USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1204 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 25 HIS : no HE2:sc= -1.73 K(o=-1.7,f=-4.3!) USER MOD Set 1.2: D 311 ASN : amide:sc= 0.0227 K(o=-1.7,f=-3.9) USER MOD Set 2.1: A 68 LYS NZ :NH3+ 175:sc= 0 (180deg=0) USER MOD Set 2.2: C 230 ASN : amide:sc= -2.03! C(o=-2!,f=-2!) USER MOD Set 3.1: A 22 ASN : amide:sc= -2.02! C(o=-1.2!,f=-2.7!) USER MOD Set 3.2: B 121 TYR OH : rot 110:sc= 0.822 USER MOD Set 4.1: B 111 ASN : amide:sc= -0.514 K(o=-5.4,f=-9.1!) USER MOD Set 4.2: C 224 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.3: C 225 HIS : no HD1:sc= -4.86! C(o=-5.4!,f=-7.1!) USER MOD Set 5.1: B 109 SER OG : rot -165:sc= 0.425 USER MOD Set 5.2: C 243 LYS NZ :NH3+ -108:sc= 0.823 (180deg=0.000864) USER MOD Set 6.1: B 107 TYR OH : rot 92:sc= 1.22 USER MOD Set 6.2: C 261 TYR OH : rot -116:sc= 1.17 USER MOD Set 7.1: A 61 TYR OH : rot -93:sc= 1.51 USER MOD Set 7.2: D 307 TYR OH : rot -141:sc= 0.466 USER MOD Set 8.1: A 43 LYS NZ :NH3+ 148:sc= 0.0356 (180deg=0) USER MOD Set 8.2: D 309 SER OG : rot -100:sc= -0.0192 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= 0.229 K(o=0.23,f=-4.2!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ -172:sc= -0.0708 (180deg=-0.206) USER MOD Single : A 30 ASN :FLIP amide:sc= -1.43 F(o=-2.5,f=-1.4) USER MOD Single : A 31 THR OG1 : rot 117:sc= -0.546 USER MOD Single : A 33 ASN : amide:sc= -0.288 X(o=-0.29,f=-0.16) USER MOD Single : A 37 GLN :FLIP amide:sc= -3.36! C(o=-4.4!,f=-3.4!) USER MOD Single : A 44 ASN : amide:sc= -0.4 X(o=-0.4,f=-0.096) USER MOD Single : A 45 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 46 ASN : amide:sc= -0.435 K(o=-0.44,f=-3.2!) USER MOD Single : A 48 GLN : amide:sc= -0.544 K(o=-0.54,f=-3.1!) USER MOD Single : A 54 LYS NZ :NH3+ -122:sc= 1.2 (180deg=0.0717) USER MOD Single : A 56 LYS NZ :NH3+ -144:sc= 1.22 (180deg=-0.733) USER MOD Single : A 59 GLN : amide:sc= -0.82 X(o=-0.82,f=-0.7) USER MOD Single : A 64 LYS NZ :NH3+ -179:sc= 0.772 (180deg=0.718) USER MOD Single : A 67 ASN : amide:sc= -0.5 X(o=-0.5,f=0) USER MOD Single : B 108 THR OG1 : rot 180:sc= 0 USER MOD Single : B 123 SER OG : rot 180:sc= 0 USER MOD Single : B 124 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 216 SER OG : rot -140:sc= 0.0357 USER MOD Single : C 217 HIS : no HD1:sc= -2.34! C(o=-2.3!,f=-3.6!) USER MOD Single : C 222 ASN :FLIP amide:sc= -0.0893 F(o=-2.9!,f=-0.089) USER MOD Single : C 227 LYS NZ :NH3+ 138:sc= -0.0357 (180deg=-0.252) USER MOD Single : C 231 THR OG1 : rot 115:sc= -0.604 USER MOD Single : C 233 ASN : amide:sc= 0.0642 X(o=0.064,f=-0.1) USER MOD Single : C 237 GLN : amide:sc= -0.512 K(o=-0.51,f=-3.2!) USER MOD Single : C 244 ASN : amide:sc= -0.0335 X(o=-0.033,f=0) USER MOD Single : C 245 ASN : amide:sc=-0.000297 X(o=-0.0003,f=0) USER MOD Single : C 246 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : C 248 GLN : amide:sc= -1.93 K(o=-1.9,f=-4.8!) USER MOD Single : C 254 LYS NZ :NH3+ 175:sc= 1.37 (180deg=1.33) USER MOD Single : C 256 LYS NZ :NH3+ -121:sc=-0.00228 (180deg=-1.55!) USER MOD Single : C 259 GLN : amide:sc= -3.32 X(o=-3.3,f=-3.4!) USER MOD Single : C 264 LYS NZ :NH3+ -176:sc= 0.559 (180deg=0.486) USER MOD Single : C 267 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 268 LYS NZ :NH3+ 174:sc=-0.000279 (180deg=-0.0448) USER MOD Single : D 308 THR OG1 : rot 180:sc= 0 USER MOD Single : D 321 TYR OH : rot 180:sc= 0 USER MOD Single : D 323 SER OG : rot 180:sc= 0.0314 USER MOD Single : D 324 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 325 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 139 N CYS A 9 -7.238 -8.273 15.143 1.00 23.31 N ATOM 140 CA CYS A 9 -6.616 -8.445 13.870 1.00 23.13 C ATOM 141 C CYS A 9 -7.733 -8.657 12.884 1.00 62.23 C ATOM 142 O CYS A 9 -8.707 -9.346 13.210 1.00 62.42 O ATOM 143 CB CYS A 9 -5.678 -9.661 13.890 1.00 73.31 C ATOM 144 SG CYS A 9 -4.390 -9.598 15.189 1.00 11.43 S ATOM 0 HA CYS A 9 -6.011 -7.579 13.604 1.00 23.13 H new ATOM 0 HB2 CYS A 9 -6.274 -10.563 14.030 1.00 73.31 H new ATOM 0 HB3 CYS A 9 -5.193 -9.747 12.918 1.00 73.31 H new ATOM 149 N PRO A 10 -7.668 -8.043 11.693 1.00 72.35 N ATOM 150 CA PRO A 10 -8.715 -8.193 10.703 1.00 41.34 C ATOM 151 C PRO A 10 -8.915 -9.653 10.341 1.00 54.22 C ATOM 152 O PRO A 10 -10.010 -10.192 10.467 1.00 63.01 O ATOM 153 CB PRO A 10 -8.209 -7.379 9.511 1.00 71.41 C ATOM 154 CG PRO A 10 -6.765 -7.173 9.734 1.00 73.25 C ATOM 155 CD PRO A 10 -6.576 -7.169 11.224 1.00 24.42 C ATOM 0 HA PRO A 10 -9.687 -7.849 11.056 1.00 41.34 H new ATOM 0 HB2 PRO A 10 -8.386 -7.909 8.575 1.00 71.41 H new ATOM 0 HB3 PRO A 10 -8.732 -6.425 9.441 1.00 71.41 H new ATOM 0 HG2 PRO A 10 -6.181 -7.966 9.268 1.00 73.25 H new ATOM 0 HG3 PRO A 10 -6.432 -6.232 9.295 1.00 73.25 H new ATOM 0 HD2 PRO A 10 -5.597 -7.556 11.509 1.00 24.42 H new ATOM 0 HD3 PRO A 10 -6.655 -6.164 11.639 1.00 24.42 H new ATOM 163 N CYS A 11 -7.874 -10.272 9.887 1.00 1.11 N ATOM 164 CA CYS A 11 -7.896 -11.661 9.608 1.00 55.14 C ATOM 165 C CYS A 11 -7.245 -12.467 10.723 1.00 20.21 C ATOM 166 O CYS A 11 -6.126 -12.176 11.139 1.00 1.45 O ATOM 167 CB CYS A 11 -7.250 -11.934 8.271 1.00 51.44 C ATOM 168 SG CYS A 11 -5.575 -11.203 8.062 1.00 25.21 S ATOM 0 H CYS A 11 -6.979 -9.819 9.700 1.00 1.11 H new ATOM 0 HA CYS A 11 -8.936 -11.983 9.556 1.00 55.14 H new ATOM 0 HB2 CYS A 11 -7.181 -13.013 8.130 1.00 51.44 H new ATOM 0 HB3 CYS A 11 -7.899 -11.551 7.484 1.00 51.44 H new ATOM 173 N ARG A 12 -7.968 -13.438 11.233 1.00 64.32 N ATOM 174 CA ARG A 12 -7.410 -14.389 12.174 1.00 41.33 C ATOM 175 C ARG A 12 -6.594 -15.394 11.363 1.00 4.21 C ATOM 176 O ARG A 12 -5.480 -15.757 11.713 1.00 21.51 O ATOM 177 CB ARG A 12 -8.534 -15.092 12.928 1.00 31.42 C ATOM 178 CG ARG A 12 -8.070 -16.156 13.901 1.00 61.50 C ATOM 179 CD ARG A 12 -9.248 -16.833 14.574 1.00 24.44 C ATOM 180 NE ARG A 12 -10.177 -17.421 13.593 1.00 74.25 N ATOM 181 CZ ARG A 12 -10.783 -18.606 13.716 1.00 72.32 C ATOM 182 NH1 ARG A 12 -10.512 -19.401 14.750 1.00 33.35 N ATOM 183 NH2 ARG A 12 -11.639 -19.001 12.784 1.00 20.31 N ATOM 0 H ARG A 12 -8.952 -13.592 11.011 1.00 64.32 H new ATOM 0 HA ARG A 12 -6.779 -13.892 12.911 1.00 41.33 H new ATOM 0 HB2 ARG A 12 -9.110 -14.345 13.474 1.00 31.42 H new ATOM 0 HB3 ARG A 12 -9.209 -15.549 12.204 1.00 31.42 H new ATOM 0 HG2 ARG A 12 -7.472 -16.899 13.374 1.00 61.50 H new ATOM 0 HG3 ARG A 12 -7.425 -15.706 14.656 1.00 61.50 H new ATOM 0 HD2 ARG A 12 -8.885 -17.613 15.243 1.00 24.44 H new ATOM 0 HD3 ARG A 12 -9.781 -16.108 15.189 1.00 24.44 H new ATOM 0 HE ARG A 12 -10.374 -16.880 12.751 1.00 74.25 H new ATOM 0 HH11 ARG A 12 -9.837 -19.107 15.456 1.00 33.35 H new ATOM 0 HH12 ARG A 12 -10.979 -20.304 14.836 1.00 33.35 H new ATOM 0 HH21 ARG A 12 -11.831 -18.402 11.981 1.00 20.31 H new ATOM 0 HH22 ARG A 12 -12.106 -19.904 12.870 1.00 20.31 H new ATOM 197 N PHE A 13 -7.183 -15.828 10.273 1.00 11.15 N ATOM 198 CA PHE A 13 -6.515 -16.640 9.293 1.00 70.54 C ATOM 199 C PHE A 13 -6.449 -15.846 8.019 1.00 35.41 C ATOM 200 O PHE A 13 -7.448 -15.273 7.593 1.00 30.44 O ATOM 201 CB PHE A 13 -7.213 -17.989 9.057 1.00 33.11 C ATOM 202 CG PHE A 13 -7.120 -18.949 10.213 1.00 54.42 C ATOM 203 CD1 PHE A 13 -5.983 -19.722 10.390 1.00 60.30 C ATOM 204 CD2 PHE A 13 -8.159 -19.083 11.115 1.00 21.14 C ATOM 205 CE1 PHE A 13 -5.886 -20.609 11.443 1.00 63.43 C ATOM 206 CE2 PHE A 13 -8.066 -19.971 12.171 1.00 64.24 C ATOM 207 CZ PHE A 13 -6.930 -20.733 12.336 1.00 5.04 C ATOM 0 H PHE A 13 -8.155 -15.621 10.042 1.00 11.15 H new ATOM 0 HA PHE A 13 -5.518 -16.886 9.657 1.00 70.54 H new ATOM 0 HB2 PHE A 13 -8.265 -17.806 8.836 1.00 33.11 H new ATOM 0 HB3 PHE A 13 -6.779 -18.459 8.174 1.00 33.11 H new ATOM 0 HD1 PHE A 13 -5.162 -19.629 9.695 1.00 60.30 H new ATOM 0 HD2 PHE A 13 -9.052 -18.488 10.994 1.00 21.14 H new ATOM 0 HE1 PHE A 13 -4.994 -21.205 11.568 1.00 63.43 H new ATOM 0 HE2 PHE A 13 -8.885 -20.067 12.868 1.00 64.24 H new ATOM 0 HZ PHE A 13 -6.857 -21.425 13.162 1.00 5.04 H new ATOM 217 N PHE A 14 -5.297 -15.798 7.441 1.00 23.22 N ATOM 218 CA PHE A 14 -5.040 -15.002 6.265 1.00 14.21 C ATOM 219 C PHE A 14 -4.404 -15.797 5.182 1.00 55.04 C ATOM 220 O PHE A 14 -3.715 -16.792 5.454 1.00 51.10 O ATOM 221 CB PHE A 14 -4.202 -13.765 6.604 1.00 63.10 C ATOM 222 CG PHE A 14 -3.027 -14.024 7.509 1.00 10.43 C ATOM 223 CD1 PHE A 14 -1.814 -14.473 7.017 1.00 54.42 C ATOM 224 CD2 PHE A 14 -3.148 -13.796 8.875 1.00 72.22 C ATOM 225 CE1 PHE A 14 -0.756 -14.688 7.873 1.00 33.13 C ATOM 226 CE2 PHE A 14 -2.093 -14.014 9.726 1.00 33.51 C ATOM 227 CZ PHE A 14 -0.895 -14.460 9.227 1.00 32.23 C ATOM 0 H PHE A 14 -4.484 -16.318 7.771 1.00 23.22 H new ATOM 0 HA PHE A 14 -6.007 -14.663 5.892 1.00 14.21 H new ATOM 0 HB2 PHE A 14 -3.837 -13.326 5.676 1.00 63.10 H new ATOM 0 HB3 PHE A 14 -4.848 -13.024 7.075 1.00 63.10 H new ATOM 0 HD1 PHE A 14 -1.696 -14.655 5.959 1.00 54.42 H new ATOM 0 HD2 PHE A 14 -4.087 -13.442 9.273 1.00 72.22 H new ATOM 0 HE1 PHE A 14 0.188 -15.037 7.482 1.00 33.13 H new ATOM 0 HE2 PHE A 14 -2.206 -13.835 10.785 1.00 33.51 H new ATOM 0 HZ PHE A 14 -0.062 -14.632 9.893 1.00 32.23 H new ATOM 237 N GLU A 15 -4.655 -15.383 3.964 1.00 13.13 N ATOM 238 CA GLU A 15 -4.140 -15.978 2.806 1.00 4.30 C ATOM 239 C GLU A 15 -2.655 -15.744 2.784 1.00 43.32 C ATOM 240 O GLU A 15 -2.209 -14.612 2.619 1.00 23.52 O ATOM 241 CB GLU A 15 -4.794 -15.321 1.566 1.00 61.20 C ATOM 242 CG GLU A 15 -6.318 -15.548 1.395 1.00 74.34 C ATOM 243 CD GLU A 15 -7.201 -15.018 2.539 1.00 63.41 C ATOM 244 OE1 GLU A 15 -7.591 -13.861 2.526 1.00 23.32 O ATOM 245 OE2 GLU A 15 -7.540 -15.782 3.426 1.00 63.43 O ATOM 0 H GLU A 15 -5.255 -14.582 3.770 1.00 13.13 H new ATOM 0 HA GLU A 15 -4.350 -17.047 2.794 1.00 4.30 H new ATOM 0 HB2 GLU A 15 -4.610 -14.247 1.610 1.00 61.20 H new ATOM 0 HB3 GLU A 15 -4.290 -15.694 0.675 1.00 61.20 H new ATOM 0 HG2 GLU A 15 -6.636 -15.075 0.466 1.00 74.34 H new ATOM 0 HG3 GLU A 15 -6.498 -16.618 1.286 1.00 74.34 H new ATOM 252 N SER A 16 -1.890 -16.790 2.997 1.00 10.10 N ATOM 253 CA SER A 16 -0.476 -16.638 2.993 1.00 61.23 C ATOM 254 C SER A 16 0.026 -16.377 1.576 1.00 53.21 C ATOM 255 O SER A 16 0.111 -15.235 1.175 1.00 30.14 O ATOM 256 CB SER A 16 0.207 -17.802 3.650 1.00 41.43 C ATOM 257 OG SER A 16 -0.353 -18.054 4.929 1.00 22.22 O ATOM 0 H SER A 16 -2.228 -17.736 3.172 1.00 10.10 H new ATOM 0 HA SER A 16 -0.218 -15.765 3.592 1.00 61.23 H new ATOM 0 HB2 SER A 16 0.109 -18.689 3.023 1.00 41.43 H new ATOM 0 HB3 SER A 16 1.273 -17.597 3.748 1.00 41.43 H new ATOM 0 HG SER A 16 0.103 -18.817 5.341 1.00 22.22 H new ATOM 263 N HIS A 17 0.298 -17.403 0.771 1.00 41.14 N ATOM 264 CA HIS A 17 0.704 -17.073 -0.573 1.00 3.30 C ATOM 265 C HIS A 17 -0.464 -17.032 -1.480 1.00 61.23 C ATOM 266 O HIS A 17 -0.891 -18.035 -2.042 1.00 65.21 O ATOM 267 CB HIS A 17 1.931 -17.825 -1.168 1.00 5.12 C ATOM 268 CG HIS A 17 1.790 -19.277 -1.437 1.00 13.33 C ATOM 269 ND1 HIS A 17 1.888 -19.819 -2.695 1.00 64.05 N ATOM 270 CD2 HIS A 17 1.662 -20.296 -0.609 1.00 3.01 C ATOM 271 CE1 HIS A 17 1.831 -21.120 -2.610 1.00 5.11 C ATOM 272 NE2 HIS A 17 1.692 -21.434 -1.350 1.00 42.25 N ATOM 0 H HIS A 17 0.248 -18.394 1.009 1.00 41.14 H new ATOM 0 HA HIS A 17 1.119 -16.070 -0.480 1.00 3.30 H new ATOM 0 HB2 HIS A 17 2.202 -17.336 -2.104 1.00 5.12 H new ATOM 0 HB3 HIS A 17 2.769 -17.691 -0.484 1.00 5.12 H new ATOM 0 HD2 HIS A 17 1.553 -20.236 0.464 1.00 3.01 H new ATOM 0 HE1 HIS A 17 1.889 -21.814 -3.435 1.00 5.11 H new ATOM 0 HE2 HIS A 17 1.618 -22.382 -0.981 1.00 42.25 H new ATOM 281 N VAL A 18 -1.030 -15.874 -1.543 1.00 13.44 N ATOM 282 CA VAL A 18 -2.131 -15.602 -2.381 1.00 73.01 C ATOM 283 C VAL A 18 -1.592 -15.545 -3.812 1.00 53.02 C ATOM 284 O VAL A 18 -0.376 -15.352 -4.018 1.00 12.51 O ATOM 285 CB VAL A 18 -2.749 -14.238 -1.983 1.00 12.22 C ATOM 286 CG1 VAL A 18 -1.903 -13.059 -2.420 1.00 53.20 C ATOM 287 CG2 VAL A 18 -4.196 -14.101 -2.384 1.00 73.35 C ATOM 0 H VAL A 18 -0.724 -15.071 -0.993 1.00 13.44 H new ATOM 0 HA VAL A 18 -2.904 -16.365 -2.293 1.00 73.01 H new ATOM 0 HB VAL A 18 -2.745 -14.223 -0.893 1.00 12.22 H new ATOM 0 HG11 VAL A 18 -2.386 -12.131 -2.114 1.00 53.20 H new ATOM 0 HG12 VAL A 18 -0.919 -13.126 -1.956 1.00 53.20 H new ATOM 0 HG13 VAL A 18 -1.795 -13.071 -3.505 1.00 53.20 H new ATOM 0 HG21 VAL A 18 -4.568 -13.124 -2.076 1.00 73.35 H new ATOM 0 HG22 VAL A 18 -4.285 -14.199 -3.466 1.00 73.35 H new ATOM 0 HG23 VAL A 18 -4.783 -14.881 -1.900 1.00 73.35 H new ATOM 297 N ALA A 19 -2.426 -15.739 -4.776 1.00 62.01 N ATOM 298 CA ALA A 19 -1.968 -15.684 -6.129 1.00 30.43 C ATOM 299 C ALA A 19 -1.858 -14.245 -6.573 1.00 60.34 C ATOM 300 O ALA A 19 -2.836 -13.505 -6.568 1.00 62.03 O ATOM 301 CB ALA A 19 -2.871 -16.475 -7.046 1.00 2.32 C ATOM 0 H ALA A 19 -3.420 -15.936 -4.659 1.00 62.01 H new ATOM 0 HA ALA A 19 -0.980 -16.141 -6.182 1.00 30.43 H new ATOM 0 HB1 ALA A 19 -2.496 -16.414 -8.068 1.00 2.32 H new ATOM 0 HB2 ALA A 19 -2.889 -17.517 -6.728 1.00 2.32 H new ATOM 0 HB3 ALA A 19 -3.880 -16.065 -7.005 1.00 2.32 H new ATOM 307 N ARG A 20 -0.667 -13.854 -6.940 1.00 3.11 N ATOM 308 CA ARG A 20 -0.393 -12.509 -7.376 1.00 0.21 C ATOM 309 C ARG A 20 -1.034 -12.213 -8.718 1.00 63.24 C ATOM 310 O ARG A 20 -1.325 -11.075 -9.048 1.00 31.04 O ATOM 311 CB ARG A 20 1.075 -12.268 -7.403 1.00 12.13 C ATOM 312 CG ARG A 20 1.506 -10.894 -7.867 1.00 64.03 C ATOM 313 CD ARG A 20 2.945 -10.833 -7.661 1.00 13.34 C ATOM 314 NE ARG A 20 3.608 -9.613 -8.112 1.00 33.32 N ATOM 315 CZ ARG A 20 4.838 -9.259 -7.687 1.00 33.15 C ATOM 316 NH1 ARG A 20 5.497 -10.051 -6.848 1.00 51.42 N ATOM 317 NH2 ARG A 20 5.417 -8.154 -8.122 1.00 3.03 N ATOM 0 H ARG A 20 0.149 -14.466 -6.945 1.00 3.11 H new ATOM 0 HA ARG A 20 -0.839 -11.820 -6.659 1.00 0.21 H new ATOM 0 HB2 ARG A 20 1.470 -12.433 -6.401 1.00 12.13 H new ATOM 0 HB3 ARG A 20 1.535 -13.012 -8.054 1.00 12.13 H new ATOM 0 HG2 ARG A 20 1.255 -10.741 -8.917 1.00 64.03 H new ATOM 0 HG3 ARG A 20 0.998 -10.114 -7.301 1.00 64.03 H new ATOM 0 HD2 ARG A 20 3.145 -10.958 -6.597 1.00 13.34 H new ATOM 0 HD3 ARG A 20 3.401 -11.680 -8.173 1.00 13.34 H new ATOM 0 HE ARG A 20 3.123 -9.006 -8.773 1.00 33.32 H new ATOM 0 HH11 ARG A 20 5.072 -10.922 -6.529 1.00 51.42 H new ATOM 0 HH12 ARG A 20 6.428 -9.788 -6.523 1.00 51.42 H new ATOM 0 HH21 ARG A 20 4.933 -7.554 -8.790 1.00 3.03 H new ATOM 0 HH22 ARG A 20 6.348 -7.901 -7.790 1.00 3.03 H new ATOM 331 N ALA A 21 -1.266 -13.248 -9.476 1.00 40.43 N ATOM 332 CA ALA A 21 -1.967 -13.127 -10.737 1.00 43.14 C ATOM 333 C ALA A 21 -3.447 -12.857 -10.482 1.00 3.14 C ATOM 334 O ALA A 21 -4.218 -12.585 -11.404 1.00 40.41 O ATOM 335 CB ALA A 21 -1.786 -14.378 -11.575 1.00 62.43 C ATOM 0 H ALA A 21 -0.978 -14.199 -9.244 1.00 40.43 H new ATOM 0 HA ALA A 21 -1.547 -12.289 -11.293 1.00 43.14 H new ATOM 0 HB1 ALA A 21 -2.321 -14.265 -12.518 1.00 62.43 H new ATOM 0 HB2 ALA A 21 -0.726 -14.531 -11.776 1.00 62.43 H new ATOM 0 HB3 ALA A 21 -2.181 -15.238 -11.035 1.00 62.43 H new ATOM 341 N ASN A 22 -3.838 -12.981 -9.225 1.00 62.12 N ATOM 342 CA ASN A 22 -5.201 -12.804 -8.825 1.00 72.33 C ATOM 343 C ASN A 22 -5.369 -11.535 -7.950 1.00 42.30 C ATOM 344 O ASN A 22 -6.478 -11.182 -7.597 1.00 12.41 O ATOM 345 CB ASN A 22 -5.675 -14.077 -8.078 1.00 23.21 C ATOM 346 CG ASN A 22 -7.159 -14.097 -7.723 1.00 43.13 C ATOM 347 OD1 ASN A 22 -7.995 -13.478 -8.383 1.00 64.52 O ATOM 348 ND2 ASN A 22 -7.507 -14.877 -6.730 1.00 21.04 N ATOM 0 H ASN A 22 -3.206 -13.209 -8.458 1.00 62.12 H new ATOM 0 HA ASN A 22 -5.821 -12.658 -9.709 1.00 72.33 H new ATOM 0 HB2 ASN A 22 -5.452 -14.947 -8.695 1.00 23.21 H new ATOM 0 HB3 ASN A 22 -5.095 -14.180 -7.161 1.00 23.21 H new ATOM 0 HD21 ASN A 22 -8.492 -14.984 -6.486 1.00 21.04 H new ATOM 0 HD22 ASN A 22 -6.793 -15.378 -6.200 1.00 21.04 H new ATOM 355 N VAL A 23 -4.270 -10.835 -7.612 1.00 12.40 N ATOM 356 CA VAL A 23 -4.412 -9.611 -6.788 1.00 50.12 C ATOM 357 C VAL A 23 -4.445 -8.331 -7.663 1.00 31.43 C ATOM 358 O VAL A 23 -3.820 -8.290 -8.710 1.00 14.04 O ATOM 359 CB VAL A 23 -3.265 -9.516 -5.724 1.00 65.43 C ATOM 360 CG1 VAL A 23 -1.945 -9.638 -6.396 1.00 51.23 C ATOM 361 CG2 VAL A 23 -3.301 -8.199 -5.005 1.00 60.21 C ATOM 0 H VAL A 23 -3.316 -11.076 -7.879 1.00 12.40 H new ATOM 0 HA VAL A 23 -5.366 -9.682 -6.266 1.00 50.12 H new ATOM 0 HB VAL A 23 -3.411 -10.324 -5.007 1.00 65.43 H new ATOM 0 HG11 VAL A 23 -1.151 -9.571 -5.653 1.00 51.23 H new ATOM 0 HG12 VAL A 23 -1.884 -10.599 -6.907 1.00 51.23 H new ATOM 0 HG13 VAL A 23 -1.831 -8.833 -7.122 1.00 51.23 H new ATOM 0 HG21 VAL A 23 -2.494 -8.162 -4.273 1.00 60.21 H new ATOM 0 HG22 VAL A 23 -3.177 -7.389 -5.723 1.00 60.21 H new ATOM 0 HG23 VAL A 23 -4.258 -8.089 -4.495 1.00 60.21 H new ATOM 371 N LYS A 24 -5.224 -7.300 -7.248 1.00 31.20 N ATOM 372 CA LYS A 24 -5.202 -6.021 -7.974 1.00 35.54 C ATOM 373 C LYS A 24 -4.311 -4.983 -7.295 1.00 73.13 C ATOM 374 O LYS A 24 -3.821 -4.075 -7.936 1.00 32.14 O ATOM 375 CB LYS A 24 -6.594 -5.414 -8.142 1.00 33.31 C ATOM 376 CG LYS A 24 -7.525 -6.296 -8.906 1.00 54.21 C ATOM 377 CD LYS A 24 -8.794 -5.582 -9.346 1.00 21.55 C ATOM 378 CE LYS A 24 -9.613 -5.047 -8.191 1.00 54.43 C ATOM 379 NZ LYS A 24 -10.813 -4.322 -8.679 1.00 54.31 N ATOM 0 H LYS A 24 -5.851 -7.332 -6.444 1.00 31.20 H new ATOM 0 HA LYS A 24 -4.796 -6.267 -8.955 1.00 35.54 H new ATOM 0 HB2 LYS A 24 -7.018 -5.213 -7.158 1.00 33.31 H new ATOM 0 HB3 LYS A 24 -6.507 -4.456 -8.654 1.00 33.31 H new ATOM 0 HG2 LYS A 24 -7.010 -6.684 -9.785 1.00 54.21 H new ATOM 0 HG3 LYS A 24 -7.793 -7.154 -8.289 1.00 54.21 H new ATOM 0 HD2 LYS A 24 -8.528 -4.757 -10.006 1.00 21.55 H new ATOM 0 HD3 LYS A 24 -9.406 -6.271 -9.928 1.00 21.55 H new ATOM 0 HE2 LYS A 24 -9.919 -5.870 -7.546 1.00 54.43 H new ATOM 0 HE3 LYS A 24 -9.001 -4.378 -7.586 1.00 54.43 H new ATOM 0 HZ1 LYS A 24 -11.357 -3.965 -7.868 1.00 54.31 H new ATOM 0 HZ2 LYS A 24 -10.517 -3.523 -9.275 1.00 54.31 H new ATOM 0 HZ3 LYS A 24 -11.407 -4.969 -9.236 1.00 54.31 H new ATOM 393 N HIS A 25 -4.132 -5.113 -5.990 1.00 32.43 N ATOM 394 CA HIS A 25 -3.366 -4.113 -5.198 1.00 43.12 C ATOM 395 C HIS A 25 -3.253 -4.528 -3.745 1.00 35.40 C ATOM 396 O HIS A 25 -4.002 -5.398 -3.299 1.00 64.22 O ATOM 397 CB HIS A 25 -4.018 -2.706 -5.273 1.00 72.23 C ATOM 398 CG HIS A 25 -5.470 -2.643 -4.846 1.00 13.24 C ATOM 399 ND1 HIS A 25 -6.113 -3.665 -4.176 1.00 64.04 N ATOM 400 CD2 HIS A 25 -6.400 -1.690 -5.030 1.00 22.14 C ATOM 401 CE1 HIS A 25 -7.365 -3.339 -3.979 1.00 21.43 C ATOM 402 NE2 HIS A 25 -7.566 -2.148 -4.481 1.00 61.21 N ATOM 0 H HIS A 25 -4.498 -5.891 -5.442 1.00 32.43 H new ATOM 0 HA HIS A 25 -2.369 -4.067 -5.636 1.00 43.12 H new ATOM 0 HB2 HIS A 25 -3.442 -2.023 -4.648 1.00 72.23 H new ATOM 0 HB3 HIS A 25 -3.941 -2.342 -6.298 1.00 72.23 H new ATOM 0 HD1 HIS A 25 -5.679 -4.539 -3.880 1.00 64.04 H new ATOM 0 HD2 HIS A 25 -6.254 -0.739 -5.520 1.00 22.14 H new ATOM 0 HE1 HIS A 25 -8.107 -3.950 -3.486 1.00 21.43 H new ATOM 411 N LEU A 26 -2.396 -3.843 -3.005 1.00 64.21 N ATOM 412 CA LEU A 26 -2.155 -4.134 -1.595 1.00 2.41 C ATOM 413 C LEU A 26 -2.581 -2.949 -0.735 1.00 64.53 C ATOM 414 O LEU A 26 -2.606 -1.817 -1.199 1.00 41.44 O ATOM 415 CB LEU A 26 -0.652 -4.393 -1.347 1.00 52.13 C ATOM 416 CG LEU A 26 -0.015 -5.585 -2.067 1.00 64.22 C ATOM 417 CD1 LEU A 26 1.467 -5.670 -1.745 1.00 3.12 C ATOM 418 CD2 LEU A 26 -0.707 -6.875 -1.687 1.00 31.14 C ATOM 0 H LEU A 26 -1.843 -3.065 -3.365 1.00 64.21 H new ATOM 0 HA LEU A 26 -2.733 -5.019 -1.331 1.00 2.41 H new ATOM 0 HB2 LEU A 26 -0.104 -3.495 -1.632 1.00 52.13 H new ATOM 0 HB3 LEU A 26 -0.506 -4.529 -0.275 1.00 52.13 H new ATOM 0 HG LEU A 26 -0.132 -5.435 -3.140 1.00 64.22 H new ATOM 0 HD11 LEU A 26 1.904 -6.523 -2.265 1.00 3.12 H new ATOM 0 HD12 LEU A 26 1.963 -4.755 -2.069 1.00 3.12 H new ATOM 0 HD13 LEU A 26 1.599 -5.794 -0.670 1.00 3.12 H new ATOM 0 HD21 LEU A 26 -0.237 -7.708 -2.211 1.00 31.14 H new ATOM 0 HD22 LEU A 26 -0.624 -7.029 -0.611 1.00 31.14 H new ATOM 0 HD23 LEU A 26 -1.759 -6.819 -1.965 1.00 31.14 H new ATOM 430 N LYS A 27 -2.941 -3.230 0.482 1.00 61.31 N ATOM 431 CA LYS A 27 -3.281 -2.246 1.472 1.00 23.45 C ATOM 432 C LYS A 27 -2.632 -2.608 2.778 1.00 74.41 C ATOM 433 O LYS A 27 -2.917 -3.662 3.335 1.00 74.05 O ATOM 434 CB LYS A 27 -4.792 -2.145 1.628 1.00 22.23 C ATOM 435 CG LYS A 27 -5.248 -1.280 2.786 1.00 71.42 C ATOM 436 CD LYS A 27 -6.671 -0.860 2.597 1.00 71.34 C ATOM 437 CE LYS A 27 -7.602 -2.021 2.409 1.00 73.53 C ATOM 438 NZ LYS A 27 -7.708 -2.897 3.610 1.00 25.11 N ATOM 0 H LYS A 27 -3.009 -4.187 0.828 1.00 61.31 H new ATOM 0 HA LYS A 27 -2.914 -1.271 1.152 1.00 23.45 H new ATOM 0 HB2 LYS A 27 -5.214 -1.747 0.705 1.00 22.23 H new ATOM 0 HB3 LYS A 27 -5.199 -3.148 1.758 1.00 22.23 H new ATOM 0 HG2 LYS A 27 -5.146 -1.831 3.721 1.00 71.42 H new ATOM 0 HG3 LYS A 27 -4.610 -0.400 2.863 1.00 71.42 H new ATOM 0 HD2 LYS A 27 -6.991 -0.280 3.463 1.00 71.34 H new ATOM 0 HD3 LYS A 27 -6.738 -0.203 1.730 1.00 71.34 H new ATOM 0 HE2 LYS A 27 -8.593 -1.645 2.155 1.00 73.53 H new ATOM 0 HE3 LYS A 27 -7.261 -2.617 1.563 1.00 73.53 H new ATOM 0 HZ1 LYS A 27 -8.256 -3.748 3.372 1.00 25.11 H new ATOM 0 HZ2 LYS A 27 -6.756 -3.174 3.923 1.00 25.11 H new ATOM 0 HZ3 LYS A 27 -8.187 -2.380 4.375 1.00 25.11 H new ATOM 452 N ILE A 28 -1.770 -1.748 3.271 1.00 40.23 N ATOM 453 CA ILE A 28 -1.060 -2.048 4.486 1.00 3.33 C ATOM 454 C ILE A 28 -1.664 -1.259 5.622 1.00 11.11 C ATOM 455 O ILE A 28 -1.989 -0.058 5.469 1.00 1.01 O ATOM 456 CB ILE A 28 0.452 -1.717 4.410 1.00 11.34 C ATOM 457 CG1 ILE A 28 1.082 -2.290 3.142 1.00 54.53 C ATOM 458 CG2 ILE A 28 1.158 -2.309 5.633 1.00 50.15 C ATOM 459 CD1 ILE A 28 2.564 -1.997 3.030 1.00 3.43 C ATOM 0 H ILE A 28 -1.547 -0.845 2.852 1.00 40.23 H new ATOM 0 HA ILE A 28 -1.153 -3.122 4.646 1.00 3.33 H new ATOM 0 HB ILE A 28 0.566 -0.633 4.390 1.00 11.34 H new ATOM 0 HG12 ILE A 28 0.929 -3.369 3.123 1.00 54.53 H new ATOM 0 HG13 ILE A 28 0.570 -1.880 2.272 1.00 54.53 H new ATOM 0 HG21 ILE A 28 2.222 -2.079 5.585 1.00 50.15 H new ATOM 0 HG22 ILE A 28 0.735 -1.879 6.541 1.00 50.15 H new ATOM 0 HG23 ILE A 28 1.020 -3.390 5.645 1.00 50.15 H new ATOM 0 HD11 ILE A 28 2.952 -2.430 2.108 1.00 3.43 H new ATOM 0 HD12 ILE A 28 2.722 -0.919 3.018 1.00 3.43 H new ATOM 0 HD13 ILE A 28 3.086 -2.431 3.883 1.00 3.43 H new ATOM 471 N LEU A 29 -1.839 -1.916 6.726 1.00 4.04 N ATOM 472 CA LEU A 29 -2.389 -1.330 7.898 1.00 1.31 C ATOM 473 C LEU A 29 -1.813 -2.054 9.094 1.00 42.10 C ATOM 474 O LEU A 29 -1.519 -3.241 9.014 1.00 30.35 O ATOM 475 CB LEU A 29 -3.909 -1.489 7.841 1.00 44.02 C ATOM 476 CG LEU A 29 -4.409 -2.929 7.816 1.00 42.04 C ATOM 477 CD1 LEU A 29 -4.917 -3.373 9.175 1.00 64.15 C ATOM 478 CD2 LEU A 29 -5.425 -3.128 6.743 1.00 74.21 C ATOM 0 H LEU A 29 -1.595 -2.900 6.835 1.00 4.04 H new ATOM 0 HA LEU A 29 -2.148 -0.270 7.974 1.00 1.31 H new ATOM 0 HB2 LEU A 29 -4.344 -0.985 8.704 1.00 44.02 H new ATOM 0 HB3 LEU A 29 -4.279 -0.977 6.953 1.00 44.02 H new ATOM 0 HG LEU A 29 -3.559 -3.569 7.578 1.00 42.04 H new ATOM 0 HD11 LEU A 29 -5.264 -4.404 9.114 1.00 64.15 H new ATOM 0 HD12 LEU A 29 -4.111 -3.304 9.905 1.00 64.15 H new ATOM 0 HD13 LEU A 29 -5.742 -2.730 9.483 1.00 64.15 H new ATOM 0 HD21 LEU A 29 -5.763 -4.164 6.750 1.00 74.21 H new ATOM 0 HD22 LEU A 29 -6.274 -2.468 6.919 1.00 74.21 H new ATOM 0 HD23 LEU A 29 -4.981 -2.897 5.774 1.00 74.21 H new ATOM 490 N ASN A 30 -1.589 -1.366 10.150 1.00 42.41 N ATOM 491 CA ASN A 30 -1.119 -2.015 11.345 1.00 70.21 C ATOM 492 C ASN A 30 -2.067 -1.690 12.468 1.00 50.11 C ATOM 493 O ASN A 30 -2.152 -0.533 12.878 1.00 15.33 O ATOM 494 CB ASN A 30 0.303 -1.563 11.698 1.00 40.15 C ATOM 495 CG ASN A 30 0.907 -2.372 12.837 1.00 0.42 C ATOM 496 OD1 ASN A 30 0.680 -1.954 14.050 1.00 45.55 O flip ATOM 497 ND2 ASN A 30 1.571 -3.374 12.611 1.00 0.04 N flip ATOM 0 H ASN A 30 -1.718 -0.357 10.226 1.00 42.41 H new ATOM 0 HA ASN A 30 -1.086 -3.092 11.182 1.00 70.21 H new ATOM 0 HB2 ASN A 30 0.938 -1.652 10.817 1.00 40.15 H new ATOM 0 HB3 ASN A 30 0.287 -0.509 11.974 1.00 40.15 H new ATOM 0 HD21 ASN A 30 1.730 -3.674 11.649 1.00 0.04 H new ATOM 0 HD22 ASN A 30 1.966 -3.909 13.384 1.00 0.04 H new ATOM 504 N THR A 31 -2.793 -2.666 12.947 1.00 4.33 N ATOM 505 CA THR A 31 -3.702 -2.428 14.033 1.00 51.23 C ATOM 506 C THR A 31 -2.905 -2.489 15.368 1.00 33.43 C ATOM 507 O THR A 31 -1.954 -3.279 15.484 1.00 73.30 O ATOM 508 CB THR A 31 -4.902 -3.438 14.011 1.00 61.11 C ATOM 509 OG1 THR A 31 -4.414 -4.777 14.108 1.00 42.52 O ATOM 510 CG2 THR A 31 -5.704 -3.321 12.701 1.00 43.44 C ATOM 0 H THR A 31 -2.772 -3.626 12.604 1.00 4.33 H new ATOM 0 HA THR A 31 -4.146 -1.438 13.931 1.00 51.23 H new ATOM 0 HB THR A 31 -5.547 -3.199 14.857 1.00 61.11 H new ATOM 0 HG1 THR A 31 -4.748 -5.188 14.933 1.00 42.52 H new ATOM 0 HG21 THR A 31 -6.529 -4.033 12.715 1.00 43.44 H new ATOM 0 HG22 THR A 31 -6.099 -2.310 12.605 1.00 43.44 H new ATOM 0 HG23 THR A 31 -5.052 -3.537 11.855 1.00 43.44 H new ATOM 518 N PRO A 32 -3.255 -1.632 16.372 1.00 50.14 N ATOM 519 CA PRO A 32 -2.518 -1.490 17.682 1.00 65.05 C ATOM 520 C PRO A 32 -2.328 -2.775 18.544 1.00 42.11 C ATOM 521 O PRO A 32 -1.955 -2.676 19.719 1.00 64.22 O ATOM 522 CB PRO A 32 -3.378 -0.480 18.456 1.00 65.01 C ATOM 523 CG PRO A 32 -4.100 0.289 17.410 1.00 60.21 C ATOM 524 CD PRO A 32 -4.389 -0.684 16.306 1.00 14.23 C ATOM 0 HA PRO A 32 -1.488 -1.200 17.472 1.00 65.05 H new ATOM 0 HB2 PRO A 32 -4.074 -0.985 19.126 1.00 65.01 H new ATOM 0 HB3 PRO A 32 -2.761 0.174 19.072 1.00 65.01 H new ATOM 0 HG2 PRO A 32 -5.022 0.715 17.806 1.00 60.21 H new ATOM 0 HG3 PRO A 32 -3.494 1.120 17.049 1.00 60.21 H new ATOM 0 HD2 PRO A 32 -5.343 -1.189 16.456 1.00 14.23 H new ATOM 0 HD3 PRO A 32 -4.440 -0.187 15.337 1.00 14.23 H new ATOM 532 N ASN A 33 -2.553 -3.938 17.991 1.00 55.04 N ATOM 533 CA ASN A 33 -2.375 -5.177 18.747 1.00 51.44 C ATOM 534 C ASN A 33 -1.989 -6.325 17.805 1.00 62.33 C ATOM 535 O ASN A 33 -1.913 -7.485 18.197 1.00 73.22 O ATOM 536 CB ASN A 33 -3.673 -5.488 19.551 1.00 1.22 C ATOM 537 CG ASN A 33 -3.582 -6.698 20.490 1.00 44.24 C ATOM 538 OD1 ASN A 33 -3.149 -6.574 21.645 1.00 14.34 O ATOM 539 ND2 ASN A 33 -4.036 -7.843 20.040 1.00 4.12 N ATOM 0 H ASN A 33 -2.858 -4.067 17.026 1.00 55.04 H new ATOM 0 HA ASN A 33 -1.559 -5.060 19.460 1.00 51.44 H new ATOM 0 HB2 ASN A 33 -3.936 -4.609 20.140 1.00 1.22 H new ATOM 0 HB3 ASN A 33 -4.487 -5.655 18.846 1.00 1.22 H new ATOM 0 HD21 ASN A 33 -4.039 -8.664 20.646 1.00 4.12 H new ATOM 0 HD22 ASN A 33 -4.386 -7.913 19.084 1.00 4.12 H new ATOM 546 N CYS A 34 -1.690 -5.992 16.569 1.00 53.23 N ATOM 547 CA CYS A 34 -1.381 -7.005 15.581 1.00 1.51 C ATOM 548 C CYS A 34 -0.139 -6.632 14.814 1.00 30.42 C ATOM 549 O CYS A 34 0.298 -5.478 14.859 1.00 22.43 O ATOM 550 CB CYS A 34 -2.568 -7.210 14.635 1.00 63.54 C ATOM 551 SG CYS A 34 -4.118 -7.615 15.521 1.00 2.41 S ATOM 0 H CYS A 34 -1.654 -5.033 16.224 1.00 53.23 H new ATOM 0 HA CYS A 34 -1.191 -7.947 16.096 1.00 1.51 H new ATOM 0 HB2 CYS A 34 -2.717 -6.306 14.045 1.00 63.54 H new ATOM 0 HB3 CYS A 34 -2.335 -8.012 13.935 1.00 63.54 H new ATOM 556 N ALA A 35 0.466 -7.615 14.162 1.00 25.32 N ATOM 557 CA ALA A 35 1.636 -7.389 13.327 1.00 10.22 C ATOM 558 C ALA A 35 1.222 -6.636 12.058 1.00 22.32 C ATOM 559 O ALA A 35 0.075 -6.178 11.951 1.00 22.52 O ATOM 560 CB ALA A 35 2.281 -8.729 12.968 1.00 52.44 C ATOM 0 H ALA A 35 0.161 -8.588 14.197 1.00 25.32 H new ATOM 0 HA ALA A 35 2.363 -6.787 13.872 1.00 10.22 H new ATOM 0 HB1 ALA A 35 3.157 -8.555 12.343 1.00 52.44 H new ATOM 0 HB2 ALA A 35 2.583 -9.244 13.880 1.00 52.44 H new ATOM 0 HB3 ALA A 35 1.564 -9.344 12.425 1.00 52.44 H new ATOM 566 N CYS A 36 2.132 -6.508 11.105 1.00 55.44 N ATOM 567 CA CYS A 36 1.824 -5.825 9.862 1.00 42.23 C ATOM 568 C CYS A 36 0.670 -6.560 9.178 1.00 44.50 C ATOM 569 O CYS A 36 0.703 -7.770 9.029 1.00 41.44 O ATOM 570 CB CYS A 36 3.070 -5.781 8.947 1.00 24.04 C ATOM 571 SG CYS A 36 2.848 -4.838 7.393 1.00 24.11 S ATOM 0 H CYS A 36 3.085 -6.867 11.169 1.00 55.44 H new ATOM 0 HA CYS A 36 1.530 -4.795 10.066 1.00 42.23 H new ATOM 0 HB2 CYS A 36 3.898 -5.345 9.505 1.00 24.04 H new ATOM 0 HB3 CYS A 36 3.357 -6.803 8.698 1.00 24.04 H new ATOM 576 N GLN A 37 -0.363 -5.858 8.835 1.00 44.23 N ATOM 577 CA GLN A 37 -1.497 -6.478 8.205 1.00 51.12 C ATOM 578 C GLN A 37 -1.614 -5.966 6.784 1.00 23.01 C ATOM 579 O GLN A 37 -1.931 -4.793 6.557 1.00 12.30 O ATOM 580 CB GLN A 37 -2.811 -6.173 8.956 1.00 73.31 C ATOM 581 CG GLN A 37 -2.899 -6.485 10.483 1.00 10.21 C ATOM 582 CD GLN A 37 -2.702 -7.951 10.899 1.00 4.15 C ATOM 583 OE1 GLN A 37 -1.771 -8.621 10.326 1.00 32.11 O flip ATOM 584 NE2 GLN A 37 -3.327 -8.416 11.849 1.00 61.13 N flip ATOM 0 H GLN A 37 -0.450 -4.852 8.979 1.00 44.23 H new ATOM 0 HA GLN A 37 -1.341 -7.557 8.220 1.00 51.12 H new ATOM 0 HB2 GLN A 37 -3.027 -5.113 8.824 1.00 73.31 H new ATOM 0 HB3 GLN A 37 -3.609 -6.726 8.461 1.00 73.31 H new ATOM 0 HG2 GLN A 37 -2.151 -5.882 10.997 1.00 10.21 H new ATOM 0 HG3 GLN A 37 -3.875 -6.157 10.842 1.00 10.21 H new ATOM 0 HE21 GLN A 37 -4.064 -7.868 12.292 1.00 61.13 H new ATOM 0 HE22 GLN A 37 -3.109 -9.350 12.195 1.00 61.13 H new ATOM 593 N ILE A 38 -1.327 -6.809 5.839 1.00 32.22 N ATOM 594 CA ILE A 38 -1.463 -6.444 4.461 1.00 41.11 C ATOM 595 C ILE A 38 -2.693 -7.109 3.904 1.00 23.13 C ATOM 596 O ILE A 38 -2.835 -8.309 3.973 1.00 34.11 O ATOM 597 CB ILE A 38 -0.210 -6.813 3.623 1.00 40.21 C ATOM 598 CG1 ILE A 38 1.015 -6.069 4.178 1.00 14.04 C ATOM 599 CG2 ILE A 38 -0.427 -6.471 2.143 1.00 24.13 C ATOM 600 CD1 ILE A 38 2.299 -6.319 3.419 1.00 62.34 C ATOM 0 H ILE A 38 -0.995 -7.760 5.998 1.00 32.22 H new ATOM 0 HA ILE A 38 -1.562 -5.360 4.400 1.00 41.11 H new ATOM 0 HB ILE A 38 -0.037 -7.887 3.695 1.00 40.21 H new ATOM 0 HG12 ILE A 38 0.807 -4.999 4.173 1.00 14.04 H new ATOM 0 HG13 ILE A 38 1.160 -6.360 5.218 1.00 14.04 H new ATOM 0 HG21 ILE A 38 0.463 -6.738 1.574 1.00 24.13 H new ATOM 0 HG22 ILE A 38 -1.282 -7.029 1.762 1.00 24.13 H new ATOM 0 HG23 ILE A 38 -0.617 -5.403 2.040 1.00 24.13 H new ATOM 0 HD11 ILE A 38 3.110 -5.755 3.880 1.00 62.34 H new ATOM 0 HD12 ILE A 38 2.536 -7.383 3.446 1.00 62.34 H new ATOM 0 HD13 ILE A 38 2.178 -6.000 2.384 1.00 62.34 H new ATOM 612 N VAL A 39 -3.583 -6.324 3.404 1.00 63.33 N ATOM 613 CA VAL A 39 -4.824 -6.808 2.864 1.00 75.44 C ATOM 614 C VAL A 39 -4.849 -6.511 1.363 1.00 5.11 C ATOM 615 O VAL A 39 -4.423 -5.441 0.944 1.00 41.40 O ATOM 616 CB VAL A 39 -6.018 -6.121 3.587 1.00 75.31 C ATOM 617 CG1 VAL A 39 -7.337 -6.616 3.071 1.00 4.32 C ATOM 618 CG2 VAL A 39 -5.935 -6.341 5.090 1.00 21.25 C ATOM 0 H VAL A 39 -3.476 -5.311 3.354 1.00 63.33 H new ATOM 0 HA VAL A 39 -4.912 -7.883 3.019 1.00 75.44 H new ATOM 0 HB VAL A 39 -5.951 -5.053 3.378 1.00 75.31 H new ATOM 0 HG11 VAL A 39 -8.147 -6.113 3.600 1.00 4.32 H new ATOM 0 HG12 VAL A 39 -7.413 -6.404 2.005 1.00 4.32 H new ATOM 0 HG13 VAL A 39 -7.411 -7.691 3.233 1.00 4.32 H new ATOM 0 HG21 VAL A 39 -6.779 -5.852 5.576 1.00 21.25 H new ATOM 0 HG22 VAL A 39 -5.962 -7.410 5.303 1.00 21.25 H new ATOM 0 HG23 VAL A 39 -5.004 -5.919 5.469 1.00 21.25 H new ATOM 628 N ALA A 40 -5.328 -7.437 0.566 1.00 71.42 N ATOM 629 CA ALA A 40 -5.308 -7.281 -0.874 1.00 2.33 C ATOM 630 C ALA A 40 -6.610 -7.748 -1.485 1.00 20.42 C ATOM 631 O ALA A 40 -7.095 -8.809 -1.170 1.00 13.15 O ATOM 632 CB ALA A 40 -4.150 -8.076 -1.462 1.00 31.42 C ATOM 0 H ALA A 40 -5.739 -8.312 0.891 1.00 71.42 H new ATOM 0 HA ALA A 40 -5.179 -6.223 -1.104 1.00 2.33 H new ATOM 0 HB1 ALA A 40 -4.139 -7.956 -2.545 1.00 31.42 H new ATOM 0 HB2 ALA A 40 -3.210 -7.711 -1.047 1.00 31.42 H new ATOM 0 HB3 ALA A 40 -4.271 -9.131 -1.215 1.00 31.42 H new ATOM 638 N ARG A 41 -7.174 -6.980 -2.377 1.00 2.44 N ATOM 639 CA ARG A 41 -8.399 -7.429 -2.976 1.00 50.22 C ATOM 640 C ARG A 41 -8.110 -8.092 -4.298 1.00 41.33 C ATOM 641 O ARG A 41 -7.337 -7.554 -5.136 1.00 51.45 O ATOM 642 CB ARG A 41 -9.467 -6.329 -3.142 1.00 61.12 C ATOM 643 CG ARG A 41 -10.812 -6.937 -3.539 1.00 73.53 C ATOM 644 CD ARG A 41 -11.933 -5.933 -3.728 1.00 14.11 C ATOM 645 NE ARG A 41 -13.218 -6.642 -3.935 1.00 25.01 N ATOM 646 CZ ARG A 41 -14.002 -6.560 -5.020 1.00 74.31 C ATOM 647 NH1 ARG A 41 -13.701 -5.737 -6.010 1.00 71.42 N ATOM 648 NH2 ARG A 41 -15.103 -7.297 -5.094 1.00 40.30 N ATOM 0 H ARG A 41 -6.823 -6.077 -2.695 1.00 2.44 H new ATOM 0 HA ARG A 41 -8.831 -8.148 -2.280 1.00 50.22 H new ATOM 0 HB2 ARG A 41 -9.574 -5.775 -2.209 1.00 61.12 H new ATOM 0 HB3 ARG A 41 -9.146 -5.616 -3.901 1.00 61.12 H new ATOM 0 HG2 ARG A 41 -10.683 -7.495 -4.466 1.00 73.53 H new ATOM 0 HG3 ARG A 41 -11.111 -7.654 -2.774 1.00 73.53 H new ATOM 0 HD2 ARG A 41 -12.003 -5.284 -2.855 1.00 14.11 H new ATOM 0 HD3 ARG A 41 -11.719 -5.293 -4.584 1.00 14.11 H new ATOM 0 HE ARG A 41 -13.536 -7.250 -3.181 1.00 25.01 H new ATOM 0 HH11 ARG A 41 -12.865 -5.156 -5.954 1.00 71.42 H new ATOM 0 HH12 ARG A 41 -14.305 -5.683 -6.830 1.00 71.42 H new ATOM 0 HH21 ARG A 41 -15.350 -7.923 -4.327 1.00 40.30 H new ATOM 0 HH22 ARG A 41 -15.702 -7.238 -5.917 1.00 40.30 H new ATOM 662 N LEU A 42 -8.685 -9.266 -4.456 1.00 75.31 N ATOM 663 CA LEU A 42 -8.570 -10.077 -5.641 1.00 43.32 C ATOM 664 C LEU A 42 -9.175 -9.372 -6.849 1.00 32.32 C ATOM 665 O LEU A 42 -9.941 -8.407 -6.709 1.00 72.10 O ATOM 666 CB LEU A 42 -9.292 -11.416 -5.417 1.00 54.01 C ATOM 667 CG LEU A 42 -8.805 -12.251 -4.234 1.00 25.25 C ATOM 668 CD1 LEU A 42 -9.679 -13.482 -4.050 1.00 71.23 C ATOM 669 CD2 LEU A 42 -7.348 -12.645 -4.414 1.00 73.12 C ATOM 0 H LEU A 42 -9.265 -9.693 -3.734 1.00 75.31 H new ATOM 0 HA LEU A 42 -7.512 -10.250 -5.837 1.00 43.32 H new ATOM 0 HB2 LEU A 42 -10.355 -11.215 -5.281 1.00 54.01 H new ATOM 0 HB3 LEU A 42 -9.195 -12.014 -6.323 1.00 54.01 H new ATOM 0 HG LEU A 42 -8.881 -11.642 -3.333 1.00 25.25 H new ATOM 0 HD11 LEU A 42 -9.315 -14.063 -3.203 1.00 71.23 H new ATOM 0 HD12 LEU A 42 -10.708 -13.173 -3.864 1.00 71.23 H new ATOM 0 HD13 LEU A 42 -9.641 -14.093 -4.952 1.00 71.23 H new ATOM 0 HD21 LEU A 42 -7.023 -13.239 -3.560 1.00 73.12 H new ATOM 0 HD22 LEU A 42 -7.240 -13.232 -5.326 1.00 73.12 H new ATOM 0 HD23 LEU A 42 -6.734 -11.747 -4.486 1.00 73.12 H new ATOM 681 N LYS A 43 -8.816 -9.854 -8.007 1.00 53.35 N ATOM 682 CA LYS A 43 -9.307 -9.342 -9.255 1.00 21.53 C ATOM 683 C LYS A 43 -10.798 -9.581 -9.426 1.00 63.31 C ATOM 684 O LYS A 43 -11.588 -8.661 -9.254 1.00 1.30 O ATOM 685 CB LYS A 43 -8.471 -9.889 -10.412 1.00 63.32 C ATOM 686 CG LYS A 43 -7.059 -9.308 -10.434 1.00 15.31 C ATOM 687 CD LYS A 43 -6.122 -10.021 -11.386 1.00 52.12 C ATOM 688 CE LYS A 43 -6.660 -10.096 -12.797 1.00 11.22 C ATOM 689 NZ LYS A 43 -5.696 -10.744 -13.704 1.00 14.40 N ATOM 0 H LYS A 43 -8.161 -10.629 -8.111 1.00 53.35 H new ATOM 0 HA LYS A 43 -9.192 -8.258 -9.255 1.00 21.53 H new ATOM 0 HB2 LYS A 43 -8.413 -10.975 -10.334 1.00 63.32 H new ATOM 0 HB3 LYS A 43 -8.969 -9.663 -11.355 1.00 63.32 H new ATOM 0 HG2 LYS A 43 -7.113 -8.255 -10.712 1.00 15.31 H new ATOM 0 HG3 LYS A 43 -6.642 -9.351 -9.428 1.00 15.31 H new ATOM 0 HD2 LYS A 43 -5.161 -9.506 -11.396 1.00 52.12 H new ATOM 0 HD3 LYS A 43 -5.938 -11.031 -11.019 1.00 52.12 H new ATOM 0 HE2 LYS A 43 -7.598 -10.652 -12.802 1.00 11.22 H new ATOM 0 HE3 LYS A 43 -6.883 -9.092 -13.157 1.00 11.22 H new ATOM 0 HZ1 LYS A 43 -6.210 -11.261 -14.446 1.00 14.40 H new ATOM 0 HZ2 LYS A 43 -5.091 -10.020 -14.142 1.00 14.40 H new ATOM 0 HZ3 LYS A 43 -5.105 -11.409 -13.165 1.00 14.40 H new ATOM 703 N ASN A 44 -11.197 -10.795 -9.735 1.00 71.33 N ATOM 704 CA ASN A 44 -12.624 -11.075 -9.888 1.00 1.01 C ATOM 705 C ASN A 44 -12.891 -12.553 -9.583 1.00 34.00 C ATOM 706 O ASN A 44 -13.890 -13.129 -9.998 1.00 41.23 O ATOM 707 CB ASN A 44 -13.083 -10.686 -11.327 1.00 74.04 C ATOM 708 CG ASN A 44 -14.610 -10.644 -11.506 1.00 40.24 C ATOM 709 OD1 ASN A 44 -15.243 -9.623 -11.246 1.00 54.15 O ATOM 710 ND2 ASN A 44 -15.197 -11.712 -11.997 1.00 1.42 N ATOM 0 H ASN A 44 -10.578 -11.592 -9.884 1.00 71.33 H new ATOM 0 HA ASN A 44 -13.202 -10.478 -9.183 1.00 1.01 H new ATOM 0 HB2 ASN A 44 -12.671 -9.708 -11.577 1.00 74.04 H new ATOM 0 HB3 ASN A 44 -12.664 -11.399 -12.036 1.00 74.04 H new ATOM 0 HD21 ASN A 44 -16.202 -11.707 -12.171 1.00 1.42 H new ATOM 0 HD22 ASN A 44 -14.648 -12.546 -12.204 1.00 1.42 H new ATOM 717 N ASN A 45 -11.996 -13.161 -8.807 1.00 31.45 N ATOM 718 CA ASN A 45 -12.139 -14.574 -8.452 1.00 30.13 C ATOM 719 C ASN A 45 -13.360 -14.788 -7.583 1.00 60.40 C ATOM 720 O ASN A 45 -14.198 -15.634 -7.879 1.00 72.32 O ATOM 721 CB ASN A 45 -10.907 -15.116 -7.722 1.00 1.54 C ATOM 722 CG ASN A 45 -11.013 -16.625 -7.442 1.00 53.20 C ATOM 723 OD1 ASN A 45 -11.628 -17.374 -8.209 1.00 74.10 O ATOM 724 ND2 ASN A 45 -10.445 -17.069 -6.350 1.00 33.24 N ATOM 0 H ASN A 45 -11.172 -12.705 -8.415 1.00 31.45 H new ATOM 0 HA ASN A 45 -12.250 -15.119 -9.389 1.00 30.13 H new ATOM 0 HB2 ASN A 45 -10.017 -14.921 -8.321 1.00 1.54 H new ATOM 0 HB3 ASN A 45 -10.781 -14.582 -6.780 1.00 1.54 H new ATOM 0 HD21 ASN A 45 -10.503 -18.059 -6.111 1.00 33.24 H new ATOM 0 HD22 ASN A 45 -9.944 -16.425 -5.737 1.00 33.24 H new ATOM 731 N ASN A 46 -13.476 -14.001 -6.519 1.00 4.43 N ATOM 732 CA ASN A 46 -14.595 -14.146 -5.592 1.00 34.33 C ATOM 733 C ASN A 46 -14.622 -13.009 -4.587 1.00 64.45 C ATOM 734 O ASN A 46 -15.561 -12.216 -4.560 1.00 61.01 O ATOM 735 CB ASN A 46 -14.505 -15.501 -4.823 1.00 62.03 C ATOM 736 CG ASN A 46 -15.704 -15.806 -3.887 1.00 64.23 C ATOM 737 OD1 ASN A 46 -16.373 -14.914 -3.361 1.00 25.25 O ATOM 738 ND2 ASN A 46 -15.964 -17.067 -3.672 1.00 32.34 N ATOM 0 H ASN A 46 -12.816 -13.262 -6.277 1.00 4.43 H new ATOM 0 HA ASN A 46 -15.511 -14.123 -6.183 1.00 34.33 H new ATOM 0 HB2 ASN A 46 -14.417 -16.309 -5.550 1.00 62.03 H new ATOM 0 HB3 ASN A 46 -13.591 -15.505 -4.230 1.00 62.03 H new ATOM 0 HD21 ASN A 46 -16.734 -17.331 -3.058 1.00 32.34 H new ATOM 0 HD22 ASN A 46 -15.397 -17.788 -4.118 1.00 32.34 H new ATOM 745 N ARG A 47 -13.578 -12.904 -3.789 1.00 32.52 N ATOM 746 CA ARG A 47 -13.622 -12.026 -2.643 1.00 4.21 C ATOM 747 C ARG A 47 -12.425 -11.098 -2.502 1.00 3.02 C ATOM 748 O ARG A 47 -11.631 -10.918 -3.416 1.00 74.45 O ATOM 749 CB ARG A 47 -13.738 -12.859 -1.383 1.00 21.14 C ATOM 750 CG ARG A 47 -12.642 -13.880 -1.201 1.00 34.02 C ATOM 751 CD ARG A 47 -12.623 -14.299 0.221 1.00 42.23 C ATOM 752 NE ARG A 47 -11.695 -15.397 0.499 1.00 73.35 N ATOM 753 CZ ARG A 47 -10.604 -15.303 1.289 1.00 62.42 C ATOM 754 NH1 ARG A 47 -10.228 -14.119 1.797 1.00 4.40 N ATOM 755 NH2 ARG A 47 -9.889 -16.393 1.559 1.00 23.11 N ATOM 0 H ARG A 47 -12.701 -13.410 -3.912 1.00 32.52 H new ATOM 0 HA ARG A 47 -14.490 -11.384 -2.796 1.00 4.21 H new ATOM 0 HB2 ARG A 47 -13.741 -12.192 -0.521 1.00 21.14 H new ATOM 0 HB3 ARG A 47 -14.699 -13.374 -1.391 1.00 21.14 H new ATOM 0 HG2 ARG A 47 -12.814 -14.741 -1.847 1.00 34.02 H new ATOM 0 HG3 ARG A 47 -11.678 -13.456 -1.484 1.00 34.02 H new ATOM 0 HD2 ARG A 47 -12.354 -13.443 0.839 1.00 42.23 H new ATOM 0 HD3 ARG A 47 -13.628 -14.601 0.515 1.00 42.23 H new ATOM 0 HE ARG A 47 -11.887 -16.299 0.064 1.00 73.35 H new ATOM 0 HH11 ARG A 47 -10.768 -13.279 1.587 1.00 4.40 H new ATOM 0 HH12 ARG A 47 -9.402 -14.059 2.393 1.00 4.40 H new ATOM 0 HH21 ARG A 47 -10.166 -17.294 1.170 1.00 23.11 H new ATOM 0 HH22 ARG A 47 -9.064 -16.327 2.155 1.00 23.11 H new ATOM 769 N GLN A 48 -12.361 -10.503 -1.337 1.00 1.11 N ATOM 770 CA GLN A 48 -11.322 -9.626 -0.891 1.00 62.11 C ATOM 771 C GLN A 48 -10.474 -10.507 0.078 1.00 61.53 C ATOM 772 O GLN A 48 -11.051 -11.298 0.846 1.00 31.52 O ATOM 773 CB GLN A 48 -12.063 -8.463 -0.166 1.00 23.15 C ATOM 774 CG GLN A 48 -11.308 -7.187 0.160 1.00 1.51 C ATOM 775 CD GLN A 48 -10.178 -7.376 1.089 1.00 0.12 C ATOM 776 OE1 GLN A 48 -9.073 -7.586 0.667 1.00 21.02 O ATOM 777 NE2 GLN A 48 -10.460 -7.325 2.369 1.00 54.40 N ATOM 0 H GLN A 48 -13.086 -10.632 -0.631 1.00 1.11 H new ATOM 0 HA GLN A 48 -10.672 -9.200 -1.656 1.00 62.11 H new ATOM 0 HB2 GLN A 48 -12.920 -8.188 -0.780 1.00 23.15 H new ATOM 0 HB3 GLN A 48 -12.456 -8.859 0.770 1.00 23.15 H new ATOM 0 HG2 GLN A 48 -10.934 -6.752 -0.767 1.00 1.51 H new ATOM 0 HG3 GLN A 48 -12.003 -6.467 0.592 1.00 1.51 H new ATOM 0 HE21 GLN A 48 -11.416 -7.143 2.674 1.00 54.40 H new ATOM 0 HE22 GLN A 48 -9.723 -7.467 3.060 1.00 54.40 H new ATOM 786 N VAL A 49 -9.149 -10.416 0.026 1.00 22.03 N ATOM 787 CA VAL A 49 -8.300 -11.327 0.806 1.00 73.11 C ATOM 788 C VAL A 49 -7.284 -10.611 1.708 1.00 53.24 C ATOM 789 O VAL A 49 -6.917 -9.465 1.483 1.00 40.55 O ATOM 790 CB VAL A 49 -7.587 -12.414 -0.071 1.00 23.21 C ATOM 791 CG1 VAL A 49 -8.582 -13.305 -0.768 1.00 24.01 C ATOM 792 CG2 VAL A 49 -6.643 -11.817 -1.077 1.00 50.32 C ATOM 0 H VAL A 49 -8.640 -9.734 -0.537 1.00 22.03 H new ATOM 0 HA VAL A 49 -9.003 -11.840 1.462 1.00 73.11 H new ATOM 0 HB VAL A 49 -6.999 -13.017 0.621 1.00 23.21 H new ATOM 0 HG11 VAL A 49 -8.051 -14.045 -1.366 1.00 24.01 H new ATOM 0 HG12 VAL A 49 -9.198 -13.812 -0.026 1.00 24.01 H new ATOM 0 HG13 VAL A 49 -9.218 -12.703 -1.417 1.00 24.01 H new ATOM 0 HG21 VAL A 49 -6.177 -12.614 -1.657 1.00 50.32 H new ATOM 0 HG22 VAL A 49 -7.194 -11.156 -1.746 1.00 50.32 H new ATOM 0 HG23 VAL A 49 -5.872 -11.247 -0.559 1.00 50.32 H new ATOM 802 N CYS A 50 -6.855 -11.291 2.719 1.00 4.23 N ATOM 803 CA CYS A 50 -5.909 -10.755 3.668 1.00 63.13 C ATOM 804 C CYS A 50 -4.607 -11.527 3.467 1.00 21.23 C ATOM 805 O CYS A 50 -4.642 -12.728 3.291 1.00 21.30 O ATOM 806 CB CYS A 50 -6.466 -10.953 5.066 1.00 41.21 C ATOM 807 SG CYS A 50 -5.667 -9.975 6.415 1.00 13.34 S ATOM 0 H CYS A 50 -7.149 -12.247 2.921 1.00 4.23 H new ATOM 0 HA CYS A 50 -5.729 -9.689 3.528 1.00 63.13 H new ATOM 0 HB2 CYS A 50 -7.528 -10.707 5.049 1.00 41.21 H new ATOM 0 HB3 CYS A 50 -6.388 -12.010 5.318 1.00 41.21 H new ATOM 812 N ILE A 51 -3.481 -10.851 3.487 1.00 11.12 N ATOM 813 CA ILE A 51 -2.216 -11.462 3.072 1.00 44.41 C ATOM 814 C ILE A 51 -1.239 -11.634 4.238 1.00 10.44 C ATOM 815 O ILE A 51 -1.268 -10.863 5.209 1.00 52.02 O ATOM 816 CB ILE A 51 -1.514 -10.551 2.000 1.00 53.42 C ATOM 817 CG1 ILE A 51 -2.471 -10.169 0.881 1.00 72.11 C ATOM 818 CG2 ILE A 51 -0.278 -11.211 1.409 1.00 62.42 C ATOM 819 CD1 ILE A 51 -3.138 -11.342 0.212 1.00 15.24 C ATOM 0 H ILE A 51 -3.404 -9.878 3.784 1.00 11.12 H new ATOM 0 HA ILE A 51 -2.462 -12.444 2.669 1.00 44.41 H new ATOM 0 HB ILE A 51 -1.202 -9.648 2.524 1.00 53.42 H new ATOM 0 HG12 ILE A 51 -3.240 -9.510 1.285 1.00 72.11 H new ATOM 0 HG13 ILE A 51 -1.925 -9.599 0.130 1.00 72.11 H new ATOM 0 HG21 ILE A 51 0.174 -10.545 0.674 1.00 62.42 H new ATOM 0 HG22 ILE A 51 0.440 -11.415 2.203 1.00 62.42 H new ATOM 0 HG23 ILE A 51 -0.561 -12.146 0.926 1.00 62.42 H new ATOM 0 HD11 ILE A 51 -3.803 -10.983 -0.573 1.00 15.24 H new ATOM 0 HD12 ILE A 51 -2.379 -11.992 -0.224 1.00 15.24 H new ATOM 0 HD13 ILE A 51 -3.715 -11.901 0.949 1.00 15.24 H new ATOM 831 N ASP A 52 -0.385 -12.657 4.140 1.00 54.33 N ATOM 832 CA ASP A 52 0.732 -12.825 5.065 1.00 23.43 C ATOM 833 C ASP A 52 1.807 -11.825 4.656 1.00 45.32 C ATOM 834 O ASP A 52 2.347 -11.909 3.552 1.00 41.35 O ATOM 835 CB ASP A 52 1.326 -14.245 4.991 1.00 54.31 C ATOM 836 CG ASP A 52 2.434 -14.473 6.013 1.00 23.13 C ATOM 837 OD1 ASP A 52 3.559 -13.997 5.818 1.00 54.50 O ATOM 838 OD2 ASP A 52 2.168 -15.115 7.058 1.00 24.11 O ATOM 0 H ASP A 52 -0.449 -13.382 3.425 1.00 54.33 H new ATOM 0 HA ASP A 52 0.382 -12.664 6.085 1.00 23.43 H new ATOM 0 HB2 ASP A 52 0.533 -14.975 5.152 1.00 54.31 H new ATOM 0 HB3 ASP A 52 1.720 -14.418 3.989 1.00 54.31 H new ATOM 843 N PRO A 53 2.134 -10.866 5.515 1.00 45.01 N ATOM 844 CA PRO A 53 3.083 -9.803 5.175 1.00 43.11 C ATOM 845 C PRO A 53 4.547 -10.236 5.204 1.00 71.34 C ATOM 846 O PRO A 53 5.427 -9.398 5.138 1.00 44.02 O ATOM 847 CB PRO A 53 2.828 -8.764 6.254 1.00 21.41 C ATOM 848 CG PRO A 53 2.399 -9.559 7.430 1.00 71.33 C ATOM 849 CD PRO A 53 1.607 -10.714 6.883 1.00 23.40 C ATOM 0 HA PRO A 53 2.931 -9.457 4.153 1.00 43.11 H new ATOM 0 HB2 PRO A 53 3.726 -8.186 6.470 1.00 21.41 H new ATOM 0 HB3 PRO A 53 2.058 -8.055 5.950 1.00 21.41 H new ATOM 0 HG2 PRO A 53 3.260 -9.911 7.998 1.00 71.33 H new ATOM 0 HG3 PRO A 53 1.794 -8.957 8.108 1.00 71.33 H new ATOM 0 HD2 PRO A 53 1.753 -11.618 7.474 1.00 23.40 H new ATOM 0 HD3 PRO A 53 0.537 -10.504 6.881 1.00 23.40 H new ATOM 857 N LYS A 54 4.814 -11.529 5.326 1.00 62.44 N ATOM 858 CA LYS A 54 6.175 -11.978 5.314 1.00 14.44 C ATOM 859 C LYS A 54 6.464 -12.788 4.052 1.00 62.14 C ATOM 860 O LYS A 54 7.523 -13.417 3.940 1.00 13.14 O ATOM 861 CB LYS A 54 6.559 -12.783 6.576 1.00 14.44 C ATOM 862 CG LYS A 54 6.326 -12.082 7.901 1.00 30.11 C ATOM 863 CD LYS A 54 4.926 -12.285 8.337 1.00 33.51 C ATOM 864 CE LYS A 54 4.725 -13.704 8.859 1.00 2.51 C ATOM 865 NZ LYS A 54 3.319 -13.997 9.166 1.00 3.31 N ATOM 0 H LYS A 54 4.113 -12.263 5.432 1.00 62.44 H new ATOM 0 HA LYS A 54 6.796 -11.082 5.316 1.00 14.44 H new ATOM 0 HB2 LYS A 54 5.994 -13.715 6.575 1.00 14.44 H new ATOM 0 HB3 LYS A 54 7.614 -13.049 6.508 1.00 14.44 H new ATOM 0 HG2 LYS A 54 7.011 -12.471 8.654 1.00 30.11 H new ATOM 0 HG3 LYS A 54 6.534 -11.017 7.801 1.00 30.11 H new ATOM 0 HD2 LYS A 54 4.675 -11.566 9.117 1.00 33.51 H new ATOM 0 HD3 LYS A 54 4.249 -12.100 7.503 1.00 33.51 H new ATOM 0 HE2 LYS A 54 5.087 -14.415 8.117 1.00 2.51 H new ATOM 0 HE3 LYS A 54 5.327 -13.846 9.757 1.00 2.51 H new ATOM 0 HZ1 LYS A 54 3.233 -14.276 10.164 1.00 3.31 H new ATOM 0 HZ2 LYS A 54 2.742 -13.149 8.992 1.00 3.31 H new ATOM 0 HZ3 LYS A 54 2.986 -14.773 8.559 1.00 3.31 H new ATOM 879 N LEU A 55 5.512 -12.777 3.106 1.00 3.53 N ATOM 880 CA LEU A 55 5.693 -13.432 1.801 1.00 23.42 C ATOM 881 C LEU A 55 6.907 -12.919 1.101 1.00 13.52 C ATOM 882 O LEU A 55 7.169 -11.732 1.114 1.00 65.10 O ATOM 883 CB LEU A 55 4.524 -13.175 0.877 1.00 15.31 C ATOM 884 CG LEU A 55 3.229 -13.846 1.189 1.00 33.35 C ATOM 885 CD1 LEU A 55 2.192 -13.358 0.208 1.00 12.33 C ATOM 886 CD2 LEU A 55 3.394 -15.340 1.054 1.00 12.14 C ATOM 0 H LEU A 55 4.607 -12.321 3.221 1.00 3.53 H new ATOM 0 HA LEU A 55 5.785 -14.497 2.016 1.00 23.42 H new ATOM 0 HB2 LEU A 55 4.347 -12.100 0.853 1.00 15.31 H new ATOM 0 HB3 LEU A 55 4.821 -13.472 -0.129 1.00 15.31 H new ATOM 0 HG LEU A 55 2.918 -13.614 2.207 1.00 33.35 H new ATOM 0 HD11 LEU A 55 1.236 -13.838 0.420 1.00 12.33 H new ATOM 0 HD12 LEU A 55 2.084 -12.277 0.300 1.00 12.33 H new ATOM 0 HD13 LEU A 55 2.505 -13.606 -0.806 1.00 12.33 H new ATOM 0 HD21 LEU A 55 2.449 -15.833 1.282 1.00 12.14 H new ATOM 0 HD22 LEU A 55 3.693 -15.582 0.034 1.00 12.14 H new ATOM 0 HD23 LEU A 55 4.160 -15.686 1.749 1.00 12.14 H new ATOM 898 N LYS A 56 7.614 -13.812 0.438 1.00 35.12 N ATOM 899 CA LYS A 56 8.802 -13.452 -0.300 1.00 45.50 C ATOM 900 C LYS A 56 8.459 -12.387 -1.353 1.00 43.42 C ATOM 901 O LYS A 56 9.181 -11.400 -1.479 1.00 30.13 O ATOM 902 CB LYS A 56 9.440 -14.727 -0.915 1.00 72.41 C ATOM 903 CG LYS A 56 10.822 -14.582 -1.603 1.00 42.43 C ATOM 904 CD LYS A 56 10.800 -13.807 -2.912 1.00 74.42 C ATOM 905 CE LYS A 56 12.160 -13.876 -3.594 1.00 70.31 C ATOM 906 NZ LYS A 56 12.171 -13.214 -4.918 1.00 74.54 N ATOM 0 H LYS A 56 7.380 -14.804 0.397 1.00 35.12 H new ATOM 0 HA LYS A 56 9.544 -13.011 0.366 1.00 45.50 H new ATOM 0 HB2 LYS A 56 9.536 -15.469 -0.123 1.00 72.41 H new ATOM 0 HB3 LYS A 56 8.742 -15.131 -1.648 1.00 72.41 H new ATOM 0 HG2 LYS A 56 11.506 -14.086 -0.914 1.00 42.43 H new ATOM 0 HG3 LYS A 56 11.225 -15.577 -1.792 1.00 42.43 H new ATOM 0 HD2 LYS A 56 10.035 -14.216 -3.571 1.00 74.42 H new ATOM 0 HD3 LYS A 56 10.534 -12.767 -2.722 1.00 74.42 H new ATOM 0 HE2 LYS A 56 12.907 -13.409 -2.953 1.00 70.31 H new ATOM 0 HE3 LYS A 56 12.450 -14.920 -3.712 1.00 70.31 H new ATOM 0 HZ1 LYS A 56 12.789 -13.744 -5.566 1.00 74.54 H new ATOM 0 HZ2 LYS A 56 11.205 -13.190 -5.302 1.00 74.54 H new ATOM 0 HZ3 LYS A 56 12.527 -12.242 -4.817 1.00 74.54 H new ATOM 920 N TRP A 57 7.335 -12.559 -2.081 1.00 74.10 N ATOM 921 CA TRP A 57 6.973 -11.567 -3.080 1.00 74.52 C ATOM 922 C TRP A 57 6.558 -10.249 -2.437 1.00 45.24 C ATOM 923 O TRP A 57 6.729 -9.188 -3.030 1.00 25.34 O ATOM 924 CB TRP A 57 5.946 -12.060 -4.144 1.00 4.04 C ATOM 925 CG TRP A 57 4.506 -12.294 -3.724 1.00 1.12 C ATOM 926 CD1 TRP A 57 3.927 -13.470 -3.313 1.00 5.34 C ATOM 927 CD2 TRP A 57 3.450 -11.314 -3.737 1.00 1.31 C ATOM 928 NE1 TRP A 57 2.578 -13.272 -3.086 1.00 45.31 N ATOM 929 CE2 TRP A 57 2.269 -11.955 -3.323 1.00 32.44 C ATOM 930 CE3 TRP A 57 3.400 -9.948 -4.054 1.00 73.50 C ATOM 931 CZ2 TRP A 57 1.050 -11.280 -3.223 1.00 72.43 C ATOM 932 CZ3 TRP A 57 2.194 -9.286 -3.954 1.00 24.41 C ATOM 933 CH2 TRP A 57 1.036 -9.951 -3.540 1.00 53.10 C ATOM 0 H TRP A 57 6.694 -13.347 -1.993 1.00 74.10 H new ATOM 0 HA TRP A 57 7.885 -11.388 -3.650 1.00 74.52 H new ATOM 0 HB2 TRP A 57 5.938 -11.332 -4.955 1.00 4.04 H new ATOM 0 HB3 TRP A 57 6.324 -12.995 -4.558 1.00 4.04 H new ATOM 0 HD1 TRP A 57 4.447 -14.408 -3.186 1.00 5.34 H new ATOM 0 HE1 TRP A 57 1.917 -13.990 -2.790 1.00 45.31 H new ATOM 0 HE3 TRP A 57 4.290 -9.424 -4.371 1.00 73.50 H new ATOM 0 HZ2 TRP A 57 0.152 -11.790 -2.907 1.00 72.43 H new ATOM 0 HZ3 TRP A 57 2.143 -8.236 -4.200 1.00 24.41 H new ATOM 0 HH2 TRP A 57 0.109 -9.402 -3.469 1.00 53.10 H new ATOM 944 N ILE A 58 6.041 -10.325 -1.216 1.00 51.02 N ATOM 945 CA ILE A 58 5.692 -9.135 -0.456 1.00 75.44 C ATOM 946 C ILE A 58 6.957 -8.388 -0.040 1.00 40.31 C ATOM 947 O ILE A 58 7.058 -7.183 -0.273 1.00 42.33 O ATOM 948 CB ILE A 58 4.787 -9.459 0.791 1.00 2.41 C ATOM 949 CG1 ILE A 58 3.341 -9.820 0.365 1.00 34.34 C ATOM 950 CG2 ILE A 58 4.788 -8.321 1.809 1.00 25.52 C ATOM 951 CD1 ILE A 58 2.587 -8.681 -0.268 1.00 11.33 C ATOM 0 H ILE A 58 5.854 -11.203 -0.731 1.00 51.02 H new ATOM 0 HA ILE A 58 5.099 -8.493 -1.107 1.00 75.44 H new ATOM 0 HB ILE A 58 5.222 -10.332 1.277 1.00 2.41 H new ATOM 0 HG12 ILE A 58 3.377 -10.653 -0.337 1.00 34.34 H new ATOM 0 HG13 ILE A 58 2.791 -10.165 1.240 1.00 34.34 H new ATOM 0 HG21 ILE A 58 4.151 -8.587 2.653 1.00 25.52 H new ATOM 0 HG22 ILE A 58 5.805 -8.149 2.162 1.00 25.52 H new ATOM 0 HG23 ILE A 58 4.409 -7.413 1.340 1.00 25.52 H new ATOM 0 HD11 ILE A 58 1.585 -9.014 -0.538 1.00 11.33 H new ATOM 0 HD12 ILE A 58 2.517 -7.854 0.438 1.00 11.33 H new ATOM 0 HD13 ILE A 58 3.113 -8.350 -1.164 1.00 11.33 H new ATOM 963 N GLN A 59 7.929 -9.116 0.541 1.00 52.23 N ATOM 964 CA GLN A 59 9.210 -8.528 0.970 1.00 61.21 C ATOM 965 C GLN A 59 9.835 -7.797 -0.199 1.00 31.14 C ATOM 966 O GLN A 59 10.198 -6.633 -0.100 1.00 24.13 O ATOM 967 CB GLN A 59 10.202 -9.618 1.434 1.00 25.42 C ATOM 968 CG GLN A 59 9.630 -10.651 2.389 1.00 51.13 C ATOM 969 CD GLN A 59 8.929 -10.056 3.582 1.00 11.34 C ATOM 970 OE1 GLN A 59 7.758 -9.798 3.531 1.00 55.04 O ATOM 971 NE2 GLN A 59 9.632 -9.856 4.655 1.00 14.05 N ATOM 0 H GLN A 59 7.850 -10.116 0.724 1.00 52.23 H new ATOM 0 HA GLN A 59 9.008 -7.851 1.800 1.00 61.21 H new ATOM 0 HB2 GLN A 59 10.587 -10.134 0.554 1.00 25.42 H new ATOM 0 HB3 GLN A 59 11.051 -9.133 1.916 1.00 25.42 H new ATOM 0 HG2 GLN A 59 8.928 -11.284 1.846 1.00 51.13 H new ATOM 0 HG3 GLN A 59 10.437 -11.295 2.738 1.00 51.13 H new ATOM 0 HE21 GLN A 59 10.626 -10.087 4.664 1.00 14.05 H new ATOM 0 HE22 GLN A 59 9.191 -9.468 5.489 1.00 14.05 H new ATOM 980 N GLU A 60 9.916 -8.501 -1.318 1.00 4.20 N ATOM 981 CA GLU A 60 10.444 -7.971 -2.567 1.00 44.22 C ATOM 982 C GLU A 60 9.716 -6.723 -2.971 1.00 51.44 C ATOM 983 O GLU A 60 10.344 -5.705 -3.229 1.00 23.50 O ATOM 984 CB GLU A 60 10.275 -9.017 -3.665 1.00 64.54 C ATOM 985 CG GLU A 60 11.166 -10.211 -3.528 1.00 32.41 C ATOM 986 CD GLU A 60 12.566 -9.927 -3.956 1.00 11.55 C ATOM 987 OE1 GLU A 60 13.196 -9.013 -3.426 1.00 61.33 O ATOM 988 OE2 GLU A 60 13.042 -10.600 -4.878 1.00 11.22 O ATOM 0 H GLU A 60 9.612 -9.472 -1.385 1.00 4.20 H new ATOM 0 HA GLU A 60 11.498 -7.732 -2.423 1.00 44.22 H new ATOM 0 HB2 GLU A 60 9.238 -9.353 -3.673 1.00 64.54 H new ATOM 0 HB3 GLU A 60 10.465 -8.547 -4.630 1.00 64.54 H new ATOM 0 HG2 GLU A 60 11.167 -10.543 -2.490 1.00 32.41 H new ATOM 0 HG3 GLU A 60 10.765 -11.030 -4.125 1.00 32.41 H new ATOM 995 N TYR A 61 8.398 -6.805 -2.998 1.00 53.21 N ATOM 996 CA TYR A 61 7.553 -5.716 -3.441 1.00 72.51 C ATOM 997 C TYR A 61 7.809 -4.476 -2.579 1.00 22.15 C ATOM 998 O TYR A 61 8.000 -3.368 -3.102 1.00 32.23 O ATOM 999 CB TYR A 61 6.082 -6.140 -3.368 1.00 50.33 C ATOM 1000 CG TYR A 61 5.151 -5.240 -4.124 1.00 41.22 C ATOM 1001 CD1 TYR A 61 4.593 -4.117 -3.539 1.00 63.10 C ATOM 1002 CD2 TYR A 61 4.836 -5.520 -5.446 1.00 61.23 C ATOM 1003 CE1 TYR A 61 3.751 -3.291 -4.253 1.00 72.25 C ATOM 1004 CE2 TYR A 61 3.998 -4.711 -6.168 1.00 11.43 C ATOM 1005 CZ TYR A 61 3.456 -3.591 -5.574 1.00 51.44 C ATOM 1006 OH TYR A 61 2.615 -2.767 -6.303 1.00 22.15 O ATOM 0 H TYR A 61 7.882 -7.637 -2.710 1.00 53.21 H new ATOM 0 HA TYR A 61 7.789 -5.468 -4.476 1.00 72.51 H new ATOM 0 HB2 TYR A 61 5.987 -7.154 -3.757 1.00 50.33 H new ATOM 0 HB3 TYR A 61 5.774 -6.169 -2.323 1.00 50.33 H new ATOM 0 HD1 TYR A 61 4.820 -3.884 -2.509 1.00 63.10 H new ATOM 0 HD2 TYR A 61 5.261 -6.395 -5.916 1.00 61.23 H new ATOM 0 HE1 TYR A 61 3.324 -2.416 -3.786 1.00 72.25 H new ATOM 0 HE2 TYR A 61 3.764 -4.949 -7.195 1.00 11.43 H new ATOM 0 HH TYR A 61 1.696 -3.101 -6.242 1.00 22.15 H new ATOM 1016 N LEU A 62 7.847 -4.683 -1.265 1.00 14.20 N ATOM 1017 CA LEU A 62 8.122 -3.618 -0.313 1.00 53.31 C ATOM 1018 C LEU A 62 9.492 -3.018 -0.580 1.00 43.30 C ATOM 1019 O LEU A 62 9.616 -1.818 -0.773 1.00 43.13 O ATOM 1020 CB LEU A 62 8.089 -4.174 1.120 1.00 11.13 C ATOM 1021 CG LEU A 62 6.754 -4.739 1.611 1.00 75.40 C ATOM 1022 CD1 LEU A 62 6.938 -5.426 2.958 1.00 23.40 C ATOM 1023 CD2 LEU A 62 5.731 -3.627 1.749 1.00 61.14 C ATOM 0 H LEU A 62 7.688 -5.594 -0.834 1.00 14.20 H new ATOM 0 HA LEU A 62 7.360 -2.847 -0.425 1.00 53.31 H new ATOM 0 HB2 LEU A 62 8.839 -4.961 1.196 1.00 11.13 H new ATOM 0 HB3 LEU A 62 8.392 -3.378 1.800 1.00 11.13 H new ATOM 0 HG LEU A 62 6.398 -5.466 0.881 1.00 75.40 H new ATOM 0 HD11 LEU A 62 5.982 -5.824 3.297 1.00 23.40 H new ATOM 0 HD12 LEU A 62 7.654 -6.241 2.856 1.00 23.40 H new ATOM 0 HD13 LEU A 62 7.310 -4.705 3.686 1.00 23.40 H new ATOM 0 HD21 LEU A 62 4.786 -4.043 2.099 1.00 61.14 H new ATOM 0 HD22 LEU A 62 6.090 -2.889 2.466 1.00 61.14 H new ATOM 0 HD23 LEU A 62 5.580 -3.149 0.781 1.00 61.14 H new ATOM 1035 N GLU A 63 10.502 -3.888 -0.662 1.00 11.43 N ATOM 1036 CA GLU A 63 11.897 -3.489 -0.853 1.00 72.33 C ATOM 1037 C GLU A 63 12.139 -2.690 -2.135 1.00 14.12 C ATOM 1038 O GLU A 63 12.993 -1.814 -2.170 1.00 15.54 O ATOM 1039 CB GLU A 63 12.830 -4.704 -0.810 1.00 64.50 C ATOM 1040 CG GLU A 63 12.925 -5.383 0.543 1.00 74.31 C ATOM 1041 CD GLU A 63 14.027 -6.410 0.588 1.00 60.30 C ATOM 1042 OE1 GLU A 63 14.240 -7.114 -0.409 1.00 61.22 O ATOM 1043 OE2 GLU A 63 14.750 -6.487 1.611 1.00 60.25 O ATOM 0 H GLU A 63 10.372 -4.898 -0.597 1.00 11.43 H new ATOM 0 HA GLU A 63 12.125 -2.823 -0.021 1.00 72.33 H new ATOM 0 HB2 GLU A 63 12.488 -5.434 -1.544 1.00 64.50 H new ATOM 0 HB3 GLU A 63 13.828 -4.389 -1.114 1.00 64.50 H new ATOM 0 HG2 GLU A 63 13.099 -4.632 1.313 1.00 74.31 H new ATOM 0 HG3 GLU A 63 11.974 -5.863 0.775 1.00 74.31 H new ATOM 1050 N LYS A 64 11.392 -2.980 -3.169 1.00 24.03 N ATOM 1051 CA LYS A 64 11.612 -2.311 -4.441 1.00 32.55 C ATOM 1052 C LYS A 64 10.953 -0.941 -4.452 1.00 61.10 C ATOM 1053 O LYS A 64 11.435 -0.025 -5.109 1.00 23.41 O ATOM 1054 CB LYS A 64 11.096 -3.167 -5.602 1.00 43.12 C ATOM 1055 CG LYS A 64 11.635 -4.581 -5.589 1.00 40.05 C ATOM 1056 CD LYS A 64 13.145 -4.637 -5.700 1.00 42.43 C ATOM 1057 CE LYS A 64 13.629 -6.047 -5.448 1.00 71.54 C ATOM 1058 NZ LYS A 64 13.393 -6.466 -4.037 1.00 33.42 N ATOM 0 H LYS A 64 10.635 -3.663 -3.165 1.00 24.03 H new ATOM 0 HA LYS A 64 12.686 -2.174 -4.569 1.00 32.55 H new ATOM 0 HB2 LYS A 64 10.007 -3.200 -5.564 1.00 43.12 H new ATOM 0 HB3 LYS A 64 11.367 -2.691 -6.544 1.00 43.12 H new ATOM 0 HG2 LYS A 64 11.325 -5.074 -4.668 1.00 40.05 H new ATOM 0 HG3 LYS A 64 11.194 -5.140 -6.414 1.00 40.05 H new ATOM 0 HD2 LYS A 64 13.458 -4.308 -6.691 1.00 42.43 H new ATOM 0 HD3 LYS A 64 13.597 -3.954 -4.980 1.00 42.43 H new ATOM 0 HE2 LYS A 64 13.117 -6.734 -6.122 1.00 71.54 H new ATOM 0 HE3 LYS A 64 14.693 -6.113 -5.674 1.00 71.54 H new ATOM 0 HZ1 LYS A 64 13.753 -7.432 -3.897 1.00 33.42 H new ATOM 0 HZ2 LYS A 64 13.888 -5.815 -3.394 1.00 33.42 H new ATOM 0 HZ3 LYS A 64 12.373 -6.444 -3.834 1.00 33.42 H new ATOM 1072 N CYS A 65 9.875 -0.802 -3.695 1.00 50.54 N ATOM 1073 CA CYS A 65 9.114 0.445 -3.632 1.00 11.03 C ATOM 1074 C CYS A 65 9.978 1.608 -3.111 1.00 3.43 C ATOM 1075 O CYS A 65 9.823 2.741 -3.562 1.00 10.40 O ATOM 1076 CB CYS A 65 7.840 0.276 -2.792 1.00 51.13 C ATOM 1077 SG CYS A 65 6.752 1.743 -2.758 1.00 45.31 S ATOM 0 H CYS A 65 9.501 -1.546 -3.107 1.00 50.54 H new ATOM 0 HA CYS A 65 8.810 0.695 -4.648 1.00 11.03 H new ATOM 0 HB2 CYS A 65 7.274 -0.571 -3.180 1.00 51.13 H new ATOM 0 HB3 CYS A 65 8.125 0.027 -1.770 1.00 51.13 H new ATOM 1082 N LEU A 66 10.925 1.300 -2.190 1.00 74.11 N ATOM 1083 CA LEU A 66 11.878 2.314 -1.666 1.00 15.02 C ATOM 1084 C LEU A 66 12.593 3.015 -2.815 1.00 32.11 C ATOM 1085 O LEU A 66 12.809 4.243 -2.799 1.00 72.42 O ATOM 1086 CB LEU A 66 12.985 1.676 -0.759 1.00 55.45 C ATOM 1087 CG LEU A 66 12.615 1.105 0.629 1.00 71.14 C ATOM 1088 CD1 LEU A 66 11.983 2.144 1.498 1.00 3.03 C ATOM 1089 CD2 LEU A 66 11.752 -0.114 0.537 1.00 43.20 C ATOM 0 H LEU A 66 11.050 0.367 -1.797 1.00 74.11 H new ATOM 0 HA LEU A 66 11.283 3.014 -1.079 1.00 15.02 H new ATOM 0 HB2 LEU A 66 13.445 0.869 -1.329 1.00 55.45 H new ATOM 0 HB3 LEU A 66 13.753 2.434 -0.603 1.00 55.45 H new ATOM 0 HG LEU A 66 13.551 0.797 1.095 1.00 71.14 H new ATOM 0 HD11 LEU A 66 11.736 1.708 2.466 1.00 3.03 H new ATOM 0 HD12 LEU A 66 12.678 2.972 1.640 1.00 3.03 H new ATOM 0 HD13 LEU A 66 11.073 2.512 1.023 1.00 3.03 H new ATOM 0 HD21 LEU A 66 11.522 -0.474 1.540 1.00 43.20 H new ATOM 0 HD22 LEU A 66 10.825 0.134 0.019 1.00 43.20 H new ATOM 0 HD23 LEU A 66 12.279 -0.892 -0.015 1.00 43.20 H new ATOM 1101 N ASN A 67 12.936 2.236 -3.810 1.00 53.14 N ATOM 1102 CA ASN A 67 13.716 2.707 -4.922 1.00 61.11 C ATOM 1103 C ASN A 67 12.824 3.174 -6.067 1.00 33.30 C ATOM 1104 O ASN A 67 13.023 4.267 -6.605 1.00 12.25 O ATOM 1105 CB ASN A 67 14.683 1.609 -5.408 1.00 33.43 C ATOM 1106 CG ASN A 67 15.660 1.107 -4.326 1.00 5.03 C ATOM 1107 OD1 ASN A 67 16.067 -0.064 -4.340 1.00 10.42 O ATOM 1108 ND2 ASN A 67 16.057 1.972 -3.406 1.00 72.43 N ATOM 0 H ASN A 67 12.679 1.251 -3.870 1.00 53.14 H new ATOM 0 HA ASN A 67 14.299 3.562 -4.581 1.00 61.11 H new ATOM 0 HB2 ASN A 67 14.101 0.764 -5.777 1.00 33.43 H new ATOM 0 HB3 ASN A 67 15.257 1.993 -6.251 1.00 33.43 H new ATOM 0 HD21 ASN A 67 16.715 1.681 -2.683 1.00 72.43 H new ATOM 0 HD22 ASN A 67 15.705 2.929 -3.420 1.00 72.43 H new ATOM 1115 N LYS A 68 11.818 2.374 -6.417 1.00 41.30 N ATOM 1116 CA LYS A 68 10.950 2.686 -7.561 1.00 62.12 C ATOM 1117 C LYS A 68 10.202 4.008 -7.406 1.00 61.42 C ATOM 1118 O LYS A 68 9.175 4.071 -6.715 1.00 51.14 O ATOM 1119 CB LYS A 68 9.953 1.575 -7.840 1.00 61.30 C ATOM 1120 CG LYS A 68 10.597 0.239 -8.123 1.00 63.03 C ATOM 1121 CD LYS A 68 9.594 -0.753 -8.648 1.00 31.13 C ATOM 1122 CE LYS A 68 9.084 -0.372 -10.045 1.00 35.15 C ATOM 1123 NZ LYS A 68 8.086 -1.333 -10.563 1.00 12.11 N ATOM 0 H LYS A 68 11.581 1.509 -5.931 1.00 41.30 H new ATOM 0 HA LYS A 68 11.627 2.781 -8.410 1.00 62.12 H new ATOM 0 HB2 LYS A 68 9.287 1.473 -6.983 1.00 61.30 H new ATOM 0 HB3 LYS A 68 9.335 1.859 -8.692 1.00 61.30 H new ATOM 0 HG2 LYS A 68 11.400 0.367 -8.849 1.00 63.03 H new ATOM 0 HG3 LYS A 68 11.051 -0.148 -7.211 1.00 63.03 H new ATOM 0 HD2 LYS A 68 10.049 -1.743 -8.686 1.00 31.13 H new ATOM 0 HD3 LYS A 68 8.751 -0.816 -7.959 1.00 31.13 H new ATOM 0 HE2 LYS A 68 8.641 0.623 -10.008 1.00 35.15 H new ATOM 0 HE3 LYS A 68 9.926 -0.320 -10.735 1.00 35.15 H new ATOM 0 HZ1 LYS A 68 7.710 -0.988 -11.469 1.00 12.11 H new ATOM 0 HZ2 LYS A 68 8.537 -2.259 -10.705 1.00 12.11 H new ATOM 0 HZ3 LYS A 68 7.308 -1.428 -9.879 1.00 12.11 H new ATOM 1207 N ILE B 106 2.283 3.016 13.617 1.00 24.44 N ATOM 1208 CA ILE B 106 0.901 3.176 13.178 1.00 32.05 C ATOM 1209 C ILE B 106 0.598 4.624 12.781 1.00 11.13 C ATOM 1210 O ILE B 106 1.305 5.542 13.165 1.00 13.53 O ATOM 1211 CB ILE B 106 -0.089 2.685 14.289 1.00 3.54 C ATOM 1212 CG1 ILE B 106 0.275 1.265 14.680 1.00 12.22 C ATOM 1213 CG2 ILE B 106 -1.562 2.737 13.832 1.00 10.31 C ATOM 1214 CD1 ILE B 106 -0.678 0.639 15.640 1.00 31.25 C ATOM 0 HA ILE B 106 0.762 2.559 12.291 1.00 32.05 H new ATOM 0 HB ILE B 106 0.006 3.357 15.142 1.00 3.54 H new ATOM 0 HG12 ILE B 106 0.324 0.652 13.780 1.00 12.22 H new ATOM 0 HG13 ILE B 106 1.272 1.264 15.121 1.00 12.22 H new ATOM 0 HG21 ILE B 106 -2.206 2.386 14.639 1.00 10.31 H new ATOM 0 HG22 ILE B 106 -1.827 3.763 13.576 1.00 10.31 H new ATOM 0 HG23 ILE B 106 -1.695 2.099 12.958 1.00 10.31 H new ATOM 0 HD11 ILE B 106 -0.349 -0.374 15.870 1.00 31.25 H new ATOM 0 HD12 ILE B 106 -0.710 1.227 16.557 1.00 31.25 H new ATOM 0 HD13 ILE B 106 -1.673 0.606 15.196 1.00 31.25 H new ATOM 1226 N TYR B 107 -0.478 4.794 12.025 1.00 1.41 N ATOM 1227 CA TYR B 107 -0.968 6.070 11.500 1.00 65.02 C ATOM 1228 C TYR B 107 -1.716 6.843 12.612 1.00 32.30 C ATOM 1229 O TYR B 107 -2.518 7.726 12.332 1.00 44.11 O ATOM 1230 CB TYR B 107 -1.995 5.745 10.417 1.00 53.24 C ATOM 1231 CG TYR B 107 -1.568 4.730 9.412 1.00 15.33 C ATOM 1232 CD1 TYR B 107 -0.923 5.113 8.275 1.00 60.21 C ATOM 1233 CD2 TYR B 107 -1.852 3.389 9.598 1.00 21.41 C ATOM 1234 CE1 TYR B 107 -0.562 4.210 7.327 1.00 25.42 C ATOM 1235 CE2 TYR B 107 -1.492 2.458 8.671 1.00 3.03 C ATOM 1236 CZ TYR B 107 -0.840 2.878 7.514 1.00 61.20 C ATOM 1237 OH TYR B 107 -0.478 1.974 6.547 1.00 33.05 O ATOM 0 H TYR B 107 -1.065 4.009 11.745 1.00 1.41 H new ATOM 0 HA TYR B 107 -0.134 6.664 11.126 1.00 65.02 H new ATOM 0 HB2 TYR B 107 -2.907 5.392 10.899 1.00 53.24 H new ATOM 0 HB3 TYR B 107 -2.248 6.666 9.892 1.00 53.24 H new ATOM 0 HD1 TYR B 107 -0.694 6.158 8.124 1.00 60.21 H new ATOM 0 HD2 TYR B 107 -2.368 3.075 10.493 1.00 21.41 H new ATOM 0 HE1 TYR B 107 -0.058 4.538 6.430 1.00 25.42 H new ATOM 0 HE2 TYR B 107 -1.708 1.412 8.830 1.00 3.03 H new ATOM 0 HH TYR B 107 0.417 1.626 6.743 1.00 33.05 H new ATOM 1247 N THR B 108 -1.449 6.468 13.873 1.00 34.21 N ATOM 1248 CA THR B 108 -2.123 7.004 15.066 1.00 30.35 C ATOM 1249 C THR B 108 -3.530 6.356 15.245 1.00 72.15 C ATOM 1250 O THR B 108 -4.091 6.320 16.342 1.00 0.34 O ATOM 1251 CB THR B 108 -2.194 8.572 15.056 1.00 34.41 C ATOM 1252 OG1 THR B 108 -0.862 9.104 14.931 1.00 45.33 O ATOM 1253 CG2 THR B 108 -2.814 9.114 16.339 1.00 2.44 C ATOM 0 H THR B 108 -0.742 5.767 14.096 1.00 34.21 H new ATOM 0 HA THR B 108 -1.519 6.734 15.932 1.00 30.35 H new ATOM 0 HB THR B 108 -2.817 8.875 14.215 1.00 34.41 H new ATOM 0 HG1 THR B 108 -0.900 10.083 14.922 1.00 45.33 H new ATOM 0 HG21 THR B 108 -2.846 10.203 16.296 1.00 2.44 H new ATOM 0 HG22 THR B 108 -3.826 8.725 16.447 1.00 2.44 H new ATOM 0 HG23 THR B 108 -2.213 8.803 17.193 1.00 2.44 H new ATOM 1261 N SER B 109 -4.074 5.838 14.171 1.00 34.42 N ATOM 1262 CA SER B 109 -5.352 5.172 14.184 1.00 20.32 C ATOM 1263 C SER B 109 -5.362 4.163 13.049 1.00 64.15 C ATOM 1264 O SER B 109 -4.476 4.204 12.184 1.00 35.43 O ATOM 1265 CB SER B 109 -6.469 6.199 13.963 1.00 13.42 C ATOM 1266 OG SER B 109 -6.394 7.261 14.920 1.00 3.53 O ATOM 0 H SER B 109 -3.635 5.868 13.251 1.00 34.42 H new ATOM 0 HA SER B 109 -5.513 4.675 15.141 1.00 20.32 H new ATOM 0 HB2 SER B 109 -6.396 6.608 12.955 1.00 13.42 H new ATOM 0 HB3 SER B 109 -7.439 5.707 14.037 1.00 13.42 H new ATOM 0 HG SER B 109 -7.234 7.766 14.915 1.00 3.53 H new ATOM 1272 N ASP B 110 -6.316 3.266 13.057 1.00 34.44 N ATOM 1273 CA ASP B 110 -6.466 2.316 11.981 1.00 73.15 C ATOM 1274 C ASP B 110 -7.861 2.456 11.369 1.00 62.11 C ATOM 1275 O ASP B 110 -8.545 3.477 11.580 1.00 40.34 O ATOM 1276 CB ASP B 110 -6.160 0.854 12.428 1.00 20.43 C ATOM 1277 CG ASP B 110 -7.103 0.293 13.470 1.00 32.55 C ATOM 1278 OD1 ASP B 110 -8.126 -0.291 13.089 1.00 30.54 O ATOM 1279 OD2 ASP B 110 -6.809 0.409 14.668 1.00 14.22 O ATOM 0 H ASP B 110 -7.006 3.173 13.803 1.00 34.44 H new ATOM 0 HA ASP B 110 -5.725 2.544 11.215 1.00 73.15 H new ATOM 0 HB2 ASP B 110 -6.187 0.208 11.550 1.00 20.43 H new ATOM 0 HB3 ASP B 110 -5.144 0.815 12.821 1.00 20.43 H new ATOM 1284 N ASN B 111 -8.275 1.471 10.615 1.00 54.43 N ATOM 1285 CA ASN B 111 -9.521 1.541 9.860 1.00 55.35 C ATOM 1286 C ASN B 111 -10.331 0.282 10.159 1.00 61.52 C ATOM 1287 O ASN B 111 -11.301 -0.031 9.484 1.00 54.25 O ATOM 1288 CB ASN B 111 -9.129 1.589 8.343 1.00 41.11 C ATOM 1289 CG ASN B 111 -10.233 1.965 7.308 1.00 12.25 C ATOM 1290 OD1 ASN B 111 -9.932 2.579 6.298 1.00 22.13 O ATOM 1291 ND2 ASN B 111 -11.447 1.581 7.506 1.00 64.22 N ATOM 0 H ASN B 111 -7.766 0.594 10.500 1.00 54.43 H new ATOM 0 HA ASN B 111 -10.116 2.415 10.124 1.00 55.35 H new ATOM 0 HB2 ASN B 111 -8.312 2.302 8.233 1.00 41.11 H new ATOM 0 HB3 ASN B 111 -8.736 0.610 8.070 1.00 41.11 H new ATOM 0 HD21 ASN B 111 -12.167 1.790 6.815 1.00 64.22 H new ATOM 0 HD22 ASN B 111 -11.688 1.068 8.354 1.00 64.22 H new ATOM 1417 N TYR B 121 -5.413 -19.147 1.711 1.00 73.44 N ATOM 1418 CA TYR B 121 -5.328 -19.474 0.296 1.00 63.41 C ATOM 1419 C TYR B 121 -4.418 -20.680 0.115 1.00 55.05 C ATOM 1420 O TYR B 121 -4.766 -21.645 -0.575 1.00 1.12 O ATOM 1421 CB TYR B 121 -4.680 -18.270 -0.374 1.00 15.53 C ATOM 1422 CG TYR B 121 -5.039 -17.993 -1.807 1.00 73.52 C ATOM 1423 CD1 TYR B 121 -4.448 -18.665 -2.866 1.00 14.31 C ATOM 1424 CD2 TYR B 121 -5.961 -16.997 -2.090 1.00 4.33 C ATOM 1425 CE1 TYR B 121 -4.782 -18.349 -4.172 1.00 42.42 C ATOM 1426 CE2 TYR B 121 -6.295 -16.667 -3.376 1.00 4.42 C ATOM 1427 CZ TYR B 121 -5.708 -17.343 -4.420 1.00 74.41 C ATOM 1428 OH TYR B 121 -6.029 -17.005 -5.713 1.00 42.44 O ATOM 0 HA TYR B 121 -6.308 -19.700 -0.124 1.00 63.41 H new ATOM 0 HB2 TYR B 121 -4.929 -17.385 0.212 1.00 15.53 H new ATOM 0 HB3 TYR B 121 -3.599 -18.396 -0.317 1.00 15.53 H new ATOM 0 HD1 TYR B 121 -3.722 -19.440 -2.671 1.00 14.31 H new ATOM 0 HD2 TYR B 121 -6.429 -16.467 -1.273 1.00 4.33 H new ATOM 0 HE1 TYR B 121 -4.325 -18.881 -4.993 1.00 42.42 H new ATOM 0 HE2 TYR B 121 -7.013 -15.883 -3.569 1.00 4.42 H new ATOM 0 HH TYR B 121 -6.945 -17.293 -5.909 1.00 42.44 H new ATOM 1438 N ASP B 122 -3.252 -20.595 0.744 1.00 41.53 N ATOM 1439 CA ASP B 122 -2.239 -21.640 0.744 1.00 73.31 C ATOM 1440 C ASP B 122 -1.087 -21.112 1.606 1.00 72.13 C ATOM 1441 O ASP B 122 -0.700 -19.937 1.473 1.00 23.40 O ATOM 1442 CB ASP B 122 -1.752 -21.946 -0.680 1.00 71.45 C ATOM 1443 CG ASP B 122 -1.003 -23.255 -0.768 1.00 54.11 C ATOM 1444 OD1 ASP B 122 0.184 -23.305 -0.425 1.00 73.40 O ATOM 1445 OD2 ASP B 122 -1.602 -24.257 -1.193 1.00 23.30 O ATOM 0 H ASP B 122 -2.979 -19.773 1.283 1.00 41.53 H new ATOM 0 HA ASP B 122 -2.642 -22.573 1.138 1.00 73.31 H new ATOM 0 HB2 ASP B 122 -2.608 -21.975 -1.354 1.00 71.45 H new ATOM 0 HB3 ASP B 122 -1.105 -21.138 -1.021 1.00 71.45 H new ATOM 1450 N SER B 123 -0.554 -21.935 2.465 1.00 23.35 N ATOM 1451 CA SER B 123 0.387 -21.494 3.477 1.00 34.34 C ATOM 1452 C SER B 123 1.825 -21.312 2.943 1.00 51.12 C ATOM 1453 O SER B 123 2.331 -22.128 2.167 1.00 73.21 O ATOM 1454 CB SER B 123 0.357 -22.470 4.657 1.00 13.01 C ATOM 1455 OG SER B 123 1.069 -21.967 5.786 1.00 72.52 O ATOM 0 H SER B 123 -0.755 -22.935 2.490 1.00 23.35 H new ATOM 0 HA SER B 123 0.071 -20.504 3.805 1.00 34.34 H new ATOM 0 HB2 SER B 123 -0.678 -22.666 4.939 1.00 13.01 H new ATOM 0 HB3 SER B 123 0.790 -23.422 4.351 1.00 13.01 H new ATOM 0 HG SER B 123 1.025 -22.618 6.517 1.00 72.52 H new ATOM 1461 N MET B 124 2.447 -20.212 3.373 1.00 61.03 N ATOM 1462 CA MET B 124 3.832 -19.836 3.071 1.00 63.11 C ATOM 1463 C MET B 124 4.118 -18.564 3.828 1.00 41.53 C ATOM 1464 O MET B 124 3.360 -17.608 3.710 1.00 63.54 O ATOM 1465 CB MET B 124 4.041 -19.574 1.579 1.00 11.13 C ATOM 1466 CG MET B 124 5.452 -19.135 1.213 1.00 34.42 C ATOM 1467 SD MET B 124 5.619 -18.739 -0.540 1.00 61.11 S ATOM 1468 CE MET B 124 7.346 -18.261 -0.604 1.00 74.15 C ATOM 0 H MET B 124 1.979 -19.528 3.968 1.00 61.03 H new ATOM 0 HA MET B 124 4.496 -20.651 3.359 1.00 63.11 H new ATOM 0 HB2 MET B 124 3.800 -20.481 1.025 1.00 11.13 H new ATOM 0 HB3 MET B 124 3.338 -18.806 1.255 1.00 11.13 H new ATOM 0 HG2 MET B 124 5.723 -18.262 1.807 1.00 34.42 H new ATOM 0 HG3 MET B 124 6.154 -19.927 1.472 1.00 34.42 H new ATOM 0 HE1 MET B 124 7.610 -17.986 -1.625 1.00 74.15 H new ATOM 0 HE2 MET B 124 7.513 -17.410 0.056 1.00 74.15 H new ATOM 0 HE3 MET B 124 7.967 -19.097 -0.282 1.00 74.15 H new ATOM 1478 N LYS B 125 5.171 -18.541 4.602 1.00 23.51 N ATOM 1479 CA LYS B 125 5.479 -17.381 5.397 1.00 11.13 C ATOM 1480 C LYS B 125 6.968 -17.270 5.665 1.00 62.54 C ATOM 1481 O LYS B 125 7.718 -18.239 5.459 1.00 63.52 O ATOM 1482 CB LYS B 125 4.694 -17.429 6.709 1.00 70.03 C ATOM 1483 CG LYS B 125 4.932 -18.682 7.535 1.00 32.40 C ATOM 1484 CD LYS B 125 4.063 -18.695 8.772 1.00 33.05 C ATOM 1485 CE LYS B 125 4.255 -19.968 9.569 1.00 55.34 C ATOM 1486 NZ LYS B 125 3.370 -20.021 10.753 1.00 24.43 N ATOM 0 H LYS B 125 5.831 -19.313 4.699 1.00 23.51 H new ATOM 0 HA LYS B 125 5.184 -16.494 4.837 1.00 11.13 H new ATOM 0 HB2 LYS B 125 4.957 -16.557 7.308 1.00 70.03 H new ATOM 0 HB3 LYS B 125 3.630 -17.352 6.485 1.00 70.03 H new ATOM 0 HG2 LYS B 125 4.722 -19.564 6.931 1.00 32.40 H new ATOM 0 HG3 LYS B 125 5.982 -18.736 7.824 1.00 32.40 H new ATOM 0 HD2 LYS B 125 4.303 -17.834 9.396 1.00 33.05 H new ATOM 0 HD3 LYS B 125 3.016 -18.599 8.484 1.00 33.05 H new ATOM 0 HE2 LYS B 125 4.057 -20.829 8.930 1.00 55.34 H new ATOM 0 HE3 LYS B 125 5.294 -20.041 9.890 1.00 55.34 H new ATOM 0 HZ1 LYS B 125 3.534 -20.909 11.270 1.00 24.43 H new ATOM 0 HZ2 LYS B 125 3.576 -19.214 11.376 1.00 24.43 H new ATOM 0 HZ3 LYS B 125 2.377 -19.977 10.447 1.00 24.43 H new ATOM 1500 N GLU B 126 7.370 -16.082 6.116 1.00 35.04 N ATOM 1501 CA GLU B 126 8.754 -15.736 6.468 1.00 14.13 C ATOM 1502 C GLU B 126 9.652 -15.511 5.251 1.00 13.35 C ATOM 1503 O GLU B 126 9.584 -16.244 4.258 1.00 61.34 O ATOM 1504 CB GLU B 126 9.364 -16.677 7.513 1.00 10.31 C ATOM 1505 CG GLU B 126 8.665 -16.575 8.857 1.00 75.01 C ATOM 1506 CD GLU B 126 9.274 -17.448 9.903 1.00 20.14 C ATOM 1507 OE1 GLU B 126 10.292 -17.044 10.517 1.00 11.10 O ATOM 1508 OE2 GLU B 126 8.741 -18.538 10.159 1.00 53.11 O ATOM 0 H GLU B 126 6.723 -15.306 6.252 1.00 35.04 H new ATOM 0 HA GLU B 126 8.694 -14.764 6.958 1.00 14.13 H new ATOM 0 HB2 GLU B 126 9.305 -17.704 7.152 1.00 10.31 H new ATOM 0 HB3 GLU B 126 10.421 -16.443 7.637 1.00 10.31 H new ATOM 0 HG2 GLU B 126 8.692 -15.539 9.196 1.00 75.01 H new ATOM 0 HG3 GLU B 126 7.616 -16.843 8.735 1.00 75.01 H new ATOM 1515 N PRO B 127 10.500 -14.468 5.313 1.00 73.24 N ATOM 1516 CA PRO B 127 11.346 -14.044 4.195 1.00 61.03 C ATOM 1517 C PRO B 127 12.480 -15.011 3.814 1.00 2.01 C ATOM 1518 O PRO B 127 13.642 -14.832 4.190 1.00 13.41 O ATOM 1519 CB PRO B 127 11.921 -12.724 4.674 1.00 33.40 C ATOM 1520 CG PRO B 127 11.985 -12.908 6.137 1.00 41.15 C ATOM 1521 CD PRO B 127 10.704 -13.588 6.485 1.00 61.41 C ATOM 0 HA PRO B 127 10.754 -13.991 3.281 1.00 61.03 H new ATOM 0 HB2 PRO B 127 12.905 -12.533 4.247 1.00 33.40 H new ATOM 0 HB3 PRO B 127 11.285 -11.882 4.399 1.00 33.40 H new ATOM 0 HG2 PRO B 127 12.846 -13.512 6.424 1.00 41.15 H new ATOM 0 HG3 PRO B 127 12.080 -11.953 6.653 1.00 41.15 H new ATOM 0 HD2 PRO B 127 10.781 -14.154 7.413 1.00 61.41 H new ATOM 0 HD3 PRO B 127 9.886 -12.879 6.611 1.00 61.41 H new ATOM 1846 N CYS C 209 -1.137 6.632 -14.377 1.00 71.15 N ATOM 1847 CA CYS C 209 -0.789 6.640 -12.990 1.00 55.51 C ATOM 1848 C CYS C 209 -2.105 6.894 -12.265 1.00 74.20 C ATOM 1849 O CYS C 209 -2.977 7.568 -12.825 1.00 73.52 O ATOM 1850 CB CYS C 209 0.239 7.746 -12.685 1.00 55.33 C ATOM 1851 SG CYS C 209 1.823 7.634 -13.622 1.00 13.12 S ATOM 0 HA CYS C 209 -0.322 5.707 -12.676 1.00 55.51 H new ATOM 0 HB2 CYS C 209 -0.220 8.712 -12.894 1.00 55.33 H new ATOM 0 HB3 CYS C 209 0.465 7.725 -11.619 1.00 55.33 H new ATOM 1856 N PRO C 210 -2.311 6.332 -11.060 1.00 35.35 N ATOM 1857 CA PRO C 210 -3.593 6.437 -10.349 1.00 43.11 C ATOM 1858 C PRO C 210 -4.032 7.871 -10.119 1.00 30.44 C ATOM 1859 O PRO C 210 -5.169 8.242 -10.421 1.00 35.15 O ATOM 1860 CB PRO C 210 -3.317 5.716 -9.046 1.00 74.42 C ATOM 1861 CG PRO C 210 -1.861 5.692 -8.880 1.00 32.23 C ATOM 1862 CD PRO C 210 -1.316 5.585 -10.273 1.00 72.35 C ATOM 0 HA PRO C 210 -4.418 6.008 -10.918 1.00 43.11 H new ATOM 0 HB2 PRO C 210 -3.794 6.229 -8.211 1.00 74.42 H new ATOM 0 HB3 PRO C 210 -3.721 4.704 -9.070 1.00 74.42 H new ATOM 0 HG2 PRO C 210 -1.505 6.595 -8.385 1.00 32.23 H new ATOM 0 HG3 PRO C 210 -1.547 4.847 -8.267 1.00 32.23 H new ATOM 0 HD2 PRO C 210 -0.321 6.023 -10.355 1.00 72.35 H new ATOM 0 HD3 PRO C 210 -1.235 4.548 -10.599 1.00 72.35 H new ATOM 1870 N CYS C 211 -3.154 8.667 -9.605 1.00 23.24 N ATOM 1871 CA CYS C 211 -3.435 10.049 -9.404 1.00 72.13 C ATOM 1872 C CYS C 211 -2.829 10.882 -10.524 1.00 63.12 C ATOM 1873 O CYS C 211 -2.151 10.344 -11.399 1.00 24.00 O ATOM 1874 CB CYS C 211 -2.923 10.486 -8.053 1.00 13.24 C ATOM 1875 SG CYS C 211 -1.125 10.197 -7.772 1.00 14.44 S ATOM 0 H CYS C 211 -2.221 8.377 -9.312 1.00 23.24 H new ATOM 0 HA CYS C 211 -4.514 10.203 -9.425 1.00 72.13 H new ATOM 0 HB2 CYS C 211 -3.129 11.549 -7.930 1.00 13.24 H new ATOM 0 HB3 CYS C 211 -3.485 9.961 -7.281 1.00 13.24 H new ATOM 1880 N ARG C 212 -3.075 12.180 -10.503 1.00 61.04 N ATOM 1881 CA ARG C 212 -2.469 13.069 -11.469 1.00 35.44 C ATOM 1882 C ARG C 212 -1.017 13.302 -11.056 1.00 74.41 C ATOM 1883 O ARG C 212 -0.088 13.045 -11.824 1.00 2.34 O ATOM 1884 CB ARG C 212 -3.234 14.395 -11.510 1.00 14.30 C ATOM 1885 CG ARG C 212 -2.691 15.400 -12.504 1.00 52.40 C ATOM 1886 CD ARG C 212 -3.486 16.690 -12.461 1.00 75.32 C ATOM 1887 NE ARG C 212 -3.465 17.315 -11.124 1.00 3.01 N ATOM 1888 CZ ARG C 212 -4.102 18.453 -10.811 1.00 34.12 C ATOM 1889 NH1 ARG C 212 -4.803 19.104 -11.735 1.00 64.51 N ATOM 1890 NH2 ARG C 212 -4.028 18.942 -9.577 1.00 35.24 N ATOM 0 H ARG C 212 -3.689 12.637 -9.829 1.00 61.04 H new ATOM 0 HA ARG C 212 -2.504 12.628 -12.465 1.00 35.44 H new ATOM 0 HB2 ARG C 212 -4.277 14.191 -11.751 1.00 14.30 H new ATOM 0 HB3 ARG C 212 -3.218 14.841 -10.515 1.00 14.30 H new ATOM 0 HG2 ARG C 212 -1.644 15.606 -12.283 1.00 52.40 H new ATOM 0 HG3 ARG C 212 -2.728 14.979 -13.509 1.00 52.40 H new ATOM 0 HD2 ARG C 212 -3.081 17.389 -13.193 1.00 75.32 H new ATOM 0 HD3 ARG C 212 -4.518 16.489 -12.750 1.00 75.32 H new ATOM 0 HE ARG C 212 -2.931 16.851 -10.390 1.00 3.01 H new ATOM 0 HH11 ARG C 212 -4.858 18.738 -12.686 1.00 64.51 H new ATOM 0 HH12 ARG C 212 -5.286 19.969 -11.493 1.00 64.51 H new ATOM 0 HH21 ARG C 212 -3.486 18.452 -8.866 1.00 35.24 H new ATOM 0 HH22 ARG C 212 -4.513 19.808 -9.342 1.00 35.24 H new ATOM 1904 N PHE C 213 -0.840 13.774 -9.839 1.00 72.04 N ATOM 1905 CA PHE C 213 0.464 13.954 -9.244 1.00 63.23 C ATOM 1906 C PHE C 213 0.378 13.430 -7.829 1.00 3.31 C ATOM 1907 O PHE C 213 -0.727 13.344 -7.275 1.00 3.10 O ATOM 1908 CB PHE C 213 0.879 15.433 -9.214 1.00 72.13 C ATOM 1909 CG PHE C 213 0.950 16.110 -10.548 1.00 53.23 C ATOM 1910 CD1 PHE C 213 1.943 15.785 -11.450 1.00 50.23 C ATOM 1911 CD2 PHE C 213 0.022 17.072 -10.896 1.00 14.13 C ATOM 1912 CE1 PHE C 213 2.012 16.407 -12.677 1.00 50.03 C ATOM 1913 CE2 PHE C 213 0.083 17.699 -12.121 1.00 41.44 C ATOM 1914 CZ PHE C 213 1.081 17.366 -13.014 1.00 63.21 C ATOM 0 H PHE C 213 -1.610 14.047 -9.229 1.00 72.04 H new ATOM 0 HA PHE C 213 1.211 13.422 -9.833 1.00 63.23 H new ATOM 0 HB2 PHE C 213 0.173 15.978 -8.587 1.00 72.13 H new ATOM 0 HB3 PHE C 213 1.855 15.509 -8.735 1.00 72.13 H new ATOM 0 HD1 PHE C 213 2.675 15.034 -11.191 1.00 50.23 H new ATOM 0 HD2 PHE C 213 -0.760 17.336 -10.200 1.00 14.13 H new ATOM 0 HE1 PHE C 213 2.794 16.144 -13.374 1.00 50.03 H new ATOM 0 HE2 PHE C 213 -0.649 18.449 -12.382 1.00 41.44 H new ATOM 0 HZ PHE C 213 1.133 17.856 -13.975 1.00 63.21 H new ATOM 1924 N PHE C 214 1.493 13.077 -7.251 1.00 22.13 N ATOM 1925 CA PHE C 214 1.489 12.529 -5.913 1.00 74.33 C ATOM 1926 C PHE C 214 1.851 13.574 -4.867 1.00 25.11 C ATOM 1927 O PHE C 214 2.668 14.479 -5.113 1.00 61.33 O ATOM 1928 CB PHE C 214 2.375 11.274 -5.807 1.00 4.32 C ATOM 1929 CG PHE C 214 3.787 11.463 -6.278 1.00 53.11 C ATOM 1930 CD1 PHE C 214 4.722 12.080 -5.474 1.00 73.11 C ATOM 1931 CD2 PHE C 214 4.173 11.025 -7.534 1.00 33.32 C ATOM 1932 CE1 PHE C 214 6.010 12.257 -5.907 1.00 62.44 C ATOM 1933 CE2 PHE C 214 5.466 11.202 -7.973 1.00 14.51 C ATOM 1934 CZ PHE C 214 6.386 11.820 -7.157 1.00 1.24 C ATOM 0 H PHE C 214 2.415 13.157 -7.679 1.00 22.13 H new ATOM 0 HA PHE C 214 0.467 12.215 -5.701 1.00 74.33 H new ATOM 0 HB2 PHE C 214 2.394 10.946 -4.768 1.00 4.32 H new ATOM 0 HB3 PHE C 214 1.917 10.472 -6.386 1.00 4.32 H new ATOM 0 HD1 PHE C 214 4.436 12.428 -4.492 1.00 73.11 H new ATOM 0 HD2 PHE C 214 3.452 10.540 -8.176 1.00 33.32 H new ATOM 0 HE1 PHE C 214 6.732 12.741 -5.266 1.00 62.44 H new ATOM 0 HE2 PHE C 214 5.757 10.857 -8.954 1.00 14.51 H new ATOM 0 HZ PHE C 214 7.401 11.962 -7.497 1.00 1.24 H new ATOM 1944 N GLU C 215 1.256 13.435 -3.717 1.00 53.11 N ATOM 1945 CA GLU C 215 1.413 14.347 -2.627 1.00 43.34 C ATOM 1946 C GLU C 215 2.599 13.959 -1.776 1.00 41.21 C ATOM 1947 O GLU C 215 2.758 12.798 -1.410 1.00 34.41 O ATOM 1948 CB GLU C 215 0.086 14.411 -1.856 1.00 34.45 C ATOM 1949 CG GLU C 215 -0.987 14.990 -2.739 1.00 65.45 C ATOM 1950 CD GLU C 215 -2.412 14.957 -2.243 1.00 4.15 C ATOM 1951 OE1 GLU C 215 -3.117 13.955 -2.525 1.00 42.52 O ATOM 1952 OE2 GLU C 215 -2.877 15.976 -1.660 1.00 34.03 O ATOM 0 H GLU C 215 0.629 12.658 -3.508 1.00 53.11 H new ATOM 0 HA GLU C 215 1.635 15.353 -2.984 1.00 43.34 H new ATOM 0 HB2 GLU C 215 -0.202 13.413 -1.525 1.00 34.45 H new ATOM 0 HB3 GLU C 215 0.203 15.022 -0.961 1.00 34.45 H new ATOM 0 HG2 GLU C 215 -0.728 16.030 -2.940 1.00 65.45 H new ATOM 0 HG3 GLU C 215 -0.954 14.463 -3.693 1.00 65.45 H new ATOM 1959 N SER C 216 3.446 14.939 -1.509 1.00 63.24 N ATOM 1960 CA SER C 216 4.674 14.743 -0.787 1.00 21.31 C ATOM 1961 C SER C 216 4.463 14.444 0.716 1.00 0.02 C ATOM 1962 O SER C 216 3.961 13.387 1.060 1.00 32.14 O ATOM 1963 CB SER C 216 5.587 15.926 -1.026 1.00 34.33 C ATOM 1964 OG SER C 216 4.902 17.138 -0.694 1.00 51.12 O ATOM 0 H SER C 216 3.289 15.905 -1.796 1.00 63.24 H new ATOM 0 HA SER C 216 5.154 13.844 -1.173 1.00 21.31 H new ATOM 0 HB2 SER C 216 6.489 15.829 -0.422 1.00 34.33 H new ATOM 0 HB3 SER C 216 5.903 15.949 -2.069 1.00 34.33 H new ATOM 0 HG SER C 216 5.123 17.829 -1.353 1.00 51.12 H new ATOM 1970 N HIS C 217 4.792 15.378 1.624 1.00 61.45 N ATOM 1971 CA HIS C 217 4.631 15.044 3.033 1.00 10.02 C ATOM 1972 C HIS C 217 3.217 15.217 3.525 1.00 11.00 C ATOM 1973 O HIS C 217 2.846 16.238 4.104 1.00 22.50 O ATOM 1974 CB HIS C 217 5.694 15.617 4.026 1.00 65.31 C ATOM 1975 CG HIS C 217 5.693 17.098 4.236 1.00 24.35 C ATOM 1976 ND1 HIS C 217 5.309 17.701 5.416 1.00 52.23 N ATOM 1977 CD2 HIS C 217 6.082 18.069 3.442 1.00 1.31 C ATOM 1978 CE1 HIS C 217 5.473 18.997 5.312 1.00 64.02 C ATOM 1979 NE2 HIS C 217 5.944 19.247 4.115 1.00 51.33 N ATOM 0 H HIS C 217 5.149 16.312 1.420 1.00 61.45 H new ATOM 0 HA HIS C 217 4.853 13.977 3.041 1.00 10.02 H new ATOM 0 HB2 HIS C 217 5.548 15.137 4.994 1.00 65.31 H new ATOM 0 HB3 HIS C 217 6.682 15.325 3.671 1.00 65.31 H new ATOM 0 HD2 HIS C 217 6.447 17.955 2.432 1.00 1.31 H new ATOM 0 HE1 HIS C 217 5.258 19.729 6.077 1.00 64.02 H new ATOM 0 HE2 HIS C 217 6.170 20.171 3.747 1.00 51.33 H new ATOM 1988 N VAL C 218 2.419 14.250 3.207 1.00 1.51 N ATOM 1989 CA VAL C 218 1.086 14.159 3.692 1.00 70.23 C ATOM 1990 C VAL C 218 1.165 13.736 5.167 1.00 64.13 C ATOM 1991 O VAL C 218 2.097 13.024 5.556 1.00 4.22 O ATOM 1992 CB VAL C 218 0.274 13.128 2.848 1.00 14.53 C ATOM 1993 CG1 VAL C 218 -1.125 12.912 3.418 1.00 64.12 C ATOM 1994 CG2 VAL C 218 0.204 13.565 1.358 1.00 51.22 C ATOM 0 H VAL C 218 2.685 13.485 2.588 1.00 1.51 H new ATOM 0 HA VAL C 218 0.571 15.116 3.607 1.00 70.23 H new ATOM 0 HB VAL C 218 0.800 12.175 2.901 1.00 14.53 H new ATOM 0 HG11 VAL C 218 -1.660 12.188 2.804 1.00 64.12 H new ATOM 0 HG12 VAL C 218 -1.048 12.536 4.438 1.00 64.12 H new ATOM 0 HG13 VAL C 218 -1.667 13.858 3.420 1.00 64.12 H new ATOM 0 HG21 VAL C 218 -0.367 12.831 0.790 1.00 51.22 H new ATOM 0 HG22 VAL C 218 -0.283 14.538 1.287 1.00 51.22 H new ATOM 0 HG23 VAL C 218 1.213 13.634 0.951 1.00 51.22 H new ATOM 2004 N ALA C 219 0.243 14.205 5.978 1.00 4.32 N ATOM 2005 CA ALA C 219 0.265 13.918 7.400 1.00 32.33 C ATOM 2006 C ALA C 219 0.063 12.428 7.694 1.00 4.21 C ATOM 2007 O ALA C 219 -0.985 11.851 7.403 1.00 24.24 O ATOM 2008 CB ALA C 219 -0.746 14.774 8.138 1.00 51.11 C ATOM 0 H ALA C 219 -0.537 14.790 5.678 1.00 4.32 H new ATOM 0 HA ALA C 219 1.258 14.175 7.768 1.00 32.33 H new ATOM 0 HB1 ALA C 219 -0.712 14.542 9.202 1.00 51.11 H new ATOM 0 HB2 ALA C 219 -0.509 15.827 7.989 1.00 51.11 H new ATOM 0 HB3 ALA C 219 -1.745 14.569 7.754 1.00 51.11 H new ATOM 2014 N ARG C 220 1.081 11.843 8.287 1.00 20.10 N ATOM 2015 CA ARG C 220 1.151 10.425 8.640 1.00 52.52 C ATOM 2016 C ARG C 220 0.156 10.098 9.769 1.00 10.33 C ATOM 2017 O ARG C 220 -0.276 8.960 9.920 1.00 74.33 O ATOM 2018 CB ARG C 220 2.639 10.129 9.002 1.00 63.20 C ATOM 2019 CG ARG C 220 3.085 8.700 9.373 1.00 2.54 C ATOM 2020 CD ARG C 220 2.587 8.198 10.696 1.00 52.33 C ATOM 2021 NE ARG C 220 3.254 6.942 11.039 1.00 52.43 N ATOM 2022 CZ ARG C 220 2.962 5.741 10.537 1.00 55.32 C ATOM 2023 NH1 ARG C 220 1.993 5.600 9.628 1.00 75.04 N ATOM 2024 NH2 ARG C 220 3.645 4.685 10.940 1.00 43.33 N ATOM 0 H ARG C 220 1.922 12.356 8.551 1.00 20.10 H new ATOM 0 HA ARG C 220 0.854 9.778 7.814 1.00 52.52 H new ATOM 0 HB2 ARG C 220 3.246 10.445 8.153 1.00 63.20 H new ATOM 0 HB3 ARG C 220 2.901 10.775 9.840 1.00 63.20 H new ATOM 0 HG2 ARG C 220 2.747 8.017 8.593 1.00 2.54 H new ATOM 0 HG3 ARG C 220 4.174 8.666 9.376 1.00 2.54 H new ATOM 0 HD2 ARG C 220 2.775 8.942 11.470 1.00 52.33 H new ATOM 0 HD3 ARG C 220 1.508 8.047 10.654 1.00 52.33 H new ATOM 0 HE ARG C 220 4.009 6.989 11.723 1.00 52.43 H new ATOM 0 HH11 ARG C 220 1.468 6.415 9.311 1.00 75.04 H new ATOM 0 HH12 ARG C 220 1.778 4.677 9.251 1.00 75.04 H new ATOM 0 HH21 ARG C 220 4.389 4.792 11.630 1.00 43.33 H new ATOM 0 HH22 ARG C 220 3.429 3.763 10.562 1.00 43.33 H new ATOM 2038 N ALA C 221 -0.179 11.093 10.549 1.00 64.22 N ATOM 2039 CA ALA C 221 -1.172 10.952 11.610 1.00 1.52 C ATOM 2040 C ALA C 221 -2.611 11.100 11.068 1.00 41.14 C ATOM 2041 O ALA C 221 -3.580 10.827 11.774 1.00 61.30 O ATOM 2042 CB ALA C 221 -0.913 11.974 12.711 1.00 45.21 C ATOM 0 H ALA C 221 0.222 12.028 10.476 1.00 64.22 H new ATOM 0 HA ALA C 221 -1.077 9.948 12.023 1.00 1.52 H new ATOM 0 HB1 ALA C 221 -1.660 11.859 13.497 1.00 45.21 H new ATOM 0 HB2 ALA C 221 0.081 11.815 13.129 1.00 45.21 H new ATOM 0 HB3 ALA C 221 -0.975 12.980 12.296 1.00 45.21 H new ATOM 2048 N ASN C 222 -2.742 11.536 9.811 1.00 33.34 N ATOM 2049 CA ASN C 222 -4.063 11.875 9.239 1.00 63.23 C ATOM 2050 C ASN C 222 -4.562 10.774 8.271 1.00 70.34 C ATOM 2051 O ASN C 222 -5.613 10.895 7.642 1.00 51.41 O ATOM 2052 CB ASN C 222 -3.951 13.240 8.517 1.00 4.53 C ATOM 2053 CG ASN C 222 -5.284 13.866 8.125 1.00 50.12 C ATOM 2054 OD1 ASN C 222 -5.695 13.679 6.903 1.00 10.42 O flip ATOM 2055 ND2 ASN C 222 -5.907 14.564 8.924 1.00 61.22 N flip ATOM 0 H ASN C 222 -1.960 11.664 9.169 1.00 33.34 H new ATOM 0 HA ASN C 222 -4.797 11.942 10.042 1.00 63.23 H new ATOM 0 HB2 ASN C 222 -3.416 13.935 9.164 1.00 4.53 H new ATOM 0 HB3 ASN C 222 -3.347 13.112 7.618 1.00 4.53 H new ATOM 0 HD21 ASN C 222 -5.556 14.689 9.874 1.00 61.22 H new ATOM 0 HD22 ASN C 222 -6.774 15.018 8.637 1.00 61.22 H new ATOM 2062 N VAL C 223 -3.825 9.704 8.198 1.00 43.33 N ATOM 2063 CA VAL C 223 -4.118 8.587 7.296 1.00 14.35 C ATOM 2064 C VAL C 223 -4.629 7.337 8.066 1.00 35.45 C ATOM 2065 O VAL C 223 -4.278 7.146 9.206 1.00 71.34 O ATOM 2066 CB VAL C 223 -2.855 8.261 6.404 1.00 43.42 C ATOM 2067 CG1 VAL C 223 -1.597 8.349 7.220 1.00 74.53 C ATOM 2068 CG2 VAL C 223 -2.926 6.878 5.832 1.00 53.35 C ATOM 0 H VAL C 223 -2.988 9.564 8.764 1.00 43.33 H new ATOM 0 HA VAL C 223 -4.930 8.888 6.634 1.00 14.35 H new ATOM 0 HB VAL C 223 -2.845 8.993 5.596 1.00 43.42 H new ATOM 0 HG11 VAL C 223 -0.738 8.121 6.589 1.00 74.53 H new ATOM 0 HG12 VAL C 223 -1.495 9.356 7.623 1.00 74.53 H new ATOM 0 HG13 VAL C 223 -1.645 7.633 8.040 1.00 74.53 H new ATOM 0 HG21 VAL C 223 -2.041 6.690 5.225 1.00 53.35 H new ATOM 0 HG22 VAL C 223 -2.971 6.151 6.643 1.00 53.35 H new ATOM 0 HG23 VAL C 223 -3.818 6.786 5.212 1.00 53.35 H new ATOM 2078 N LYS C 224 -5.513 6.530 7.432 1.00 14.55 N ATOM 2079 CA LYS C 224 -6.012 5.288 8.056 1.00 15.01 C ATOM 2080 C LYS C 224 -5.183 4.070 7.640 1.00 74.23 C ATOM 2081 O LYS C 224 -5.031 3.123 8.399 1.00 61.43 O ATOM 2082 CB LYS C 224 -7.495 5.033 7.715 1.00 62.21 C ATOM 2083 CG LYS C 224 -8.430 6.124 8.201 1.00 0.44 C ATOM 2084 CD LYS C 224 -9.912 5.781 8.004 1.00 71.12 C ATOM 2085 CE LYS C 224 -10.276 5.601 6.545 1.00 33.14 C ATOM 2086 NZ LYS C 224 -11.704 5.254 6.367 1.00 43.21 N ATOM 0 H LYS C 224 -5.889 6.716 6.502 1.00 14.55 H new ATOM 0 HA LYS C 224 -5.916 5.429 9.133 1.00 15.01 H new ATOM 0 HB2 LYS C 224 -7.598 4.934 6.634 1.00 62.21 H new ATOM 0 HB3 LYS C 224 -7.801 4.083 8.153 1.00 62.21 H new ATOM 0 HG2 LYS C 224 -8.244 6.309 9.259 1.00 0.44 H new ATOM 0 HG3 LYS C 224 -8.204 7.050 7.671 1.00 0.44 H new ATOM 0 HD2 LYS C 224 -10.146 4.866 8.549 1.00 71.12 H new ATOM 0 HD3 LYS C 224 -10.525 6.573 8.433 1.00 71.12 H new ATOM 0 HE2 LYS C 224 -10.056 6.519 6.001 1.00 33.14 H new ATOM 0 HE3 LYS C 224 -9.656 4.817 6.111 1.00 33.14 H new ATOM 0 HZ1 LYS C 224 -11.910 5.140 5.354 1.00 43.21 H new ATOM 0 HZ2 LYS C 224 -11.910 4.364 6.864 1.00 43.21 H new ATOM 0 HZ3 LYS C 224 -12.297 6.014 6.757 1.00 43.21 H new ATOM 2100 N HIS C 225 -4.681 4.098 6.416 1.00 3.14 N ATOM 2101 CA HIS C 225 -3.874 2.998 5.850 1.00 44.54 C ATOM 2102 C HIS C 225 -3.300 3.373 4.502 1.00 34.32 C ATOM 2103 O HIS C 225 -3.697 4.390 3.922 1.00 34.21 O ATOM 2104 CB HIS C 225 -4.662 1.660 5.747 1.00 41.33 C ATOM 2105 CG HIS C 225 -6.014 1.736 5.083 1.00 3.42 C ATOM 2106 ND1 HIS C 225 -6.341 2.611 4.062 1.00 61.21 N ATOM 2107 CD2 HIS C 225 -7.148 1.059 5.354 1.00 20.01 C ATOM 2108 CE1 HIS C 225 -7.619 2.466 3.761 1.00 50.51 C ATOM 2109 NE2 HIS C 225 -8.121 1.534 4.520 1.00 11.00 N ATOM 0 H HIS C 225 -4.815 4.880 5.775 1.00 3.14 H new ATOM 0 HA HIS C 225 -3.054 2.836 6.550 1.00 44.54 H new ATOM 0 HB2 HIS C 225 -4.051 0.943 5.199 1.00 41.33 H new ATOM 0 HB3 HIS C 225 -4.796 1.262 6.753 1.00 41.33 H new ATOM 0 HD2 HIS C 225 -7.266 0.283 6.095 1.00 20.01 H new ATOM 0 HE1 HIS C 225 -8.158 3.026 3.011 1.00 50.51 H new ATOM 0 HE2 HIS C 225 -9.088 1.210 4.496 1.00 11.00 H new ATOM 2118 N LEU C 226 -2.435 2.522 3.978 1.00 72.12 N ATOM 2119 CA LEU C 226 -1.764 2.778 2.714 1.00 0.34 C ATOM 2120 C LEU C 226 -2.191 1.757 1.693 1.00 42.12 C ATOM 2121 O LEU C 226 -2.472 0.616 2.027 1.00 21.13 O ATOM 2122 CB LEU C 226 -0.227 2.699 2.869 1.00 12.30 C ATOM 2123 CG LEU C 226 0.441 3.706 3.805 1.00 34.14 C ATOM 2124 CD1 LEU C 226 1.945 3.467 3.854 1.00 74.15 C ATOM 2125 CD2 LEU C 226 0.151 5.128 3.359 1.00 5.43 C ATOM 0 H LEU C 226 -2.178 1.637 4.415 1.00 72.12 H new ATOM 0 HA LEU C 226 -2.040 3.782 2.391 1.00 0.34 H new ATOM 0 HB2 LEU C 226 0.025 1.697 3.218 1.00 12.30 H new ATOM 0 HB3 LEU C 226 0.217 2.813 1.880 1.00 12.30 H new ATOM 0 HG LEU C 226 0.030 3.568 4.805 1.00 34.14 H new ATOM 0 HD11 LEU C 226 2.407 4.192 4.524 1.00 74.15 H new ATOM 0 HD12 LEU C 226 2.141 2.459 4.218 1.00 74.15 H new ATOM 0 HD13 LEU C 226 2.364 3.579 2.854 1.00 74.15 H new ATOM 0 HD21 LEU C 226 0.636 5.829 4.039 1.00 5.43 H new ATOM 0 HD22 LEU C 226 0.534 5.278 2.350 1.00 5.43 H new ATOM 0 HD23 LEU C 226 -0.925 5.300 3.368 1.00 5.43 H new ATOM 2137 N LYS C 227 -2.270 2.184 0.476 1.00 31.43 N ATOM 2138 CA LYS C 227 -2.621 1.352 -0.639 1.00 72.44 C ATOM 2139 C LYS C 227 -1.426 1.342 -1.566 1.00 44.34 C ATOM 2140 O LYS C 227 -1.029 2.400 -2.048 1.00 23.25 O ATOM 2141 CB LYS C 227 -3.808 1.999 -1.378 1.00 73.20 C ATOM 2142 CG LYS C 227 -4.382 1.209 -2.545 1.00 52.42 C ATOM 2143 CD LYS C 227 -5.134 -0.036 -2.100 1.00 41.33 C ATOM 2144 CE LYS C 227 -6.319 0.323 -1.220 1.00 43.43 C ATOM 2145 NZ LYS C 227 -7.252 1.274 -1.880 1.00 71.34 N ATOM 0 H LYS C 227 -2.087 3.153 0.217 1.00 31.43 H new ATOM 0 HA LYS C 227 -2.889 0.345 -0.319 1.00 72.44 H new ATOM 0 HB2 LYS C 227 -4.606 2.174 -0.657 1.00 73.20 H new ATOM 0 HB3 LYS C 227 -3.492 2.975 -1.747 1.00 73.20 H new ATOM 0 HG2 LYS C 227 -5.054 1.849 -3.116 1.00 52.42 H new ATOM 0 HG3 LYS C 227 -3.573 0.919 -3.215 1.00 52.42 H new ATOM 0 HD2 LYS C 227 -5.481 -0.587 -2.974 1.00 41.33 H new ATOM 0 HD3 LYS C 227 -4.459 -0.696 -1.555 1.00 41.33 H new ATOM 0 HE2 LYS C 227 -6.859 -0.586 -0.955 1.00 43.43 H new ATOM 0 HE3 LYS C 227 -5.957 0.761 -0.290 1.00 43.43 H new ATOM 0 HZ1 LYS C 227 -8.233 0.985 -1.692 1.00 71.34 H new ATOM 0 HZ2 LYS C 227 -7.095 2.231 -1.505 1.00 71.34 H new ATOM 0 HZ3 LYS C 227 -7.081 1.272 -2.906 1.00 71.34 H new ATOM 2159 N ILE C 228 -0.840 0.197 -1.808 1.00 4.11 N ATOM 2160 CA ILE C 228 0.291 0.162 -2.698 1.00 4.35 C ATOM 2161 C ILE C 228 -0.135 -0.457 -4.000 1.00 12.40 C ATOM 2162 O ILE C 228 -0.722 -1.573 -4.025 1.00 53.31 O ATOM 2163 CB ILE C 228 1.514 -0.611 -2.154 1.00 70.23 C ATOM 2164 CG1 ILE C 228 1.851 -0.163 -0.739 1.00 63.05 C ATOM 2165 CG2 ILE C 228 2.712 -0.326 -3.060 1.00 62.23 C ATOM 2166 CD1 ILE C 228 3.076 -0.839 -0.163 1.00 63.15 C ATOM 0 H ILE C 228 -1.118 -0.701 -1.413 1.00 4.11 H new ATOM 0 HA ILE C 228 0.615 1.196 -2.819 1.00 4.35 H new ATOM 0 HB ILE C 228 1.282 -1.676 -2.138 1.00 70.23 H new ATOM 0 HG12 ILE C 228 2.007 0.916 -0.736 1.00 63.05 H new ATOM 0 HG13 ILE C 228 0.998 -0.363 -0.091 1.00 63.05 H new ATOM 0 HG21 ILE C 228 3.584 -0.864 -2.690 1.00 62.23 H new ATOM 0 HG22 ILE C 228 2.487 -0.654 -4.075 1.00 62.23 H new ATOM 0 HG23 ILE C 228 2.920 0.744 -3.062 1.00 62.23 H new ATOM 0 HD11 ILE C 228 3.254 -0.470 0.847 1.00 63.15 H new ATOM 0 HD12 ILE C 228 2.916 -1.917 -0.133 1.00 63.15 H new ATOM 0 HD13 ILE C 228 3.941 -0.618 -0.788 1.00 63.15 H new ATOM 2178 N LEU C 229 0.114 0.253 -5.062 1.00 22.12 N ATOM 2179 CA LEU C 229 -0.251 -0.169 -6.374 1.00 25.14 C ATOM 2180 C LEU C 229 0.589 0.467 -7.470 1.00 2.23 C ATOM 2181 O LEU C 229 0.345 1.569 -7.911 1.00 54.14 O ATOM 2182 CB LEU C 229 -1.776 -0.066 -6.593 1.00 70.23 C ATOM 2183 CG LEU C 229 -2.496 1.095 -5.879 1.00 20.03 C ATOM 2184 CD1 LEU C 229 -2.077 2.466 -6.374 1.00 45.31 C ATOM 2185 CD2 LEU C 229 -3.993 0.906 -5.922 1.00 64.31 C ATOM 0 H LEU C 229 0.585 1.157 -5.035 1.00 22.12 H new ATOM 0 HA LEU C 229 -0.008 -1.229 -6.452 1.00 25.14 H new ATOM 0 HB2 LEU C 229 -1.962 0.024 -7.663 1.00 70.23 H new ATOM 0 HB3 LEU C 229 -2.231 -1.001 -6.268 1.00 70.23 H new ATOM 0 HG LEU C 229 -2.179 1.062 -4.836 1.00 20.03 H new ATOM 0 HD11 LEU C 229 -2.624 3.233 -5.827 1.00 45.31 H new ATOM 0 HD12 LEU C 229 -1.007 2.599 -6.214 1.00 45.31 H new ATOM 0 HD13 LEU C 229 -2.298 2.552 -7.438 1.00 45.31 H new ATOM 0 HD21 LEU C 229 -4.480 1.737 -5.412 1.00 64.31 H new ATOM 0 HD22 LEU C 229 -4.326 0.872 -6.959 1.00 64.31 H new ATOM 0 HD23 LEU C 229 -4.256 -0.028 -5.426 1.00 64.31 H new ATOM 2197 N ASN C 230 1.585 -0.256 -7.886 1.00 35.04 N ATOM 2198 CA ASN C 230 2.486 0.189 -8.929 1.00 1.05 C ATOM 2199 C ASN C 230 1.810 -0.088 -10.265 1.00 32.11 C ATOM 2200 O ASN C 230 1.554 -1.235 -10.595 1.00 32.11 O ATOM 2201 CB ASN C 230 3.776 -0.655 -8.842 1.00 62.33 C ATOM 2202 CG ASN C 230 4.864 -0.262 -9.833 1.00 43.14 C ATOM 2203 OD1 ASN C 230 5.764 0.496 -9.515 1.00 52.14 O ATOM 2204 ND2 ASN C 230 4.784 -0.772 -11.030 1.00 15.00 N ATOM 0 H ASN C 230 1.805 -1.180 -7.514 1.00 35.04 H new ATOM 0 HA ASN C 230 2.722 1.248 -8.826 1.00 1.05 H new ATOM 0 HB2 ASN C 230 4.178 -0.576 -7.832 1.00 62.33 H new ATOM 0 HB3 ASN C 230 3.520 -1.702 -9.002 1.00 62.33 H new ATOM 0 HD21 ASN C 230 5.487 -0.540 -11.731 1.00 15.00 H new ATOM 0 HD22 ASN C 230 4.018 -1.404 -11.265 1.00 15.00 H new ATOM 2211 N THR C 231 1.487 0.933 -11.005 1.00 23.53 N ATOM 2212 CA THR C 231 0.841 0.725 -12.270 1.00 32.34 C ATOM 2213 C THR C 231 1.899 0.418 -13.361 1.00 42.14 C ATOM 2214 O THR C 231 3.046 0.867 -13.247 1.00 33.35 O ATOM 2215 CB THR C 231 -0.073 1.926 -12.646 1.00 62.33 C ATOM 2216 OG1 THR C 231 0.681 3.135 -12.650 1.00 1.14 O ATOM 2217 CG2 THR C 231 -1.225 2.071 -11.647 1.00 12.51 C ATOM 0 H THR C 231 1.658 1.908 -10.759 1.00 23.53 H new ATOM 0 HA THR C 231 0.184 -0.142 -12.193 1.00 32.34 H new ATOM 0 HB THR C 231 -0.480 1.735 -13.639 1.00 62.33 H new ATOM 0 HG1 THR C 231 0.720 3.493 -13.561 1.00 1.14 H new ATOM 0 HG21 THR C 231 -1.849 2.918 -11.932 1.00 12.51 H new ATOM 0 HG22 THR C 231 -1.825 1.161 -11.649 1.00 12.51 H new ATOM 0 HG23 THR C 231 -0.822 2.238 -10.648 1.00 12.51 H new ATOM 2225 N PRO C 232 1.533 -0.368 -14.421 1.00 3.10 N ATOM 2226 CA PRO C 232 2.474 -0.834 -15.513 1.00 32.03 C ATOM 2227 C PRO C 232 3.084 0.289 -16.397 1.00 40.34 C ATOM 2228 O PRO C 232 3.339 0.082 -17.589 1.00 22.04 O ATOM 2229 CB PRO C 232 1.568 -1.729 -16.382 1.00 45.32 C ATOM 2230 CG PRO C 232 0.422 -2.090 -15.505 1.00 42.03 C ATOM 2231 CD PRO C 232 0.176 -0.893 -14.643 1.00 22.54 C ATOM 0 HA PRO C 232 3.347 -1.315 -15.073 1.00 32.03 H new ATOM 0 HB2 PRO C 232 1.231 -1.200 -17.274 1.00 45.32 H new ATOM 0 HB3 PRO C 232 2.100 -2.618 -16.721 1.00 45.32 H new ATOM 0 HG2 PRO C 232 -0.461 -2.334 -16.096 1.00 42.03 H new ATOM 0 HG3 PRO C 232 0.653 -2.967 -14.900 1.00 42.03 H new ATOM 0 HD2 PRO C 232 -0.464 -0.163 -15.138 1.00 22.54 H new ATOM 0 HD3 PRO C 232 -0.312 -1.162 -13.706 1.00 22.54 H new ATOM 2239 N ASN C 233 3.363 1.418 -15.803 1.00 65.12 N ATOM 2240 CA ASN C 233 3.923 2.568 -16.506 1.00 14.43 C ATOM 2241 C ASN C 233 4.480 3.591 -15.520 1.00 12.02 C ATOM 2242 O ASN C 233 5.243 4.489 -15.890 1.00 4.22 O ATOM 2243 CB ASN C 233 2.839 3.222 -17.384 1.00 55.50 C ATOM 2244 CG ASN C 233 3.303 4.487 -18.099 1.00 1.15 C ATOM 2245 OD1 ASN C 233 3.845 4.428 -19.197 1.00 13.22 O ATOM 2246 ND2 ASN C 233 3.063 5.630 -17.499 1.00 14.40 N ATOM 0 H ASN C 233 3.211 1.579 -14.807 1.00 65.12 H new ATOM 0 HA ASN C 233 4.741 2.221 -17.138 1.00 14.43 H new ATOM 0 HB2 ASN C 233 2.502 2.499 -18.127 1.00 55.50 H new ATOM 0 HB3 ASN C 233 1.978 3.464 -16.761 1.00 55.50 H new ATOM 0 HD21 ASN C 233 3.330 6.507 -17.947 1.00 14.40 H new ATOM 0 HD22 ASN C 233 2.610 5.641 -16.585 1.00 14.40 H new ATOM 2253 N CYS C 234 4.170 3.420 -14.275 1.00 12.21 N ATOM 2254 CA CYS C 234 4.483 4.411 -13.289 1.00 13.33 C ATOM 2255 C CYS C 234 5.298 3.772 -12.190 1.00 1.24 C ATOM 2256 O CYS C 234 5.341 2.536 -12.087 1.00 55.05 O ATOM 2257 CB CYS C 234 3.161 4.996 -12.743 1.00 74.24 C ATOM 2258 SG CYS C 234 2.057 5.661 -14.060 1.00 20.23 S ATOM 0 H CYS C 234 3.695 2.594 -13.911 1.00 12.21 H new ATOM 0 HA CYS C 234 5.071 5.221 -13.721 1.00 13.33 H new ATOM 0 HB2 CYS C 234 2.630 4.221 -12.191 1.00 74.24 H new ATOM 0 HB3 CYS C 234 3.390 5.792 -12.034 1.00 74.24 H new ATOM 2263 N ALA C 235 5.993 4.589 -11.415 1.00 20.03 N ATOM 2264 CA ALA C 235 6.797 4.106 -10.301 1.00 24.11 C ATOM 2265 C ALA C 235 5.884 3.561 -9.204 1.00 50.04 C ATOM 2266 O ALA C 235 4.668 3.440 -9.406 1.00 53.43 O ATOM 2267 CB ALA C 235 7.664 5.240 -9.763 1.00 45.43 C ATOM 0 H ALA C 235 6.017 5.601 -11.538 1.00 20.03 H new ATOM 0 HA ALA C 235 7.448 3.302 -10.643 1.00 24.11 H new ATOM 0 HB1 ALA C 235 8.264 4.875 -8.930 1.00 45.43 H new ATOM 0 HB2 ALA C 235 8.322 5.601 -10.553 1.00 45.43 H new ATOM 0 HB3 ALA C 235 7.026 6.055 -9.421 1.00 45.43 H new ATOM 2273 N CYS C 236 6.442 3.240 -8.049 1.00 31.31 N ATOM 2274 CA CYS C 236 5.630 2.720 -6.967 1.00 23.41 C ATOM 2275 C CYS C 236 4.609 3.779 -6.591 1.00 11.30 C ATOM 2276 O CYS C 236 4.944 4.944 -6.471 1.00 61.13 O ATOM 2277 CB CYS C 236 6.496 2.336 -5.752 1.00 13.54 C ATOM 2278 SG CYS C 236 5.565 1.534 -4.396 1.00 5.13 S ATOM 0 H CYS C 236 7.436 3.329 -7.840 1.00 31.31 H new ATOM 0 HA CYS C 236 5.124 1.812 -7.293 1.00 23.41 H new ATOM 0 HB2 CYS C 236 7.288 1.664 -6.082 1.00 13.54 H new ATOM 0 HB3 CYS C 236 6.979 3.233 -5.366 1.00 13.54 H new ATOM 2283 N GLN C 237 3.377 3.400 -6.490 1.00 2.11 N ATOM 2284 CA GLN C 237 2.345 4.347 -6.180 1.00 75.41 C ATOM 2285 C GLN C 237 1.725 3.976 -4.862 1.00 34.33 C ATOM 2286 O GLN C 237 1.072 2.930 -4.747 1.00 60.24 O ATOM 2287 CB GLN C 237 1.261 4.344 -7.261 1.00 41.25 C ATOM 2288 CG GLN C 237 1.733 4.622 -8.692 1.00 20.23 C ATOM 2289 CD GLN C 237 2.274 6.022 -8.912 1.00 64.22 C ATOM 2290 OE1 GLN C 237 1.528 6.941 -9.246 1.00 4.32 O ATOM 2291 NE2 GLN C 237 3.548 6.189 -8.760 1.00 10.34 N ATOM 0 H GLN C 237 3.056 2.440 -6.617 1.00 2.11 H new ATOM 0 HA GLN C 237 2.785 5.343 -6.130 1.00 75.41 H new ATOM 0 HB2 GLN C 237 0.765 3.374 -7.246 1.00 41.25 H new ATOM 0 HB3 GLN C 237 0.511 5.089 -6.996 1.00 41.25 H new ATOM 0 HG2 GLN C 237 2.508 3.901 -8.953 1.00 20.23 H new ATOM 0 HG3 GLN C 237 0.900 4.456 -9.375 1.00 20.23 H new ATOM 0 HE21 GLN C 237 4.136 5.403 -8.482 1.00 10.34 H new ATOM 0 HE22 GLN C 237 3.965 7.107 -8.918 1.00 10.34 H new ATOM 2300 N ILE C 238 1.957 4.778 -3.870 1.00 30.53 N ATOM 2301 CA ILE C 238 1.351 4.566 -2.590 1.00 22.22 C ATOM 2302 C ILE C 238 0.297 5.608 -2.383 1.00 32.44 C ATOM 2303 O ILE C 238 0.556 6.787 -2.481 1.00 50.34 O ATOM 2304 CB ILE C 238 2.378 4.566 -1.427 1.00 61.31 C ATOM 2305 CG1 ILE C 238 3.354 3.394 -1.606 1.00 62.22 C ATOM 2306 CG2 ILE C 238 1.670 4.477 -0.072 1.00 72.14 C ATOM 2307 CD1 ILE C 238 4.382 3.266 -0.509 1.00 71.33 C ATOM 0 H ILE C 238 2.568 5.593 -3.922 1.00 30.53 H new ATOM 0 HA ILE C 238 0.903 3.572 -2.583 1.00 22.22 H new ATOM 0 HB ILE C 238 2.935 5.503 -1.448 1.00 61.31 H new ATOM 0 HG12 ILE C 238 2.783 2.467 -1.662 1.00 62.22 H new ATOM 0 HG13 ILE C 238 3.870 3.509 -2.559 1.00 62.22 H new ATOM 0 HG21 ILE C 238 2.412 4.479 0.727 1.00 72.14 H new ATOM 0 HG22 ILE C 238 1.005 5.333 0.048 1.00 72.14 H new ATOM 0 HG23 ILE C 238 1.088 3.556 -0.025 1.00 72.14 H new ATOM 0 HD11 ILE C 238 5.029 2.414 -0.715 1.00 71.33 H new ATOM 0 HD12 ILE C 238 4.982 4.175 -0.465 1.00 71.33 H new ATOM 0 HD13 ILE C 238 3.878 3.117 0.446 1.00 71.33 H new ATOM 2319 N VAL C 239 -0.887 5.172 -2.149 1.00 40.13 N ATOM 2320 CA VAL C 239 -2.006 6.050 -2.011 1.00 54.35 C ATOM 2321 C VAL C 239 -2.602 5.905 -0.600 1.00 65.44 C ATOM 2322 O VAL C 239 -2.675 4.796 -0.069 1.00 45.31 O ATOM 2323 CB VAL C 239 -3.042 5.725 -3.124 1.00 5.12 C ATOM 2324 CG1 VAL C 239 -4.233 6.615 -3.048 1.00 54.32 C ATOM 2325 CG2 VAL C 239 -2.392 5.852 -4.497 1.00 3.45 C ATOM 0 H VAL C 239 -1.116 4.183 -2.045 1.00 40.13 H new ATOM 0 HA VAL C 239 -1.700 7.089 -2.130 1.00 54.35 H new ATOM 0 HB VAL C 239 -3.379 4.700 -2.970 1.00 5.12 H new ATOM 0 HG11 VAL C 239 -4.932 6.355 -3.843 1.00 54.32 H new ATOM 0 HG12 VAL C 239 -4.720 6.490 -2.081 1.00 54.32 H new ATOM 0 HG13 VAL C 239 -3.920 7.653 -3.165 1.00 54.32 H new ATOM 0 HG21 VAL C 239 -3.126 5.622 -5.270 1.00 3.45 H new ATOM 0 HG22 VAL C 239 -2.027 6.870 -4.634 1.00 3.45 H new ATOM 0 HG23 VAL C 239 -1.558 5.155 -4.570 1.00 3.45 H new ATOM 2335 N ALA C 240 -3.013 7.002 0.003 1.00 40.42 N ATOM 2336 CA ALA C 240 -3.469 6.973 1.376 1.00 4.15 C ATOM 2337 C ALA C 240 -4.907 7.430 1.535 1.00 1.21 C ATOM 2338 O ALA C 240 -5.321 8.471 1.026 1.00 32.23 O ATOM 2339 CB ALA C 240 -2.557 7.796 2.275 1.00 53.22 C ATOM 0 H ALA C 240 -3.040 7.922 -0.436 1.00 40.42 H new ATOM 0 HA ALA C 240 -3.428 5.928 1.683 1.00 4.15 H new ATOM 0 HB1 ALA C 240 -2.924 7.756 3.300 1.00 53.22 H new ATOM 0 HB2 ALA C 240 -1.546 7.391 2.236 1.00 53.22 H new ATOM 0 HB3 ALA C 240 -2.547 8.831 1.933 1.00 53.22 H new ATOM 2345 N ARG C 241 -5.634 6.664 2.286 1.00 21.33 N ATOM 2346 CA ARG C 241 -7.011 6.936 2.593 1.00 34.21 C ATOM 2347 C ARG C 241 -7.044 7.653 3.934 1.00 50.21 C ATOM 2348 O ARG C 241 -6.632 7.091 4.960 1.00 51.51 O ATOM 2349 CB ARG C 241 -7.768 5.594 2.657 1.00 62.42 C ATOM 2350 CG ARG C 241 -9.187 5.652 3.198 1.00 51.00 C ATOM 2351 CD ARG C 241 -10.126 6.462 2.347 1.00 13.21 C ATOM 2352 NE ARG C 241 -10.436 5.856 1.039 1.00 42.13 N ATOM 2353 CZ ARG C 241 -11.233 6.437 0.131 1.00 54.01 C ATOM 2354 NH1 ARG C 241 -11.684 7.677 0.340 1.00 22.04 N ATOM 2355 NH2 ARG C 241 -11.559 5.791 -0.992 1.00 42.13 N ATOM 0 H ARG C 241 -5.281 5.809 2.716 1.00 21.33 H new ATOM 0 HA ARG C 241 -7.486 7.562 1.838 1.00 34.21 H new ATOM 0 HB2 ARG C 241 -7.801 5.170 1.653 1.00 62.42 H new ATOM 0 HB3 ARG C 241 -7.193 4.905 3.275 1.00 62.42 H new ATOM 0 HG2 ARG C 241 -9.575 4.637 3.286 1.00 51.00 H new ATOM 0 HG3 ARG C 241 -9.166 6.074 4.203 1.00 51.00 H new ATOM 0 HD2 ARG C 241 -11.057 6.611 2.895 1.00 13.21 H new ATOM 0 HD3 ARG C 241 -9.691 7.448 2.183 1.00 13.21 H new ATOM 0 HE ARG C 241 -10.024 4.950 0.814 1.00 42.13 H new ATOM 0 HH11 ARG C 241 -11.422 8.179 1.188 1.00 22.04 H new ATOM 0 HH12 ARG C 241 -12.291 8.122 -0.349 1.00 22.04 H new ATOM 0 HH21 ARG C 241 -11.201 4.851 -1.162 1.00 42.13 H new ATOM 0 HH22 ARG C 241 -12.166 6.238 -1.680 1.00 42.13 H new ATOM 2369 N LEU C 242 -7.500 8.889 3.912 1.00 22.52 N ATOM 2370 CA LEU C 242 -7.471 9.753 5.079 1.00 71.13 C ATOM 2371 C LEU C 242 -8.482 9.368 6.142 1.00 32.31 C ATOM 2372 O LEU C 242 -9.447 8.644 5.879 1.00 34.45 O ATOM 2373 CB LEU C 242 -7.613 11.227 4.678 1.00 21.34 C ATOM 2374 CG LEU C 242 -6.520 11.765 3.746 1.00 51.03 C ATOM 2375 CD1 LEU C 242 -6.698 13.250 3.512 1.00 42.23 C ATOM 2376 CD2 LEU C 242 -5.125 11.454 4.287 1.00 61.21 C ATOM 0 H LEU C 242 -7.903 9.326 3.083 1.00 22.52 H new ATOM 0 HA LEU C 242 -6.492 9.612 5.537 1.00 71.13 H new ATOM 0 HB2 LEU C 242 -8.579 11.362 4.192 1.00 21.34 H new ATOM 0 HB3 LEU C 242 -7.624 11.833 5.584 1.00 21.34 H new ATOM 0 HG LEU C 242 -6.618 11.258 2.786 1.00 51.03 H new ATOM 0 HD11 LEU C 242 -5.912 13.611 2.848 1.00 42.23 H new ATOM 0 HD12 LEU C 242 -7.671 13.432 3.055 1.00 42.23 H new ATOM 0 HD13 LEU C 242 -6.640 13.778 4.464 1.00 42.23 H new ATOM 0 HD21 LEU C 242 -4.373 11.849 3.603 1.00 61.21 H new ATOM 0 HD22 LEU C 242 -5.003 11.916 5.266 1.00 61.21 H new ATOM 0 HD23 LEU C 242 -5.002 10.375 4.378 1.00 61.21 H new ATOM 2388 N LYS C 243 -8.242 9.856 7.340 1.00 43.33 N ATOM 2389 CA LYS C 243 -9.056 9.564 8.503 1.00 32.41 C ATOM 2390 C LYS C 243 -10.392 10.287 8.525 1.00 34.01 C ATOM 2391 O LYS C 243 -10.495 11.386 9.070 1.00 13.25 O ATOM 2392 CB LYS C 243 -8.268 9.826 9.796 1.00 31.40 C ATOM 2393 CG LYS C 243 -7.128 8.848 10.022 1.00 1.10 C ATOM 2394 CD LYS C 243 -6.192 9.271 11.144 1.00 43.32 C ATOM 2395 CE LYS C 243 -6.896 9.488 12.463 1.00 3.45 C ATOM 2396 NZ LYS C 243 -5.932 9.835 13.529 1.00 43.23 N ATOM 0 H LYS C 243 -7.460 10.480 7.538 1.00 43.33 H new ATOM 0 HA LYS C 243 -9.300 8.504 8.436 1.00 32.41 H new ATOM 0 HB2 LYS C 243 -7.866 10.839 9.768 1.00 31.40 H new ATOM 0 HB3 LYS C 243 -8.951 9.777 10.644 1.00 31.40 H new ATOM 0 HG2 LYS C 243 -7.540 7.866 10.252 1.00 1.10 H new ATOM 0 HG3 LYS C 243 -6.557 8.746 9.099 1.00 1.10 H new ATOM 0 HD2 LYS C 243 -5.423 8.509 11.272 1.00 43.32 H new ATOM 0 HD3 LYS C 243 -5.684 10.191 10.856 1.00 43.32 H new ATOM 0 HE2 LYS C 243 -7.631 10.286 12.359 1.00 3.45 H new ATOM 0 HE3 LYS C 243 -7.441 8.586 12.741 1.00 3.45 H new ATOM 0 HZ1 LYS C 243 -5.832 9.031 14.181 1.00 43.23 H new ATOM 0 HZ2 LYS C 243 -5.008 10.053 13.104 1.00 43.23 H new ATOM 0 HZ3 LYS C 243 -6.277 10.665 14.052 1.00 43.23 H new ATOM 2410 N ASN C 244 -11.391 9.684 7.851 1.00 52.23 N ATOM 2411 CA ASN C 244 -12.820 10.102 7.911 1.00 12.31 C ATOM 2412 C ASN C 244 -13.136 11.404 7.182 1.00 22.44 C ATOM 2413 O ASN C 244 -13.991 11.435 6.299 1.00 25.33 O ATOM 2414 CB ASN C 244 -13.283 10.202 9.384 1.00 73.52 C ATOM 2415 CG ASN C 244 -14.728 10.642 9.552 1.00 72.20 C ATOM 2416 OD1 ASN C 244 -15.633 9.817 9.577 1.00 21.43 O ATOM 2417 ND2 ASN C 244 -14.948 11.926 9.707 1.00 71.34 N ATOM 0 H ASN C 244 -11.234 8.882 7.240 1.00 52.23 H new ATOM 0 HA ASN C 244 -13.372 9.325 7.382 1.00 12.31 H new ATOM 0 HB2 ASN C 244 -13.152 9.231 9.861 1.00 73.52 H new ATOM 0 HB3 ASN C 244 -12.637 10.905 9.910 1.00 73.52 H new ATOM 0 HD21 ASN C 244 -15.898 12.266 9.854 1.00 71.34 H new ATOM 0 HD22 ASN C 244 -14.169 12.584 9.680 1.00 71.34 H new ATOM 2424 N ASN C 245 -12.400 12.426 7.546 1.00 44.01 N ATOM 2425 CA ASN C 245 -12.630 13.827 7.200 1.00 11.21 C ATOM 2426 C ASN C 245 -13.207 14.098 5.807 1.00 64.24 C ATOM 2427 O ASN C 245 -14.383 14.432 5.699 1.00 31.33 O ATOM 2428 CB ASN C 245 -11.379 14.651 7.467 1.00 71.12 C ATOM 2429 CG ASN C 245 -11.594 16.133 7.269 1.00 24.53 C ATOM 2430 OD1 ASN C 245 -12.005 16.838 8.192 1.00 53.11 O ATOM 2431 ND2 ASN C 245 -11.281 16.627 6.107 1.00 1.33 N ATOM 0 H ASN C 245 -11.571 12.305 8.128 1.00 44.01 H new ATOM 0 HA ASN C 245 -13.434 14.147 7.863 1.00 11.21 H new ATOM 0 HB2 ASN C 245 -11.044 14.472 8.489 1.00 71.12 H new ATOM 0 HB3 ASN C 245 -10.581 14.314 6.806 1.00 71.12 H new ATOM 0 HD21 ASN C 245 -11.373 17.629 5.937 1.00 1.33 H new ATOM 0 HD22 ASN C 245 -10.944 16.013 5.366 1.00 1.33 H new ATOM 2438 N ASN C 246 -12.430 13.957 4.738 1.00 32.41 N ATOM 2439 CA ASN C 246 -12.994 14.323 3.436 1.00 0.34 C ATOM 2440 C ASN C 246 -12.431 13.564 2.245 1.00 60.43 C ATOM 2441 O ASN C 246 -13.188 12.956 1.489 1.00 52.03 O ATOM 2442 CB ASN C 246 -12.867 15.842 3.186 1.00 72.23 C ATOM 2443 CG ASN C 246 -13.482 16.302 1.861 1.00 4.12 C ATOM 2444 OD1 ASN C 246 -14.458 15.725 1.361 1.00 11.14 O ATOM 2445 ND2 ASN C 246 -12.918 17.335 1.285 1.00 51.21 N ATOM 0 H ASN C 246 -11.469 13.615 4.735 1.00 32.41 H new ATOM 0 HA ASN C 246 -14.041 14.030 3.507 1.00 0.34 H new ATOM 0 HB2 ASN C 246 -13.348 16.377 4.005 1.00 72.23 H new ATOM 0 HB3 ASN C 246 -11.812 16.117 3.201 1.00 72.23 H new ATOM 0 HD21 ASN C 246 -13.281 17.686 0.399 1.00 51.21 H new ATOM 0 HD22 ASN C 246 -12.116 17.788 1.723 1.00 51.21 H new ATOM 2452 N ARG C 247 -11.130 13.573 2.062 1.00 50.33 N ATOM 2453 CA ARG C 247 -10.604 13.077 0.810 1.00 24.14 C ATOM 2454 C ARG C 247 -9.731 11.842 0.886 1.00 61.42 C ATOM 2455 O ARG C 247 -9.475 11.282 1.956 1.00 1.50 O ATOM 2456 CB ARG C 247 -9.928 14.179 0.018 1.00 32.42 C ATOM 2457 CG ARG C 247 -8.815 14.896 0.716 1.00 13.33 C ATOM 2458 CD ARG C 247 -8.201 15.868 -0.240 1.00 51.13 C ATOM 2459 NE ARG C 247 -7.140 16.671 0.370 1.00 10.30 N ATOM 2460 CZ ARG C 247 -5.894 16.813 -0.109 1.00 11.03 C ATOM 2461 NH1 ARG C 247 -5.526 16.200 -1.228 1.00 44.22 N ATOM 2462 NH2 ARG C 247 -5.028 17.587 0.530 1.00 24.43 N ATOM 0 H ARG C 247 -10.439 13.904 2.735 1.00 50.33 H new ATOM 0 HA ARG C 247 -11.492 12.734 0.279 1.00 24.14 H new ATOM 0 HB2 ARG C 247 -9.536 13.750 -0.904 1.00 32.42 H new ATOM 0 HB3 ARG C 247 -10.684 14.911 -0.267 1.00 32.42 H new ATOM 0 HG2 ARG C 247 -9.193 15.418 1.595 1.00 13.33 H new ATOM 0 HG3 ARG C 247 -8.067 14.184 1.065 1.00 13.33 H new ATOM 0 HD2 ARG C 247 -7.794 15.324 -1.093 1.00 51.13 H new ATOM 0 HD3 ARG C 247 -8.976 16.531 -0.625 1.00 51.13 H new ATOM 0 HE ARG C 247 -7.367 17.165 1.233 1.00 10.30 H new ATOM 0 HH11 ARG C 247 -6.192 15.615 -1.732 1.00 44.22 H new ATOM 0 HH12 ARG C 247 -4.577 16.314 -1.584 1.00 44.22 H new ATOM 0 HH21 ARG C 247 -5.309 18.072 1.382 1.00 24.43 H new ATOM 0 HH22 ARG C 247 -4.080 17.698 0.170 1.00 24.43 H new ATOM 2476 N GLN C 248 -9.329 11.425 -0.289 1.00 53.33 N ATOM 2477 CA GLN C 248 -8.474 10.299 -0.550 1.00 10.23 C ATOM 2478 C GLN C 248 -7.223 10.945 -1.199 1.00 31.42 C ATOM 2479 O GLN C 248 -7.379 11.766 -2.110 1.00 41.22 O ATOM 2480 CB GLN C 248 -9.251 9.446 -1.590 1.00 4.35 C ATOM 2481 CG GLN C 248 -8.831 8.000 -1.827 1.00 53.21 C ATOM 2482 CD GLN C 248 -7.408 7.820 -2.193 1.00 54.23 C ATOM 2483 OE1 GLN C 248 -6.581 7.600 -1.340 1.00 24.33 O ATOM 2484 NE2 GLN C 248 -7.106 7.946 -3.459 1.00 53.14 N ATOM 0 H GLN C 248 -9.612 11.899 -1.147 1.00 53.33 H new ATOM 0 HA GLN C 248 -8.202 9.684 0.307 1.00 10.23 H new ATOM 0 HB2 GLN C 248 -10.299 9.439 -1.291 1.00 4.35 H new ATOM 0 HB3 GLN C 248 -9.196 9.965 -2.547 1.00 4.35 H new ATOM 0 HG2 GLN C 248 -9.035 7.424 -0.924 1.00 53.21 H new ATOM 0 HG3 GLN C 248 -9.451 7.581 -2.619 1.00 53.21 H new ATOM 0 HE21 GLN C 248 -7.840 8.132 -4.142 1.00 53.14 H new ATOM 0 HE22 GLN C 248 -6.136 7.859 -3.763 1.00 53.14 H new ATOM 2493 N VAL C 249 -6.021 10.614 -0.751 1.00 64.35 N ATOM 2494 CA VAL C 249 -4.828 11.322 -1.247 1.00 51.54 C ATOM 2495 C VAL C 249 -3.759 10.382 -1.784 1.00 23.45 C ATOM 2496 O VAL C 249 -3.696 9.221 -1.414 1.00 20.14 O ATOM 2497 CB VAL C 249 -4.215 12.305 -0.202 1.00 50.13 C ATOM 2498 CG1 VAL C 249 -5.219 13.354 0.203 1.00 21.25 C ATOM 2499 CG2 VAL C 249 -3.688 11.595 1.017 1.00 14.23 C ATOM 0 H VAL C 249 -5.837 9.882 -0.064 1.00 64.35 H new ATOM 0 HA VAL C 249 -5.193 11.920 -2.082 1.00 51.54 H new ATOM 0 HB VAL C 249 -3.369 12.789 -0.689 1.00 50.13 H new ATOM 0 HG11 VAL C 249 -4.768 14.027 0.932 1.00 21.25 H new ATOM 0 HG12 VAL C 249 -5.525 13.923 -0.675 1.00 21.25 H new ATOM 0 HG13 VAL C 249 -6.091 12.872 0.645 1.00 21.25 H new ATOM 0 HG21 VAL C 249 -3.273 12.325 1.712 1.00 14.23 H new ATOM 0 HG22 VAL C 249 -4.500 11.053 1.502 1.00 14.23 H new ATOM 0 HG23 VAL C 249 -2.909 10.892 0.721 1.00 14.23 H new ATOM 2509 N CYS C 250 -2.921 10.895 -2.646 1.00 55.15 N ATOM 2510 CA CYS C 250 -1.891 10.100 -3.304 1.00 14.03 C ATOM 2511 C CYS C 250 -0.568 10.447 -2.649 1.00 34.43 C ATOM 2512 O CYS C 250 -0.343 11.590 -2.366 1.00 11.42 O ATOM 2513 CB CYS C 250 -1.870 10.492 -4.768 1.00 24.43 C ATOM 2514 SG CYS C 250 -0.963 9.358 -5.898 1.00 63.05 S ATOM 0 H CYS C 250 -2.925 11.878 -2.919 1.00 55.15 H new ATOM 0 HA CYS C 250 -2.077 9.029 -3.218 1.00 14.03 H new ATOM 0 HB2 CYS C 250 -2.900 10.572 -5.116 1.00 24.43 H new ATOM 0 HB3 CYS C 250 -1.428 11.485 -4.851 1.00 24.43 H new ATOM 2519 N ILE C 251 0.306 9.495 -2.414 1.00 71.11 N ATOM 2520 CA ILE C 251 1.513 9.796 -1.639 1.00 1.24 C ATOM 2521 C ILE C 251 2.785 9.485 -2.438 1.00 3.23 C ATOM 2522 O ILE C 251 2.778 8.624 -3.328 1.00 64.52 O ATOM 2523 CB ILE C 251 1.576 8.922 -0.336 1.00 60.31 C ATOM 2524 CG1 ILE C 251 0.239 8.865 0.395 1.00 74.40 C ATOM 2525 CG2 ILE C 251 2.612 9.479 0.610 1.00 30.03 C ATOM 2526 CD1 ILE C 251 -0.278 10.199 0.858 1.00 13.34 C ATOM 0 H ILE C 251 0.220 8.530 -2.732 1.00 71.11 H new ATOM 0 HA ILE C 251 1.463 10.858 -1.397 1.00 1.24 H new ATOM 0 HB ILE C 251 1.838 7.912 -0.650 1.00 60.31 H new ATOM 0 HG12 ILE C 251 -0.502 8.412 -0.264 1.00 74.40 H new ATOM 0 HG13 ILE C 251 0.340 8.209 1.260 1.00 74.40 H new ATOM 0 HG21 ILE C 251 2.649 8.867 1.511 1.00 30.03 H new ATOM 0 HG22 ILE C 251 3.589 9.471 0.126 1.00 30.03 H new ATOM 0 HG23 ILE C 251 2.348 10.502 0.877 1.00 30.03 H new ATOM 0 HD11 ILE C 251 -1.232 10.063 1.367 1.00 13.34 H new ATOM 0 HD12 ILE C 251 0.439 10.648 1.545 1.00 13.34 H new ATOM 0 HD13 ILE C 251 -0.416 10.854 -0.002 1.00 13.34 H new ATOM 2538 N ASP C 252 3.859 10.212 -2.130 1.00 53.41 N ATOM 2539 CA ASP C 252 5.180 9.880 -2.645 1.00 22.52 C ATOM 2540 C ASP C 252 5.677 8.659 -1.898 1.00 12.42 C ATOM 2541 O ASP C 252 5.799 8.682 -0.670 1.00 13.21 O ATOM 2542 CB ASP C 252 6.183 11.042 -2.474 1.00 1.03 C ATOM 2543 CG ASP C 252 7.600 10.673 -2.938 1.00 23.13 C ATOM 2544 OD1 ASP C 252 7.799 10.421 -4.152 1.00 65.21 O ATOM 2545 OD2 ASP C 252 8.524 10.620 -2.103 1.00 10.54 O ATOM 0 H ASP C 252 3.836 11.034 -1.526 1.00 53.41 H new ATOM 0 HA ASP C 252 5.102 9.685 -3.715 1.00 22.52 H new ATOM 0 HB2 ASP C 252 5.833 11.905 -3.040 1.00 1.03 H new ATOM 0 HB3 ASP C 252 6.214 11.339 -1.426 1.00 1.03 H new ATOM 2550 N PRO C 253 5.973 7.583 -2.609 1.00 24.12 N ATOM 2551 CA PRO C 253 6.370 6.311 -1.994 1.00 41.02 C ATOM 2552 C PRO C 253 7.815 6.311 -1.529 1.00 1.54 C ATOM 2553 O PRO C 253 8.336 5.289 -1.106 1.00 43.41 O ATOM 2554 CB PRO C 253 6.209 5.335 -3.147 1.00 32.14 C ATOM 2555 CG PRO C 253 6.555 6.144 -4.337 1.00 65.55 C ATOM 2556 CD PRO C 253 5.959 7.494 -4.082 1.00 34.21 C ATOM 0 HA PRO C 253 5.783 6.082 -1.105 1.00 41.02 H new ATOM 0 HB2 PRO C 253 6.871 4.475 -3.040 1.00 32.14 H new ATOM 0 HB3 PRO C 253 5.191 4.949 -3.207 1.00 32.14 H new ATOM 0 HG2 PRO C 253 7.635 6.209 -4.468 1.00 65.55 H new ATOM 0 HG3 PRO C 253 6.150 5.700 -5.246 1.00 65.55 H new ATOM 0 HD2 PRO C 253 6.547 8.289 -4.541 1.00 34.21 H new ATOM 0 HD3 PRO C 253 4.948 7.572 -4.483 1.00 34.21 H new ATOM 2564 N LYS C 254 8.461 7.447 -1.640 1.00 60.21 N ATOM 2565 CA LYS C 254 9.809 7.561 -1.281 1.00 74.23 C ATOM 2566 C LYS C 254 9.981 8.475 -0.048 1.00 12.54 C ATOM 2567 O LYS C 254 11.093 8.811 0.324 1.00 41.44 O ATOM 2568 CB LYS C 254 10.571 8.056 -2.500 1.00 42.21 C ATOM 2569 CG LYS C 254 10.419 7.113 -3.710 1.00 65.34 C ATOM 2570 CD LYS C 254 11.115 7.637 -4.949 1.00 11.34 C ATOM 2571 CE LYS C 254 12.606 7.727 -4.749 1.00 21.34 C ATOM 2572 NZ LYS C 254 13.250 6.386 -4.579 1.00 63.13 N ATOM 0 H LYS C 254 8.042 8.310 -1.987 1.00 60.21 H new ATOM 0 HA LYS C 254 10.214 6.595 -0.981 1.00 74.23 H new ATOM 0 HB2 LYS C 254 10.213 9.050 -2.770 1.00 42.21 H new ATOM 0 HB3 LYS C 254 11.627 8.154 -2.250 1.00 42.21 H new ATOM 0 HG2 LYS C 254 10.826 6.134 -3.456 1.00 65.34 H new ATOM 0 HG3 LYS C 254 9.360 6.972 -3.925 1.00 65.34 H new ATOM 0 HD2 LYS C 254 10.899 6.982 -5.793 1.00 11.34 H new ATOM 0 HD3 LYS C 254 10.721 8.622 -5.200 1.00 11.34 H new ATOM 0 HE2 LYS C 254 13.053 8.234 -5.604 1.00 21.34 H new ATOM 0 HE3 LYS C 254 12.814 8.339 -3.871 1.00 21.34 H new ATOM 0 HZ1 LYS C 254 14.283 6.500 -4.530 1.00 63.13 H new ATOM 0 HZ2 LYS C 254 12.908 5.946 -3.701 1.00 63.13 H new ATOM 0 HZ3 LYS C 254 13.007 5.779 -5.388 1.00 63.13 H new ATOM 2586 N LEU C 255 8.864 8.848 0.583 1.00 3.21 N ATOM 2587 CA LEU C 255 8.884 9.652 1.826 1.00 42.30 C ATOM 2588 C LEU C 255 9.577 8.929 2.944 1.00 41.43 C ATOM 2589 O LEU C 255 9.454 7.735 3.056 1.00 22.23 O ATOM 2590 CB LEU C 255 7.482 9.937 2.305 1.00 41.24 C ATOM 2591 CG LEU C 255 6.676 10.929 1.533 1.00 14.41 C ATOM 2592 CD1 LEU C 255 5.280 10.913 2.066 1.00 11.05 C ATOM 2593 CD2 LEU C 255 7.264 12.306 1.724 1.00 30.44 C ATOM 0 H LEU C 255 7.927 8.609 0.258 1.00 3.21 H new ATOM 0 HA LEU C 255 9.414 10.572 1.581 1.00 42.30 H new ATOM 0 HB2 LEU C 255 6.933 8.995 2.318 1.00 41.24 H new ATOM 0 HB3 LEU C 255 7.543 10.284 3.337 1.00 41.24 H new ATOM 0 HG LEU C 255 6.681 10.677 0.472 1.00 14.41 H new ATOM 0 HD11 LEU C 255 4.672 11.631 1.516 1.00 11.05 H new ATOM 0 HD12 LEU C 255 4.857 9.915 1.949 1.00 11.05 H new ATOM 0 HD13 LEU C 255 5.291 11.181 3.123 1.00 11.05 H new ATOM 0 HD21 LEU C 255 6.678 13.033 1.162 1.00 30.44 H new ATOM 0 HD22 LEU C 255 7.246 12.566 2.782 1.00 30.44 H new ATOM 0 HD23 LEU C 255 8.293 12.315 1.366 1.00 30.44 H new ATOM 2605 N LYS C 256 10.256 9.676 3.816 1.00 62.43 N ATOM 2606 CA LYS C 256 10.970 9.088 4.948 1.00 20.43 C ATOM 2607 C LYS C 256 10.011 8.283 5.832 1.00 12.12 C ATOM 2608 O LYS C 256 10.346 7.179 6.254 1.00 53.21 O ATOM 2609 CB LYS C 256 11.743 10.186 5.742 1.00 14.50 C ATOM 2610 CG LYS C 256 12.708 9.695 6.861 1.00 25.34 C ATOM 2611 CD LYS C 256 12.023 9.219 8.138 1.00 21.10 C ATOM 2612 CE LYS C 256 13.064 8.755 9.161 1.00 3.44 C ATOM 2613 NZ LYS C 256 12.461 8.373 10.463 1.00 3.33 N ATOM 0 H LYS C 256 10.326 10.692 3.759 1.00 62.43 H new ATOM 0 HA LYS C 256 11.716 8.388 4.573 1.00 20.43 H new ATOM 0 HB2 LYS C 256 12.320 10.777 5.031 1.00 14.50 H new ATOM 0 HB3 LYS C 256 11.012 10.856 6.194 1.00 14.50 H new ATOM 0 HG2 LYS C 256 13.314 8.880 6.466 1.00 25.34 H new ATOM 0 HG3 LYS C 256 13.391 10.506 7.113 1.00 25.34 H new ATOM 0 HD2 LYS C 256 11.424 10.026 8.560 1.00 21.10 H new ATOM 0 HD3 LYS C 256 11.340 8.401 7.909 1.00 21.10 H new ATOM 0 HE2 LYS C 256 13.611 7.904 8.755 1.00 3.44 H new ATOM 0 HE3 LYS C 256 13.789 9.553 9.322 1.00 3.44 H new ATOM 0 HZ1 LYS C 256 12.864 8.963 11.219 1.00 3.33 H new ATOM 0 HZ2 LYS C 256 11.432 8.516 10.424 1.00 3.33 H new ATOM 0 HZ3 LYS C 256 12.664 7.372 10.660 1.00 3.33 H new ATOM 2627 N TRP C 257 8.804 8.817 6.085 1.00 0.33 N ATOM 2628 CA TRP C 257 7.843 8.077 6.896 1.00 32.01 C ATOM 2629 C TRP C 257 7.316 6.847 6.170 1.00 34.15 C ATOM 2630 O TRP C 257 6.937 5.858 6.795 1.00 25.41 O ATOM 2631 CB TRP C 257 6.707 8.947 7.501 1.00 73.11 C ATOM 2632 CG TRP C 257 5.738 9.650 6.558 1.00 4.35 C ATOM 2633 CD1 TRP C 257 5.853 10.907 6.014 1.00 75.53 C ATOM 2634 CD2 TRP C 257 4.460 9.145 6.112 1.00 64.02 C ATOM 2635 NE1 TRP C 257 4.722 11.209 5.287 1.00 11.30 N ATOM 2636 CE2 TRP C 257 3.863 10.142 5.322 1.00 25.14 C ATOM 2637 CE3 TRP C 257 3.770 7.943 6.308 1.00 61.31 C ATOM 2638 CZ2 TRP C 257 2.603 9.979 4.734 1.00 64.45 C ATOM 2639 CZ3 TRP C 257 2.526 7.789 5.727 1.00 32.23 C ATOM 2640 CH2 TRP C 257 1.961 8.804 4.950 1.00 44.03 C ATOM 0 H TRP C 257 8.485 9.726 5.750 1.00 0.33 H new ATOM 0 HA TRP C 257 8.406 7.728 7.761 1.00 32.01 H new ATOM 0 HB2 TRP C 257 6.120 8.310 8.162 1.00 73.11 H new ATOM 0 HB3 TRP C 257 7.173 9.710 8.125 1.00 73.11 H new ATOM 0 HD1 TRP C 257 6.704 11.561 6.138 1.00 75.53 H new ATOM 0 HE1 TRP C 257 4.551 12.089 4.799 1.00 11.30 H new ATOM 0 HE3 TRP C 257 4.202 7.151 6.902 1.00 61.31 H new ATOM 0 HZ2 TRP C 257 2.160 10.758 4.132 1.00 64.45 H new ATOM 0 HZ3 TRP C 257 1.981 6.869 5.876 1.00 32.23 H new ATOM 0 HH2 TRP C 257 0.987 8.649 4.510 1.00 44.03 H new ATOM 2651 N ILE C 258 7.311 6.911 4.853 1.00 33.34 N ATOM 2652 CA ILE C 258 6.924 5.788 4.036 1.00 75.35 C ATOM 2653 C ILE C 258 8.024 4.718 4.053 1.00 41.44 C ATOM 2654 O ILE C 258 7.731 3.543 4.272 1.00 70.31 O ATOM 2655 CB ILE C 258 6.571 6.212 2.575 1.00 32.51 C ATOM 2656 CG1 ILE C 258 5.252 7.028 2.528 1.00 62.40 C ATOM 2657 CG2 ILE C 258 6.490 5.006 1.655 1.00 24.54 C ATOM 2658 CD1 ILE C 258 4.032 6.253 2.968 1.00 45.13 C ATOM 0 H ILE C 258 7.575 7.742 4.325 1.00 33.34 H new ATOM 0 HA ILE C 258 6.015 5.365 4.464 1.00 75.35 H new ATOM 0 HB ILE C 258 7.377 6.854 2.219 1.00 32.51 H new ATOM 0 HG12 ILE C 258 5.359 7.908 3.162 1.00 62.40 H new ATOM 0 HG13 ILE C 258 5.095 7.386 1.511 1.00 62.40 H new ATOM 0 HG21 ILE C 258 6.243 5.334 0.646 1.00 24.54 H new ATOM 0 HG22 ILE C 258 7.451 4.492 1.644 1.00 24.54 H new ATOM 0 HG23 ILE C 258 5.718 4.325 2.014 1.00 24.54 H new ATOM 0 HD11 ILE C 258 3.152 6.894 2.906 1.00 45.13 H new ATOM 0 HD12 ILE C 258 3.897 5.388 2.319 1.00 45.13 H new ATOM 0 HD13 ILE C 258 4.165 5.918 3.997 1.00 45.13 H new ATOM 2670 N GLN C 259 9.293 5.143 3.849 1.00 63.52 N ATOM 2671 CA GLN C 259 10.454 4.232 3.876 1.00 32.40 C ATOM 2672 C GLN C 259 10.436 3.443 5.160 1.00 73.44 C ATOM 2673 O GLN C 259 10.486 2.217 5.155 1.00 4.11 O ATOM 2674 CB GLN C 259 11.792 5.012 3.823 1.00 4.50 C ATOM 2675 CG GLN C 259 11.885 6.068 2.740 1.00 53.31 C ATOM 2676 CD GLN C 259 11.535 5.556 1.374 1.00 5.30 C ATOM 2677 OE1 GLN C 259 10.401 5.584 0.979 1.00 63.31 O ATOM 2678 NE2 GLN C 259 12.496 5.093 0.650 1.00 65.31 N ATOM 0 H GLN C 259 9.536 6.116 3.663 1.00 63.52 H new ATOM 0 HA GLN C 259 10.383 3.581 3.005 1.00 32.40 H new ATOM 0 HB2 GLN C 259 11.953 5.491 4.789 1.00 4.50 H new ATOM 0 HB3 GLN C 259 12.604 4.298 3.682 1.00 4.50 H new ATOM 0 HG2 GLN C 259 11.220 6.894 2.991 1.00 53.31 H new ATOM 0 HG3 GLN C 259 12.898 6.469 2.721 1.00 53.31 H new ATOM 0 HE21 GLN C 259 13.449 5.083 1.013 1.00 65.31 H new ATOM 0 HE22 GLN C 259 12.303 4.737 -0.286 1.00 65.31 H new ATOM 2687 N GLU C 260 10.309 4.175 6.258 1.00 33.10 N ATOM 2688 CA GLU C 260 10.231 3.613 7.590 1.00 43.23 C ATOM 2689 C GLU C 260 9.119 2.611 7.689 1.00 52.14 C ATOM 2690 O GLU C 260 9.320 1.525 8.200 1.00 64.22 O ATOM 2691 CB GLU C 260 9.978 4.725 8.601 1.00 31.14 C ATOM 2692 CG GLU C 260 11.143 5.640 8.844 1.00 34.31 C ATOM 2693 CD GLU C 260 12.240 4.946 9.575 1.00 22.25 C ATOM 2694 OE1 GLU C 260 12.007 4.519 10.714 1.00 2.23 O ATOM 2695 OE2 GLU C 260 13.348 4.835 9.047 1.00 31.23 O ATOM 0 H GLU C 260 10.257 5.194 6.243 1.00 33.10 H new ATOM 0 HA GLU C 260 11.177 3.114 7.801 1.00 43.23 H new ATOM 0 HB2 GLU C 260 9.132 5.321 8.258 1.00 31.14 H new ATOM 0 HB3 GLU C 260 9.686 4.274 9.549 1.00 31.14 H new ATOM 0 HG2 GLU C 260 11.519 6.013 7.891 1.00 34.31 H new ATOM 0 HG3 GLU C 260 10.813 6.506 9.418 1.00 34.31 H new ATOM 2702 N TYR C 261 7.958 2.977 7.186 1.00 3.05 N ATOM 2703 CA TYR C 261 6.791 2.147 7.293 1.00 54.35 C ATOM 2704 C TYR C 261 7.006 0.834 6.540 1.00 62.54 C ATOM 2705 O TYR C 261 6.740 -0.255 7.074 1.00 42.21 O ATOM 2706 CB TYR C 261 5.554 2.877 6.765 1.00 13.30 C ATOM 2707 CG TYR C 261 4.289 2.198 7.162 1.00 12.34 C ATOM 2708 CD1 TYR C 261 3.741 1.180 6.405 1.00 21.41 C ATOM 2709 CD2 TYR C 261 3.661 2.558 8.333 1.00 54.01 C ATOM 2710 CE1 TYR C 261 2.593 0.545 6.815 1.00 21.50 C ATOM 2711 CE2 TYR C 261 2.528 1.930 8.757 1.00 11.01 C ATOM 2712 CZ TYR C 261 1.991 0.919 7.999 1.00 33.01 C ATOM 2713 OH TYR C 261 0.856 0.263 8.432 1.00 33.14 O ATOM 0 H TYR C 261 7.804 3.857 6.694 1.00 3.05 H new ATOM 0 HA TYR C 261 6.624 1.921 8.346 1.00 54.35 H new ATOM 0 HB2 TYR C 261 5.549 3.900 7.142 1.00 13.30 H new ATOM 0 HB3 TYR C 261 5.606 2.938 5.678 1.00 13.30 H new ATOM 0 HD1 TYR C 261 4.219 0.881 5.484 1.00 21.41 H new ATOM 0 HD2 TYR C 261 4.076 3.357 8.930 1.00 54.01 H new ATOM 0 HE1 TYR C 261 2.164 -0.243 6.213 1.00 21.50 H new ATOM 0 HE2 TYR C 261 2.056 2.226 9.682 1.00 11.01 H new ATOM 0 HH TYR C 261 0.104 0.891 8.455 1.00 33.14 H new ATOM 2723 N LEU C 262 7.509 0.948 5.317 1.00 71.43 N ATOM 2724 CA LEU C 262 7.802 -0.202 4.479 1.00 3.14 C ATOM 2725 C LEU C 262 8.805 -1.102 5.180 1.00 4.53 C ATOM 2726 O LEU C 262 8.563 -2.294 5.358 1.00 15.33 O ATOM 2727 CB LEU C 262 8.382 0.264 3.136 1.00 33.43 C ATOM 2728 CG LEU C 262 7.472 1.134 2.263 1.00 71.11 C ATOM 2729 CD1 LEU C 262 8.241 1.662 1.059 1.00 52.33 C ATOM 2730 CD2 LEU C 262 6.266 0.337 1.795 1.00 34.31 C ATOM 0 H LEU C 262 7.725 1.844 4.880 1.00 71.43 H new ATOM 0 HA LEU C 262 6.881 -0.756 4.299 1.00 3.14 H new ATOM 0 HB2 LEU C 262 9.298 0.821 3.335 1.00 33.43 H new ATOM 0 HB3 LEU C 262 8.664 -0.618 2.562 1.00 33.43 H new ATOM 0 HG LEU C 262 7.127 1.977 2.861 1.00 71.11 H new ATOM 0 HD11 LEU C 262 7.582 2.278 0.448 1.00 52.33 H new ATOM 0 HD12 LEU C 262 9.085 2.262 1.401 1.00 52.33 H new ATOM 0 HD13 LEU C 262 8.608 0.824 0.466 1.00 52.33 H new ATOM 0 HD21 LEU C 262 5.630 0.970 1.176 1.00 34.31 H new ATOM 0 HD22 LEU C 262 6.601 -0.521 1.213 1.00 34.31 H new ATOM 0 HD23 LEU C 262 5.701 -0.010 2.660 1.00 34.31 H new ATOM 2742 N GLU C 263 9.898 -0.497 5.630 1.00 1.45 N ATOM 2743 CA GLU C 263 10.980 -1.193 6.307 1.00 25.41 C ATOM 2744 C GLU C 263 10.532 -1.902 7.584 1.00 72.13 C ATOM 2745 O GLU C 263 11.078 -2.952 7.938 1.00 41.45 O ATOM 2746 CB GLU C 263 12.134 -0.237 6.594 1.00 60.02 C ATOM 2747 CG GLU C 263 12.860 0.250 5.355 1.00 13.02 C ATOM 2748 CD GLU C 263 14.058 1.083 5.699 1.00 32.41 C ATOM 2749 OE1 GLU C 263 13.888 2.181 6.233 1.00 54.30 O ATOM 2750 OE2 GLU C 263 15.203 0.618 5.479 1.00 2.25 O ATOM 0 H GLU C 263 10.058 0.506 5.532 1.00 1.45 H new ATOM 0 HA GLU C 263 11.322 -1.974 5.627 1.00 25.41 H new ATOM 0 HB2 GLU C 263 11.750 0.625 7.139 1.00 60.02 H new ATOM 0 HB3 GLU C 263 12.849 -0.735 7.249 1.00 60.02 H new ATOM 0 HG2 GLU C 263 13.173 -0.606 4.758 1.00 13.02 H new ATOM 0 HG3 GLU C 263 12.176 0.835 4.740 1.00 13.02 H new ATOM 2757 N LYS C 264 9.550 -1.344 8.270 1.00 61.45 N ATOM 2758 CA LYS C 264 9.046 -1.956 9.492 1.00 73.35 C ATOM 2759 C LYS C 264 8.287 -3.239 9.196 1.00 22.21 C ATOM 2760 O LYS C 264 8.454 -4.228 9.897 1.00 32.14 O ATOM 2761 CB LYS C 264 8.147 -0.999 10.295 1.00 73.55 C ATOM 2762 CG LYS C 264 8.828 0.261 10.790 1.00 2.42 C ATOM 2763 CD LYS C 264 9.966 -0.029 11.748 1.00 54.11 C ATOM 2764 CE LYS C 264 10.664 1.258 12.142 1.00 74.31 C ATOM 2765 NZ LYS C 264 11.276 1.925 10.966 1.00 31.20 N ATOM 0 H LYS C 264 9.087 -0.474 8.006 1.00 61.45 H new ATOM 0 HA LYS C 264 9.920 -2.190 10.099 1.00 73.35 H new ATOM 0 HB2 LYS C 264 7.299 -0.714 9.672 1.00 73.55 H new ATOM 0 HB3 LYS C 264 7.746 -1.537 11.154 1.00 73.55 H new ATOM 0 HG2 LYS C 264 9.210 0.822 9.937 1.00 2.42 H new ATOM 0 HG3 LYS C 264 8.093 0.896 11.286 1.00 2.42 H new ATOM 0 HD2 LYS C 264 9.583 -0.530 12.637 1.00 54.11 H new ATOM 0 HD3 LYS C 264 10.679 -0.709 11.281 1.00 54.11 H new ATOM 0 HE2 LYS C 264 9.948 1.932 12.613 1.00 74.31 H new ATOM 0 HE3 LYS C 264 11.435 1.044 12.882 1.00 74.31 H new ATOM 0 HZ1 LYS C 264 11.803 2.766 11.279 1.00 31.20 H new ATOM 0 HZ2 LYS C 264 11.926 1.266 10.492 1.00 31.20 H new ATOM 0 HZ3 LYS C 264 10.529 2.212 10.302 1.00 31.20 H new ATOM 2779 N CYS C 265 7.483 -3.231 8.141 1.00 24.53 N ATOM 2780 CA CYS C 265 6.631 -4.378 7.797 1.00 33.34 C ATOM 2781 C CYS C 265 7.454 -5.660 7.552 1.00 45.44 C ATOM 2782 O CYS C 265 7.002 -6.752 7.873 1.00 5.24 O ATOM 2783 CB CYS C 265 5.708 -4.057 6.609 1.00 30.32 C ATOM 2784 SG CYS C 265 4.459 -5.343 6.241 1.00 20.23 S ATOM 0 H CYS C 265 7.398 -2.441 7.501 1.00 24.53 H new ATOM 0 HA CYS C 265 5.995 -4.574 8.660 1.00 33.34 H new ATOM 0 HB2 CYS C 265 5.194 -3.117 6.810 1.00 30.32 H new ATOM 0 HB3 CYS C 265 6.322 -3.901 5.722 1.00 30.32 H new ATOM 2789 N LEU C 266 8.687 -5.503 7.023 1.00 55.33 N ATOM 2790 CA LEU C 266 9.621 -6.646 6.839 1.00 21.32 C ATOM 2791 C LEU C 266 9.842 -7.418 8.151 1.00 73.24 C ATOM 2792 O LEU C 266 10.094 -8.625 8.133 1.00 31.42 O ATOM 2793 CB LEU C 266 11.021 -6.193 6.306 1.00 60.41 C ATOM 2794 CG LEU C 266 11.186 -5.803 4.812 1.00 24.34 C ATOM 2795 CD1 LEU C 266 10.901 -6.974 3.895 1.00 31.12 C ATOM 2796 CD2 LEU C 266 10.346 -4.611 4.431 1.00 4.24 C ATOM 0 H LEU C 266 9.061 -4.605 6.717 1.00 55.33 H new ATOM 0 HA LEU C 266 9.145 -7.291 6.101 1.00 21.32 H new ATOM 0 HB2 LEU C 266 11.335 -5.337 6.903 1.00 60.41 H new ATOM 0 HB3 LEU C 266 11.724 -7.000 6.512 1.00 60.41 H new ATOM 0 HG LEU C 266 12.230 -5.517 4.685 1.00 24.34 H new ATOM 0 HD11 LEU C 266 11.027 -6.663 2.858 1.00 31.12 H new ATOM 0 HD12 LEU C 266 11.593 -7.786 4.117 1.00 31.12 H new ATOM 0 HD13 LEU C 266 9.878 -7.317 4.050 1.00 31.12 H new ATOM 0 HD21 LEU C 266 10.499 -4.380 3.377 1.00 4.24 H new ATOM 0 HD22 LEU C 266 9.294 -4.837 4.605 1.00 4.24 H new ATOM 0 HD23 LEU C 266 10.637 -3.752 5.036 1.00 4.24 H new ATOM 2808 N ASN C 267 9.742 -6.720 9.275 1.00 70.33 N ATOM 2809 CA ASN C 267 10.016 -7.322 10.575 1.00 4.04 C ATOM 2810 C ASN C 267 8.776 -7.418 11.462 1.00 11.15 C ATOM 2811 O ASN C 267 8.661 -8.346 12.271 1.00 10.12 O ATOM 2812 CB ASN C 267 11.134 -6.559 11.308 1.00 20.45 C ATOM 2813 CG ASN C 267 12.463 -6.604 10.576 1.00 11.02 C ATOM 2814 OD1 ASN C 267 12.763 -5.738 9.751 1.00 0.10 O ATOM 2815 ND2 ASN C 267 13.270 -7.600 10.873 1.00 12.12 N ATOM 0 H ASN C 267 9.473 -5.737 9.313 1.00 70.33 H new ATOM 0 HA ASN C 267 10.346 -8.342 10.375 1.00 4.04 H new ATOM 0 HB2 ASN C 267 10.832 -5.520 11.437 1.00 20.45 H new ATOM 0 HB3 ASN C 267 11.260 -6.981 12.305 1.00 20.45 H new ATOM 0 HD21 ASN C 267 14.178 -7.674 10.415 1.00 12.12 H new ATOM 0 HD22 ASN C 267 12.987 -8.298 11.561 1.00 12.12 H new ATOM 2822 N LYS C 268 7.856 -6.474 11.321 1.00 34.10 N ATOM 2823 CA LYS C 268 6.645 -6.453 12.147 1.00 25.01 C ATOM 2824 C LYS C 268 5.721 -7.633 11.895 1.00 34.45 C ATOM 2825 O LYS C 268 4.899 -7.600 10.968 1.00 12.41 O ATOM 2826 CB LYS C 268 5.874 -5.155 11.990 1.00 14.24 C ATOM 2827 CG LYS C 268 6.626 -3.942 12.487 1.00 31.24 C ATOM 2828 CD LYS C 268 5.794 -2.692 12.358 1.00 1.14 C ATOM 2829 CE LYS C 268 4.532 -2.716 13.223 1.00 64.13 C ATOM 2830 NZ LYS C 268 4.836 -2.748 14.666 1.00 12.11 N ATOM 0 H LYS C 268 7.920 -5.712 10.646 1.00 34.10 H new ATOM 0 HA LYS C 268 7.002 -6.532 13.174 1.00 25.01 H new ATOM 0 HB2 LYS C 268 5.627 -5.013 10.938 1.00 14.24 H new ATOM 0 HB3 LYS C 268 4.931 -5.234 12.531 1.00 14.24 H new ATOM 0 HG2 LYS C 268 6.908 -4.088 13.530 1.00 31.24 H new ATOM 0 HG3 LYS C 268 7.550 -3.827 11.920 1.00 31.24 H new ATOM 0 HD2 LYS C 268 6.400 -1.830 12.635 1.00 1.14 H new ATOM 0 HD3 LYS C 268 5.509 -2.559 11.314 1.00 1.14 H new ATOM 0 HE2 LYS C 268 3.927 -1.836 13.002 1.00 64.13 H new ATOM 0 HE3 LYS C 268 3.933 -3.588 12.962 1.00 64.13 H new ATOM 0 HZ1 LYS C 268 3.953 -2.661 15.209 1.00 12.11 H new ATOM 0 HZ2 LYS C 268 5.301 -3.648 14.903 1.00 12.11 H new ATOM 0 HZ3 LYS C 268 5.469 -1.958 14.905 1.00 12.11 H new ATOM 2914 N ILE D 306 4.324 -6.831 -11.613 1.00 22.22 N ATOM 2915 CA ILE D 306 3.398 -6.261 -10.658 1.00 63.34 C ATOM 2916 C ILE D 306 2.267 -7.283 -10.447 1.00 20.04 C ATOM 2917 O ILE D 306 2.486 -8.481 -10.592 1.00 22.12 O ATOM 2918 CB ILE D 306 2.793 -4.951 -11.239 1.00 32.20 C ATOM 2919 CG1 ILE D 306 3.844 -4.203 -12.071 1.00 74.31 C ATOM 2920 CG2 ILE D 306 2.388 -4.045 -10.070 1.00 13.22 C ATOM 2921 CD1 ILE D 306 3.295 -3.028 -12.834 1.00 3.14 C ATOM 0 HA ILE D 306 3.905 -6.035 -9.720 1.00 63.34 H new ATOM 0 HB ILE D 306 1.937 -5.200 -11.867 1.00 32.20 H new ATOM 0 HG12 ILE D 306 4.637 -3.855 -11.409 1.00 74.31 H new ATOM 0 HG13 ILE D 306 4.299 -4.900 -12.775 1.00 74.31 H new ATOM 0 HG21 ILE D 306 1.961 -3.120 -10.458 1.00 13.22 H new ATOM 0 HG22 ILE D 306 1.648 -4.556 -9.453 1.00 13.22 H new ATOM 0 HG23 ILE D 306 3.266 -3.814 -9.467 1.00 13.22 H new ATOM 0 HD11 ILE D 306 4.098 -2.552 -13.397 1.00 3.14 H new ATOM 0 HD12 ILE D 306 2.523 -3.370 -13.523 1.00 3.14 H new ATOM 0 HD13 ILE D 306 2.866 -2.309 -12.136 1.00 3.14 H new ATOM 2933 N TYR D 307 1.089 -6.817 -10.076 1.00 73.13 N ATOM 2934 CA TYR D 307 -0.079 -7.670 -9.932 1.00 14.52 C ATOM 2935 C TYR D 307 -0.586 -7.973 -11.353 1.00 42.04 C ATOM 2936 O TYR D 307 -1.290 -8.948 -11.600 1.00 63.43 O ATOM 2937 CB TYR D 307 -1.177 -6.914 -9.180 1.00 13.32 C ATOM 2938 CG TYR D 307 -0.717 -6.129 -7.983 1.00 13.03 C ATOM 2939 CD1 TYR D 307 -0.336 -6.756 -6.817 1.00 53.14 C ATOM 2940 CD2 TYR D 307 -0.684 -4.754 -8.028 1.00 62.03 C ATOM 2941 CE1 TYR D 307 0.060 -6.041 -5.729 1.00 32.44 C ATOM 2942 CE2 TYR D 307 -0.289 -4.026 -6.947 1.00 35.33 C ATOM 2943 CZ TYR D 307 0.081 -4.670 -5.795 1.00 71.35 C ATOM 2944 OH TYR D 307 0.476 -3.943 -4.713 1.00 62.22 O ATOM 0 H TYR D 307 0.913 -5.835 -9.865 1.00 73.13 H new ATOM 0 HA TYR D 307 0.171 -8.579 -9.386 1.00 14.52 H new ATOM 0 HB2 TYR D 307 -1.665 -6.231 -9.875 1.00 13.32 H new ATOM 0 HB3 TYR D 307 -1.931 -7.631 -8.855 1.00 13.32 H new ATOM 0 HD1 TYR D 307 -0.352 -7.835 -6.765 1.00 53.14 H new ATOM 0 HD2 TYR D 307 -0.976 -4.244 -8.934 1.00 62.03 H new ATOM 0 HE1 TYR D 307 0.355 -6.548 -4.822 1.00 32.44 H new ATOM 0 HE2 TYR D 307 -0.267 -2.947 -6.997 1.00 35.33 H new ATOM 0 HH TYR D 307 -0.085 -3.143 -4.634 1.00 62.22 H new ATOM 2954 N THR D 308 -0.177 -7.080 -12.282 1.00 73.52 N ATOM 2955 CA THR D 308 -0.507 -7.131 -13.706 1.00 53.43 C ATOM 2956 C THR D 308 -1.971 -6.660 -13.935 1.00 24.11 C ATOM 2957 O THR D 308 -2.572 -6.845 -15.002 1.00 2.13 O ATOM 2958 CB THR D 308 -0.221 -8.549 -14.294 1.00 23.42 C ATOM 2959 OG1 THR D 308 1.103 -8.948 -13.877 1.00 53.14 O ATOM 2960 CG2 THR D 308 -0.240 -8.534 -15.824 1.00 3.35 C ATOM 0 H THR D 308 0.411 -6.281 -12.043 1.00 73.52 H new ATOM 0 HA THR D 308 0.138 -6.441 -14.250 1.00 53.43 H new ATOM 0 HB THR D 308 -0.990 -9.234 -13.937 1.00 23.42 H new ATOM 0 HG1 THR D 308 1.304 -9.838 -14.234 1.00 53.14 H new ATOM 0 HG21 THR D 308 -0.037 -9.537 -16.200 1.00 3.35 H new ATOM 0 HG22 THR D 308 -1.220 -8.207 -16.173 1.00 3.35 H new ATOM 0 HG23 THR D 308 0.523 -7.848 -16.191 1.00 3.35 H new ATOM 2968 N SER D 309 -2.515 -6.021 -12.925 1.00 73.41 N ATOM 2969 CA SER D 309 -3.827 -5.439 -12.968 1.00 72.41 C ATOM 2970 C SER D 309 -3.853 -4.263 -12.018 1.00 15.21 C ATOM 2971 O SER D 309 -3.119 -4.261 -11.021 1.00 73.52 O ATOM 2972 CB SER D 309 -4.883 -6.475 -12.556 1.00 33.33 C ATOM 2973 OG SER D 309 -4.850 -7.598 -13.426 1.00 43.25 O ATOM 0 H SER D 309 -2.042 -5.891 -12.031 1.00 73.41 H new ATOM 0 HA SER D 309 -4.055 -5.109 -13.981 1.00 72.41 H new ATOM 0 HB2 SER D 309 -4.703 -6.798 -11.531 1.00 33.33 H new ATOM 0 HB3 SER D 309 -5.874 -6.021 -12.578 1.00 33.33 H new ATOM 0 HG SER D 309 -5.571 -7.522 -14.086 1.00 43.25 H new ATOM 2979 N ASP D 310 -4.634 -3.264 -12.339 1.00 13.02 N ATOM 2980 CA ASP D 310 -4.795 -2.119 -11.476 1.00 0.35 C ATOM 2981 C ASP D 310 -6.248 -2.038 -11.037 1.00 54.21 C ATOM 2982 O ASP D 310 -7.053 -2.939 -11.334 1.00 24.40 O ATOM 2983 CB ASP D 310 -4.353 -0.790 -12.153 1.00 23.05 C ATOM 2984 CG ASP D 310 -5.246 -0.337 -13.296 1.00 13.02 C ATOM 2985 OD1 ASP D 310 -6.232 0.368 -13.042 1.00 5.11 O ATOM 2986 OD2 ASP D 310 -4.963 -0.658 -14.447 1.00 13.41 O ATOM 0 H ASP D 310 -5.175 -3.220 -13.202 1.00 13.02 H new ATOM 0 HA ASP D 310 -4.145 -2.251 -10.611 1.00 0.35 H new ATOM 0 HB2 ASP D 310 -4.324 -0.004 -11.398 1.00 23.05 H new ATOM 0 HB3 ASP D 310 -3.336 -0.909 -12.528 1.00 23.05 H new ATOM 2991 N ASN D 311 -6.581 -0.987 -10.339 1.00 45.11 N ATOM 2992 CA ASN D 311 -7.919 -0.803 -9.804 1.00 22.30 C ATOM 2993 C ASN D 311 -8.257 0.686 -9.956 1.00 61.24 C ATOM 2994 O ASN D 311 -9.026 1.265 -9.185 1.00 34.31 O ATOM 2995 CB ASN D 311 -7.891 -1.229 -8.302 1.00 21.42 C ATOM 2996 CG ASN D 311 -9.265 -1.422 -7.604 1.00 12.22 C ATOM 2997 OD1 ASN D 311 -9.383 -2.252 -6.701 1.00 31.34 O ATOM 2998 ND2 ASN D 311 -10.265 -0.683 -7.973 1.00 31.15 N ATOM 0 H ASN D 311 -5.937 -0.227 -10.120 1.00 45.11 H new ATOM 0 HA ASN D 311 -8.670 -1.400 -10.321 1.00 22.30 H new ATOM 0 HB2 ASN D 311 -7.336 -2.164 -8.224 1.00 21.42 H new ATOM 0 HB3 ASN D 311 -7.330 -0.478 -7.746 1.00 21.42 H new ATOM 0 HD21 ASN D 311 -11.170 -0.783 -7.513 1.00 31.15 H new ATOM 0 HD22 ASN D 311 -10.146 -0.002 -8.723 1.00 31.15 H new ATOM 3124 N TYR D 321 1.321 18.105 -1.676 1.00 3.15 N ATOM 3125 CA TYR D 321 0.828 18.428 -0.389 1.00 42.03 C ATOM 3126 C TYR D 321 1.544 19.652 0.144 1.00 61.42 C ATOM 3127 O TYR D 321 0.963 20.437 0.903 1.00 63.14 O ATOM 3128 CB TYR D 321 1.029 17.253 0.545 1.00 4.23 C ATOM 3129 CG TYR D 321 0.058 17.221 1.678 1.00 13.11 C ATOM 3130 CD1 TYR D 321 -1.165 16.616 1.501 1.00 42.32 C ATOM 3131 CD2 TYR D 321 0.358 17.766 2.907 1.00 11.21 C ATOM 3132 CE1 TYR D 321 -2.090 16.544 2.519 1.00 32.23 C ATOM 3133 CE2 TYR D 321 -0.552 17.710 3.945 1.00 35.24 C ATOM 3134 CZ TYR D 321 -1.781 17.096 3.744 1.00 60.01 C ATOM 3135 OH TYR D 321 -2.692 17.024 4.777 1.00 61.22 O ATOM 0 HA TYR D 321 -0.238 18.647 -0.455 1.00 42.03 H new ATOM 0 HB2 TYR D 321 0.942 16.327 -0.024 1.00 4.23 H new ATOM 0 HB3 TYR D 321 2.042 17.287 0.946 1.00 4.23 H new ATOM 0 HD1 TYR D 321 -1.406 16.187 0.540 1.00 42.32 H new ATOM 0 HD2 TYR D 321 1.315 18.242 3.061 1.00 11.21 H new ATOM 0 HE1 TYR D 321 -3.043 16.062 2.360 1.00 32.23 H new ATOM 0 HE2 TYR D 321 -0.309 18.140 4.905 1.00 35.24 H new ATOM 0 HH TYR D 321 -2.320 17.460 5.572 1.00 61.22 H new ATOM 3145 N ASP D 322 2.796 19.837 -0.286 1.00 71.20 N ATOM 3146 CA ASP D 322 3.636 20.933 0.192 1.00 74.34 C ATOM 3147 C ASP D 322 4.976 20.965 -0.535 1.00 64.43 C ATOM 3148 O ASP D 322 5.192 21.811 -1.410 1.00 51.23 O ATOM 3149 CB ASP D 322 3.855 20.835 1.716 1.00 24.01 C ATOM 3150 CG ASP D 322 4.840 21.852 2.248 1.00 64.41 C ATOM 3151 OD1 ASP D 322 4.515 23.042 2.295 1.00 54.03 O ATOM 3152 OD2 ASP D 322 5.941 21.453 2.668 1.00 63.43 O ATOM 0 H ASP D 322 3.251 19.234 -0.971 1.00 71.20 H new ATOM 0 HA ASP D 322 3.112 21.864 -0.024 1.00 74.34 H new ATOM 0 HB2 ASP D 322 2.899 20.967 2.222 1.00 24.01 H new ATOM 0 HB3 ASP D 322 4.210 19.834 1.961 1.00 24.01 H new ATOM 3157 N SER D 323 5.836 20.018 -0.194 1.00 11.15 N ATOM 3158 CA SER D 323 7.188 19.899 -0.707 1.00 53.23 C ATOM 3159 C SER D 323 7.834 18.748 0.076 1.00 22.44 C ATOM 3160 O SER D 323 7.140 18.092 0.837 1.00 71.14 O ATOM 3161 CB SER D 323 7.966 21.223 -0.460 1.00 43.12 C ATOM 3162 OG SER D 323 9.267 21.199 -1.046 1.00 4.22 O ATOM 0 H SER D 323 5.600 19.284 0.474 1.00 11.15 H new ATOM 0 HA SER D 323 7.199 19.707 -1.780 1.00 53.23 H new ATOM 0 HB2 SER D 323 7.399 22.058 -0.871 1.00 43.12 H new ATOM 0 HB3 SER D 323 8.055 21.396 0.613 1.00 43.12 H new ATOM 0 HG SER D 323 9.721 22.049 -0.869 1.00 4.22 H new ATOM 3168 N MET D 324 9.122 18.515 -0.117 1.00 31.25 N ATOM 3169 CA MET D 324 9.892 17.488 0.619 1.00 15.12 C ATOM 3170 C MET D 324 9.444 16.048 0.329 1.00 74.14 C ATOM 3171 O MET D 324 8.425 15.570 0.841 1.00 43.12 O ATOM 3172 CB MET D 324 9.903 17.741 2.135 1.00 62.54 C ATOM 3173 CG MET D 324 10.696 16.702 2.917 1.00 3.41 C ATOM 3174 SD MET D 324 10.638 16.956 4.699 1.00 54.54 S ATOM 3175 CE MET D 324 11.644 15.569 5.238 1.00 33.41 C ATOM 0 H MET D 324 9.682 19.032 -0.794 1.00 31.25 H new ATOM 0 HA MET D 324 10.909 17.588 0.240 1.00 15.12 H new ATOM 0 HB2 MET D 324 10.323 18.728 2.328 1.00 62.54 H new ATOM 0 HB3 MET D 324 8.876 17.754 2.501 1.00 62.54 H new ATOM 0 HG2 MET D 324 10.309 15.710 2.686 1.00 3.41 H new ATOM 0 HG3 MET D 324 11.735 16.724 2.587 1.00 3.41 H new ATOM 0 HE1 MET D 324 11.715 15.572 6.326 1.00 33.41 H new ATOM 0 HE2 MET D 324 11.186 14.637 4.907 1.00 33.41 H new ATOM 0 HE3 MET D 324 12.642 15.655 4.809 1.00 33.41 H new ATOM 3185 N LYS D 325 10.211 15.386 -0.483 1.00 30.10 N ATOM 3186 CA LYS D 325 10.005 13.993 -0.814 1.00 3.54 C ATOM 3187 C LYS D 325 11.368 13.334 -1.007 1.00 11.33 C ATOM 3188 O LYS D 325 12.393 14.002 -0.790 1.00 21.02 O ATOM 3189 CB LYS D 325 9.121 13.876 -2.060 1.00 52.10 C ATOM 3190 CG LYS D 325 9.635 14.626 -3.273 1.00 25.15 C ATOM 3191 CD LYS D 325 8.648 14.548 -4.412 1.00 52.23 C ATOM 3192 CE LYS D 325 9.126 15.331 -5.611 1.00 33.55 C ATOM 3193 NZ LYS D 325 8.130 15.324 -6.692 1.00 35.43 N ATOM 0 H LYS D 325 11.018 15.801 -0.949 1.00 30.10 H new ATOM 0 HA LYS D 325 9.485 13.477 -0.007 1.00 3.54 H new ATOM 0 HB2 LYS D 325 9.018 12.822 -2.318 1.00 52.10 H new ATOM 0 HB3 LYS D 325 8.124 14.244 -1.818 1.00 52.10 H new ATOM 0 HG2 LYS D 325 9.814 15.669 -3.012 1.00 25.15 H new ATOM 0 HG3 LYS D 325 10.592 14.208 -3.586 1.00 25.15 H new ATOM 0 HD2 LYS D 325 8.497 13.506 -4.693 1.00 52.23 H new ATOM 0 HD3 LYS D 325 7.682 14.934 -4.085 1.00 52.23 H new ATOM 0 HE2 LYS D 325 9.336 16.359 -5.315 1.00 33.55 H new ATOM 0 HE3 LYS D 325 10.062 14.906 -5.974 1.00 33.55 H new ATOM 0 HZ1 LYS D 325 8.491 15.871 -7.500 1.00 35.43 H new ATOM 0 HZ2 LYS D 325 7.948 14.344 -6.990 1.00 35.43 H new ATOM 0 HZ3 LYS D 325 7.245 15.752 -6.352 1.00 35.43 H new ATOM 3207 N GLU D 326 11.387 12.041 -1.405 1.00 62.42 N ATOM 3208 CA GLU D 326 12.641 11.249 -1.607 1.00 12.21 C ATOM 3209 C GLU D 326 13.231 10.787 -0.262 1.00 12.10 C ATOM 3210 O GLU D 326 13.097 11.486 0.754 1.00 14.21 O ATOM 3211 CB GLU D 326 13.701 12.007 -2.451 1.00 63.24 C ATOM 3212 CG GLU D 326 13.224 12.400 -3.832 1.00 2.44 C ATOM 3213 CD GLU D 326 14.260 13.149 -4.625 1.00 40.41 C ATOM 3214 OE1 GLU D 326 14.342 14.385 -4.499 1.00 12.02 O ATOM 3215 OE2 GLU D 326 14.994 12.515 -5.397 1.00 13.42 O ATOM 0 H GLU D 326 10.538 11.510 -1.597 1.00 62.42 H new ATOM 0 HA GLU D 326 12.360 10.365 -2.180 1.00 12.21 H new ATOM 0 HB2 GLU D 326 14.003 12.906 -1.913 1.00 63.24 H new ATOM 0 HB3 GLU D 326 14.588 11.381 -2.549 1.00 63.24 H new ATOM 0 HG2 GLU D 326 12.936 11.502 -4.379 1.00 2.44 H new ATOM 0 HG3 GLU D 326 12.330 13.017 -3.739 1.00 2.44 H new ATOM 3222 N PRO D 327 13.864 9.579 -0.224 1.00 25.12 N ATOM 3223 CA PRO D 327 14.421 8.986 1.000 1.00 24.01 C ATOM 3224 C PRO D 327 15.568 9.760 1.636 1.00 3.45 C ATOM 3225 O PRO D 327 16.748 9.424 1.480 1.00 34.53 O ATOM 3226 CB PRO D 327 14.912 7.625 0.542 1.00 15.22 C ATOM 3227 CG PRO D 327 15.203 7.854 -0.882 1.00 53.41 C ATOM 3228 CD PRO D 327 14.054 8.660 -1.350 1.00 5.40 C ATOM 0 HA PRO D 327 13.661 8.970 1.781 1.00 24.01 H new ATOM 0 HB2 PRO D 327 15.798 7.307 1.091 1.00 15.22 H new ATOM 0 HB3 PRO D 327 14.156 6.852 0.683 1.00 15.22 H new ATOM 0 HG2 PRO D 327 16.146 8.384 -1.018 1.00 53.41 H new ATOM 0 HG3 PRO D 327 15.283 6.915 -1.430 1.00 53.41 H new ATOM 0 HD2 PRO D 327 14.274 9.188 -2.278 1.00 5.40 H new ATOM 0 HD3 PRO D 327 13.171 8.048 -1.533 1.00 5.40 H new