USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1154 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 216 SER OG : rot 180:sc= -0.0635 USER MOD Set 1.2: C 217 HIS : no HD1:sc= -0.196 X(o=-0.26,f=-0.061) USER MOD Set 2.1: A 30 ASN : amide:sc= -1.37! X(o=-0.93!,f=-0.98) USER MOD Set 2.2: C 264 LYS NZ :NH3+ -128:sc= 0.434 (180deg=0) USER MOD Single : A 16 SER OG : rot -111:sc= 1.06 USER MOD Single : A 17 HIS : no HD1:sc= -4.68! C(o=-4.7!,f=-5.9!) USER MOD Single : A 22 ASN : amide:sc= -0.639 X(o=-0.64,f=-0.69) USER MOD Single : A 24 LYS NZ :NH3+ 147:sc= -0.439 (180deg=-2.76!) USER MOD Single : A 25 HIS : no HD1:sc= -0.196 X(o=-0.2,f=-0.00037) USER MOD Single : A 27 LYS NZ :NH3+ -129:sc= -0.0564 (180deg=-3.16!) USER MOD Single : A 31 THR OG1 : rot -130:sc= -1.6! USER MOD Single : A 33 ASN : amide:sc= -0.446 X(o=-0.45,f=-0.15) USER MOD Single : A 37 GLN :FLIP amide:sc= -0.554 F(o=-1.1,f=-0.55) USER MOD Single : A 43 LYS NZ :NH3+ 154:sc= 1.3 (180deg=1.05) USER MOD Single : A 48 GLN : amide:sc= 0.0109 K(o=0.011,f=-3.8!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -4.49! C(o=-4.5!,f=-4.4!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.413 K(o=-0.41,f=-2.7!) USER MOD Single : B 116 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 118 SER OG : rot 97:sc= 1.13 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+ 170:sc=-0.00734 (180deg=-0.133) USER MOD Single : C 222 ASN : amide:sc= -1.13 X(o=-1.1,f=-0.85) USER MOD Single : C 224 LYS NZ :NH3+ -157:sc= 0.897 (180deg=0.561) USER MOD Single : C 225 HIS :FLIP no HD1:sc=-0.00772 F(o=-0.85,f=-0.0077) USER MOD Single : C 227 LYS NZ :NH3+ -136:sc= -0.706 (180deg=-2.22) USER MOD Single : C 230 ASN :FLIP amide:sc= -0.412 F(o=-2.4!,f=-0.41) USER MOD Single : C 231 THR OG1 : rot 106:sc= -2.22! USER MOD Single : C 233 ASN : amide:sc= 1.25 K(o=1.3,f=-0.71) USER MOD Single : C 237 GLN : amide:sc= -2.33! C(o=-2.3!,f=-7.2!) USER MOD Single : C 243 LYS NZ :NH3+ -119:sc= 0.825 (180deg=-0.0035) USER MOD Single : C 248 GLN : amide:sc= -1.19! C(o=-1.2!,f=-3.4!) USER MOD Single : C 254 LYS NZ :NH3+ 168:sc= -1.39 (180deg=-1.97!) USER MOD Single : C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 259 GLN : amide:sc= -2.77! C(o=-2.8!,f=-3.1!) USER MOD Single : C 261 TYR OH : rot -30:sc= -0.872 USER MOD Single : C 267 ASN :FLIP amide:sc= -1.13 F(o=-2.6!,f=-1.1) USER MOD Single : D 312 TYR OH : rot 130:sc= 0 USER MOD Single : D 313 THR OG1 : rot 11:sc= 1.05 USER MOD Single : D 316 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 318 SER OG : rot -120:sc= 0.38 USER MOD Single : D 323 SER OG : rot 151:sc= -1.09 USER MOD Single : D 324 MET CE :methyl 171:sc= -2.5! (180deg=-2.5!) USER MOD Single : D 325 LYS NZ :NH3+ 171:sc=-0.00588 (180deg=-0.107) USER MOD ----------------------------------------------------------------- ATOM 115 N ARG A 8 13.043 -8.493 12.393 1.00 33.12 N ATOM 116 CA ARG A 8 11.719 -9.004 12.670 1.00 12.50 C ATOM 117 C ARG A 8 10.810 -8.630 11.518 1.00 34.31 C ATOM 118 O ARG A 8 11.163 -7.780 10.692 1.00 64.03 O ATOM 119 CB ARG A 8 11.152 -8.354 13.946 1.00 3.34 C ATOM 120 CG ARG A 8 11.909 -8.604 15.262 1.00 25.24 C ATOM 121 CD ARG A 8 11.773 -10.037 15.802 1.00 54.33 C ATOM 122 NE ARG A 8 12.477 -11.048 15.014 1.00 53.13 N ATOM 123 CZ ARG A 8 12.529 -12.353 15.318 1.00 43.32 C ATOM 124 NH1 ARG A 8 11.862 -12.835 16.371 1.00 23.25 N ATOM 125 NH2 ARG A 8 13.238 -13.174 14.572 1.00 24.02 N ATOM 0 HA ARG A 8 11.775 -10.085 12.801 1.00 12.50 H new ATOM 0 HB2 ARG A 8 11.105 -7.277 13.783 1.00 3.34 H new ATOM 0 HB3 ARG A 8 10.127 -8.702 14.075 1.00 3.34 H new ATOM 0 HG2 ARG A 8 12.965 -8.384 15.108 1.00 25.24 H new ATOM 0 HG3 ARG A 8 11.544 -7.907 16.016 1.00 25.24 H new ATOM 0 HD2 ARG A 8 12.149 -10.064 16.825 1.00 54.33 H new ATOM 0 HD3 ARG A 8 10.715 -10.298 15.844 1.00 54.33 H new ATOM 0 HE ARG A 8 12.963 -10.738 14.173 1.00 53.13 H new ATOM 0 HH11 ARG A 8 11.306 -12.208 16.953 1.00 23.25 H new ATOM 0 HH12 ARG A 8 11.909 -13.830 16.593 1.00 23.25 H new ATOM 0 HH21 ARG A 8 13.747 -12.817 13.763 1.00 24.02 H new ATOM 0 HH22 ARG A 8 13.278 -14.167 14.803 1.00 24.02 H new ATOM 139 N CYS A 9 9.689 -9.276 11.434 1.00 11.13 N ATOM 140 CA CYS A 9 8.676 -8.916 10.476 1.00 23.23 C ATOM 141 C CYS A 9 7.669 -7.966 11.159 1.00 43.41 C ATOM 142 O CYS A 9 7.644 -7.881 12.391 1.00 73.10 O ATOM 143 CB CYS A 9 7.979 -10.177 9.925 1.00 54.23 C ATOM 144 SG CYS A 9 9.012 -11.204 8.827 1.00 10.03 S ATOM 0 H CYS A 9 9.445 -10.070 12.026 1.00 11.13 H new ATOM 0 HA CYS A 9 9.129 -8.405 9.627 1.00 23.23 H new ATOM 0 HB2 CYS A 9 7.647 -10.788 10.765 1.00 54.23 H new ATOM 0 HB3 CYS A 9 7.086 -9.872 9.380 1.00 54.23 H new ATOM 149 N PRO A 10 6.826 -7.227 10.389 1.00 41.53 N ATOM 150 CA PRO A 10 5.840 -6.281 10.977 1.00 43.31 C ATOM 151 C PRO A 10 4.679 -7.033 11.573 1.00 74.14 C ATOM 152 O PRO A 10 3.830 -6.485 12.279 1.00 11.53 O ATOM 153 CB PRO A 10 5.366 -5.502 9.756 1.00 62.14 C ATOM 154 CG PRO A 10 5.497 -6.457 8.626 1.00 43.22 C ATOM 155 CD PRO A 10 6.747 -7.237 8.905 1.00 44.12 C ATOM 0 HA PRO A 10 6.256 -5.662 11.772 1.00 43.31 H new ATOM 0 HB2 PRO A 10 4.335 -5.168 9.875 1.00 62.14 H new ATOM 0 HB3 PRO A 10 5.973 -4.611 9.594 1.00 62.14 H new ATOM 0 HG2 PRO A 10 4.630 -7.114 8.565 1.00 43.22 H new ATOM 0 HG3 PRO A 10 5.567 -5.931 7.674 1.00 43.22 H new ATOM 0 HD2 PRO A 10 6.685 -8.252 8.511 1.00 44.12 H new ATOM 0 HD3 PRO A 10 7.622 -6.772 8.452 1.00 44.12 H new ATOM 163 N CYS A 11 4.668 -8.287 11.270 1.00 40.40 N ATOM 164 CA CYS A 11 3.643 -9.193 11.652 1.00 71.41 C ATOM 165 C CYS A 11 4.280 -10.491 12.077 1.00 71.14 C ATOM 166 O CYS A 11 5.491 -10.673 11.916 1.00 54.15 O ATOM 167 CB CYS A 11 2.758 -9.440 10.440 1.00 43.42 C ATOM 168 SG CYS A 11 2.133 -7.913 9.692 1.00 41.52 S ATOM 0 H CYS A 11 5.409 -8.727 10.724 1.00 40.40 H new ATOM 0 HA CYS A 11 3.053 -8.788 12.474 1.00 71.41 H new ATOM 0 HB2 CYS A 11 3.323 -9.998 9.693 1.00 43.42 H new ATOM 0 HB3 CYS A 11 1.915 -10.065 10.735 1.00 43.42 H new ATOM 173 N ARG A 12 3.500 -11.374 12.635 1.00 70.05 N ATOM 174 CA ARG A 12 3.987 -12.690 12.953 1.00 75.32 C ATOM 175 C ARG A 12 3.621 -13.565 11.772 1.00 34.14 C ATOM 176 O ARG A 12 4.451 -14.277 11.208 1.00 63.30 O ATOM 177 CB ARG A 12 3.334 -13.202 14.245 1.00 4.21 C ATOM 178 CG ARG A 12 3.803 -14.578 14.695 1.00 63.13 C ATOM 179 CD ARG A 12 5.286 -14.601 15.021 1.00 35.33 C ATOM 180 NE ARG A 12 5.718 -15.928 15.475 1.00 3.12 N ATOM 181 CZ ARG A 12 6.685 -16.151 16.369 1.00 53.35 C ATOM 182 NH1 ARG A 12 7.336 -15.137 16.920 1.00 64.40 N ATOM 183 NH2 ARG A 12 6.995 -17.395 16.717 1.00 24.21 N ATOM 0 H ARG A 12 2.524 -11.208 12.880 1.00 70.05 H new ATOM 0 HA ARG A 12 5.064 -12.694 13.124 1.00 75.32 H new ATOM 0 HB2 ARG A 12 3.532 -12.487 15.044 1.00 4.21 H new ATOM 0 HB3 ARG A 12 2.254 -13.230 14.103 1.00 4.21 H new ATOM 0 HG2 ARG A 12 3.235 -14.884 15.573 1.00 63.13 H new ATOM 0 HG3 ARG A 12 3.594 -15.306 13.911 1.00 63.13 H new ATOM 0 HD2 ARG A 12 5.858 -14.314 14.139 1.00 35.33 H new ATOM 0 HD3 ARG A 12 5.501 -13.863 15.794 1.00 35.33 H new ATOM 0 HE ARG A 12 5.245 -16.740 15.079 1.00 3.12 H new ATOM 0 HH11 ARG A 12 7.100 -14.179 16.662 1.00 64.40 H new ATOM 0 HH12 ARG A 12 8.073 -15.315 17.602 1.00 64.40 H new ATOM 0 HH21 ARG A 12 6.494 -18.181 16.301 1.00 24.21 H new ATOM 0 HH22 ARG A 12 7.734 -17.565 17.400 1.00 24.21 H new ATOM 197 N PHE A 13 2.367 -13.469 11.401 1.00 73.31 N ATOM 198 CA PHE A 13 1.813 -14.108 10.243 1.00 53.44 C ATOM 199 C PHE A 13 0.922 -13.099 9.557 1.00 14.31 C ATOM 200 O PHE A 13 0.589 -12.076 10.151 1.00 55.42 O ATOM 201 CB PHE A 13 1.017 -15.374 10.590 1.00 65.23 C ATOM 202 CG PHE A 13 1.818 -16.478 11.208 1.00 53.23 C ATOM 203 CD1 PHE A 13 2.509 -17.376 10.415 1.00 1.44 C ATOM 204 CD2 PHE A 13 1.880 -16.622 12.582 1.00 75.15 C ATOM 205 CE1 PHE A 13 3.243 -18.393 10.979 1.00 4.44 C ATOM 206 CE2 PHE A 13 2.613 -17.638 13.151 1.00 64.24 C ATOM 207 CZ PHE A 13 3.297 -18.524 12.349 1.00 2.33 C ATOM 0 H PHE A 13 1.682 -12.921 11.921 1.00 73.31 H new ATOM 0 HA PHE A 13 2.624 -14.433 9.592 1.00 53.44 H new ATOM 0 HB2 PHE A 13 0.213 -15.103 11.274 1.00 65.23 H new ATOM 0 HB3 PHE A 13 0.549 -15.751 9.681 1.00 65.23 H new ATOM 0 HD1 PHE A 13 2.472 -17.277 9.340 1.00 1.44 H new ATOM 0 HD2 PHE A 13 1.347 -15.929 13.216 1.00 75.15 H new ATOM 0 HE1 PHE A 13 3.777 -19.088 10.348 1.00 4.44 H new ATOM 0 HE2 PHE A 13 2.652 -17.740 14.225 1.00 64.24 H new ATOM 0 HZ PHE A 13 3.875 -19.321 12.794 1.00 2.33 H new ATOM 217 N PHE A 14 0.608 -13.342 8.330 1.00 1.12 N ATOM 218 CA PHE A 14 -0.269 -12.477 7.581 1.00 74.04 C ATOM 219 C PHE A 14 -1.613 -13.154 7.347 1.00 30.42 C ATOM 220 O PHE A 14 -1.658 -14.319 6.994 1.00 42.31 O ATOM 221 CB PHE A 14 0.411 -12.017 6.268 1.00 44.42 C ATOM 222 CG PHE A 14 1.149 -13.114 5.521 1.00 73.03 C ATOM 223 CD1 PHE A 14 0.478 -14.027 4.732 1.00 52.31 C ATOM 224 CD2 PHE A 14 2.531 -13.217 5.622 1.00 13.05 C ATOM 225 CE1 PHE A 14 1.164 -15.022 4.061 1.00 14.23 C ATOM 226 CE2 PHE A 14 3.221 -14.206 4.952 1.00 15.12 C ATOM 227 CZ PHE A 14 2.536 -15.110 4.170 1.00 64.34 C ATOM 0 H PHE A 14 0.949 -14.148 7.806 1.00 1.12 H new ATOM 0 HA PHE A 14 -0.468 -11.576 8.162 1.00 74.04 H new ATOM 0 HB2 PHE A 14 -0.348 -11.594 5.610 1.00 44.42 H new ATOM 0 HB3 PHE A 14 1.114 -11.217 6.499 1.00 44.42 H new ATOM 0 HD1 PHE A 14 -0.596 -13.963 4.638 1.00 52.31 H new ATOM 0 HD2 PHE A 14 3.073 -12.512 6.234 1.00 13.05 H new ATOM 0 HE1 PHE A 14 0.625 -15.731 3.451 1.00 14.23 H new ATOM 0 HE2 PHE A 14 4.295 -14.271 5.040 1.00 15.12 H new ATOM 0 HZ PHE A 14 3.072 -15.886 3.644 1.00 64.34 H new ATOM 237 N GLU A 15 -2.686 -12.430 7.566 1.00 43.55 N ATOM 238 CA GLU A 15 -4.020 -12.956 7.439 1.00 33.23 C ATOM 239 C GLU A 15 -4.369 -13.136 5.978 1.00 4.23 C ATOM 240 O GLU A 15 -4.540 -12.161 5.228 1.00 4.22 O ATOM 241 CB GLU A 15 -5.052 -12.050 8.154 1.00 53.54 C ATOM 242 CG GLU A 15 -4.979 -12.032 9.704 1.00 3.33 C ATOM 243 CD GLU A 15 -3.638 -11.632 10.308 1.00 22.43 C ATOM 244 OE1 GLU A 15 -2.777 -12.492 10.460 1.00 45.25 O ATOM 245 OE2 GLU A 15 -3.466 -10.461 10.680 1.00 33.13 O ATOM 0 H GLU A 15 -2.654 -11.448 7.840 1.00 43.55 H new ATOM 0 HA GLU A 15 -4.054 -13.930 7.926 1.00 33.23 H new ATOM 0 HB2 GLU A 15 -4.924 -11.030 7.792 1.00 53.54 H new ATOM 0 HB3 GLU A 15 -6.052 -12.369 7.860 1.00 53.54 H new ATOM 0 HG2 GLU A 15 -5.741 -11.346 10.075 1.00 3.33 H new ATOM 0 HG3 GLU A 15 -5.238 -13.025 10.071 1.00 3.33 H new ATOM 252 N SER A 16 -4.454 -14.369 5.572 1.00 63.34 N ATOM 253 CA SER A 16 -4.708 -14.681 4.207 1.00 42.43 C ATOM 254 C SER A 16 -6.198 -14.949 3.937 1.00 74.32 C ATOM 255 O SER A 16 -6.602 -15.125 2.802 1.00 34.40 O ATOM 256 CB SER A 16 -3.865 -15.863 3.802 1.00 55.34 C ATOM 257 OG SER A 16 -2.497 -15.651 4.106 1.00 1.51 O ATOM 0 H SER A 16 -4.349 -15.181 6.181 1.00 63.34 H new ATOM 0 HA SER A 16 -4.437 -13.815 3.604 1.00 42.43 H new ATOM 0 HB2 SER A 16 -4.219 -16.757 4.315 1.00 55.34 H new ATOM 0 HB3 SER A 16 -3.978 -16.043 2.733 1.00 55.34 H new ATOM 0 HG SER A 16 -1.988 -15.554 3.274 1.00 1.51 H new ATOM 263 N HIS A 17 -7.007 -15.021 4.973 1.00 51.53 N ATOM 264 CA HIS A 17 -8.452 -15.163 4.772 1.00 42.30 C ATOM 265 C HIS A 17 -9.166 -14.043 5.475 1.00 1.33 C ATOM 266 O HIS A 17 -9.672 -14.199 6.591 1.00 64.54 O ATOM 267 CB HIS A 17 -9.021 -16.535 5.212 1.00 32.34 C ATOM 268 CG HIS A 17 -8.487 -17.731 4.470 1.00 53.43 C ATOM 269 ND1 HIS A 17 -9.293 -18.707 3.924 1.00 63.24 N ATOM 270 CD2 HIS A 17 -7.226 -18.145 4.263 1.00 41.30 C ATOM 271 CE1 HIS A 17 -8.538 -19.666 3.422 1.00 20.12 C ATOM 272 NE2 HIS A 17 -7.277 -19.349 3.618 1.00 2.42 N ATOM 0 H HIS A 17 -6.707 -14.985 5.947 1.00 51.53 H new ATOM 0 HA HIS A 17 -8.625 -15.110 3.697 1.00 42.30 H new ATOM 0 HB2 HIS A 17 -8.817 -16.669 6.274 1.00 32.34 H new ATOM 0 HB3 HIS A 17 -10.105 -16.512 5.096 1.00 32.34 H new ATOM 0 HD2 HIS A 17 -6.329 -17.619 4.555 1.00 41.30 H new ATOM 0 HE1 HIS A 17 -8.895 -20.560 2.933 1.00 20.12 H new ATOM 0 HE2 HIS A 17 -6.472 -19.908 3.336 1.00 2.42 H new ATOM 281 N VAL A 18 -9.160 -12.910 4.851 1.00 64.54 N ATOM 282 CA VAL A 18 -9.726 -11.711 5.403 1.00 10.44 C ATOM 283 C VAL A 18 -10.440 -10.938 4.289 1.00 55.22 C ATOM 284 O VAL A 18 -10.004 -10.971 3.125 1.00 62.14 O ATOM 285 CB VAL A 18 -8.618 -10.856 6.115 1.00 54.52 C ATOM 286 CG1 VAL A 18 -7.501 -10.469 5.168 1.00 74.33 C ATOM 287 CG2 VAL A 18 -9.197 -9.636 6.824 1.00 23.12 C ATOM 0 H VAL A 18 -8.754 -12.784 3.924 1.00 64.54 H new ATOM 0 HA VAL A 18 -10.462 -11.960 6.167 1.00 10.44 H new ATOM 0 HB VAL A 18 -8.183 -11.495 6.883 1.00 54.52 H new ATOM 0 HG11 VAL A 18 -6.758 -9.879 5.704 1.00 74.33 H new ATOM 0 HG12 VAL A 18 -7.032 -11.369 4.771 1.00 74.33 H new ATOM 0 HG13 VAL A 18 -7.908 -9.880 4.346 1.00 74.33 H new ATOM 0 HG21 VAL A 18 -8.392 -9.077 7.301 1.00 23.12 H new ATOM 0 HG22 VAL A 18 -9.701 -8.998 6.098 1.00 23.12 H new ATOM 0 HG23 VAL A 18 -9.912 -9.960 7.580 1.00 23.12 H new ATOM 297 N ALA A 19 -11.549 -10.312 4.622 1.00 53.15 N ATOM 298 CA ALA A 19 -12.358 -9.594 3.649 1.00 22.13 C ATOM 299 C ALA A 19 -12.033 -8.101 3.658 1.00 44.11 C ATOM 300 O ALA A 19 -11.913 -7.495 4.726 1.00 10.34 O ATOM 301 CB ALA A 19 -13.839 -9.818 3.946 1.00 3.31 C ATOM 0 H ALA A 19 -11.918 -10.284 5.572 1.00 53.15 H new ATOM 0 HA ALA A 19 -12.128 -9.979 2.656 1.00 22.13 H new ATOM 0 HB1 ALA A 19 -14.442 -9.279 3.215 1.00 3.31 H new ATOM 0 HB2 ALA A 19 -14.065 -10.883 3.888 1.00 3.31 H new ATOM 0 HB3 ALA A 19 -14.069 -9.452 4.947 1.00 3.31 H new ATOM 307 N ARG A 20 -11.903 -7.500 2.467 1.00 65.24 N ATOM 308 CA ARG A 20 -11.572 -6.069 2.363 1.00 11.24 C ATOM 309 C ARG A 20 -12.722 -5.195 2.829 1.00 43.14 C ATOM 310 O ARG A 20 -12.550 -4.033 3.124 1.00 55.32 O ATOM 311 CB ARG A 20 -11.071 -5.680 0.946 1.00 0.33 C ATOM 312 CG ARG A 20 -12.081 -5.666 -0.206 1.00 61.42 C ATOM 313 CD ARG A 20 -12.810 -4.324 -0.315 1.00 71.52 C ATOM 314 NE ARG A 20 -13.833 -4.343 -1.369 1.00 54.54 N ATOM 315 CZ ARG A 20 -14.600 -3.308 -1.745 1.00 42.01 C ATOM 316 NH1 ARG A 20 -14.405 -2.087 -1.222 1.00 64.12 N ATOM 317 NH2 ARG A 20 -15.556 -3.496 -2.654 1.00 53.44 N ATOM 0 H ARG A 20 -12.020 -7.974 1.571 1.00 65.24 H new ATOM 0 HA ARG A 20 -10.738 -5.885 3.040 1.00 11.24 H new ATOM 0 HB2 ARG A 20 -10.629 -4.686 1.012 1.00 0.33 H new ATOM 0 HB3 ARG A 20 -10.270 -6.368 0.677 1.00 0.33 H new ATOM 0 HG2 ARG A 20 -11.565 -5.875 -1.143 1.00 61.42 H new ATOM 0 HG3 ARG A 20 -12.810 -6.463 -0.059 1.00 61.42 H new ATOM 0 HD2 ARG A 20 -13.277 -4.085 0.641 1.00 71.52 H new ATOM 0 HD3 ARG A 20 -12.088 -3.534 -0.523 1.00 71.52 H new ATOM 0 HE ARG A 20 -13.973 -5.225 -1.861 1.00 54.54 H new ATOM 0 HH11 ARG A 20 -13.668 -1.939 -0.532 1.00 64.12 H new ATOM 0 HH12 ARG A 20 -14.993 -1.307 -1.515 1.00 64.12 H new ATOM 0 HH21 ARG A 20 -15.700 -4.421 -3.058 1.00 53.44 H new ATOM 0 HH22 ARG A 20 -16.143 -2.715 -2.945 1.00 53.44 H new ATOM 331 N ALA A 21 -13.891 -5.775 2.894 1.00 34.53 N ATOM 332 CA ALA A 21 -15.077 -5.075 3.364 1.00 41.31 C ATOM 333 C ALA A 21 -15.018 -4.849 4.880 1.00 54.32 C ATOM 334 O ALA A 21 -15.819 -4.094 5.440 1.00 72.33 O ATOM 335 CB ALA A 21 -16.327 -5.849 2.987 1.00 14.42 C ATOM 0 H ALA A 21 -14.057 -6.745 2.625 1.00 34.53 H new ATOM 0 HA ALA A 21 -15.112 -4.098 2.881 1.00 41.31 H new ATOM 0 HB1 ALA A 21 -17.207 -5.315 3.344 1.00 14.42 H new ATOM 0 HB2 ALA A 21 -16.379 -5.950 1.903 1.00 14.42 H new ATOM 0 HB3 ALA A 21 -16.293 -6.839 3.443 1.00 14.42 H new ATOM 341 N ASN A 22 -14.068 -5.508 5.538 1.00 3.33 N ATOM 342 CA ASN A 22 -13.914 -5.381 6.979 1.00 42.44 C ATOM 343 C ASN A 22 -12.673 -4.525 7.315 1.00 73.32 C ATOM 344 O ASN A 22 -12.409 -4.209 8.475 1.00 54.13 O ATOM 345 CB ASN A 22 -13.808 -6.784 7.626 1.00 31.50 C ATOM 346 CG ASN A 22 -13.793 -6.756 9.156 1.00 21.01 C ATOM 347 OD1 ASN A 22 -14.390 -5.880 9.784 1.00 31.41 O ATOM 348 ND2 ASN A 22 -13.129 -7.710 9.760 1.00 21.54 N ATOM 0 H ASN A 22 -13.396 -6.134 5.095 1.00 3.33 H new ATOM 0 HA ASN A 22 -14.791 -4.878 7.386 1.00 42.44 H new ATOM 0 HB2 ASN A 22 -14.647 -7.393 7.291 1.00 31.50 H new ATOM 0 HB3 ASN A 22 -12.899 -7.270 7.271 1.00 31.50 H new ATOM 0 HD21 ASN A 22 -13.096 -7.742 10.779 1.00 21.54 H new ATOM 0 HD22 ASN A 22 -12.645 -8.421 9.211 1.00 21.54 H new ATOM 355 N VAL A 23 -11.931 -4.120 6.296 1.00 43.35 N ATOM 356 CA VAL A 23 -10.722 -3.329 6.518 1.00 42.13 C ATOM 357 C VAL A 23 -10.976 -1.875 6.133 1.00 14.23 C ATOM 358 O VAL A 23 -11.857 -1.601 5.355 1.00 2.04 O ATOM 359 CB VAL A 23 -9.492 -3.870 5.738 1.00 63.03 C ATOM 360 CG1 VAL A 23 -9.249 -5.341 6.039 1.00 33.23 C ATOM 361 CG2 VAL A 23 -9.603 -3.621 4.244 1.00 61.23 C ATOM 0 H VAL A 23 -12.138 -4.321 5.317 1.00 43.35 H new ATOM 0 HA VAL A 23 -10.485 -3.404 7.579 1.00 42.13 H new ATOM 0 HB VAL A 23 -8.624 -3.310 6.087 1.00 63.03 H new ATOM 0 HG11 VAL A 23 -8.382 -5.689 5.478 1.00 33.23 H new ATOM 0 HG12 VAL A 23 -9.066 -5.469 7.106 1.00 33.23 H new ATOM 0 HG13 VAL A 23 -10.125 -5.921 5.749 1.00 33.23 H new ATOM 0 HG21 VAL A 23 -8.720 -4.017 3.743 1.00 61.23 H new ATOM 0 HG22 VAL A 23 -10.493 -4.118 3.857 1.00 61.23 H new ATOM 0 HG23 VAL A 23 -9.676 -2.549 4.058 1.00 61.23 H new ATOM 371 N LYS A 24 -10.229 -0.960 6.715 1.00 61.30 N ATOM 372 CA LYS A 24 -10.401 0.471 6.431 1.00 44.42 C ATOM 373 C LYS A 24 -9.589 0.886 5.241 1.00 64.51 C ATOM 374 O LYS A 24 -9.982 1.746 4.496 1.00 12.23 O ATOM 375 CB LYS A 24 -9.934 1.305 7.608 1.00 3.12 C ATOM 376 CG LYS A 24 -10.563 0.927 8.892 1.00 24.01 C ATOM 377 CD LYS A 24 -10.013 1.761 10.024 1.00 1.10 C ATOM 378 CE LYS A 24 -10.573 1.326 11.358 1.00 12.10 C ATOM 379 NZ LYS A 24 -12.029 1.614 11.514 1.00 53.12 N ATOM 0 H LYS A 24 -9.493 -1.170 7.390 1.00 61.30 H new ATOM 0 HA LYS A 24 -11.462 0.633 6.238 1.00 44.42 H new ATOM 0 HB2 LYS A 24 -8.852 1.211 7.702 1.00 3.12 H new ATOM 0 HB3 LYS A 24 -10.146 2.355 7.405 1.00 3.12 H new ATOM 0 HG2 LYS A 24 -11.643 1.061 8.827 1.00 24.01 H new ATOM 0 HG3 LYS A 24 -10.385 -0.129 9.093 1.00 24.01 H new ATOM 0 HD2 LYS A 24 -8.926 1.681 10.041 1.00 1.10 H new ATOM 0 HD3 LYS A 24 -10.252 2.811 9.853 1.00 1.10 H new ATOM 0 HE2 LYS A 24 -10.407 0.256 11.481 1.00 12.10 H new ATOM 0 HE3 LYS A 24 -10.024 1.828 12.155 1.00 12.10 H new ATOM 0 HZ1 LYS A 24 -12.468 0.875 12.099 1.00 53.12 H new ATOM 0 HZ2 LYS A 24 -12.153 2.539 11.973 1.00 53.12 H new ATOM 0 HZ3 LYS A 24 -12.482 1.629 10.578 1.00 53.12 H new ATOM 393 N HIS A 25 -8.427 0.289 5.101 1.00 64.30 N ATOM 394 CA HIS A 25 -7.508 0.648 3.989 1.00 71.12 C ATOM 395 C HIS A 25 -6.306 -0.259 3.939 1.00 1.03 C ATOM 396 O HIS A 25 -6.198 -1.181 4.739 1.00 64.41 O ATOM 397 CB HIS A 25 -7.024 2.111 4.116 1.00 65.44 C ATOM 398 CG HIS A 25 -6.260 2.452 5.373 1.00 65.04 C ATOM 399 ND1 HIS A 25 -6.743 3.299 6.347 1.00 23.12 N ATOM 400 CD2 HIS A 25 -5.019 2.082 5.789 1.00 34.42 C ATOM 401 CE1 HIS A 25 -5.836 3.425 7.291 1.00 74.52 C ATOM 402 NE2 HIS A 25 -4.789 2.701 6.980 1.00 13.33 N ATOM 0 H HIS A 25 -8.078 -0.441 5.722 1.00 64.30 H new ATOM 0 HA HIS A 25 -8.078 0.529 3.067 1.00 71.12 H new ATOM 0 HB2 HIS A 25 -6.392 2.339 3.258 1.00 65.44 H new ATOM 0 HB3 HIS A 25 -7.893 2.766 4.054 1.00 65.44 H new ATOM 0 HD2 HIS A 25 -4.341 1.420 5.271 1.00 34.42 H new ATOM 0 HE1 HIS A 25 -5.938 4.029 8.181 1.00 74.52 H new ATOM 0 HE2 HIS A 25 -3.940 2.615 7.539 1.00 13.33 H new ATOM 411 N LEU A 26 -5.358 0.063 3.041 1.00 20.20 N ATOM 412 CA LEU A 26 -4.143 -0.715 2.911 1.00 22.20 C ATOM 413 C LEU A 26 -2.932 0.123 3.298 1.00 43.41 C ATOM 414 O LEU A 26 -2.890 1.326 3.054 1.00 52.42 O ATOM 415 CB LEU A 26 -3.967 -1.240 1.466 1.00 43.33 C ATOM 416 CG LEU A 26 -5.003 -2.250 0.967 1.00 55.53 C ATOM 417 CD1 LEU A 26 -4.698 -2.675 -0.475 1.00 12.23 C ATOM 418 CD2 LEU A 26 -5.038 -3.461 1.890 1.00 20.05 C ATOM 0 H LEU A 26 -5.422 0.856 2.403 1.00 20.20 H new ATOM 0 HA LEU A 26 -4.223 -1.569 3.584 1.00 22.20 H new ATOM 0 HB2 LEU A 26 -3.974 -0.384 0.791 1.00 43.33 H new ATOM 0 HB3 LEU A 26 -2.981 -1.699 1.389 1.00 43.33 H new ATOM 0 HG LEU A 26 -5.984 -1.776 0.976 1.00 55.53 H new ATOM 0 HD11 LEU A 26 -5.447 -3.393 -0.809 1.00 12.23 H new ATOM 0 HD12 LEU A 26 -4.719 -1.800 -1.124 1.00 12.23 H new ATOM 0 HD13 LEU A 26 -3.711 -3.135 -0.518 1.00 12.23 H new ATOM 0 HD21 LEU A 26 -5.778 -4.174 1.527 1.00 20.05 H new ATOM 0 HD22 LEU A 26 -4.056 -3.934 1.907 1.00 20.05 H new ATOM 0 HD23 LEU A 26 -5.305 -3.143 2.898 1.00 20.05 H new ATOM 430 N LYS A 27 -2.004 -0.506 3.961 1.00 72.44 N ATOM 431 CA LYS A 27 -0.765 0.059 4.355 1.00 53.35 C ATOM 432 C LYS A 27 0.342 -0.962 4.088 1.00 41.15 C ATOM 433 O LYS A 27 0.309 -2.046 4.621 1.00 32.34 O ATOM 434 CB LYS A 27 -0.858 0.471 5.829 1.00 63.22 C ATOM 435 CG LYS A 27 0.458 0.818 6.453 1.00 54.12 C ATOM 436 CD LYS A 27 0.312 1.696 7.689 1.00 24.23 C ATOM 437 CE LYS A 27 -0.715 1.182 8.686 1.00 22.24 C ATOM 438 NZ LYS A 27 -0.265 -0.025 9.438 1.00 25.11 N ATOM 0 H LYS A 27 -2.107 -1.478 4.252 1.00 72.44 H new ATOM 0 HA LYS A 27 -0.528 0.956 3.783 1.00 53.35 H new ATOM 0 HB2 LYS A 27 -1.525 1.329 5.914 1.00 63.22 H new ATOM 0 HB3 LYS A 27 -1.312 -0.343 6.394 1.00 63.22 H new ATOM 0 HG2 LYS A 27 0.979 -0.100 6.725 1.00 54.12 H new ATOM 0 HG3 LYS A 27 1.079 1.332 5.719 1.00 54.12 H new ATOM 0 HD2 LYS A 27 1.280 1.774 8.185 1.00 24.23 H new ATOM 0 HD3 LYS A 27 0.031 2.702 7.378 1.00 24.23 H new ATOM 0 HE2 LYS A 27 -0.949 1.976 9.396 1.00 22.24 H new ATOM 0 HE3 LYS A 27 -1.638 0.946 8.156 1.00 22.24 H new ATOM 0 HZ1 LYS A 27 -0.996 -0.763 9.379 1.00 25.11 H new ATOM 0 HZ2 LYS A 27 0.621 -0.381 9.025 1.00 25.11 H new ATOM 0 HZ3 LYS A 27 -0.106 0.226 10.435 1.00 25.11 H new ATOM 452 N ILE A 28 1.299 -0.627 3.244 1.00 51.14 N ATOM 453 CA ILE A 28 2.321 -1.594 2.854 1.00 42.43 C ATOM 454 C ILE A 28 3.631 -1.311 3.566 1.00 70.52 C ATOM 455 O ILE A 28 4.131 -0.139 3.578 1.00 24.44 O ATOM 456 CB ILE A 28 2.588 -1.610 1.330 1.00 2.32 C ATOM 457 CG1 ILE A 28 1.280 -1.698 0.536 1.00 75.11 C ATOM 458 CG2 ILE A 28 3.496 -2.796 0.978 1.00 50.33 C ATOM 459 CD1 ILE A 28 1.478 -1.746 -0.968 1.00 53.43 C ATOM 0 H ILE A 28 1.395 0.294 2.817 1.00 51.14 H new ATOM 0 HA ILE A 28 1.930 -2.570 3.143 1.00 42.43 H new ATOM 0 HB ILE A 28 3.082 -0.677 1.060 1.00 2.32 H new ATOM 0 HG12 ILE A 28 0.735 -2.588 0.850 1.00 75.11 H new ATOM 0 HG13 ILE A 28 0.657 -0.839 0.784 1.00 75.11 H new ATOM 0 HG21 ILE A 28 3.683 -2.805 -0.096 1.00 50.33 H new ATOM 0 HG22 ILE A 28 4.443 -2.700 1.510 1.00 50.33 H new ATOM 0 HG23 ILE A 28 3.009 -3.726 1.270 1.00 50.33 H new ATOM 0 HD11 ILE A 28 0.508 -1.808 -1.461 1.00 53.43 H new ATOM 0 HD12 ILE A 28 1.995 -0.844 -1.296 1.00 53.43 H new ATOM 0 HD13 ILE A 28 2.074 -2.621 -1.229 1.00 53.43 H new ATOM 471 N LEU A 29 4.179 -2.371 4.158 1.00 70.22 N ATOM 472 CA LEU A 29 5.409 -2.328 4.928 1.00 51.34 C ATOM 473 C LEU A 29 6.422 -3.355 4.480 1.00 44.31 C ATOM 474 O LEU A 29 6.202 -4.577 4.590 1.00 72.44 O ATOM 475 CB LEU A 29 5.166 -2.461 6.463 1.00 43.42 C ATOM 476 CG LEU A 29 4.689 -1.223 7.200 1.00 31.41 C ATOM 477 CD1 LEU A 29 5.697 -0.120 7.097 1.00 15.43 C ATOM 478 CD2 LEU A 29 3.333 -0.753 6.753 1.00 3.33 C ATOM 0 H LEU A 29 3.766 -3.303 4.111 1.00 70.22 H new ATOM 0 HA LEU A 29 5.823 -1.339 4.732 1.00 51.34 H new ATOM 0 HB2 LEU A 29 4.433 -3.252 6.622 1.00 43.42 H new ATOM 0 HB3 LEU A 29 6.096 -2.791 6.925 1.00 43.42 H new ATOM 0 HG LEU A 29 4.584 -1.510 8.246 1.00 31.41 H new ATOM 0 HD11 LEU A 29 5.333 0.757 7.633 1.00 15.43 H new ATOM 0 HD12 LEU A 29 6.640 -0.447 7.535 1.00 15.43 H new ATOM 0 HD13 LEU A 29 5.852 0.134 6.048 1.00 15.43 H new ATOM 0 HD21 LEU A 29 3.051 0.135 7.319 1.00 3.33 H new ATOM 0 HD22 LEU A 29 3.364 -0.512 5.690 1.00 3.33 H new ATOM 0 HD23 LEU A 29 2.600 -1.541 6.925 1.00 3.33 H new ATOM 490 N ASN A 30 7.522 -2.868 3.971 1.00 34.24 N ATOM 491 CA ASN A 30 8.632 -3.713 3.651 1.00 13.14 C ATOM 492 C ASN A 30 9.573 -3.570 4.828 1.00 23.10 C ATOM 493 O ASN A 30 10.211 -2.552 4.995 1.00 63.21 O ATOM 494 CB ASN A 30 9.331 -3.246 2.355 1.00 24.23 C ATOM 495 CG ASN A 30 10.328 -4.257 1.758 1.00 71.42 C ATOM 496 OD1 ASN A 30 10.545 -4.276 0.537 1.00 45.42 O ATOM 497 ND2 ASN A 30 10.938 -5.092 2.578 1.00 44.11 N ATOM 0 H ASN A 30 7.670 -1.879 3.769 1.00 34.24 H new ATOM 0 HA ASN A 30 8.320 -4.744 3.482 1.00 13.14 H new ATOM 0 HB2 ASN A 30 8.569 -3.024 1.608 1.00 24.23 H new ATOM 0 HB3 ASN A 30 9.858 -2.314 2.559 1.00 24.23 H new ATOM 0 HD21 ASN A 30 11.604 -5.772 2.211 1.00 44.11 H new ATOM 0 HD22 ASN A 30 10.743 -5.058 3.579 1.00 44.11 H new ATOM 504 N THR A 31 9.597 -4.556 5.661 1.00 74.31 N ATOM 505 CA THR A 31 10.383 -4.505 6.858 1.00 62.40 C ATOM 506 C THR A 31 11.778 -5.072 6.573 1.00 13.42 C ATOM 507 O THR A 31 11.889 -6.061 5.860 1.00 61.54 O ATOM 508 CB THR A 31 9.644 -5.302 7.957 1.00 63.34 C ATOM 509 OG1 THR A 31 8.297 -4.818 7.989 1.00 64.33 O ATOM 510 CG2 THR A 31 10.257 -5.088 9.342 1.00 45.40 C ATOM 0 H THR A 31 9.074 -5.422 5.535 1.00 74.31 H new ATOM 0 HA THR A 31 10.513 -3.479 7.204 1.00 62.40 H new ATOM 0 HB THR A 31 9.710 -6.365 7.725 1.00 63.34 H new ATOM 0 HG1 THR A 31 8.048 -4.603 8.912 1.00 64.33 H new ATOM 0 HG21 THR A 31 9.703 -5.669 10.079 1.00 45.40 H new ATOM 0 HG22 THR A 31 11.298 -5.412 9.333 1.00 45.40 H new ATOM 0 HG23 THR A 31 10.208 -4.031 9.602 1.00 45.40 H new ATOM 518 N PRO A 32 12.843 -4.405 7.095 1.00 14.43 N ATOM 519 CA PRO A 32 14.277 -4.753 6.902 1.00 3.53 C ATOM 520 C PRO A 32 14.658 -6.251 6.740 1.00 62.51 C ATOM 521 O PRO A 32 15.630 -6.563 6.057 1.00 70.55 O ATOM 522 CB PRO A 32 14.908 -4.184 8.160 1.00 54.21 C ATOM 523 CG PRO A 32 14.147 -2.926 8.409 1.00 23.01 C ATOM 524 CD PRO A 32 12.736 -3.163 7.917 1.00 4.23 C ATOM 0 HA PRO A 32 14.616 -4.355 5.945 1.00 3.53 H new ATOM 0 HB2 PRO A 32 14.821 -4.876 8.998 1.00 54.21 H new ATOM 0 HB3 PRO A 32 15.971 -3.986 8.019 1.00 54.21 H new ATOM 0 HG2 PRO A 32 14.149 -2.676 9.470 1.00 23.01 H new ATOM 0 HG3 PRO A 32 14.604 -2.088 7.883 1.00 23.01 H new ATOM 0 HD2 PRO A 32 12.041 -3.292 8.746 1.00 4.23 H new ATOM 0 HD3 PRO A 32 12.373 -2.323 7.325 1.00 4.23 H new ATOM 532 N ASN A 33 13.924 -7.158 7.352 1.00 30.34 N ATOM 533 CA ASN A 33 14.290 -8.574 7.269 1.00 43.04 C ATOM 534 C ASN A 33 13.083 -9.413 6.823 1.00 13.24 C ATOM 535 O ASN A 33 13.029 -10.619 7.017 1.00 23.50 O ATOM 536 CB ASN A 33 14.835 -9.035 8.649 1.00 2.53 C ATOM 537 CG ASN A 33 15.485 -10.430 8.650 1.00 43.24 C ATOM 538 OD1 ASN A 33 16.673 -10.568 8.356 1.00 21.32 O ATOM 539 ND2 ASN A 33 14.746 -11.448 9.022 1.00 41.41 N ATOM 0 H ASN A 33 13.089 -6.957 7.902 1.00 30.34 H new ATOM 0 HA ASN A 33 15.071 -8.715 6.522 1.00 43.04 H new ATOM 0 HB2 ASN A 33 15.568 -8.307 8.996 1.00 2.53 H new ATOM 0 HB3 ASN A 33 14.016 -9.030 9.368 1.00 2.53 H new ATOM 0 HD21 ASN A 33 15.153 -12.382 9.073 1.00 41.41 H new ATOM 0 HD22 ASN A 33 13.764 -11.306 9.260 1.00 41.41 H new ATOM 546 N CYS A 34 12.139 -8.790 6.173 1.00 41.11 N ATOM 547 CA CYS A 34 10.958 -9.509 5.784 1.00 45.55 C ATOM 548 C CYS A 34 10.591 -9.129 4.343 1.00 5.51 C ATOM 549 O CYS A 34 10.789 -7.982 3.947 1.00 62.50 O ATOM 550 CB CYS A 34 9.832 -9.163 6.753 1.00 14.24 C ATOM 551 SG CYS A 34 8.598 -10.470 6.968 1.00 51.21 S ATOM 0 H CYS A 34 12.162 -7.806 5.906 1.00 41.11 H new ATOM 0 HA CYS A 34 11.129 -10.585 5.820 1.00 45.55 H new ATOM 0 HB2 CYS A 34 10.266 -8.927 7.725 1.00 14.24 H new ATOM 0 HB3 CYS A 34 9.330 -8.262 6.400 1.00 14.24 H new ATOM 556 N ALA A 35 10.061 -10.099 3.577 1.00 33.14 N ATOM 557 CA ALA A 35 9.752 -9.925 2.141 1.00 50.00 C ATOM 558 C ALA A 35 8.845 -8.710 1.848 1.00 52.52 C ATOM 559 O ALA A 35 9.324 -7.658 1.439 1.00 11.14 O ATOM 560 CB ALA A 35 9.155 -11.210 1.562 1.00 14.23 C ATOM 0 H ALA A 35 9.834 -11.027 3.934 1.00 33.14 H new ATOM 0 HA ALA A 35 10.699 -9.715 1.644 1.00 50.00 H new ATOM 0 HB1 ALA A 35 8.934 -11.064 0.505 1.00 14.23 H new ATOM 0 HB2 ALA A 35 9.869 -12.026 1.674 1.00 14.23 H new ATOM 0 HB3 ALA A 35 8.236 -11.456 2.094 1.00 14.23 H new ATOM 566 N CYS A 36 7.554 -8.864 2.059 1.00 64.22 N ATOM 567 CA CYS A 36 6.606 -7.779 1.859 1.00 74.31 C ATOM 568 C CYS A 36 5.315 -8.146 2.551 1.00 2.30 C ATOM 569 O CYS A 36 4.891 -9.292 2.494 1.00 3.35 O ATOM 570 CB CYS A 36 6.347 -7.508 0.356 1.00 75.15 C ATOM 571 SG CYS A 36 5.294 -6.035 0.029 1.00 24.15 S ATOM 0 H CYS A 36 7.131 -9.738 2.372 1.00 64.22 H new ATOM 0 HA CYS A 36 7.022 -6.864 2.280 1.00 74.31 H new ATOM 0 HB2 CYS A 36 7.304 -7.376 -0.149 1.00 75.15 H new ATOM 0 HB3 CYS A 36 5.873 -8.385 -0.084 1.00 75.15 H new ATOM 576 N GLN A 37 4.734 -7.199 3.245 1.00 32.00 N ATOM 577 CA GLN A 37 3.498 -7.378 3.975 1.00 43.35 C ATOM 578 C GLN A 37 2.641 -6.150 3.829 1.00 64.10 C ATOM 579 O GLN A 37 3.142 -5.019 3.900 1.00 0.04 O ATOM 580 CB GLN A 37 3.714 -7.638 5.501 1.00 71.32 C ATOM 581 CG GLN A 37 4.192 -9.050 5.919 1.00 20.41 C ATOM 582 CD GLN A 37 5.600 -9.430 5.492 1.00 12.01 C ATOM 583 OE1 GLN A 37 6.505 -8.471 5.435 1.00 60.25 O flip ATOM 584 NE2 GLN A 37 5.880 -10.602 5.247 1.00 34.45 N flip ATOM 0 H GLN A 37 5.116 -6.256 3.321 1.00 32.00 H new ATOM 0 HA GLN A 37 3.017 -8.258 3.549 1.00 43.35 H new ATOM 0 HB2 GLN A 37 4.441 -6.913 5.867 1.00 71.32 H new ATOM 0 HB3 GLN A 37 2.774 -7.434 6.014 1.00 71.32 H new ATOM 0 HG2 GLN A 37 4.130 -9.126 7.005 1.00 20.41 H new ATOM 0 HG3 GLN A 37 3.498 -9.783 5.508 1.00 20.41 H new ATOM 0 HE21 GLN A 37 5.158 -11.321 5.300 1.00 34.45 H new ATOM 0 HE22 GLN A 37 6.834 -10.856 4.991 1.00 34.45 H new ATOM 593 N ILE A 38 1.381 -6.355 3.606 1.00 54.11 N ATOM 594 CA ILE A 38 0.444 -5.283 3.562 1.00 1.44 C ATOM 595 C ILE A 38 -0.437 -5.437 4.768 1.00 64.20 C ATOM 596 O ILE A 38 -0.907 -6.511 5.047 1.00 43.05 O ATOM 597 CB ILE A 38 -0.405 -5.332 2.280 1.00 32.03 C ATOM 598 CG1 ILE A 38 0.514 -5.365 1.054 1.00 32.53 C ATOM 599 CG2 ILE A 38 -1.355 -4.129 2.221 1.00 4.31 C ATOM 600 CD1 ILE A 38 -0.207 -5.445 -0.259 1.00 64.10 C ATOM 0 H ILE A 38 0.974 -7.277 3.449 1.00 54.11 H new ATOM 0 HA ILE A 38 0.963 -4.325 3.561 1.00 1.44 H new ATOM 0 HB ILE A 38 -1.012 -6.238 2.286 1.00 32.03 H new ATOM 0 HG12 ILE A 38 1.138 -4.471 1.058 1.00 32.53 H new ATOM 0 HG13 ILE A 38 1.183 -6.221 1.140 1.00 32.53 H new ATOM 0 HG21 ILE A 38 -1.948 -4.178 1.308 1.00 4.31 H new ATOM 0 HG22 ILE A 38 -2.018 -4.146 3.086 1.00 4.31 H new ATOM 0 HG23 ILE A 38 -0.775 -3.206 2.227 1.00 4.31 H new ATOM 0 HD11 ILE A 38 0.519 -5.464 -1.072 1.00 64.10 H new ATOM 0 HD12 ILE A 38 -0.809 -6.353 -0.289 1.00 64.10 H new ATOM 0 HD13 ILE A 38 -0.855 -4.576 -0.372 1.00 64.10 H new ATOM 612 N VAL A 39 -0.622 -4.399 5.475 1.00 73.12 N ATOM 613 CA VAL A 39 -1.363 -4.428 6.704 1.00 52.54 C ATOM 614 C VAL A 39 -2.582 -3.517 6.627 1.00 62.31 C ATOM 615 O VAL A 39 -2.569 -2.490 5.924 1.00 32.15 O ATOM 616 CB VAL A 39 -0.471 -4.061 7.911 1.00 4.54 C ATOM 617 CG1 VAL A 39 0.637 -5.081 8.090 1.00 44.34 C ATOM 618 CG2 VAL A 39 0.129 -2.700 7.720 1.00 12.14 C ATOM 0 H VAL A 39 -0.263 -3.477 5.228 1.00 73.12 H new ATOM 0 HA VAL A 39 -1.713 -5.449 6.854 1.00 52.54 H new ATOM 0 HB VAL A 39 -1.096 -4.058 8.804 1.00 4.54 H new ATOM 0 HG11 VAL A 39 1.253 -4.803 8.945 1.00 44.34 H new ATOM 0 HG12 VAL A 39 0.201 -6.065 8.261 1.00 44.34 H new ATOM 0 HG13 VAL A 39 1.254 -5.109 7.192 1.00 44.34 H new ATOM 0 HG21 VAL A 39 0.755 -2.455 8.578 1.00 12.14 H new ATOM 0 HG22 VAL A 39 0.736 -2.694 6.815 1.00 12.14 H new ATOM 0 HG23 VAL A 39 -0.667 -1.961 7.628 1.00 12.14 H new ATOM 628 N ALA A 40 -3.626 -3.888 7.323 1.00 13.42 N ATOM 629 CA ALA A 40 -4.876 -3.180 7.264 1.00 24.35 C ATOM 630 C ALA A 40 -5.489 -2.998 8.645 1.00 62.14 C ATOM 631 O ALA A 40 -5.312 -3.821 9.521 1.00 3.10 O ATOM 632 CB ALA A 40 -5.828 -3.934 6.377 1.00 63.05 C ATOM 0 H ALA A 40 -3.631 -4.693 7.949 1.00 13.42 H new ATOM 0 HA ALA A 40 -4.687 -2.187 6.857 1.00 24.35 H new ATOM 0 HB1 ALA A 40 -6.778 -3.402 6.328 1.00 63.05 H new ATOM 0 HB2 ALA A 40 -5.405 -4.015 5.376 1.00 63.05 H new ATOM 0 HB3 ALA A 40 -5.991 -4.932 6.784 1.00 63.05 H new ATOM 638 N ARG A 41 -6.173 -1.899 8.847 1.00 31.54 N ATOM 639 CA ARG A 41 -6.867 -1.680 10.088 1.00 2.24 C ATOM 640 C ARG A 41 -8.295 -2.070 9.909 1.00 43.53 C ATOM 641 O ARG A 41 -8.910 -1.677 8.934 1.00 4.43 O ATOM 642 CB ARG A 41 -6.793 -0.237 10.565 1.00 62.15 C ATOM 643 CG ARG A 41 -5.417 0.249 10.920 1.00 61.41 C ATOM 644 CD ARG A 41 -5.528 1.559 11.642 1.00 21.11 C ATOM 645 NE ARG A 41 -4.228 2.071 12.100 1.00 72.12 N ATOM 646 CZ ARG A 41 -4.017 3.323 12.558 1.00 1.14 C ATOM 647 NH1 ARG A 41 -4.981 4.233 12.488 1.00 4.14 N ATOM 648 NH2 ARG A 41 -2.833 3.660 13.055 1.00 30.33 N ATOM 0 H ARG A 41 -6.263 -1.144 8.167 1.00 31.54 H new ATOM 0 HA ARG A 41 -6.381 -2.289 10.850 1.00 2.24 H new ATOM 0 HB2 ARG A 41 -7.199 0.408 9.786 1.00 62.15 H new ATOM 0 HB3 ARG A 41 -7.437 -0.126 11.438 1.00 62.15 H new ATOM 0 HG2 ARG A 41 -4.910 -0.484 11.548 1.00 61.41 H new ATOM 0 HG3 ARG A 41 -4.816 0.367 10.018 1.00 61.41 H new ATOM 0 HD2 ARG A 41 -5.990 2.294 10.983 1.00 21.11 H new ATOM 0 HD3 ARG A 41 -6.189 1.440 12.500 1.00 21.11 H new ATOM 0 HE ARG A 41 -3.430 1.436 12.069 1.00 72.12 H new ATOM 0 HH11 ARG A 41 -5.886 3.987 12.087 1.00 4.14 H new ATOM 0 HH12 ARG A 41 -4.817 5.178 12.835 1.00 4.14 H new ATOM 0 HH21 ARG A 41 -2.081 2.972 13.091 1.00 30.33 H new ATOM 0 HH22 ARG A 41 -2.676 4.607 13.401 1.00 30.33 H new ATOM 662 N LEU A 42 -8.807 -2.860 10.804 1.00 4.13 N ATOM 663 CA LEU A 42 -10.184 -3.340 10.695 1.00 73.24 C ATOM 664 C LEU A 42 -11.180 -2.349 11.166 1.00 4.13 C ATOM 665 O LEU A 42 -10.930 -1.597 12.105 1.00 53.21 O ATOM 666 CB LEU A 42 -10.401 -4.748 11.275 1.00 55.31 C ATOM 667 CG LEU A 42 -10.072 -5.895 10.325 1.00 23.53 C ATOM 668 CD1 LEU A 42 -8.698 -5.760 9.741 1.00 4.14 C ATOM 669 CD2 LEU A 42 -10.214 -7.217 11.018 1.00 11.13 C ATOM 0 H LEU A 42 -8.304 -3.196 11.626 1.00 4.13 H new ATOM 0 HA LEU A 42 -10.362 -3.453 9.626 1.00 73.24 H new ATOM 0 HB2 LEU A 42 -9.791 -4.853 12.172 1.00 55.31 H new ATOM 0 HB3 LEU A 42 -11.442 -4.840 11.585 1.00 55.31 H new ATOM 0 HG LEU A 42 -10.788 -5.848 9.504 1.00 23.53 H new ATOM 0 HD11 LEU A 42 -8.504 -6.597 9.070 1.00 4.14 H new ATOM 0 HD12 LEU A 42 -8.630 -4.825 9.184 1.00 4.14 H new ATOM 0 HD13 LEU A 42 -7.960 -5.759 10.543 1.00 4.14 H new ATOM 0 HD21 LEU A 42 -9.975 -8.021 10.321 1.00 11.13 H new ATOM 0 HD22 LEU A 42 -9.532 -7.258 11.867 1.00 11.13 H new ATOM 0 HD23 LEU A 42 -11.239 -7.335 11.370 1.00 11.13 H new ATOM 681 N LYS A 43 -12.291 -2.349 10.494 1.00 10.20 N ATOM 682 CA LYS A 43 -13.332 -1.358 10.653 1.00 44.14 C ATOM 683 C LYS A 43 -13.970 -1.240 12.036 1.00 55.50 C ATOM 684 O LYS A 43 -13.483 -0.477 12.876 1.00 3.44 O ATOM 685 CB LYS A 43 -14.337 -1.470 9.533 1.00 23.21 C ATOM 686 CG LYS A 43 -13.744 -1.063 8.203 1.00 32.20 C ATOM 687 CD LYS A 43 -14.564 -1.550 7.042 1.00 61.13 C ATOM 688 CE LYS A 43 -15.988 -1.061 7.074 1.00 51.33 C ATOM 689 NZ LYS A 43 -16.725 -1.511 5.878 1.00 72.45 N ATOM 0 H LYS A 43 -12.513 -3.058 9.795 1.00 10.20 H new ATOM 0 HA LYS A 43 -12.820 -0.398 10.578 1.00 44.14 H new ATOM 0 HB2 LYS A 43 -14.699 -2.496 9.471 1.00 23.21 H new ATOM 0 HB3 LYS A 43 -15.199 -0.841 9.754 1.00 23.21 H new ATOM 0 HG2 LYS A 43 -13.665 0.023 8.160 1.00 32.20 H new ATOM 0 HG3 LYS A 43 -12.732 -1.459 8.122 1.00 32.20 H new ATOM 0 HD2 LYS A 43 -14.096 -1.224 6.113 1.00 61.13 H new ATOM 0 HD3 LYS A 43 -14.561 -2.640 7.035 1.00 61.13 H new ATOM 0 HE2 LYS A 43 -16.484 -1.430 7.972 1.00 51.33 H new ATOM 0 HE3 LYS A 43 -16.002 0.028 7.127 1.00 51.33 H new ATOM 0 HZ1 LYS A 43 -17.740 -1.566 6.096 1.00 72.45 H new ATOM 0 HZ2 LYS A 43 -16.573 -0.835 5.102 1.00 72.45 H new ATOM 0 HZ3 LYS A 43 -16.381 -2.450 5.591 1.00 72.45 H new ATOM 745 N ARG A 47 -9.229 -5.152 15.262 1.00 21.12 N ATOM 746 CA ARG A 47 -8.105 -4.247 15.414 1.00 41.33 C ATOM 747 C ARG A 47 -7.378 -4.222 14.079 1.00 11.30 C ATOM 748 O ARG A 47 -8.008 -4.369 13.053 1.00 11.40 O ATOM 749 CB ARG A 47 -7.161 -4.693 16.598 1.00 22.35 C ATOM 750 CG ARG A 47 -6.291 -5.970 16.422 1.00 75.35 C ATOM 751 CD ARG A 47 -7.062 -7.269 16.308 1.00 12.44 C ATOM 752 NE ARG A 47 -6.131 -8.406 16.156 1.00 33.24 N ATOM 753 CZ ARG A 47 -6.440 -9.717 16.293 1.00 34.41 C ATOM 754 NH1 ARG A 47 -7.658 -10.099 16.653 1.00 22.34 N ATOM 755 NH2 ARG A 47 -5.510 -10.632 16.090 1.00 51.13 N ATOM 0 HA ARG A 47 -8.445 -3.245 15.676 1.00 41.33 H new ATOM 0 HB2 ARG A 47 -6.489 -3.863 16.815 1.00 22.35 H new ATOM 0 HB3 ARG A 47 -7.784 -4.837 17.481 1.00 22.35 H new ATOM 0 HG2 ARG A 47 -5.678 -5.851 15.529 1.00 75.35 H new ATOM 0 HG3 ARG A 47 -5.609 -6.045 17.269 1.00 75.35 H new ATOM 0 HD2 ARG A 47 -7.680 -7.412 17.194 1.00 12.44 H new ATOM 0 HD3 ARG A 47 -7.737 -7.226 15.453 1.00 12.44 H new ATOM 0 HE ARG A 47 -5.163 -8.182 15.926 1.00 33.24 H new ATOM 0 HH11 ARG A 47 -8.380 -9.401 16.831 1.00 22.34 H new ATOM 0 HH12 ARG A 47 -7.873 -11.091 16.751 1.00 22.34 H new ATOM 0 HH21 ARG A 47 -4.565 -10.350 15.831 1.00 51.13 H new ATOM 0 HH22 ARG A 47 -5.737 -11.621 16.192 1.00 51.13 H new ATOM 769 N GLN A 48 -6.098 -4.051 14.068 1.00 24.23 N ATOM 770 CA GLN A 48 -5.391 -4.058 12.813 1.00 74.33 C ATOM 771 C GLN A 48 -4.804 -5.435 12.560 1.00 31.42 C ATOM 772 O GLN A 48 -4.221 -6.041 13.456 1.00 10.31 O ATOM 773 CB GLN A 48 -4.288 -2.968 12.730 1.00 61.44 C ATOM 774 CG GLN A 48 -3.161 -3.049 13.775 1.00 52.14 C ATOM 775 CD GLN A 48 -3.612 -2.691 15.170 1.00 64.10 C ATOM 776 OE1 GLN A 48 -4.053 -3.540 15.929 1.00 55.30 O ATOM 777 NE2 GLN A 48 -3.489 -1.441 15.514 1.00 62.21 N ATOM 0 H GLN A 48 -5.519 -3.906 14.895 1.00 24.23 H new ATOM 0 HA GLN A 48 -6.116 -3.819 12.035 1.00 74.33 H new ATOM 0 HB2 GLN A 48 -3.838 -3.014 11.738 1.00 61.44 H new ATOM 0 HB3 GLN A 48 -4.766 -1.992 12.819 1.00 61.44 H new ATOM 0 HG2 GLN A 48 -2.753 -4.060 13.781 1.00 52.14 H new ATOM 0 HG3 GLN A 48 -2.352 -2.380 13.479 1.00 52.14 H new ATOM 0 HE21 GLN A 48 -3.116 -0.763 14.849 1.00 62.21 H new ATOM 0 HE22 GLN A 48 -3.766 -1.140 16.448 1.00 62.21 H new ATOM 786 N VAL A 49 -4.992 -5.931 11.362 1.00 21.21 N ATOM 787 CA VAL A 49 -4.499 -7.237 10.989 1.00 43.21 C ATOM 788 C VAL A 49 -3.622 -7.108 9.768 1.00 52.20 C ATOM 789 O VAL A 49 -3.702 -6.113 9.022 1.00 71.24 O ATOM 790 CB VAL A 49 -5.618 -8.313 10.728 1.00 25.20 C ATOM 791 CG1 VAL A 49 -6.620 -8.404 11.863 1.00 0.20 C ATOM 792 CG2 VAL A 49 -6.298 -8.174 9.373 1.00 65.54 C ATOM 0 H VAL A 49 -5.490 -5.443 10.618 1.00 21.21 H new ATOM 0 HA VAL A 49 -3.935 -7.603 11.847 1.00 43.21 H new ATOM 0 HB VAL A 49 -5.090 -9.266 10.696 1.00 25.20 H new ATOM 0 HG11 VAL A 49 -7.368 -9.161 11.628 1.00 0.20 H new ATOM 0 HG12 VAL A 49 -6.104 -8.677 12.783 1.00 0.20 H new ATOM 0 HG13 VAL A 49 -7.110 -7.439 11.994 1.00 0.20 H new ATOM 0 HG21 VAL A 49 -7.057 -8.949 9.265 1.00 65.54 H new ATOM 0 HG22 VAL A 49 -6.769 -7.193 9.301 1.00 65.54 H new ATOM 0 HG23 VAL A 49 -5.556 -8.280 8.581 1.00 65.54 H new ATOM 802 N CYS A 50 -2.791 -8.042 9.585 1.00 54.13 N ATOM 803 CA CYS A 50 -1.910 -8.062 8.480 1.00 20.04 C ATOM 804 C CYS A 50 -2.573 -8.813 7.367 1.00 73.03 C ATOM 805 O CYS A 50 -3.246 -9.766 7.607 1.00 55.42 O ATOM 806 CB CYS A 50 -0.628 -8.731 8.892 1.00 21.44 C ATOM 807 SG CYS A 50 0.212 -7.877 10.262 1.00 44.42 S ATOM 0 H CYS A 50 -2.693 -8.842 10.211 1.00 54.13 H new ATOM 0 HA CYS A 50 -1.679 -7.052 8.141 1.00 20.04 H new ATOM 0 HB2 CYS A 50 -0.840 -9.759 9.187 1.00 21.44 H new ATOM 0 HB3 CYS A 50 0.043 -8.777 8.034 1.00 21.44 H new ATOM 812 N ILE A 51 -2.404 -8.379 6.172 1.00 72.41 N ATOM 813 CA ILE A 51 -3.043 -9.016 5.060 1.00 34.11 C ATOM 814 C ILE A 51 -1.983 -9.739 4.255 1.00 4.53 C ATOM 815 O ILE A 51 -0.820 -9.299 4.218 1.00 45.21 O ATOM 816 CB ILE A 51 -3.710 -7.957 4.130 1.00 51.00 C ATOM 817 CG1 ILE A 51 -4.552 -6.952 4.933 1.00 10.35 C ATOM 818 CG2 ILE A 51 -4.577 -8.639 3.085 1.00 11.43 C ATOM 819 CD1 ILE A 51 -5.669 -7.566 5.735 1.00 73.20 C ATOM 0 H ILE A 51 -1.823 -7.577 5.928 1.00 72.41 H new ATOM 0 HA ILE A 51 -3.804 -9.701 5.432 1.00 34.11 H new ATOM 0 HB ILE A 51 -2.911 -7.408 3.631 1.00 51.00 H new ATOM 0 HG12 ILE A 51 -3.894 -6.407 5.610 1.00 10.35 H new ATOM 0 HG13 ILE A 51 -4.977 -6.222 4.244 1.00 10.35 H new ATOM 0 HG21 ILE A 51 -5.035 -7.886 2.444 1.00 11.43 H new ATOM 0 HG22 ILE A 51 -3.962 -9.305 2.480 1.00 11.43 H new ATOM 0 HG23 ILE A 51 -5.357 -9.217 3.580 1.00 11.43 H new ATOM 0 HD11 ILE A 51 -6.208 -6.782 6.268 1.00 73.20 H new ATOM 0 HD12 ILE A 51 -6.354 -8.087 5.066 1.00 73.20 H new ATOM 0 HD13 ILE A 51 -5.255 -8.274 6.453 1.00 73.20 H new ATOM 831 N ASP A 52 -2.352 -10.853 3.650 1.00 24.41 N ATOM 832 CA ASP A 52 -1.467 -11.555 2.761 1.00 73.11 C ATOM 833 C ASP A 52 -1.280 -10.653 1.548 1.00 52.40 C ATOM 834 O ASP A 52 -2.266 -10.303 0.886 1.00 13.25 O ATOM 835 CB ASP A 52 -2.127 -12.862 2.315 1.00 21.22 C ATOM 836 CG ASP A 52 -1.215 -13.794 1.535 1.00 71.24 C ATOM 837 OD1 ASP A 52 -0.553 -13.353 0.581 1.00 23.41 O ATOM 838 OD2 ASP A 52 -1.139 -14.991 1.900 1.00 2.32 O ATOM 0 H ASP A 52 -3.268 -11.288 3.764 1.00 24.41 H new ATOM 0 HA ASP A 52 -0.518 -11.788 3.243 1.00 73.11 H new ATOM 0 HB2 ASP A 52 -2.495 -13.388 3.196 1.00 21.22 H new ATOM 0 HB3 ASP A 52 -2.995 -12.625 1.700 1.00 21.22 H new ATOM 843 N PRO A 53 -0.044 -10.226 1.250 1.00 73.23 N ATOM 844 CA PRO A 53 0.219 -9.333 0.117 1.00 61.22 C ATOM 845 C PRO A 53 -0.123 -9.967 -1.222 1.00 54.41 C ATOM 846 O PRO A 53 -0.188 -9.299 -2.252 1.00 74.24 O ATOM 847 CB PRO A 53 1.715 -9.042 0.192 1.00 72.52 C ATOM 848 CG PRO A 53 2.298 -10.011 1.162 1.00 43.44 C ATOM 849 CD PRO A 53 1.176 -10.569 1.994 1.00 22.03 C ATOM 0 HA PRO A 53 -0.399 -8.437 0.180 1.00 61.22 H new ATOM 0 HB2 PRO A 53 2.179 -9.151 -0.788 1.00 72.52 H new ATOM 0 HB3 PRO A 53 1.893 -8.017 0.517 1.00 72.52 H new ATOM 0 HG2 PRO A 53 2.816 -10.812 0.635 1.00 43.44 H new ATOM 0 HG3 PRO A 53 3.034 -9.518 1.797 1.00 43.44 H new ATOM 0 HD2 PRO A 53 1.274 -11.647 2.119 1.00 22.03 H new ATOM 0 HD3 PRO A 53 1.168 -10.132 2.992 1.00 22.03 H new ATOM 857 N LYS A 54 -0.328 -11.244 -1.204 1.00 12.24 N ATOM 858 CA LYS A 54 -0.642 -11.962 -2.372 1.00 20.24 C ATOM 859 C LYS A 54 -2.104 -12.494 -2.355 1.00 31.23 C ATOM 860 O LYS A 54 -2.493 -13.318 -3.199 1.00 1.11 O ATOM 861 CB LYS A 54 0.429 -13.036 -2.587 1.00 62.34 C ATOM 862 CG LYS A 54 1.827 -12.395 -2.607 1.00 50.13 C ATOM 863 CD LYS A 54 2.975 -13.354 -2.919 1.00 51.14 C ATOM 864 CE LYS A 54 3.119 -14.415 -1.858 1.00 52.32 C ATOM 865 NZ LYS A 54 4.279 -15.292 -2.098 1.00 22.05 N ATOM 0 H LYS A 54 -0.279 -11.815 -0.360 1.00 12.24 H new ATOM 0 HA LYS A 54 -0.621 -11.303 -3.240 1.00 20.24 H new ATOM 0 HB2 LYS A 54 0.373 -13.780 -1.792 1.00 62.34 H new ATOM 0 HB3 LYS A 54 0.247 -13.559 -3.526 1.00 62.34 H new ATOM 0 HG2 LYS A 54 1.832 -11.594 -3.346 1.00 50.13 H new ATOM 0 HG3 LYS A 54 2.012 -11.934 -1.637 1.00 50.13 H new ATOM 0 HD2 LYS A 54 2.802 -13.827 -3.886 1.00 51.14 H new ATOM 0 HD3 LYS A 54 3.906 -12.793 -3.001 1.00 51.14 H new ATOM 0 HE2 LYS A 54 3.222 -13.939 -0.883 1.00 52.32 H new ATOM 0 HE3 LYS A 54 2.211 -15.018 -1.824 1.00 52.32 H new ATOM 0 HZ1 LYS A 54 4.337 -16.005 -1.343 1.00 22.05 H new ATOM 0 HZ2 LYS A 54 4.170 -15.768 -3.016 1.00 22.05 H new ATOM 0 HZ3 LYS A 54 5.149 -14.723 -2.104 1.00 22.05 H new ATOM 879 N LEU A 55 -2.931 -11.992 -1.404 1.00 74.25 N ATOM 880 CA LEU A 55 -4.338 -12.291 -1.370 1.00 74.33 C ATOM 881 C LEU A 55 -5.047 -11.805 -2.638 1.00 0.01 C ATOM 882 O LEU A 55 -4.629 -10.829 -3.248 1.00 3.54 O ATOM 883 CB LEU A 55 -4.947 -11.626 -0.169 1.00 13.24 C ATOM 884 CG LEU A 55 -5.534 -12.553 0.860 1.00 42.42 C ATOM 885 CD1 LEU A 55 -6.053 -11.769 2.046 1.00 15.23 C ATOM 886 CD2 LEU A 55 -6.640 -13.407 0.261 1.00 51.53 C ATOM 0 H LEU A 55 -2.619 -11.375 -0.654 1.00 74.25 H new ATOM 0 HA LEU A 55 -4.460 -13.373 -1.312 1.00 74.33 H new ATOM 0 HB2 LEU A 55 -4.183 -11.015 0.312 1.00 13.24 H new ATOM 0 HB3 LEU A 55 -5.730 -10.948 -0.509 1.00 13.24 H new ATOM 0 HG LEU A 55 -4.742 -13.219 1.203 1.00 42.42 H new ATOM 0 HD11 LEU A 55 -6.474 -12.456 2.780 1.00 15.23 H new ATOM 0 HD12 LEU A 55 -5.234 -11.210 2.499 1.00 15.23 H new ATOM 0 HD13 LEU A 55 -6.825 -11.075 1.714 1.00 15.23 H new ATOM 0 HD21 LEU A 55 -7.046 -14.067 1.028 1.00 51.53 H new ATOM 0 HD22 LEU A 55 -7.432 -12.762 -0.119 1.00 51.53 H new ATOM 0 HD23 LEU A 55 -6.236 -14.005 -0.556 1.00 51.53 H new ATOM 898 N LYS A 56 -6.150 -12.474 -2.984 1.00 44.01 N ATOM 899 CA LYS A 56 -6.919 -12.224 -4.220 1.00 72.42 C ATOM 900 C LYS A 56 -7.243 -10.755 -4.425 1.00 71.42 C ATOM 901 O LYS A 56 -6.813 -10.153 -5.409 1.00 12.13 O ATOM 902 CB LYS A 56 -8.220 -13.000 -4.193 1.00 64.32 C ATOM 903 CG LYS A 56 -9.056 -12.832 -5.449 1.00 72.21 C ATOM 904 CD LYS A 56 -10.376 -13.554 -5.334 1.00 71.41 C ATOM 905 CE LYS A 56 -11.284 -12.939 -4.273 1.00 20.33 C ATOM 906 NZ LYS A 56 -12.546 -13.680 -4.149 1.00 34.31 N ATOM 0 H LYS A 56 -6.545 -13.218 -2.409 1.00 44.01 H new ATOM 0 HA LYS A 56 -6.287 -12.552 -5.045 1.00 72.42 H new ATOM 0 HB2 LYS A 56 -7.999 -14.058 -4.053 1.00 64.32 H new ATOM 0 HB3 LYS A 56 -8.806 -12.680 -3.331 1.00 64.32 H new ATOM 0 HG2 LYS A 56 -9.234 -11.772 -5.630 1.00 72.21 H new ATOM 0 HG3 LYS A 56 -8.505 -13.214 -6.308 1.00 72.21 H new ATOM 0 HD2 LYS A 56 -10.883 -13.534 -6.299 1.00 71.41 H new ATOM 0 HD3 LYS A 56 -10.195 -14.601 -5.091 1.00 71.41 H new ATOM 0 HE2 LYS A 56 -10.769 -12.932 -3.312 1.00 20.33 H new ATOM 0 HE3 LYS A 56 -11.494 -11.901 -4.530 1.00 20.33 H new ATOM 0 HZ1 LYS A 56 -13.139 -13.236 -3.420 1.00 34.31 H new ATOM 0 HZ2 LYS A 56 -13.048 -13.666 -5.060 1.00 34.31 H new ATOM 0 HZ3 LYS A 56 -12.346 -14.664 -3.880 1.00 34.31 H new ATOM 920 N TRP A 57 -8.004 -10.187 -3.498 1.00 63.24 N ATOM 921 CA TRP A 57 -8.397 -8.787 -3.597 1.00 2.42 C ATOM 922 C TRP A 57 -7.204 -7.845 -3.595 1.00 11.12 C ATOM 923 O TRP A 57 -7.278 -6.766 -4.144 1.00 22.01 O ATOM 924 CB TRP A 57 -9.453 -8.392 -2.558 1.00 61.14 C ATOM 925 CG TRP A 57 -9.083 -8.671 -1.146 1.00 42.52 C ATOM 926 CD1 TRP A 57 -9.231 -9.843 -0.491 1.00 73.43 C ATOM 927 CD2 TRP A 57 -8.536 -7.750 -0.206 1.00 51.33 C ATOM 928 NE1 TRP A 57 -8.810 -9.722 0.793 1.00 72.23 N ATOM 929 CE2 TRP A 57 -8.379 -8.444 1.003 1.00 72.20 C ATOM 930 CE3 TRP A 57 -8.165 -6.409 -0.267 1.00 60.50 C ATOM 931 CZ2 TRP A 57 -7.869 -7.844 2.143 1.00 21.42 C ATOM 932 CZ3 TRP A 57 -7.661 -5.812 0.866 1.00 0.25 C ATOM 933 CH2 TRP A 57 -7.519 -6.532 2.062 1.00 24.40 C ATOM 0 H TRP A 57 -8.360 -10.671 -2.674 1.00 63.24 H new ATOM 0 HA TRP A 57 -8.874 -8.678 -4.571 1.00 2.42 H new ATOM 0 HB2 TRP A 57 -9.659 -7.327 -2.660 1.00 61.14 H new ATOM 0 HB3 TRP A 57 -10.379 -8.919 -2.786 1.00 61.14 H new ATOM 0 HD1 TRP A 57 -9.628 -10.748 -0.927 1.00 73.43 H new ATOM 0 HE1 TRP A 57 -8.815 -10.467 1.490 1.00 72.23 H new ATOM 0 HE3 TRP A 57 -8.271 -5.849 -1.184 1.00 60.50 H new ATOM 0 HZ2 TRP A 57 -7.753 -8.398 3.063 1.00 21.42 H new ATOM 0 HZ3 TRP A 57 -7.370 -4.772 0.834 1.00 0.25 H new ATOM 0 HH2 TRP A 57 -7.124 -6.035 2.936 1.00 24.40 H new ATOM 944 N ILE A 58 -6.105 -8.266 -2.979 1.00 22.35 N ATOM 945 CA ILE A 58 -4.884 -7.476 -2.998 1.00 1.33 C ATOM 946 C ILE A 58 -4.308 -7.484 -4.408 1.00 52.43 C ATOM 947 O ILE A 58 -4.019 -6.428 -4.975 1.00 72.32 O ATOM 948 CB ILE A 58 -3.816 -8.030 -2.018 1.00 3.25 C ATOM 949 CG1 ILE A 58 -4.288 -7.939 -0.568 1.00 75.51 C ATOM 950 CG2 ILE A 58 -2.503 -7.290 -2.190 1.00 43.41 C ATOM 951 CD1 ILE A 58 -4.480 -6.522 -0.077 1.00 52.20 C ATOM 0 H ILE A 58 -6.036 -9.144 -2.464 1.00 22.35 H new ATOM 0 HA ILE A 58 -5.138 -6.464 -2.684 1.00 1.33 H new ATOM 0 HB ILE A 58 -3.663 -9.083 -2.256 1.00 3.25 H new ATOM 0 HG12 ILE A 58 -5.229 -8.479 -0.467 1.00 75.51 H new ATOM 0 HG13 ILE A 58 -3.563 -8.441 0.073 1.00 75.51 H new ATOM 0 HG21 ILE A 58 -1.765 -7.691 -1.495 1.00 43.41 H new ATOM 0 HG22 ILE A 58 -2.145 -7.416 -3.212 1.00 43.41 H new ATOM 0 HG23 ILE A 58 -2.654 -6.230 -1.987 1.00 43.41 H new ATOM 0 HD11 ILE A 58 -4.816 -6.539 0.960 1.00 52.20 H new ATOM 0 HD12 ILE A 58 -3.535 -5.983 -0.144 1.00 52.20 H new ATOM 0 HD13 ILE A 58 -5.228 -6.022 -0.692 1.00 52.20 H new ATOM 963 N GLN A 59 -4.170 -8.694 -4.961 1.00 74.21 N ATOM 964 CA GLN A 59 -3.635 -8.914 -6.295 1.00 21.33 C ATOM 965 C GLN A 59 -4.306 -8.029 -7.319 1.00 64.44 C ATOM 966 O GLN A 59 -3.639 -7.302 -8.028 1.00 72.21 O ATOM 967 CB GLN A 59 -3.850 -10.370 -6.719 1.00 23.44 C ATOM 968 CG GLN A 59 -3.209 -11.397 -5.832 1.00 2.22 C ATOM 969 CD GLN A 59 -1.728 -11.332 -5.897 1.00 34.21 C ATOM 970 OE1 GLN A 59 -1.109 -12.004 -6.712 1.00 41.35 O ATOM 971 NE2 GLN A 59 -1.147 -10.530 -5.069 1.00 33.42 N ATOM 0 H GLN A 59 -4.433 -9.555 -4.482 1.00 74.21 H new ATOM 0 HA GLN A 59 -2.572 -8.676 -6.253 1.00 21.33 H new ATOM 0 HB2 GLN A 59 -4.922 -10.565 -6.758 1.00 23.44 H new ATOM 0 HB3 GLN A 59 -3.466 -10.497 -7.731 1.00 23.44 H new ATOM 0 HG2 GLN A 59 -3.535 -11.244 -4.803 1.00 2.22 H new ATOM 0 HG3 GLN A 59 -3.543 -12.392 -6.127 1.00 2.22 H new ATOM 0 HE21 GLN A 59 -1.704 -9.989 -4.407 1.00 33.42 H new ATOM 0 HE22 GLN A 59 -0.131 -10.437 -5.077 1.00 33.42 H new ATOM 980 N GLU A 60 -5.627 -8.058 -7.350 1.00 54.32 N ATOM 981 CA GLU A 60 -6.374 -7.343 -8.351 1.00 13.12 C ATOM 982 C GLU A 60 -6.367 -5.837 -8.096 1.00 22.40 C ATOM 983 O GLU A 60 -6.411 -5.025 -9.041 1.00 52.53 O ATOM 984 CB GLU A 60 -7.776 -7.953 -8.489 1.00 42.30 C ATOM 985 CG GLU A 60 -8.757 -7.755 -7.332 1.00 40.31 C ATOM 986 CD GLU A 60 -9.555 -6.473 -7.459 1.00 53.21 C ATOM 987 OE1 GLU A 60 -10.490 -6.440 -8.291 1.00 15.11 O ATOM 988 OE2 GLU A 60 -9.288 -5.501 -6.740 1.00 3.53 O ATOM 0 H GLU A 60 -6.201 -8.575 -6.685 1.00 54.32 H new ATOM 0 HA GLU A 60 -5.886 -7.458 -9.319 1.00 13.12 H new ATOM 0 HB2 GLU A 60 -8.233 -7.542 -9.389 1.00 42.30 H new ATOM 0 HB3 GLU A 60 -7.661 -9.025 -8.651 1.00 42.30 H new ATOM 0 HG2 GLU A 60 -9.441 -8.602 -7.291 1.00 40.31 H new ATOM 0 HG3 GLU A 60 -8.207 -7.745 -6.391 1.00 40.31 H new ATOM 995 N TYR A 61 -6.296 -5.481 -6.827 1.00 63.03 N ATOM 996 CA TYR A 61 -6.246 -4.089 -6.390 1.00 74.24 C ATOM 997 C TYR A 61 -4.950 -3.448 -6.913 1.00 50.04 C ATOM 998 O TYR A 61 -4.979 -2.413 -7.576 1.00 40.13 O ATOM 999 CB TYR A 61 -6.278 -4.036 -4.850 1.00 32.52 C ATOM 1000 CG TYR A 61 -6.552 -2.678 -4.241 1.00 71.41 C ATOM 1001 CD1 TYR A 61 -5.566 -1.711 -4.144 1.00 74.03 C ATOM 1002 CD2 TYR A 61 -7.815 -2.373 -3.755 1.00 54.54 C ATOM 1003 CE1 TYR A 61 -5.833 -0.482 -3.582 1.00 60.21 C ATOM 1004 CE2 TYR A 61 -8.092 -1.150 -3.193 1.00 60.23 C ATOM 1005 CZ TYR A 61 -7.093 -0.202 -3.108 1.00 23.40 C ATOM 1006 OH TYR A 61 -7.351 1.041 -2.555 1.00 52.43 O ATOM 0 H TYR A 61 -6.271 -6.153 -6.060 1.00 63.03 H new ATOM 0 HA TYR A 61 -7.104 -3.542 -6.782 1.00 74.24 H new ATOM 0 HB2 TYR A 61 -7.040 -4.731 -4.498 1.00 32.52 H new ATOM 0 HB3 TYR A 61 -5.320 -4.395 -4.473 1.00 32.52 H new ATOM 0 HD1 TYR A 61 -4.574 -1.923 -4.514 1.00 74.03 H new ATOM 0 HD2 TYR A 61 -8.598 -3.114 -3.820 1.00 54.54 H new ATOM 0 HE1 TYR A 61 -5.053 0.262 -3.514 1.00 60.21 H new ATOM 0 HE2 TYR A 61 -9.082 -0.933 -2.821 1.00 60.23 H new ATOM 0 HH TYR A 61 -8.287 1.083 -2.268 1.00 52.43 H new ATOM 1016 N LEU A 62 -3.822 -4.088 -6.611 1.00 11.31 N ATOM 1017 CA LEU A 62 -2.498 -3.633 -7.084 1.00 2.02 C ATOM 1018 C LEU A 62 -2.443 -3.672 -8.598 1.00 12.11 C ATOM 1019 O LEU A 62 -1.921 -2.770 -9.239 1.00 31.01 O ATOM 1020 CB LEU A 62 -1.413 -4.567 -6.574 1.00 20.32 C ATOM 1021 CG LEU A 62 -1.377 -4.820 -5.085 1.00 44.35 C ATOM 1022 CD1 LEU A 62 -0.283 -5.814 -4.761 1.00 5.04 C ATOM 1023 CD2 LEU A 62 -1.194 -3.530 -4.300 1.00 52.03 C ATOM 0 H LEU A 62 -3.790 -4.931 -6.037 1.00 11.31 H new ATOM 0 HA LEU A 62 -2.342 -2.619 -6.717 1.00 2.02 H new ATOM 0 HB2 LEU A 62 -1.526 -5.526 -7.079 1.00 20.32 H new ATOM 0 HB3 LEU A 62 -0.447 -4.161 -6.873 1.00 20.32 H new ATOM 0 HG LEU A 62 -2.337 -5.240 -4.786 1.00 44.35 H new ATOM 0 HD11 LEU A 62 -0.261 -5.993 -3.686 1.00 5.04 H new ATOM 0 HD12 LEU A 62 -0.478 -6.752 -5.281 1.00 5.04 H new ATOM 0 HD13 LEU A 62 0.679 -5.414 -5.082 1.00 5.04 H new ATOM 0 HD21 LEU A 62 -1.173 -3.753 -3.233 1.00 52.03 H new ATOM 0 HD22 LEU A 62 -0.256 -3.057 -4.590 1.00 52.03 H new ATOM 0 HD23 LEU A 62 -2.022 -2.854 -4.513 1.00 52.03 H new ATOM 1035 N GLU A 63 -2.989 -4.740 -9.140 1.00 61.41 N ATOM 1036 CA GLU A 63 -3.026 -5.012 -10.577 1.00 52.11 C ATOM 1037 C GLU A 63 -3.620 -3.807 -11.351 1.00 71.05 C ATOM 1038 O GLU A 63 -3.015 -3.328 -12.317 1.00 70.53 O ATOM 1039 CB GLU A 63 -3.867 -6.280 -10.783 1.00 42.53 C ATOM 1040 CG GLU A 63 -3.420 -7.222 -11.885 1.00 73.42 C ATOM 1041 CD GLU A 63 -3.661 -6.740 -13.285 1.00 42.45 C ATOM 1042 OE1 GLU A 63 -4.816 -6.871 -13.773 1.00 32.32 O ATOM 1043 OE2 GLU A 63 -2.709 -6.287 -13.939 1.00 3.31 O ATOM 0 H GLU A 63 -3.435 -5.470 -8.584 1.00 61.41 H new ATOM 0 HA GLU A 63 -2.019 -5.165 -10.965 1.00 52.11 H new ATOM 0 HB2 GLU A 63 -3.881 -6.835 -9.845 1.00 42.53 H new ATOM 0 HB3 GLU A 63 -4.894 -5.978 -10.989 1.00 42.53 H new ATOM 0 HG2 GLU A 63 -2.354 -7.414 -11.764 1.00 73.42 H new ATOM 0 HG3 GLU A 63 -3.933 -8.175 -11.754 1.00 73.42 H new ATOM 1050 N LYS A 64 -4.772 -3.294 -10.912 1.00 41.52 N ATOM 1051 CA LYS A 64 -5.376 -2.164 -11.562 1.00 43.04 C ATOM 1052 C LYS A 64 -4.637 -0.872 -11.227 1.00 1.41 C ATOM 1053 O LYS A 64 -4.492 0.009 -12.063 1.00 35.11 O ATOM 1054 CB LYS A 64 -6.843 -2.053 -11.180 1.00 53.53 C ATOM 1055 CG LYS A 64 -7.143 -1.780 -9.711 1.00 53.12 C ATOM 1056 CD LYS A 64 -8.635 -1.598 -9.481 1.00 51.33 C ATOM 1057 CE LYS A 64 -8.936 -1.222 -8.037 1.00 33.24 C ATOM 1058 NZ LYS A 64 -10.378 -0.963 -7.824 1.00 32.25 N ATOM 0 H LYS A 64 -5.292 -3.653 -10.111 1.00 41.52 H new ATOM 0 HA LYS A 64 -5.306 -2.320 -12.639 1.00 43.04 H new ATOM 0 HB2 LYS A 64 -7.291 -1.256 -11.774 1.00 53.53 H new ATOM 0 HB3 LYS A 64 -7.341 -2.980 -11.464 1.00 53.53 H new ATOM 0 HG2 LYS A 64 -6.776 -2.606 -9.102 1.00 53.12 H new ATOM 0 HG3 LYS A 64 -6.610 -0.885 -9.388 1.00 53.12 H new ATOM 0 HD2 LYS A 64 -9.015 -0.823 -10.146 1.00 51.33 H new ATOM 0 HD3 LYS A 64 -9.158 -2.520 -9.734 1.00 51.33 H new ATOM 0 HE2 LYS A 64 -8.610 -2.026 -7.377 1.00 33.24 H new ATOM 0 HE3 LYS A 64 -8.364 -0.335 -7.766 1.00 33.24 H new ATOM 0 HZ1 LYS A 64 -10.542 -0.710 -6.829 1.00 32.25 H new ATOM 0 HZ2 LYS A 64 -10.684 -0.179 -8.435 1.00 32.25 H new ATOM 0 HZ3 LYS A 64 -10.923 -1.818 -8.058 1.00 32.25 H new ATOM 1072 N CYS A 65 -4.161 -0.819 -10.024 1.00 63.05 N ATOM 1073 CA CYS A 65 -3.452 0.343 -9.463 1.00 33.12 C ATOM 1074 C CYS A 65 -2.186 0.662 -10.260 1.00 51.12 C ATOM 1075 O CYS A 65 -1.839 1.829 -10.456 1.00 42.14 O ATOM 1076 CB CYS A 65 -3.095 0.061 -7.989 1.00 63.10 C ATOM 1077 SG CYS A 65 -2.285 1.435 -7.098 1.00 44.55 S ATOM 0 H CYS A 65 -4.245 -1.594 -9.366 1.00 63.05 H new ATOM 0 HA CYS A 65 -4.109 1.211 -9.524 1.00 33.12 H new ATOM 0 HB2 CYS A 65 -4.008 -0.205 -7.457 1.00 63.10 H new ATOM 0 HB3 CYS A 65 -2.439 -0.809 -7.952 1.00 63.10 H new ATOM 1082 N LEU A 66 -1.522 -0.394 -10.716 1.00 14.11 N ATOM 1083 CA LEU A 66 -0.298 -0.326 -11.468 1.00 72.42 C ATOM 1084 C LEU A 66 -0.482 0.521 -12.743 1.00 24.51 C ATOM 1085 O LEU A 66 0.299 1.444 -13.008 1.00 22.10 O ATOM 1086 CB LEU A 66 0.101 -1.789 -11.828 1.00 63.11 C ATOM 1087 CG LEU A 66 1.522 -2.071 -12.370 1.00 12.43 C ATOM 1088 CD1 LEU A 66 1.798 -1.405 -13.709 1.00 53.53 C ATOM 1089 CD2 LEU A 66 2.540 -1.661 -11.346 1.00 23.41 C ATOM 0 H LEU A 66 -1.842 -1.350 -10.561 1.00 14.11 H new ATOM 0 HA LEU A 66 0.486 0.153 -10.881 1.00 72.42 H new ATOM 0 HB2 LEU A 66 -0.035 -2.396 -10.933 1.00 63.11 H new ATOM 0 HB3 LEU A 66 -0.611 -2.150 -12.570 1.00 63.11 H new ATOM 0 HG LEU A 66 1.593 -3.143 -12.553 1.00 12.43 H new ATOM 0 HD11 LEU A 66 2.811 -1.643 -14.032 1.00 53.53 H new ATOM 0 HD12 LEU A 66 1.086 -1.769 -14.450 1.00 53.53 H new ATOM 0 HD13 LEU A 66 1.695 -0.325 -13.606 1.00 53.53 H new ATOM 0 HD21 LEU A 66 3.541 -1.860 -11.728 1.00 23.41 H new ATOM 0 HD22 LEU A 66 2.437 -0.596 -11.136 1.00 23.41 H new ATOM 0 HD23 LEU A 66 2.383 -2.229 -10.429 1.00 23.41 H new ATOM 1101 N ASN A 67 -1.511 0.207 -13.511 1.00 35.21 N ATOM 1102 CA ASN A 67 -1.709 0.845 -14.805 1.00 20.13 C ATOM 1103 C ASN A 67 -3.154 0.740 -15.220 1.00 35.31 C ATOM 1104 O ASN A 67 -3.846 1.729 -15.382 1.00 35.14 O ATOM 1105 CB ASN A 67 -0.831 0.143 -15.863 1.00 21.31 C ATOM 1106 CG ASN A 67 -0.806 0.858 -17.211 1.00 15.33 C ATOM 1107 OD1 ASN A 67 -1.755 1.530 -17.616 1.00 23.32 O ATOM 1108 ND2 ASN A 67 0.275 0.714 -17.913 1.00 0.32 N ATOM 0 H ASN A 67 -2.221 -0.483 -13.264 1.00 35.21 H new ATOM 0 HA ASN A 67 -1.432 1.896 -14.726 1.00 20.13 H new ATOM 0 HB2 ASN A 67 0.188 0.066 -15.484 1.00 21.31 H new ATOM 0 HB3 ASN A 67 -1.195 -0.874 -16.008 1.00 21.31 H new ATOM 0 HD21 ASN A 67 0.354 1.163 -18.825 1.00 0.32 H new ATOM 0 HD22 ASN A 67 1.046 0.151 -17.553 1.00 0.32 H new ATOM 1333 N GLU B 114 8.400 -1.631 13.601 1.00 62.12 N ATOM 1334 CA GLU B 114 8.388 -2.832 12.864 1.00 15.11 C ATOM 1335 C GLU B 114 8.988 -4.002 13.610 1.00 13.31 C ATOM 1336 O GLU B 114 10.192 -4.277 13.546 1.00 60.02 O ATOM 1337 CB GLU B 114 8.994 -2.629 11.461 1.00 40.20 C ATOM 1338 CG GLU B 114 10.341 -1.893 11.418 1.00 11.20 C ATOM 1339 CD GLU B 114 10.242 -0.400 11.775 1.00 43.10 C ATOM 1340 OE1 GLU B 114 9.910 0.412 10.900 1.00 1.10 O ATOM 1341 OE2 GLU B 114 10.432 -0.053 12.962 1.00 54.41 O ATOM 0 HA GLU B 114 7.343 -3.107 12.725 1.00 15.11 H new ATOM 0 HB2 GLU B 114 9.120 -3.606 10.995 1.00 40.20 H new ATOM 0 HB3 GLU B 114 8.279 -2.075 10.853 1.00 40.20 H new ATOM 0 HG2 GLU B 114 11.032 -2.377 12.108 1.00 11.20 H new ATOM 0 HG3 GLU B 114 10.767 -1.991 10.419 1.00 11.20 H new ATOM 1348 N GLU B 115 8.130 -4.642 14.356 1.00 24.21 N ATOM 1349 CA GLU B 115 8.449 -5.777 15.143 1.00 14.42 C ATOM 1350 C GLU B 115 7.156 -6.423 15.644 1.00 64.31 C ATOM 1351 O GLU B 115 6.456 -5.829 16.481 1.00 34.11 O ATOM 1352 CB GLU B 115 9.288 -5.357 16.362 1.00 11.23 C ATOM 1353 CG GLU B 115 9.439 -6.444 17.408 1.00 3.55 C ATOM 1354 CD GLU B 115 10.124 -5.967 18.656 1.00 65.53 C ATOM 1355 OE1 GLU B 115 9.622 -5.023 19.295 1.00 25.34 O ATOM 1356 OE2 GLU B 115 11.165 -6.523 19.023 1.00 0.44 O ATOM 0 H GLU B 115 7.151 -4.366 14.427 1.00 24.21 H new ATOM 0 HA GLU B 115 9.016 -6.480 14.533 1.00 14.42 H new ATOM 0 HB2 GLU B 115 10.278 -5.054 16.022 1.00 11.23 H new ATOM 0 HB3 GLU B 115 8.828 -4.483 16.824 1.00 11.23 H new ATOM 0 HG2 GLU B 115 8.453 -6.831 17.667 1.00 3.55 H new ATOM 0 HG3 GLU B 115 10.006 -7.273 16.983 1.00 3.55 H new ATOM 1363 N MET B 116 6.818 -7.592 15.102 1.00 25.11 N ATOM 1364 CA MET B 116 5.679 -8.412 15.578 1.00 4.41 C ATOM 1365 C MET B 116 4.290 -7.775 15.314 1.00 72.14 C ATOM 1366 O MET B 116 4.087 -6.563 15.433 1.00 13.54 O ATOM 1367 CB MET B 116 5.856 -8.769 17.078 1.00 35.35 C ATOM 1368 CG MET B 116 4.724 -9.590 17.688 1.00 74.33 C ATOM 1369 SD MET B 116 5.003 -9.960 19.435 1.00 22.01 S ATOM 1370 CE MET B 116 3.516 -10.891 19.824 1.00 10.25 C ATOM 0 H MET B 116 7.321 -8.008 14.318 1.00 25.11 H new ATOM 0 HA MET B 116 5.695 -9.327 14.986 1.00 4.41 H new ATOM 0 HB2 MET B 116 6.788 -9.321 17.196 1.00 35.35 H new ATOM 0 HB3 MET B 116 5.959 -7.844 17.645 1.00 35.35 H new ATOM 0 HG2 MET B 116 3.786 -9.046 17.580 1.00 74.33 H new ATOM 0 HG3 MET B 116 4.617 -10.523 17.135 1.00 74.33 H new ATOM 0 HE1 MET B 116 3.539 -11.192 20.871 1.00 10.25 H new ATOM 0 HE2 MET B 116 2.640 -10.268 19.644 1.00 10.25 H new ATOM 0 HE3 MET B 116 3.467 -11.778 19.193 1.00 10.25 H new ATOM 1380 N GLY B 117 3.351 -8.608 14.959 1.00 55.00 N ATOM 1381 CA GLY B 117 2.010 -8.164 14.718 1.00 13.42 C ATOM 1382 C GLY B 117 1.051 -9.289 14.924 1.00 64.10 C ATOM 1383 O GLY B 117 1.266 -10.132 15.804 1.00 3.13 O ATOM 0 H GLY B 117 3.495 -9.609 14.830 1.00 55.00 H new ATOM 0 HA2 GLY B 117 1.766 -7.340 15.389 1.00 13.42 H new ATOM 0 HA3 GLY B 117 1.922 -7.783 13.700 1.00 13.42 H new ATOM 1387 N SER B 118 0.041 -9.343 14.119 1.00 60.24 N ATOM 1388 CA SER B 118 -0.964 -10.357 14.212 1.00 15.23 C ATOM 1389 C SER B 118 -0.530 -11.648 13.495 1.00 2.42 C ATOM 1390 O SER B 118 0.651 -11.788 13.083 1.00 23.02 O ATOM 1391 CB SER B 118 -2.243 -9.793 13.631 1.00 31.22 C ATOM 1392 OG SER B 118 -1.985 -9.212 12.374 1.00 51.24 O ATOM 0 H SER B 118 -0.114 -8.674 13.365 1.00 60.24 H new ATOM 0 HA SER B 118 -1.123 -10.633 15.254 1.00 15.23 H new ATOM 0 HB2 SER B 118 -2.986 -10.584 13.530 1.00 31.22 H new ATOM 0 HB3 SER B 118 -2.661 -9.047 14.307 1.00 31.22 H new ATOM 0 HG SER B 118 -2.199 -9.855 11.666 1.00 51.24 H new ATOM 1398 N GLY B 119 -1.445 -12.588 13.389 1.00 44.22 N ATOM 1399 CA GLY B 119 -1.186 -13.834 12.733 1.00 71.34 C ATOM 1400 C GLY B 119 -2.371 -14.745 12.867 1.00 71.02 C ATOM 1401 O GLY B 119 -2.374 -15.659 13.707 1.00 3.33 O ATOM 0 H GLY B 119 -2.391 -12.501 13.760 1.00 44.22 H new ATOM 0 HA2 GLY B 119 -0.969 -13.660 11.679 1.00 71.34 H new ATOM 0 HA3 GLY B 119 -0.304 -14.306 13.167 1.00 71.34 H new ATOM 1405 N ASP B 120 -3.375 -14.509 12.060 1.00 2.14 N ATOM 1406 CA ASP B 120 -4.638 -15.226 12.163 1.00 74.35 C ATOM 1407 C ASP B 120 -5.306 -15.431 10.819 1.00 24.35 C ATOM 1408 O ASP B 120 -4.751 -15.129 9.778 1.00 3.34 O ATOM 1409 CB ASP B 120 -5.634 -14.426 12.984 1.00 25.25 C ATOM 1410 CG ASP B 120 -5.301 -14.223 14.439 1.00 23.34 C ATOM 1411 OD1 ASP B 120 -4.637 -13.221 14.778 1.00 62.53 O ATOM 1412 OD2 ASP B 120 -5.743 -15.045 15.289 1.00 14.30 O ATOM 0 H ASP B 120 -3.348 -13.817 11.311 1.00 2.14 H new ATOM 0 HA ASP B 120 -4.389 -16.186 12.616 1.00 74.35 H new ATOM 0 HB2 ASP B 120 -5.748 -13.446 12.521 1.00 25.25 H new ATOM 0 HB3 ASP B 120 -6.603 -14.922 12.922 1.00 25.25 H new ATOM 1441 N ASP B 122 -6.264 -18.068 9.075 1.00 63.33 N ATOM 1442 CA ASP B 122 -5.582 -18.994 8.182 1.00 43.51 C ATOM 1443 C ASP B 122 -4.497 -18.193 7.509 1.00 0.12 C ATOM 1444 O ASP B 122 -4.600 -17.742 6.359 1.00 54.01 O ATOM 1445 CB ASP B 122 -6.571 -19.625 7.208 1.00 12.11 C ATOM 1446 CG ASP B 122 -6.006 -20.783 6.430 1.00 41.40 C ATOM 1447 OD1 ASP B 122 -6.025 -21.924 6.961 1.00 5.34 O ATOM 1448 OD2 ASP B 122 -5.575 -20.600 5.280 1.00 53.51 O ATOM 0 HA ASP B 122 -5.137 -19.837 8.710 1.00 43.51 H new ATOM 0 HB2 ASP B 122 -7.446 -19.965 7.763 1.00 12.11 H new ATOM 0 HB3 ASP B 122 -6.914 -18.863 6.508 1.00 12.11 H new ATOM 1453 N SER B 123 -3.501 -17.966 8.292 1.00 63.21 N ATOM 1454 CA SER B 123 -2.538 -16.942 8.082 1.00 22.44 C ATOM 1455 C SER B 123 -1.327 -17.368 7.211 1.00 3.30 C ATOM 1456 O SER B 123 -0.165 -17.119 7.594 1.00 34.23 O ATOM 1457 CB SER B 123 -2.120 -16.506 9.494 1.00 64.33 C ATOM 1458 OG SER B 123 -1.386 -17.533 10.164 1.00 62.13 O ATOM 0 H SER B 123 -3.328 -18.514 9.135 1.00 63.21 H new ATOM 0 HA SER B 123 -2.969 -16.126 7.502 1.00 22.44 H new ATOM 0 HB2 SER B 123 -1.511 -15.604 9.432 1.00 64.33 H new ATOM 0 HB3 SER B 123 -3.007 -16.253 10.075 1.00 64.33 H new ATOM 0 HG SER B 123 -1.133 -17.224 11.059 1.00 62.13 H new ATOM 1464 N MET B 124 -1.595 -17.976 6.044 1.00 74.13 N ATOM 1465 CA MET B 124 -0.529 -18.334 5.088 1.00 35.42 C ATOM 1466 C MET B 124 -1.134 -18.892 3.797 1.00 74.54 C ATOM 1467 O MET B 124 -1.766 -19.953 3.813 1.00 43.31 O ATOM 1468 CB MET B 124 0.477 -19.356 5.709 1.00 32.31 C ATOM 1469 CG MET B 124 1.771 -19.594 4.900 1.00 72.53 C ATOM 1470 SD MET B 124 1.541 -20.424 3.310 1.00 41.33 S ATOM 1471 CE MET B 124 3.212 -20.398 2.667 1.00 61.14 C ATOM 0 H MET B 124 -2.535 -18.230 5.739 1.00 74.13 H new ATOM 0 HA MET B 124 0.025 -17.426 4.852 1.00 35.42 H new ATOM 0 HB2 MET B 124 0.751 -19.009 6.705 1.00 32.31 H new ATOM 0 HB3 MET B 124 -0.033 -20.311 5.833 1.00 32.31 H new ATOM 0 HG2 MET B 124 2.253 -18.632 4.724 1.00 72.53 H new ATOM 0 HG3 MET B 124 2.456 -20.187 5.506 1.00 72.53 H new ATOM 0 HE1 MET B 124 3.232 -20.876 1.688 1.00 61.14 H new ATOM 0 HE2 MET B 124 3.550 -19.366 2.574 1.00 61.14 H new ATOM 0 HE3 MET B 124 3.872 -20.936 3.347 1.00 61.14 H new ATOM 1481 N LYS B 125 -0.975 -18.163 2.701 1.00 65.41 N ATOM 1482 CA LYS B 125 -1.389 -18.618 1.374 1.00 33.24 C ATOM 1483 C LYS B 125 -0.357 -18.197 0.326 1.00 60.44 C ATOM 1484 O LYS B 125 0.795 -17.907 0.653 1.00 53.14 O ATOM 1485 CB LYS B 125 -2.777 -18.064 0.978 1.00 74.10 C ATOM 1486 CG LYS B 125 -3.950 -18.602 1.782 1.00 5.32 C ATOM 1487 CD LYS B 125 -5.276 -18.035 1.275 1.00 63.43 C ATOM 1488 CE LYS B 125 -5.582 -18.454 -0.160 1.00 23.33 C ATOM 1489 NZ LYS B 125 -5.705 -19.922 -0.296 1.00 70.40 N ATOM 0 H LYS B 125 -0.553 -17.234 2.704 1.00 65.41 H new ATOM 0 HA LYS B 125 -1.458 -19.705 1.413 1.00 33.24 H new ATOM 0 HB2 LYS B 125 -2.758 -16.979 1.078 1.00 74.10 H new ATOM 0 HB3 LYS B 125 -2.950 -18.284 -0.076 1.00 74.10 H new ATOM 0 HG2 LYS B 125 -3.969 -19.690 1.718 1.00 5.32 H new ATOM 0 HG3 LYS B 125 -3.821 -18.346 2.834 1.00 5.32 H new ATOM 0 HD2 LYS B 125 -6.083 -18.369 1.927 1.00 63.43 H new ATOM 0 HD3 LYS B 125 -5.248 -16.947 1.334 1.00 63.43 H new ATOM 0 HE2 LYS B 125 -6.509 -17.981 -0.486 1.00 23.33 H new ATOM 0 HE3 LYS B 125 -4.792 -18.094 -0.819 1.00 23.33 H new ATOM 0 HZ1 LYS B 125 -6.077 -20.153 -1.239 1.00 70.40 H new ATOM 0 HZ2 LYS B 125 -4.770 -20.361 -0.175 1.00 70.40 H new ATOM 0 HZ3 LYS B 125 -6.354 -20.285 0.431 1.00 70.40 H new ATOM 1503 N GLU B 126 -0.787 -18.156 -0.912 1.00 25.11 N ATOM 1504 CA GLU B 126 -0.013 -17.822 -2.034 1.00 63.52 C ATOM 1505 C GLU B 126 -0.936 -16.934 -2.861 1.00 20.44 C ATOM 1506 O GLU B 126 -2.132 -16.837 -2.521 1.00 64.33 O ATOM 1507 CB GLU B 126 0.314 -19.108 -2.821 1.00 40.24 C ATOM 1508 CG GLU B 126 -0.908 -19.766 -3.430 1.00 3.51 C ATOM 1509 CD GLU B 126 -0.579 -20.981 -4.230 1.00 15.11 C ATOM 1510 OE1 GLU B 126 -0.179 -20.838 -5.402 1.00 73.52 O ATOM 1511 OE2 GLU B 126 -0.740 -22.103 -3.714 1.00 52.30 O ATOM 0 H GLU B 126 -1.754 -18.373 -1.155 1.00 25.11 H new ATOM 0 HA GLU B 126 0.929 -17.335 -1.782 1.00 63.52 H new ATOM 0 HB2 GLU B 126 1.023 -18.870 -3.614 1.00 40.24 H new ATOM 0 HB3 GLU B 126 0.806 -19.817 -2.156 1.00 40.24 H new ATOM 0 HG2 GLU B 126 -1.601 -20.039 -2.634 1.00 3.51 H new ATOM 0 HG3 GLU B 126 -1.421 -19.046 -4.067 1.00 3.51 H new ATOM 1518 N PRO B 127 -0.436 -16.276 -3.906 1.00 30.12 N ATOM 1519 CA PRO B 127 -1.238 -15.437 -4.784 1.00 10.21 C ATOM 1520 C PRO B 127 -2.507 -16.105 -5.277 1.00 1.52 C ATOM 1521 O PRO B 127 -2.487 -17.097 -6.024 1.00 10.13 O ATOM 1522 CB PRO B 127 -0.307 -15.131 -5.951 1.00 14.10 C ATOM 1523 CG PRO B 127 0.826 -16.057 -5.765 1.00 41.34 C ATOM 1524 CD PRO B 127 0.945 -16.231 -4.303 1.00 32.12 C ATOM 0 HA PRO B 127 -1.591 -14.552 -4.255 1.00 10.21 H new ATOM 0 HB2 PRO B 127 -0.802 -15.295 -6.908 1.00 14.10 H new ATOM 0 HB3 PRO B 127 0.022 -14.092 -5.936 1.00 14.10 H new ATOM 0 HG2 PRO B 127 0.642 -17.010 -6.262 1.00 41.34 H new ATOM 0 HG3 PRO B 127 1.743 -15.648 -6.189 1.00 41.34 H new ATOM 0 HD2 PRO B 127 1.477 -17.145 -4.041 1.00 32.12 H new ATOM 0 HD3 PRO B 127 1.480 -15.405 -3.834 1.00 32.12 H new ATOM 1825 N ARG C 208 -14.705 12.369 -3.683 1.00 65.24 N ATOM 1826 CA ARG C 208 -13.587 13.283 -3.679 1.00 70.41 C ATOM 1827 C ARG C 208 -12.301 12.503 -3.734 1.00 73.01 C ATOM 1828 O ARG C 208 -12.309 11.310 -3.554 1.00 14.34 O ATOM 1829 CB ARG C 208 -13.616 14.186 -2.440 1.00 13.34 C ATOM 1830 CG ARG C 208 -14.802 15.161 -2.360 1.00 0.54 C ATOM 1831 CD ARG C 208 -14.754 16.249 -3.445 1.00 51.33 C ATOM 1832 NE ARG C 208 -14.911 15.734 -4.821 1.00 55.01 N ATOM 1833 CZ ARG C 208 -14.450 16.341 -5.927 1.00 3.42 C ATOM 1834 NH1 ARG C 208 -13.678 17.421 -5.828 1.00 65.04 N ATOM 1835 NH2 ARG C 208 -14.746 15.847 -7.124 1.00 12.40 N ATOM 0 HA ARG C 208 -13.657 13.925 -4.557 1.00 70.41 H new ATOM 0 HB2 ARG C 208 -13.627 13.554 -1.552 1.00 13.34 H new ATOM 0 HB3 ARG C 208 -12.691 14.762 -2.410 1.00 13.34 H new ATOM 0 HG2 ARG C 208 -15.733 14.602 -2.454 1.00 0.54 H new ATOM 0 HG3 ARG C 208 -14.812 15.634 -1.378 1.00 0.54 H new ATOM 0 HD2 ARG C 208 -15.540 16.978 -3.249 1.00 51.33 H new ATOM 0 HD3 ARG C 208 -13.804 16.778 -3.372 1.00 51.33 H new ATOM 0 HE ARG C 208 -15.407 14.851 -4.940 1.00 55.01 H new ATOM 0 HH11 ARG C 208 -13.434 17.791 -4.909 1.00 65.04 H new ATOM 0 HH12 ARG C 208 -13.330 17.878 -6.671 1.00 65.04 H new ATOM 0 HH21 ARG C 208 -15.322 15.009 -7.202 1.00 12.40 H new ATOM 0 HH22 ARG C 208 -14.397 16.306 -7.966 1.00 12.40 H new ATOM 1849 N CYS C 209 -11.225 13.163 -4.061 1.00 15.10 N ATOM 1850 CA CYS C 209 -9.913 12.527 -4.094 1.00 5.41 C ATOM 1851 C CYS C 209 -9.240 12.760 -2.752 1.00 64.13 C ATOM 1852 O CYS C 209 -9.543 13.738 -2.108 1.00 42.24 O ATOM 1853 CB CYS C 209 -9.086 13.158 -5.193 1.00 44.32 C ATOM 1854 SG CYS C 209 -9.871 13.069 -6.812 1.00 24.35 S ATOM 0 H CYS C 209 -11.219 14.151 -4.313 1.00 15.10 H new ATOM 0 HA CYS C 209 -10.008 11.458 -4.285 1.00 5.41 H new ATOM 0 HB2 CYS C 209 -8.899 14.203 -4.944 1.00 44.32 H new ATOM 0 HB3 CYS C 209 -8.116 12.663 -5.239 1.00 44.32 H new ATOM 1859 N PRO C 210 -8.298 11.893 -2.318 1.00 21.05 N ATOM 1860 CA PRO C 210 -7.663 12.012 -0.994 1.00 31.33 C ATOM 1861 C PRO C 210 -6.449 12.925 -1.049 1.00 52.15 C ATOM 1862 O PRO C 210 -5.860 13.287 -0.038 1.00 63.11 O ATOM 1863 CB PRO C 210 -7.230 10.585 -0.759 1.00 11.32 C ATOM 1864 CG PRO C 210 -6.774 10.138 -2.091 1.00 52.41 C ATOM 1865 CD PRO C 210 -7.745 10.730 -3.069 1.00 31.14 C ATOM 0 HA PRO C 210 -8.310 12.432 -0.224 1.00 31.33 H new ATOM 0 HB2 PRO C 210 -6.431 10.525 -0.020 1.00 11.32 H new ATOM 0 HB3 PRO C 210 -8.052 9.972 -0.390 1.00 11.32 H new ATOM 0 HG2 PRO C 210 -5.758 10.478 -2.292 1.00 52.41 H new ATOM 0 HG3 PRO C 210 -6.765 9.050 -2.157 1.00 52.41 H new ATOM 0 HD2 PRO C 210 -7.253 11.040 -3.991 1.00 31.14 H new ATOM 0 HD3 PRO C 210 -8.524 10.020 -3.347 1.00 31.14 H new ATOM 1873 N CYS C 211 -6.102 13.272 -2.245 1.00 40.45 N ATOM 1874 CA CYS C 211 -4.988 14.110 -2.538 1.00 63.42 C ATOM 1875 C CYS C 211 -5.370 14.998 -3.677 1.00 25.23 C ATOM 1876 O CYS C 211 -6.313 14.684 -4.410 1.00 22.51 O ATOM 1877 CB CYS C 211 -3.780 13.258 -2.931 1.00 40.15 C ATOM 1878 SG CYS C 211 -3.242 12.085 -1.649 1.00 3.25 S ATOM 0 H CYS C 211 -6.607 12.967 -3.077 1.00 40.45 H new ATOM 0 HA CYS C 211 -4.721 14.703 -1.663 1.00 63.42 H new ATOM 0 HB2 CYS C 211 -4.022 12.702 -3.837 1.00 40.15 H new ATOM 0 HB3 CYS C 211 -2.948 13.919 -3.175 1.00 40.15 H new ATOM 1883 N ARG C 212 -4.687 16.108 -3.829 1.00 32.34 N ATOM 1884 CA ARG C 212 -4.956 16.979 -4.938 1.00 72.22 C ATOM 1885 C ARG C 212 -4.100 16.546 -6.105 1.00 40.34 C ATOM 1886 O ARG C 212 -4.592 16.371 -7.215 1.00 41.33 O ATOM 1887 CB ARG C 212 -4.733 18.454 -4.565 1.00 12.21 C ATOM 1888 CG ARG C 212 -4.941 19.429 -5.718 1.00 14.43 C ATOM 1889 CD ARG C 212 -6.312 19.269 -6.355 1.00 63.33 C ATOM 1890 NE ARG C 212 -6.481 20.164 -7.493 1.00 42.41 N ATOM 1891 CZ ARG C 212 -7.074 19.839 -8.651 1.00 73.41 C ATOM 1892 NH1 ARG C 212 -7.533 18.598 -8.853 1.00 45.40 N ATOM 1893 NH2 ARG C 212 -7.192 20.749 -9.610 1.00 44.24 N ATOM 0 H ARG C 212 -3.947 16.424 -3.202 1.00 32.34 H new ATOM 0 HA ARG C 212 -6.006 16.902 -5.221 1.00 72.22 H new ATOM 0 HB2 ARG C 212 -5.411 18.718 -3.754 1.00 12.21 H new ATOM 0 HB3 ARG C 212 -3.719 18.571 -4.183 1.00 12.21 H new ATOM 0 HG2 ARG C 212 -4.826 20.450 -5.355 1.00 14.43 H new ATOM 0 HG3 ARG C 212 -4.170 19.270 -6.472 1.00 14.43 H new ATOM 0 HD2 ARG C 212 -6.445 18.237 -6.680 1.00 63.33 H new ATOM 0 HD3 ARG C 212 -7.085 19.472 -5.613 1.00 63.33 H new ATOM 0 HE ARG C 212 -6.119 21.113 -7.401 1.00 42.41 H new ATOM 0 HH11 ARG C 212 -7.433 17.892 -8.124 1.00 45.40 H new ATOM 0 HH12 ARG C 212 -7.983 18.358 -9.736 1.00 45.40 H new ATOM 0 HH21 ARG C 212 -6.832 21.692 -9.465 1.00 44.24 H new ATOM 0 HH22 ARG C 212 -7.643 20.505 -10.492 1.00 44.24 H new ATOM 1907 N PHE C 213 -2.835 16.358 -5.842 1.00 71.11 N ATOM 1908 CA PHE C 213 -1.921 15.845 -6.812 1.00 12.12 C ATOM 1909 C PHE C 213 -1.081 14.781 -6.144 1.00 41.42 C ATOM 1910 O PHE C 213 -1.019 14.728 -4.911 1.00 14.11 O ATOM 1911 CB PHE C 213 -1.013 16.944 -7.400 1.00 73.40 C ATOM 1912 CG PHE C 213 -1.731 18.055 -8.123 1.00 45.01 C ATOM 1913 CD1 PHE C 213 -2.230 17.861 -9.400 1.00 25.32 C ATOM 1914 CD2 PHE C 213 -1.903 19.289 -7.525 1.00 61.32 C ATOM 1915 CE1 PHE C 213 -2.888 18.874 -10.064 1.00 20.11 C ATOM 1916 CE2 PHE C 213 -2.558 20.304 -8.186 1.00 13.12 C ATOM 1917 CZ PHE C 213 -3.052 20.096 -9.458 1.00 23.21 C ATOM 0 H PHE C 213 -2.411 16.561 -4.937 1.00 71.11 H new ATOM 0 HA PHE C 213 -2.489 15.431 -7.645 1.00 12.12 H new ATOM 0 HB2 PHE C 213 -0.427 17.379 -6.591 1.00 73.40 H new ATOM 0 HB3 PHE C 213 -0.309 16.480 -8.090 1.00 73.40 H new ATOM 0 HD1 PHE C 213 -2.102 16.903 -9.882 1.00 25.32 H new ATOM 0 HD2 PHE C 213 -1.520 19.459 -6.530 1.00 61.32 H new ATOM 0 HE1 PHE C 213 -3.274 18.707 -11.059 1.00 20.11 H new ATOM 0 HE2 PHE C 213 -2.685 21.264 -7.708 1.00 13.12 H new ATOM 0 HZ PHE C 213 -3.566 20.892 -9.976 1.00 23.21 H new ATOM 1927 N PHE C 214 -0.477 13.936 -6.930 1.00 45.10 N ATOM 1928 CA PHE C 214 0.377 12.901 -6.416 1.00 71.04 C ATOM 1929 C PHE C 214 1.766 12.949 -7.028 1.00 73.24 C ATOM 1930 O PHE C 214 1.938 12.950 -8.257 1.00 53.11 O ATOM 1931 CB PHE C 214 -0.292 11.518 -6.445 1.00 73.34 C ATOM 1932 CG PHE C 214 -1.088 11.181 -7.686 1.00 61.22 C ATOM 1933 CD1 PHE C 214 -0.486 10.678 -8.807 1.00 21.04 C ATOM 1934 CD2 PHE C 214 -2.466 11.342 -7.692 1.00 11.35 C ATOM 1935 CE1 PHE C 214 -1.232 10.339 -9.919 1.00 64.34 C ATOM 1936 CE2 PHE C 214 -3.217 11.014 -8.800 1.00 31.04 C ATOM 1937 CZ PHE C 214 -2.598 10.508 -9.915 1.00 10.12 C ATOM 0 H PHE C 214 -0.562 13.944 -7.946 1.00 45.10 H new ATOM 0 HA PHE C 214 0.533 13.102 -5.356 1.00 71.04 H new ATOM 0 HB2 PHE C 214 0.483 10.761 -6.320 1.00 73.34 H new ATOM 0 HB3 PHE C 214 -0.955 11.441 -5.583 1.00 73.34 H new ATOM 0 HD1 PHE C 214 0.586 10.544 -8.823 1.00 21.04 H new ATOM 0 HD2 PHE C 214 -2.959 11.731 -6.813 1.00 11.35 H new ATOM 0 HE1 PHE C 214 -0.742 9.940 -10.795 1.00 64.34 H new ATOM 0 HE2 PHE C 214 -4.288 11.155 -8.791 1.00 31.04 H new ATOM 0 HZ PHE C 214 -3.180 10.244 -10.786 1.00 10.12 H new ATOM 1947 N GLU C 215 2.732 12.990 -6.149 1.00 31.13 N ATOM 1948 CA GLU C 215 4.122 13.248 -6.435 1.00 64.24 C ATOM 1949 C GLU C 215 4.784 12.185 -7.266 1.00 12.30 C ATOM 1950 O GLU C 215 4.645 10.979 -7.013 1.00 31.14 O ATOM 1951 CB GLU C 215 4.902 13.478 -5.123 1.00 52.42 C ATOM 1952 CG GLU C 215 4.603 14.805 -4.390 1.00 54.04 C ATOM 1953 CD GLU C 215 3.140 15.064 -4.059 1.00 5.40 C ATOM 1954 OE1 GLU C 215 2.435 15.684 -4.890 1.00 10.30 O ATOM 1955 OE2 GLU C 215 2.691 14.687 -2.965 1.00 74.10 O ATOM 0 H GLU C 215 2.561 12.835 -5.155 1.00 31.13 H new ATOM 0 HA GLU C 215 4.144 14.153 -7.043 1.00 64.24 H new ATOM 0 HB2 GLU C 215 4.687 12.653 -4.444 1.00 52.42 H new ATOM 0 HB3 GLU C 215 5.969 13.439 -5.344 1.00 52.42 H new ATOM 0 HG2 GLU C 215 5.174 14.822 -3.462 1.00 54.04 H new ATOM 0 HG3 GLU C 215 4.968 15.628 -5.005 1.00 54.04 H new ATOM 1962 N SER C 216 5.507 12.637 -8.262 1.00 2.11 N ATOM 1963 CA SER C 216 6.235 11.769 -9.109 1.00 35.33 C ATOM 1964 C SER C 216 7.747 11.859 -8.830 1.00 50.52 C ATOM 1965 O SER C 216 8.462 10.859 -8.881 1.00 23.31 O ATOM 1966 CB SER C 216 5.903 12.073 -10.555 1.00 34.42 C ATOM 1967 OG SER C 216 6.104 13.433 -10.833 1.00 3.33 O ATOM 0 H SER C 216 5.597 13.626 -8.496 1.00 2.11 H new ATOM 0 HA SER C 216 5.943 10.739 -8.903 1.00 35.33 H new ATOM 0 HB2 SER C 216 6.526 11.466 -11.212 1.00 34.42 H new ATOM 0 HB3 SER C 216 4.867 11.804 -10.760 1.00 34.42 H new ATOM 0 HG SER C 216 5.886 13.611 -11.772 1.00 3.33 H new ATOM 1973 N HIS C 217 8.249 13.034 -8.527 1.00 51.23 N ATOM 1974 CA HIS C 217 9.672 13.133 -8.218 1.00 61.12 C ATOM 1975 C HIS C 217 9.887 12.935 -6.742 1.00 4.22 C ATOM 1976 O HIS C 217 10.036 13.878 -5.984 1.00 40.33 O ATOM 1977 CB HIS C 217 10.323 14.434 -8.713 1.00 30.33 C ATOM 1978 CG HIS C 217 10.278 14.624 -10.198 1.00 24.10 C ATOM 1979 ND1 HIS C 217 11.386 14.919 -10.959 1.00 34.53 N ATOM 1980 CD2 HIS C 217 9.241 14.612 -11.053 1.00 72.10 C ATOM 1981 CE1 HIS C 217 11.021 15.082 -12.212 1.00 5.11 C ATOM 1982 NE2 HIS C 217 9.727 14.901 -12.293 1.00 51.44 N ATOM 0 H HIS C 217 7.725 13.908 -8.486 1.00 51.23 H new ATOM 0 HA HIS C 217 10.174 12.337 -8.768 1.00 61.12 H new ATOM 0 HB2 HIS C 217 9.826 15.279 -8.236 1.00 30.33 H new ATOM 0 HB3 HIS C 217 11.363 14.451 -8.388 1.00 30.33 H new ATOM 0 HD2 HIS C 217 8.210 14.410 -10.803 1.00 72.10 H new ATOM 0 HE1 HIS C 217 11.678 15.324 -13.035 1.00 5.11 H new ATOM 0 HE2 HIS C 217 9.172 14.966 -13.146 1.00 51.44 H new ATOM 1991 N VAL C 218 9.813 11.708 -6.344 1.00 4.12 N ATOM 1992 CA VAL C 218 9.951 11.304 -4.976 1.00 65.15 C ATOM 1993 C VAL C 218 10.651 9.954 -4.947 1.00 72.24 C ATOM 1994 O VAL C 218 10.474 9.145 -5.863 1.00 2.33 O ATOM 1995 CB VAL C 218 8.550 11.257 -4.266 1.00 13.24 C ATOM 1996 CG1 VAL C 218 7.572 10.393 -5.036 1.00 60.11 C ATOM 1997 CG2 VAL C 218 8.657 10.790 -2.810 1.00 4.41 C ATOM 0 H VAL C 218 9.649 10.929 -6.982 1.00 4.12 H new ATOM 0 HA VAL C 218 10.552 12.028 -4.425 1.00 65.15 H new ATOM 0 HB VAL C 218 8.168 12.278 -4.254 1.00 13.24 H new ATOM 0 HG11 VAL C 218 6.612 10.381 -4.519 1.00 60.11 H new ATOM 0 HG12 VAL C 218 7.439 10.799 -6.039 1.00 60.11 H new ATOM 0 HG13 VAL C 218 7.960 9.377 -5.105 1.00 60.11 H new ATOM 0 HG21 VAL C 218 7.665 10.773 -2.359 1.00 4.41 H new ATOM 0 HG22 VAL C 218 9.086 9.789 -2.780 1.00 4.41 H new ATOM 0 HG23 VAL C 218 9.296 11.476 -2.254 1.00 4.41 H new ATOM 2007 N ALA C 219 11.488 9.751 -3.970 1.00 41.10 N ATOM 2008 CA ALA C 219 12.244 8.526 -3.838 1.00 70.13 C ATOM 2009 C ALA C 219 11.796 7.778 -2.602 1.00 41.50 C ATOM 2010 O ALA C 219 11.572 8.394 -1.558 1.00 21.14 O ATOM 2011 CB ALA C 219 13.734 8.831 -3.768 1.00 24.53 C ATOM 0 H ALA C 219 11.671 10.433 -3.234 1.00 41.10 H new ATOM 0 HA ALA C 219 12.063 7.900 -4.712 1.00 70.13 H new ATOM 0 HB1 ALA C 219 14.292 7.900 -3.669 1.00 24.53 H new ATOM 0 HB2 ALA C 219 14.044 9.344 -4.679 1.00 24.53 H new ATOM 0 HB3 ALA C 219 13.935 9.468 -2.907 1.00 24.53 H new ATOM 2017 N ARG C 220 11.658 6.456 -2.700 1.00 75.33 N ATOM 2018 CA ARG C 220 11.232 5.653 -1.547 1.00 13.51 C ATOM 2019 C ARG C 220 12.245 5.676 -0.418 1.00 34.25 C ATOM 2020 O ARG C 220 11.938 5.357 0.707 1.00 72.41 O ATOM 2021 CB ARG C 220 10.765 4.225 -1.926 1.00 54.12 C ATOM 2022 CG ARG C 220 11.748 3.284 -2.653 1.00 14.41 C ATOM 2023 CD ARG C 220 12.881 2.810 -1.768 1.00 63.42 C ATOM 2024 NE ARG C 220 13.714 1.807 -2.439 1.00 11.53 N ATOM 2025 CZ ARG C 220 14.789 1.198 -1.912 1.00 52.30 C ATOM 2026 NH1 ARG C 220 15.273 1.572 -0.732 1.00 62.30 N ATOM 2027 NH2 ARG C 220 15.389 0.228 -2.589 1.00 75.42 N ATOM 0 H ARG C 220 11.831 5.922 -3.551 1.00 75.33 H new ATOM 0 HA ARG C 220 10.339 6.142 -1.158 1.00 13.51 H new ATOM 0 HB2 ARG C 220 10.451 3.727 -1.008 1.00 54.12 H new ATOM 0 HB3 ARG C 220 9.880 4.324 -2.554 1.00 54.12 H new ATOM 0 HG2 ARG C 220 11.202 2.419 -3.029 1.00 14.41 H new ATOM 0 HG3 ARG C 220 12.163 3.800 -3.519 1.00 14.41 H new ATOM 0 HD2 ARG C 220 13.498 3.661 -1.481 1.00 63.42 H new ATOM 0 HD3 ARG C 220 12.473 2.388 -0.850 1.00 63.42 H new ATOM 0 HE ARG C 220 13.454 1.549 -3.391 1.00 11.53 H new ATOM 0 HH11 ARG C 220 14.827 2.330 -0.215 1.00 62.30 H new ATOM 0 HH12 ARG C 220 16.090 1.101 -0.343 1.00 62.30 H new ATOM 0 HH21 ARG C 220 15.034 -0.051 -3.503 1.00 75.42 H new ATOM 0 HH22 ARG C 220 16.206 -0.239 -2.195 1.00 75.42 H new ATOM 2041 N ALA C 221 13.444 6.082 -0.735 1.00 24.14 N ATOM 2042 CA ALA C 221 14.505 6.251 0.249 1.00 4.34 C ATOM 2043 C ALA C 221 14.158 7.374 1.253 1.00 22.20 C ATOM 2044 O ALA C 221 14.836 7.543 2.267 1.00 33.21 O ATOM 2045 CB ALA C 221 15.816 6.561 -0.456 1.00 53.31 C ATOM 0 H ALA C 221 13.725 6.310 -1.689 1.00 24.14 H new ATOM 0 HA ALA C 221 14.608 5.321 0.808 1.00 4.34 H new ATOM 0 HB1 ALA C 221 16.606 6.687 0.284 1.00 53.31 H new ATOM 0 HB2 ALA C 221 16.072 5.740 -1.125 1.00 53.31 H new ATOM 0 HB3 ALA C 221 15.710 7.480 -1.033 1.00 53.31 H new ATOM 2051 N ASN C 222 13.111 8.140 0.949 1.00 51.30 N ATOM 2052 CA ASN C 222 12.690 9.249 1.787 1.00 73.53 C ATOM 2053 C ASN C 222 11.344 8.925 2.521 1.00 64.35 C ATOM 2054 O ASN C 222 10.811 9.749 3.268 1.00 32.10 O ATOM 2055 CB ASN C 222 12.518 10.506 0.908 1.00 44.05 C ATOM 2056 CG ASN C 222 12.265 11.771 1.706 1.00 14.31 C ATOM 2057 OD1 ASN C 222 12.757 11.931 2.817 1.00 2.35 O ATOM 2058 ND2 ASN C 222 11.499 12.669 1.158 1.00 14.24 N ATOM 0 H ASN C 222 12.536 8.006 0.117 1.00 51.30 H new ATOM 0 HA ASN C 222 13.452 9.424 2.546 1.00 73.53 H new ATOM 0 HB2 ASN C 222 13.414 10.641 0.302 1.00 44.05 H new ATOM 0 HB3 ASN C 222 11.688 10.348 0.220 1.00 44.05 H new ATOM 0 HD21 ASN C 222 11.293 13.536 1.655 1.00 14.24 H new ATOM 0 HD22 ASN C 222 11.105 12.506 0.232 1.00 14.24 H new ATOM 2065 N VAL C 223 10.818 7.717 2.333 1.00 65.21 N ATOM 2066 CA VAL C 223 9.507 7.364 2.923 1.00 71.14 C ATOM 2067 C VAL C 223 9.633 6.447 4.148 1.00 71.22 C ATOM 2068 O VAL C 223 10.627 5.761 4.318 1.00 1.41 O ATOM 2069 CB VAL C 223 8.569 6.661 1.911 1.00 62.43 C ATOM 2070 CG1 VAL C 223 8.446 7.467 0.625 1.00 3.42 C ATOM 2071 CG2 VAL C 223 9.008 5.213 1.647 1.00 43.22 C ATOM 0 H VAL C 223 11.259 6.974 1.791 1.00 65.21 H new ATOM 0 HA VAL C 223 9.081 8.321 3.222 1.00 71.14 H new ATOM 0 HB VAL C 223 7.575 6.611 2.356 1.00 62.43 H new ATOM 0 HG11 VAL C 223 7.781 6.949 -0.067 1.00 3.42 H new ATOM 0 HG12 VAL C 223 8.038 8.452 0.851 1.00 3.42 H new ATOM 0 HG13 VAL C 223 9.430 7.577 0.169 1.00 3.42 H new ATOM 0 HG21 VAL C 223 8.327 4.751 0.932 1.00 43.22 H new ATOM 0 HG22 VAL C 223 10.019 5.208 1.240 1.00 43.22 H new ATOM 0 HG23 VAL C 223 8.990 4.651 2.581 1.00 43.22 H new ATOM 2081 N LYS C 224 8.619 6.484 5.012 1.00 44.02 N ATOM 2082 CA LYS C 224 8.529 5.558 6.134 1.00 43.42 C ATOM 2083 C LYS C 224 7.892 4.265 5.613 1.00 61.01 C ATOM 2084 O LYS C 224 8.283 3.171 5.976 1.00 72.23 O ATOM 2085 CB LYS C 224 7.567 6.068 7.227 1.00 14.13 C ATOM 2086 CG LYS C 224 7.754 7.473 7.720 1.00 52.22 C ATOM 2087 CD LYS C 224 6.690 7.773 8.784 1.00 32.44 C ATOM 2088 CE LYS C 224 6.650 9.235 9.223 1.00 2.22 C ATOM 2089 NZ LYS C 224 7.878 9.684 9.914 1.00 63.23 N ATOM 0 H LYS C 224 7.847 7.149 4.954 1.00 44.02 H new ATOM 0 HA LYS C 224 9.531 5.433 6.545 1.00 43.42 H new ATOM 0 HB2 LYS C 224 6.549 5.979 6.847 1.00 14.13 H new ATOM 0 HB3 LYS C 224 7.647 5.399 8.083 1.00 14.13 H new ATOM 0 HG2 LYS C 224 8.752 7.595 8.140 1.00 52.22 H new ATOM 0 HG3 LYS C 224 7.668 8.177 6.892 1.00 52.22 H new ATOM 0 HD2 LYS C 224 5.711 7.494 8.394 1.00 32.44 H new ATOM 0 HD3 LYS C 224 6.876 7.147 9.657 1.00 32.44 H new ATOM 0 HE2 LYS C 224 6.486 9.863 8.347 1.00 2.22 H new ATOM 0 HE3 LYS C 224 5.797 9.383 9.885 1.00 2.22 H new ATOM 0 HZ1 LYS C 224 7.659 10.508 10.510 1.00 63.23 H new ATOM 0 HZ2 LYS C 224 8.243 8.913 10.509 1.00 63.23 H new ATOM 0 HZ3 LYS C 224 8.596 9.947 9.209 1.00 63.23 H new ATOM 2103 N HIS C 225 6.847 4.438 4.775 1.00 74.12 N ATOM 2104 CA HIS C 225 6.073 3.301 4.211 1.00 24.22 C ATOM 2105 C HIS C 225 5.070 3.786 3.170 1.00 13.34 C ATOM 2106 O HIS C 225 4.999 4.985 2.896 1.00 42.31 O ATOM 2107 CB HIS C 225 5.296 2.556 5.320 1.00 64.32 C ATOM 2108 CG HIS C 225 4.186 3.340 6.004 1.00 53.24 C ATOM 2109 ND1 HIS C 225 2.939 3.678 5.581 1.00 25.23 N flip ATOM 2110 CD2 HIS C 225 4.279 3.821 7.283 1.00 30.10 C flip ATOM 2111 CE1 HIS C 225 2.331 4.340 6.600 1.00 20.13 C flip ATOM 2112 NE2 HIS C 225 3.154 4.412 7.613 1.00 63.42 N flip ATOM 0 H HIS C 225 6.516 5.354 4.471 1.00 74.12 H new ATOM 0 HA HIS C 225 6.792 2.626 3.746 1.00 24.22 H new ATOM 0 HB2 HIS C 225 4.862 1.654 4.888 1.00 64.32 H new ATOM 0 HB3 HIS C 225 6.008 2.235 6.081 1.00 64.32 H new ATOM 0 HD2 HIS C 225 5.145 3.728 7.922 1.00 30.10 H new ATOM 0 HE1 HIS C 225 1.329 4.742 6.577 1.00 20.13 H new ATOM 0 HE2 HIS C 225 2.955 4.854 8.511 1.00 63.42 H new ATOM 2121 N LEU C 226 4.234 2.854 2.665 1.00 25.41 N ATOM 2122 CA LEU C 226 3.190 3.199 1.691 1.00 44.21 C ATOM 2123 C LEU C 226 1.800 2.926 2.295 1.00 44.34 C ATOM 2124 O LEU C 226 1.649 2.044 3.132 1.00 21.52 O ATOM 2125 CB LEU C 226 3.348 2.373 0.387 1.00 12.20 C ATOM 2126 CG LEU C 226 4.661 2.535 -0.407 1.00 70.33 C ATOM 2127 CD1 LEU C 226 4.643 1.662 -1.670 1.00 11.44 C ATOM 2128 CD2 LEU C 226 4.895 3.996 -0.774 1.00 43.31 C ATOM 0 H LEU C 226 4.265 1.866 2.916 1.00 25.41 H new ATOM 0 HA LEU C 226 3.291 4.257 1.450 1.00 44.21 H new ATOM 0 HB2 LEU C 226 3.237 1.319 0.642 1.00 12.20 H new ATOM 0 HB3 LEU C 226 2.521 2.629 -0.275 1.00 12.20 H new ATOM 0 HG LEU C 226 5.483 2.205 0.229 1.00 70.33 H new ATOM 0 HD11 LEU C 226 5.578 1.791 -2.215 1.00 11.44 H new ATOM 0 HD12 LEU C 226 4.530 0.615 -1.387 1.00 11.44 H new ATOM 0 HD13 LEU C 226 3.809 1.959 -2.305 1.00 11.44 H new ATOM 0 HD21 LEU C 226 5.826 4.086 -1.333 1.00 43.31 H new ATOM 0 HD22 LEU C 226 4.068 4.354 -1.387 1.00 43.31 H new ATOM 0 HD23 LEU C 226 4.959 4.594 0.135 1.00 43.31 H new ATOM 2140 N LYS C 227 0.828 3.718 1.916 1.00 5.12 N ATOM 2141 CA LYS C 227 -0.539 3.562 2.317 1.00 70.52 C ATOM 2142 C LYS C 227 -1.443 3.777 1.117 1.00 74.24 C ATOM 2143 O LYS C 227 -1.299 4.761 0.418 1.00 73.21 O ATOM 2144 CB LYS C 227 -0.862 4.517 3.457 1.00 74.01 C ATOM 2145 CG LYS C 227 -2.331 4.600 3.766 1.00 55.32 C ATOM 2146 CD LYS C 227 -2.588 5.024 5.194 1.00 53.41 C ATOM 2147 CE LYS C 227 -1.873 6.304 5.575 1.00 2.12 C ATOM 2148 NZ LYS C 227 -2.432 7.507 4.927 1.00 10.52 N ATOM 0 H LYS C 227 0.977 4.516 1.298 1.00 5.12 H new ATOM 0 HA LYS C 227 -0.707 2.551 2.687 1.00 70.52 H new ATOM 0 HB2 LYS C 227 -0.327 4.198 4.352 1.00 74.01 H new ATOM 0 HB3 LYS C 227 -0.494 5.511 3.204 1.00 74.01 H new ATOM 0 HG2 LYS C 227 -2.804 5.309 3.087 1.00 55.32 H new ATOM 0 HG3 LYS C 227 -2.794 3.630 3.587 1.00 55.32 H new ATOM 0 HD2 LYS C 227 -3.660 5.157 5.339 1.00 53.41 H new ATOM 0 HD3 LYS C 227 -2.272 4.226 5.866 1.00 53.41 H new ATOM 0 HE2 LYS C 227 -1.920 6.429 6.657 1.00 2.12 H new ATOM 0 HE3 LYS C 227 -0.819 6.215 5.310 1.00 2.12 H new ATOM 0 HZ1 LYS C 227 -1.656 8.106 4.580 1.00 10.52 H new ATOM 0 HZ2 LYS C 227 -3.034 7.223 4.128 1.00 10.52 H new ATOM 0 HZ3 LYS C 227 -3.000 8.040 5.616 1.00 10.52 H new ATOM 2162 N ILE C 228 -2.359 2.861 0.871 1.00 65.33 N ATOM 2163 CA ILE C 228 -3.156 2.933 -0.337 1.00 44.54 C ATOM 2164 C ILE C 228 -4.654 2.992 -0.033 1.00 63.13 C ATOM 2165 O ILE C 228 -5.184 2.207 0.822 1.00 2.44 O ATOM 2166 CB ILE C 228 -2.907 1.715 -1.263 1.00 63.50 C ATOM 2167 CG1 ILE C 228 -1.410 1.438 -1.425 1.00 62.41 C ATOM 2168 CG2 ILE C 228 -3.536 1.969 -2.631 1.00 12.53 C ATOM 2169 CD1 ILE C 228 -1.099 0.268 -2.339 1.00 71.41 C ATOM 0 H ILE C 228 -2.568 2.070 1.481 1.00 65.33 H new ATOM 0 HA ILE C 228 -2.847 3.850 -0.838 1.00 44.54 H new ATOM 0 HB ILE C 228 -3.367 0.840 -0.804 1.00 63.50 H new ATOM 0 HG12 ILE C 228 -0.925 2.332 -1.817 1.00 62.41 H new ATOM 0 HG13 ILE C 228 -0.977 1.245 -0.443 1.00 62.41 H new ATOM 0 HG21 ILE C 228 -3.358 1.110 -3.278 1.00 12.53 H new ATOM 0 HG22 ILE C 228 -4.609 2.120 -2.516 1.00 12.53 H new ATOM 0 HG23 ILE C 228 -3.090 2.858 -3.077 1.00 12.53 H new ATOM 0 HD11 ILE C 228 -0.019 0.134 -2.404 1.00 71.41 H new ATOM 0 HD12 ILE C 228 -1.554 -0.638 -1.938 1.00 71.41 H new ATOM 0 HD13 ILE C 228 -1.500 0.466 -3.333 1.00 71.41 H new ATOM 2181 N LEU C 229 -5.314 3.937 -0.713 1.00 44.05 N ATOM 2182 CA LEU C 229 -6.769 4.121 -0.706 1.00 72.22 C ATOM 2183 C LEU C 229 -7.196 4.700 -2.043 1.00 61.44 C ATOM 2184 O LEU C 229 -6.714 5.750 -2.445 1.00 12.52 O ATOM 2185 CB LEU C 229 -7.299 5.042 0.426 1.00 53.13 C ATOM 2186 CG LEU C 229 -7.046 4.606 1.854 1.00 43.51 C ATOM 2187 CD1 LEU C 229 -5.683 5.057 2.372 1.00 42.42 C ATOM 2188 CD2 LEU C 229 -8.163 5.040 2.749 1.00 70.33 C ATOM 0 H LEU C 229 -4.834 4.617 -1.302 1.00 44.05 H new ATOM 0 HA LEU C 229 -7.198 3.135 -0.525 1.00 72.22 H new ATOM 0 HB2 LEU C 229 -6.857 6.029 0.292 1.00 53.13 H new ATOM 0 HB3 LEU C 229 -8.375 5.154 0.293 1.00 53.13 H new ATOM 0 HG LEU C 229 -7.020 3.516 1.860 1.00 43.51 H new ATOM 0 HD11 LEU C 229 -5.554 4.718 3.400 1.00 42.42 H new ATOM 0 HD12 LEU C 229 -4.897 4.631 1.748 1.00 42.42 H new ATOM 0 HD13 LEU C 229 -5.623 6.145 2.339 1.00 42.42 H new ATOM 0 HD21 LEU C 229 -7.959 4.715 3.769 1.00 70.33 H new ATOM 0 HD22 LEU C 229 -8.248 6.126 2.724 1.00 70.33 H new ATOM 0 HD23 LEU C 229 -9.097 4.595 2.407 1.00 70.33 H new ATOM 2200 N ASN C 230 -8.080 4.027 -2.727 1.00 33.13 N ATOM 2201 CA ASN C 230 -8.517 4.487 -4.040 1.00 34.01 C ATOM 2202 C ASN C 230 -9.914 5.116 -3.940 1.00 60.32 C ATOM 2203 O ASN C 230 -10.919 4.408 -3.807 1.00 14.32 O ATOM 2204 CB ASN C 230 -8.473 3.291 -5.047 1.00 14.53 C ATOM 2205 CG ASN C 230 -8.791 3.585 -6.538 1.00 14.11 C ATOM 2206 OD1 ASN C 230 -9.642 4.538 -6.843 1.00 14.34 O flip ATOM 2207 ND2 ASN C 230 -8.255 2.908 -7.413 1.00 1.32 N flip ATOM 0 H ASN C 230 -8.517 3.162 -2.410 1.00 33.13 H new ATOM 0 HA ASN C 230 -7.845 5.261 -4.411 1.00 34.01 H new ATOM 0 HB2 ASN C 230 -7.478 2.849 -4.998 1.00 14.53 H new ATOM 0 HB3 ASN C 230 -9.175 2.534 -4.698 1.00 14.53 H new ATOM 0 HD21 ASN C 230 -7.597 2.172 -7.157 1.00 1.32 H new ATOM 0 HD22 ASN C 230 -8.469 3.082 -8.395 1.00 1.32 H new ATOM 2214 N THR C 231 -9.945 6.449 -3.985 1.00 35.54 N ATOM 2215 CA THR C 231 -11.188 7.240 -3.959 1.00 12.32 C ATOM 2216 C THR C 231 -11.964 7.068 -5.276 1.00 13.51 C ATOM 2217 O THR C 231 -11.397 6.619 -6.252 1.00 44.32 O ATOM 2218 CB THR C 231 -10.866 8.736 -3.773 1.00 11.20 C ATOM 2219 OG1 THR C 231 -9.804 9.097 -4.688 1.00 50.02 O ATOM 2220 CG2 THR C 231 -10.495 9.091 -2.321 1.00 53.21 C ATOM 0 H THR C 231 -9.102 7.021 -4.041 1.00 35.54 H new ATOM 0 HA THR C 231 -11.794 6.884 -3.126 1.00 12.32 H new ATOM 0 HB THR C 231 -11.764 9.312 -3.996 1.00 11.20 H new ATOM 0 HG1 THR C 231 -10.174 9.623 -5.427 1.00 50.02 H new ATOM 0 HG21 THR C 231 -10.279 10.157 -2.251 1.00 53.21 H new ATOM 0 HG22 THR C 231 -11.328 8.846 -1.662 1.00 53.21 H new ATOM 0 HG23 THR C 231 -9.615 8.522 -2.021 1.00 53.21 H new ATOM 2228 N PRO C 232 -13.255 7.409 -5.323 1.00 2.41 N ATOM 2229 CA PRO C 232 -14.051 7.266 -6.544 1.00 45.11 C ATOM 2230 C PRO C 232 -13.743 8.343 -7.612 1.00 61.41 C ATOM 2231 O PRO C 232 -13.925 8.108 -8.809 1.00 32.35 O ATOM 2232 CB PRO C 232 -15.506 7.414 -6.049 1.00 32.21 C ATOM 2233 CG PRO C 232 -15.424 7.384 -4.554 1.00 54.43 C ATOM 2234 CD PRO C 232 -14.071 7.918 -4.209 1.00 5.53 C ATOM 0 HA PRO C 232 -13.838 6.318 -7.039 1.00 45.11 H new ATOM 0 HB2 PRO C 232 -15.947 8.347 -6.399 1.00 32.21 H new ATOM 0 HB3 PRO C 232 -16.133 6.605 -6.424 1.00 32.21 H new ATOM 0 HG2 PRO C 232 -16.210 7.993 -4.107 1.00 54.43 H new ATOM 0 HG3 PRO C 232 -15.552 6.370 -4.176 1.00 54.43 H new ATOM 0 HD2 PRO C 232 -14.061 9.007 -4.159 1.00 5.53 H new ATOM 0 HD3 PRO C 232 -13.720 7.552 -3.244 1.00 5.53 H new ATOM 2242 N ASN C 233 -13.268 9.510 -7.188 1.00 3.13 N ATOM 2243 CA ASN C 233 -13.055 10.626 -8.136 1.00 64.23 C ATOM 2244 C ASN C 233 -11.673 10.566 -8.793 1.00 3.23 C ATOM 2245 O ASN C 233 -11.468 11.081 -9.888 1.00 24.25 O ATOM 2246 CB ASN C 233 -13.258 11.976 -7.437 1.00 52.23 C ATOM 2247 CG ASN C 233 -13.273 13.167 -8.399 1.00 73.00 C ATOM 2248 OD1 ASN C 233 -14.313 13.526 -8.920 1.00 51.14 O ATOM 2249 ND2 ASN C 233 -12.149 13.795 -8.613 1.00 63.04 N ATOM 0 H ASN C 233 -13.025 9.717 -6.219 1.00 3.13 H new ATOM 0 HA ASN C 233 -13.797 10.523 -8.927 1.00 64.23 H new ATOM 0 HB2 ASN C 233 -14.198 11.953 -6.886 1.00 52.23 H new ATOM 0 HB3 ASN C 233 -12.463 12.120 -6.705 1.00 52.23 H new ATOM 0 HD21 ASN C 233 -12.128 14.607 -9.229 1.00 63.04 H new ATOM 0 HD22 ASN C 233 -11.292 13.473 -8.164 1.00 63.04 H new ATOM 2256 N CYS C 234 -10.752 9.921 -8.140 1.00 63.25 N ATOM 2257 CA CYS C 234 -9.385 9.795 -8.633 1.00 1.40 C ATOM 2258 C CYS C 234 -8.982 8.360 -8.703 1.00 30.44 C ATOM 2259 O CYS C 234 -9.631 7.511 -8.105 1.00 25.22 O ATOM 2260 CB CYS C 234 -8.380 10.591 -7.774 1.00 14.42 C ATOM 2261 SG CYS C 234 -8.412 12.404 -8.027 1.00 62.42 S ATOM 0 H CYS C 234 -10.914 9.460 -7.245 1.00 63.25 H new ATOM 0 HA CYS C 234 -9.366 10.221 -9.636 1.00 1.40 H new ATOM 0 HB2 CYS C 234 -8.578 10.382 -6.723 1.00 14.42 H new ATOM 0 HB3 CYS C 234 -7.375 10.227 -7.987 1.00 14.42 H new ATOM 2266 N ALA C 235 -7.945 8.083 -9.470 1.00 23.02 N ATOM 2267 CA ALA C 235 -7.405 6.744 -9.618 1.00 22.13 C ATOM 2268 C ALA C 235 -6.805 6.245 -8.298 1.00 70.11 C ATOM 2269 O ALA C 235 -7.024 6.841 -7.224 1.00 74.11 O ATOM 2270 CB ALA C 235 -6.339 6.751 -10.706 1.00 23.23 C ATOM 0 H ALA C 235 -7.448 8.788 -10.014 1.00 23.02 H new ATOM 0 HA ALA C 235 -8.213 6.068 -9.897 1.00 22.13 H new ATOM 0 HB1 ALA C 235 -5.930 5.747 -10.821 1.00 23.23 H new ATOM 0 HB2 ALA C 235 -6.783 7.072 -11.648 1.00 23.23 H new ATOM 0 HB3 ALA C 235 -5.540 7.439 -10.428 1.00 23.23 H new ATOM 2276 N CYS C 236 -6.060 5.152 -8.379 1.00 63.42 N ATOM 2277 CA CYS C 236 -5.403 4.582 -7.228 1.00 43.02 C ATOM 2278 C CYS C 236 -4.518 5.634 -6.586 1.00 3.13 C ATOM 2279 O CYS C 236 -4.018 6.539 -7.265 1.00 24.34 O ATOM 2280 CB CYS C 236 -4.579 3.367 -7.639 1.00 22.43 C ATOM 2281 SG CYS C 236 -3.825 2.455 -6.247 1.00 64.11 S ATOM 0 H CYS C 236 -5.899 4.641 -9.247 1.00 63.42 H new ATOM 0 HA CYS C 236 -6.152 4.255 -6.506 1.00 43.02 H new ATOM 0 HB2 CYS C 236 -5.217 2.685 -8.201 1.00 22.43 H new ATOM 0 HB3 CYS C 236 -3.788 3.692 -8.314 1.00 22.43 H new ATOM 2286 N GLN C 237 -4.338 5.542 -5.317 1.00 32.10 N ATOM 2287 CA GLN C 237 -3.619 6.541 -4.624 1.00 21.22 C ATOM 2288 C GLN C 237 -2.778 5.902 -3.569 1.00 52.24 C ATOM 2289 O GLN C 237 -3.305 5.262 -2.646 1.00 25.24 O ATOM 2290 CB GLN C 237 -4.587 7.489 -3.953 1.00 1.32 C ATOM 2291 CG GLN C 237 -3.942 8.753 -3.447 1.00 70.30 C ATOM 2292 CD GLN C 237 -3.516 9.672 -4.574 1.00 51.34 C ATOM 2293 OE1 GLN C 237 -2.565 10.413 -4.453 1.00 62.24 O ATOM 2294 NE2 GLN C 237 -4.236 9.627 -5.681 1.00 21.32 N ATOM 0 H GLN C 237 -4.683 4.777 -4.737 1.00 32.10 H new ATOM 0 HA GLN C 237 -2.992 7.085 -5.330 1.00 21.22 H new ATOM 0 HB2 GLN C 237 -5.375 7.751 -4.660 1.00 1.32 H new ATOM 0 HB3 GLN C 237 -5.065 6.976 -3.119 1.00 1.32 H new ATOM 0 HG2 GLN C 237 -4.640 9.279 -2.796 1.00 70.30 H new ATOM 0 HG3 GLN C 237 -3.073 8.497 -2.841 1.00 70.30 H new ATOM 0 HE21 GLN C 237 -5.030 8.990 -5.747 1.00 21.32 H new ATOM 0 HE22 GLN C 237 -3.998 10.229 -6.469 1.00 21.32 H new ATOM 2303 N ILE C 238 -1.505 6.036 -3.698 1.00 4.32 N ATOM 2304 CA ILE C 238 -0.616 5.545 -2.715 1.00 23.04 C ATOM 2305 C ILE C 238 0.016 6.733 -2.071 1.00 62.55 C ATOM 2306 O ILE C 238 0.619 7.542 -2.732 1.00 52.13 O ATOM 2307 CB ILE C 238 0.483 4.679 -3.332 1.00 23.25 C ATOM 2308 CG1 ILE C 238 -0.130 3.579 -4.202 1.00 62.32 C ATOM 2309 CG2 ILE C 238 1.377 4.090 -2.236 1.00 42.41 C ATOM 2310 CD1 ILE C 238 0.877 2.687 -4.869 1.00 45.13 C ATOM 0 H ILE C 238 -1.053 6.491 -4.491 1.00 4.32 H new ATOM 0 HA ILE C 238 -1.164 4.928 -2.003 1.00 23.04 H new ATOM 0 HB ILE C 238 1.106 5.303 -3.972 1.00 23.25 H new ATOM 0 HG12 ILE C 238 -0.787 2.967 -3.584 1.00 62.32 H new ATOM 0 HG13 ILE C 238 -0.752 4.042 -4.968 1.00 62.32 H new ATOM 0 HG21 ILE C 238 2.154 3.476 -2.691 1.00 42.41 H new ATOM 0 HG22 ILE C 238 1.839 4.899 -1.669 1.00 42.41 H new ATOM 0 HG23 ILE C 238 0.775 3.476 -1.567 1.00 42.41 H new ATOM 0 HD11 ILE C 238 0.359 1.936 -5.466 1.00 45.13 H new ATOM 0 HD12 ILE C 238 1.520 3.284 -5.516 1.00 45.13 H new ATOM 0 HD13 ILE C 238 1.484 2.193 -4.111 1.00 45.13 H new ATOM 2322 N VAL C 239 -0.141 6.846 -0.828 1.00 73.21 N ATOM 2323 CA VAL C 239 0.398 7.952 -0.100 1.00 15.40 C ATOM 2324 C VAL C 239 1.522 7.466 0.774 1.00 74.25 C ATOM 2325 O VAL C 239 1.479 6.342 1.298 1.00 31.02 O ATOM 2326 CB VAL C 239 -0.685 8.689 0.743 1.00 4.23 C ATOM 2327 CG1 VAL C 239 -1.768 9.251 -0.157 1.00 31.40 C ATOM 2328 CG2 VAL C 239 -1.301 7.770 1.777 1.00 4.51 C ATOM 0 H VAL C 239 -0.652 6.174 -0.256 1.00 73.21 H new ATOM 0 HA VAL C 239 0.778 8.681 -0.816 1.00 15.40 H new ATOM 0 HB VAL C 239 -0.193 9.509 1.266 1.00 4.23 H new ATOM 0 HG11 VAL C 239 -2.516 9.762 0.449 1.00 31.40 H new ATOM 0 HG12 VAL C 239 -1.326 9.957 -0.860 1.00 31.40 H new ATOM 0 HG13 VAL C 239 -2.241 8.438 -0.708 1.00 31.40 H new ATOM 0 HG21 VAL C 239 -2.052 8.316 2.348 1.00 4.51 H new ATOM 0 HG22 VAL C 239 -1.770 6.922 1.277 1.00 4.51 H new ATOM 0 HG23 VAL C 239 -0.525 7.409 2.452 1.00 4.51 H new ATOM 2338 N ALA C 240 2.522 8.266 0.921 1.00 52.13 N ATOM 2339 CA ALA C 240 3.660 7.880 1.678 1.00 3.33 C ATOM 2340 C ALA C 240 3.996 8.923 2.684 1.00 32.33 C ATOM 2341 O ALA C 240 3.888 10.115 2.424 1.00 70.42 O ATOM 2342 CB ALA C 240 4.838 7.644 0.766 1.00 60.12 C ATOM 0 H ALA C 240 2.573 9.203 0.521 1.00 52.13 H new ATOM 0 HA ALA C 240 3.427 6.953 2.202 1.00 3.33 H new ATOM 0 HB1 ALA C 240 5.704 7.349 1.359 1.00 60.12 H new ATOM 0 HB2 ALA C 240 4.596 6.852 0.057 1.00 60.12 H new ATOM 0 HB3 ALA C 240 5.066 8.561 0.222 1.00 60.12 H new ATOM 2348 N ARG C 241 4.390 8.492 3.828 1.00 21.31 N ATOM 2349 CA ARG C 241 4.800 9.403 4.830 1.00 74.20 C ATOM 2350 C ARG C 241 6.282 9.507 4.804 1.00 41.31 C ATOM 2351 O ARG C 241 6.952 8.498 4.787 1.00 32.50 O ATOM 2352 CB ARG C 241 4.313 9.016 6.226 1.00 74.20 C ATOM 2353 CG ARG C 241 2.811 9.045 6.404 1.00 44.02 C ATOM 2354 CD ARG C 241 2.477 9.112 7.868 1.00 11.52 C ATOM 2355 NE ARG C 241 1.066 9.427 8.111 1.00 13.15 N ATOM 2356 CZ ARG C 241 0.644 10.325 9.022 1.00 10.51 C ATOM 2357 NH1 ARG C 241 1.521 11.004 9.757 1.00 61.02 N ATOM 2358 NH2 ARG C 241 -0.650 10.557 9.174 1.00 31.20 N ATOM 0 H ARG C 241 4.437 7.508 4.093 1.00 21.31 H new ATOM 0 HA ARG C 241 4.346 10.369 4.611 1.00 74.20 H new ATOM 0 HB2 ARG C 241 4.673 8.013 6.456 1.00 74.20 H new ATOM 0 HB3 ARG C 241 4.764 9.691 6.953 1.00 74.20 H new ATOM 0 HG2 ARG C 241 2.390 9.906 5.885 1.00 44.02 H new ATOM 0 HG3 ARG C 241 2.365 8.155 5.959 1.00 44.02 H new ATOM 0 HD2 ARG C 241 2.718 8.157 8.336 1.00 11.52 H new ATOM 0 HD3 ARG C 241 3.101 9.867 8.345 1.00 11.52 H new ATOM 0 HE ARG C 241 0.363 8.937 7.558 1.00 13.15 H new ATOM 0 HH11 ARG C 241 2.521 10.846 9.633 1.00 61.02 H new ATOM 0 HH12 ARG C 241 1.193 11.682 10.445 1.00 61.02 H new ATOM 0 HH21 ARG C 241 -1.329 10.056 8.601 1.00 31.20 H new ATOM 0 HH22 ARG C 241 -0.969 11.237 9.864 1.00 31.20 H new ATOM 2372 N LEU C 242 6.785 10.712 4.758 1.00 63.03 N ATOM 2373 CA LEU C 242 8.231 10.943 4.739 1.00 13.51 C ATOM 2374 C LEU C 242 8.858 10.578 6.035 1.00 43.43 C ATOM 2375 O LEU C 242 8.222 10.647 7.084 1.00 14.32 O ATOM 2376 CB LEU C 242 8.618 12.381 4.332 1.00 21.31 C ATOM 2377 CG LEU C 242 8.708 12.690 2.846 1.00 23.13 C ATOM 2378 CD1 LEU C 242 7.436 12.337 2.128 1.00 21.31 C ATOM 2379 CD2 LEU C 242 9.043 14.155 2.659 1.00 12.45 C ATOM 0 H LEU C 242 6.223 11.563 4.732 1.00 63.03 H new ATOM 0 HA LEU C 242 8.623 10.285 3.964 1.00 13.51 H new ATOM 0 HB2 LEU C 242 7.891 13.063 4.774 1.00 21.31 H new ATOM 0 HB3 LEU C 242 9.584 12.609 4.782 1.00 21.31 H new ATOM 0 HG LEU C 242 9.499 12.079 2.412 1.00 23.13 H new ATOM 0 HD11 LEU C 242 7.539 12.572 1.069 1.00 21.31 H new ATOM 0 HD12 LEU C 242 7.235 11.272 2.246 1.00 21.31 H new ATOM 0 HD13 LEU C 242 6.610 12.910 2.548 1.00 21.31 H new ATOM 0 HD21 LEU C 242 9.108 14.380 1.595 1.00 12.45 H new ATOM 0 HD22 LEU C 242 8.263 14.767 3.112 1.00 12.45 H new ATOM 0 HD23 LEU C 242 9.999 14.373 3.135 1.00 12.45 H new ATOM 2391 N LYS C 243 10.086 10.195 5.955 1.00 3.42 N ATOM 2392 CA LYS C 243 10.867 9.747 7.101 1.00 61.34 C ATOM 2393 C LYS C 243 10.894 10.746 8.236 1.00 32.14 C ATOM 2394 O LYS C 243 10.374 10.453 9.315 1.00 0.11 O ATOM 2395 CB LYS C 243 12.250 9.375 6.650 1.00 11.25 C ATOM 2396 CG LYS C 243 12.282 8.067 5.903 1.00 54.32 C ATOM 2397 CD LYS C 243 13.512 7.936 5.048 1.00 32.44 C ATOM 2398 CE LYS C 243 14.798 8.138 5.809 1.00 23.22 C ATOM 2399 NZ LYS C 243 15.967 8.005 4.931 1.00 61.53 N ATOM 0 H LYS C 243 10.605 10.177 5.077 1.00 3.42 H new ATOM 0 HA LYS C 243 10.374 8.866 7.512 1.00 61.34 H new ATOM 0 HB2 LYS C 243 12.645 10.165 6.010 1.00 11.25 H new ATOM 0 HB3 LYS C 243 12.906 9.310 7.518 1.00 11.25 H new ATOM 0 HG2 LYS C 243 12.246 7.242 6.615 1.00 54.32 H new ATOM 0 HG3 LYS C 243 11.394 7.986 5.276 1.00 54.32 H new ATOM 0 HD2 LYS C 243 13.522 6.947 4.589 1.00 32.44 H new ATOM 0 HD3 LYS C 243 13.461 8.663 4.238 1.00 32.44 H new ATOM 0 HE2 LYS C 243 14.798 9.126 6.270 1.00 23.22 H new ATOM 0 HE3 LYS C 243 14.863 7.409 6.617 1.00 23.22 H new ATOM 0 HZ1 LYS C 243 16.562 7.219 5.262 1.00 61.53 H new ATOM 0 HZ2 LYS C 243 15.651 7.815 3.959 1.00 61.53 H new ATOM 0 HZ3 LYS C 243 16.517 8.887 4.950 1.00 61.53 H new ATOM 2455 N ARG C 247 6.602 16.200 5.813 1.00 64.23 N ATOM 2456 CA ARG C 247 5.399 15.546 6.269 1.00 23.13 C ATOM 2457 C ARG C 247 5.113 14.434 5.252 1.00 75.14 C ATOM 2458 O ARG C 247 6.035 13.978 4.599 1.00 33.41 O ATOM 2459 CB ARG C 247 4.208 16.561 6.362 1.00 11.44 C ATOM 2460 CG ARG C 247 3.530 16.945 5.051 1.00 74.32 C ATOM 2461 CD ARG C 247 4.339 17.738 4.076 1.00 3.33 C ATOM 2462 NE ARG C 247 3.584 17.832 2.818 1.00 45.44 N ATOM 2463 CZ ARG C 247 3.922 18.525 1.739 1.00 12.04 C ATOM 2464 NH1 ARG C 247 4.966 19.340 1.766 1.00 51.20 N ATOM 2465 NH2 ARG C 247 3.188 18.420 0.640 1.00 2.41 N ATOM 0 HA ARG C 247 5.522 15.136 7.272 1.00 23.13 H new ATOM 0 HB2 ARG C 247 3.452 16.139 7.025 1.00 11.44 H new ATOM 0 HB3 ARG C 247 4.574 17.472 6.835 1.00 11.44 H new ATOM 0 HG2 ARG C 247 3.206 16.029 4.556 1.00 74.32 H new ATOM 0 HG3 ARG C 247 2.632 17.515 5.288 1.00 74.32 H new ATOM 0 HD2 ARG C 247 4.542 18.733 4.472 1.00 3.33 H new ATOM 0 HD3 ARG C 247 5.303 17.260 3.905 1.00 3.33 H new ATOM 0 HE ARG C 247 2.709 17.310 2.770 1.00 45.44 H new ATOM 0 HH11 ARG C 247 5.515 19.437 2.620 1.00 51.20 H new ATOM 0 HH12 ARG C 247 5.221 19.870 0.933 1.00 51.20 H new ATOM 0 HH21 ARG C 247 2.371 17.810 0.629 1.00 2.41 H new ATOM 0 HH22 ARG C 247 3.441 18.949 -0.194 1.00 2.41 H new ATOM 2479 N GLN C 248 3.879 14.037 5.077 1.00 74.40 N ATOM 2480 CA GLN C 248 3.564 12.983 4.142 1.00 44.14 C ATOM 2481 C GLN C 248 3.126 13.568 2.802 1.00 41.53 C ATOM 2482 O GLN C 248 2.544 14.658 2.740 1.00 43.32 O ATOM 2483 CB GLN C 248 2.462 12.050 4.692 1.00 13.22 C ATOM 2484 CG GLN C 248 1.062 12.665 4.902 1.00 34.13 C ATOM 2485 CD GLN C 248 1.013 13.744 5.962 1.00 52.23 C ATOM 2486 OE1 GLN C 248 1.191 14.920 5.675 1.00 5.13 O ATOM 2487 NE2 GLN C 248 0.792 13.352 7.183 1.00 22.32 N ATOM 0 H GLN C 248 3.075 14.426 5.569 1.00 74.40 H new ATOM 0 HA GLN C 248 4.469 12.393 3.997 1.00 44.14 H new ATOM 0 HB2 GLN C 248 2.362 11.206 4.010 1.00 13.22 H new ATOM 0 HB3 GLN C 248 2.803 11.650 5.647 1.00 13.22 H new ATOM 0 HG2 GLN C 248 0.715 13.083 3.957 1.00 34.13 H new ATOM 0 HG3 GLN C 248 0.366 11.872 5.174 1.00 34.13 H new ATOM 0 HE21 GLN C 248 0.648 12.362 7.383 1.00 22.32 H new ATOM 0 HE22 GLN C 248 0.763 14.035 7.940 1.00 22.32 H new ATOM 2496 N VAL C 249 3.428 12.857 1.744 1.00 71.12 N ATOM 2497 CA VAL C 249 3.090 13.276 0.399 1.00 55.05 C ATOM 2498 C VAL C 249 2.427 12.134 -0.332 1.00 74.34 C ATOM 2499 O VAL C 249 2.590 10.964 0.041 1.00 71.02 O ATOM 2500 CB VAL C 249 4.307 13.811 -0.433 1.00 34.11 C ATOM 2501 CG1 VAL C 249 4.950 15.023 0.226 1.00 33.24 C ATOM 2502 CG2 VAL C 249 5.342 12.727 -0.717 1.00 55.40 C ATOM 0 H VAL C 249 3.919 11.964 1.788 1.00 71.12 H new ATOM 0 HA VAL C 249 2.408 14.120 0.502 1.00 55.05 H new ATOM 0 HB VAL C 249 3.905 14.127 -1.395 1.00 34.11 H new ATOM 0 HG11 VAL C 249 5.789 15.364 -0.380 1.00 33.24 H new ATOM 0 HG12 VAL C 249 4.215 15.823 0.312 1.00 33.24 H new ATOM 0 HG13 VAL C 249 5.307 14.750 1.219 1.00 33.24 H new ATOM 0 HG21 VAL C 249 6.163 13.150 -1.296 1.00 55.40 H new ATOM 0 HG22 VAL C 249 5.726 12.335 0.225 1.00 55.40 H new ATOM 0 HG23 VAL C 249 4.877 11.920 -1.283 1.00 55.40 H new ATOM 2512 N CYS C 250 1.681 12.449 -1.323 1.00 31.22 N ATOM 2513 CA CYS C 250 0.988 11.448 -2.063 1.00 21.04 C ATOM 2514 C CYS C 250 1.878 11.008 -3.197 1.00 52.30 C ATOM 2515 O CYS C 250 2.559 11.811 -3.778 1.00 15.32 O ATOM 2516 CB CYS C 250 -0.329 12.012 -2.563 1.00 14.44 C ATOM 2517 SG CYS C 250 -1.365 12.695 -1.207 1.00 73.24 S ATOM 0 H CYS C 250 1.529 13.404 -1.649 1.00 31.22 H new ATOM 0 HA CYS C 250 0.757 10.583 -1.441 1.00 21.04 H new ATOM 0 HB2 CYS C 250 -0.130 12.796 -3.294 1.00 14.44 H new ATOM 0 HB3 CYS C 250 -0.883 11.228 -3.079 1.00 14.44 H new ATOM 2522 N ILE C 251 1.902 9.749 -3.482 1.00 72.10 N ATOM 2523 CA ILE C 251 2.791 9.224 -4.484 1.00 62.30 C ATOM 2524 C ILE C 251 1.984 8.798 -5.691 1.00 22.41 C ATOM 2525 O ILE C 251 0.823 8.383 -5.557 1.00 14.01 O ATOM 2526 CB ILE C 251 3.549 7.975 -3.941 1.00 54.43 C ATOM 2527 CG1 ILE C 251 4.161 8.253 -2.562 1.00 22.12 C ATOM 2528 CG2 ILE C 251 4.636 7.543 -4.910 1.00 64.01 C ATOM 2529 CD1 ILE C 251 5.131 9.406 -2.529 1.00 43.14 C ATOM 0 H ILE C 251 1.311 9.050 -3.033 1.00 72.10 H new ATOM 0 HA ILE C 251 3.509 9.999 -4.751 1.00 62.30 H new ATOM 0 HB ILE C 251 2.823 7.168 -3.840 1.00 54.43 H new ATOM 0 HG12 ILE C 251 3.356 8.452 -1.855 1.00 22.12 H new ATOM 0 HG13 ILE C 251 4.673 7.354 -2.218 1.00 22.12 H new ATOM 0 HG21 ILE C 251 5.153 6.670 -4.512 1.00 64.01 H new ATOM 0 HG22 ILE C 251 4.188 7.292 -5.871 1.00 64.01 H new ATOM 0 HG23 ILE C 251 5.349 8.357 -5.043 1.00 64.01 H new ATOM 0 HD11 ILE C 251 5.514 9.530 -1.516 1.00 43.14 H new ATOM 0 HD12 ILE C 251 5.959 9.204 -3.208 1.00 43.14 H new ATOM 0 HD13 ILE C 251 4.622 10.319 -2.839 1.00 43.14 H new ATOM 2541 N ASP C 252 2.577 8.908 -6.854 1.00 41.11 N ATOM 2542 CA ASP C 252 1.940 8.482 -8.058 1.00 62.30 C ATOM 2543 C ASP C 252 2.021 6.959 -8.095 1.00 62.42 C ATOM 2544 O ASP C 252 3.120 6.404 -8.072 1.00 73.51 O ATOM 2545 CB ASP C 252 2.683 9.067 -9.272 1.00 64.12 C ATOM 2546 CG ASP C 252 1.940 8.880 -10.569 1.00 65.41 C ATOM 2547 OD1 ASP C 252 1.675 7.752 -10.938 1.00 43.34 O ATOM 2548 OD2 ASP C 252 1.577 9.881 -11.228 1.00 22.20 O ATOM 0 H ASP C 252 3.512 9.295 -6.984 1.00 41.11 H new ATOM 0 HA ASP C 252 0.904 8.819 -8.090 1.00 62.30 H new ATOM 0 HB2 ASP C 252 2.852 10.131 -9.108 1.00 64.12 H new ATOM 0 HB3 ASP C 252 3.663 8.597 -9.351 1.00 64.12 H new ATOM 2553 N PRO C 253 0.872 6.255 -8.140 1.00 71.12 N ATOM 2554 CA PRO C 253 0.849 4.780 -8.144 1.00 30.50 C ATOM 2555 C PRO C 253 1.430 4.192 -9.432 1.00 51.41 C ATOM 2556 O PRO C 253 1.611 2.986 -9.573 1.00 60.33 O ATOM 2557 CB PRO C 253 -0.633 4.438 -8.039 1.00 50.02 C ATOM 2558 CG PRO C 253 -1.359 5.650 -8.495 1.00 62.23 C ATOM 2559 CD PRO C 253 -0.484 6.829 -8.174 1.00 52.11 C ATOM 0 HA PRO C 253 1.454 4.369 -7.336 1.00 30.50 H new ATOM 0 HB2 PRO C 253 -0.881 3.577 -8.659 1.00 50.02 H new ATOM 0 HB3 PRO C 253 -0.904 4.182 -7.015 1.00 50.02 H new ATOM 0 HG2 PRO C 253 -1.562 5.599 -9.565 1.00 62.23 H new ATOM 0 HG3 PRO C 253 -2.322 5.735 -7.992 1.00 62.23 H new ATOM 0 HD2 PRO C 253 -0.570 7.610 -8.930 1.00 52.11 H new ATOM 0 HD3 PRO C 253 -0.753 7.279 -7.218 1.00 52.11 H new ATOM 2567 N LYS C 254 1.700 5.055 -10.345 1.00 21.34 N ATOM 2568 CA LYS C 254 2.204 4.715 -11.616 1.00 75.44 C ATOM 2569 C LYS C 254 3.720 5.071 -11.734 1.00 3.25 C ATOM 2570 O LYS C 254 4.339 4.849 -12.776 1.00 21.14 O ATOM 2571 CB LYS C 254 1.331 5.446 -12.631 1.00 41.14 C ATOM 2572 CG LYS C 254 -0.154 5.122 -12.408 1.00 34.52 C ATOM 2573 CD LYS C 254 -1.146 5.951 -13.246 1.00 73.44 C ATOM 2574 CE LYS C 254 -1.367 7.387 -12.712 1.00 51.31 C ATOM 2575 NZ LYS C 254 -0.166 8.234 -12.739 1.00 24.42 N ATOM 0 H LYS C 254 1.568 6.058 -10.216 1.00 21.34 H new ATOM 0 HA LYS C 254 2.158 3.641 -11.798 1.00 75.44 H new ATOM 0 HB2 LYS C 254 1.490 6.521 -12.546 1.00 41.14 H new ATOM 0 HB3 LYS C 254 1.623 5.159 -13.641 1.00 41.14 H new ATOM 0 HG2 LYS C 254 -0.314 4.066 -12.626 1.00 34.52 H new ATOM 0 HG3 LYS C 254 -0.386 5.268 -11.353 1.00 34.52 H new ATOM 0 HD2 LYS C 254 -0.782 6.007 -14.272 1.00 73.44 H new ATOM 0 HD3 LYS C 254 -2.104 5.433 -13.275 1.00 73.44 H new ATOM 0 HE2 LYS C 254 -2.148 7.866 -13.303 1.00 51.31 H new ATOM 0 HE3 LYS C 254 -1.733 7.329 -11.687 1.00 51.31 H new ATOM 0 HZ1 LYS C 254 -0.435 9.223 -12.562 1.00 24.42 H new ATOM 0 HZ2 LYS C 254 0.498 7.919 -12.003 1.00 24.42 H new ATOM 0 HZ3 LYS C 254 0.290 8.160 -13.671 1.00 24.42 H new ATOM 2589 N LEU C 255 4.314 5.619 -10.647 1.00 33.51 N ATOM 2590 CA LEU C 255 5.738 5.909 -10.593 1.00 72.21 C ATOM 2591 C LEU C 255 6.601 4.649 -10.737 1.00 25.44 C ATOM 2592 O LEU C 255 6.197 3.582 -10.305 1.00 34.01 O ATOM 2593 CB LEU C 255 6.041 6.536 -9.275 1.00 61.43 C ATOM 2594 CG LEU C 255 6.345 8.003 -9.259 1.00 32.02 C ATOM 2595 CD1 LEU C 255 6.634 8.432 -7.846 1.00 43.11 C ATOM 2596 CD2 LEU C 255 7.520 8.316 -10.168 1.00 72.41 C ATOM 0 H LEU C 255 3.809 5.865 -9.796 1.00 33.51 H new ATOM 0 HA LEU C 255 5.974 6.572 -11.425 1.00 72.21 H new ATOM 0 HB2 LEU C 255 5.190 6.362 -8.616 1.00 61.43 H new ATOM 0 HB3 LEU C 255 6.892 6.012 -8.841 1.00 61.43 H new ATOM 0 HG LEU C 255 5.482 8.555 -9.632 1.00 32.02 H new ATOM 0 HD11 LEU C 255 6.856 9.499 -7.828 1.00 43.11 H new ATOM 0 HD12 LEU C 255 5.765 8.232 -7.220 1.00 43.11 H new ATOM 0 HD13 LEU C 255 7.491 7.877 -7.465 1.00 43.11 H new ATOM 0 HD21 LEU C 255 7.725 9.386 -10.142 1.00 72.41 H new ATOM 0 HD22 LEU C 255 8.400 7.770 -9.827 1.00 72.41 H new ATOM 0 HD23 LEU C 255 7.280 8.017 -11.188 1.00 72.41 H new ATOM 2608 N LYS C 256 7.831 4.813 -11.286 1.00 25.05 N ATOM 2609 CA LYS C 256 8.768 3.687 -11.550 1.00 43.42 C ATOM 2610 C LYS C 256 8.947 2.771 -10.351 1.00 41.20 C ATOM 2611 O LYS C 256 8.668 1.567 -10.436 1.00 2.43 O ATOM 2612 CB LYS C 256 10.155 4.184 -11.951 1.00 45.30 C ATOM 2613 CG LYS C 256 11.124 3.040 -12.259 1.00 35.41 C ATOM 2614 CD LYS C 256 12.551 3.505 -12.450 1.00 44.44 C ATOM 2615 CE LYS C 256 13.156 4.039 -11.158 1.00 41.54 C ATOM 2616 NZ LYS C 256 14.573 4.423 -11.327 1.00 30.24 N ATOM 0 H LYS C 256 8.201 5.724 -11.558 1.00 25.05 H new ATOM 0 HA LYS C 256 8.308 3.131 -12.367 1.00 43.42 H new ATOM 0 HB2 LYS C 256 10.067 4.827 -12.827 1.00 45.30 H new ATOM 0 HB3 LYS C 256 10.564 4.795 -11.147 1.00 45.30 H new ATOM 0 HG2 LYS C 256 11.090 2.315 -11.446 1.00 35.41 H new ATOM 0 HG3 LYS C 256 10.793 2.524 -13.160 1.00 35.41 H new ATOM 0 HD2 LYS C 256 13.156 2.676 -12.818 1.00 44.44 H new ATOM 0 HD3 LYS C 256 12.579 4.284 -13.212 1.00 44.44 H new ATOM 0 HE2 LYS C 256 12.584 4.903 -10.820 1.00 41.54 H new ATOM 0 HE3 LYS C 256 13.076 3.280 -10.380 1.00 41.54 H new ATOM 0 HZ1 LYS C 256 14.946 4.781 -10.424 1.00 30.24 H new ATOM 0 HZ2 LYS C 256 15.124 3.593 -11.625 1.00 30.24 H new ATOM 0 HZ3 LYS C 256 14.647 5.166 -12.051 1.00 30.24 H new ATOM 2630 N TRP C 257 9.448 3.330 -9.243 1.00 23.32 N ATOM 2631 CA TRP C 257 9.689 2.523 -8.054 1.00 40.44 C ATOM 2632 C TRP C 257 8.407 1.931 -7.497 1.00 14.43 C ATOM 2633 O TRP C 257 8.438 0.890 -6.890 1.00 42.51 O ATOM 2634 CB TRP C 257 10.489 3.264 -6.970 1.00 4.34 C ATOM 2635 CG TRP C 257 9.879 4.527 -6.505 1.00 43.40 C ATOM 2636 CD1 TRP C 257 10.012 5.748 -7.075 1.00 5.31 C ATOM 2637 CD2 TRP C 257 9.055 4.703 -5.355 1.00 30.11 C ATOM 2638 NE1 TRP C 257 9.321 6.668 -6.360 1.00 64.25 N ATOM 2639 CE2 TRP C 257 8.726 6.059 -5.291 1.00 70.05 C ATOM 2640 CE3 TRP C 257 8.563 3.841 -4.374 1.00 13.54 C ATOM 2641 CZ2 TRP C 257 7.927 6.584 -4.280 1.00 23.43 C ATOM 2642 CZ3 TRP C 257 7.774 4.361 -3.370 1.00 73.10 C ATOM 2643 CH2 TRP C 257 7.462 5.721 -3.330 1.00 74.11 C ATOM 0 H TRP C 257 9.688 4.317 -9.150 1.00 23.32 H new ATOM 0 HA TRP C 257 10.317 1.695 -8.382 1.00 40.44 H new ATOM 0 HB2 TRP C 257 10.615 2.601 -6.114 1.00 4.34 H new ATOM 0 HB3 TRP C 257 11.485 3.479 -7.356 1.00 4.34 H new ATOM 0 HD1 TRP C 257 10.584 5.957 -7.967 1.00 5.31 H new ATOM 0 HE1 TRP C 257 9.255 7.661 -6.585 1.00 64.25 H new ATOM 0 HE3 TRP C 257 8.796 2.787 -4.401 1.00 13.54 H new ATOM 0 HZ2 TRP C 257 7.684 7.636 -4.248 1.00 23.43 H new ATOM 0 HZ3 TRP C 257 7.391 3.705 -2.602 1.00 73.10 H new ATOM 0 HH2 TRP C 257 6.840 6.098 -2.531 1.00 74.11 H new ATOM 2654 N ILE C 258 7.284 2.596 -7.723 1.00 64.32 N ATOM 2655 CA ILE C 258 5.999 2.061 -7.303 1.00 40.32 C ATOM 2656 C ILE C 258 5.650 0.852 -8.146 1.00 61.03 C ATOM 2657 O ILE C 258 5.292 -0.190 -7.608 1.00 12.41 O ATOM 2658 CB ILE C 258 4.860 3.100 -7.401 1.00 62.51 C ATOM 2659 CG1 ILE C 258 5.038 4.222 -6.380 1.00 1.31 C ATOM 2660 CG2 ILE C 258 3.518 2.425 -7.201 1.00 62.32 C ATOM 2661 CD1 ILE C 258 4.890 3.765 -4.941 1.00 11.31 C ATOM 0 H ILE C 258 7.237 3.501 -8.192 1.00 64.32 H new ATOM 0 HA ILE C 258 6.096 1.781 -6.254 1.00 40.32 H new ATOM 0 HB ILE C 258 4.897 3.542 -8.397 1.00 62.51 H new ATOM 0 HG12 ILE C 258 6.024 4.668 -6.511 1.00 1.31 H new ATOM 0 HG13 ILE C 258 4.306 5.004 -6.581 1.00 1.31 H new ATOM 0 HG21 ILE C 258 2.723 3.167 -7.272 1.00 62.32 H new ATOM 0 HG22 ILE C 258 3.375 1.665 -7.969 1.00 62.32 H new ATOM 0 HG23 ILE C 258 3.490 1.956 -6.217 1.00 62.32 H new ATOM 0 HD11 ILE C 258 5.029 4.615 -4.273 1.00 11.31 H new ATOM 0 HD12 ILE C 258 3.895 3.346 -4.793 1.00 11.31 H new ATOM 0 HD13 ILE C 258 5.640 3.005 -4.722 1.00 11.31 H new ATOM 2673 N GLN C 259 5.783 1.007 -9.471 1.00 53.11 N ATOM 2674 CA GLN C 259 5.512 -0.054 -10.432 1.00 31.02 C ATOM 2675 C GLN C 259 6.214 -1.321 -10.015 1.00 74.12 C ATOM 2676 O GLN C 259 5.592 -2.350 -9.873 1.00 13.32 O ATOM 2677 CB GLN C 259 6.031 0.338 -11.827 1.00 33.14 C ATOM 2678 CG GLN C 259 5.446 1.606 -12.393 1.00 23.34 C ATOM 2679 CD GLN C 259 4.015 1.455 -12.734 1.00 34.13 C ATOM 2680 OE1 GLN C 259 3.680 1.108 -13.854 1.00 22.30 O ATOM 2681 NE2 GLN C 259 3.163 1.687 -11.788 1.00 33.23 N ATOM 0 H GLN C 259 6.084 1.881 -9.902 1.00 53.11 H new ATOM 0 HA GLN C 259 4.434 -0.209 -10.465 1.00 31.02 H new ATOM 0 HB2 GLN C 259 7.114 0.447 -11.777 1.00 33.14 H new ATOM 0 HB3 GLN C 259 5.824 -0.479 -12.518 1.00 33.14 H new ATOM 0 HG2 GLN C 259 5.563 2.413 -11.670 1.00 23.34 H new ATOM 0 HG3 GLN C 259 6.002 1.895 -13.285 1.00 23.34 H new ATOM 0 HE21 GLN C 259 3.491 1.975 -10.866 1.00 33.23 H new ATOM 0 HE22 GLN C 259 2.164 1.581 -11.964 1.00 33.23 H new ATOM 2690 N GLU C 260 7.501 -1.210 -9.753 1.00 72.34 N ATOM 2691 CA GLU C 260 8.315 -2.348 -9.429 1.00 42.31 C ATOM 2692 C GLU C 260 8.053 -2.855 -8.008 1.00 11.04 C ATOM 2693 O GLU C 260 8.186 -4.053 -7.730 1.00 15.12 O ATOM 2694 CB GLU C 260 9.791 -2.030 -9.724 1.00 3.13 C ATOM 2695 CG GLU C 260 10.494 -1.002 -8.832 1.00 60.03 C ATOM 2696 CD GLU C 260 11.110 -1.617 -7.594 1.00 42.23 C ATOM 2697 OE1 GLU C 260 12.227 -2.151 -7.696 1.00 32.22 O ATOM 2698 OE2 GLU C 260 10.514 -1.595 -6.532 1.00 54.51 O ATOM 0 H GLU C 260 8.006 -0.324 -9.761 1.00 72.34 H new ATOM 0 HA GLU C 260 8.037 -3.185 -10.069 1.00 42.31 H new ATOM 0 HB2 GLU C 260 10.352 -2.963 -9.666 1.00 3.13 H new ATOM 0 HB3 GLU C 260 9.859 -1.681 -10.754 1.00 3.13 H new ATOM 0 HG2 GLU C 260 11.272 -0.501 -9.408 1.00 60.03 H new ATOM 0 HG3 GLU C 260 9.777 -0.238 -8.533 1.00 60.03 H new ATOM 2705 N TYR C 261 7.690 -1.945 -7.132 1.00 31.21 N ATOM 2706 CA TYR C 261 7.375 -2.262 -5.735 1.00 0.33 C ATOM 2707 C TYR C 261 6.091 -3.102 -5.676 1.00 71.43 C ATOM 2708 O TYR C 261 6.049 -4.150 -5.035 1.00 4.13 O ATOM 2709 CB TYR C 261 7.197 -0.967 -4.926 1.00 65.44 C ATOM 2710 CG TYR C 261 7.159 -1.136 -3.421 1.00 73.02 C ATOM 2711 CD1 TYR C 261 6.008 -1.534 -2.762 1.00 61.13 C ATOM 2712 CD2 TYR C 261 8.293 -0.881 -2.659 1.00 70.51 C ATOM 2713 CE1 TYR C 261 5.987 -1.675 -1.389 1.00 43.11 C ATOM 2714 CE2 TYR C 261 8.283 -1.017 -1.292 1.00 43.24 C ATOM 2715 CZ TYR C 261 7.125 -1.416 -0.656 1.00 41.12 C ATOM 2716 OH TYR C 261 7.101 -1.557 0.718 1.00 13.04 O ATOM 0 H TYR C 261 7.601 -0.955 -7.359 1.00 31.21 H new ATOM 0 HA TYR C 261 8.197 -2.832 -5.303 1.00 0.33 H new ATOM 0 HB2 TYR C 261 8.012 -0.288 -5.177 1.00 65.44 H new ATOM 0 HB3 TYR C 261 6.272 -0.486 -5.243 1.00 65.44 H new ATOM 0 HD1 TYR C 261 5.113 -1.737 -3.331 1.00 61.13 H new ATOM 0 HD2 TYR C 261 9.202 -0.569 -3.152 1.00 70.51 H new ATOM 0 HE1 TYR C 261 5.081 -1.987 -0.891 1.00 43.11 H new ATOM 0 HE2 TYR C 261 9.175 -0.813 -0.719 1.00 43.24 H new ATOM 0 HH TYR C 261 6.199 -1.367 1.051 1.00 13.04 H new ATOM 2726 N LEU C 262 5.048 -2.621 -6.327 1.00 11.11 N ATOM 2727 CA LEU C 262 3.787 -3.365 -6.435 1.00 52.11 C ATOM 2728 C LEU C 262 4.043 -4.684 -7.130 1.00 24.31 C ATOM 2729 O LEU C 262 3.652 -5.732 -6.652 1.00 44.13 O ATOM 2730 CB LEU C 262 2.769 -2.592 -7.270 1.00 41.14 C ATOM 2731 CG LEU C 262 2.479 -1.166 -6.848 1.00 3.33 C ATOM 2732 CD1 LEU C 262 1.464 -0.533 -7.790 1.00 71.04 C ATOM 2733 CD2 LEU C 262 2.007 -1.092 -5.402 1.00 62.12 C ATOM 0 H LEU C 262 5.040 -1.714 -6.794 1.00 11.11 H new ATOM 0 HA LEU C 262 3.397 -3.517 -5.429 1.00 52.11 H new ATOM 0 HB2 LEU C 262 3.119 -2.576 -8.302 1.00 41.14 H new ATOM 0 HB3 LEU C 262 1.831 -3.146 -7.260 1.00 41.14 H new ATOM 0 HG LEU C 262 3.409 -0.601 -6.910 1.00 3.33 H new ATOM 0 HD11 LEU C 262 1.265 0.491 -7.475 1.00 71.04 H new ATOM 0 HD12 LEU C 262 1.862 -0.530 -8.805 1.00 71.04 H new ATOM 0 HD13 LEU C 262 0.538 -1.107 -7.765 1.00 71.04 H new ATOM 0 HD21 LEU C 262 1.809 -0.053 -5.137 1.00 62.12 H new ATOM 0 HD22 LEU C 262 1.094 -1.676 -5.287 1.00 62.12 H new ATOM 0 HD23 LEU C 262 2.780 -1.493 -4.746 1.00 62.12 H new ATOM 2745 N GLU C 263 4.726 -4.596 -8.261 1.00 34.52 N ATOM 2746 CA GLU C 263 5.066 -5.732 -9.110 1.00 44.23 C ATOM 2747 C GLU C 263 5.768 -6.854 -8.287 1.00 71.42 C ATOM 2748 O GLU C 263 5.403 -8.028 -8.401 1.00 64.41 O ATOM 2749 CB GLU C 263 5.987 -5.198 -10.223 1.00 2.13 C ATOM 2750 CG GLU C 263 5.882 -5.861 -11.577 1.00 22.21 C ATOM 2751 CD GLU C 263 6.391 -7.264 -11.632 1.00 22.21 C ATOM 2752 OE1 GLU C 263 7.610 -7.443 -11.777 1.00 31.42 O ATOM 2753 OE2 GLU C 263 5.586 -8.202 -11.571 1.00 33.20 O ATOM 0 H GLU C 263 5.070 -3.708 -8.626 1.00 34.52 H new ATOM 0 HA GLU C 263 4.168 -6.179 -9.537 1.00 44.23 H new ATOM 0 HB2 GLU C 263 5.784 -4.135 -10.350 1.00 2.13 H new ATOM 0 HB3 GLU C 263 7.018 -5.287 -9.881 1.00 2.13 H new ATOM 0 HG2 GLU C 263 4.837 -5.857 -11.887 1.00 22.21 H new ATOM 0 HG3 GLU C 263 6.432 -5.262 -12.302 1.00 22.21 H new ATOM 2760 N LYS C 264 6.735 -6.491 -7.433 1.00 52.13 N ATOM 2761 CA LYS C 264 7.439 -7.464 -6.651 1.00 0.53 C ATOM 2762 C LYS C 264 6.548 -8.052 -5.553 1.00 61.03 C ATOM 2763 O LYS C 264 6.538 -9.248 -5.325 1.00 51.12 O ATOM 2764 CB LYS C 264 8.700 -6.848 -6.019 1.00 71.02 C ATOM 2765 CG LYS C 264 8.460 -5.828 -4.902 1.00 62.51 C ATOM 2766 CD LYS C 264 9.746 -5.299 -4.286 1.00 23.34 C ATOM 2767 CE LYS C 264 9.440 -4.352 -3.119 1.00 0.54 C ATOM 2768 NZ LYS C 264 10.665 -3.792 -2.500 1.00 72.22 N ATOM 0 H LYS C 264 7.033 -5.527 -7.281 1.00 52.13 H new ATOM 0 HA LYS C 264 7.733 -8.269 -7.325 1.00 0.53 H new ATOM 0 HB2 LYS C 264 9.315 -7.655 -5.621 1.00 71.02 H new ATOM 0 HB3 LYS C 264 9.279 -6.366 -6.807 1.00 71.02 H new ATOM 0 HG2 LYS C 264 7.885 -4.992 -5.300 1.00 62.51 H new ATOM 0 HG3 LYS C 264 7.854 -6.289 -4.122 1.00 62.51 H new ATOM 0 HD2 LYS C 264 10.356 -6.131 -3.935 1.00 23.34 H new ATOM 0 HD3 LYS C 264 10.329 -4.774 -5.043 1.00 23.34 H new ATOM 0 HE2 LYS C 264 8.812 -3.535 -3.474 1.00 0.54 H new ATOM 0 HE3 LYS C 264 8.868 -4.888 -2.362 1.00 0.54 H new ATOM 0 HZ1 LYS C 264 10.637 -3.949 -1.472 1.00 72.22 H new ATOM 0 HZ2 LYS C 264 11.502 -4.262 -2.900 1.00 72.22 H new ATOM 0 HZ3 LYS C 264 10.716 -2.771 -2.693 1.00 72.22 H new ATOM 2782 N CYS C 265 5.797 -7.198 -4.908 1.00 53.11 N ATOM 2783 CA CYS C 265 4.991 -7.585 -3.747 1.00 40.14 C ATOM 2784 C CYS C 265 3.769 -8.391 -4.171 1.00 34.15 C ATOM 2785 O CYS C 265 3.246 -9.194 -3.404 1.00 70.54 O ATOM 2786 CB CYS C 265 4.598 -6.340 -2.927 1.00 74.41 C ATOM 2787 SG CYS C 265 3.871 -6.681 -1.285 1.00 32.30 S ATOM 0 H CYS C 265 5.717 -6.213 -5.161 1.00 53.11 H new ATOM 0 HA CYS C 265 5.593 -8.230 -3.107 1.00 40.14 H new ATOM 0 HB2 CYS C 265 5.484 -5.720 -2.792 1.00 74.41 H new ATOM 0 HB3 CYS C 265 3.885 -5.754 -3.507 1.00 74.41 H new ATOM 2792 N LEU C 266 3.341 -8.172 -5.412 1.00 72.53 N ATOM 2793 CA LEU C 266 2.250 -8.884 -6.017 1.00 42.10 C ATOM 2794 C LEU C 266 2.560 -10.384 -6.019 1.00 1.42 C ATOM 2795 O LEU C 266 1.704 -11.204 -5.690 1.00 32.14 O ATOM 2796 CB LEU C 266 2.085 -8.346 -7.479 1.00 3.04 C ATOM 2797 CG LEU C 266 0.852 -8.774 -8.313 1.00 41.34 C ATOM 2798 CD1 LEU C 266 0.834 -10.263 -8.630 1.00 50.24 C ATOM 2799 CD2 LEU C 266 -0.400 -8.367 -7.596 1.00 55.40 C ATOM 0 H LEU C 266 3.762 -7.476 -6.028 1.00 72.53 H new ATOM 0 HA LEU C 266 1.324 -8.732 -5.462 1.00 42.10 H new ATOM 0 HB2 LEU C 266 2.084 -7.257 -7.428 1.00 3.04 H new ATOM 0 HB3 LEU C 266 2.975 -8.638 -8.037 1.00 3.04 H new ATOM 0 HG LEU C 266 0.913 -8.263 -9.274 1.00 41.34 H new ATOM 0 HD11 LEU C 266 -0.054 -10.500 -9.216 1.00 50.24 H new ATOM 0 HD12 LEU C 266 1.725 -10.524 -9.200 1.00 50.24 H new ATOM 0 HD13 LEU C 266 0.818 -10.833 -7.701 1.00 50.24 H new ATOM 0 HD21 LEU C 266 -1.269 -8.668 -8.182 1.00 55.40 H new ATOM 0 HD22 LEU C 266 -0.435 -8.852 -6.620 1.00 55.40 H new ATOM 0 HD23 LEU C 266 -0.408 -7.285 -7.464 1.00 55.40 H new ATOM 2811 N ASN C 267 3.788 -10.727 -6.367 1.00 52.45 N ATOM 2812 CA ASN C 267 4.158 -12.122 -6.514 1.00 2.14 C ATOM 2813 C ASN C 267 5.649 -12.302 -6.425 1.00 51.33 C ATOM 2814 O ASN C 267 6.179 -12.907 -5.497 1.00 40.11 O ATOM 2815 CB ASN C 267 3.680 -12.650 -7.884 1.00 14.12 C ATOM 2816 CG ASN C 267 4.003 -14.107 -8.104 1.00 43.34 C ATOM 2817 OD1 ASN C 267 3.065 -14.948 -7.843 1.00 4.21 O flip ATOM 2818 ND2 ASN C 267 5.087 -14.457 -8.573 1.00 52.32 N flip ATOM 0 H ASN C 267 4.540 -10.063 -6.552 1.00 52.45 H new ATOM 0 HA ASN C 267 3.684 -12.678 -5.706 1.00 2.14 H new ATOM 0 HB2 ASN C 267 2.603 -12.507 -7.966 1.00 14.12 H new ATOM 0 HB3 ASN C 267 4.141 -12.059 -8.675 1.00 14.12 H new ATOM 0 HD21 ASN C 267 5.807 -13.761 -8.767 1.00 52.32 H new ATOM 0 HD22 ASN C 267 5.264 -15.443 -8.767 1.00 52.32 H new ATOM 3008 N TYR D 312 -9.992 7.420 7.248 1.00 13.41 N ATOM 3009 CA TYR D 312 -8.941 8.025 6.468 1.00 55.03 C ATOM 3010 C TYR D 312 -9.370 9.407 6.108 1.00 74.14 C ATOM 3011 O TYR D 312 -8.547 10.315 6.023 1.00 0.01 O ATOM 3012 CB TYR D 312 -8.666 7.236 5.192 1.00 11.23 C ATOM 3013 CG TYR D 312 -7.616 7.859 4.284 1.00 50.11 C ATOM 3014 CD1 TYR D 312 -6.289 7.904 4.667 1.00 75.11 C ATOM 3015 CD2 TYR D 312 -7.959 8.403 3.039 1.00 22.41 C ATOM 3016 CE1 TYR D 312 -5.340 8.469 3.851 1.00 61.33 C ATOM 3017 CE2 TYR D 312 -7.012 8.963 2.233 1.00 44.11 C ATOM 3018 CZ TYR D 312 -5.699 8.996 2.643 1.00 50.23 C ATOM 3019 OH TYR D 312 -4.733 9.562 1.842 1.00 5.44 O ATOM 0 HA TYR D 312 -8.024 8.036 7.057 1.00 55.03 H new ATOM 0 HB2 TYR D 312 -8.344 6.230 5.463 1.00 11.23 H new ATOM 0 HB3 TYR D 312 -9.597 7.134 4.634 1.00 11.23 H new ATOM 0 HD1 TYR D 312 -5.995 7.490 5.620 1.00 75.11 H new ATOM 0 HD2 TYR D 312 -8.988 8.378 2.713 1.00 22.41 H new ATOM 0 HE1 TYR D 312 -4.307 8.497 4.165 1.00 61.33 H new ATOM 0 HE2 TYR D 312 -7.292 9.379 1.276 1.00 44.11 H new ATOM 0 HH TYR D 312 -4.802 9.194 0.936 1.00 5.44 H new ATOM 3029 N THR D 313 -10.681 9.548 5.907 1.00 11.35 N ATOM 3030 CA THR D 313 -11.331 10.789 5.546 1.00 1.31 C ATOM 3031 C THR D 313 -10.811 11.328 4.223 1.00 24.25 C ATOM 3032 O THR D 313 -9.810 12.057 4.173 1.00 33.34 O ATOM 3033 CB THR D 313 -11.312 11.862 6.680 1.00 75.54 C ATOM 3034 OG1 THR D 313 -9.968 12.191 7.087 1.00 43.23 O ATOM 3035 CG2 THR D 313 -12.078 11.365 7.888 1.00 45.11 C ATOM 0 H THR D 313 -11.334 8.769 5.996 1.00 11.35 H new ATOM 0 HA THR D 313 -12.385 10.548 5.407 1.00 1.31 H new ATOM 0 HB THR D 313 -11.783 12.759 6.277 1.00 75.54 H new ATOM 0 HG1 THR D 313 -9.330 11.811 6.448 1.00 43.23 H new ATOM 0 HG21 THR D 313 -12.056 12.124 8.670 1.00 45.11 H new ATOM 0 HG22 THR D 313 -13.112 11.164 7.606 1.00 45.11 H new ATOM 0 HG23 THR D 313 -11.619 10.449 8.258 1.00 45.11 H new ATOM 3043 N GLU D 314 -11.457 10.908 3.157 1.00 61.51 N ATOM 3044 CA GLU D 314 -11.067 11.277 1.817 1.00 34.22 C ATOM 3045 C GLU D 314 -11.566 12.659 1.455 1.00 40.33 C ATOM 3046 O GLU D 314 -12.772 12.923 1.596 1.00 1.44 O ATOM 3047 CB GLU D 314 -11.635 10.286 0.778 1.00 1.51 C ATOM 3048 CG GLU D 314 -13.147 10.107 0.875 1.00 43.43 C ATOM 3049 CD GLU D 314 -13.805 9.654 -0.410 1.00 3.10 C ATOM 3050 OE1 GLU D 314 -13.875 8.444 -0.672 1.00 53.43 O ATOM 3051 OE2 GLU D 314 -14.319 10.542 -1.154 1.00 34.10 O ATOM 0 H GLU D 314 -12.273 10.297 3.198 1.00 61.51 H new ATOM 0 HA GLU D 314 -9.977 11.259 1.799 1.00 34.22 H new ATOM 0 HB2 GLU D 314 -11.381 10.635 -0.223 1.00 1.51 H new ATOM 0 HB3 GLU D 314 -11.153 9.317 0.909 1.00 1.51 H new ATOM 0 HG2 GLU D 314 -13.365 9.380 1.657 1.00 43.43 H new ATOM 0 HG3 GLU D 314 -13.594 11.052 1.185 1.00 43.43 H new ATOM 3058 N GLU D 315 -10.631 13.553 1.076 1.00 2.53 N ATOM 3059 CA GLU D 315 -10.941 14.812 0.427 1.00 52.25 C ATOM 3060 C GLU D 315 -9.730 15.782 0.437 1.00 32.44 C ATOM 3061 O GLU D 315 -9.381 16.344 1.490 1.00 2.24 O ATOM 3062 CB GLU D 315 -12.138 15.538 1.024 1.00 62.42 C ATOM 3063 CG GLU D 315 -12.452 16.822 0.339 1.00 43.54 C ATOM 3064 CD GLU D 315 -13.611 17.526 0.969 1.00 72.41 C ATOM 3065 OE1 GLU D 315 -13.402 18.266 1.951 1.00 23.32 O ATOM 3066 OE2 GLU D 315 -14.748 17.351 0.505 1.00 42.54 O ATOM 0 H GLU D 315 -9.632 13.405 1.220 1.00 2.53 H new ATOM 0 HA GLU D 315 -11.192 14.529 -0.595 1.00 52.25 H new ATOM 0 HB2 GLU D 315 -13.010 14.886 0.976 1.00 62.42 H new ATOM 0 HB3 GLU D 315 -11.945 15.735 2.079 1.00 62.42 H new ATOM 0 HG2 GLU D 315 -11.576 17.470 0.366 1.00 43.54 H new ATOM 0 HG3 GLU D 315 -12.673 16.628 -0.711 1.00 43.54 H new ATOM 3073 N MET D 316 -9.116 15.952 -0.732 1.00 45.40 N ATOM 3074 CA MET D 316 -8.051 16.945 -0.990 1.00 23.35 C ATOM 3075 C MET D 316 -6.723 16.618 -0.266 1.00 73.41 C ATOM 3076 O MET D 316 -6.700 15.949 0.755 1.00 41.42 O ATOM 3077 CB MET D 316 -8.562 18.386 -0.677 1.00 25.23 C ATOM 3078 CG MET D 316 -7.580 19.518 -0.976 1.00 33.21 C ATOM 3079 SD MET D 316 -8.293 21.151 -0.673 1.00 20.04 S ATOM 3080 CE MET D 316 -6.911 22.216 -1.102 1.00 10.14 C ATOM 0 H MET D 316 -9.344 15.393 -1.554 1.00 45.40 H new ATOM 0 HA MET D 316 -7.812 16.894 -2.052 1.00 23.35 H new ATOM 0 HB2 MET D 316 -9.474 18.560 -1.249 1.00 25.23 H new ATOM 0 HB3 MET D 316 -8.833 18.434 0.378 1.00 25.23 H new ATOM 0 HG2 MET D 316 -6.689 19.394 -0.360 1.00 33.21 H new ATOM 0 HG3 MET D 316 -7.260 19.452 -2.016 1.00 33.21 H new ATOM 0 HE1 MET D 316 -7.199 23.258 -0.965 1.00 10.14 H new ATOM 0 HE2 MET D 316 -6.062 21.987 -0.459 1.00 10.14 H new ATOM 0 HE3 MET D 316 -6.633 22.050 -2.143 1.00 10.14 H new ATOM 3090 N GLY D 317 -5.634 17.080 -0.843 1.00 3.30 N ATOM 3091 CA GLY D 317 -4.323 16.888 -0.286 1.00 42.21 C ATOM 3092 C GLY D 317 -3.383 17.857 -0.920 1.00 10.43 C ATOM 3093 O GLY D 317 -3.838 18.832 -1.507 1.00 33.14 O ATOM 0 H GLY D 317 -5.640 17.603 -1.719 1.00 3.30 H new ATOM 0 HA2 GLY D 317 -4.346 17.037 0.794 1.00 42.21 H new ATOM 0 HA3 GLY D 317 -3.985 15.866 -0.460 1.00 42.21 H new ATOM 3097 N SER D 318 -2.111 17.601 -0.849 1.00 54.20 N ATOM 3098 CA SER D 318 -1.131 18.507 -1.399 1.00 71.23 C ATOM 3099 C SER D 318 -0.775 18.157 -2.865 1.00 23.12 C ATOM 3100 O SER D 318 -1.500 17.388 -3.534 1.00 10.11 O ATOM 3101 CB SER D 318 0.111 18.524 -0.486 1.00 4.52 C ATOM 3102 OG SER D 318 0.624 17.206 -0.252 1.00 35.13 O ATOM 0 H SER D 318 -1.719 16.766 -0.413 1.00 54.20 H new ATOM 0 HA SER D 318 -1.556 19.510 -1.431 1.00 71.23 H new ATOM 0 HB2 SER D 318 0.887 19.139 -0.941 1.00 4.52 H new ATOM 0 HB3 SER D 318 -0.146 18.987 0.467 1.00 4.52 H new ATOM 0 HG SER D 318 0.606 17.014 0.709 1.00 35.13 H new ATOM 3108 N GLY D 319 0.297 18.758 -3.348 1.00 64.24 N ATOM 3109 CA GLY D 319 0.818 18.529 -4.682 1.00 11.04 C ATOM 3110 C GLY D 319 2.211 19.116 -4.780 1.00 70.14 C ATOM 3111 O GLY D 319 2.369 20.329 -4.976 1.00 14.31 O ATOM 0 H GLY D 319 0.841 19.434 -2.811 1.00 64.24 H new ATOM 0 HA2 GLY D 319 0.845 17.461 -4.897 1.00 11.04 H new ATOM 0 HA3 GLY D 319 0.164 18.987 -5.424 1.00 11.04 H new ATOM 3115 N ASP D 320 3.210 18.288 -4.652 1.00 43.25 N ATOM 3116 CA ASP D 320 4.605 18.751 -4.542 1.00 42.22 C ATOM 3117 C ASP D 320 5.581 18.028 -5.439 1.00 64.11 C ATOM 3118 O ASP D 320 5.202 17.232 -6.264 1.00 52.15 O ATOM 3119 CB ASP D 320 5.110 18.572 -3.127 1.00 4.45 C ATOM 3120 CG ASP D 320 4.757 19.677 -2.169 1.00 42.33 C ATOM 3121 OD1 ASP D 320 3.654 19.681 -1.607 1.00 71.41 O ATOM 3122 OD2 ASP D 320 5.606 20.554 -1.931 1.00 62.05 O ATOM 0 H ASP D 320 3.103 17.274 -4.619 1.00 43.25 H new ATOM 0 HA ASP D 320 4.566 19.797 -4.848 1.00 42.22 H new ATOM 0 HB2 ASP D 320 4.715 17.635 -2.735 1.00 4.45 H new ATOM 0 HB3 ASP D 320 6.195 18.473 -3.157 1.00 4.45 H new ATOM 3151 N ASP D 322 7.168 18.404 -8.029 1.00 54.34 N ATOM 3152 CA ASP D 322 6.869 18.225 -9.450 1.00 23.50 C ATOM 3153 C ASP D 322 6.078 16.938 -9.531 1.00 42.31 C ATOM 3154 O ASP D 322 6.624 15.829 -9.522 1.00 73.10 O ATOM 3155 CB ASP D 322 8.133 18.186 -10.336 1.00 61.01 C ATOM 3156 CG ASP D 322 7.820 18.113 -11.818 1.00 63.33 C ATOM 3157 OD1 ASP D 322 7.639 17.002 -12.363 1.00 1.14 O ATOM 3158 OD2 ASP D 322 7.759 19.175 -12.468 1.00 55.24 O ATOM 0 HA ASP D 322 6.306 19.074 -9.837 1.00 23.50 H new ATOM 0 HB2 ASP D 322 8.733 19.075 -10.141 1.00 61.01 H new ATOM 0 HB3 ASP D 322 8.739 17.324 -10.056 1.00 61.01 H new ATOM 3163 N SER D 323 4.809 17.103 -9.513 1.00 34.33 N ATOM 3164 CA SER D 323 3.889 16.042 -9.314 1.00 32.10 C ATOM 3165 C SER D 323 3.126 15.630 -10.609 1.00 34.24 C ATOM 3166 O SER D 323 3.041 16.418 -11.571 1.00 12.33 O ATOM 3167 CB SER D 323 2.998 16.461 -8.101 1.00 14.22 C ATOM 3168 OG SER D 323 1.822 15.745 -7.966 1.00 34.42 O ATOM 0 H SER D 323 4.364 18.012 -9.641 1.00 34.33 H new ATOM 0 HA SER D 323 4.399 15.109 -9.072 1.00 32.10 H new ATOM 0 HB2 SER D 323 3.580 16.351 -7.186 1.00 14.22 H new ATOM 0 HB3 SER D 323 2.753 17.519 -8.197 1.00 14.22 H new ATOM 0 HG SER D 323 1.568 15.709 -7.020 1.00 34.42 H new ATOM 3174 N MET D 324 2.583 14.372 -10.601 1.00 15.01 N ATOM 3175 CA MET D 324 1.876 13.703 -11.743 1.00 45.42 C ATOM 3176 C MET D 324 2.820 13.055 -12.764 1.00 64.15 C ATOM 3177 O MET D 324 3.698 13.718 -13.330 1.00 35.22 O ATOM 3178 CB MET D 324 0.848 14.604 -12.448 1.00 41.33 C ATOM 3179 CG MET D 324 -0.342 14.982 -11.599 1.00 45.54 C ATOM 3180 SD MET D 324 -1.327 13.554 -11.134 1.00 22.21 S ATOM 3181 CE MET D 324 -2.610 14.339 -10.173 1.00 23.10 C ATOM 0 H MET D 324 2.627 13.777 -9.774 1.00 15.01 H new ATOM 0 HA MET D 324 1.322 12.896 -11.263 1.00 45.42 H new ATOM 0 HB2 MET D 324 1.348 15.515 -12.776 1.00 41.33 H new ATOM 0 HB3 MET D 324 0.492 14.095 -13.344 1.00 41.33 H new ATOM 0 HG2 MET D 324 0.003 15.491 -10.699 1.00 45.54 H new ATOM 0 HG3 MET D 324 -0.966 15.689 -12.146 1.00 45.54 H new ATOM 0 HE1 MET D 324 -3.390 13.612 -9.945 1.00 23.10 H new ATOM 0 HE2 MET D 324 -2.187 14.721 -9.244 1.00 23.10 H new ATOM 0 HE3 MET D 324 -3.038 15.164 -10.743 1.00 23.10 H new ATOM 3191 N LYS D 325 2.646 11.738 -12.975 1.00 31.21 N ATOM 3192 CA LYS D 325 3.408 10.987 -13.963 1.00 3.10 C ATOM 3193 C LYS D 325 2.497 9.858 -14.583 1.00 35.03 C ATOM 3194 O LYS D 325 1.290 9.823 -14.328 1.00 52.12 O ATOM 3195 CB LYS D 325 4.708 10.441 -13.280 1.00 61.31 C ATOM 3196 CG LYS D 325 5.686 9.669 -14.145 1.00 64.11 C ATOM 3197 CD LYS D 325 6.139 10.500 -15.327 1.00 54.43 C ATOM 3198 CE LYS D 325 7.001 11.696 -14.928 1.00 73.23 C ATOM 3199 NZ LYS D 325 8.277 11.294 -14.307 1.00 72.52 N ATOM 0 H LYS D 325 1.971 11.173 -12.460 1.00 31.21 H new ATOM 0 HA LYS D 325 3.720 11.619 -14.794 1.00 3.10 H new ATOM 0 HB2 LYS D 325 5.240 11.287 -12.846 1.00 61.31 H new ATOM 0 HB3 LYS D 325 4.408 9.795 -12.455 1.00 61.31 H new ATOM 0 HG2 LYS D 325 6.551 9.376 -13.550 1.00 64.11 H new ATOM 0 HG3 LYS D 325 5.217 8.751 -14.500 1.00 64.11 H new ATOM 0 HD2 LYS D 325 6.702 9.867 -16.013 1.00 54.43 H new ATOM 0 HD3 LYS D 325 5.263 10.857 -15.869 1.00 54.43 H new ATOM 0 HE2 LYS D 325 7.206 12.302 -15.811 1.00 73.23 H new ATOM 0 HE3 LYS D 325 6.445 12.324 -14.232 1.00 73.23 H new ATOM 0 HZ1 LYS D 325 8.887 12.129 -14.195 1.00 72.52 H new ATOM 0 HZ2 LYS D 325 8.092 10.873 -13.374 1.00 72.52 H new ATOM 0 HZ3 LYS D 325 8.754 10.596 -14.913 1.00 72.52 H new ATOM 3213 N GLU D 326 3.076 8.984 -15.390 1.00 71.44 N ATOM 3214 CA GLU D 326 2.415 7.909 -16.051 1.00 2.33 C ATOM 3215 C GLU D 326 3.171 6.627 -15.683 1.00 13.31 C ATOM 3216 O GLU D 326 4.343 6.713 -15.294 1.00 34.03 O ATOM 3217 CB GLU D 326 2.465 8.138 -17.575 1.00 34.23 C ATOM 3218 CG GLU D 326 3.873 8.256 -18.143 1.00 72.04 C ATOM 3219 CD GLU D 326 3.881 8.375 -19.639 1.00 21.12 C ATOM 3220 OE1 GLU D 326 3.824 7.335 -20.317 1.00 4.25 O ATOM 3221 OE2 GLU D 326 3.957 9.500 -20.165 1.00 31.23 O ATOM 0 H GLU D 326 4.073 9.022 -15.602 1.00 71.44 H new ATOM 0 HA GLU D 326 1.370 7.838 -15.751 1.00 2.33 H new ATOM 0 HB2 GLU D 326 1.953 7.314 -18.072 1.00 34.23 H new ATOM 0 HB3 GLU D 326 1.912 9.047 -17.813 1.00 34.23 H new ATOM 0 HG2 GLU D 326 4.364 9.127 -17.710 1.00 72.04 H new ATOM 0 HG3 GLU D 326 4.455 7.383 -17.848 1.00 72.04 H new ATOM 3228 N PRO D 327 2.521 5.449 -15.782 1.00 74.51 N ATOM 3229 CA PRO D 327 3.112 4.160 -15.419 1.00 43.10 C ATOM 3230 C PRO D 327 4.418 3.901 -16.106 1.00 10.43 C ATOM 3231 O PRO D 327 4.499 3.795 -17.348 1.00 54.34 O ATOM 3232 CB PRO D 327 2.062 3.131 -15.842 1.00 45.42 C ATOM 3233 CG PRO D 327 1.152 3.881 -16.728 1.00 51.13 C ATOM 3234 CD PRO D 327 1.158 5.277 -16.221 1.00 3.13 C ATOM 0 HA PRO D 327 3.348 4.122 -14.356 1.00 43.10 H new ATOM 0 HB2 PRO D 327 2.518 2.288 -16.362 1.00 45.42 H new ATOM 0 HB3 PRO D 327 1.533 2.725 -14.980 1.00 45.42 H new ATOM 0 HG2 PRO D 327 1.491 3.839 -17.763 1.00 51.13 H new ATOM 0 HG3 PRO D 327 0.147 3.460 -16.704 1.00 51.13 H new ATOM 0 HD2 PRO D 327 0.890 5.992 -16.999 1.00 3.13 H new ATOM 0 HD3 PRO D 327 0.449 5.414 -15.404 1.00 3.13 H new