOM 0 HE2 LYS C 243 -7.641 9.990 12.193 1.00 3.23 H new ATOM 0 HE3 LYS C 243 -7.609 8.249 12.390 1.00 3.23 H new ATOM 0 HZ1 LYS C 243 -6.467 9.355 14.184 1.00 55.20 H new ATOM 0 HZ2 LYS C 243 -5.372 8.419 13.285 1.00 55.20 H new ATOM 0 HZ3 LYS C 243 -5.403 10.105 13.094 1.00 55.20 H new ATOM 2410 N ASN C 244 -9.311 12.683 9.069 1.00 74.13 N ATOM 2411 CA ASN C 244 -9.971 13.890 9.574 1.00 12.22 C ATOM 2412 C ASN C 244 -10.934 14.501 8.581 1.00 32.22 C ATOM 2413 O ASN C 244 -12.139 14.511 8.807 1.00 55.33 O ATOM 2414 CB ASN C 244 -8.933 14.936 10.011 1.00 73.23 C ATOM 2415 CG ASN C 244 -9.554 16.199 10.617 1.00 52.55 C ATOM 2416 OD1 ASN C 244 -9.024 17.298 10.460 1.00 30.04 O ATOM 2417 ND2 ASN C 244 -10.633 16.051 11.345 1.00 23.21 N ATOM 0 H ASN C 244 -8.299 12.778 8.979 1.00 74.13 H new ATOM 0 HA ASN C 244 -10.559 13.576 10.436 1.00 12.22 H new ATOM 0 HB2 ASN C 244 -8.260 14.486 10.741 1.00 73.23 H new ATOM 0 HB3 ASN C 244 -8.327 15.216 9.150 1.00 73.23 H new ATOM 0 HD21 ASN C 244 -11.056 16.860 11.800 1.00 23.21 H new ATOM 0 HD22 ASN C 244 -11.050 15.127 11.457 1.00 23.21 H new ATOM 2424 N ASN C 245 -10.414 15.009 7.503 1.00 72.44 N ATOM 2425 CA ASN C 245 -11.239 15.656 6.516 1.00 42.44 C ATOM 2426 C ASN C 245 -10.864 15.143 5.149 1.00 61.34 C ATOM 2427 O ASN C 245 -9.716 14.732 4.942 1.00 62.23 O ATOM 2428 CB ASN C 245 -11.054 17.186 6.586 1.00 14.43 C ATOM 2429 CG ASN C 245 -11.976 17.963 5.650 1.00 43.10 C ATOM 2430 OD1 ASN C 245 -13.104 17.538 5.362 1.00 43.10 O ATOM 2431 ND2 ASN C 245 -11.511 19.094 5.173 1.00 31.22 N ATOM 0 H ASN C 245 -9.419 14.990 7.281 1.00 72.44 H new ATOM 0 HA ASN C 245 -12.287 15.431 6.712 1.00 42.44 H new ATOM 0 HB2 ASN C 245 -11.229 17.517 7.610 1.00 14.43 H new ATOM 0 HB3 ASN C 245 -10.019 17.429 6.345 1.00 14.43 H new ATOM 0 HD21 ASN C 245 -12.084 19.655 4.543 1.00 31.22 H new ATOM 0 HD22 ASN C 245 -10.577 19.412 5.433 1.00 31.22 H new ATOM 2438 N ASN C 246 -11.824 15.157 4.241 1.00 1.02 N ATOM 2439 CA ASN C 246 -11.665 14.713 2.860 1.00 25.13 C ATOM 2440 C ASN C 246 -11.639 13.182 2.764 1.00 32.12 C ATOM 2441 O ASN C 246 -12.061 12.495 3.703 1.00 63.15 O ATOM 2442 CB ASN C 246 -10.485 15.404 2.135 1.00 65.11 C ATOM 2443 CG ASN C 246 -10.642 16.912 2.048 1.00 51.33 C ATOM 2444 OD1 ASN C 246 -11.761 17.434 2.016 1.00 23.25 O ATOM 2445 ND2 ASN C 246 -9.539 17.616 1.996 1.00 63.21 N ATOM 0 H ASN C 246 -12.767 15.487 4.447 1.00 1.02 H new ATOM 0 HA ASN C 246 -12.549 15.039 2.312 1.00 25.13 H new ATOM 0 HB2 ASN C 246 -9.558 15.171 2.658 1.00 65.11 H new ATOM 0 HB3 ASN C 246 -10.395 14.995 1.129 1.00 65.11 H new ATOM 0 HD21 ASN C 246 -9.586 18.633 1.926 1.00 63.21 H new ATOM 0 HD22 ASN C 246 -8.633 17.148 2.025 1.00 63.21 H new ATOM 2452 N ARG C 247 -11.158 12.640 1.655 1.00 22.54 N ATOM 2453 CA ARG C 247 -11.346 11.216 1.376 1.00 64.52 C ATOM 2454 C ARG C 247 -10.035 10.490 1.195 1.00 53.12 C ATOM 2455 O ARG C 247 -9.617 9.717 2.058 1.00 50.31 O ATOM 2456 CB ARG C 247 -12.233 10.969 0.115 1.00 3.42 C ATOM 2457 CG ARG C 247 -13.599 11.666 0.092 1.00 31.15 C ATOM 2458 CD ARG C 247 -13.464 13.169 -0.152 1.00 34.23 C ATOM 2459 NE ARG C 247 -12.917 13.468 -1.487 1.00 65.12 N ATOM 2460 CZ ARG C 247 -12.773 14.700 -1.998 1.00 63.05 C ATOM 2461 NH1 ARG C 247 -13.169 15.762 -1.311 1.00 55.03 N ATOM 2462 NH2 ARG C 247 -12.244 14.861 -3.199 1.00 72.40 N ATOM 0 H ARG C 247 -10.641 13.152 0.940 1.00 22.54 H new ATOM 0 HA ARG C 247 -11.857 10.818 2.253 1.00 64.52 H new ATOM 0 HB2 ARG C 247 -11.673 11.288 -0.764 1.00 3.42 H new ATOM 0 HB3 ARG C 247 -12.396 9.896 0.017 1.00 3.42 H new ATOM 0 HG2 ARG C 247 -14.219 11.225 -0.688 1.00 31.15 H new ATOM 0 HG3 ARG C 247 -14.110 11.496 1.040 1.00 31.15 H new ATOM 0 HD2 ARG C 247 -14.440 13.642 -0.047 1.00 34.23 H new ATOM 0 HD3 ARG C 247 -12.816 13.603 0.610 1.00 34.23 H new ATOM 0 HE ARG C 247 -12.626 12.680 -2.066 1.00 65.12 H new ATOM 0 HH11 ARG C 247 -13.586 15.646 -0.388 1.00 55.03 H new ATOM 0 HH12 ARG C 247 -13.056 16.696 -1.706 1.00 55.03 H new ATOM 0 HH21 ARG C 247 -11.945 14.048 -3.738 1.00 72.40 H new ATOM 0 HH22 ARG C 247 -12.135 15.798 -3.587 1.00 72.40 H new ATOM 2476 N GLN C 248 -9.412 10.701 0.067 1.00 15.34 N ATOM 2477 CA GLN C 248 -8.164 10.056 -0.255 1.00 41.53 C ATOM 2478 C GLN C 248 -7.189 11.021 -0.912 1.00 23.21 C ATOM 2479 O GLN C 248 -7.595 11.986 -1.547 1.00 54.40 O ATOM 2480 CB GLN C 248 -8.399 8.813 -1.126 1.00 2.34 C ATOM 2481 CG GLN C 248 -9.140 9.074 -2.429 1.00 45.01 C ATOM 2482 CD GLN C 248 -9.368 7.801 -3.216 1.00 13.43 C ATOM 2483 OE1 GLN C 248 -10.379 7.121 -3.042 1.00 23.04 O ATOM 2484 NE2 GLN C 248 -8.443 7.469 -4.081 1.00 72.04 N ATOM 0 H GLN C 248 -9.756 11.328 -0.660 1.00 15.34 H new ATOM 0 HA GLN C 248 -7.709 9.728 0.679 1.00 41.53 H new ATOM 0 HB2 GLN C 248 -7.434 8.362 -1.358 1.00 2.34 H new ATOM 0 HB3 GLN C 248 -8.961 8.082 -0.545 1.00 2.34 H new ATOM 0 HG2 GLN C 248 -10.100 9.543 -2.213 1.00 45.01 H new ATOM 0 HG3 GLN C 248 -8.570 9.778 -3.035 1.00 45.01 H new ATOM 0 HE21 GLN C 248 -7.619 8.058 -4.197 1.00 72.04 H new ATOM 0 HE22 GLN C 248 -8.547 6.621 -4.639 1.00 72.04 H new ATOM 2493 N VAL C 249 -5.927 10.754 -0.732 1.00 50.10 N ATOM 2494 CA VAL C 249 -4.840 11.525 -1.315 1.00 51.54 C ATOM 2495 C VAL C 249 -3.766 10.562 -1.761 1.00 52.43 C ATOM 2496 O VAL C 249 -3.696 9.444 -1.263 1.00 4.41 O ATOM 2497 CB VAL C 249 -4.222 12.584 -0.332 1.00 42.23 C ATOM 2498 CG1 VAL C 249 -5.207 13.695 -0.019 1.00 21.04 C ATOM 2499 CG2 VAL C 249 -3.734 11.932 0.959 1.00 74.15 C ATOM 0 H VAL C 249 -5.605 9.973 -0.160 1.00 50.10 H new ATOM 0 HA VAL C 249 -5.249 12.091 -2.152 1.00 51.54 H new ATOM 0 HB VAL C 249 -3.363 13.023 -0.839 1.00 42.23 H new ATOM 0 HG11 VAL C 249 -4.746 14.409 0.663 1.00 21.04 H new ATOM 0 HG12 VAL C 249 -5.487 14.204 -0.941 1.00 21.04 H new ATOM 0 HG13 VAL C 249 -6.097 13.272 0.446 1.00 21.04 H new ATOM 0 HG21 VAL C 249 -3.313 12.694 1.615 1.00 74.15 H new ATOM 0 HG22 VAL C 249 -4.571 11.445 1.459 1.00 74.15 H new ATOM 0 HG23 VAL C 249 -2.969 11.191 0.726 1.00 74.15 H new ATOM 2509 N CYS C 250 -2.948 10.957 -2.673 1.00 35.34 N ATOM 2510 CA CYS C 250 -1.912 10.071 -3.150 1.00 31.12 C ATOM 2511 C CYS C 250 -0.628 10.485 -2.509 1.00 74.41 C ATOM 2512 O CYS C 250 -0.476 11.634 -2.163 1.00 52.23 O ATOM 2513 CB CYS C 250 -1.800 10.137 -4.659 1.00 45.11 C ATOM 2514 SG CYS C 250 -0.510 9.059 -5.344 1.00 65.03 S ATOM 0 H CYS C 250 -2.965 11.879 -3.109 1.00 35.34 H new ATOM 0 HA CYS C 250 -2.151 9.040 -2.889 1.00 31.12 H new ATOM 0 HB2 CYS C 250 -2.760 9.864 -5.098 1.00 45.11 H new ATOM 0 HB3 CYS C 250 -1.596 11.166 -4.954 1.00 45.11 H new ATOM 2519 N ILE C 251 0.285 9.568 -2.325 1.00 30.23 N ATOM 2520 CA ILE C 251 1.476 9.861 -1.573 1.00 14.31 C ATOM 2521 C ILE C 251 2.702 9.602 -2.413 1.00 71.21 C ATOM 2522 O ILE C 251 2.695 8.723 -3.280 1.00 15.25 O ATOM 2523 CB ILE C 251 1.568 8.945 -0.307 1.00 62.32 C ATOM 2524 CG1 ILE C 251 0.271 8.948 0.488 1.00 73.31 C ATOM 2525 CG2 ILE C 251 2.705 9.375 0.596 1.00 70.24 C ATOM 2526 CD1 ILE C 251 -0.215 10.324 0.867 1.00 13.45 C ATOM 0 H ILE C 251 0.227 8.615 -2.684 1.00 30.23 H new ATOM 0 HA ILE C 251 1.428 10.909 -1.278 1.00 14.31 H new ATOM 0 HB ILE C 251 1.754 7.933 -0.667 1.00 62.32 H new ATOM 0 HG12 ILE C 251 -0.502 8.449 -0.097 1.00 73.31 H new ATOM 0 HG13 ILE C 251 0.412 8.361 1.396 1.00 73.31 H new ATOM 0 HG21 ILE C 251 2.745 8.721 1.467 1.00 70.24 H new ATOM 0 HG22 ILE C 251 3.647 9.311 0.051 1.00 70.24 H new ATOM 0 HG23 ILE C 251 2.543 10.403 0.921 1.00 70.24 H new ATOM 0 HD11 ILE C 251 -1.144 10.239 1.431 1.00 13.45 H new ATOM 0 HD12 ILE C 251 0.538 10.820 1.480 1.00 13.45 H new ATOM 0 HD13 ILE C 251 -0.391 10.909 -0.036 1.00 13.45 H new ATOM 2538 N ASP C 252 3.739 10.380 -2.188 1.00 40.15 N ATOM 2539 CA ASP C 252 5.011 10.096 -2.791 1.00 53.45 C ATOM 2540 C ASP C 252 5.597 8.899 -2.067 1.00 53.12 C ATOM 2541 O ASP C 252 5.855 8.959 -0.858 1.00 74.40 O ATOM 2542 CB ASP C 252 5.977 11.285 -2.700 1.00 54.14 C ATOM 2543 CG ASP C 252 7.298 10.996 -3.403 1.00 22.45 C ATOM 2544 OD1 ASP C 252 7.358 11.135 -4.645 1.00 32.11 O ATOM 2545 OD2 ASP C 252 8.276 10.628 -2.739 1.00 45.21 O ATOM 0 H ASP C 252 3.721 11.209 -1.594 1.00 40.15 H new ATOM 0 HA ASP C 252 4.867 9.893 -3.852 1.00 53.45 H new ATOM 0 HB2 ASP C 252 5.513 12.165 -3.145 1.00 54.14 H new ATOM 0 HB3 ASP C 252 6.166 11.520 -1.653 1.00 54.14 H new ATOM 2550 N PRO C 253 5.808 7.792 -2.772 1.00 24.31 N ATOM 2551 CA PRO C 253 6.287 6.546 -2.165 1.00 42.05 C ATOM 2552 C PRO C 253 7.748 6.622 -1.747 1.00 21.15 C ATOM 2553 O PRO C 253 8.321 5.650 -1.254 1.00 42.41 O ATOM 2554 CB PRO C 253 6.114 5.529 -3.290 1.00 44.41 C ATOM 2555 CG PRO C 253 6.238 6.336 -4.532 1.00 12.23 C ATOM 2556 CD PRO C 253 5.606 7.649 -4.227 1.00 33.31 C ATOM 0 HA PRO C 253 5.745 6.303 -1.251 1.00 42.05 H new ATOM 0 HB2 PRO C 253 6.875 4.750 -3.243 1.00 44.41 H new ATOM 0 HB3 PRO C 253 5.145 5.032 -3.233 1.00 44.41 H new ATOM 0 HG2 PRO C 253 7.283 6.461 -4.814 1.00 12.23 H new ATOM 0 HG3 PRO C 253 5.739 5.846 -5.368 1.00 12.23 H new ATOM 0 HD2 PRO C 253 6.078 8.461 -4.781 1.00 33.31 H new ATOM 0 HD3 PRO C 253 4.548 7.657 -4.489 1.00 33.31 H new ATOM 2564 N LYS C 254 8.357 7.765 -1.941 1.00 74.42 N ATOM 2565 CA LYS C 254 9.701 7.920 -1.610 1.00 11.42 C ATOM 2566 C LYS C 254 9.887 8.820 -0.373 1.00 30.32 C ATOM 2567 O LYS C 254 10.980 9.247 -0.075 1.00 21.25 O ATOM 2568 CB LYS C 254 10.488 8.370 -2.835 1.00 25.24 C ATOM 2569 CG LYS C 254 10.280 7.426 -4.032 1.00 52.45 C ATOM 2570 CD LYS C 254 11.233 7.694 -5.177 1.00 43.54 C ATOM 2571 CE LYS C 254 12.662 7.457 -4.724 1.00 10.11 C ATOM 2572 NZ LYS C 254 13.647 7.605 -5.815 1.00 12.20 N ATOM 0 H LYS C 254 7.913 8.596 -2.333 1.00 74.42 H new ATOM 0 HA LYS C 254 10.112 6.956 -1.310 1.00 11.42 H new ATOM 0 HB2 LYS C 254 10.183 9.379 -3.112 1.00 25.24 H new ATOM 0 HB3 LYS C 254 11.549 8.414 -2.588 1.00 25.24 H new ATOM 0 HG2 LYS C 254 10.403 6.395 -3.699 1.00 52.45 H new ATOM 0 HG3 LYS C 254 9.255 7.525 -4.390 1.00 52.45 H new ATOM 0 HD2 LYS C 254 10.996 7.043 -6.019 1.00 43.54 H new ATOM 0 HD3 LYS C 254 11.118 8.720 -5.525 1.00 43.54 H new ATOM 0 HE2 LYS C 254 12.905 8.158 -3.925 1.00 10.11 H new ATOM 0 HE3 LYS C 254 12.742 6.455 -4.303 1.00 10.11 H new ATOM 0 HZ1 LYS C 254 14.420 6.923 -5.680 1.00 12.20 H new ATOM 0 HZ2 LYS C 254 13.183 7.426 -6.728 1.00 12.20 H new ATOM 0 HZ3 LYS C 254 14.032 8.571 -5.806 1.00 12.20 H new ATOM 2586 N LEU C 255 8.795 9.072 0.361 1.00 62.12 N ATOM 2587 CA LEU C 255 8.874 9.772 1.667 1.00 3.12 C ATOM 2588 C LEU C 255 9.699 8.978 2.647 1.00 4.23 C ATOM 2589 O LEU C 255 9.677 7.753 2.608 1.00 14.41 O ATOM 2590 CB LEU C 255 7.499 9.925 2.285 1.00 21.42 C ATOM 2591 CG LEU C 255 6.583 10.957 1.704 1.00 40.12 C ATOM 2592 CD1 LEU C 255 5.230 10.811 2.351 1.00 73.43 C ATOM 2593 CD2 LEU C 255 7.135 12.331 2.009 1.00 62.32 C ATOM 0 H LEU C 255 7.850 8.807 0.083 1.00 62.12 H new ATOM 0 HA LEU C 255 9.323 10.746 1.474 1.00 3.12 H new ATOM 0 HB2 LEU C 255 6.996 8.960 2.226 1.00 21.42 H new ATOM 0 HB3 LEU C 255 7.631 10.152 3.343 1.00 21.42 H new ATOM 0 HG LEU C 255 6.499 10.827 0.625 1.00 40.12 H new ATOM 0 HD11 LEU C 255 4.548 11.555 1.940 1.00 73.43 H new ATOM 0 HD12 LEU C 255 4.839 9.813 2.155 1.00 73.43 H new ATOM 0 HD13 LEU C 255 5.323 10.959 3.427 1.00 73.43 H new ATOM 0 HD21 LEU C 255 6.474 13.090 1.590 1.00 62.32 H new ATOM 0 HD22 LEU C 255 7.202 12.465 3.089 1.00 62.32 H new ATOM 0 HD23 LEU C 255 8.127 12.430 1.569 1.00 62.32 H new ATOM 2605 N LYS C 256 10.383 9.665 3.561 1.00 61.40 N ATOM 2606 CA LYS C 256 11.193 8.997 4.569 1.00 13.22 C ATOM 2607 C LYS C 256 10.332 8.113 5.462 1.00 52.11 C ATOM 2608 O LYS C 256 10.711 6.974 5.755 1.00 54.40 O ATOM 2609 CB LYS C 256 12.021 9.995 5.416 1.00 51.20 C ATOM 2610 CG LYS C 256 12.786 9.341 6.583 1.00 24.25 C ATOM 2611 CD LYS C 256 13.830 8.329 6.113 1.00 41.13 C ATOM 2612 CE LYS C 256 14.397 7.521 7.288 1.00 61.21 C ATOM 2613 NZ LYS C 256 15.032 8.355 8.332 1.00 45.23 N ATOM 0 H LYS C 256 10.390 10.683 3.621 1.00 61.40 H new ATOM 0 HA LYS C 256 11.903 8.365 4.036 1.00 13.22 H new ATOM 0 HB2 LYS C 256 12.734 10.503 4.767 1.00 51.20 H new ATOM 0 HB3 LYS C 256 11.353 10.759 5.815 1.00 51.20 H new ATOM 0 HG2 LYS C 256 13.277 10.117 7.170 1.00 24.25 H new ATOM 0 HG3 LYS C 256 12.076 8.844 7.244 1.00 24.25 H new ATOM 0 HD2 LYS C 256 13.381 7.651 5.387 1.00 41.13 H new ATOM 0 HD3 LYS C 256 14.640 8.850 5.604 1.00 41.13 H new ATOM 0 HE2 LYS C 256 13.593 6.940 7.739 1.00 61.21 H new ATOM 0 HE3 LYS C 256 15.130 6.810 6.908 1.00 61.21 H new ATOM 0 HZ1 LYS C 256 15.437 7.742 9.068 1.00 45.23 H new ATOM 0 HZ2 LYS C 256 15.787 8.929 7.906 1.00 45.23 H new ATOM 0 HZ3 LYS C 256 14.319 8.982 8.757 1.00 45.23 H new ATOM 2627 N TRP C 257 9.159 8.607 5.874 1.00 32.01 N ATOM 2628 CA TRP C 257 8.314 7.794 6.730 1.00 10.40 C ATOM 2629 C TRP C 257 7.757 6.594 5.975 1.00 41.32 C ATOM 2630 O TRP C 257 7.478 5.550 6.567 1.00 54.12 O ATOM 2631 CB TRP C 257 7.227 8.587 7.511 1.00 23.22 C ATOM 2632 CG TRP C 257 6.069 9.204 6.742 1.00 21.32 C ATOM 2633 CD1 TRP C 257 5.959 10.493 6.288 1.00 4.52 C ATOM 2634 CD2 TRP C 257 4.830 8.558 6.397 1.00 1.20 C ATOM 2635 NE1 TRP C 257 4.724 10.686 5.709 1.00 30.20 N ATOM 2636 CE2 TRP C 257 4.023 9.512 5.748 1.00 11.04 C ATOM 2637 CE3 TRP C 257 4.330 7.266 6.574 1.00 15.23 C ATOM 2638 CZ2 TRP C 257 2.741 9.211 5.281 1.00 51.30 C ATOM 2639 CZ3 TRP C 257 3.065 6.972 6.110 1.00 71.22 C ATOM 2640 CH2 TRP C 257 2.285 7.941 5.471 1.00 11.31 C ATOM 0 H TRP C 257 8.791 9.528 5.637 1.00 32.01 H new ATOM 0 HA TRP C 257 8.965 7.414 7.517 1.00 10.40 H new ATOM 0 HB2 TRP C 257 6.805 7.916 8.259 1.00 23.22 H new ATOM 0 HB3 TRP C 257 7.729 9.390 8.050 1.00 23.22 H new ATOM 0 HD1 TRP C 257 6.728 11.247 6.372 1.00 4.52 H new ATOM 0 HE1 TRP C 257 4.386 11.564 5.314 1.00 30.20 H new ATOM 0 HE3 TRP C 257 4.924 6.510 7.066 1.00 15.23 H new ATOM 0 HZ2 TRP C 257 2.135 9.956 4.788 1.00 51.30 H new ATOM 0 HZ3 TRP C 257 2.670 5.976 6.242 1.00 71.22 H new ATOM 0 HH2 TRP C 257 1.298 7.677 5.120 1.00 11.31 H new ATOM 2651 N ILE C 258 7.619 6.747 4.661 1.00 51.34 N ATOM 2652 CA ILE C 258 7.201 5.657 3.801 1.00 1.34 C ATOM 2653 C ILE C 258 8.342 4.632 3.650 1.00 43.21 C ATOM 2654 O ILE C 258 8.096 3.427 3.731 1.00 70.01 O ATOM 2655 CB ILE C 258 6.721 6.159 2.390 1.00 13.21 C ATOM 2656 CG1 ILE C 258 5.387 6.947 2.482 1.00 75.05 C ATOM 2657 CG2 ILE C 258 6.590 5.002 1.410 1.00 42.43 C ATOM 2658 CD1 ILE C 258 4.221 6.119 2.946 1.00 14.11 C ATOM 0 H ILE C 258 7.793 7.624 4.171 1.00 51.34 H new ATOM 0 HA ILE C 258 6.346 5.177 4.276 1.00 1.34 H new ATOM 0 HB ILE C 258 7.485 6.841 2.017 1.00 13.21 H new ATOM 0 HG12 ILE C 258 5.519 7.786 3.165 1.00 75.05 H new ATOM 0 HG13 ILE C 258 5.156 7.366 1.503 1.00 75.05 H new ATOM 0 HG21 ILE C 258 6.257 5.380 0.443 1.00 42.43 H new ATOM 0 HG22 ILE C 258 7.557 4.512 1.294 1.00 42.43 H new ATOM 0 HG23 ILE C 258 5.863 4.284 1.789 1.00 42.43 H new ATOM 0 HD11 ILE C 258 3.326 6.740 2.984 1.00 14.11 H new ATOM 0 HD12 ILE C 258 4.061 5.294 2.251 1.00 14.11 H new ATOM 0 HD13 ILE C 258 4.429 5.721 3.939 1.00 14.11 H new ATOM 2670 N GLN C 259 9.596 5.131 3.465 1.00 71.40 N ATOM 2671 CA GLN C 259 10.787 4.252 3.282 1.00 13.35 C ATOM 2672 C GLN C 259 10.855 3.273 4.436 1.00 64.10 C ATOM 2673 O GLN C 259 10.871 2.058 4.247 1.00 3.03 O ATOM 2674 CB GLN C 259 12.110 5.072 3.312 1.00 41.22 C ATOM 2675 CG GLN C 259 12.216 6.241 2.340 1.00 53.24 C ATOM 2676 CD GLN C 259 12.097 5.849 0.896 1.00 45.32 C ATOM 2677 OE1 GLN C 259 10.895 5.858 0.395 1.00 33.31 O flip ATOM 2678 NE2 GLN C 259 13.090 5.555 0.233 1.00 60.14 N flip ATOM 0 H GLN C 259 9.808 6.128 3.439 1.00 71.40 H new ATOM 0 HA GLN C 259 10.685 3.751 2.319 1.00 13.35 H new ATOM 0 HB2 GLN C 259 12.248 5.457 4.322 1.00 41.22 H new ATOM 0 HB3 GLN C 259 12.937 4.390 3.115 1.00 41.22 H new ATOM 0 HG2 GLN C 259 11.437 6.966 2.574 1.00 53.24 H new ATOM 0 HG3 GLN C 259 13.173 6.741 2.492 1.00 53.24 H new ATOM 0 HE21 GLN C 259 14.013 5.561 0.667 1.00 60.14 H new ATOM 0 HE22 GLN C 259 12.991 5.305 -0.751 1.00 60.14 H new ATOM 2687 N GLU C 260 10.806 3.839 5.628 1.00 70.41 N ATOM 2688 CA GLU C 260 10.857 3.101 6.864 1.00 1.45 C ATOM 2689 C GLU C 260 9.704 2.137 6.964 1.00 55.43 C ATOM 2690 O GLU C 260 9.906 0.973 7.224 1.00 15.33 O ATOM 2691 CB GLU C 260 10.780 4.073 8.037 1.00 73.12 C ATOM 2692 CG GLU C 260 11.957 5.005 8.186 1.00 41.42 C ATOM 2693 CD GLU C 260 13.212 4.290 8.601 1.00 51.44 C ATOM 2694 OE1 GLU C 260 13.237 3.742 9.718 1.00 65.41 O ATOM 2695 OE2 GLU C 260 14.169 4.252 7.828 1.00 14.21 O ATOM 0 H GLU C 260 10.728 4.847 5.760 1.00 70.41 H new ATOM 0 HA GLU C 260 11.792 2.541 6.889 1.00 1.45 H new ATOM 0 HB2 GLU C 260 9.876 4.672 7.931 1.00 73.12 H new ATOM 0 HB3 GLU C 260 10.676 3.498 8.957 1.00 73.12 H new ATOM 0 HG2 GLU C 260 12.131 5.518 7.240 1.00 41.42 H new ATOM 0 HG3 GLU C 260 11.718 5.770 8.924 1.00 41.42 H new ATOM 2702 N TYR C 261 8.496 2.637 6.734 1.00 60.54 N ATOM 2703 CA TYR C 261 7.285 1.851 6.916 1.00 41.45 C ATOM 2704 C TYR C 261 7.331 0.565 6.083 1.00 52.12 C ATOM 2705 O TYR C 261 7.065 -0.532 6.597 1.00 14.30 O ATOM 2706 CB TYR C 261 6.042 2.682 6.565 1.00 43.51 C ATOM 2707 CG TYR C 261 4.751 2.041 6.999 1.00 21.53 C ATOM 2708 CD1 TYR C 261 4.265 2.257 8.280 1.00 1.05 C ATOM 2709 CD2 TYR C 261 4.027 1.217 6.151 1.00 22.12 C ATOM 2710 CE1 TYR C 261 3.110 1.672 8.716 1.00 43.31 C ATOM 2711 CE2 TYR C 261 2.858 0.627 6.569 1.00 42.21 C ATOM 2712 CZ TYR C 261 2.400 0.854 7.860 1.00 1.31 C ATOM 2713 OH TYR C 261 1.246 0.240 8.295 1.00 63.51 O ATOM 0 H TYR C 261 8.330 3.593 6.418 1.00 60.54 H new ATOM 0 HA TYR C 261 7.223 1.567 7.967 1.00 41.45 H new ATOM 0 HB2 TYR C 261 6.127 3.663 7.032 1.00 43.51 H new ATOM 0 HB3 TYR C 261 6.014 2.843 5.487 1.00 43.51 H new ATOM 0 HD1 TYR C 261 4.813 2.904 8.949 1.00 1.05 H new ATOM 0 HD2 TYR C 261 4.386 1.036 5.149 1.00 22.12 H new ATOM 0 HE1 TYR C 261 2.756 1.848 9.721 1.00 43.31 H new ATOM 0 HE2 TYR C 261 2.300 -0.009 5.898 1.00 42.21 H new ATOM 0 HH TYR C 261 0.601 0.920 8.581 1.00 63.51 H new ATOM 2723 N LEU C 262 7.709 0.709 4.825 1.00 23.25 N ATOM 2724 CA LEU C 262 7.820 -0.418 3.913 1.00 33.41 C ATOM 2725 C LEU C 262 8.867 -1.402 4.420 1.00 2.02 C ATOM 2726 O LEU C 262 8.623 -2.609 4.482 1.00 14.12 O ATOM 2727 CB LEU C 262 8.192 0.078 2.516 1.00 65.22 C ATOM 2728 CG LEU C 262 7.207 1.064 1.881 1.00 70.01 C ATOM 2729 CD1 LEU C 262 7.722 1.538 0.547 1.00 30.04 C ATOM 2730 CD2 LEU C 262 5.836 0.434 1.721 1.00 10.11 C ATOM 0 H LEU C 262 7.947 1.608 4.407 1.00 23.25 H new ATOM 0 HA LEU C 262 6.858 -0.929 3.861 1.00 33.41 H new ATOM 0 HB2 LEU C 262 9.172 0.553 2.567 1.00 65.22 H new ATOM 0 HB3 LEU C 262 8.290 -0.785 1.857 1.00 65.22 H new ATOM 0 HG LEU C 262 7.113 1.923 2.546 1.00 70.01 H new ATOM 0 HD11 LEU C 262 7.010 2.238 0.110 1.00 30.04 H new ATOM 0 HD12 LEU C 262 8.682 2.035 0.684 1.00 30.04 H new ATOM 0 HD13 LEU C 262 7.847 0.684 -0.119 1.00 30.04 H new ATOM 0 HD21 LEU C 262 5.155 1.155 1.268 1.00 10.11 H new ATOM 0 HD22 LEU C 262 5.912 -0.445 1.081 1.00 10.11 H new ATOM 0 HD23 LEU C 262 5.455 0.139 2.699 1.00 10.11 H new ATOM 2742 N GLU C 263 10.004 -0.864 4.823 1.00 1.00 N ATOM 2743 CA GLU C 263 11.123 -1.641 5.334 1.00 5.24 C ATOM 2744 C GLU C 263 10.807 -2.389 6.638 1.00 34.24 C ATOM 2745 O GLU C 263 11.406 -3.438 6.924 1.00 25.42 O ATOM 2746 CB GLU C 263 12.368 -0.772 5.490 1.00 1.32 C ATOM 2747 CG GLU C 263 12.934 -0.277 4.175 1.00 24.11 C ATOM 2748 CD GLU C 263 14.250 0.433 4.349 1.00 4.32 C ATOM 2749 OE1 GLU C 263 14.259 1.617 4.713 1.00 72.02 O ATOM 2750 OE2 GLU C 263 15.307 -0.203 4.136 1.00 40.11 O ATOM 0 H GLU C 263 10.180 0.140 4.805 1.00 1.00 H new ATOM 0 HA GLU C 263 11.321 -2.409 4.587 1.00 5.24 H new ATOM 0 HB2 GLU C 263 12.125 0.086 6.117 1.00 1.32 H new ATOM 0 HB3 GLU C 263 13.135 -1.342 6.014 1.00 1.32 H new ATOM 0 HG2 GLU C 263 13.066 -1.121 3.498 1.00 24.11 H new ATOM 0 HG3 GLU C 263 12.219 0.399 3.706 1.00 24.11 H new ATOM 2757 N LYS C 264 9.903 -1.864 7.439 1.00 50.33 N ATOM 2758 CA LYS C 264 9.583 -2.524 8.704 1.00 54.53 C ATOM 2759 C LYS C 264 8.532 -3.613 8.481 1.00 2.35 C ATOM 2760 O LYS C 264 8.639 -4.703 9.027 1.00 53.22 O ATOM 2761 CB LYS C 264 9.046 -1.536 9.762 1.00 11.13 C ATOM 2762 CG LYS C 264 9.790 -0.218 9.870 1.00 24.12 C ATOM 2763 CD LYS C 264 11.286 -0.353 10.116 1.00 40.10 C ATOM 2764 CE LYS C 264 11.913 1.025 10.012 1.00 23.02 C ATOM 2765 NZ LYS C 264 13.372 1.045 10.200 1.00 11.14 N ATOM 0 H LYS C 264 9.385 -1.006 7.252 1.00 50.33 H new ATOM 0 HA LYS C 264 10.512 -2.956 9.075 1.00 54.53 H new ATOM 0 HB2 LYS C 264 8.001 -1.324 9.537 1.00 11.13 H new ATOM 0 HB3 LYS C 264 9.070 -2.026 10.735 1.00 11.13 H new ATOM 0 HG2 LYS C 264 9.636 0.348 8.951 1.00 24.12 H new ATOM 0 HG3 LYS C 264 9.353 0.365 10.680 1.00 24.12 H new ATOM 0 HD2 LYS C 264 11.472 -0.781 11.101 1.00 40.10 H new ATOM 0 HD3 LYS C 264 11.731 -1.029 9.386 1.00 40.10 H new ATOM 0 HE2 LYS C 264 11.679 1.444 9.033 1.00 23.02 H new ATOM 0 HE3 LYS C 264 11.454 1.677 10.756 1.00 23.02 H new ATOM 0 HZ1 LYS C 264 13.726 2.013 10.063 1.00 11.14 H new ATOM 0 HZ2 LYS C 264 13.602 0.724 11.162 1.00 11.14 H new ATOM 0 HZ3 LYS C 264 13.820 0.412 9.507 1.00 11.14 H new ATOM 2779 N CYS C 265 7.531 -3.314 7.660 1.00 45.32 N ATOM 2780 CA CYS C 265 6.400 -4.225 7.449 1.00 63.44 C ATOM 2781 C CYS C 265 6.719 -5.597 6.884 1.00 0.43 C ATOM 2782 O CYS C 265 6.015 -6.542 7.199 1.00 45.25 O ATOM 2783 CB CYS C 265 5.225 -3.570 6.728 1.00 52.52 C ATOM 2784 SG CYS C 265 4.304 -2.385 7.759 1.00 20.41 S ATOM 0 H CYS C 265 7.475 -2.447 7.126 1.00 45.32 H new ATOM 0 HA CYS C 265 6.092 -4.438 8.473 1.00 63.44 H new ATOM 0 HB2 CYS C 265 5.595 -3.056 5.841 1.00 52.52 H new ATOM 0 HB3 CYS C 265 4.542 -4.347 6.384 1.00 52.52 H new ATOM 2789 N LEU C 266 7.765 -5.743 6.068 1.00 21.21 N ATOM 2790 CA LEU C 266 8.063 -7.096 5.573 1.00 23.52 C ATOM 2791 C LEU C 266 8.696 -7.952 6.673 1.00 54.43 C ATOM 2792 O LEU C 266 8.666 -9.181 6.628 1.00 15.22 O ATOM 2793 CB LEU C 266 8.864 -7.150 4.207 1.00 23.32 C ATOM 2794 CG LEU C 266 10.331 -6.637 4.093 1.00 61.44 C ATOM 2795 CD1 LEU C 266 10.472 -5.184 4.447 1.00 65.12 C ATOM 2796 CD2 LEU C 266 11.323 -7.514 4.861 1.00 22.02 C ATOM 0 H LEU C 266 8.386 -4.999 5.750 1.00 21.21 H new ATOM 0 HA LEU C 266 7.100 -7.535 5.314 1.00 23.52 H new ATOM 0 HB2 LEU C 266 8.869 -8.191 3.885 1.00 23.32 H new ATOM 0 HB3 LEU C 266 8.278 -6.593 3.476 1.00 23.32 H new ATOM 0 HG LEU C 266 10.591 -6.722 3.038 1.00 61.44 H new ATOM 0 HD11 LEU C 266 11.516 -4.885 4.349 1.00 65.12 H new ATOM 0 HD12 LEU C 266 9.858 -4.585 3.775 1.00 65.12 H new ATOM 0 HD13 LEU C 266 10.145 -5.026 5.475 1.00 65.12 H new ATOM 0 HD21 LEU C 266 12.329 -7.111 4.747 1.00 22.02 H new ATOM 0 HD22 LEU C 266 11.055 -7.527 5.917 1.00 22.02 H new ATOM 0 HD23 LEU C 266 11.292 -8.529 4.466 1.00 22.02 H new ATOM 2808 N ASN C 267 9.248 -7.280 7.665 1.00 71.54 N ATOM 2809 CA ASN C 267 9.878 -7.934 8.800 1.00 34.22 C ATOM 2810 C ASN C 267 8.829 -8.232 9.871 1.00 55.04 C ATOM 2811 O ASN C 267 8.877 -9.268 10.542 1.00 12.41 O ATOM 2812 CB ASN C 267 10.989 -7.035 9.367 1.00 15.40 C ATOM 2813 CG ASN C 267 11.696 -7.621 10.581 1.00 5.04 C ATOM 2814 OD1 ASN C 267 11.287 -7.399 11.720 1.00 71.42 O ATOM 2815 ND2 ASN C 267 12.771 -8.337 10.352 1.00 71.42 N ATOM 0 H ASN C 267 9.273 -6.261 7.708 1.00 71.54 H new ATOM 0 HA ASN C 267 10.323 -8.875 8.477 1.00 34.22 H new ATOM 0 HB2 ASN C 267 11.725 -6.847 8.586 1.00 15.40 H new ATOM 0 HB3 ASN C 267 10.560 -6.071 9.639 1.00 15.40 H new ATOM 0 HD21 ASN C 267 13.297 -8.730 11.132 1.00 71.42 H new ATOM 0 HD22 ASN C 267 13.080 -8.500 9.394 1.00 71.42 H new ATOM 2822 N LYS C 268 7.872 -7.330 10.010 1.00 3.12 N ATOM 2823 CA LYS C 268 6.800 -7.490 10.985 1.00 64.22 C ATOM 2824 C LYS C 268 5.845 -8.607 10.588 1.00 55.25 C ATOM 2825 O LYS C 268 5.195 -8.533 9.549 1.00 12.21 O ATOM 2826 CB LYS C 268 6.016 -6.187 11.179 1.00 34.24 C ATOM 2827 CG LYS C 268 6.828 -5.041 11.748 1.00 31.22 C ATOM 2828 CD LYS C 268 5.945 -3.837 12.019 1.00 24.00 C ATOM 2829 CE LYS C 268 6.710 -2.716 12.709 1.00 23.11 C ATOM 2830 NZ LYS C 268 7.244 -3.135 14.026 1.00 40.21 N ATOM 0 H LYS C 268 7.813 -6.474 9.458 1.00 3.12 H new ATOM 0 HA LYS C 268 7.275 -7.756 11.930 1.00 64.22 H new ATOM 0 HB2 LYS C 268 5.603 -5.880 10.218 1.00 34.24 H new ATOM 0 HB3 LYS C 268 5.172 -6.381 11.841 1.00 34.24 H new ATOM 0 HG2 LYS C 268 7.313 -5.357 12.671 1.00 31.22 H new ATOM 0 HG3 LYS C 268 7.619 -4.768 11.049 1.00 31.22 H new ATOM 0 HD2 LYS C 268 5.533 -3.470 11.079 1.00 24.00 H new ATOM 0 HD3 LYS C 268 5.102 -4.138 12.641 1.00 24.00 H new ATOM 0 HE2 LYS C 268 7.532 -2.393 12.071 1.00 23.11 H new ATOM 0 HE3 LYS C 268 6.052 -1.857 12.841 1.00 23.11 H new ATOM 0 HZ1 LYS C 268 7.498 -2.293 14.581 1.00 40.21 H new ATOM 0 HZ2 LYS C 268 6.521 -3.681 14.536 1.00 40.21 H new ATOM 0 HZ3 LYS C 268 8.089 -3.726 13.886 1.00 40.21 H new ATOM 2914 N ILE D 306 4.277 -6.556 -12.158 1.00 14.23 N ATOM 2915 CA ILE D 306 3.021 -5.908 -11.833 1.00 25.31 C ATOM 2916 C ILE D 306 2.025 -7.005 -11.397 1.00 22.34 C ATOM 2917 O ILE D 306 2.235 -8.183 -11.689 1.00 71.51 O ATOM 2918 CB ILE D 306 2.457 -5.136 -13.085 1.00 63.33 C ATOM 2919 CG1 ILE D 306 3.538 -4.226 -13.710 1.00 12.30 C ATOM 2920 CG2 ILE D 306 1.218 -4.301 -12.731 1.00 32.15 C ATOM 2921 CD1 ILE D 306 4.099 -3.168 -12.778 1.00 30.42 C ATOM 0 HA ILE D 306 3.170 -5.183 -11.033 1.00 25.31 H new ATOM 0 HB ILE D 306 2.163 -5.891 -13.814 1.00 63.33 H new ATOM 0 HG12 ILE D 306 4.359 -4.851 -14.063 1.00 12.30 H new ATOM 0 HG13 ILE D 306 3.115 -3.732 -14.585 1.00 12.30 H new ATOM 0 HG21 ILE D 306 0.861 -3.785 -13.622 1.00 32.15 H new ATOM 0 HG22 ILE D 306 0.434 -4.956 -12.352 1.00 32.15 H new ATOM 0 HG23 ILE D 306 1.479 -3.568 -11.967 1.00 32.15 H new ATOM 0 HD11 ILE D 306 4.850 -2.580 -13.305 1.00 30.42 H new ATOM 0 HD12 ILE D 306 3.294 -2.514 -12.444 1.00 30.42 H new ATOM 0 HD13 ILE D 306 4.557 -3.650 -11.914 1.00 30.42 H new ATOM 2933 N TYR D 307 0.958 -6.628 -10.701 1.00 5.23 N ATOM 2934 CA TYR D 307 -0.073 -7.580 -10.274 1.00 52.34 C ATOM 2935 C TYR D 307 -0.925 -7.982 -11.485 1.00 43.32 C ATOM 2936 O TYR D 307 -1.745 -8.876 -11.411 1.00 32.05 O ATOM 2937 CB TYR D 307 -1.016 -6.909 -9.304 1.00 12.40 C ATOM 2938 CG TYR D 307 -0.439 -6.270 -8.098 1.00 60.01 C ATOM 2939 CD1 TYR D 307 -0.214 -7.000 -6.956 1.00 63.33 C ATOM 2940 CD2 TYR D 307 -0.195 -4.919 -8.073 1.00 34.32 C ATOM 2941 CE1 TYR D 307 0.245 -6.413 -5.823 1.00 63.03 C ATOM 2942 CE2 TYR D 307 0.248 -4.318 -6.940 1.00 73.10 C ATOM 2943 CZ TYR D 307 0.468 -5.072 -5.816 1.00 32.22 C ATOM 2944 OH TYR D 307 0.878 -4.469 -4.680 1.00 11.40 O ATOM 0 H TYR D 307 0.780 -5.665 -10.417 1.00 5.23 H new ATOM 0 HA TYR D 307 0.420 -8.440 -9.821 1.00 52.34 H new ATOM 0 HB2 TYR D 307 -1.571 -6.147 -9.852 1.00 12.40 H new ATOM 0 HB3 TYR D 307 -1.739 -7.654 -8.973 1.00 12.40 H new ATOM 0 HD1 TYR D 307 -0.407 -8.063 -6.961 1.00 63.33 H new ATOM 0 HD2 TYR D 307 -0.357 -4.329 -8.963 1.00 34.32 H new ATOM 0 HE1 TYR D 307 0.431 -7.003 -4.938 1.00 63.03 H new ATOM 0 HE2 TYR D 307 0.426 -3.253 -6.924 1.00 73.10 H new ATOM 0 HH TYR D 307 1.474 -3.723 -4.902 1.00 11.40 H new ATOM 2954 N THR D 308 -0.679 -7.275 -12.582 1.00 15.41 N ATOM 2955 CA THR D 308 -1.390 -7.327 -13.855 1.00 2.21 C ATOM 2956 C THR D 308 -2.699 -6.545 -13.822 1.00 14.02 C ATOM 2957 O THR D 308 -3.789 -7.106 -13.749 1.00 1.33 O ATOM 2958 CB THR D 308 -1.540 -8.741 -14.543 1.00 53.42 C ATOM 2959 OG1 THR D 308 -2.330 -9.648 -13.759 1.00 64.53 O ATOM 2960 CG2 THR D 308 -0.170 -9.353 -14.790 1.00 11.20 C ATOM 0 H THR D 308 0.083 -6.597 -12.607 1.00 15.41 H new ATOM 0 HA THR D 308 -0.704 -6.816 -14.530 1.00 2.21 H new ATOM 0 HB THR D 308 -2.055 -8.580 -15.490 1.00 53.42 H new ATOM 0 HG1 THR D 308 -2.483 -9.264 -12.870 1.00 64.53 H new ATOM 0 HG21 THR D 308 -0.287 -10.327 -15.265 1.00 11.20 H new ATOM 0 HG22 THR D 308 0.409 -8.699 -15.442 1.00 11.20 H new ATOM 0 HG23 THR D 308 0.352 -9.472 -13.840 1.00 11.20 H new ATOM 2968 N SER D 309 -2.564 -5.239 -13.803 1.00 41.34 N ATOM 2969 CA SER D 309 -3.680 -4.341 -13.822 1.00 62.12 C ATOM 2970 C SER D 309 -3.716 -3.620 -15.169 1.00 22.15 C ATOM 2971 O SER D 309 -2.787 -3.788 -15.990 1.00 64.01 O ATOM 2972 CB SER D 309 -3.570 -3.368 -12.640 1.00 12.14 C ATOM 2973 OG SER D 309 -2.281 -2.753 -12.594 1.00 2.31 O ATOM 0 H SER D 309 -1.659 -4.770 -13.773 1.00 41.34 H new ATOM 0 HA SER D 309 -4.618 -4.884 -13.711 1.00 62.12 H new ATOM 0 HB2 SER D 309 -4.339 -2.600 -12.725 1.00 12.14 H new ATOM 0 HB3 SER D 309 -3.754 -3.902 -11.708 1.00 12.14 H new ATOM 0 HG SER D 309 -1.982 -2.689 -11.663 1.00 2.31 H new ATOM 2979 N ASP D 310 -4.756 -2.853 -15.423 1.00 1.23 N ATOM 2980 CA ASP D 310 -4.888 -2.176 -16.714 1.00 51.45 C ATOM 2981 C ASP D 310 -5.739 -0.912 -16.605 1.00 52.55 C ATOM 2982 O ASP D 310 -5.549 0.044 -17.352 1.00 13.42 O ATOM 2983 CB ASP D 310 -5.477 -3.153 -17.733 1.00 20.42 C ATOM 2984 CG ASP D 310 -5.583 -2.609 -19.138 1.00 31.15 C ATOM 2985 OD1 ASP D 310 -4.527 -2.318 -19.746 1.00 20.54 O ATOM 2986 OD2 ASP D 310 -6.706 -2.569 -19.693 1.00 0.20 O ATOM 0 H ASP D 310 -5.518 -2.679 -14.768 1.00 1.23 H new ATOM 0 HA ASP D 310 -3.900 -1.858 -17.047 1.00 51.45 H new ATOM 0 HB2 ASP D 310 -4.862 -4.053 -17.751 1.00 20.42 H new ATOM 0 HB3 ASP D 310 -6.470 -3.452 -17.398 1.00 20.42 H new ATOM 2991 N ASN D 311 -6.668 -0.909 -15.675 1.00 22.32 N ATOM 2992 CA ASN D 311 -7.516 0.251 -15.445 1.00 64.33 C ATOM 2993 C ASN D 311 -7.491 0.616 -13.969 1.00 14.42 C ATOM 2994 O ASN D 311 -7.833 -0.216 -13.116 1.00 3.24 O ATOM 2995 CB ASN D 311 -8.954 -0.040 -15.882 1.00 52.42 C ATOM 2996 CG ASN D 311 -9.884 1.149 -15.689 1.00 21.31 C ATOM 2997 OD1 ASN D 311 -9.470 2.313 -15.781 1.00 31.32 O ATOM 2998 ND2 ASN D 311 -11.127 0.873 -15.416 1.00 63.21 N ATOM 0 H ASN D 311 -6.860 -1.700 -15.060 1.00 22.32 H new ATOM 0 HA ASN D 311 -7.136 1.086 -16.034 1.00 64.33 H new ATOM 0 HB2 ASN D 311 -8.957 -0.331 -16.933 1.00 52.42 H new ATOM 0 HB3 ASN D 311 -9.336 -0.889 -15.315 1.00 52.42 H new ATOM 0 HD21 ASN D 311 -11.797 1.628 -15.270 1.00 63.21 H new ATOM 0 HD22 ASN D 311 -11.431 -0.098 -15.348 1.00 63.21 H new ATOM 3124 N TYR D 321 -0.726 19.135 -0.999 1.00 52.21 N ATOM 3125 CA TYR D 321 -0.813 19.151 0.474 1.00 64.31 C ATOM 3126 C TYR D 321 0.435 19.872 0.980 1.00 34.40 C ATOM 3127 O TYR D 321 0.367 20.795 1.795 1.00 55.54 O ATOM 3128 CB TYR D 321 -0.761 17.700 0.963 1.00 53.42 C ATOM 3129 CG TYR D 321 -1.296 17.402 2.342 1.00 12.14 C ATOM 3130 CD1 TYR D 321 -0.675 17.855 3.489 1.00 13.20 C ATOM 3131 CD2 TYR D 321 -2.436 16.628 2.477 1.00 53.30 C ATOM 3132 CE1 TYR D 321 -1.180 17.546 4.740 1.00 2.33 C ATOM 3133 CE2 TYR D 321 -2.947 16.307 3.708 1.00 22.01 C ATOM 3134 CZ TYR D 321 -2.316 16.769 4.843 1.00 13.13 C ATOM 3135 OH TYR D 321 -2.816 16.440 6.088 1.00 35.14 O ATOM 0 HA TYR D 321 -1.724 19.638 0.822 1.00 64.31 H new ATOM 0 HB2 TYR D 321 -1.312 17.087 0.250 1.00 53.42 H new ATOM 0 HB3 TYR D 321 0.278 17.372 0.929 1.00 53.42 H new ATOM 0 HD1 TYR D 321 0.217 18.459 3.409 1.00 13.20 H new ATOM 0 HD2 TYR D 321 -2.936 16.268 1.590 1.00 53.30 H new ATOM 0 HE1 TYR D 321 -0.688 17.911 5.630 1.00 2.33 H new ATOM 0 HE2 TYR D 321 -3.835 15.698 3.788 1.00 22.01 H new ATOM 0 HH TYR D 321 -3.774 16.642 6.120 1.00 35.14 H new ATOM 3145 N ASP D 322 1.558 19.424 0.448 1.00 42.52 N ATOM 3146 CA ASP D 322 2.898 19.954 0.689 1.00 12.31 C ATOM 3147 C ASP D 322 3.820 19.190 -0.238 1.00 20.14 C ATOM 3148 O ASP D 322 3.674 17.966 -0.367 1.00 22.33 O ATOM 3149 CB ASP D 322 3.327 19.776 2.151 1.00 12.21 C ATOM 3150 CG ASP D 322 4.695 20.358 2.431 1.00 40.04 C ATOM 3151 OD1 ASP D 322 4.815 21.593 2.533 1.00 54.53 O ATOM 3152 OD2 ASP D 322 5.667 19.596 2.546 1.00 25.43 O ATOM 0 H ASP D 322 1.565 18.637 -0.201 1.00 42.52 H new ATOM 0 HA ASP D 322 2.929 21.027 0.497 1.00 12.31 H new ATOM 0 HB2 ASP D 322 2.594 20.252 2.802 1.00 12.21 H new ATOM 0 HB3 ASP D 322 3.330 18.714 2.398 1.00 12.21 H new ATOM 3157 N SER D 323 4.732 19.867 -0.892 1.00 63.32 N ATOM 3158 CA SER D 323 5.501 19.225 -1.944 1.00 43.32 C ATOM 3159 C SER D 323 6.976 18.938 -1.592 1.00 60.51 C ATOM 3160 O SER D 323 7.616 19.678 -0.830 1.00 44.51 O ATOM 3161 CB SER D 323 5.384 20.039 -3.221 1.00 13.34 C ATOM 3162 OG SER D 323 4.012 20.185 -3.586 1.00 2.12 O ATOM 0 H SER D 323 4.962 20.846 -0.723 1.00 63.32 H new ATOM 0 HA SER D 323 5.065 18.236 -2.083 1.00 43.32 H new ATOM 0 HB2 SER D 323 5.837 21.020 -3.079 1.00 13.34 H new ATOM 0 HB3 SER D 323 5.932 19.549 -4.025 1.00 13.34 H new ATOM 0 HG SER D 323 3.947 20.713 -4.409 1.00 2.12 H new ATOM 3168 N MET D 324 7.450 17.824 -2.163 1.00 12.00 N ATOM 3169 CA MET D 324 8.818 17.254 -2.114 1.00 54.23 C ATOM 3170 C MET D 324 8.797 15.964 -2.880 1.00 52.42 C ATOM 3171 O MET D 324 7.715 15.420 -3.133 1.00 41.32 O ATOM 3172 CB MET D 324 9.340 16.930 -0.698 1.00 11.45 C ATOM 3173 CG MET D 324 9.989 18.054 0.056 1.00 1.22 C ATOM 3174 SD MET D 324 10.545 17.543 1.697 1.00 32.31 S ATOM 3175 CE MET D 324 11.614 16.151 1.302 1.00 55.21 C ATOM 0 H MET D 324 6.834 17.238 -2.726 1.00 12.00 H new ATOM 0 HA MET D 324 9.481 18.013 -2.528 1.00 54.23 H new ATOM 0 HB2 MET D 324 8.504 16.560 -0.104 1.00 11.45 H new ATOM 0 HB3 MET D 324 10.059 16.115 -0.779 1.00 11.45 H new ATOM 0 HG2 MET D 324 10.840 18.428 -0.514 1.00 1.22 H new ATOM 0 HG3 MET D 324 9.283 18.879 0.154 1.00 1.22 H new ATOM 0 HE1 MET D 324 12.391 16.062 2.061 1.00 55.21 H new ATOM 0 HE2 MET D 324 11.024 15.235 1.278 1.00 55.21 H new ATOM 0 HE3 MET D 324 12.075 16.311 0.327 1.00 55.21 H new ATOM 3185 N LYS D 325 9.959 15.481 -3.254 1.00 2.32 N ATOM 3186 CA LYS D 325 10.104 14.201 -3.924 1.00 71.15 C ATOM 3187 C LYS D 325 11.437 13.580 -3.540 1.00 72.32 C ATOM 3188 O LYS D 325 12.463 14.281 -3.549 1.00 33.51 O ATOM 3189 CB LYS D 325 10.049 14.343 -5.457 1.00 50.21 C ATOM 3190 CG LYS D 325 8.740 14.861 -6.026 1.00 64.34 C ATOM 3191 CD LYS D 325 8.753 14.857 -7.547 1.00 24.32 C ATOM 3192 CE LYS D 325 9.830 15.753 -8.123 1.00 62.11 C ATOM 3193 NZ LYS D 325 9.816 15.719 -9.596 1.00 54.31 N ATOM 0 H LYS D 325 10.842 15.968 -3.102 1.00 2.32 H new ATOM 0 HA LYS D 325 9.274 13.568 -3.609 1.00 71.15 H new ATOM 0 HB2 LYS D 325 10.850 15.013 -5.770 1.00 50.21 H new ATOM 0 HB3 LYS D 325 10.256 13.369 -5.901 1.00 50.21 H new ATOM 0 HG2 LYS D 325 7.916 14.244 -5.667 1.00 64.34 H new ATOM 0 HG3 LYS D 325 8.561 15.874 -5.665 1.00 64.34 H new ATOM 0 HD2 LYS D 325 8.905 13.838 -7.903 1.00 24.32 H new ATOM 0 HD3 LYS D 325 7.780 15.182 -7.916 1.00 24.32 H new ATOM 0 HE2 LYS D 325 9.679 16.776 -7.778 1.00 62.11 H new ATOM 0 HE3 LYS D 325 10.806 15.434 -7.758 1.00 62.11 H new ATOM 0 HZ1 LYS D 325 10.563 16.341 -9.965 1.00 54.31 H new ATOM 0 HZ2 LYS D 325 9.983 14.746 -9.922 1.00 54.31 H new ATOM 0 HZ3 LYS D 325 8.891 16.046 -9.942 1.00 54.31 H new ATOM 3207 N GLU D 326 11.414 12.280 -3.197 1.00 31.43 N ATOM 3208 CA GLU D 326 12.610 11.485 -2.853 1.00 25.22 C ATOM 3209 C GLU D 326 13.134 11.778 -1.437 1.00 54.12 C ATOM 3210 O GLU D 326 13.152 12.934 -0.984 1.00 44.03 O ATOM 3211 CB GLU D 326 13.705 11.562 -3.936 1.00 43.13 C ATOM 3212 CG GLU D 326 13.210 11.085 -5.293 1.00 3.05 C ATOM 3213 CD GLU D 326 14.274 11.060 -6.347 1.00 21.22 C ATOM 3214 OE1 GLU D 326 14.623 12.128 -6.881 1.00 33.00 O ATOM 3215 OE2 GLU D 326 14.760 9.960 -6.676 1.00 54.20 O ATOM 0 H GLU D 326 10.549 11.741 -3.150 1.00 31.43 H new ATOM 0 HA GLU D 326 12.288 10.444 -2.833 1.00 25.22 H new ATOM 0 HB2 GLU D 326 14.057 12.590 -4.021 1.00 43.13 H new ATOM 0 HB3 GLU D 326 14.559 10.957 -3.630 1.00 43.13 H new ATOM 0 HG2 GLU D 326 12.793 10.084 -5.186 1.00 3.05 H new ATOM 0 HG3 GLU D 326 12.399 11.734 -5.623 1.00 3.05 H new ATOM 3222 N PRO D 327 13.568 10.722 -0.724 1.00 25.31 N ATOM 3223 CA PRO D 327 13.947 10.813 0.679 1.00 34.31 C ATOM 3224 C PRO D 327 15.318 11.418 0.929 1.00 21.14 C ATOM 3225 O PRO D 327 16.257 11.299 0.122 1.00 41.14 O ATOM 3226 CB PRO D 327 13.973 9.349 1.108 1.00 13.22 C ATOM 3227 CG PRO D 327 14.459 8.661 -0.107 1.00 20.52 C ATOM 3228 CD PRO D 327 13.737 9.334 -1.229 1.00 21.22 C ATOM 0 HA PRO D 327 13.259 11.464 1.219 1.00 34.31 H new ATOM 0 HB2 PRO D 327 14.637 9.188 1.957 1.00 13.22 H new ATOM 0 HB3 PRO D 327 12.985 8.997 1.405 1.00 13.22 H new ATOM 0 HG2 PRO D 327 15.539 8.759 -0.214 1.00 20.52 H new ATOM 0 HG3 PRO D 327 14.238 7.594 -0.075 1.00 20.52 H new ATOM 0 HD2 PRO D 327 14.312 9.307 -2.154 1.00 21.22 H new ATOM 0 HD3 PRO D 327 12.778 8.859 -1.436 1.00 21.22 H new