USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 486 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 230 THR OG1 : rot -79:sc= 0.917 USER MOD Set 1.2: A 233 GLN : amide:sc= 0.0129 K(o=0.93,f=-4!) USER MOD Single : A 158 HIS : no HD1:sc= -3.96! C(o=-4!,f=-4.3!) USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 180 THR OG1 : rot 180:sc= 0.0226 USER MOD Single : A 181 SER OG : rot 151:sc= 1.26 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 192 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 208 SER OG : rot 70:sc= 0.697 USER MOD Single : A 209 THR OG1 : rot 180:sc= -0.445 USER MOD Single : A 215 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 ASN : amide:sc= 1.98 K(o=2,f=-7!) USER MOD Single : A 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 235 THR OG1 : rot 66:sc= 0.655 USER MOD Single : A 237 MET CE :methyl -174:sc=-6.58e-05 (180deg=-0.0662) USER MOD Single : A 238 MET CE :methyl -131:sc= -0.885 (180deg=-3.07) USER MOD Single : A 241 ASN : amide:sc= -0.832 X(o=-0.83,f=-0.64) USER MOD Single : A 242 SER OG : rot 180:sc= 0 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 244 ASN : amide:sc= -0.0805 X(o=-0.08,f=-0.08) USER MOD Single : A 248 THR OG1 : rot 70:sc= -0.126 USER MOD Single : A 250 LYS NZ :NH3+ 179:sc= 1.27 (180deg=1.26) USER MOD ----------------------------------------------------------------- ATOM 28 N HIS A 158 -10.241 -7.056 -4.028 1.00 63.43 N ATOM 29 CA HIS A 158 -9.074 -6.314 -4.478 1.00 22.43 C ATOM 30 C HIS A 158 -9.447 -5.108 -5.262 1.00 60.50 C ATOM 31 O HIS A 158 -10.350 -5.147 -6.104 1.00 31.23 O ATOM 32 CB HIS A 158 -8.062 -7.152 -5.269 1.00 3.53 C ATOM 33 CG HIS A 158 -7.278 -8.079 -4.442 1.00 73.34 C ATOM 34 ND1 HIS A 158 -6.669 -9.208 -4.919 1.00 45.24 N ATOM 35 CD2 HIS A 158 -6.949 -7.992 -3.167 1.00 1.35 C ATOM 36 CE1 HIS A 158 -5.997 -9.775 -3.947 1.00 11.43 C ATOM 37 NE2 HIS A 158 -6.155 -9.054 -2.867 1.00 40.20 N ATOM 0 HA HIS A 158 -8.580 -6.006 -3.556 1.00 22.43 H new ATOM 0 HB2 HIS A 158 -8.594 -7.722 -6.031 1.00 3.53 H new ATOM 0 HB3 HIS A 158 -7.380 -6.481 -5.791 1.00 3.53 H new ATOM 0 HD2 HIS A 158 -7.256 -7.215 -2.483 1.00 1.35 H new ATOM 0 HE1 HIS A 158 -5.414 -10.681 -4.024 1.00 11.43 H new ATOM 0 HE2 HIS A 158 -5.750 -9.255 -1.953 1.00 40.20 H new ATOM 46 N ARG A 159 -8.764 -4.046 -4.980 1.00 33.42 N ATOM 47 CA ARG A 159 -8.948 -2.798 -5.658 1.00 12.13 C ATOM 48 C ARG A 159 -7.598 -2.360 -6.185 1.00 71.25 C ATOM 49 O ARG A 159 -6.581 -2.592 -5.528 1.00 42.25 O ATOM 50 CB ARG A 159 -9.491 -1.755 -4.664 1.00 52.21 C ATOM 51 CG ARG A 159 -8.535 -1.473 -3.509 1.00 4.24 C ATOM 52 CD ARG A 159 -9.131 -0.558 -2.464 1.00 54.10 C ATOM 53 NE ARG A 159 -10.343 -1.125 -1.857 1.00 44.24 N ATOM 54 CZ ARG A 159 -10.540 -1.301 -0.534 1.00 21.23 C ATOM 55 NH1 ARG A 159 -9.593 -0.987 0.338 1.00 2.34 N ATOM 56 NH2 ARG A 159 -11.702 -1.782 -0.107 1.00 24.21 N ATOM 0 H ARG A 159 -8.046 -4.019 -4.256 1.00 33.42 H new ATOM 0 HA ARG A 159 -9.658 -2.899 -6.478 1.00 12.13 H new ATOM 0 HB2 ARG A 159 -9.692 -0.825 -5.196 1.00 52.21 H new ATOM 0 HB3 ARG A 159 -10.442 -2.105 -4.263 1.00 52.21 H new ATOM 0 HG2 ARG A 159 -8.251 -2.415 -3.040 1.00 4.24 H new ATOM 0 HG3 ARG A 159 -7.622 -1.024 -3.900 1.00 4.24 H new ATOM 0 HD2 ARG A 159 -8.392 -0.368 -1.686 1.00 54.10 H new ATOM 0 HD3 ARG A 159 -9.370 0.403 -2.919 1.00 54.10 H new ATOM 0 HE ARG A 159 -11.095 -1.408 -2.486 1.00 44.24 H new ATOM 0 HH11 ARG A 159 -8.704 -0.608 0.011 1.00 2.34 H new ATOM 0 HH12 ARG A 159 -9.753 -1.124 1.336 1.00 2.34 H new ATOM 0 HH21 ARG A 159 -12.435 -2.014 -0.777 1.00 24.21 H new ATOM 0 HH22 ARG A 159 -11.861 -1.919 0.891 1.00 24.21 H new ATOM 68 N ARG A 160 -7.565 -1.783 -7.355 1.00 1.10 N ATOM 69 CA ARG A 160 -6.330 -1.283 -7.898 1.00 73.55 C ATOM 70 C ARG A 160 -6.493 0.121 -8.427 1.00 41.50 C ATOM 71 O ARG A 160 -7.209 0.370 -9.397 1.00 31.20 O ATOM 72 CB ARG A 160 -5.708 -2.240 -8.926 1.00 42.24 C ATOM 73 CG ARG A 160 -6.606 -2.650 -10.088 1.00 73.45 C ATOM 74 CD ARG A 160 -5.863 -3.607 -11.005 1.00 42.52 C ATOM 75 NE ARG A 160 -5.395 -4.797 -10.274 1.00 33.11 N ATOM 76 CZ ARG A 160 -4.247 -5.453 -10.522 1.00 3.05 C ATOM 77 NH1 ARG A 160 -3.475 -5.095 -11.541 1.00 5.54 N ATOM 78 NH2 ARG A 160 -3.890 -6.475 -9.759 1.00 75.44 N ATOM 0 H ARG A 160 -8.380 -1.647 -7.952 1.00 1.10 H new ATOM 0 HA ARG A 160 -5.613 -1.232 -7.078 1.00 73.55 H new ATOM 0 HB2 ARG A 160 -4.812 -1.771 -9.333 1.00 42.24 H new ATOM 0 HB3 ARG A 160 -5.387 -3.142 -8.405 1.00 42.24 H new ATOM 0 HG2 ARG A 160 -7.511 -3.125 -9.709 1.00 73.45 H new ATOM 0 HG3 ARG A 160 -6.919 -1.767 -10.646 1.00 73.45 H new ATOM 0 HD2 ARG A 160 -6.518 -3.913 -11.821 1.00 42.52 H new ATOM 0 HD3 ARG A 160 -5.012 -3.096 -11.454 1.00 42.52 H new ATOM 0 HE ARG A 160 -5.987 -5.151 -9.522 1.00 33.11 H new ATOM 0 HH11 ARG A 160 -3.751 -4.318 -12.142 1.00 5.54 H new ATOM 0 HH12 ARG A 160 -2.606 -5.597 -11.723 1.00 5.54 H new ATOM 0 HH21 ARG A 160 -4.486 -6.765 -8.983 1.00 75.44 H new ATOM 0 HH22 ARG A 160 -3.020 -6.972 -9.947 1.00 75.44 H new ATOM 90 N VAL A 161 -5.840 1.024 -7.767 1.00 62.14 N ATOM 91 CA VAL A 161 -5.907 2.435 -8.087 1.00 32.24 C ATOM 92 C VAL A 161 -4.653 2.931 -8.770 1.00 53.43 C ATOM 93 O VAL A 161 -3.553 2.518 -8.431 1.00 3.25 O ATOM 94 CB VAL A 161 -6.173 3.295 -6.839 1.00 20.05 C ATOM 95 CG1 VAL A 161 -7.541 2.985 -6.280 1.00 43.41 C ATOM 96 CG2 VAL A 161 -5.096 3.053 -5.783 1.00 11.04 C ATOM 0 H VAL A 161 -5.233 0.810 -6.976 1.00 62.14 H new ATOM 0 HA VAL A 161 -6.744 2.539 -8.778 1.00 32.24 H new ATOM 0 HB VAL A 161 -6.141 4.346 -7.124 1.00 20.05 H new ATOM 0 HG11 VAL A 161 -7.721 3.598 -5.397 1.00 43.41 H new ATOM 0 HG12 VAL A 161 -8.299 3.202 -7.033 1.00 43.41 H new ATOM 0 HG13 VAL A 161 -7.592 1.931 -6.006 1.00 43.41 H new ATOM 0 HG21 VAL A 161 -5.300 3.669 -4.907 1.00 11.04 H new ATOM 0 HG22 VAL A 161 -5.098 2.002 -5.495 1.00 11.04 H new ATOM 0 HG23 VAL A 161 -4.120 3.315 -6.192 1.00 11.04 H new ATOM 102 N ARG A 162 -4.836 3.779 -9.752 1.00 44.21 N ATOM 103 CA ARG A 162 -3.737 4.417 -10.452 1.00 62.23 C ATOM 104 C ARG A 162 -3.581 5.840 -9.874 1.00 33.14 C ATOM 105 O ARG A 162 -4.489 6.673 -10.007 1.00 4.23 O ATOM 106 CB ARG A 162 -3.998 4.520 -11.974 1.00 65.51 C ATOM 107 CG ARG A 162 -4.137 3.218 -12.801 1.00 4.02 C ATOM 108 CD ARG A 162 -5.322 2.343 -12.407 1.00 3.10 C ATOM 109 NE ARG A 162 -5.382 1.119 -13.223 1.00 12.41 N ATOM 110 CZ ARG A 162 -6.457 0.328 -13.360 1.00 2.22 C ATOM 111 NH1 ARG A 162 -7.592 0.613 -12.731 1.00 2.14 N ATOM 112 NH2 ARG A 162 -6.389 -0.744 -14.135 1.00 10.42 N ATOM 0 H ARG A 162 -5.757 4.051 -10.094 1.00 44.21 H new ATOM 0 HA ARG A 162 -2.837 3.818 -10.314 1.00 62.23 H new ATOM 0 HB2 ARG A 162 -4.912 5.097 -12.113 1.00 65.51 H new ATOM 0 HB3 ARG A 162 -3.185 5.101 -12.409 1.00 65.51 H new ATOM 0 HG2 ARG A 162 -4.229 3.480 -13.855 1.00 4.02 H new ATOM 0 HG3 ARG A 162 -3.221 2.636 -12.696 1.00 4.02 H new ATOM 0 HD2 ARG A 162 -5.244 2.076 -11.353 1.00 3.10 H new ATOM 0 HD3 ARG A 162 -6.247 2.907 -12.525 1.00 3.10 H new ATOM 0 HE ARG A 162 -4.536 0.850 -13.726 1.00 12.41 H new ATOM 0 HH11 ARG A 162 -7.652 1.440 -12.137 1.00 2.14 H new ATOM 0 HH12 ARG A 162 -8.403 0.005 -12.842 1.00 2.14 H new ATOM 0 HH21 ARG A 162 -5.522 -0.965 -14.625 1.00 10.42 H new ATOM 0 HH22 ARG A 162 -7.204 -1.348 -14.242 1.00 10.42 H new ATOM 124 N LEU A 163 -2.471 6.100 -9.229 1.00 73.04 N ATOM 125 CA LEU A 163 -2.228 7.359 -8.537 1.00 5.14 C ATOM 126 C LEU A 163 -1.095 8.141 -9.189 1.00 25.12 C ATOM 127 O LEU A 163 -0.125 7.543 -9.656 1.00 54.24 O ATOM 128 CB LEU A 163 -1.824 7.081 -7.073 1.00 44.30 C ATOM 129 CG LEU A 163 -2.686 6.075 -6.325 1.00 20.23 C ATOM 130 CD1 LEU A 163 -2.200 5.923 -4.917 1.00 51.23 C ATOM 131 CD2 LEU A 163 -4.158 6.445 -6.355 1.00 34.23 C ATOM 0 H LEU A 163 -1.696 5.440 -9.164 1.00 73.04 H new ATOM 0 HA LEU A 163 -3.148 7.941 -8.587 1.00 5.14 H new ATOM 0 HB2 LEU A 163 -0.793 6.726 -7.062 1.00 44.30 H new ATOM 0 HB3 LEU A 163 -1.842 8.024 -6.526 1.00 44.30 H new ATOM 0 HG LEU A 163 -2.592 5.117 -6.836 1.00 20.23 H new ATOM 0 HD11 LEU A 163 -2.825 5.200 -4.392 1.00 51.23 H new ATOM 0 HD12 LEU A 163 -1.168 5.572 -4.924 1.00 51.23 H new ATOM 0 HD13 LEU A 163 -2.253 6.885 -4.408 1.00 51.23 H new ATOM 0 HD21 LEU A 163 -4.732 5.697 -5.808 1.00 34.23 H new ATOM 0 HD22 LEU A 163 -4.297 7.421 -5.890 1.00 34.23 H new ATOM 0 HD23 LEU A 163 -4.503 6.483 -7.388 1.00 34.23 H new ATOM 139 N LEU A 164 -1.273 9.467 -9.280 1.00 0.43 N ATOM 140 CA LEU A 164 -0.196 10.424 -9.640 1.00 31.22 C ATOM 141 C LEU A 164 0.122 10.400 -11.158 1.00 20.32 C ATOM 142 O LEU A 164 1.132 10.905 -11.608 1.00 50.42 O ATOM 143 CB LEU A 164 1.050 10.108 -8.739 1.00 21.32 C ATOM 144 CG LEU A 164 2.068 11.242 -8.393 1.00 70.13 C ATOM 145 CD1 LEU A 164 2.988 11.571 -9.535 1.00 14.02 C ATOM 146 CD2 LEU A 164 1.338 12.485 -7.914 1.00 11.42 C ATOM 0 H LEU A 164 -2.172 9.917 -9.106 1.00 0.43 H new ATOM 0 HA LEU A 164 -0.521 11.447 -9.447 1.00 31.22 H new ATOM 0 HB2 LEU A 164 0.676 9.708 -7.796 1.00 21.32 H new ATOM 0 HB3 LEU A 164 1.608 9.308 -9.225 1.00 21.32 H new ATOM 0 HG LEU A 164 2.697 10.865 -7.587 1.00 70.13 H new ATOM 0 HD11 LEU A 164 3.672 12.365 -9.234 1.00 14.02 H new ATOM 0 HD12 LEU A 164 3.560 10.684 -9.809 1.00 14.02 H new ATOM 0 HD13 LEU A 164 2.401 11.903 -10.391 1.00 14.02 H new ATOM 0 HD21 LEU A 164 2.063 13.264 -7.678 1.00 11.42 H new ATOM 0 HD22 LEU A 164 0.668 12.838 -8.698 1.00 11.42 H new ATOM 0 HD23 LEU A 164 0.759 12.246 -7.022 1.00 11.42 H new ATOM 260 N LEU A 172 2.252 11.232 -2.299 1.00 63.20 N ATOM 261 CA LEU A 172 0.970 10.709 -2.732 1.00 65.30 C ATOM 262 C LEU A 172 -0.121 10.997 -1.742 1.00 51.43 C ATOM 263 O LEU A 172 -1.304 11.020 -2.095 1.00 53.22 O ATOM 264 CB LEU A 172 1.046 9.207 -2.992 1.00 63.25 C ATOM 265 CG LEU A 172 1.929 8.716 -4.145 1.00 44.20 C ATOM 266 CD1 LEU A 172 1.519 9.352 -5.444 1.00 42.20 C ATOM 267 CD2 LEU A 172 3.424 8.896 -3.876 1.00 60.03 C ATOM 0 HA LEU A 172 0.726 11.220 -3.663 1.00 65.30 H new ATOM 0 HB2 LEU A 172 1.395 8.728 -2.077 1.00 63.25 H new ATOM 0 HB3 LEU A 172 0.033 8.848 -3.172 1.00 63.25 H new ATOM 0 HG LEU A 172 1.768 7.641 -4.225 1.00 44.20 H new ATOM 0 HD11 LEU A 172 2.161 8.987 -6.246 1.00 42.20 H new ATOM 0 HD12 LEU A 172 0.483 9.096 -5.663 1.00 42.20 H new ATOM 0 HD13 LEU A 172 1.616 10.435 -5.366 1.00 42.20 H new ATOM 0 HD21 LEU A 172 3.994 8.529 -4.730 1.00 60.03 H new ATOM 0 HD22 LEU A 172 3.641 9.953 -3.722 1.00 60.03 H new ATOM 0 HD23 LEU A 172 3.704 8.334 -2.985 1.00 60.03 H new ATOM 275 N GLY A 173 0.260 11.189 -0.511 1.00 32.31 N ATOM 276 CA GLY A 173 -0.694 11.514 0.495 1.00 50.10 C ATOM 277 C GLY A 173 -1.188 10.300 1.224 1.00 25.42 C ATOM 278 O GLY A 173 -2.203 10.350 1.905 1.00 12.34 O ATOM 0 H GLY A 173 1.225 11.125 -0.186 1.00 32.31 H new ATOM 0 HA2 GLY A 173 -0.246 12.206 1.208 1.00 50.10 H new ATOM 0 HA3 GLY A 173 -1.539 12.030 0.039 1.00 50.10 H new ATOM 282 N PHE A 174 -0.494 9.207 1.071 1.00 22.14 N ATOM 283 CA PHE A 174 -0.790 8.038 1.832 1.00 30.33 C ATOM 284 C PHE A 174 0.537 7.448 2.221 1.00 25.51 C ATOM 285 O PHE A 174 1.538 7.666 1.523 1.00 2.01 O ATOM 286 CB PHE A 174 -1.693 7.010 1.047 1.00 43.14 C ATOM 287 CG PHE A 174 -1.036 6.236 -0.101 1.00 1.41 C ATOM 288 CD1 PHE A 174 -0.769 6.832 -1.330 1.00 41.51 C ATOM 289 CD2 PHE A 174 -0.679 4.900 0.071 1.00 74.21 C ATOM 290 CE1 PHE A 174 -0.165 6.113 -2.351 1.00 74.42 C ATOM 291 CE2 PHE A 174 -0.069 4.191 -0.948 1.00 71.55 C ATOM 292 CZ PHE A 174 0.186 4.803 -2.158 1.00 13.14 C ATOM 0 H PHE A 174 0.285 9.107 0.420 1.00 22.14 H new ATOM 0 HA PHE A 174 -1.380 8.294 2.712 1.00 30.33 H new ATOM 0 HB2 PHE A 174 -2.082 6.286 1.763 1.00 43.14 H new ATOM 0 HB3 PHE A 174 -2.549 7.551 0.644 1.00 43.14 H new ATOM 0 HD1 PHE A 174 -1.035 7.866 -1.491 1.00 41.51 H new ATOM 0 HD2 PHE A 174 -0.881 4.412 1.013 1.00 74.21 H new ATOM 0 HE1 PHE A 174 0.029 6.588 -3.301 1.00 74.42 H new ATOM 0 HE2 PHE A 174 0.208 3.158 -0.796 1.00 71.55 H new ATOM 0 HZ PHE A 174 0.663 4.249 -2.953 1.00 13.14 H new ATOM 302 N TYR A 175 0.577 6.753 3.305 1.00 45.15 N ATOM 303 CA TYR A 175 1.811 6.180 3.780 1.00 64.45 C ATOM 304 C TYR A 175 1.655 4.730 4.044 1.00 50.53 C ATOM 305 O TYR A 175 0.572 4.267 4.430 1.00 71.52 O ATOM 306 CB TYR A 175 2.298 6.881 5.042 1.00 30.24 C ATOM 307 CG TYR A 175 2.693 8.315 4.836 1.00 31.42 C ATOM 308 CD1 TYR A 175 3.994 8.638 4.482 1.00 22.04 C ATOM 309 CD2 TYR A 175 1.780 9.345 5.000 1.00 45.01 C ATOM 310 CE1 TYR A 175 4.378 9.943 4.293 1.00 45.00 C ATOM 311 CE2 TYR A 175 2.161 10.658 4.813 1.00 24.44 C ATOM 312 CZ TYR A 175 3.462 10.950 4.460 1.00 42.14 C ATOM 313 OH TYR A 175 3.849 12.258 4.275 1.00 34.41 O ATOM 0 H TYR A 175 -0.234 6.560 3.892 1.00 45.15 H new ATOM 0 HA TYR A 175 2.555 6.320 2.996 1.00 64.45 H new ATOM 0 HB2 TYR A 175 1.511 6.837 5.795 1.00 30.24 H new ATOM 0 HB3 TYR A 175 3.152 6.334 5.441 1.00 30.24 H new ATOM 0 HD1 TYR A 175 4.719 7.848 4.352 1.00 22.04 H new ATOM 0 HD2 TYR A 175 0.761 9.118 5.277 1.00 45.01 H new ATOM 0 HE1 TYR A 175 5.395 10.175 4.014 1.00 45.00 H new ATOM 0 HE2 TYR A 175 1.443 11.454 4.943 1.00 24.44 H new ATOM 0 HH TYR A 175 3.084 12.851 4.430 1.00 34.41 H new ATOM 323 N ILE A 176 2.718 4.013 3.868 1.00 34.41 N ATOM 324 CA ILE A 176 2.716 2.602 4.063 1.00 72.22 C ATOM 325 C ILE A 176 3.529 2.237 5.293 1.00 4.24 C ATOM 326 O ILE A 176 4.235 3.081 5.864 1.00 42.42 O ATOM 327 CB ILE A 176 3.257 1.842 2.829 1.00 1.55 C ATOM 328 CG1 ILE A 176 4.707 2.261 2.529 1.00 72.24 C ATOM 329 CG2 ILE A 176 2.350 2.081 1.622 1.00 73.15 C ATOM 330 CD1 ILE A 176 5.350 1.521 1.395 1.00 2.11 C ATOM 0 H ILE A 176 3.619 4.395 3.582 1.00 34.41 H new ATOM 0 HA ILE A 176 1.679 2.299 4.209 1.00 72.22 H new ATOM 0 HB ILE A 176 3.258 0.774 3.046 1.00 1.55 H new ATOM 0 HG12 ILE A 176 4.724 3.328 2.305 1.00 72.24 H new ATOM 0 HG13 ILE A 176 5.307 2.114 3.427 1.00 72.24 H new ATOM 0 HG21 ILE A 176 2.742 1.541 0.760 1.00 73.15 H new ATOM 0 HG22 ILE A 176 1.344 1.726 1.847 1.00 73.15 H new ATOM 0 HG23 ILE A 176 2.317 3.147 1.397 1.00 73.15 H new ATOM 0 HD11 ILE A 176 6.369 1.882 1.256 1.00 2.11 H new ATOM 0 HD12 ILE A 176 5.370 0.455 1.621 1.00 2.11 H new ATOM 0 HD13 ILE A 176 4.779 1.687 0.482 1.00 2.11 H new ATOM 337 N ARG A 177 3.414 1.012 5.691 1.00 63.41 N ATOM 338 CA ARG A 177 4.080 0.470 6.856 1.00 42.40 C ATOM 339 C ARG A 177 4.315 -1.001 6.656 1.00 24.21 C ATOM 340 O ARG A 177 3.593 -1.648 5.904 1.00 4.52 O ATOM 341 CB ARG A 177 3.234 0.674 8.114 1.00 50.05 C ATOM 342 CG ARG A 177 1.788 0.259 7.919 1.00 32.13 C ATOM 343 CD ARG A 177 1.022 0.158 9.214 1.00 43.23 C ATOM 344 NE ARG A 177 -0.412 -0.082 8.966 1.00 2.42 N ATOM 345 CZ ARG A 177 -1.222 -0.817 9.729 1.00 45.02 C ATOM 346 NH1 ARG A 177 -0.740 -1.477 10.788 1.00 1.41 N ATOM 347 NH2 ARG A 177 -2.517 -0.905 9.415 1.00 24.20 N ATOM 0 H ARG A 177 2.836 0.327 5.204 1.00 63.41 H new ATOM 0 HA ARG A 177 5.029 0.991 6.984 1.00 42.40 H new ATOM 0 HB2 ARG A 177 3.665 0.100 8.934 1.00 50.05 H new ATOM 0 HB3 ARG A 177 3.271 1.724 8.406 1.00 50.05 H new ATOM 0 HG2 ARG A 177 1.294 0.979 7.267 1.00 32.13 H new ATOM 0 HG3 ARG A 177 1.758 -0.704 7.410 1.00 32.13 H new ATOM 0 HD2 ARG A 177 1.430 -0.652 9.819 1.00 43.23 H new ATOM 0 HD3 ARG A 177 1.146 1.077 9.786 1.00 43.23 H new ATOM 0 HE ARG A 177 -0.820 0.352 8.138 1.00 2.42 H new ATOM 0 HH11 ARG A 177 0.253 -1.420 11.016 1.00 1.41 H new ATOM 0 HH12 ARG A 177 -1.365 -2.037 11.367 1.00 1.41 H new ATOM 0 HH21 ARG A 177 -2.878 -0.413 8.598 1.00 24.20 H new ATOM 0 HH22 ARG A 177 -3.145 -1.465 9.992 1.00 24.20 H new ATOM 359 N ASP A 178 5.296 -1.517 7.321 1.00 0.11 N ATOM 360 CA ASP A 178 5.645 -2.922 7.218 1.00 33.20 C ATOM 361 C ASP A 178 5.277 -3.633 8.487 1.00 54.25 C ATOM 362 O ASP A 178 5.473 -3.108 9.595 1.00 64.20 O ATOM 363 CB ASP A 178 7.147 -3.080 6.959 1.00 14.41 C ATOM 364 CG ASP A 178 7.645 -4.526 6.995 1.00 71.42 C ATOM 365 OD1 ASP A 178 8.055 -5.002 8.088 1.00 74.21 O ATOM 366 OD2 ASP A 178 7.676 -5.178 5.954 1.00 63.23 O ATOM 0 H ASP A 178 5.889 -0.985 7.958 1.00 0.11 H new ATOM 0 HA ASP A 178 5.094 -3.358 6.385 1.00 33.20 H new ATOM 0 HB2 ASP A 178 7.383 -2.651 5.985 1.00 14.41 H new ATOM 0 HB3 ASP A 178 7.695 -2.501 7.703 1.00 14.41 H new ATOM 371 N GLY A 179 4.741 -4.775 8.337 1.00 44.42 N ATOM 372 CA GLY A 179 4.400 -5.616 9.430 1.00 61.53 C ATOM 373 C GLY A 179 4.497 -7.009 8.964 1.00 34.43 C ATOM 374 O GLY A 179 4.436 -7.246 7.775 1.00 20.33 O ATOM 0 H GLY A 179 4.516 -5.173 7.425 1.00 44.42 H new ATOM 0 HA2 GLY A 179 5.073 -5.445 10.270 1.00 61.53 H new ATOM 0 HA3 GLY A 179 3.391 -5.399 9.781 1.00 61.53 H new ATOM 378 N THR A 180 4.676 -7.943 9.827 1.00 42.51 N ATOM 379 CA THR A 180 4.752 -9.274 9.340 1.00 12.04 C ATOM 380 C THR A 180 3.320 -9.793 9.261 1.00 15.24 C ATOM 381 O THR A 180 2.607 -9.834 10.262 1.00 52.02 O ATOM 382 CB THR A 180 5.565 -10.137 10.290 1.00 73.55 C ATOM 383 OG1 THR A 180 6.399 -9.273 11.098 1.00 31.23 O ATOM 384 CG2 THR A 180 6.490 -11.050 9.499 1.00 50.12 C ATOM 0 H THR A 180 4.770 -7.822 10.835 1.00 42.51 H new ATOM 0 HA THR A 180 5.238 -9.305 8.365 1.00 12.04 H new ATOM 0 HB THR A 180 4.886 -10.728 10.904 1.00 73.55 H new ATOM 0 HG1 THR A 180 6.929 -9.816 11.718 1.00 31.23 H new ATOM 0 HG21 THR A 180 7.069 -11.665 10.187 1.00 50.12 H new ATOM 0 HG22 THR A 180 5.897 -11.693 8.848 1.00 50.12 H new ATOM 0 HG23 THR A 180 7.167 -10.447 8.894 1.00 50.12 H new ATOM 390 N SER A 181 2.916 -10.184 8.104 1.00 45.23 N ATOM 391 CA SER A 181 1.589 -10.618 7.883 1.00 45.54 C ATOM 392 C SER A 181 1.522 -12.101 8.109 1.00 31.02 C ATOM 393 O SER A 181 2.242 -12.858 7.462 1.00 51.22 O ATOM 394 CB SER A 181 1.153 -10.269 6.450 1.00 3.21 C ATOM 395 OG SER A 181 -0.215 -10.595 6.224 1.00 54.42 O ATOM 0 H SER A 181 3.509 -10.210 7.275 1.00 45.23 H new ATOM 0 HA SER A 181 0.913 -10.116 8.575 1.00 45.54 H new ATOM 0 HB2 SER A 181 1.308 -9.205 6.271 1.00 3.21 H new ATOM 0 HB3 SER A 181 1.778 -10.807 5.738 1.00 3.21 H new ATOM 0 HG SER A 181 -0.587 -9.993 5.546 1.00 54.42 H new ATOM 517 N LYS A 191 3.786 -16.214 8.397 1.00 61.25 N ATOM 518 CA LYS A 191 4.174 -14.881 8.720 1.00 5.43 C ATOM 519 C LYS A 191 5.300 -14.447 7.789 1.00 33.44 C ATOM 520 O LYS A 191 6.319 -15.129 7.680 1.00 12.42 O ATOM 521 CB LYS A 191 4.634 -14.870 10.163 1.00 42.23 C ATOM 522 CG LYS A 191 4.717 -13.526 10.799 1.00 41.04 C ATOM 523 CD LYS A 191 5.126 -13.618 12.261 1.00 53.11 C ATOM 524 CE LYS A 191 4.101 -14.388 13.089 1.00 22.24 C ATOM 525 NZ LYS A 191 4.478 -14.469 14.517 1.00 14.12 N ATOM 0 HA LYS A 191 3.343 -14.187 8.596 1.00 5.43 H new ATOM 0 HB2 LYS A 191 3.953 -15.488 10.748 1.00 42.23 H new ATOM 0 HB3 LYS A 191 5.616 -15.339 10.217 1.00 42.23 H new ATOM 0 HG2 LYS A 191 5.437 -12.912 10.258 1.00 41.04 H new ATOM 0 HG3 LYS A 191 3.751 -13.027 10.722 1.00 41.04 H new ATOM 0 HD2 LYS A 191 6.097 -14.108 12.337 1.00 53.11 H new ATOM 0 HD3 LYS A 191 5.243 -12.614 12.670 1.00 53.11 H new ATOM 0 HE2 LYS A 191 3.128 -13.905 12.999 1.00 22.24 H new ATOM 0 HE3 LYS A 191 3.995 -15.395 12.686 1.00 22.24 H new ATOM 0 HZ1 LYS A 191 3.752 -15.001 15.038 1.00 14.12 H new ATOM 0 HZ2 LYS A 191 5.394 -14.954 14.607 1.00 14.12 H new ATOM 0 HZ3 LYS A 191 4.554 -13.510 14.911 1.00 14.12 H new ATOM 539 N GLN A 192 5.118 -13.337 7.136 1.00 2.42 N ATOM 540 CA GLN A 192 6.084 -12.838 6.153 1.00 44.00 C ATOM 541 C GLN A 192 5.971 -11.325 6.116 1.00 35.32 C ATOM 542 O GLN A 192 4.985 -10.800 6.610 1.00 31.33 O ATOM 543 CB GLN A 192 5.754 -13.396 4.756 1.00 43.32 C ATOM 544 CG GLN A 192 4.494 -12.815 4.124 1.00 72.24 C ATOM 545 CD GLN A 192 4.254 -13.332 2.726 1.00 61.45 C ATOM 546 OE1 GLN A 192 4.594 -14.466 2.397 1.00 12.23 O ATOM 547 NE2 GLN A 192 3.719 -12.490 1.879 1.00 2.21 N ATOM 0 H GLN A 192 4.301 -12.739 7.257 1.00 2.42 H new ATOM 0 HA GLN A 192 7.091 -13.150 6.430 1.00 44.00 H new ATOM 0 HB2 GLN A 192 6.598 -13.205 4.094 1.00 43.32 H new ATOM 0 HB3 GLN A 192 5.643 -14.478 4.828 1.00 43.32 H new ATOM 0 HG2 GLN A 192 3.634 -13.056 4.749 1.00 72.24 H new ATOM 0 HG3 GLN A 192 4.574 -11.728 4.097 1.00 72.24 H new ATOM 0 HE21 GLN A 192 3.449 -11.557 2.189 1.00 2.21 H new ATOM 0 HE22 GLN A 192 3.572 -12.767 0.909 1.00 2.21 H new ATOM 555 N PRO A 193 6.954 -10.587 5.557 1.00 63.43 N ATOM 556 CA PRO A 193 6.836 -9.137 5.447 1.00 25.21 C ATOM 557 C PRO A 193 5.594 -8.754 4.627 1.00 14.50 C ATOM 558 O PRO A 193 5.330 -9.326 3.542 1.00 0.43 O ATOM 559 CB PRO A 193 8.125 -8.706 4.721 1.00 72.12 C ATOM 560 CG PRO A 193 8.705 -9.962 4.153 1.00 13.03 C ATOM 561 CD PRO A 193 8.230 -11.086 5.023 1.00 43.20 C ATOM 0 HA PRO A 193 6.722 -8.652 6.416 1.00 25.21 H new ATOM 0 HB2 PRO A 193 7.909 -7.983 3.934 1.00 72.12 H new ATOM 0 HB3 PRO A 193 8.822 -8.229 5.410 1.00 72.12 H new ATOM 0 HG2 PRO A 193 8.381 -10.107 3.122 1.00 13.03 H new ATOM 0 HG3 PRO A 193 9.794 -9.915 4.141 1.00 13.03 H new ATOM 0 HD2 PRO A 193 8.095 -12.006 4.454 1.00 43.20 H new ATOM 0 HD3 PRO A 193 8.941 -11.306 5.820 1.00 43.20 H new ATOM 569 N GLY A 194 4.842 -7.836 5.152 1.00 34.54 N ATOM 570 CA GLY A 194 3.655 -7.390 4.532 1.00 1.44 C ATOM 571 C GLY A 194 3.503 -5.929 4.720 1.00 14.21 C ATOM 572 O GLY A 194 3.735 -5.405 5.812 1.00 61.32 O ATOM 0 H GLY A 194 5.048 -7.375 6.038 1.00 34.54 H new ATOM 0 HA2 GLY A 194 3.679 -7.627 3.468 1.00 1.44 H new ATOM 0 HA3 GLY A 194 2.796 -7.911 4.955 1.00 1.44 H new ATOM 576 N ILE A 195 3.149 -5.263 3.695 1.00 55.33 N ATOM 577 CA ILE A 195 3.003 -3.869 3.762 1.00 31.01 C ATOM 578 C ILE A 195 1.545 -3.483 3.808 1.00 50.33 C ATOM 579 O ILE A 195 0.724 -3.994 3.055 1.00 15.24 O ATOM 580 CB ILE A 195 3.799 -3.116 2.648 1.00 13.01 C ATOM 581 CG1 ILE A 195 5.321 -3.270 2.872 1.00 14.35 C ATOM 582 CG2 ILE A 195 3.424 -1.647 2.573 1.00 4.51 C ATOM 583 CD1 ILE A 195 5.913 -4.625 2.541 1.00 35.01 C ATOM 0 H ILE A 195 2.951 -5.672 2.782 1.00 55.33 H new ATOM 0 HA ILE A 195 3.455 -3.541 4.698 1.00 31.01 H new ATOM 0 HB ILE A 195 3.530 -3.571 1.695 1.00 13.01 H new ATOM 0 HG12 ILE A 195 5.833 -2.517 2.273 1.00 14.35 H new ATOM 0 HG13 ILE A 195 5.538 -3.048 3.917 1.00 14.35 H new ATOM 0 HG21 ILE A 195 4.002 -1.164 1.785 1.00 4.51 H new ATOM 0 HG22 ILE A 195 2.361 -1.554 2.352 1.00 4.51 H new ATOM 0 HG23 ILE A 195 3.640 -1.167 3.528 1.00 4.51 H new ATOM 0 HD11 ILE A 195 6.985 -4.612 2.738 1.00 35.01 H new ATOM 0 HD12 ILE A 195 5.440 -5.389 3.158 1.00 35.01 H new ATOM 0 HD13 ILE A 195 5.740 -4.850 1.489 1.00 35.01 H new ATOM 590 N PHE A 196 1.243 -2.613 4.719 1.00 33.10 N ATOM 591 CA PHE A 196 -0.098 -2.152 4.966 1.00 22.42 C ATOM 592 C PHE A 196 -0.088 -0.644 4.861 1.00 63.42 C ATOM 593 O PHE A 196 0.985 -0.029 4.824 1.00 14.21 O ATOM 594 CB PHE A 196 -0.537 -2.540 6.399 1.00 1.40 C ATOM 595 CG PHE A 196 -0.448 -4.012 6.737 1.00 4.42 C ATOM 596 CD1 PHE A 196 0.767 -4.585 7.100 1.00 10.54 C ATOM 597 CD2 PHE A 196 -1.571 -4.812 6.708 1.00 54.04 C ATOM 598 CE1 PHE A 196 0.854 -5.924 7.423 1.00 60.51 C ATOM 599 CE2 PHE A 196 -1.489 -6.154 7.030 1.00 53.01 C ATOM 600 CZ PHE A 196 -0.275 -6.710 7.387 1.00 21.13 C ATOM 0 H PHE A 196 1.938 -2.188 5.332 1.00 33.10 H new ATOM 0 HA PHE A 196 -0.785 -2.600 4.248 1.00 22.42 H new ATOM 0 HB2 PHE A 196 0.076 -1.985 7.110 1.00 1.40 H new ATOM 0 HB3 PHE A 196 -1.567 -2.214 6.544 1.00 1.40 H new ATOM 0 HD1 PHE A 196 1.656 -3.972 7.129 1.00 10.54 H new ATOM 0 HD2 PHE A 196 -2.524 -4.386 6.431 1.00 54.04 H new ATOM 0 HE1 PHE A 196 1.805 -6.353 7.703 1.00 60.51 H new ATOM 0 HE2 PHE A 196 -2.376 -6.770 7.003 1.00 53.01 H new ATOM 0 HZ PHE A 196 -0.213 -7.759 7.637 1.00 21.13 H new ATOM 610 N ILE A 197 -1.239 -0.054 4.809 1.00 34.23 N ATOM 611 CA ILE A 197 -1.349 1.387 4.794 1.00 52.34 C ATOM 612 C ILE A 197 -1.338 1.898 6.232 1.00 5.34 C ATOM 613 O ILE A 197 -1.979 1.339 7.093 1.00 62.54 O ATOM 614 CB ILE A 197 -2.601 1.871 4.023 1.00 71.40 C ATOM 615 CG1 ILE A 197 -2.514 1.369 2.575 1.00 45.22 C ATOM 616 CG2 ILE A 197 -2.717 3.402 4.067 1.00 54.41 C ATOM 617 CD1 ILE A 197 -3.627 1.840 1.680 1.00 3.51 C ATOM 0 H ILE A 197 -2.132 -0.546 4.776 1.00 34.23 H new ATOM 0 HA ILE A 197 -0.494 1.799 4.258 1.00 52.34 H new ATOM 0 HB ILE A 197 -3.496 1.466 4.495 1.00 71.40 H new ATOM 0 HG12 ILE A 197 -1.563 1.690 2.150 1.00 45.22 H new ATOM 0 HG13 ILE A 197 -2.508 0.279 2.582 1.00 45.22 H new ATOM 0 HG21 ILE A 197 -3.605 3.716 3.518 1.00 54.41 H new ATOM 0 HG22 ILE A 197 -2.796 3.731 5.103 1.00 54.41 H new ATOM 0 HG23 ILE A 197 -1.833 3.847 3.611 1.00 54.41 H new ATOM 0 HD11 ILE A 197 -3.483 1.437 0.678 1.00 3.51 H new ATOM 0 HD12 ILE A 197 -4.583 1.496 2.076 1.00 3.51 H new ATOM 0 HD13 ILE A 197 -3.623 2.929 1.637 1.00 3.51 H new ATOM 624 N SER A 198 -0.546 2.882 6.503 1.00 53.20 N ATOM 625 CA SER A 198 -0.434 3.378 7.850 1.00 24.14 C ATOM 626 C SER A 198 -1.196 4.673 8.091 1.00 52.13 C ATOM 627 O SER A 198 -1.691 4.899 9.204 1.00 22.11 O ATOM 628 CB SER A 198 1.041 3.482 8.259 1.00 13.44 C ATOM 629 OG SER A 198 1.226 4.134 9.494 1.00 1.30 O ATOM 0 H SER A 198 0.035 3.363 5.817 1.00 53.20 H new ATOM 0 HA SER A 198 -0.920 2.649 8.498 1.00 24.14 H new ATOM 0 HB2 SER A 198 1.468 2.481 8.316 1.00 13.44 H new ATOM 0 HB3 SER A 198 1.590 4.019 7.485 1.00 13.44 H new ATOM 0 HG SER A 198 2.182 4.170 9.705 1.00 1.30 H new ATOM 635 N ARG A 199 -1.327 5.505 7.080 1.00 54.44 N ATOM 636 CA ARG A 199 -1.969 6.791 7.277 1.00 52.52 C ATOM 637 C ARG A 199 -2.349 7.446 5.968 1.00 60.11 C ATOM 638 O ARG A 199 -1.645 7.303 4.961 1.00 12.13 O ATOM 639 CB ARG A 199 -1.046 7.717 8.099 1.00 70.11 C ATOM 640 CG ARG A 199 -1.564 9.130 8.308 1.00 43.03 C ATOM 641 CD ARG A 199 -0.669 9.918 9.235 1.00 15.31 C ATOM 642 NE ARG A 199 0.712 9.997 8.742 1.00 15.31 N ATOM 643 CZ ARG A 199 1.464 11.102 8.765 1.00 53.41 C ATOM 644 NH1 ARG A 199 0.954 12.254 9.199 1.00 32.45 N ATOM 645 NH2 ARG A 199 2.724 11.054 8.356 1.00 70.24 N ATOM 0 H ARG A 199 -1.005 5.322 6.130 1.00 54.44 H new ATOM 0 HA ARG A 199 -2.894 6.619 7.827 1.00 52.52 H new ATOM 0 HB2 ARG A 199 -0.877 7.261 9.075 1.00 70.11 H new ATOM 0 HB3 ARG A 199 -0.078 7.772 7.601 1.00 70.11 H new ATOM 0 HG2 ARG A 199 -1.632 9.639 7.347 1.00 43.03 H new ATOM 0 HG3 ARG A 199 -2.572 9.091 8.720 1.00 43.03 H new ATOM 0 HD2 ARG A 199 -1.069 10.925 9.353 1.00 15.31 H new ATOM 0 HD3 ARG A 199 -0.674 9.455 10.222 1.00 15.31 H new ATOM 0 HE ARG A 199 1.127 9.149 8.355 1.00 15.31 H new ATOM 0 HH11 ARG A 199 -0.015 12.296 9.516 1.00 32.45 H new ATOM 0 HH12 ARG A 199 1.532 13.094 9.214 1.00 32.45 H new ATOM 0 HH21 ARG A 199 3.119 10.174 8.024 1.00 70.24 H new ATOM 0 HH22 ARG A 199 3.298 11.897 8.373 1.00 70.24 H new ATOM 657 N LEU A 200 -3.469 8.132 5.991 1.00 43.14 N ATOM 658 CA LEU A 200 -3.922 8.934 4.889 1.00 44.22 C ATOM 659 C LEU A 200 -3.743 10.381 5.216 1.00 44.05 C ATOM 660 O LEU A 200 -3.953 10.804 6.364 1.00 72.40 O ATOM 661 CB LEU A 200 -5.406 8.730 4.600 1.00 72.12 C ATOM 662 CG LEU A 200 -5.850 7.417 4.000 1.00 13.22 C ATOM 663 CD1 LEU A 200 -7.356 7.452 3.845 1.00 23.44 C ATOM 664 CD2 LEU A 200 -5.199 7.223 2.640 1.00 22.43 C ATOM 0 H LEU A 200 -4.099 8.145 6.793 1.00 43.14 H new ATOM 0 HA LEU A 200 -3.336 8.633 4.021 1.00 44.22 H new ATOM 0 HB2 LEU A 200 -5.948 8.867 5.536 1.00 72.12 H new ATOM 0 HB3 LEU A 200 -5.725 9.526 3.928 1.00 72.12 H new ATOM 0 HG LEU A 200 -5.556 6.591 4.648 1.00 13.22 H new ATOM 0 HD11 LEU A 200 -7.699 6.512 3.413 1.00 23.44 H new ATOM 0 HD12 LEU A 200 -7.819 7.593 4.822 1.00 23.44 H new ATOM 0 HD13 LEU A 200 -7.635 8.276 3.189 1.00 23.44 H new ATOM 0 HD21 LEU A 200 -5.524 6.274 2.213 1.00 22.43 H new ATOM 0 HD22 LEU A 200 -5.491 8.038 1.977 1.00 22.43 H new ATOM 0 HD23 LEU A 200 -4.115 7.218 2.753 1.00 22.43 H new ATOM 672 N VAL A 201 -3.347 11.127 4.248 1.00 4.11 N ATOM 673 CA VAL A 201 -3.310 12.539 4.368 1.00 33.53 C ATOM 674 C VAL A 201 -4.413 13.055 3.476 1.00 64.33 C ATOM 675 O VAL A 201 -4.366 12.836 2.250 1.00 41.33 O ATOM 676 CB VAL A 201 -1.960 13.130 3.887 1.00 24.24 C ATOM 677 CG1 VAL A 201 -1.924 14.634 4.098 1.00 43.40 C ATOM 678 CG2 VAL A 201 -0.796 12.469 4.594 1.00 32.22 C ATOM 0 H VAL A 201 -3.037 10.772 3.344 1.00 4.11 H new ATOM 0 HA VAL A 201 -3.431 12.828 5.412 1.00 33.53 H new ATOM 0 HB VAL A 201 -1.869 12.929 2.819 1.00 24.24 H new ATOM 0 HG11 VAL A 201 -0.967 15.027 3.753 1.00 43.40 H new ATOM 0 HG12 VAL A 201 -2.732 15.100 3.534 1.00 43.40 H new ATOM 0 HG13 VAL A 201 -2.047 14.856 5.158 1.00 43.40 H new ATOM 0 HG21 VAL A 201 0.139 12.902 4.238 1.00 32.22 H new ATOM 0 HG22 VAL A 201 -0.884 12.629 5.669 1.00 32.22 H new ATOM 0 HG23 VAL A 201 -0.803 11.399 4.385 1.00 32.22 H new ATOM 684 N PRO A 202 -5.444 13.683 4.053 1.00 13.24 N ATOM 685 CA PRO A 202 -6.552 14.229 3.284 1.00 53.05 C ATOM 686 C PRO A 202 -6.044 15.158 2.184 1.00 24.23 C ATOM 687 O PRO A 202 -5.280 16.102 2.454 1.00 30.40 O ATOM 688 CB PRO A 202 -7.356 15.010 4.318 1.00 3.21 C ATOM 689 CG PRO A 202 -7.049 14.340 5.606 1.00 1.13 C ATOM 690 CD PRO A 202 -5.628 13.881 5.500 1.00 3.14 C ATOM 0 HA PRO A 202 -7.138 13.459 2.782 1.00 53.05 H new ATOM 0 HB2 PRO A 202 -7.065 16.060 4.337 1.00 3.21 H new ATOM 0 HB3 PRO A 202 -8.423 14.979 4.098 1.00 3.21 H new ATOM 0 HG2 PRO A 202 -7.177 15.026 6.443 1.00 1.13 H new ATOM 0 HG3 PRO A 202 -7.720 13.498 5.778 1.00 1.13 H new ATOM 0 HD2 PRO A 202 -4.935 14.623 5.896 1.00 3.14 H new ATOM 0 HD3 PRO A 202 -5.460 12.959 6.057 1.00 3.14 H new ATOM 698 N GLY A 203 -6.456 14.887 0.968 1.00 4.34 N ATOM 699 CA GLY A 203 -5.971 15.642 -0.168 1.00 62.44 C ATOM 700 C GLY A 203 -5.076 14.801 -1.052 1.00 63.31 C ATOM 701 O GLY A 203 -4.803 15.160 -2.209 1.00 21.11 O ATOM 0 H GLY A 203 -7.124 14.152 0.738 1.00 4.34 H new ATOM 0 HA2 GLY A 203 -6.816 16.010 -0.749 1.00 62.44 H new ATOM 0 HA3 GLY A 203 -5.421 16.515 0.182 1.00 62.44 H new ATOM 705 N GLY A 204 -4.615 13.682 -0.513 1.00 71.31 N ATOM 706 CA GLY A 204 -3.779 12.781 -1.266 1.00 0.43 C ATOM 707 C GLY A 204 -4.581 11.951 -2.245 1.00 13.20 C ATOM 708 O GLY A 204 -5.770 11.746 -2.041 1.00 25.53 O ATOM 0 H GLY A 204 -4.810 13.383 0.443 1.00 71.31 H new ATOM 0 HA2 GLY A 204 -3.025 13.352 -1.807 1.00 0.43 H new ATOM 0 HA3 GLY A 204 -3.248 12.121 -0.581 1.00 0.43 H new ATOM 712 N LEU A 205 -3.913 11.438 -3.269 1.00 24.04 N ATOM 713 CA LEU A 205 -4.527 10.680 -4.349 1.00 22.32 C ATOM 714 C LEU A 205 -5.361 9.506 -3.832 1.00 20.42 C ATOM 715 O LEU A 205 -6.517 9.320 -4.227 1.00 55.43 O ATOM 716 CB LEU A 205 -3.441 10.154 -5.311 1.00 12.32 C ATOM 717 CG LEU A 205 -2.671 11.169 -6.195 1.00 22.31 C ATOM 718 CD1 LEU A 205 -3.618 11.963 -7.066 1.00 33.54 C ATOM 719 CD2 LEU A 205 -1.762 12.091 -5.384 1.00 0.23 C ATOM 0 H LEU A 205 -2.904 11.540 -3.374 1.00 24.04 H new ATOM 0 HA LEU A 205 -5.198 11.358 -4.876 1.00 22.32 H new ATOM 0 HB2 LEU A 205 -2.707 9.612 -4.715 1.00 12.32 H new ATOM 0 HB3 LEU A 205 -3.911 9.429 -5.975 1.00 12.32 H new ATOM 0 HG LEU A 205 -2.019 10.583 -6.843 1.00 22.31 H new ATOM 0 HD11 LEU A 205 -3.050 12.666 -7.674 1.00 33.54 H new ATOM 0 HD12 LEU A 205 -4.170 11.284 -7.716 1.00 33.54 H new ATOM 0 HD13 LEU A 205 -4.318 12.512 -6.436 1.00 33.54 H new ATOM 0 HD21 LEU A 205 -1.249 12.779 -6.056 1.00 0.23 H new ATOM 0 HD22 LEU A 205 -2.361 12.658 -4.672 1.00 0.23 H new ATOM 0 HD23 LEU A 205 -1.026 11.494 -4.845 1.00 0.23 H new ATOM 727 N ALA A 206 -4.775 8.737 -2.940 1.00 2.43 N ATOM 728 CA ALA A 206 -5.433 7.562 -2.381 1.00 74.33 C ATOM 729 C ALA A 206 -6.598 7.955 -1.480 1.00 34.43 C ATOM 730 O ALA A 206 -7.607 7.247 -1.394 1.00 5.53 O ATOM 731 CB ALA A 206 -4.433 6.743 -1.607 1.00 41.35 C ATOM 0 H ALA A 206 -3.835 8.902 -2.580 1.00 2.43 H new ATOM 0 HA ALA A 206 -5.833 6.969 -3.204 1.00 74.33 H new ATOM 0 HB1 ALA A 206 -4.927 5.865 -1.190 1.00 41.35 H new ATOM 0 HB2 ALA A 206 -3.630 6.426 -2.272 1.00 41.35 H new ATOM 0 HB3 ALA A 206 -4.018 7.345 -0.798 1.00 41.35 H new ATOM 737 N GLU A 207 -6.457 9.082 -0.831 1.00 34.05 N ATOM 738 CA GLU A 207 -7.450 9.564 0.094 1.00 45.53 C ATOM 739 C GLU A 207 -8.644 10.133 -0.693 1.00 13.22 C ATOM 740 O GLU A 207 -9.790 9.831 -0.393 1.00 65.23 O ATOM 741 CB GLU A 207 -6.787 10.601 1.033 1.00 40.31 C ATOM 742 CG GLU A 207 -7.594 11.042 2.260 1.00 2.54 C ATOM 743 CD GLU A 207 -8.821 11.849 1.951 1.00 21.23 C ATOM 744 OE1 GLU A 207 -8.693 12.999 1.489 1.00 31.03 O ATOM 745 OE2 GLU A 207 -9.933 11.342 2.148 1.00 31.43 O ATOM 0 H GLU A 207 -5.647 9.694 -0.930 1.00 34.05 H new ATOM 0 HA GLU A 207 -7.840 8.760 0.718 1.00 45.53 H new ATOM 0 HB2 GLU A 207 -5.840 10.187 1.380 1.00 40.31 H new ATOM 0 HB3 GLU A 207 -6.551 11.488 0.446 1.00 40.31 H new ATOM 0 HG2 GLU A 207 -7.891 10.155 2.819 1.00 2.54 H new ATOM 0 HG3 GLU A 207 -6.946 11.628 2.912 1.00 2.54 H new ATOM 752 N SER A 208 -8.351 10.913 -1.733 1.00 40.01 N ATOM 753 CA SER A 208 -9.376 11.530 -2.576 1.00 73.42 C ATOM 754 C SER A 208 -10.311 10.493 -3.210 1.00 15.35 C ATOM 755 O SER A 208 -11.500 10.758 -3.407 1.00 54.12 O ATOM 756 CB SER A 208 -8.722 12.378 -3.669 1.00 13.45 C ATOM 757 OG SER A 208 -7.903 13.393 -3.110 1.00 34.15 O ATOM 0 H SER A 208 -7.396 11.135 -2.015 1.00 40.01 H new ATOM 0 HA SER A 208 -9.982 12.166 -1.931 1.00 73.42 H new ATOM 0 HB2 SER A 208 -8.123 11.740 -4.318 1.00 13.45 H new ATOM 0 HB3 SER A 208 -9.493 12.831 -4.292 1.00 13.45 H new ATOM 0 HG SER A 208 -7.107 12.987 -2.709 1.00 34.15 H new ATOM 763 N THR A 209 -9.789 9.320 -3.527 1.00 53.21 N ATOM 764 CA THR A 209 -10.616 8.303 -4.132 1.00 5.44 C ATOM 765 C THR A 209 -11.402 7.520 -3.060 1.00 33.33 C ATOM 766 O THR A 209 -12.385 6.844 -3.368 1.00 71.41 O ATOM 767 CB THR A 209 -9.796 7.346 -5.061 1.00 71.03 C ATOM 768 OG1 THR A 209 -10.660 6.423 -5.727 1.00 2.41 O ATOM 769 CG2 THR A 209 -8.729 6.573 -4.290 1.00 3.31 C ATOM 0 H THR A 209 -8.815 9.056 -3.377 1.00 53.21 H new ATOM 0 HA THR A 209 -11.337 8.812 -4.771 1.00 5.44 H new ATOM 0 HB THR A 209 -9.296 7.976 -5.797 1.00 71.03 H new ATOM 0 HG1 THR A 209 -10.129 5.835 -6.304 1.00 2.41 H new ATOM 0 HG21 THR A 209 -8.185 5.922 -4.975 1.00 3.31 H new ATOM 0 HG22 THR A 209 -8.034 7.274 -3.828 1.00 3.31 H new ATOM 0 HG23 THR A 209 -9.204 5.970 -3.516 1.00 3.31 H new ATOM 775 N GLY A 210 -10.959 7.622 -1.806 1.00 24.40 N ATOM 776 CA GLY A 210 -11.632 6.961 -0.691 1.00 74.41 C ATOM 777 C GLY A 210 -11.600 5.451 -0.773 1.00 24.52 C ATOM 778 O GLY A 210 -12.360 4.762 -0.096 1.00 3.44 O ATOM 0 H GLY A 210 -10.134 8.159 -1.538 1.00 24.40 H new ATOM 0 HA2 GLY A 210 -11.165 7.276 0.242 1.00 74.41 H new ATOM 0 HA3 GLY A 210 -12.670 7.293 -0.656 1.00 74.41 H new ATOM 782 N LEU A 211 -10.722 4.929 -1.585 1.00 63.02 N ATOM 783 CA LEU A 211 -10.663 3.506 -1.768 1.00 23.13 C ATOM 784 C LEU A 211 -9.627 2.900 -0.879 1.00 54.20 C ATOM 785 O LEU A 211 -9.712 1.753 -0.541 1.00 22.30 O ATOM 786 CB LEU A 211 -10.403 3.138 -3.227 1.00 71.41 C ATOM 787 CG LEU A 211 -11.413 3.678 -4.231 1.00 70.54 C ATOM 788 CD1 LEU A 211 -11.083 3.206 -5.636 1.00 52.12 C ATOM 789 CD2 LEU A 211 -12.835 3.288 -3.855 1.00 42.44 C ATOM 0 H LEU A 211 -10.043 5.463 -2.127 1.00 63.02 H new ATOM 0 HA LEU A 211 -11.636 3.099 -1.493 1.00 23.13 H new ATOM 0 HB2 LEU A 211 -9.413 3.500 -3.504 1.00 71.41 H new ATOM 0 HB3 LEU A 211 -10.380 2.051 -3.311 1.00 71.41 H new ATOM 0 HG LEU A 211 -11.349 4.766 -4.209 1.00 70.54 H new ATOM 0 HD11 LEU A 211 -11.818 3.604 -6.336 1.00 52.12 H new ATOM 0 HD12 LEU A 211 -10.090 3.558 -5.914 1.00 52.12 H new ATOM 0 HD13 LEU A 211 -11.104 2.117 -5.668 1.00 52.12 H new ATOM 0 HD21 LEU A 211 -13.530 3.690 -4.593 1.00 42.44 H new ATOM 0 HD22 LEU A 211 -12.920 2.202 -3.831 1.00 42.44 H new ATOM 0 HD23 LEU A 211 -13.075 3.693 -2.872 1.00 42.44 H new ATOM 797 N LEU A 212 -8.689 3.687 -0.462 1.00 42.45 N ATOM 798 CA LEU A 212 -7.626 3.180 0.371 1.00 21.00 C ATOM 799 C LEU A 212 -7.779 3.648 1.784 1.00 11.51 C ATOM 800 O LEU A 212 -8.070 4.823 2.046 1.00 3.13 O ATOM 801 CB LEU A 212 -6.232 3.567 -0.164 1.00 25.25 C ATOM 802 CG LEU A 212 -5.775 2.893 -1.468 1.00 44.23 C ATOM 803 CD1 LEU A 212 -6.581 3.359 -2.660 1.00 4.13 C ATOM 804 CD2 LEU A 212 -4.273 3.073 -1.698 1.00 54.40 C ATOM 0 H LEU A 212 -8.629 4.682 -0.679 1.00 42.45 H new ATOM 0 HA LEU A 212 -7.703 2.093 0.347 1.00 21.00 H new ATOM 0 HB2 LEU A 212 -6.215 4.646 -0.316 1.00 25.25 H new ATOM 0 HB3 LEU A 212 -5.498 3.342 0.609 1.00 25.25 H new ATOM 0 HG LEU A 212 -5.962 1.825 -1.356 1.00 44.23 H new ATOM 0 HD11 LEU A 212 -6.224 2.857 -3.559 1.00 4.13 H new ATOM 0 HD12 LEU A 212 -7.633 3.119 -2.504 1.00 4.13 H new ATOM 0 HD13 LEU A 212 -6.468 4.437 -2.777 1.00 4.13 H new ATOM 0 HD21 LEU A 212 -3.986 2.584 -2.629 1.00 54.40 H new ATOM 0 HD22 LEU A 212 -4.039 4.136 -1.760 1.00 54.40 H new ATOM 0 HD23 LEU A 212 -3.722 2.628 -0.869 1.00 54.40 H new ATOM 812 N ALA A 213 -7.617 2.716 2.675 1.00 75.11 N ATOM 813 CA ALA A 213 -7.729 2.919 4.082 1.00 34.14 C ATOM 814 C ALA A 213 -6.525 2.310 4.791 1.00 2.24 C ATOM 815 O ALA A 213 -5.799 1.517 4.215 1.00 40.22 O ATOM 816 CB ALA A 213 -9.005 2.284 4.579 1.00 73.52 C ATOM 0 H ALA A 213 -7.393 1.752 2.426 1.00 75.11 H new ATOM 0 HA ALA A 213 -7.755 3.988 4.295 1.00 34.14 H new ATOM 0 HB1 ALA A 213 -9.093 2.438 5.655 1.00 73.52 H new ATOM 0 HB2 ALA A 213 -9.858 2.740 4.076 1.00 73.52 H new ATOM 0 HB3 ALA A 213 -8.987 1.215 4.366 1.00 73.52 H new ATOM 822 N VAL A 214 -6.336 2.669 6.040 1.00 61.41 N ATOM 823 CA VAL A 214 -5.226 2.188 6.840 1.00 23.43 C ATOM 824 C VAL A 214 -5.271 0.672 7.112 1.00 14.41 C ATOM 825 O VAL A 214 -4.245 0.031 7.312 1.00 65.24 O ATOM 826 CB VAL A 214 -5.053 2.983 8.143 1.00 62.25 C ATOM 827 CG1 VAL A 214 -4.789 4.445 7.839 1.00 21.43 C ATOM 828 CG2 VAL A 214 -6.259 2.834 9.047 1.00 21.31 C ATOM 0 H VAL A 214 -6.954 3.310 6.537 1.00 61.41 H new ATOM 0 HA VAL A 214 -4.342 2.363 6.227 1.00 23.43 H new ATOM 0 HB VAL A 214 -4.192 2.575 8.672 1.00 62.25 H new ATOM 0 HG11 VAL A 214 -4.669 4.995 8.772 1.00 21.43 H new ATOM 0 HG12 VAL A 214 -3.879 4.535 7.245 1.00 21.43 H new ATOM 0 HG13 VAL A 214 -5.629 4.858 7.280 1.00 21.43 H new ATOM 0 HG21 VAL A 214 -6.103 3.409 9.960 1.00 21.31 H new ATOM 0 HG22 VAL A 214 -7.147 3.203 8.533 1.00 21.31 H new ATOM 0 HG23 VAL A 214 -6.397 1.783 9.300 1.00 21.31 H new ATOM 834 N ASN A 215 -6.449 0.113 7.160 1.00 21.40 N ATOM 835 CA ASN A 215 -6.581 -1.321 7.453 1.00 12.32 C ATOM 836 C ASN A 215 -6.181 -2.173 6.246 1.00 53.31 C ATOM 837 O ASN A 215 -5.992 -3.385 6.372 1.00 50.32 O ATOM 838 CB ASN A 215 -7.998 -1.725 7.954 1.00 74.42 C ATOM 839 CG ASN A 215 -9.075 -1.763 6.873 1.00 3.02 C ATOM 840 OD1 ASN A 215 -9.305 -2.813 6.244 1.00 21.05 O ATOM 841 ND2 ASN A 215 -9.759 -0.664 6.675 1.00 65.31 N ATOM 0 H ASN A 215 -7.330 0.604 7.005 1.00 21.40 H new ATOM 0 HA ASN A 215 -5.892 -1.518 8.274 1.00 12.32 H new ATOM 0 HB2 ASN A 215 -7.936 -2.709 8.420 1.00 74.42 H new ATOM 0 HB3 ASN A 215 -8.307 -1.024 8.730 1.00 74.42 H new ATOM 0 HD21 ASN A 215 -10.510 -0.648 5.985 1.00 65.31 H new ATOM 0 HD22 ASN A 215 -9.540 0.176 7.210 1.00 65.31 H new ATOM 847 N ASP A 216 -6.072 -1.545 5.087 1.00 3.41 N ATOM 848 CA ASP A 216 -5.761 -2.247 3.847 1.00 51.50 C ATOM 849 C ASP A 216 -4.353 -2.837 3.833 1.00 41.43 C ATOM 850 O ASP A 216 -3.391 -2.242 4.359 1.00 52.51 O ATOM 851 CB ASP A 216 -5.936 -1.358 2.615 1.00 51.20 C ATOM 852 CG ASP A 216 -7.349 -0.871 2.363 1.00 51.30 C ATOM 853 OD1 ASP A 216 -8.319 -1.573 2.703 1.00 32.23 O ATOM 854 OD2 ASP A 216 -7.503 0.224 1.795 1.00 3.15 O ATOM 0 H ASP A 216 -6.195 -0.539 4.976 1.00 3.41 H new ATOM 0 HA ASP A 216 -6.480 -3.065 3.804 1.00 51.50 H new ATOM 0 HB2 ASP A 216 -5.283 -0.491 2.717 1.00 51.20 H new ATOM 0 HB3 ASP A 216 -5.598 -1.910 1.738 1.00 51.20 H new ATOM 859 N GLU A 217 -4.253 -4.005 3.232 1.00 32.41 N ATOM 860 CA GLU A 217 -3.009 -4.732 3.053 1.00 25.24 C ATOM 861 C GLU A 217 -2.625 -4.695 1.573 1.00 4.21 C ATOM 862 O GLU A 217 -3.470 -4.931 0.707 1.00 31.01 O ATOM 863 CB GLU A 217 -3.165 -6.178 3.592 1.00 42.45 C ATOM 864 CG GLU A 217 -1.971 -7.114 3.387 1.00 22.31 C ATOM 865 CD GLU A 217 -2.205 -8.492 4.013 1.00 72.11 C ATOM 866 OE1 GLU A 217 -2.902 -9.341 3.409 1.00 74.34 O ATOM 867 OE2 GLU A 217 -1.733 -8.725 5.146 1.00 10.12 O ATOM 0 H GLU A 217 -5.060 -4.491 2.842 1.00 32.41 H new ATOM 0 HA GLU A 217 -2.203 -4.267 3.620 1.00 25.24 H new ATOM 0 HB2 GLU A 217 -3.377 -6.123 4.660 1.00 42.45 H new ATOM 0 HB3 GLU A 217 -4.037 -6.627 3.117 1.00 42.45 H new ATOM 0 HG2 GLU A 217 -1.780 -7.229 2.320 1.00 22.31 H new ATOM 0 HG3 GLU A 217 -1.079 -6.664 3.824 1.00 22.31 H new ATOM 874 N VAL A 218 -1.371 -4.388 1.288 1.00 12.24 N ATOM 875 CA VAL A 218 -0.915 -4.207 -0.082 1.00 22.35 C ATOM 876 C VAL A 218 -0.549 -5.547 -0.728 1.00 73.01 C ATOM 877 O VAL A 218 0.183 -6.354 -0.161 1.00 23.24 O ATOM 878 CB VAL A 218 0.285 -3.209 -0.170 1.00 13.20 C ATOM 879 CG1 VAL A 218 0.604 -2.875 -1.616 1.00 61.44 C ATOM 880 CG2 VAL A 218 0.002 -1.929 0.616 1.00 73.03 C ATOM 0 H VAL A 218 -0.645 -4.258 1.992 1.00 12.24 H new ATOM 0 HA VAL A 218 -1.747 -3.774 -0.638 1.00 22.35 H new ATOM 0 HB VAL A 218 1.151 -3.698 0.276 1.00 13.20 H new ATOM 0 HG11 VAL A 218 1.442 -2.179 -1.652 1.00 61.44 H new ATOM 0 HG12 VAL A 218 0.867 -3.788 -2.151 1.00 61.44 H new ATOM 0 HG13 VAL A 218 -0.268 -2.418 -2.085 1.00 61.44 H new ATOM 0 HG21 VAL A 218 0.856 -1.256 0.535 1.00 73.03 H new ATOM 0 HG22 VAL A 218 -0.884 -1.441 0.210 1.00 73.03 H new ATOM 0 HG23 VAL A 218 -0.167 -2.176 1.664 1.00 73.03 H new ATOM 886 N ILE A 219 -1.075 -5.758 -1.914 1.00 32.40 N ATOM 887 CA ILE A 219 -0.890 -6.978 -2.673 1.00 2.22 C ATOM 888 C ILE A 219 0.192 -6.818 -3.745 1.00 5.32 C ATOM 889 O ILE A 219 1.185 -7.568 -3.772 1.00 31.52 O ATOM 890 CB ILE A 219 -2.228 -7.387 -3.357 1.00 11.31 C ATOM 891 CG1 ILE A 219 -3.286 -7.700 -2.313 1.00 34.01 C ATOM 892 CG2 ILE A 219 -2.046 -8.578 -4.281 1.00 75.11 C ATOM 893 CD1 ILE A 219 -2.925 -8.867 -1.436 1.00 1.43 C ATOM 0 H ILE A 219 -1.658 -5.070 -2.390 1.00 32.40 H new ATOM 0 HA ILE A 219 -0.572 -7.753 -1.976 1.00 2.22 H new ATOM 0 HB ILE A 219 -2.557 -6.540 -3.960 1.00 11.31 H new ATOM 0 HG12 ILE A 219 -3.443 -6.820 -1.689 1.00 34.01 H new ATOM 0 HG13 ILE A 219 -4.231 -7.909 -2.814 1.00 34.01 H new ATOM 0 HG21 ILE A 219 -3.002 -8.833 -4.739 1.00 75.11 H new ATOM 0 HG22 ILE A 219 -1.326 -8.328 -5.060 1.00 75.11 H new ATOM 0 HG23 ILE A 219 -1.680 -9.430 -3.708 1.00 75.11 H new ATOM 0 HD11 ILE A 219 -3.722 -9.038 -0.712 1.00 1.43 H new ATOM 0 HD12 ILE A 219 -2.796 -9.758 -2.051 1.00 1.43 H new ATOM 0 HD13 ILE A 219 -1.996 -8.652 -0.909 1.00 1.43 H new ATOM 900 N GLU A 220 0.008 -5.848 -4.612 1.00 22.13 N ATOM 901 CA GLU A 220 0.907 -5.634 -5.718 1.00 53.03 C ATOM 902 C GLU A 220 0.857 -4.191 -6.170 1.00 41.21 C ATOM 903 O GLU A 220 -0.161 -3.509 -6.001 1.00 41.41 O ATOM 904 CB GLU A 220 0.568 -6.602 -6.883 1.00 23.11 C ATOM 905 CG GLU A 220 -0.864 -6.533 -7.369 1.00 13.13 C ATOM 906 CD GLU A 220 -1.162 -7.532 -8.463 1.00 32.21 C ATOM 907 OE1 GLU A 220 -1.362 -8.721 -8.157 1.00 3.14 O ATOM 908 OE2 GLU A 220 -1.214 -7.147 -9.646 1.00 70.23 O ATOM 0 H GLU A 220 -0.768 -5.188 -4.569 1.00 22.13 H new ATOM 0 HA GLU A 220 1.925 -5.845 -5.390 1.00 53.03 H new ATOM 0 HB2 GLU A 220 1.232 -6.387 -7.720 1.00 23.11 H new ATOM 0 HB3 GLU A 220 0.779 -7.622 -6.562 1.00 23.11 H new ATOM 0 HG2 GLU A 220 -1.536 -6.710 -6.529 1.00 13.13 H new ATOM 0 HG3 GLU A 220 -1.070 -5.528 -7.736 1.00 13.13 H new ATOM 915 N VAL A 221 1.957 -3.727 -6.707 1.00 41.45 N ATOM 916 CA VAL A 221 2.065 -2.400 -7.228 1.00 11.23 C ATOM 917 C VAL A 221 2.427 -2.470 -8.728 1.00 62.44 C ATOM 918 O VAL A 221 3.405 -3.099 -9.118 1.00 63.34 O ATOM 919 CB VAL A 221 3.099 -1.546 -6.426 1.00 14.34 C ATOM 920 CG1 VAL A 221 4.465 -2.152 -6.471 1.00 40.40 C ATOM 921 CG2 VAL A 221 3.120 -0.108 -6.913 1.00 52.20 C ATOM 0 H VAL A 221 2.813 -4.275 -6.793 1.00 41.45 H new ATOM 0 HA VAL A 221 1.103 -1.899 -7.118 1.00 11.23 H new ATOM 0 HB VAL A 221 2.779 -1.540 -5.384 1.00 14.34 H new ATOM 0 HG11 VAL A 221 5.157 -1.531 -5.903 1.00 40.40 H new ATOM 0 HG12 VAL A 221 4.434 -3.151 -6.037 1.00 40.40 H new ATOM 0 HG13 VAL A 221 4.801 -2.216 -7.506 1.00 40.40 H new ATOM 0 HG21 VAL A 221 3.849 0.461 -6.336 1.00 52.20 H new ATOM 0 HG22 VAL A 221 3.394 -0.085 -7.968 1.00 52.20 H new ATOM 0 HG23 VAL A 221 2.132 0.334 -6.786 1.00 52.20 H new ATOM 927 N ASN A 222 1.589 -1.868 -9.547 1.00 24.32 N ATOM 928 CA ASN A 222 1.713 -1.860 -11.021 1.00 5.33 C ATOM 929 C ASN A 222 1.720 -3.251 -11.607 1.00 52.41 C ATOM 930 O ASN A 222 2.203 -3.480 -12.718 1.00 13.05 O ATOM 931 CB ASN A 222 2.914 -1.040 -11.531 1.00 53.33 C ATOM 932 CG ASN A 222 2.781 0.434 -11.225 1.00 3.40 C ATOM 933 OD1 ASN A 222 2.254 0.823 -10.192 1.00 34.05 O ATOM 934 ND2 ASN A 222 3.201 1.261 -12.133 1.00 4.21 N ATOM 0 H ASN A 222 0.775 -1.352 -9.213 1.00 24.32 H new ATOM 0 HA ASN A 222 0.815 -1.354 -11.376 1.00 5.33 H new ATOM 0 HB2 ASN A 222 3.829 -1.421 -11.077 1.00 53.33 H new ATOM 0 HB3 ASN A 222 3.012 -1.177 -12.608 1.00 53.33 H new ATOM 0 HD21 ASN A 222 3.096 2.266 -11.995 1.00 4.21 H new ATOM 0 HD22 ASN A 222 3.637 0.906 -12.984 1.00 4.21 H new ATOM 940 N GLY A 223 1.138 -4.168 -10.880 1.00 35.13 N ATOM 941 CA GLY A 223 1.079 -5.532 -11.321 1.00 35.22 C ATOM 942 C GLY A 223 2.193 -6.357 -10.739 1.00 64.13 C ATOM 943 O GLY A 223 2.227 -7.576 -10.901 1.00 41.11 O ATOM 0 H GLY A 223 0.697 -3.992 -9.977 1.00 35.13 H new ATOM 0 HA2 GLY A 223 0.120 -5.965 -11.036 1.00 35.22 H new ATOM 0 HA3 GLY A 223 1.133 -5.565 -12.409 1.00 35.22 H new ATOM 947 N ILE A 224 3.109 -5.707 -10.062 1.00 75.42 N ATOM 948 CA ILE A 224 4.216 -6.385 -9.465 1.00 50.41 C ATOM 949 C ILE A 224 3.906 -6.639 -8.005 1.00 54.31 C ATOM 950 O ILE A 224 3.650 -5.710 -7.249 1.00 73.41 O ATOM 951 CB ILE A 224 5.500 -5.552 -9.572 1.00 73.51 C ATOM 952 CG1 ILE A 224 5.788 -5.213 -11.037 1.00 51.13 C ATOM 953 CG2 ILE A 224 6.653 -6.331 -8.970 1.00 75.11 C ATOM 954 CD1 ILE A 224 7.009 -4.348 -11.234 1.00 2.51 C ATOM 0 H ILE A 224 3.101 -4.698 -9.914 1.00 75.42 H new ATOM 0 HA ILE A 224 4.374 -7.326 -9.993 1.00 50.41 H new ATOM 0 HB ILE A 224 5.375 -4.618 -9.024 1.00 73.51 H new ATOM 0 HG12 ILE A 224 5.917 -6.140 -11.596 1.00 51.13 H new ATOM 0 HG13 ILE A 224 4.922 -4.704 -11.459 1.00 51.13 H new ATOM 0 HG21 ILE A 224 7.568 -5.743 -9.044 1.00 75.11 H new ATOM 0 HG22 ILE A 224 6.441 -6.542 -7.922 1.00 75.11 H new ATOM 0 HG23 ILE A 224 6.780 -7.269 -9.511 1.00 75.11 H new ATOM 0 HD11 ILE A 224 7.148 -4.151 -12.297 1.00 2.51 H new ATOM 0 HD12 ILE A 224 6.876 -3.405 -10.704 1.00 2.51 H new ATOM 0 HD13 ILE A 224 7.887 -4.863 -10.843 1.00 2.51 H new ATOM 961 N GLU A 225 3.949 -7.880 -7.633 1.00 23.23 N ATOM 962 CA GLU A 225 3.613 -8.332 -6.295 1.00 14.43 C ATOM 963 C GLU A 225 4.527 -7.746 -5.232 1.00 23.11 C ATOM 964 O GLU A 225 5.742 -7.619 -5.425 1.00 45.11 O ATOM 965 CB GLU A 225 3.681 -9.844 -6.258 1.00 71.31 C ATOM 966 CG GLU A 225 5.046 -10.376 -6.636 1.00 51.22 C ATOM 967 CD GLU A 225 5.039 -11.857 -6.845 1.00 72.23 C ATOM 968 OE1 GLU A 225 4.628 -12.297 -7.933 1.00 21.14 O ATOM 969 OE2 GLU A 225 5.443 -12.602 -5.944 1.00 1.55 O ATOM 0 H GLU A 225 4.225 -8.636 -8.259 1.00 23.23 H new ATOM 0 HA GLU A 225 2.605 -7.986 -6.068 1.00 14.43 H new ATOM 0 HB2 GLU A 225 3.425 -10.191 -5.257 1.00 71.31 H new ATOM 0 HB3 GLU A 225 2.935 -10.254 -6.938 1.00 71.31 H new ATOM 0 HG2 GLU A 225 5.386 -9.884 -7.547 1.00 51.22 H new ATOM 0 HG3 GLU A 225 5.761 -10.125 -5.853 1.00 51.22 H new ATOM 976 N VAL A 226 3.939 -7.381 -4.131 1.00 24.01 N ATOM 977 CA VAL A 226 4.691 -6.897 -2.998 1.00 50.44 C ATOM 978 C VAL A 226 4.502 -7.823 -1.828 1.00 22.14 C ATOM 979 O VAL A 226 5.036 -7.604 -0.746 1.00 64.04 O ATOM 980 CB VAL A 226 4.337 -5.446 -2.609 1.00 64.13 C ATOM 981 CG1 VAL A 226 4.639 -4.501 -3.747 1.00 44.52 C ATOM 982 CG2 VAL A 226 2.900 -5.319 -2.188 1.00 12.32 C ATOM 0 H VAL A 226 2.930 -7.408 -3.987 1.00 24.01 H new ATOM 0 HA VAL A 226 5.741 -6.884 -3.292 1.00 50.44 H new ATOM 0 HB VAL A 226 4.957 -5.176 -1.755 1.00 64.13 H new ATOM 0 HG11 VAL A 226 4.382 -3.483 -3.453 1.00 44.52 H new ATOM 0 HG12 VAL A 226 5.700 -4.552 -3.990 1.00 44.52 H new ATOM 0 HG13 VAL A 226 4.053 -4.785 -4.621 1.00 44.52 H new ATOM 0 HG21 VAL A 226 2.689 -4.283 -1.922 1.00 12.32 H new ATOM 0 HG22 VAL A 226 2.252 -5.622 -3.010 1.00 12.32 H new ATOM 0 HG23 VAL A 226 2.715 -5.960 -1.326 1.00 12.32 H new ATOM 988 N ALA A 227 3.773 -8.890 -2.070 1.00 5.51 N ATOM 989 CA ALA A 227 3.503 -9.859 -1.048 1.00 25.50 C ATOM 990 C ALA A 227 4.734 -10.713 -0.811 1.00 14.02 C ATOM 991 O ALA A 227 5.032 -11.621 -1.585 1.00 73.51 O ATOM 992 CB ALA A 227 2.302 -10.719 -1.420 1.00 64.12 C ATOM 0 H ALA A 227 3.356 -9.104 -2.976 1.00 5.51 H new ATOM 0 HA ALA A 227 3.259 -9.337 -0.123 1.00 25.50 H new ATOM 0 HB1 ALA A 227 2.117 -11.446 -0.630 1.00 64.12 H new ATOM 0 HB2 ALA A 227 1.424 -10.085 -1.542 1.00 64.12 H new ATOM 0 HB3 ALA A 227 2.505 -11.242 -2.354 1.00 64.12 H new ATOM 998 N GLY A 228 5.472 -10.378 0.220 1.00 32.31 N ATOM 999 CA GLY A 228 6.662 -11.123 0.559 1.00 13.53 C ATOM 1000 C GLY A 228 7.893 -10.288 0.362 1.00 52.32 C ATOM 1001 O GLY A 228 9.000 -10.689 0.737 1.00 31.44 O ATOM 0 H GLY A 228 5.270 -9.594 0.840 1.00 32.31 H new ATOM 0 HA2 GLY A 228 6.605 -11.454 1.596 1.00 13.53 H new ATOM 0 HA3 GLY A 228 6.723 -12.019 -0.059 1.00 13.53 H new ATOM 1005 N LYS A 229 7.699 -9.132 -0.240 1.00 40.31 N ATOM 1006 CA LYS A 229 8.786 -8.193 -0.485 1.00 70.43 C ATOM 1007 C LYS A 229 9.012 -7.375 0.763 1.00 23.52 C ATOM 1008 O LYS A 229 8.120 -7.268 1.604 1.00 54.33 O ATOM 1009 CB LYS A 229 8.424 -7.252 -1.638 1.00 10.32 C ATOM 1010 CG LYS A 229 7.953 -7.963 -2.887 1.00 41.02 C ATOM 1011 CD LYS A 229 8.990 -8.906 -3.412 1.00 1.12 C ATOM 1012 CE LYS A 229 8.432 -9.744 -4.522 1.00 51.20 C ATOM 1013 NZ LYS A 229 9.442 -10.689 -5.054 1.00 60.34 N ATOM 0 H LYS A 229 6.789 -8.814 -0.574 1.00 40.31 H new ATOM 0 HA LYS A 229 9.687 -8.747 -0.747 1.00 70.43 H new ATOM 0 HB2 LYS A 229 7.643 -6.569 -1.304 1.00 10.32 H new ATOM 0 HB3 LYS A 229 9.295 -6.644 -1.885 1.00 10.32 H new ATOM 0 HG2 LYS A 229 7.038 -8.513 -2.669 1.00 41.02 H new ATOM 0 HG3 LYS A 229 7.708 -7.228 -3.654 1.00 41.02 H new ATOM 0 HD2 LYS A 229 9.851 -8.343 -3.772 1.00 1.12 H new ATOM 0 HD3 LYS A 229 9.344 -9.550 -2.607 1.00 1.12 H new ATOM 0 HE2 LYS A 229 7.568 -10.301 -4.159 1.00 51.20 H new ATOM 0 HE3 LYS A 229 8.080 -9.097 -5.325 1.00 51.20 H new ATOM 0 HZ1 LYS A 229 9.021 -11.252 -5.820 1.00 60.34 H new ATOM 0 HZ2 LYS A 229 10.256 -10.156 -5.423 1.00 60.34 H new ATOM 0 HZ3 LYS A 229 9.759 -11.323 -4.293 1.00 60.34 H new ATOM 1027 N THR A 230 10.183 -6.806 0.902 1.00 5.51 N ATOM 1028 CA THR A 230 10.439 -6.006 2.037 1.00 11.45 C ATOM 1029 C THR A 230 9.926 -4.591 1.815 1.00 64.51 C ATOM 1030 O THR A 230 9.554 -4.229 0.686 1.00 73.12 O ATOM 1031 CB THR A 230 11.927 -5.964 2.453 1.00 13.11 C ATOM 1032 OG1 THR A 230 12.733 -5.423 1.395 1.00 40.53 O ATOM 1033 CG2 THR A 230 12.423 -7.355 2.838 1.00 30.14 C ATOM 0 H THR A 230 10.956 -6.890 0.242 1.00 5.51 H new ATOM 0 HA THR A 230 9.902 -6.478 2.860 1.00 11.45 H new ATOM 0 HB THR A 230 12.015 -5.315 3.324 1.00 13.11 H new ATOM 0 HG1 THR A 230 12.896 -6.116 0.721 1.00 40.53 H new ATOM 0 HG21 THR A 230 13.473 -7.300 3.127 1.00 30.14 H new ATOM 0 HG22 THR A 230 11.835 -7.732 3.675 1.00 30.14 H new ATOM 0 HG23 THR A 230 12.316 -8.028 1.987 1.00 30.14 H new ATOM 1039 N LEU A 231 9.927 -3.784 2.863 1.00 32.52 N ATOM 1040 CA LEU A 231 9.482 -2.424 2.773 1.00 74.14 C ATOM 1041 C LEU A 231 10.386 -1.661 1.786 1.00 53.15 C ATOM 1042 O LEU A 231 9.909 -0.842 1.002 1.00 11.35 O ATOM 1043 CB LEU A 231 9.464 -1.810 4.190 1.00 73.00 C ATOM 1044 CG LEU A 231 8.775 -0.442 4.401 1.00 75.55 C ATOM 1045 CD1 LEU A 231 9.553 0.707 3.789 1.00 72.04 C ATOM 1046 CD2 LEU A 231 7.350 -0.465 3.862 1.00 52.24 C ATOM 0 H LEU A 231 10.238 -4.063 3.794 1.00 32.52 H new ATOM 0 HA LEU A 231 8.466 -2.360 2.383 1.00 74.14 H new ATOM 0 HB2 LEU A 231 8.983 -2.528 4.854 1.00 73.00 H new ATOM 0 HB3 LEU A 231 10.498 -1.713 4.521 1.00 73.00 H new ATOM 0 HG LEU A 231 8.747 -0.271 5.477 1.00 75.55 H new ATOM 0 HD11 LEU A 231 9.022 1.642 3.968 1.00 72.04 H new ATOM 0 HD12 LEU A 231 10.543 0.759 4.243 1.00 72.04 H new ATOM 0 HD13 LEU A 231 9.654 0.547 2.716 1.00 72.04 H new ATOM 0 HD21 LEU A 231 6.885 0.508 4.021 1.00 52.24 H new ATOM 0 HD22 LEU A 231 7.368 -0.688 2.795 1.00 52.24 H new ATOM 0 HD23 LEU A 231 6.776 -1.231 4.383 1.00 52.24 H new ATOM 1054 N ASP A 232 11.677 -1.970 1.810 1.00 54.02 N ATOM 1055 CA ASP A 232 12.638 -1.396 0.852 1.00 1.04 C ATOM 1056 C ASP A 232 12.224 -1.734 -0.564 1.00 13.12 C ATOM 1057 O ASP A 232 12.063 -0.850 -1.412 1.00 35.12 O ATOM 1058 CB ASP A 232 14.043 -1.946 1.110 1.00 61.11 C ATOM 1059 CG ASP A 232 15.015 -1.617 -0.013 1.00 24.12 C ATOM 1060 OD1 ASP A 232 15.530 -0.495 -0.066 1.00 73.33 O ATOM 1061 OD2 ASP A 232 15.273 -2.495 -0.861 1.00 43.53 O ATOM 0 H ASP A 232 12.092 -2.616 2.481 1.00 54.02 H new ATOM 0 HA ASP A 232 12.647 -0.314 0.982 1.00 1.04 H new ATOM 0 HB2 ASP A 232 14.423 -1.537 2.046 1.00 61.11 H new ATOM 0 HB3 ASP A 232 13.989 -3.028 1.234 1.00 61.11 H new ATOM 1066 N GLN A 233 12.006 -3.016 -0.781 1.00 25.13 N ATOM 1067 CA GLN A 233 11.588 -3.554 -2.061 1.00 4.32 C ATOM 1068 C GLN A 233 10.322 -2.885 -2.590 1.00 63.15 C ATOM 1069 O GLN A 233 10.249 -2.519 -3.762 1.00 32.24 O ATOM 1070 CB GLN A 233 11.374 -5.055 -1.931 1.00 21.14 C ATOM 1071 CG GLN A 233 12.647 -5.893 -1.890 1.00 23.33 C ATOM 1072 CD GLN A 233 12.376 -7.309 -1.423 1.00 21.42 C ATOM 1073 OE1 GLN A 233 12.501 -7.623 -0.265 1.00 33.43 O ATOM 1074 NE2 GLN A 233 11.926 -8.129 -2.265 1.00 12.45 N ATOM 0 H GLN A 233 12.117 -3.727 -0.058 1.00 25.13 H new ATOM 0 HA GLN A 233 12.379 -3.349 -2.782 1.00 4.32 H new ATOM 0 HB2 GLN A 233 10.803 -5.247 -1.023 1.00 21.14 H new ATOM 0 HB3 GLN A 233 10.763 -5.392 -2.769 1.00 21.14 H new ATOM 0 HG2 GLN A 233 13.098 -5.918 -2.882 1.00 23.33 H new ATOM 0 HG3 GLN A 233 13.370 -5.423 -1.223 1.00 23.33 H new ATOM 0 HE21 GLN A 233 11.824 -7.853 -3.242 1.00 12.45 H new ATOM 0 HE22 GLN A 233 11.663 -9.070 -1.971 1.00 12.45 H new ATOM 1082 N VAL A 234 9.341 -2.704 -1.730 1.00 32.24 N ATOM 1083 CA VAL A 234 8.076 -2.144 -2.165 1.00 51.54 C ATOM 1084 C VAL A 234 8.146 -0.638 -2.365 1.00 21.24 C ATOM 1085 O VAL A 234 7.505 -0.098 -3.264 1.00 55.31 O ATOM 1086 CB VAL A 234 6.913 -2.503 -1.231 1.00 15.10 C ATOM 1087 CG1 VAL A 234 6.883 -3.985 -0.991 1.00 54.24 C ATOM 1088 CG2 VAL A 234 6.975 -1.749 0.067 1.00 12.45 C ATOM 0 H VAL A 234 9.392 -2.933 -0.737 1.00 32.24 H new ATOM 0 HA VAL A 234 7.876 -2.605 -3.132 1.00 51.54 H new ATOM 0 HB VAL A 234 5.988 -2.205 -1.724 1.00 15.10 H new ATOM 0 HG11 VAL A 234 6.054 -4.229 -0.327 1.00 54.24 H new ATOM 0 HG12 VAL A 234 6.753 -4.505 -1.940 1.00 54.24 H new ATOM 0 HG13 VAL A 234 7.820 -4.298 -0.531 1.00 54.24 H new ATOM 0 HG21 VAL A 234 6.132 -2.036 0.695 1.00 12.45 H new ATOM 0 HG22 VAL A 234 7.907 -1.985 0.581 1.00 12.45 H new ATOM 0 HG23 VAL A 234 6.931 -0.678 -0.132 1.00 12.45 H new ATOM 1094 N THR A 235 8.926 0.037 -1.551 1.00 23.22 N ATOM 1095 CA THR A 235 9.035 1.462 -1.659 1.00 42.13 C ATOM 1096 C THR A 235 9.808 1.818 -2.917 1.00 61.43 C ATOM 1097 O THR A 235 9.475 2.778 -3.608 1.00 55.20 O ATOM 1098 CB THR A 235 9.673 2.083 -0.407 1.00 42.33 C ATOM 1099 OG1 THR A 235 8.941 1.631 0.736 1.00 13.14 O ATOM 1100 CG2 THR A 235 9.579 3.602 -0.460 1.00 52.32 C ATOM 0 H THR A 235 9.490 -0.382 -0.811 1.00 23.22 H new ATOM 0 HA THR A 235 8.032 1.883 -1.732 1.00 42.13 H new ATOM 0 HB THR A 235 10.721 1.789 -0.353 1.00 42.33 H new ATOM 0 HG1 THR A 235 9.055 0.663 0.836 1.00 13.14 H new ATOM 0 HG21 THR A 235 10.036 4.026 0.434 1.00 52.32 H new ATOM 0 HG22 THR A 235 10.102 3.968 -1.343 1.00 52.32 H new ATOM 0 HG23 THR A 235 8.532 3.900 -0.509 1.00 52.32 H new ATOM 1106 N ASP A 236 10.804 0.995 -3.251 1.00 61.43 N ATOM 1107 CA ASP A 236 11.571 1.205 -4.480 1.00 72.34 C ATOM 1108 C ASP A 236 10.659 1.056 -5.685 1.00 53.00 C ATOM 1109 O ASP A 236 10.847 1.720 -6.710 1.00 2.21 O ATOM 1110 CB ASP A 236 12.752 0.248 -4.575 1.00 52.12 C ATOM 1111 CG ASP A 236 13.602 0.472 -5.812 1.00 2.14 C ATOM 1112 OD1 ASP A 236 14.240 1.548 -5.930 1.00 52.25 O ATOM 1113 OD2 ASP A 236 13.692 -0.445 -6.653 1.00 50.35 O ATOM 0 H ASP A 236 11.095 0.189 -2.698 1.00 61.43 H new ATOM 0 HA ASP A 236 11.977 2.216 -4.461 1.00 72.34 H new ATOM 0 HB2 ASP A 236 13.375 0.361 -3.688 1.00 52.12 H new ATOM 0 HB3 ASP A 236 12.382 -0.777 -4.577 1.00 52.12 H new ATOM 1118 N MET A 237 9.636 0.192 -5.546 1.00 64.21 N ATOM 1119 CA MET A 237 8.630 0.048 -6.583 1.00 73.25 C ATOM 1120 C MET A 237 7.921 1.375 -6.730 1.00 33.33 C ATOM 1121 O MET A 237 7.864 1.938 -7.783 1.00 63.33 O ATOM 1122 CB MET A 237 7.539 -0.956 -6.205 1.00 2.14 C ATOM 1123 CG MET A 237 7.937 -2.347 -5.875 1.00 5.44 C ATOM 1124 SD MET A 237 8.525 -3.310 -7.245 1.00 33.44 S ATOM 1125 CE MET A 237 8.444 -4.907 -6.449 1.00 30.14 C ATOM 0 H MET A 237 9.496 -0.405 -4.731 1.00 64.21 H new ATOM 0 HA MET A 237 9.141 -0.287 -7.486 1.00 73.25 H new ATOM 0 HB2 MET A 237 7.001 -0.553 -5.347 1.00 2.14 H new ATOM 0 HB3 MET A 237 6.830 -1.002 -7.032 1.00 2.14 H new ATOM 0 HG2 MET A 237 8.716 -2.314 -5.114 1.00 5.44 H new ATOM 0 HG3 MET A 237 7.081 -2.858 -5.433 1.00 5.44 H new ATOM 0 HE1 MET A 237 8.876 -5.663 -7.105 1.00 30.14 H new ATOM 0 HE2 MET A 237 9.003 -4.876 -5.514 1.00 30.14 H new ATOM 0 HE3 MET A 237 7.404 -5.158 -6.242 1.00 30.14 H new ATOM 1135 N MET A 238 7.439 1.886 -5.602 1.00 31.54 N ATOM 1136 CA MET A 238 6.606 3.098 -5.543 1.00 33.21 C ATOM 1137 C MET A 238 7.341 4.341 -6.008 1.00 52.42 C ATOM 1138 O MET A 238 6.738 5.244 -6.571 1.00 34.43 O ATOM 1139 CB MET A 238 6.059 3.288 -4.134 1.00 24.44 C ATOM 1140 CG MET A 238 5.258 2.117 -3.662 1.00 44.22 C ATOM 1141 SD MET A 238 4.673 2.303 -1.992 1.00 51.12 S ATOM 1142 CE MET A 238 4.067 0.652 -1.730 1.00 45.22 C ATOM 0 H MET A 238 7.614 1.470 -4.687 1.00 31.54 H new ATOM 0 HA MET A 238 5.777 2.953 -6.236 1.00 33.21 H new ATOM 0 HB2 MET A 238 6.888 3.456 -3.447 1.00 24.44 H new ATOM 0 HB3 MET A 238 5.437 4.183 -4.108 1.00 24.44 H new ATOM 0 HG2 MET A 238 4.405 1.976 -4.326 1.00 44.22 H new ATOM 0 HG3 MET A 238 5.868 1.216 -3.729 1.00 44.22 H new ATOM 0 HE1 MET A 238 3.058 0.696 -1.319 1.00 45.22 H new ATOM 0 HE2 MET A 238 4.049 0.116 -2.679 1.00 45.22 H new ATOM 0 HE3 MET A 238 4.721 0.131 -1.031 1.00 45.22 H new ATOM 1152 N VAL A 239 8.631 4.396 -5.762 1.00 2.44 N ATOM 1153 CA VAL A 239 9.444 5.491 -6.242 1.00 63.53 C ATOM 1154 C VAL A 239 9.554 5.405 -7.765 1.00 62.44 C ATOM 1155 O VAL A 239 9.392 6.397 -8.475 1.00 72.41 O ATOM 1156 CB VAL A 239 10.857 5.469 -5.596 1.00 74.42 C ATOM 1157 CG1 VAL A 239 11.720 6.577 -6.150 1.00 44.04 C ATOM 1158 CG2 VAL A 239 10.754 5.604 -4.087 1.00 4.54 C ATOM 0 H VAL A 239 9.142 3.691 -5.230 1.00 2.44 H new ATOM 0 HA VAL A 239 8.968 6.431 -5.960 1.00 63.53 H new ATOM 0 HB VAL A 239 11.321 4.512 -5.837 1.00 74.42 H new ATOM 0 HG11 VAL A 239 12.704 6.540 -5.682 1.00 44.04 H new ATOM 0 HG12 VAL A 239 11.826 6.452 -7.228 1.00 44.04 H new ATOM 0 HG13 VAL A 239 11.254 7.540 -5.941 1.00 44.04 H new ATOM 0 HG21 VAL A 239 11.753 5.587 -3.651 1.00 4.54 H new ATOM 0 HG22 VAL A 239 10.266 6.546 -3.838 1.00 4.54 H new ATOM 0 HG23 VAL A 239 10.169 4.776 -3.687 1.00 4.54 H new ATOM 1164 N ALA A 240 9.785 4.206 -8.257 1.00 50.23 N ATOM 1165 CA ALA A 240 9.885 3.964 -9.685 1.00 53.13 C ATOM 1166 C ALA A 240 8.540 4.190 -10.362 1.00 74.52 C ATOM 1167 O ALA A 240 8.464 4.697 -11.477 1.00 53.32 O ATOM 1168 CB ALA A 240 10.388 2.554 -9.940 1.00 73.52 C ATOM 0 H ALA A 240 9.909 3.373 -7.682 1.00 50.23 H new ATOM 0 HA ALA A 240 10.599 4.669 -10.111 1.00 53.13 H new ATOM 0 HB1 ALA A 240 10.460 2.382 -11.014 1.00 73.52 H new ATOM 0 HB2 ALA A 240 11.371 2.431 -9.486 1.00 73.52 H new ATOM 0 HB3 ALA A 240 9.694 1.836 -9.503 1.00 73.52 H new ATOM 1174 N ASN A 241 7.504 3.825 -9.669 1.00 62.23 N ATOM 1175 CA ASN A 241 6.129 3.960 -10.117 1.00 31.34 C ATOM 1176 C ASN A 241 5.555 5.328 -9.764 1.00 22.44 C ATOM 1177 O ASN A 241 4.367 5.478 -9.703 1.00 24.42 O ATOM 1178 CB ASN A 241 5.277 2.855 -9.464 1.00 25.34 C ATOM 1179 CG ASN A 241 5.726 1.463 -9.871 1.00 75.42 C ATOM 1180 OD1 ASN A 241 6.203 1.244 -10.977 1.00 34.30 O ATOM 1181 ND2 ASN A 241 5.601 0.526 -8.975 1.00 2.52 N ATOM 0 H ASN A 241 7.584 3.409 -8.741 1.00 62.23 H new ATOM 0 HA ASN A 241 6.110 3.862 -11.202 1.00 31.34 H new ATOM 0 HB2 ASN A 241 5.333 2.950 -8.380 1.00 25.34 H new ATOM 0 HB3 ASN A 241 4.232 2.993 -9.742 1.00 25.34 H new ATOM 0 HD21 ASN A 241 5.905 -0.425 -9.185 1.00 2.52 H new ATOM 0 HD22 ASN A 241 5.199 0.743 -8.063 1.00 2.52 H new ATOM 1187 N SER A 242 6.401 6.322 -9.547 1.00 72.24 N ATOM 1188 CA SER A 242 5.917 7.668 -9.195 1.00 33.33 C ATOM 1189 C SER A 242 4.989 8.247 -10.272 1.00 33.20 C ATOM 1190 O SER A 242 3.973 8.804 -9.946 1.00 54.24 O ATOM 1191 CB SER A 242 7.093 8.618 -8.893 1.00 64.04 C ATOM 1192 OG SER A 242 6.644 9.914 -8.477 1.00 12.51 O ATOM 0 H SER A 242 7.416 6.235 -9.605 1.00 72.24 H new ATOM 0 HA SER A 242 5.323 7.571 -8.286 1.00 33.33 H new ATOM 0 HB2 SER A 242 7.719 8.184 -8.113 1.00 64.04 H new ATOM 0 HB3 SER A 242 7.715 8.718 -9.782 1.00 64.04 H new ATOM 0 HG SER A 242 7.419 10.485 -8.294 1.00 12.51 H new ATOM 1198 N SER A 243 5.327 8.080 -11.531 1.00 32.34 N ATOM 1199 CA SER A 243 4.511 8.633 -12.610 1.00 5.33 C ATOM 1200 C SER A 243 3.204 7.840 -12.825 1.00 21.30 C ATOM 1201 O SER A 243 2.270 8.326 -13.474 1.00 42.52 O ATOM 1202 CB SER A 243 5.326 8.681 -13.893 1.00 31.03 C ATOM 1203 OG SER A 243 6.516 9.434 -13.697 1.00 50.51 O ATOM 0 H SER A 243 6.154 7.570 -11.841 1.00 32.34 H new ATOM 0 HA SER A 243 4.220 9.643 -12.323 1.00 5.33 H new ATOM 0 HB2 SER A 243 5.577 7.669 -14.210 1.00 31.03 H new ATOM 0 HB3 SER A 243 4.733 9.127 -14.691 1.00 31.03 H new ATOM 0 HG SER A 243 7.031 9.455 -14.531 1.00 50.51 H new ATOM 1209 N ASN A 244 3.150 6.631 -12.298 1.00 1.34 N ATOM 1210 CA ASN A 244 1.971 5.770 -12.409 1.00 33.43 C ATOM 1211 C ASN A 244 1.953 4.836 -11.235 1.00 42.51 C ATOM 1212 O ASN A 244 2.500 3.743 -11.321 1.00 41.20 O ATOM 1213 CB ASN A 244 1.979 4.897 -13.701 1.00 23.04 C ATOM 1214 CG ASN A 244 2.008 5.664 -15.008 1.00 73.44 C ATOM 1215 OD1 ASN A 244 0.968 6.026 -15.548 1.00 13.15 O ATOM 1216 ND2 ASN A 244 3.177 5.867 -15.550 1.00 73.42 N ATOM 0 H ASN A 244 3.921 6.211 -11.778 1.00 1.34 H new ATOM 0 HA ASN A 244 1.097 6.421 -12.442 1.00 33.43 H new ATOM 0 HB2 ASN A 244 2.847 4.238 -13.668 1.00 23.04 H new ATOM 0 HB3 ASN A 244 1.094 4.260 -13.693 1.00 23.04 H new ATOM 0 HD21 ASN A 244 3.246 6.340 -16.451 1.00 73.42 H new ATOM 0 HD22 ASN A 244 4.022 5.553 -15.073 1.00 73.42 H new ATOM 1222 N LEU A 245 1.413 5.259 -10.120 1.00 73.23 N ATOM 1223 CA LEU A 245 1.421 4.415 -8.963 1.00 13.01 C ATOM 1224 C LEU A 245 0.136 3.587 -8.919 1.00 24.23 C ATOM 1225 O LEU A 245 -0.919 4.101 -8.633 1.00 74.43 O ATOM 1226 CB LEU A 245 1.526 5.281 -7.706 1.00 53.34 C ATOM 1227 CG LEU A 245 2.133 4.632 -6.459 1.00 53.41 C ATOM 1228 CD1 LEU A 245 2.150 5.584 -5.310 1.00 70.42 C ATOM 1229 CD2 LEU A 245 1.442 3.369 -6.082 1.00 4.14 C ATOM 0 H LEU A 245 0.970 6.169 -9.994 1.00 73.23 H new ATOM 0 HA LEU A 245 2.276 3.740 -9.010 1.00 13.01 H new ATOM 0 HB2 LEU A 245 2.119 6.162 -7.951 1.00 53.34 H new ATOM 0 HB3 LEU A 245 0.525 5.631 -7.452 1.00 53.34 H new ATOM 0 HG LEU A 245 3.161 4.374 -6.712 1.00 53.41 H new ATOM 0 HD11 LEU A 245 2.586 5.095 -4.439 1.00 70.42 H new ATOM 0 HD12 LEU A 245 2.745 6.459 -5.571 1.00 70.42 H new ATOM 0 HD13 LEU A 245 1.131 5.894 -5.079 1.00 70.42 H new ATOM 0 HD21 LEU A 245 1.911 2.949 -5.192 1.00 4.14 H new ATOM 0 HD22 LEU A 245 0.392 3.576 -5.875 1.00 4.14 H new ATOM 0 HD23 LEU A 245 1.516 2.655 -6.902 1.00 4.14 H new ATOM 1237 N ILE A 246 0.225 2.332 -9.222 1.00 44.00 N ATOM 1238 CA ILE A 246 -0.920 1.465 -9.149 1.00 72.03 C ATOM 1239 C ILE A 246 -0.775 0.507 -7.992 1.00 34.12 C ATOM 1240 O ILE A 246 0.104 -0.318 -7.988 1.00 54.21 O ATOM 1241 CB ILE A 246 -1.065 0.662 -10.453 1.00 33.14 C ATOM 1242 CG1 ILE A 246 -1.266 1.617 -11.613 1.00 32.31 C ATOM 1243 CG2 ILE A 246 -2.249 -0.318 -10.358 1.00 43.01 C ATOM 1244 CD1 ILE A 246 -1.239 0.961 -12.972 1.00 31.43 C ATOM 0 H ILE A 246 1.085 1.875 -9.526 1.00 44.00 H new ATOM 0 HA ILE A 246 -1.807 2.081 -9.002 1.00 72.03 H new ATOM 0 HB ILE A 246 -0.157 0.082 -10.615 1.00 33.14 H new ATOM 0 HG12 ILE A 246 -2.222 2.126 -11.488 1.00 32.31 H new ATOM 0 HG13 ILE A 246 -0.490 2.382 -11.577 1.00 32.31 H new ATOM 0 HG21 ILE A 246 -2.335 -0.876 -11.290 1.00 43.01 H new ATOM 0 HG22 ILE A 246 -2.082 -1.011 -9.534 1.00 43.01 H new ATOM 0 HG23 ILE A 246 -3.169 0.239 -10.183 1.00 43.01 H new ATOM 0 HD11 ILE A 246 -1.390 1.716 -13.744 1.00 31.43 H new ATOM 0 HD12 ILE A 246 -0.274 0.476 -13.123 1.00 31.43 H new ATOM 0 HD13 ILE A 246 -2.033 0.216 -13.032 1.00 31.43 H new ATOM 1251 N ILE A 247 -1.629 0.609 -7.026 1.00 4.44 N ATOM 1252 CA ILE A 247 -1.587 -0.309 -5.907 1.00 10.13 C ATOM 1253 C ILE A 247 -2.857 -1.114 -5.761 1.00 12.01 C ATOM 1254 O ILE A 247 -3.971 -0.586 -5.861 1.00 52.44 O ATOM 1255 CB ILE A 247 -1.194 0.385 -4.561 1.00 2.13 C ATOM 1256 CG1 ILE A 247 0.305 0.659 -4.514 1.00 71.13 C ATOM 1257 CG2 ILE A 247 -1.640 -0.404 -3.351 1.00 10.44 C ATOM 1258 CD1 ILE A 247 0.769 1.360 -3.258 1.00 25.51 C ATOM 0 H ILE A 247 -2.366 1.312 -6.978 1.00 4.44 H new ATOM 0 HA ILE A 247 -0.789 -1.012 -6.145 1.00 10.13 H new ATOM 0 HB ILE A 247 -1.724 1.337 -4.526 1.00 2.13 H new ATOM 0 HG12 ILE A 247 0.839 -0.287 -4.607 1.00 71.13 H new ATOM 0 HG13 ILE A 247 0.579 1.266 -5.377 1.00 71.13 H new ATOM 0 HG21 ILE A 247 -1.342 0.122 -2.444 1.00 10.44 H new ATOM 0 HG22 ILE A 247 -2.724 -0.514 -3.368 1.00 10.44 H new ATOM 0 HG23 ILE A 247 -1.175 -1.390 -3.368 1.00 10.44 H new ATOM 0 HD11 ILE A 247 1.847 1.517 -3.306 1.00 25.51 H new ATOM 0 HD12 ILE A 247 0.266 2.323 -3.172 1.00 25.51 H new ATOM 0 HD13 ILE A 247 0.530 0.747 -2.389 1.00 25.51 H new ATOM 1265 N THR A 248 -2.668 -2.398 -5.573 1.00 24.12 N ATOM 1266 CA THR A 248 -3.720 -3.304 -5.289 1.00 5.32 C ATOM 1267 C THR A 248 -3.682 -3.618 -3.816 1.00 35.42 C ATOM 1268 O THR A 248 -2.692 -4.148 -3.324 1.00 52.24 O ATOM 1269 CB THR A 248 -3.539 -4.615 -6.065 1.00 63.21 C ATOM 1270 OG1 THR A 248 -3.454 -4.319 -7.457 1.00 74.42 O ATOM 1271 CG2 THR A 248 -4.713 -5.570 -5.818 1.00 5.34 C ATOM 0 H THR A 248 -1.749 -2.839 -5.618 1.00 24.12 H new ATOM 0 HA THR A 248 -4.668 -2.851 -5.580 1.00 5.32 H new ATOM 0 HB THR A 248 -2.626 -5.102 -5.722 1.00 63.21 H new ATOM 0 HG1 THR A 248 -2.606 -3.864 -7.643 1.00 74.42 H new ATOM 0 HG21 THR A 248 -4.558 -6.491 -6.381 1.00 5.34 H new ATOM 0 HG22 THR A 248 -4.777 -5.801 -4.755 1.00 5.34 H new ATOM 0 HG23 THR A 248 -5.640 -5.098 -6.143 1.00 5.34 H new ATOM 1277 N VAL A 249 -4.708 -3.267 -3.120 1.00 5.34 N ATOM 1278 CA VAL A 249 -4.810 -3.598 -1.723 1.00 40.21 C ATOM 1279 C VAL A 249 -6.059 -4.390 -1.468 1.00 61.41 C ATOM 1280 O VAL A 249 -6.954 -4.482 -2.333 1.00 24.30 O ATOM 1281 CB VAL A 249 -4.772 -2.365 -0.741 1.00 5.54 C ATOM 1282 CG1 VAL A 249 -3.425 -1.684 -0.720 1.00 72.54 C ATOM 1283 CG2 VAL A 249 -5.875 -1.366 -1.041 1.00 42.21 C ATOM 0 H VAL A 249 -5.501 -2.745 -3.492 1.00 5.34 H new ATOM 0 HA VAL A 249 -3.917 -4.185 -1.508 1.00 40.21 H new ATOM 0 HB VAL A 249 -4.947 -2.769 0.256 1.00 5.54 H new ATOM 0 HG11 VAL A 249 -3.454 -0.842 -0.028 1.00 72.54 H new ATOM 0 HG12 VAL A 249 -2.663 -2.394 -0.397 1.00 72.54 H new ATOM 0 HG13 VAL A 249 -3.184 -1.324 -1.720 1.00 72.54 H new ATOM 0 HG21 VAL A 249 -5.812 -0.533 -0.341 1.00 42.21 H new ATOM 0 HG22 VAL A 249 -5.762 -0.994 -2.059 1.00 42.21 H new ATOM 0 HG23 VAL A 249 -6.845 -1.853 -0.938 1.00 42.21 H new ATOM 1289 N LYS A 250 -6.089 -4.970 -0.331 1.00 22.35 N ATOM 1290 CA LYS A 250 -7.196 -5.720 0.183 1.00 52.13 C ATOM 1291 C LYS A 250 -7.490 -5.207 1.572 1.00 40.34 C ATOM 1292 O LYS A 250 -6.579 -5.101 2.392 1.00 32.22 O ATOM 1293 CB LYS A 250 -6.821 -7.204 0.277 1.00 3.54 C ATOM 1294 CG LYS A 250 -5.430 -7.394 0.847 1.00 10.30 C ATOM 1295 CD LYS A 250 -5.115 -8.799 1.272 1.00 51.42 C ATOM 1296 CE LYS A 250 -5.925 -9.207 2.480 1.00 3.42 C ATOM 1297 NZ LYS A 250 -5.378 -10.431 3.077 1.00 63.12 N ATOM 0 H LYS A 250 -5.300 -4.940 0.314 1.00 22.35 H new ATOM 0 HA LYS A 250 -8.061 -5.610 -0.472 1.00 52.13 H new ATOM 0 HB2 LYS A 250 -7.546 -7.724 0.904 1.00 3.54 H new ATOM 0 HB3 LYS A 250 -6.874 -7.656 -0.713 1.00 3.54 H new ATOM 0 HG2 LYS A 250 -4.700 -7.082 0.100 1.00 10.30 H new ATOM 0 HG3 LYS A 250 -5.310 -6.733 1.706 1.00 10.30 H new ATOM 0 HD2 LYS A 250 -5.318 -9.483 0.448 1.00 51.42 H new ATOM 0 HD3 LYS A 250 -4.052 -8.882 1.500 1.00 51.42 H new ATOM 0 HE2 LYS A 250 -5.921 -8.403 3.216 1.00 3.42 H new ATOM 0 HE3 LYS A 250 -6.963 -9.369 2.191 1.00 3.42 H new ATOM 0 HZ1 LYS A 250 -5.937 -10.688 3.916 1.00 63.12 H new ATOM 0 HZ2 LYS A 250 -5.420 -11.205 2.383 1.00 63.12 H new ATOM 0 HZ3 LYS A 250 -4.389 -10.269 3.356 1.00 63.12 H new ATOM 1311 N PRO A 251 -8.720 -4.858 1.869 1.00 53.12 N ATOM 1312 CA PRO A 251 -9.064 -4.440 3.204 1.00 61.02 C ATOM 1313 C PRO A 251 -8.953 -5.621 4.152 1.00 35.42 C ATOM 1314 O PRO A 251 -9.454 -6.708 3.857 1.00 74.12 O ATOM 1315 CB PRO A 251 -10.518 -3.958 3.089 1.00 24.23 C ATOM 1316 CG PRO A 251 -11.038 -4.544 1.817 1.00 45.12 C ATOM 1317 CD PRO A 251 -9.853 -4.813 0.939 1.00 63.40 C ATOM 0 HA PRO A 251 -8.409 -3.661 3.594 1.00 61.02 H new ATOM 0 HB2 PRO A 251 -11.109 -4.289 3.943 1.00 24.23 H new ATOM 0 HB3 PRO A 251 -10.569 -2.869 3.068 1.00 24.23 H new ATOM 0 HG2 PRO A 251 -11.589 -5.464 2.013 1.00 45.12 H new ATOM 0 HG3 PRO A 251 -11.730 -3.856 1.331 1.00 45.12 H new ATOM 0 HD2 PRO A 251 -9.963 -5.753 0.399 1.00 63.40 H new ATOM 0 HD3 PRO A 251 -9.725 -4.030 0.192 1.00 63.40 H new