USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=15 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 -153:sc= 0.0381 USER MOD Set 1.2: A 233 GLN : amide:sc= -0.722! K(o=-0.68!,f=0.65) USER MOD Single : A 158 HIS : no HE2:sc= -2.64! C(o=-2.6!,f=-4.2!) USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 180 THR OG1 : rot 180:sc= 0.0473 USER MOD Single : A 181 SER OG : rot 103:sc= 1.17 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 192 GLN : amide:sc= -1.59! K(o=-1.6!,f=-0.34) USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 208 SER OG : rot 180:sc= 0 USER MOD Single : A 209 THR OG1 : rot 180:sc= -1.03 USER MOD Single : A 215 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 ASN : amide:sc= 1.96 K(o=2,f=-6.8!) USER MOD Single : A 229 LYS NZ :NH3+ 149:sc= 1.29 (180deg=0.771) USER MOD Single : A 235 THR OG1 : rot 83:sc= 1.29 USER MOD Single : A 237 MET CE :methyl 152:sc= 0 (180deg=-0.632) USER MOD Single : A 238 MET CE :methyl -124:sc= 0 (180deg=-0.381) USER MOD Single : A 241 ASN : amide:sc= -0.893 X(o=-0.89,f=-0.86) USER MOD Single : A 242 SER OG : rot 68:sc= 1.25 USER MOD Single : A 243 SER OG : rot 180:sc= 0.00929 USER MOD Single : A 244 ASN : amide:sc= -1.28 K(o=-1.3,f=-4.5!) USER MOD Single : A 248 THR OG1 : rot 180:sc= -0.101 USER MOD Single : A 250 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 28 N HIS A 158 -9.513 -7.373 -3.064 1.00 25.51 N ATOM 29 CA HIS A 158 -8.496 -6.618 -3.755 1.00 25.41 C ATOM 30 C HIS A 158 -9.046 -5.381 -4.424 1.00 24.04 C ATOM 31 O HIS A 158 -10.053 -5.422 -5.129 1.00 12.11 O ATOM 32 CB HIS A 158 -7.759 -7.500 -4.765 1.00 52.34 C ATOM 33 CG HIS A 158 -6.832 -8.505 -4.153 1.00 13.32 C ATOM 34 ND1 HIS A 158 -7.161 -9.320 -3.085 1.00 31.32 N ATOM 35 CD2 HIS A 158 -5.548 -8.783 -4.436 1.00 71.51 C ATOM 36 CE1 HIS A 158 -6.107 -10.030 -2.755 1.00 60.53 C ATOM 37 NE2 HIS A 158 -5.131 -9.733 -3.561 1.00 35.12 N ATOM 0 HA HIS A 158 -7.786 -6.279 -3.001 1.00 25.41 H new ATOM 0 HB2 HIS A 158 -8.495 -8.026 -5.373 1.00 52.34 H new ATOM 0 HB3 HIS A 158 -7.188 -6.860 -5.438 1.00 52.34 H new ATOM 0 HD1 HIS A 158 -8.072 -9.362 -2.629 1.00 31.32 H new ATOM 0 HD2 HIS A 158 -4.955 -8.332 -5.218 1.00 71.51 H new ATOM 0 HE1 HIS A 158 -6.059 -10.744 -1.946 1.00 60.53 H new ATOM 46 N ARG A 159 -8.389 -4.292 -4.171 1.00 71.31 N ATOM 47 CA ARG A 159 -8.714 -3.024 -4.737 1.00 3.43 C ATOM 48 C ARG A 159 -7.646 -2.705 -5.768 1.00 53.53 C ATOM 49 O ARG A 159 -6.473 -3.009 -5.552 1.00 34.21 O ATOM 50 CB ARG A 159 -8.632 -1.954 -3.654 1.00 33.43 C ATOM 51 CG ARG A 159 -9.181 -0.596 -4.056 1.00 54.54 C ATOM 52 CD ARG A 159 -10.696 -0.592 -4.057 1.00 24.24 C ATOM 53 NE ARG A 159 -11.214 -0.781 -2.698 1.00 33.44 N ATOM 54 CZ ARG A 159 -12.478 -0.624 -2.320 1.00 54.42 C ATOM 55 NH1 ARG A 159 -13.414 -0.314 -3.213 1.00 72.35 N ATOM 56 NH2 ARG A 159 -12.802 -0.782 -1.043 1.00 55.32 N ATOM 0 H ARG A 159 -7.585 -4.263 -3.544 1.00 71.31 H new ATOM 0 HA ARG A 159 -9.713 -3.047 -5.171 1.00 3.43 H new ATOM 0 HB2 ARG A 159 -9.175 -2.304 -2.776 1.00 33.43 H new ATOM 0 HB3 ARG A 159 -7.590 -1.836 -3.358 1.00 33.43 H new ATOM 0 HG2 ARG A 159 -8.814 0.165 -3.368 1.00 54.54 H new ATOM 0 HG3 ARG A 159 -8.814 -0.332 -5.048 1.00 54.54 H new ATOM 0 HD2 ARG A 159 -11.062 0.351 -4.464 1.00 24.24 H new ATOM 0 HD3 ARG A 159 -11.067 -1.385 -4.707 1.00 24.24 H new ATOM 0 HE ARG A 159 -10.545 -1.057 -1.980 1.00 33.44 H new ATOM 0 HH11 ARG A 159 -13.163 -0.195 -4.195 1.00 72.35 H new ATOM 0 HH12 ARG A 159 -14.383 -0.195 -2.916 1.00 72.35 H new ATOM 0 HH21 ARG A 159 -12.083 -1.022 -0.360 1.00 55.32 H new ATOM 0 HH22 ARG A 159 -13.770 -0.663 -0.744 1.00 55.32 H new ATOM 68 N ARG A 160 -8.033 -2.128 -6.860 1.00 73.55 N ATOM 69 CA ARG A 160 -7.080 -1.693 -7.869 1.00 23.42 C ATOM 70 C ARG A 160 -7.131 -0.193 -7.964 1.00 72.35 C ATOM 71 O ARG A 160 -8.157 0.372 -8.361 1.00 53.10 O ATOM 72 CB ARG A 160 -7.353 -2.293 -9.275 1.00 21.14 C ATOM 73 CG ARG A 160 -7.144 -3.804 -9.442 1.00 53.54 C ATOM 74 CD ARG A 160 -8.161 -4.645 -8.688 1.00 42.20 C ATOM 75 NE ARG A 160 -7.921 -6.072 -8.903 1.00 62.01 N ATOM 76 CZ ARG A 160 -8.577 -7.066 -8.306 1.00 51.51 C ATOM 77 NH1 ARG A 160 -9.558 -6.815 -7.473 1.00 42.11 N ATOM 78 NH2 ARG A 160 -8.250 -8.315 -8.560 1.00 31.12 N ATOM 0 H ARG A 160 -9.008 -1.939 -7.091 1.00 73.55 H new ATOM 0 HA ARG A 160 -6.098 -2.047 -7.557 1.00 23.42 H new ATOM 0 HB2 ARG A 160 -8.383 -2.062 -9.548 1.00 21.14 H new ATOM 0 HB3 ARG A 160 -6.711 -1.781 -9.992 1.00 21.14 H new ATOM 0 HG2 ARG A 160 -7.192 -4.054 -10.502 1.00 53.54 H new ATOM 0 HG3 ARG A 160 -6.143 -4.064 -9.098 1.00 53.54 H new ATOM 0 HD2 ARG A 160 -8.107 -4.420 -7.623 1.00 42.20 H new ATOM 0 HD3 ARG A 160 -9.168 -4.388 -9.018 1.00 42.20 H new ATOM 0 HE ARG A 160 -7.189 -6.328 -9.566 1.00 62.01 H new ATOM 0 HH11 ARG A 160 -9.826 -5.851 -7.276 1.00 42.11 H new ATOM 0 HH12 ARG A 160 -10.053 -7.584 -7.022 1.00 42.11 H new ATOM 0 HH21 ARG A 160 -7.495 -8.522 -9.214 1.00 31.12 H new ATOM 0 HH22 ARG A 160 -8.752 -9.077 -8.103 1.00 31.12 H new ATOM 90 N VAL A 161 -6.065 0.455 -7.575 1.00 55.44 N ATOM 91 CA VAL A 161 -5.991 1.897 -7.634 1.00 4.44 C ATOM 92 C VAL A 161 -4.741 2.370 -8.332 1.00 53.12 C ATOM 93 O VAL A 161 -3.661 1.814 -8.138 1.00 2.41 O ATOM 94 CB VAL A 161 -6.080 2.557 -6.233 1.00 54.34 C ATOM 95 CG1 VAL A 161 -7.457 2.375 -5.648 1.00 0.21 C ATOM 96 CG2 VAL A 161 -5.027 1.982 -5.290 1.00 75.30 C ATOM 0 H VAL A 161 -5.226 0.004 -7.210 1.00 55.44 H new ATOM 0 HA VAL A 161 -6.860 2.209 -8.214 1.00 4.44 H new ATOM 0 HB VAL A 161 -5.888 3.623 -6.352 1.00 54.34 H new ATOM 0 HG11 VAL A 161 -7.500 2.845 -4.665 1.00 0.21 H new ATOM 0 HG12 VAL A 161 -8.195 2.837 -6.304 1.00 0.21 H new ATOM 0 HG13 VAL A 161 -7.674 1.311 -5.551 1.00 0.21 H new ATOM 0 HG21 VAL A 161 -5.111 2.462 -4.315 1.00 75.30 H new ATOM 0 HG22 VAL A 161 -5.183 0.909 -5.181 1.00 75.30 H new ATOM 0 HG23 VAL A 161 -4.033 2.164 -5.700 1.00 75.30 H new ATOM 102 N ARG A 162 -4.888 3.367 -9.162 1.00 40.04 N ATOM 103 CA ARG A 162 -3.754 3.988 -9.777 1.00 33.40 C ATOM 104 C ARG A 162 -3.680 5.428 -9.326 1.00 31.53 C ATOM 105 O ARG A 162 -4.542 6.255 -9.656 1.00 0.31 O ATOM 106 CB ARG A 162 -3.763 3.865 -11.295 1.00 71.35 C ATOM 107 CG ARG A 162 -2.532 4.475 -11.961 1.00 10.33 C ATOM 108 CD ARG A 162 -2.529 4.257 -13.468 1.00 31.21 C ATOM 109 NE ARG A 162 -3.710 4.810 -14.122 1.00 32.33 N ATOM 110 CZ ARG A 162 -3.839 5.008 -15.437 1.00 44.35 C ATOM 111 NH1 ARG A 162 -2.811 4.822 -16.250 1.00 31.14 N ATOM 112 NH2 ARG A 162 -4.991 5.424 -15.930 1.00 42.02 N ATOM 0 H ARG A 162 -5.789 3.766 -9.427 1.00 40.04 H new ATOM 0 HA ARG A 162 -2.855 3.462 -9.455 1.00 33.40 H new ATOM 0 HB2 ARG A 162 -3.829 2.811 -11.566 1.00 71.35 H new ATOM 0 HB3 ARG A 162 -4.657 4.351 -11.686 1.00 71.35 H new ATOM 0 HG2 ARG A 162 -2.498 5.544 -11.750 1.00 10.33 H new ATOM 0 HG3 ARG A 162 -1.632 4.036 -11.530 1.00 10.33 H new ATOM 0 HD2 ARG A 162 -1.636 4.714 -13.895 1.00 31.21 H new ATOM 0 HD3 ARG A 162 -2.471 3.189 -13.676 1.00 31.21 H new ATOM 0 HE ARG A 162 -4.499 5.066 -13.529 1.00 32.33 H new ATOM 0 HH11 ARG A 162 -1.911 4.525 -15.874 1.00 31.14 H new ATOM 0 HH12 ARG A 162 -2.919 4.976 -17.253 1.00 31.14 H new ATOM 0 HH21 ARG A 162 -5.781 5.594 -15.307 1.00 42.02 H new ATOM 0 HH22 ARG A 162 -5.091 5.576 -16.934 1.00 42.02 H new ATOM 124 N LEU A 163 -2.676 5.705 -8.580 1.00 35.23 N ATOM 125 CA LEU A 163 -2.460 6.970 -7.966 1.00 74.51 C ATOM 126 C LEU A 163 -1.418 7.678 -8.763 1.00 4.34 C ATOM 127 O LEU A 163 -0.490 7.033 -9.216 1.00 60.14 O ATOM 128 CB LEU A 163 -1.904 6.746 -6.558 1.00 12.35 C ATOM 129 CG LEU A 163 -2.569 5.631 -5.753 1.00 1.12 C ATOM 130 CD1 LEU A 163 -2.009 5.574 -4.375 1.00 55.23 C ATOM 131 CD2 LEU A 163 -4.082 5.744 -5.722 1.00 64.40 C ATOM 0 H LEU A 163 -1.945 5.026 -8.368 1.00 35.23 H new ATOM 0 HA LEU A 163 -3.387 7.541 -7.919 1.00 74.51 H new ATOM 0 HB2 LEU A 163 -0.840 6.526 -6.638 1.00 12.35 H new ATOM 0 HB3 LEU A 163 -1.996 7.677 -5.999 1.00 12.35 H new ATOM 0 HG LEU A 163 -2.343 4.696 -6.265 1.00 1.12 H new ATOM 0 HD11 LEU A 163 -2.495 4.774 -3.817 1.00 55.23 H new ATOM 0 HD12 LEU A 163 -0.937 5.382 -4.425 1.00 55.23 H new ATOM 0 HD13 LEU A 163 -2.184 6.525 -3.872 1.00 55.23 H new ATOM 0 HD21 LEU A 163 -4.496 4.924 -5.135 1.00 64.40 H new ATOM 0 HD22 LEU A 163 -4.367 6.694 -5.270 1.00 64.40 H new ATOM 0 HD23 LEU A 163 -4.471 5.695 -6.739 1.00 64.40 H new ATOM 139 N LEU A 164 -1.591 8.969 -8.989 1.00 20.15 N ATOM 140 CA LEU A 164 -0.588 9.774 -9.649 1.00 34.04 C ATOM 141 C LEU A 164 -0.468 9.298 -11.096 1.00 11.40 C ATOM 142 O LEU A 164 0.448 8.581 -11.463 1.00 31.55 O ATOM 143 CB LEU A 164 0.761 9.657 -8.879 1.00 61.24 C ATOM 144 CG LEU A 164 1.787 10.788 -8.990 1.00 25.23 C ATOM 145 CD1 LEU A 164 2.284 10.970 -10.385 1.00 34.32 C ATOM 146 CD2 LEU A 164 1.218 12.075 -8.447 1.00 74.31 C ATOM 0 H LEU A 164 -2.429 9.484 -8.720 1.00 20.15 H new ATOM 0 HA LEU A 164 -0.868 10.827 -9.653 1.00 34.04 H new ATOM 0 HB2 LEU A 164 0.525 9.531 -7.822 1.00 61.24 H new ATOM 0 HB3 LEU A 164 1.248 8.739 -9.209 1.00 61.24 H new ATOM 0 HG LEU A 164 2.647 10.503 -8.385 1.00 25.23 H new ATOM 0 HD11 LEU A 164 3.009 11.784 -10.410 1.00 34.32 H new ATOM 0 HD12 LEU A 164 2.760 10.050 -10.725 1.00 34.32 H new ATOM 0 HD13 LEU A 164 1.447 11.210 -11.041 1.00 34.32 H new ATOM 0 HD21 LEU A 164 1.962 12.867 -8.534 1.00 74.31 H new ATOM 0 HD22 LEU A 164 0.329 12.348 -9.015 1.00 74.31 H new ATOM 0 HD23 LEU A 164 0.952 11.941 -7.398 1.00 74.31 H new ATOM 260 N LEU A 172 1.575 11.860 -2.799 1.00 22.35 N ATOM 261 CA LEU A 172 0.504 10.881 -2.932 1.00 70.13 C ATOM 262 C LEU A 172 -0.465 11.012 -1.786 1.00 11.13 C ATOM 263 O LEU A 172 -1.678 10.889 -1.959 1.00 72.53 O ATOM 264 CB LEU A 172 1.021 9.439 -2.989 1.00 55.00 C ATOM 265 CG LEU A 172 1.795 8.971 -4.232 1.00 62.03 C ATOM 266 CD1 LEU A 172 0.967 9.141 -5.477 1.00 53.43 C ATOM 267 CD2 LEU A 172 3.150 9.641 -4.377 1.00 23.35 C ATOM 0 HA LEU A 172 0.006 11.092 -3.878 1.00 70.13 H new ATOM 0 HB2 LEU A 172 1.666 9.287 -2.124 1.00 55.00 H new ATOM 0 HB3 LEU A 172 0.163 8.777 -2.868 1.00 55.00 H new ATOM 0 HG LEU A 172 1.995 7.909 -4.091 1.00 62.03 H new ATOM 0 HD11 LEU A 172 1.537 8.803 -6.342 1.00 53.43 H new ATOM 0 HD12 LEU A 172 0.055 8.551 -5.391 1.00 53.43 H new ATOM 0 HD13 LEU A 172 0.709 10.193 -5.601 1.00 53.43 H new ATOM 0 HD21 LEU A 172 3.646 9.268 -5.273 1.00 23.35 H new ATOM 0 HD22 LEU A 172 3.016 10.720 -4.459 1.00 23.35 H new ATOM 0 HD23 LEU A 172 3.762 9.417 -3.503 1.00 23.35 H new ATOM 275 N GLY A 173 0.074 11.242 -0.619 1.00 31.31 N ATOM 276 CA GLY A 173 -0.736 11.467 0.526 1.00 22.03 C ATOM 277 C GLY A 173 -1.067 10.211 1.283 1.00 73.34 C ATOM 278 O GLY A 173 -2.085 10.151 1.963 1.00 2.15 O ATOM 0 H GLY A 173 1.079 11.277 -0.446 1.00 31.31 H new ATOM 0 HA2 GLY A 173 -0.223 12.160 1.194 1.00 22.03 H new ATOM 0 HA3 GLY A 173 -1.663 11.950 0.216 1.00 22.03 H new ATOM 282 N PHE A 174 -0.242 9.201 1.169 1.00 74.32 N ATOM 283 CA PHE A 174 -0.442 8.020 1.971 1.00 43.45 C ATOM 284 C PHE A 174 0.917 7.494 2.367 1.00 54.31 C ATOM 285 O PHE A 174 1.901 7.697 1.648 1.00 13.14 O ATOM 286 CB PHE A 174 -1.288 6.920 1.214 1.00 51.42 C ATOM 287 CG PHE A 174 -0.583 6.209 0.058 1.00 43.15 C ATOM 288 CD1 PHE A 174 -0.345 6.847 -1.148 1.00 61.45 C ATOM 289 CD2 PHE A 174 -0.157 4.895 0.199 1.00 51.12 C ATOM 290 CE1 PHE A 174 0.319 6.197 -2.178 1.00 31.23 C ATOM 291 CE2 PHE A 174 0.498 4.241 -0.833 1.00 51.32 C ATOM 292 CZ PHE A 174 0.740 4.900 -2.022 1.00 71.01 C ATOM 0 H PHE A 174 0.561 9.171 0.541 1.00 74.32 H new ATOM 0 HA PHE A 174 -1.020 8.278 2.858 1.00 43.45 H new ATOM 0 HB2 PHE A 174 -1.602 6.169 1.939 1.00 51.42 H new ATOM 0 HB3 PHE A 174 -2.193 7.388 0.828 1.00 51.42 H new ATOM 0 HD1 PHE A 174 -0.681 7.864 -1.288 1.00 61.45 H new ATOM 0 HD2 PHE A 174 -0.339 4.374 1.127 1.00 51.12 H new ATOM 0 HE1 PHE A 174 0.506 6.714 -3.108 1.00 31.23 H new ATOM 0 HE2 PHE A 174 0.819 3.217 -0.707 1.00 51.32 H new ATOM 0 HZ PHE A 174 1.258 4.397 -2.825 1.00 71.01 H new ATOM 302 N TYR A 175 0.984 6.838 3.489 1.00 31.10 N ATOM 303 CA TYR A 175 2.216 6.255 3.962 1.00 63.02 C ATOM 304 C TYR A 175 1.994 4.845 4.367 1.00 31.35 C ATOM 305 O TYR A 175 0.891 4.472 4.785 1.00 61.51 O ATOM 306 CB TYR A 175 2.813 7.045 5.113 1.00 73.32 C ATOM 307 CG TYR A 175 3.245 8.428 4.727 1.00 63.40 C ATOM 308 CD1 TYR A 175 4.513 8.655 4.212 1.00 61.45 C ATOM 309 CD2 TYR A 175 2.391 9.501 4.868 1.00 20.34 C ATOM 310 CE1 TYR A 175 4.917 9.915 3.849 1.00 15.43 C ATOM 311 CE2 TYR A 175 2.788 10.771 4.506 1.00 60.00 C ATOM 312 CZ TYR A 175 4.054 10.969 3.997 1.00 61.35 C ATOM 313 OH TYR A 175 4.454 12.233 3.628 1.00 35.11 O ATOM 0 H TYR A 175 0.186 6.689 4.107 1.00 31.10 H new ATOM 0 HA TYR A 175 2.930 6.285 3.139 1.00 63.02 H new ATOM 0 HB2 TYR A 175 2.079 7.113 5.916 1.00 73.32 H new ATOM 0 HB3 TYR A 175 3.671 6.502 5.510 1.00 73.32 H new ATOM 0 HD1 TYR A 175 5.194 7.825 4.095 1.00 61.45 H new ATOM 0 HD2 TYR A 175 1.399 9.345 5.267 1.00 20.34 H new ATOM 0 HE1 TYR A 175 5.908 10.075 3.450 1.00 15.43 H new ATOM 0 HE2 TYR A 175 2.112 11.605 4.620 1.00 60.00 H new ATOM 0 HH TYR A 175 3.727 12.868 3.795 1.00 35.11 H new ATOM 323 N ILE A 176 3.022 4.072 4.284 1.00 44.34 N ATOM 324 CA ILE A 176 2.922 2.667 4.516 1.00 42.14 C ATOM 325 C ILE A 176 3.745 2.221 5.722 1.00 52.04 C ATOM 326 O ILE A 176 4.535 2.981 6.275 1.00 40.34 O ATOM 327 CB ILE A 176 3.265 1.798 3.255 1.00 52.31 C ATOM 328 CG1 ILE A 176 4.762 1.844 2.852 1.00 31.20 C ATOM 329 CG2 ILE A 176 2.368 2.158 2.071 1.00 14.22 C ATOM 330 CD1 ILE A 176 5.310 3.193 2.495 1.00 24.54 C ATOM 0 H ILE A 176 3.961 4.396 4.052 1.00 44.34 H new ATOM 0 HA ILE A 176 1.870 2.491 4.740 1.00 42.14 H new ATOM 0 HB ILE A 176 3.064 0.767 3.546 1.00 52.31 H new ATOM 0 HG12 ILE A 176 5.351 1.442 3.676 1.00 31.20 H new ATOM 0 HG13 ILE A 176 4.908 1.179 2.001 1.00 31.20 H new ATOM 0 HG21 ILE A 176 2.631 1.538 1.214 1.00 14.22 H new ATOM 0 HG22 ILE A 176 1.326 1.984 2.338 1.00 14.22 H new ATOM 0 HG23 ILE A 176 2.507 3.209 1.816 1.00 14.22 H new ATOM 0 HD11 ILE A 176 6.363 3.100 2.231 1.00 24.54 H new ATOM 0 HD12 ILE A 176 4.758 3.597 1.646 1.00 24.54 H new ATOM 0 HD13 ILE A 176 5.208 3.865 3.347 1.00 24.54 H new ATOM 337 N ARG A 177 3.529 1.009 6.097 1.00 3.33 N ATOM 338 CA ARG A 177 4.115 0.367 7.274 1.00 4.13 C ATOM 339 C ARG A 177 4.299 -1.112 7.014 1.00 63.24 C ATOM 340 O ARG A 177 3.612 -1.677 6.176 1.00 53.23 O ATOM 341 CB ARG A 177 3.201 0.527 8.489 1.00 55.24 C ATOM 342 CG ARG A 177 1.763 0.151 8.184 1.00 65.24 C ATOM 343 CD ARG A 177 0.903 0.007 9.418 1.00 61.10 C ATOM 344 NE ARG A 177 -0.523 -0.154 9.054 1.00 75.34 N ATOM 345 CZ ARG A 177 -1.358 -1.089 9.527 1.00 31.54 C ATOM 346 NH1 ARG A 177 -0.915 -2.046 10.338 1.00 75.15 N ATOM 347 NH2 ARG A 177 -2.638 -1.085 9.140 1.00 72.13 N ATOM 0 H ARG A 177 2.909 0.386 5.579 1.00 3.33 H new ATOM 0 HA ARG A 177 5.075 0.843 7.473 1.00 4.13 H new ATOM 0 HB2 ARG A 177 3.572 -0.095 9.304 1.00 55.24 H new ATOM 0 HB3 ARG A 177 3.238 1.560 8.835 1.00 55.24 H new ATOM 0 HG2 ARG A 177 1.327 0.910 7.534 1.00 65.24 H new ATOM 0 HG3 ARG A 177 1.751 -0.788 7.631 1.00 65.24 H new ATOM 0 HD2 ARG A 177 1.234 -0.855 9.998 1.00 61.10 H new ATOM 0 HD3 ARG A 177 1.023 0.884 10.054 1.00 61.10 H new ATOM 0 HE ARG A 177 -0.906 0.509 8.380 1.00 75.34 H new ATOM 0 HH11 ARG A 177 0.069 -2.073 10.605 1.00 75.15 H new ATOM 0 HH12 ARG A 177 -1.559 -2.753 10.692 1.00 75.15 H new ATOM 0 HH21 ARG A 177 -2.972 -0.374 8.490 1.00 72.13 H new ATOM 0 HH22 ARG A 177 -3.280 -1.793 9.495 1.00 72.13 H new ATOM 359 N ASP A 178 5.209 -1.715 7.720 1.00 1.52 N ATOM 360 CA ASP A 178 5.483 -3.148 7.588 1.00 73.25 C ATOM 361 C ASP A 178 5.044 -3.899 8.832 1.00 53.05 C ATOM 362 O ASP A 178 5.119 -3.375 9.953 1.00 41.22 O ATOM 363 CB ASP A 178 6.979 -3.404 7.334 1.00 34.42 C ATOM 364 CG ASP A 178 7.351 -4.888 7.367 1.00 24.53 C ATOM 365 OD1 ASP A 178 7.142 -5.589 6.373 1.00 61.01 O ATOM 366 OD2 ASP A 178 7.877 -5.363 8.414 1.00 44.53 O ATOM 0 H ASP A 178 5.793 -1.242 8.410 1.00 1.52 H new ATOM 0 HA ASP A 178 4.913 -3.512 6.733 1.00 73.25 H new ATOM 0 HB2 ASP A 178 7.252 -2.989 6.364 1.00 34.42 H new ATOM 0 HB3 ASP A 178 7.564 -2.873 8.084 1.00 34.42 H new ATOM 371 N GLY A 179 4.564 -5.087 8.633 1.00 25.11 N ATOM 372 CA GLY A 179 4.197 -5.954 9.706 1.00 43.42 C ATOM 373 C GLY A 179 4.097 -7.351 9.186 1.00 11.30 C ATOM 374 O GLY A 179 4.197 -7.559 7.986 1.00 43.30 O ATOM 0 H GLY A 179 4.414 -5.486 7.706 1.00 25.11 H new ATOM 0 HA2 GLY A 179 4.938 -5.901 10.504 1.00 43.42 H new ATOM 0 HA3 GLY A 179 3.244 -5.642 10.134 1.00 43.42 H new ATOM 378 N THR A 180 3.935 -8.309 10.038 1.00 21.51 N ATOM 379 CA THR A 180 3.749 -9.645 9.573 1.00 53.40 C ATOM 380 C THR A 180 2.306 -9.935 9.285 1.00 34.41 C ATOM 381 O THR A 180 1.439 -9.771 10.142 1.00 74.23 O ATOM 382 CB THR A 180 4.293 -10.684 10.534 1.00 10.03 C ATOM 383 OG1 THR A 180 4.320 -10.183 11.883 1.00 42.33 O ATOM 384 CG2 THR A 180 5.635 -11.243 10.098 1.00 1.12 C ATOM 0 H THR A 180 3.927 -8.195 11.052 1.00 21.51 H new ATOM 0 HA THR A 180 4.320 -9.715 8.647 1.00 53.40 H new ATOM 0 HB THR A 180 3.603 -11.527 10.513 1.00 10.03 H new ATOM 0 HG1 THR A 180 4.673 -10.874 12.482 1.00 42.33 H new ATOM 0 HG21 THR A 180 5.975 -11.982 10.824 1.00 1.12 H new ATOM 0 HG22 THR A 180 5.532 -11.715 9.121 1.00 1.12 H new ATOM 0 HG23 THR A 180 6.363 -10.434 10.036 1.00 1.12 H new ATOM 390 N SER A 181 2.048 -10.344 8.096 1.00 23.31 N ATOM 391 CA SER A 181 0.748 -10.703 7.707 1.00 20.30 C ATOM 392 C SER A 181 0.668 -12.204 7.690 1.00 52.42 C ATOM 393 O SER A 181 1.391 -12.863 6.943 1.00 74.55 O ATOM 394 CB SER A 181 0.413 -10.139 6.325 1.00 44.01 C ATOM 395 OG SER A 181 -0.932 -10.449 5.966 1.00 53.42 O ATOM 0 H SER A 181 2.749 -10.437 7.361 1.00 23.31 H new ATOM 0 HA SER A 181 0.026 -10.290 8.411 1.00 20.30 H new ATOM 0 HB2 SER A 181 0.555 -9.058 6.324 1.00 44.01 H new ATOM 0 HB3 SER A 181 1.097 -10.551 5.583 1.00 44.01 H new ATOM 0 HG SER A 181 -1.493 -9.653 6.079 1.00 53.42 H new ATOM 517 N LYS A 191 2.753 -16.641 7.821 1.00 44.14 N ATOM 518 CA LYS A 191 3.104 -15.282 8.141 1.00 45.10 C ATOM 519 C LYS A 191 4.233 -14.834 7.231 1.00 13.25 C ATOM 520 O LYS A 191 5.215 -15.567 7.042 1.00 73.14 O ATOM 521 CB LYS A 191 3.561 -15.222 9.596 1.00 2.42 C ATOM 522 CG LYS A 191 3.546 -13.876 10.217 1.00 13.35 C ATOM 523 CD LYS A 191 4.000 -13.930 11.685 1.00 11.42 C ATOM 524 CE LYS A 191 3.060 -14.769 12.546 1.00 3.14 C ATOM 525 NZ LYS A 191 3.442 -14.752 13.974 1.00 65.41 N ATOM 0 HA LYS A 191 2.244 -14.627 8.000 1.00 45.10 H new ATOM 0 HB2 LYS A 191 2.924 -15.882 10.186 1.00 2.42 H new ATOM 0 HB3 LYS A 191 4.574 -15.619 9.657 1.00 2.42 H new ATOM 0 HG2 LYS A 191 4.200 -13.208 9.657 1.00 13.35 H new ATOM 0 HG3 LYS A 191 2.541 -13.459 10.161 1.00 13.35 H new ATOM 0 HD2 LYS A 191 5.007 -14.345 11.738 1.00 11.42 H new ATOM 0 HD3 LYS A 191 4.051 -12.918 12.086 1.00 11.42 H new ATOM 0 HE2 LYS A 191 2.042 -14.394 12.440 1.00 3.14 H new ATOM 0 HE3 LYS A 191 3.060 -15.797 12.184 1.00 3.14 H new ATOM 0 HZ1 LYS A 191 2.775 -15.335 14.519 1.00 65.41 H new ATOM 0 HZ2 LYS A 191 4.403 -15.134 14.081 1.00 65.41 H new ATOM 0 HZ3 LYS A 191 3.417 -13.775 14.329 1.00 65.41 H new ATOM 539 N GLN A 192 4.100 -13.671 6.673 1.00 20.13 N ATOM 540 CA GLN A 192 5.111 -13.126 5.792 1.00 73.41 C ATOM 541 C GLN A 192 5.161 -11.623 6.027 1.00 43.20 C ATOM 542 O GLN A 192 4.236 -11.076 6.651 1.00 14.35 O ATOM 543 CB GLN A 192 4.740 -13.391 4.314 1.00 45.14 C ATOM 544 CG GLN A 192 3.576 -12.548 3.801 1.00 52.41 C ATOM 545 CD GLN A 192 3.279 -12.774 2.336 1.00 40.34 C ATOM 546 OE1 GLN A 192 3.458 -13.869 1.810 1.00 2.20 O ATOM 547 NE2 GLN A 192 2.896 -11.724 1.653 1.00 21.45 N ATOM 0 H GLN A 192 3.291 -13.065 6.809 1.00 20.13 H new ATOM 0 HA GLN A 192 6.074 -13.594 5.997 1.00 73.41 H new ATOM 0 HB2 GLN A 192 5.614 -13.200 3.692 1.00 45.14 H new ATOM 0 HB3 GLN A 192 4.490 -14.445 4.197 1.00 45.14 H new ATOM 0 HG2 GLN A 192 2.685 -12.776 4.385 1.00 52.41 H new ATOM 0 HG3 GLN A 192 3.801 -11.494 3.961 1.00 52.41 H new ATOM 0 HE21 GLN A 192 2.758 -10.831 2.126 1.00 21.45 H new ATOM 0 HE22 GLN A 192 2.736 -11.800 0.648 1.00 21.45 H new ATOM 555 N PRO A 193 6.216 -10.924 5.578 1.00 32.12 N ATOM 556 CA PRO A 193 6.250 -9.475 5.670 1.00 21.11 C ATOM 557 C PRO A 193 5.156 -8.874 4.784 1.00 5.52 C ATOM 558 O PRO A 193 4.977 -9.283 3.620 1.00 32.23 O ATOM 559 CB PRO A 193 7.639 -9.101 5.131 1.00 13.30 C ATOM 560 CG PRO A 193 8.430 -10.362 5.184 1.00 4.11 C ATOM 561 CD PRO A 193 7.446 -11.470 4.978 1.00 42.34 C ATOM 0 HA PRO A 193 6.081 -9.107 6.682 1.00 21.11 H new ATOM 0 HB2 PRO A 193 7.576 -8.718 4.112 1.00 13.30 H new ATOM 0 HB3 PRO A 193 8.100 -8.321 5.737 1.00 13.30 H new ATOM 0 HG2 PRO A 193 9.199 -10.374 4.412 1.00 4.11 H new ATOM 0 HG3 PRO A 193 8.939 -10.464 6.142 1.00 4.11 H new ATOM 0 HD2 PRO A 193 7.313 -11.703 3.921 1.00 42.34 H new ATOM 0 HD3 PRO A 193 7.763 -12.390 5.469 1.00 42.34 H new ATOM 569 N GLY A 194 4.428 -7.955 5.324 1.00 12.14 N ATOM 570 CA GLY A 194 3.378 -7.337 4.606 1.00 14.33 C ATOM 571 C GLY A 194 3.367 -5.880 4.855 1.00 51.51 C ATOM 572 O GLY A 194 3.631 -5.433 5.974 1.00 4.40 O ATOM 0 H GLY A 194 4.549 -7.614 6.278 1.00 12.14 H new ATOM 0 HA2 GLY A 194 3.497 -7.529 3.540 1.00 14.33 H new ATOM 0 HA3 GLY A 194 2.423 -7.770 4.903 1.00 14.33 H new ATOM 576 N ILE A 195 3.087 -5.138 3.844 1.00 22.24 N ATOM 577 CA ILE A 195 3.036 -3.733 3.963 1.00 55.01 C ATOM 578 C ILE A 195 1.592 -3.287 3.994 1.00 74.11 C ATOM 579 O ILE A 195 0.759 -3.778 3.240 1.00 51.23 O ATOM 580 CB ILE A 195 3.843 -2.984 2.844 1.00 53.20 C ATOM 581 CG1 ILE A 195 5.353 -3.265 2.925 1.00 12.24 C ATOM 582 CG2 ILE A 195 3.599 -1.498 2.872 1.00 1.12 C ATOM 583 CD1 ILE A 195 5.796 -4.625 2.438 1.00 22.51 C ATOM 0 H ILE A 195 2.887 -5.494 2.909 1.00 22.24 H new ATOM 0 HA ILE A 195 3.524 -3.463 4.899 1.00 55.01 H new ATOM 0 HB ILE A 195 3.474 -3.379 1.897 1.00 53.20 H new ATOM 0 HG12 ILE A 195 5.877 -2.504 2.346 1.00 12.24 H new ATOM 0 HG13 ILE A 195 5.670 -3.150 3.962 1.00 12.24 H new ATOM 0 HG21 ILE A 195 4.177 -1.019 2.081 1.00 1.12 H new ATOM 0 HG22 ILE A 195 2.538 -1.300 2.717 1.00 1.12 H new ATOM 0 HG23 ILE A 195 3.905 -1.097 3.838 1.00 1.12 H new ATOM 0 HD11 ILE A 195 6.877 -4.714 2.541 1.00 22.51 H new ATOM 0 HD12 ILE A 195 5.310 -5.400 3.031 1.00 22.51 H new ATOM 0 HD13 ILE A 195 5.520 -4.744 1.390 1.00 22.51 H new ATOM 590 N PHE A 196 1.309 -2.399 4.875 1.00 33.44 N ATOM 591 CA PHE A 196 -0.024 -1.891 5.077 1.00 63.41 C ATOM 592 C PHE A 196 0.046 -0.385 5.028 1.00 65.02 C ATOM 593 O PHE A 196 1.137 0.183 5.060 1.00 42.45 O ATOM 594 CB PHE A 196 -0.545 -2.292 6.470 1.00 41.23 C ATOM 595 CG PHE A 196 -0.561 -3.764 6.790 1.00 64.41 C ATOM 596 CD1 PHE A 196 0.611 -4.434 7.117 1.00 42.50 C ATOM 597 CD2 PHE A 196 -1.747 -4.469 6.789 1.00 63.13 C ATOM 598 CE1 PHE A 196 0.599 -5.775 7.430 1.00 70.52 C ATOM 599 CE2 PHE A 196 -1.767 -5.812 7.100 1.00 22.12 C ATOM 600 CZ PHE A 196 -0.592 -6.465 7.421 1.00 53.45 C ATOM 0 H PHE A 196 2.004 -1.987 5.497 1.00 33.44 H new ATOM 0 HA PHE A 196 -0.687 -2.294 4.311 1.00 63.41 H new ATOM 0 HB2 PHE A 196 0.065 -1.788 7.219 1.00 41.23 H new ATOM 0 HB3 PHE A 196 -1.560 -1.910 6.576 1.00 41.23 H new ATOM 0 HD1 PHE A 196 1.547 -3.895 7.126 1.00 42.50 H new ATOM 0 HD2 PHE A 196 -2.669 -3.964 6.542 1.00 63.13 H new ATOM 0 HE1 PHE A 196 1.519 -6.282 7.681 1.00 70.52 H new ATOM 0 HE2 PHE A 196 -2.701 -6.354 7.093 1.00 22.12 H new ATOM 0 HZ PHE A 196 -0.608 -7.517 7.665 1.00 53.45 H new ATOM 610 N ILE A 197 -1.077 0.255 4.942 1.00 25.43 N ATOM 611 CA ILE A 197 -1.129 1.699 5.007 1.00 13.50 C ATOM 612 C ILE A 197 -1.136 2.142 6.478 1.00 73.24 C ATOM 613 O ILE A 197 -1.833 1.581 7.301 1.00 70.22 O ATOM 614 CB ILE A 197 -2.341 2.272 4.229 1.00 55.44 C ATOM 615 CG1 ILE A 197 -2.221 1.868 2.752 1.00 13.21 C ATOM 616 CG2 ILE A 197 -2.416 3.800 4.370 1.00 31.31 C ATOM 617 CD1 ILE A 197 -3.326 2.386 1.872 1.00 52.21 C ATOM 0 H ILE A 197 -1.984 -0.196 4.825 1.00 25.43 H new ATOM 0 HA ILE A 197 -0.240 2.102 4.521 1.00 13.50 H new ATOM 0 HB ILE A 197 -3.261 1.862 4.646 1.00 55.44 H new ATOM 0 HG12 ILE A 197 -1.267 2.228 2.366 1.00 13.21 H new ATOM 0 HG13 ILE A 197 -2.201 0.780 2.686 1.00 13.21 H new ATOM 0 HG21 ILE A 197 -3.275 4.175 3.814 1.00 31.31 H new ATOM 0 HG22 ILE A 197 -2.521 4.064 5.422 1.00 31.31 H new ATOM 0 HG23 ILE A 197 -1.504 4.247 3.973 1.00 31.31 H new ATOM 0 HD11 ILE A 197 -3.161 2.053 0.847 1.00 52.21 H new ATOM 0 HD12 ILE A 197 -4.283 2.005 2.228 1.00 52.21 H new ATOM 0 HD13 ILE A 197 -3.335 3.476 1.903 1.00 52.21 H new ATOM 624 N SER A 198 -0.306 3.078 6.817 1.00 65.44 N ATOM 625 CA SER A 198 -0.205 3.514 8.190 1.00 41.33 C ATOM 626 C SER A 198 -0.754 4.914 8.402 1.00 62.15 C ATOM 627 O SER A 198 -1.254 5.240 9.490 1.00 53.34 O ATOM 628 CB SER A 198 1.239 3.381 8.677 1.00 70.32 C ATOM 629 OG SER A 198 1.451 3.941 9.956 1.00 33.21 O ATOM 0 H SER A 198 0.315 3.560 6.168 1.00 65.44 H new ATOM 0 HA SER A 198 -0.834 2.860 8.794 1.00 41.33 H new ATOM 0 HB2 SER A 198 1.512 2.326 8.700 1.00 70.32 H new ATOM 0 HB3 SER A 198 1.903 3.866 7.961 1.00 70.32 H new ATOM 0 HG SER A 198 2.390 3.824 10.213 1.00 33.21 H new ATOM 635 N ARG A 199 -0.709 5.722 7.390 1.00 61.15 N ATOM 636 CA ARG A 199 -1.142 7.082 7.537 1.00 2.32 C ATOM 637 C ARG A 199 -1.739 7.560 6.251 1.00 43.03 C ATOM 638 O ARG A 199 -1.188 7.316 5.171 1.00 51.44 O ATOM 639 CB ARG A 199 0.036 7.964 7.942 1.00 70.22 C ATOM 640 CG ARG A 199 -0.325 9.401 8.251 1.00 1.41 C ATOM 641 CD ARG A 199 0.909 10.176 8.640 1.00 34.35 C ATOM 642 NE ARG A 199 0.604 11.549 9.025 1.00 55.44 N ATOM 643 CZ ARG A 199 1.517 12.499 9.217 1.00 24.41 C ATOM 644 NH1 ARG A 199 2.804 12.238 8.999 1.00 10.00 N ATOM 645 NH2 ARG A 199 1.143 13.705 9.630 1.00 73.45 N ATOM 0 H ARG A 199 -0.380 5.470 6.458 1.00 61.15 H new ATOM 0 HA ARG A 199 -1.899 7.139 8.319 1.00 2.32 H new ATOM 0 HB2 ARG A 199 0.514 7.527 8.819 1.00 70.22 H new ATOM 0 HB3 ARG A 199 0.773 7.954 7.139 1.00 70.22 H new ATOM 0 HG2 ARG A 199 -0.793 9.861 7.381 1.00 1.41 H new ATOM 0 HG3 ARG A 199 -1.054 9.434 9.060 1.00 1.41 H new ATOM 0 HD2 ARG A 199 1.406 9.671 9.468 1.00 34.35 H new ATOM 0 HD3 ARG A 199 1.609 10.183 7.805 1.00 34.35 H new ATOM 0 HE ARG A 199 -0.376 11.799 9.156 1.00 55.44 H new ATOM 0 HH11 ARG A 199 3.090 11.311 8.685 1.00 10.00 H new ATOM 0 HH12 ARG A 199 3.504 12.965 9.146 1.00 10.00 H new ATOM 0 HH21 ARG A 199 0.157 13.903 9.800 1.00 73.45 H new ATOM 0 HH22 ARG A 199 1.842 14.433 9.777 1.00 73.45 H new ATOM 657 N LEU A 200 -2.856 8.204 6.355 1.00 24.13 N ATOM 658 CA LEU A 200 -3.530 8.729 5.228 1.00 14.13 C ATOM 659 C LEU A 200 -3.540 10.252 5.397 1.00 43.02 C ATOM 660 O LEU A 200 -3.973 10.757 6.434 1.00 54.05 O ATOM 661 CB LEU A 200 -4.961 8.168 5.218 1.00 71.33 C ATOM 662 CG LEU A 200 -5.615 7.975 3.852 1.00 73.53 C ATOM 663 CD1 LEU A 200 -7.025 7.428 3.998 1.00 72.45 C ATOM 664 CD2 LEU A 200 -5.600 9.235 3.013 1.00 4.42 C ATOM 0 H LEU A 200 -3.327 8.379 7.242 1.00 24.13 H new ATOM 0 HA LEU A 200 -3.049 8.460 4.288 1.00 14.13 H new ATOM 0 HB2 LEU A 200 -4.952 7.205 5.729 1.00 71.33 H new ATOM 0 HB3 LEU A 200 -5.592 8.835 5.805 1.00 71.33 H new ATOM 0 HG LEU A 200 -5.014 7.240 3.316 1.00 73.53 H new ATOM 0 HD11 LEU A 200 -7.469 7.299 3.011 1.00 72.45 H new ATOM 0 HD12 LEU A 200 -6.991 6.466 4.509 1.00 72.45 H new ATOM 0 HD13 LEU A 200 -7.628 8.126 4.579 1.00 72.45 H new ATOM 0 HD21 LEU A 200 -6.078 9.039 2.053 1.00 4.42 H new ATOM 0 HD22 LEU A 200 -6.142 10.025 3.533 1.00 4.42 H new ATOM 0 HD23 LEU A 200 -4.570 9.550 2.848 1.00 4.42 H new ATOM 672 N VAL A 201 -3.042 10.958 4.417 1.00 74.42 N ATOM 673 CA VAL A 201 -2.958 12.402 4.477 1.00 34.22 C ATOM 674 C VAL A 201 -4.183 13.037 3.817 1.00 62.15 C ATOM 675 O VAL A 201 -4.493 12.735 2.649 1.00 1.23 O ATOM 676 CB VAL A 201 -1.665 12.924 3.784 1.00 62.43 C ATOM 677 CG1 VAL A 201 -1.595 14.446 3.809 1.00 31.23 C ATOM 678 CG2 VAL A 201 -0.433 12.335 4.446 1.00 72.14 C ATOM 0 H VAL A 201 -2.682 10.553 3.553 1.00 74.42 H new ATOM 0 HA VAL A 201 -2.925 12.685 5.529 1.00 34.22 H new ATOM 0 HB VAL A 201 -1.697 12.604 2.742 1.00 62.43 H new ATOM 0 HG11 VAL A 201 -0.680 14.776 3.317 1.00 31.23 H new ATOM 0 HG12 VAL A 201 -2.458 14.859 3.286 1.00 31.23 H new ATOM 0 HG13 VAL A 201 -1.597 14.793 4.842 1.00 31.23 H new ATOM 0 HG21 VAL A 201 0.462 12.710 3.949 1.00 72.14 H new ATOM 0 HG22 VAL A 201 -0.412 12.623 5.497 1.00 72.14 H new ATOM 0 HG23 VAL A 201 -0.462 11.248 4.368 1.00 72.14 H new ATOM 684 N PRO A 202 -4.905 13.906 4.553 1.00 12.11 N ATOM 685 CA PRO A 202 -6.062 14.607 4.020 1.00 12.10 C ATOM 686 C PRO A 202 -5.668 15.475 2.832 1.00 13.53 C ATOM 687 O PRO A 202 -4.761 16.319 2.929 1.00 2.23 O ATOM 688 CB PRO A 202 -6.531 15.491 5.185 1.00 13.32 C ATOM 689 CG PRO A 202 -5.933 14.887 6.398 1.00 24.12 C ATOM 690 CD PRO A 202 -4.649 14.256 5.961 1.00 14.34 C ATOM 0 HA PRO A 202 -6.833 13.924 3.665 1.00 12.10 H new ATOM 0 HB2 PRO A 202 -6.201 16.522 5.055 1.00 13.32 H new ATOM 0 HB3 PRO A 202 -7.619 15.511 5.251 1.00 13.32 H new ATOM 0 HG2 PRO A 202 -5.755 15.644 7.162 1.00 24.12 H new ATOM 0 HG3 PRO A 202 -6.602 14.145 6.834 1.00 24.12 H new ATOM 0 HD2 PRO A 202 -3.809 14.944 6.058 1.00 14.34 H new ATOM 0 HD3 PRO A 202 -4.410 13.375 6.557 1.00 14.34 H new ATOM 698 N GLY A 203 -6.347 15.287 1.733 1.00 32.35 N ATOM 699 CA GLY A 203 -6.035 16.024 0.542 1.00 45.21 C ATOM 700 C GLY A 203 -5.180 15.232 -0.426 1.00 53.53 C ATOM 701 O GLY A 203 -4.919 15.685 -1.538 1.00 35.54 O ATOM 0 H GLY A 203 -7.120 14.629 1.639 1.00 32.35 H new ATOM 0 HA2 GLY A 203 -6.961 16.317 0.047 1.00 45.21 H new ATOM 0 HA3 GLY A 203 -5.514 16.942 0.813 1.00 45.21 H new ATOM 705 N GLY A 204 -4.730 14.062 -0.008 1.00 3.50 N ATOM 706 CA GLY A 204 -3.916 13.235 -0.875 1.00 65.41 C ATOM 707 C GLY A 204 -4.747 12.472 -1.888 1.00 63.21 C ATOM 708 O GLY A 204 -5.976 12.407 -1.766 1.00 21.02 O ATOM 0 H GLY A 204 -4.912 13.668 0.915 1.00 3.50 H new ATOM 0 HA2 GLY A 204 -3.194 13.862 -1.399 1.00 65.41 H new ATOM 0 HA3 GLY A 204 -3.346 12.529 -0.270 1.00 65.41 H new ATOM 712 N LEU A 205 -4.083 11.856 -2.861 1.00 10.52 N ATOM 713 CA LEU A 205 -4.743 11.120 -3.910 1.00 21.04 C ATOM 714 C LEU A 205 -5.462 9.914 -3.345 1.00 41.15 C ATOM 715 O LEU A 205 -6.542 9.545 -3.814 1.00 14.33 O ATOM 716 CB LEU A 205 -3.745 10.688 -5.004 1.00 32.44 C ATOM 717 CG LEU A 205 -3.166 11.782 -5.943 1.00 61.12 C ATOM 718 CD1 LEU A 205 -4.271 12.527 -6.675 1.00 73.14 C ATOM 719 CD2 LEU A 205 -2.252 12.748 -5.209 1.00 0.12 C ATOM 0 H LEU A 205 -3.066 11.859 -2.936 1.00 10.52 H new ATOM 0 HA LEU A 205 -5.479 11.781 -4.368 1.00 21.04 H new ATOM 0 HB2 LEU A 205 -2.907 10.193 -4.513 1.00 32.44 H new ATOM 0 HB3 LEU A 205 -4.237 9.941 -5.627 1.00 32.44 H new ATOM 0 HG LEU A 205 -2.557 11.266 -6.685 1.00 61.12 H new ATOM 0 HD11 LEU A 205 -3.831 13.285 -7.323 1.00 73.14 H new ATOM 0 HD12 LEU A 205 -4.847 11.824 -7.277 1.00 73.14 H new ATOM 0 HD13 LEU A 205 -4.928 13.007 -5.950 1.00 73.14 H new ATOM 0 HD21 LEU A 205 -1.873 13.493 -5.909 1.00 0.12 H new ATOM 0 HD22 LEU A 205 -2.810 13.246 -4.416 1.00 0.12 H new ATOM 0 HD23 LEU A 205 -1.416 12.199 -4.775 1.00 0.12 H new ATOM 727 N ALA A 206 -4.870 9.323 -2.316 1.00 64.23 N ATOM 728 CA ALA A 206 -5.453 8.178 -1.638 1.00 34.25 C ATOM 729 C ALA A 206 -6.818 8.534 -1.046 1.00 53.32 C ATOM 730 O ALA A 206 -7.779 7.778 -1.178 1.00 10.43 O ATOM 731 CB ALA A 206 -4.517 7.670 -0.555 1.00 61.44 C ATOM 0 H ALA A 206 -3.975 9.624 -1.930 1.00 64.23 H new ATOM 0 HA ALA A 206 -5.598 7.384 -2.371 1.00 34.25 H new ATOM 0 HB1 ALA A 206 -4.969 6.812 -0.057 1.00 61.44 H new ATOM 0 HB2 ALA A 206 -3.569 7.372 -1.004 1.00 61.44 H new ATOM 0 HB3 ALA A 206 -4.340 8.461 0.174 1.00 61.44 H new ATOM 737 N GLU A 207 -6.901 9.703 -0.423 1.00 40.15 N ATOM 738 CA GLU A 207 -8.143 10.175 0.168 1.00 72.51 C ATOM 739 C GLU A 207 -9.095 10.663 -0.919 1.00 33.52 C ATOM 740 O GLU A 207 -10.313 10.481 -0.820 1.00 22.12 O ATOM 741 CB GLU A 207 -7.871 11.291 1.168 1.00 61.24 C ATOM 742 CG GLU A 207 -9.112 11.792 1.876 1.00 0.23 C ATOM 743 CD GLU A 207 -8.813 12.896 2.832 1.00 20.41 C ATOM 744 OE1 GLU A 207 -8.686 14.058 2.386 1.00 75.23 O ATOM 745 OE2 GLU A 207 -8.691 12.629 4.040 1.00 72.12 O ATOM 0 H GLU A 207 -6.115 10.345 -0.315 1.00 40.15 H new ATOM 0 HA GLU A 207 -8.609 9.343 0.696 1.00 72.51 H new ATOM 0 HB2 GLU A 207 -7.159 10.934 1.912 1.00 61.24 H new ATOM 0 HB3 GLU A 207 -7.399 12.125 0.648 1.00 61.24 H new ATOM 0 HG2 GLU A 207 -9.833 12.140 1.137 1.00 0.23 H new ATOM 0 HG3 GLU A 207 -9.579 10.966 2.413 1.00 0.23 H new ATOM 752 N SER A 208 -8.526 11.274 -1.957 1.00 2.21 N ATOM 753 CA SER A 208 -9.288 11.781 -3.087 1.00 44.21 C ATOM 754 C SER A 208 -10.117 10.654 -3.721 1.00 11.34 C ATOM 755 O SER A 208 -11.291 10.841 -4.058 1.00 54.33 O ATOM 756 CB SER A 208 -8.338 12.419 -4.120 1.00 43.11 C ATOM 757 OG SER A 208 -9.041 12.969 -5.221 1.00 72.33 O ATOM 0 H SER A 208 -7.521 11.430 -2.034 1.00 2.21 H new ATOM 0 HA SER A 208 -9.978 12.549 -2.736 1.00 44.21 H new ATOM 0 HB2 SER A 208 -7.751 13.201 -3.638 1.00 43.11 H new ATOM 0 HB3 SER A 208 -7.635 11.667 -4.478 1.00 43.11 H new ATOM 0 HG SER A 208 -8.404 13.365 -5.852 1.00 72.33 H new ATOM 763 N THR A 209 -9.514 9.487 -3.868 1.00 30.44 N ATOM 764 CA THR A 209 -10.236 8.352 -4.382 1.00 72.33 C ATOM 765 C THR A 209 -11.029 7.673 -3.243 1.00 22.52 C ATOM 766 O THR A 209 -12.137 7.183 -3.448 1.00 33.41 O ATOM 767 CB THR A 209 -9.301 7.334 -5.133 1.00 31.22 C ATOM 768 OG1 THR A 209 -10.050 6.248 -5.650 1.00 63.34 O ATOM 769 CG2 THR A 209 -8.186 6.801 -4.242 1.00 42.23 C ATOM 0 H THR A 209 -8.536 9.308 -3.639 1.00 30.44 H new ATOM 0 HA THR A 209 -10.942 8.714 -5.130 1.00 72.33 H new ATOM 0 HB THR A 209 -8.841 7.886 -5.953 1.00 31.22 H new ATOM 0 HG1 THR A 209 -9.450 5.628 -6.114 1.00 63.34 H new ATOM 0 HG21 THR A 209 -7.570 6.103 -4.809 1.00 42.23 H new ATOM 0 HG22 THR A 209 -7.569 7.630 -3.895 1.00 42.23 H new ATOM 0 HG23 THR A 209 -8.620 6.288 -3.384 1.00 42.23 H new ATOM 775 N GLY A 210 -10.445 7.663 -2.043 1.00 3.04 N ATOM 776 CA GLY A 210 -11.106 7.114 -0.872 1.00 65.13 C ATOM 777 C GLY A 210 -11.130 5.604 -0.862 1.00 51.13 C ATOM 778 O GLY A 210 -11.722 4.998 0.012 1.00 2.20 O ATOM 0 H GLY A 210 -9.511 8.032 -1.863 1.00 3.04 H new ATOM 0 HA2 GLY A 210 -10.599 7.470 0.025 1.00 65.13 H new ATOM 0 HA3 GLY A 210 -12.129 7.489 -0.830 1.00 65.13 H new ATOM 782 N LEU A 211 -10.467 5.000 -1.821 1.00 23.14 N ATOM 783 CA LEU A 211 -10.470 3.554 -1.945 1.00 20.13 C ATOM 784 C LEU A 211 -9.381 2.940 -1.103 1.00 2.15 C ATOM 785 O LEU A 211 -9.344 1.730 -0.909 1.00 55.23 O ATOM 786 CB LEU A 211 -10.303 3.146 -3.402 1.00 40.20 C ATOM 787 CG LEU A 211 -11.323 3.736 -4.370 1.00 32.15 C ATOM 788 CD1 LEU A 211 -11.092 3.223 -5.786 1.00 13.44 C ATOM 789 CD2 LEU A 211 -12.752 3.461 -3.921 1.00 51.42 C ATOM 0 H LEU A 211 -9.917 5.485 -2.530 1.00 23.14 H new ATOM 0 HA LEU A 211 -11.430 3.185 -1.585 1.00 20.13 H new ATOM 0 HB2 LEU A 211 -9.305 3.437 -3.731 1.00 40.20 H new ATOM 0 HB3 LEU A 211 -10.355 2.059 -3.465 1.00 40.20 H new ATOM 0 HG LEU A 211 -11.182 4.817 -4.370 1.00 32.15 H new ATOM 0 HD11 LEU A 211 -11.833 3.659 -6.456 1.00 13.44 H new ATOM 0 HD12 LEU A 211 -10.093 3.505 -6.117 1.00 13.44 H new ATOM 0 HD13 LEU A 211 -11.185 2.137 -5.799 1.00 13.44 H new ATOM 0 HD21 LEU A 211 -13.449 3.897 -4.637 1.00 51.42 H new ATOM 0 HD22 LEU A 211 -12.915 2.385 -3.866 1.00 51.42 H new ATOM 0 HD23 LEU A 211 -12.916 3.904 -2.939 1.00 51.42 H new ATOM 797 N LEU A 212 -8.495 3.767 -0.617 1.00 71.13 N ATOM 798 CA LEU A 212 -7.436 3.282 0.245 1.00 10.12 C ATOM 799 C LEU A 212 -7.671 3.759 1.651 1.00 70.30 C ATOM 800 O LEU A 212 -7.980 4.936 1.870 1.00 12.52 O ATOM 801 CB LEU A 212 -6.024 3.749 -0.187 1.00 33.54 C ATOM 802 CG LEU A 212 -5.525 3.388 -1.586 1.00 41.10 C ATOM 803 CD1 LEU A 212 -6.152 4.282 -2.639 1.00 74.15 C ATOM 804 CD2 LEU A 212 -3.996 3.417 -1.643 1.00 20.00 C ATOM 0 H LEU A 212 -8.479 4.771 -0.797 1.00 71.13 H new ATOM 0 HA LEU A 212 -7.464 2.195 0.175 1.00 10.12 H new ATOM 0 HB2 LEU A 212 -5.993 4.835 -0.096 1.00 33.54 H new ATOM 0 HB3 LEU A 212 -5.309 3.348 0.532 1.00 33.54 H new ATOM 0 HG LEU A 212 -5.838 2.368 -1.808 1.00 41.10 H new ATOM 0 HD11 LEU A 212 -5.778 4.002 -3.624 1.00 74.15 H new ATOM 0 HD12 LEU A 212 -7.236 4.167 -2.616 1.00 74.15 H new ATOM 0 HD13 LEU A 212 -5.893 5.321 -2.435 1.00 74.15 H new ATOM 0 HD21 LEU A 212 -3.664 3.157 -2.648 1.00 20.00 H new ATOM 0 HD22 LEU A 212 -3.641 4.416 -1.391 1.00 20.00 H new ATOM 0 HD23 LEU A 212 -3.592 2.698 -0.930 1.00 20.00 H new ATOM 812 N ALA A 213 -7.538 2.867 2.579 1.00 42.14 N ATOM 813 CA ALA A 213 -7.646 3.175 3.966 1.00 32.13 C ATOM 814 C ALA A 213 -6.460 2.575 4.692 1.00 53.12 C ATOM 815 O ALA A 213 -5.742 1.745 4.143 1.00 14.11 O ATOM 816 CB ALA A 213 -8.955 2.655 4.536 1.00 0.44 C ATOM 0 H ALA A 213 -7.347 1.883 2.388 1.00 42.14 H new ATOM 0 HA ALA A 213 -7.643 4.257 4.101 1.00 32.13 H new ATOM 0 HB1 ALA A 213 -9.014 2.902 5.596 1.00 0.44 H new ATOM 0 HB2 ALA A 213 -9.790 3.116 4.009 1.00 0.44 H new ATOM 0 HB3 ALA A 213 -9.001 1.573 4.413 1.00 0.44 H new ATOM 822 N VAL A 214 -6.249 2.992 5.908 1.00 12.40 N ATOM 823 CA VAL A 214 -5.161 2.519 6.729 1.00 30.23 C ATOM 824 C VAL A 214 -5.203 1.002 6.981 1.00 52.15 C ATOM 825 O VAL A 214 -4.185 0.370 7.234 1.00 55.22 O ATOM 826 CB VAL A 214 -4.999 3.333 8.025 1.00 42.23 C ATOM 827 CG1 VAL A 214 -4.746 4.804 7.686 1.00 61.41 C ATOM 828 CG2 VAL A 214 -6.203 3.176 8.946 1.00 62.45 C ATOM 0 H VAL A 214 -6.838 3.685 6.370 1.00 12.40 H new ATOM 0 HA VAL A 214 -4.257 2.692 6.145 1.00 30.23 H new ATOM 0 HB VAL A 214 -4.137 2.944 8.567 1.00 42.23 H new ATOM 0 HG11 VAL A 214 -4.632 5.375 8.607 1.00 61.41 H new ATOM 0 HG12 VAL A 214 -3.836 4.889 7.091 1.00 61.41 H new ATOM 0 HG13 VAL A 214 -5.589 5.197 7.117 1.00 61.41 H new ATOM 0 HG21 VAL A 214 -6.049 3.766 9.849 1.00 62.45 H new ATOM 0 HG22 VAL A 214 -7.100 3.523 8.434 1.00 62.45 H new ATOM 0 HG23 VAL A 214 -6.322 2.126 9.214 1.00 62.45 H new ATOM 834 N ASN A 215 -6.387 0.436 6.961 1.00 50.14 N ATOM 835 CA ASN A 215 -6.540 -1.008 7.202 1.00 3.51 C ATOM 836 C ASN A 215 -6.024 -1.812 6.014 1.00 24.50 C ATOM 837 O ASN A 215 -5.812 -3.008 6.125 1.00 32.42 O ATOM 838 CB ASN A 215 -8.006 -1.422 7.404 1.00 74.34 C ATOM 839 CG ASN A 215 -8.764 -0.608 8.415 1.00 14.44 C ATOM 840 OD1 ASN A 215 -8.731 -0.894 9.606 1.00 70.14 O ATOM 841 ND2 ASN A 215 -9.523 0.349 7.938 1.00 21.11 N ATOM 0 H ASN A 215 -7.259 0.934 6.784 1.00 50.14 H new ATOM 0 HA ASN A 215 -5.969 -1.214 8.108 1.00 3.51 H new ATOM 0 HB2 ASN A 215 -8.522 -1.355 6.446 1.00 74.34 H new ATOM 0 HB3 ASN A 215 -8.033 -2.468 7.708 1.00 74.34 H new ATOM 0 HD21 ASN A 215 -10.118 0.889 8.566 1.00 21.11 H new ATOM 0 HD22 ASN A 215 -9.519 0.553 6.939 1.00 21.11 H new ATOM 847 N ASP A 216 -5.847 -1.159 4.889 1.00 32.12 N ATOM 848 CA ASP A 216 -5.478 -1.827 3.652 1.00 4.44 C ATOM 849 C ASP A 216 -4.043 -2.352 3.621 1.00 64.20 C ATOM 850 O ASP A 216 -3.082 -1.654 3.990 1.00 35.24 O ATOM 851 CB ASP A 216 -5.815 -0.969 2.429 1.00 72.51 C ATOM 852 CG ASP A 216 -7.319 -0.825 2.201 1.00 11.52 C ATOM 853 OD1 ASP A 216 -7.955 0.041 2.847 1.00 23.25 O ATOM 854 OD2 ASP A 216 -7.878 -1.570 1.382 1.00 45.23 O ATOM 0 H ASP A 216 -5.954 -0.148 4.800 1.00 32.12 H new ATOM 0 HA ASP A 216 -6.095 -2.724 3.609 1.00 4.44 H new ATOM 0 HB2 ASP A 216 -5.375 0.020 2.553 1.00 72.51 H new ATOM 0 HB3 ASP A 216 -5.359 -1.412 1.544 1.00 72.51 H new ATOM 859 N GLU A 217 -3.944 -3.598 3.194 1.00 24.21 N ATOM 860 CA GLU A 217 -2.716 -4.375 3.074 1.00 53.14 C ATOM 861 C GLU A 217 -2.344 -4.467 1.598 1.00 14.40 C ATOM 862 O GLU A 217 -3.186 -4.810 0.771 1.00 53.42 O ATOM 863 CB GLU A 217 -2.993 -5.787 3.631 1.00 34.33 C ATOM 864 CG GLU A 217 -1.832 -6.769 3.593 1.00 65.24 C ATOM 865 CD GLU A 217 -2.249 -8.155 4.067 1.00 12.21 C ATOM 866 OE1 GLU A 217 -2.326 -8.392 5.290 1.00 40.31 O ATOM 867 OE2 GLU A 217 -2.509 -9.037 3.220 1.00 64.41 O ATOM 0 H GLU A 217 -4.765 -4.129 2.904 1.00 24.21 H new ATOM 0 HA GLU A 217 -1.899 -3.910 3.625 1.00 53.14 H new ATOM 0 HB2 GLU A 217 -3.323 -5.688 4.665 1.00 34.33 H new ATOM 0 HB3 GLU A 217 -3.823 -6.218 3.072 1.00 34.33 H new ATOM 0 HG2 GLU A 217 -1.444 -6.834 2.577 1.00 65.24 H new ATOM 0 HG3 GLU A 217 -1.022 -6.399 4.221 1.00 65.24 H new ATOM 874 N VAL A 218 -1.103 -4.182 1.268 1.00 23.54 N ATOM 875 CA VAL A 218 -0.689 -4.150 -0.120 1.00 4.35 C ATOM 876 C VAL A 218 -0.338 -5.541 -0.662 1.00 14.33 C ATOM 877 O VAL A 218 0.347 -6.341 -0.018 1.00 71.23 O ATOM 878 CB VAL A 218 0.460 -3.122 -0.384 1.00 50.44 C ATOM 879 CG1 VAL A 218 1.740 -3.519 0.292 1.00 72.41 C ATOM 880 CG2 VAL A 218 0.665 -2.879 -1.869 1.00 75.51 C ATOM 0 H VAL A 218 -0.364 -3.970 1.939 1.00 23.54 H new ATOM 0 HA VAL A 218 -1.558 -3.801 -0.679 1.00 4.35 H new ATOM 0 HB VAL A 218 0.146 -2.178 0.061 1.00 50.44 H new ATOM 0 HG11 VAL A 218 2.509 -2.776 0.081 1.00 72.41 H new ATOM 0 HG12 VAL A 218 1.580 -3.579 1.368 1.00 72.41 H new ATOM 0 HG13 VAL A 218 2.062 -4.491 -0.081 1.00 72.41 H new ATOM 0 HG21 VAL A 218 1.471 -2.159 -2.012 1.00 75.51 H new ATOM 0 HG22 VAL A 218 0.925 -3.817 -2.359 1.00 75.51 H new ATOM 0 HG23 VAL A 218 -0.254 -2.485 -2.304 1.00 75.51 H new ATOM 886 N ILE A 219 -0.841 -5.802 -1.837 1.00 14.24 N ATOM 887 CA ILE A 219 -0.653 -7.037 -2.547 1.00 42.42 C ATOM 888 C ILE A 219 0.443 -6.890 -3.604 1.00 43.41 C ATOM 889 O ILE A 219 1.377 -7.708 -3.676 1.00 1.25 O ATOM 890 CB ILE A 219 -1.992 -7.470 -3.228 1.00 52.12 C ATOM 891 CG1 ILE A 219 -3.053 -7.774 -2.161 1.00 2.43 C ATOM 892 CG2 ILE A 219 -1.792 -8.673 -4.141 1.00 41.14 C ATOM 893 CD1 ILE A 219 -2.636 -8.867 -1.233 1.00 61.51 C ATOM 0 H ILE A 219 -1.417 -5.132 -2.347 1.00 14.24 H new ATOM 0 HA ILE A 219 -0.348 -7.802 -1.834 1.00 42.42 H new ATOM 0 HB ILE A 219 -2.338 -6.642 -3.847 1.00 52.12 H new ATOM 0 HG12 ILE A 219 -3.254 -6.870 -1.585 1.00 2.43 H new ATOM 0 HG13 ILE A 219 -3.986 -8.054 -2.651 1.00 2.43 H new ATOM 0 HG21 ILE A 219 -2.744 -8.946 -4.597 1.00 41.14 H new ATOM 0 HG22 ILE A 219 -1.074 -8.422 -4.922 1.00 41.14 H new ATOM 0 HG23 ILE A 219 -1.415 -9.513 -3.558 1.00 41.14 H new ATOM 0 HD11 ILE A 219 -3.423 -9.041 -0.499 1.00 61.51 H new ATOM 0 HD12 ILE A 219 -2.462 -9.780 -1.802 1.00 61.51 H new ATOM 0 HD13 ILE A 219 -1.719 -8.579 -0.720 1.00 61.51 H new ATOM 900 N GLU A 220 0.349 -5.843 -4.397 1.00 13.50 N ATOM 901 CA GLU A 220 1.277 -5.620 -5.484 1.00 33.12 C ATOM 902 C GLU A 220 1.263 -4.167 -5.913 1.00 34.23 C ATOM 903 O GLU A 220 0.315 -3.427 -5.598 1.00 73.35 O ATOM 904 CB GLU A 220 0.923 -6.527 -6.676 1.00 71.03 C ATOM 905 CG GLU A 220 -0.520 -6.435 -7.093 1.00 75.03 C ATOM 906 CD GLU A 220 -0.846 -7.228 -8.319 1.00 25.13 C ATOM 907 OE1 GLU A 220 -1.035 -8.460 -8.210 1.00 32.22 O ATOM 908 OE2 GLU A 220 -0.940 -6.625 -9.418 1.00 20.35 O ATOM 0 H GLU A 220 -0.370 -5.126 -4.306 1.00 13.50 H new ATOM 0 HA GLU A 220 2.280 -5.866 -5.135 1.00 33.12 H new ATOM 0 HB2 GLU A 220 1.555 -6.263 -7.524 1.00 71.03 H new ATOM 0 HB3 GLU A 220 1.153 -7.560 -6.417 1.00 71.03 H new ATOM 0 HG2 GLU A 220 -1.149 -6.779 -6.271 1.00 75.03 H new ATOM 0 HG3 GLU A 220 -0.771 -5.389 -7.271 1.00 75.03 H new ATOM 915 N VAL A 221 2.315 -3.759 -6.593 1.00 53.12 N ATOM 916 CA VAL A 221 2.409 -2.437 -7.152 1.00 23.11 C ATOM 917 C VAL A 221 2.814 -2.529 -8.639 1.00 23.43 C ATOM 918 O VAL A 221 3.829 -3.150 -8.991 1.00 54.12 O ATOM 919 CB VAL A 221 3.372 -1.493 -6.336 1.00 52.02 C ATOM 920 CG1 VAL A 221 4.742 -2.053 -6.224 1.00 71.55 C ATOM 921 CG2 VAL A 221 3.415 -0.100 -6.934 1.00 31.31 C ATOM 0 H VAL A 221 3.131 -4.344 -6.771 1.00 53.12 H new ATOM 0 HA VAL A 221 1.425 -1.974 -7.083 1.00 23.11 H new ATOM 0 HB VAL A 221 2.962 -1.424 -5.328 1.00 52.02 H new ATOM 0 HG11 VAL A 221 5.370 -1.368 -5.654 1.00 71.55 H new ATOM 0 HG12 VAL A 221 4.701 -3.016 -5.715 1.00 71.55 H new ATOM 0 HG13 VAL A 221 5.163 -2.187 -7.220 1.00 71.55 H new ATOM 0 HG21 VAL A 221 4.088 0.527 -6.349 1.00 31.31 H new ATOM 0 HG22 VAL A 221 3.774 -0.156 -7.962 1.00 31.31 H new ATOM 0 HG23 VAL A 221 2.414 0.332 -6.922 1.00 31.31 H new ATOM 927 N ASN A 222 1.978 -1.962 -9.491 1.00 53.41 N ATOM 928 CA ASN A 222 2.135 -1.938 -10.965 1.00 2.44 C ATOM 929 C ASN A 222 2.203 -3.306 -11.587 1.00 61.22 C ATOM 930 O ASN A 222 2.661 -3.464 -12.725 1.00 53.23 O ATOM 931 CB ASN A 222 3.293 -1.054 -11.459 1.00 33.52 C ATOM 932 CG ASN A 222 3.049 0.417 -11.221 1.00 35.24 C ATOM 933 OD1 ASN A 222 2.461 0.807 -10.232 1.00 73.22 O ATOM 934 ND2 ASN A 222 3.466 1.242 -12.143 1.00 62.43 N ATOM 0 H ASN A 222 1.133 -1.483 -9.180 1.00 53.41 H new ATOM 0 HA ASN A 222 1.213 -1.471 -11.311 1.00 2.44 H new ATOM 0 HB2 ASN A 222 4.212 -1.351 -10.954 1.00 33.52 H new ATOM 0 HB3 ASN A 222 3.445 -1.225 -12.525 1.00 33.52 H new ATOM 0 HD21 ASN A 222 3.301 2.244 -12.044 1.00 62.43 H new ATOM 0 HD22 ASN A 222 3.957 0.885 -12.963 1.00 62.43 H new ATOM 940 N GLY A 223 1.690 -4.277 -10.894 1.00 31.23 N ATOM 941 CA GLY A 223 1.699 -5.611 -11.405 1.00 22.45 C ATOM 942 C GLY A 223 2.706 -6.492 -10.729 1.00 55.52 C ATOM 943 O GLY A 223 2.659 -7.712 -10.875 1.00 24.33 O ATOM 0 H GLY A 223 1.261 -4.170 -9.975 1.00 31.23 H new ATOM 0 HA2 GLY A 223 0.707 -6.046 -11.286 1.00 22.45 H new ATOM 0 HA3 GLY A 223 1.909 -5.583 -12.474 1.00 22.45 H new ATOM 947 N ILE A 224 3.618 -5.898 -9.989 1.00 15.55 N ATOM 948 CA ILE A 224 4.632 -6.665 -9.317 1.00 12.52 C ATOM 949 C ILE A 224 4.249 -6.900 -7.884 1.00 73.33 C ATOM 950 O ILE A 224 3.979 -5.951 -7.137 1.00 0.03 O ATOM 951 CB ILE A 224 6.030 -6.008 -9.370 1.00 72.03 C ATOM 952 CG1 ILE A 224 6.488 -5.845 -10.816 1.00 53.51 C ATOM 953 CG2 ILE A 224 7.037 -6.858 -8.593 1.00 65.31 C ATOM 954 CD1 ILE A 224 7.858 -5.218 -10.955 1.00 12.25 C ATOM 0 H ILE A 224 3.674 -4.890 -9.841 1.00 15.55 H new ATOM 0 HA ILE A 224 4.698 -7.613 -9.852 1.00 12.52 H new ATOM 0 HB ILE A 224 5.969 -5.021 -8.912 1.00 72.03 H new ATOM 0 HG12 ILE A 224 6.496 -6.823 -11.297 1.00 53.51 H new ATOM 0 HG13 ILE A 224 5.762 -5.232 -11.350 1.00 53.51 H new ATOM 0 HG21 ILE A 224 8.019 -6.388 -8.636 1.00 65.31 H new ATOM 0 HG22 ILE A 224 6.719 -6.940 -7.554 1.00 65.31 H new ATOM 0 HG23 ILE A 224 7.091 -7.853 -9.035 1.00 65.31 H new ATOM 0 HD11 ILE A 224 8.115 -5.135 -12.011 1.00 12.25 H new ATOM 0 HD12 ILE A 224 7.851 -4.226 -10.504 1.00 12.25 H new ATOM 0 HD13 ILE A 224 8.596 -5.841 -10.450 1.00 12.25 H new ATOM 961 N GLU A 225 4.213 -8.157 -7.532 1.00 44.43 N ATOM 962 CA GLU A 225 3.925 -8.630 -6.200 1.00 63.35 C ATOM 963 C GLU A 225 4.810 -7.940 -5.151 1.00 43.33 C ATOM 964 O GLU A 225 6.025 -7.795 -5.325 1.00 14.02 O ATOM 965 CB GLU A 225 4.183 -10.147 -6.145 1.00 44.14 C ATOM 966 CG GLU A 225 5.612 -10.514 -6.556 1.00 1.25 C ATOM 967 CD GLU A 225 5.927 -11.984 -6.461 1.00 54.24 C ATOM 968 OE1 GLU A 225 5.525 -12.757 -7.342 1.00 41.05 O ATOM 969 OE2 GLU A 225 6.609 -12.387 -5.493 1.00 34.01 O ATOM 0 H GLU A 225 4.391 -8.914 -8.192 1.00 44.43 H new ATOM 0 HA GLU A 225 2.884 -8.400 -5.974 1.00 63.35 H new ATOM 0 HB2 GLU A 225 3.995 -10.508 -5.134 1.00 44.14 H new ATOM 0 HB3 GLU A 225 3.477 -10.656 -6.801 1.00 44.14 H new ATOM 0 HG2 GLU A 225 5.778 -10.184 -7.582 1.00 1.25 H new ATOM 0 HG3 GLU A 225 6.311 -9.963 -5.927 1.00 1.25 H new ATOM 976 N VAL A 226 4.200 -7.507 -4.092 1.00 73.20 N ATOM 977 CA VAL A 226 4.937 -6.984 -2.965 1.00 10.41 C ATOM 978 C VAL A 226 4.700 -7.880 -1.791 1.00 14.14 C ATOM 979 O VAL A 226 5.082 -7.590 -0.655 1.00 53.43 O ATOM 980 CB VAL A 226 4.603 -5.515 -2.633 1.00 25.33 C ATOM 981 CG1 VAL A 226 4.991 -4.623 -3.782 1.00 51.35 C ATOM 982 CG2 VAL A 226 3.150 -5.340 -2.306 1.00 13.24 C ATOM 0 H VAL A 226 3.187 -7.502 -3.976 1.00 73.20 H new ATOM 0 HA VAL A 226 5.995 -6.973 -3.228 1.00 10.41 H new ATOM 0 HB VAL A 226 5.177 -5.233 -1.750 1.00 25.33 H new ATOM 0 HG11 VAL A 226 4.751 -3.588 -3.537 1.00 51.35 H new ATOM 0 HG12 VAL A 226 6.061 -4.713 -3.967 1.00 51.35 H new ATOM 0 HG13 VAL A 226 4.442 -4.921 -4.675 1.00 51.35 H new ATOM 0 HG21 VAL A 226 2.952 -4.293 -2.077 1.00 13.24 H new ATOM 0 HG22 VAL A 226 2.545 -5.646 -3.160 1.00 13.24 H new ATOM 0 HG23 VAL A 226 2.895 -5.954 -1.442 1.00 13.24 H new ATOM 988 N ALA A 227 4.111 -9.009 -2.106 1.00 4.12 N ATOM 989 CA ALA A 227 3.775 -10.008 -1.152 1.00 60.01 C ATOM 990 C ALA A 227 5.023 -10.663 -0.581 1.00 13.12 C ATOM 991 O ALA A 227 5.631 -11.532 -1.207 1.00 72.43 O ATOM 992 CB ALA A 227 2.869 -11.050 -1.790 1.00 24.12 C ATOM 0 H ALA A 227 3.850 -9.253 -3.062 1.00 4.12 H new ATOM 0 HA ALA A 227 3.243 -9.532 -0.328 1.00 60.01 H new ATOM 0 HB1 ALA A 227 2.616 -11.812 -1.053 1.00 24.12 H new ATOM 0 HB2 ALA A 227 1.957 -10.571 -2.145 1.00 24.12 H new ATOM 0 HB3 ALA A 227 3.385 -11.515 -2.630 1.00 24.12 H new ATOM 998 N GLY A 228 5.435 -10.190 0.566 1.00 3.12 N ATOM 999 CA GLY A 228 6.537 -10.797 1.270 1.00 45.32 C ATOM 1000 C GLY A 228 7.847 -10.122 0.995 1.00 41.41 C ATOM 1001 O GLY A 228 8.902 -10.641 1.359 1.00 64.40 O ATOM 0 H GLY A 228 5.023 -9.383 1.035 1.00 3.12 H new ATOM 0 HA2 GLY A 228 6.337 -10.769 2.341 1.00 45.32 H new ATOM 0 HA3 GLY A 228 6.608 -11.847 0.987 1.00 45.32 H new ATOM 1005 N LYS A 229 7.800 -8.979 0.347 1.00 73.34 N ATOM 1006 CA LYS A 229 9.040 -8.243 0.036 1.00 73.24 C ATOM 1007 C LYS A 229 9.465 -7.416 1.240 1.00 1.40 C ATOM 1008 O LYS A 229 8.774 -7.389 2.271 1.00 41.13 O ATOM 1009 CB LYS A 229 8.835 -7.283 -1.138 1.00 2.52 C ATOM 1010 CG LYS A 229 8.177 -7.887 -2.344 1.00 21.33 C ATOM 1011 CD LYS A 229 8.929 -9.055 -2.918 1.00 3.33 C ATOM 1012 CE LYS A 229 8.093 -9.694 -4.001 1.00 60.22 C ATOM 1013 NZ LYS A 229 8.748 -10.844 -4.633 1.00 11.32 N ATOM 0 H LYS A 229 6.942 -8.532 0.024 1.00 73.34 H new ATOM 0 HA LYS A 229 9.802 -8.979 -0.222 1.00 73.24 H new ATOM 0 HB2 LYS A 229 8.233 -6.441 -0.798 1.00 2.52 H new ATOM 0 HB3 LYS A 229 9.805 -6.883 -1.434 1.00 2.52 H new ATOM 0 HG2 LYS A 229 7.171 -8.210 -2.075 1.00 21.33 H new ATOM 0 HG3 LYS A 229 8.071 -7.121 -3.112 1.00 21.33 H new ATOM 0 HD2 LYS A 229 9.884 -8.724 -3.326 1.00 3.33 H new ATOM 0 HD3 LYS A 229 9.151 -9.781 -2.136 1.00 3.33 H new ATOM 0 HE2 LYS A 229 7.142 -10.014 -3.576 1.00 60.22 H new ATOM 0 HE3 LYS A 229 7.866 -8.949 -4.763 1.00 60.22 H new ATOM 0 HZ1 LYS A 229 8.028 -11.528 -4.941 1.00 11.32 H new ATOM 0 HZ2 LYS A 229 9.295 -10.522 -5.457 1.00 11.32 H new ATOM 0 HZ3 LYS A 229 9.387 -11.298 -3.950 1.00 11.32 H new ATOM 1027 N THR A 230 10.579 -6.729 1.122 1.00 12.00 N ATOM 1028 CA THR A 230 10.976 -5.849 2.165 1.00 5.21 C ATOM 1029 C THR A 230 10.328 -4.516 1.892 1.00 20.41 C ATOM 1030 O THR A 230 9.956 -4.235 0.731 1.00 53.15 O ATOM 1031 CB THR A 230 12.513 -5.710 2.282 1.00 61.44 C ATOM 1032 OG1 THR A 230 13.072 -5.329 1.024 1.00 61.53 O ATOM 1033 CG2 THR A 230 13.140 -7.020 2.745 1.00 42.43 C ATOM 0 H THR A 230 11.209 -6.770 0.321 1.00 12.00 H new ATOM 0 HA THR A 230 10.652 -6.254 3.123 1.00 5.21 H new ATOM 0 HB THR A 230 12.728 -4.938 3.020 1.00 61.44 H new ATOM 0 HG1 THR A 230 13.997 -5.647 0.968 1.00 61.53 H new ATOM 0 HG21 THR A 230 14.221 -6.900 2.820 1.00 42.43 H new ATOM 0 HG22 THR A 230 12.736 -7.292 3.720 1.00 42.43 H new ATOM 0 HG23 THR A 230 12.912 -7.807 2.026 1.00 42.43 H new ATOM 1039 N LEU A 231 10.170 -3.697 2.901 1.00 35.41 N ATOM 1040 CA LEU A 231 9.508 -2.434 2.717 1.00 2.54 C ATOM 1041 C LEU A 231 10.377 -1.568 1.765 1.00 74.43 C ATOM 1042 O LEU A 231 9.866 -0.809 0.949 1.00 70.54 O ATOM 1043 CB LEU A 231 9.276 -1.748 4.084 1.00 51.15 C ATOM 1044 CG LEU A 231 8.049 -0.807 4.217 1.00 5.35 C ATOM 1045 CD1 LEU A 231 8.001 -0.165 5.585 1.00 71.52 C ATOM 1046 CD2 LEU A 231 7.994 0.243 3.132 1.00 42.12 C ATOM 0 H LEU A 231 10.489 -3.882 3.852 1.00 35.41 H new ATOM 0 HA LEU A 231 8.525 -2.573 2.267 1.00 2.54 H new ATOM 0 HB2 LEU A 231 9.185 -2.528 4.840 1.00 51.15 H new ATOM 0 HB3 LEU A 231 10.169 -1.172 4.327 1.00 51.15 H new ATOM 0 HG LEU A 231 7.166 -1.434 4.094 1.00 5.35 H new ATOM 0 HD11 LEU A 231 7.131 0.489 5.650 1.00 71.52 H new ATOM 0 HD12 LEU A 231 7.930 -0.940 6.348 1.00 71.52 H new ATOM 0 HD13 LEU A 231 8.907 0.420 5.745 1.00 71.52 H new ATOM 0 HD21 LEU A 231 7.115 0.871 3.277 1.00 42.12 H new ATOM 0 HD22 LEU A 231 8.892 0.860 3.177 1.00 42.12 H new ATOM 0 HD23 LEU A 231 7.936 -0.243 2.158 1.00 42.12 H new ATOM 1054 N ASP A 232 11.687 -1.741 1.843 1.00 40.41 N ATOM 1055 CA ASP A 232 12.606 -1.026 0.955 1.00 72.30 C ATOM 1056 C ASP A 232 12.383 -1.451 -0.505 1.00 41.41 C ATOM 1057 O ASP A 232 12.409 -0.621 -1.414 1.00 53.35 O ATOM 1058 CB ASP A 232 14.063 -1.251 1.369 1.00 74.43 C ATOM 1059 CG ASP A 232 15.042 -0.452 0.529 1.00 42.51 C ATOM 1060 OD1 ASP A 232 15.201 0.760 0.778 1.00 3.32 O ATOM 1061 OD2 ASP A 232 15.673 -1.022 -0.393 1.00 1.52 O ATOM 0 H ASP A 232 12.142 -2.367 2.508 1.00 40.41 H new ATOM 0 HA ASP A 232 12.397 0.040 1.041 1.00 72.30 H new ATOM 0 HB2 ASP A 232 14.184 -0.979 2.418 1.00 74.43 H new ATOM 0 HB3 ASP A 232 14.300 -2.312 1.285 1.00 74.43 H new ATOM 1066 N GLN A 233 12.129 -2.754 -0.719 1.00 52.34 N ATOM 1067 CA GLN A 233 11.809 -3.270 -2.056 1.00 71.21 C ATOM 1068 C GLN A 233 10.560 -2.632 -2.627 1.00 14.11 C ATOM 1069 O GLN A 233 10.565 -2.133 -3.742 1.00 53.43 O ATOM 1070 CB GLN A 233 11.667 -4.800 -2.068 1.00 32.52 C ATOM 1071 CG GLN A 233 12.984 -5.552 -2.044 1.00 0.24 C ATOM 1072 CD GLN A 233 12.799 -7.053 -1.941 1.00 12.53 C ATOM 1073 OE1 GLN A 233 12.670 -7.750 -2.941 1.00 11.31 O ATOM 1074 NE2 GLN A 233 12.841 -7.562 -0.744 1.00 73.33 N ATOM 0 H GLN A 233 12.140 -3.463 0.014 1.00 52.34 H new ATOM 0 HA GLN A 233 12.653 -3.001 -2.691 1.00 71.21 H new ATOM 0 HB2 GLN A 233 11.073 -5.104 -1.206 1.00 32.52 H new ATOM 0 HB3 GLN A 233 11.111 -5.094 -2.958 1.00 32.52 H new ATOM 0 HG2 GLN A 233 13.546 -5.321 -2.949 1.00 0.24 H new ATOM 0 HG3 GLN A 233 13.581 -5.205 -1.200 1.00 0.24 H new ATOM 0 HE21 GLN A 233 12.949 -6.952 0.066 1.00 73.33 H new ATOM 0 HE22 GLN A 233 12.766 -8.571 -0.616 1.00 73.33 H new ATOM 1082 N VAL A 234 9.507 -2.611 -1.840 1.00 72.31 N ATOM 1083 CA VAL A 234 8.219 -2.099 -2.289 1.00 10.42 C ATOM 1084 C VAL A 234 8.262 -0.583 -2.529 1.00 42.53 C ATOM 1085 O VAL A 234 7.609 -0.061 -3.432 1.00 23.20 O ATOM 1086 CB VAL A 234 7.075 -2.474 -1.316 1.00 21.34 C ATOM 1087 CG1 VAL A 234 7.127 -3.947 -1.003 1.00 71.22 C ATOM 1088 CG2 VAL A 234 7.101 -1.658 -0.052 1.00 5.24 C ATOM 0 H VAL A 234 9.512 -2.945 -0.876 1.00 72.31 H new ATOM 0 HA VAL A 234 8.007 -2.581 -3.244 1.00 10.42 H new ATOM 0 HB VAL A 234 6.134 -2.244 -1.815 1.00 21.34 H new ATOM 0 HG11 VAL A 234 6.319 -4.202 -0.318 1.00 71.22 H new ATOM 0 HG12 VAL A 234 7.016 -4.519 -1.924 1.00 71.22 H new ATOM 0 HG13 VAL A 234 8.084 -4.187 -0.540 1.00 71.22 H new ATOM 0 HG21 VAL A 234 6.278 -1.962 0.594 1.00 5.24 H new ATOM 0 HG22 VAL A 234 8.047 -1.819 0.465 1.00 5.24 H new ATOM 0 HG23 VAL A 234 6.998 -0.601 -0.299 1.00 5.24 H new ATOM 1094 N THR A 235 9.066 0.094 -1.739 1.00 51.20 N ATOM 1095 CA THR A 235 9.165 1.544 -1.784 1.00 12.50 C ATOM 1096 C THR A 235 9.928 1.945 -3.009 1.00 64.05 C ATOM 1097 O THR A 235 9.592 2.925 -3.671 1.00 41.00 O ATOM 1098 CB THR A 235 9.861 2.125 -0.524 1.00 10.21 C ATOM 1099 OG1 THR A 235 9.137 1.727 0.639 1.00 30.11 O ATOM 1100 CG2 THR A 235 9.903 3.650 -0.577 1.00 12.43 C ATOM 0 H THR A 235 9.672 -0.342 -1.045 1.00 51.20 H new ATOM 0 HA THR A 235 8.153 1.948 -1.812 1.00 12.50 H new ATOM 0 HB THR A 235 10.882 1.745 -0.490 1.00 10.21 H new ATOM 0 HG1 THR A 235 9.408 0.822 0.900 1.00 30.11 H new ATOM 0 HG21 THR A 235 10.396 4.032 0.317 1.00 12.43 H new ATOM 0 HG22 THR A 235 10.457 3.968 -1.460 1.00 12.43 H new ATOM 0 HG23 THR A 235 8.887 4.040 -0.626 1.00 12.43 H new ATOM 1106 N ASP A 236 10.933 1.150 -3.338 1.00 2.22 N ATOM 1107 CA ASP A 236 11.731 1.388 -4.520 1.00 2.20 C ATOM 1108 C ASP A 236 10.842 1.334 -5.736 1.00 55.12 C ATOM 1109 O ASP A 236 11.026 2.095 -6.693 1.00 54.33 O ATOM 1110 CB ASP A 236 12.843 0.354 -4.645 1.00 22.42 C ATOM 1111 CG ASP A 236 13.744 0.618 -5.824 1.00 31.41 C ATOM 1112 OD1 ASP A 236 14.641 1.479 -5.705 1.00 20.44 O ATOM 1113 OD2 ASP A 236 13.570 -0.024 -6.880 1.00 12.41 O ATOM 0 H ASP A 236 11.213 0.332 -2.797 1.00 2.22 H new ATOM 0 HA ASP A 236 12.192 2.372 -4.440 1.00 2.20 H new ATOM 0 HB2 ASP A 236 13.437 0.351 -3.731 1.00 22.42 H new ATOM 0 HB3 ASP A 236 12.403 -0.639 -4.743 1.00 22.42 H new ATOM 1118 N MET A 237 9.826 0.461 -5.675 1.00 52.11 N ATOM 1119 CA MET A 237 8.911 0.335 -6.778 1.00 74.31 C ATOM 1120 C MET A 237 8.081 1.593 -6.864 1.00 54.52 C ATOM 1121 O MET A 237 7.916 2.150 -7.914 1.00 4.23 O ATOM 1122 CB MET A 237 7.956 -0.865 -6.657 1.00 11.42 C ATOM 1123 CG MET A 237 8.553 -2.152 -6.166 1.00 25.24 C ATOM 1124 SD MET A 237 7.597 -3.561 -6.773 1.00 4.31 S ATOM 1125 CE MET A 237 8.361 -4.911 -5.923 1.00 0.53 C ATOM 0 H MET A 237 9.633 -0.150 -4.882 1.00 52.11 H new ATOM 0 HA MET A 237 9.516 0.176 -7.670 1.00 74.31 H new ATOM 0 HB2 MET A 237 7.144 -0.588 -5.985 1.00 11.42 H new ATOM 0 HB3 MET A 237 7.512 -1.047 -7.636 1.00 11.42 H new ATOM 0 HG2 MET A 237 9.586 -2.233 -6.503 1.00 25.24 H new ATOM 0 HG3 MET A 237 8.572 -2.159 -5.076 1.00 25.24 H new ATOM 0 HE1 MET A 237 7.635 -5.712 -5.786 1.00 0.53 H new ATOM 0 HE2 MET A 237 9.203 -5.280 -6.509 1.00 0.53 H new ATOM 0 HE3 MET A 237 8.717 -4.573 -4.950 1.00 0.53 H new ATOM 1135 N MET A 238 7.601 2.050 -5.719 1.00 2.00 N ATOM 1136 CA MET A 238 6.741 3.242 -5.633 1.00 1.43 C ATOM 1137 C MET A 238 7.447 4.487 -6.167 1.00 62.24 C ATOM 1138 O MET A 238 6.813 5.382 -6.714 1.00 55.12 O ATOM 1139 CB MET A 238 6.275 3.459 -4.186 1.00 2.40 C ATOM 1140 CG MET A 238 5.491 2.306 -3.641 1.00 2.20 C ATOM 1141 SD MET A 238 5.043 2.514 -1.922 1.00 52.40 S ATOM 1142 CE MET A 238 4.350 0.901 -1.630 1.00 31.04 C ATOM 0 H MET A 238 7.791 1.612 -4.817 1.00 2.00 H new ATOM 0 HA MET A 238 5.867 3.069 -6.261 1.00 1.43 H new ATOM 0 HB2 MET A 238 7.145 3.630 -3.552 1.00 2.40 H new ATOM 0 HB3 MET A 238 5.664 4.360 -4.139 1.00 2.40 H new ATOM 0 HG2 MET A 238 4.585 2.178 -4.234 1.00 2.20 H new ATOM 0 HG3 MET A 238 6.076 1.393 -3.750 1.00 2.20 H new ATOM 0 HE1 MET A 238 3.330 1.005 -1.261 1.00 31.04 H new ATOM 0 HE2 MET A 238 4.343 0.334 -2.561 1.00 31.04 H new ATOM 0 HE3 MET A 238 4.952 0.375 -0.889 1.00 31.04 H new ATOM 1152 N VAL A 239 8.755 4.532 -6.005 1.00 34.43 N ATOM 1153 CA VAL A 239 9.558 5.622 -6.520 1.00 50.23 C ATOM 1154 C VAL A 239 9.695 5.499 -8.038 1.00 70.05 C ATOM 1155 O VAL A 239 9.584 6.479 -8.771 1.00 52.42 O ATOM 1156 CB VAL A 239 10.962 5.636 -5.868 1.00 30.55 C ATOM 1157 CG1 VAL A 239 11.809 6.757 -6.429 1.00 10.32 C ATOM 1158 CG2 VAL A 239 10.844 5.776 -4.363 1.00 11.40 C ATOM 0 H VAL A 239 9.289 3.815 -5.514 1.00 34.43 H new ATOM 0 HA VAL A 239 9.056 6.558 -6.275 1.00 50.23 H new ATOM 0 HB VAL A 239 11.450 4.689 -6.099 1.00 30.55 H new ATOM 0 HG11 VAL A 239 12.790 6.744 -5.954 1.00 10.32 H new ATOM 0 HG12 VAL A 239 11.925 6.622 -7.504 1.00 10.32 H new ATOM 0 HG13 VAL A 239 11.323 7.713 -6.233 1.00 10.32 H new ATOM 0 HG21 VAL A 239 11.840 5.784 -3.919 1.00 11.40 H new ATOM 0 HG22 VAL A 239 10.332 6.708 -4.123 1.00 11.40 H new ATOM 0 HG23 VAL A 239 10.275 4.937 -3.963 1.00 11.40 H new ATOM 1164 N ALA A 240 9.907 4.292 -8.499 1.00 75.01 N ATOM 1165 CA ALA A 240 10.069 4.031 -9.923 1.00 54.35 C ATOM 1166 C ALA A 240 8.755 4.206 -10.664 1.00 53.51 C ATOM 1167 O ALA A 240 8.716 4.694 -11.795 1.00 33.34 O ATOM 1168 CB ALA A 240 10.609 2.635 -10.125 1.00 31.41 C ATOM 0 H ALA A 240 9.973 3.462 -7.910 1.00 75.01 H new ATOM 0 HA ALA A 240 10.778 4.752 -10.330 1.00 54.35 H new ATOM 0 HB1 ALA A 240 10.729 2.442 -11.191 1.00 31.41 H new ATOM 0 HB2 ALA A 240 11.575 2.543 -9.628 1.00 31.41 H new ATOM 0 HB3 ALA A 240 9.913 1.911 -9.702 1.00 31.41 H new ATOM 1174 N ASN A 241 7.698 3.838 -10.013 1.00 62.30 N ATOM 1175 CA ASN A 241 6.357 3.896 -10.562 1.00 51.55 C ATOM 1176 C ASN A 241 5.717 5.269 -10.397 1.00 21.24 C ATOM 1177 O ASN A 241 4.519 5.391 -10.465 1.00 43.44 O ATOM 1178 CB ASN A 241 5.500 2.823 -9.894 1.00 21.23 C ATOM 1179 CG ASN A 241 6.022 1.423 -10.183 1.00 23.31 C ATOM 1180 OD1 ASN A 241 6.598 1.158 -11.239 1.00 14.41 O ATOM 1181 ND2 ASN A 241 5.851 0.535 -9.253 1.00 23.11 N ATOM 0 H ASN A 241 7.731 3.478 -9.059 1.00 62.30 H new ATOM 0 HA ASN A 241 6.423 3.712 -11.634 1.00 51.55 H new ATOM 0 HB2 ASN A 241 5.483 2.990 -8.817 1.00 21.23 H new ATOM 0 HB3 ASN A 241 4.472 2.908 -10.246 1.00 21.23 H new ATOM 0 HD21 ASN A 241 6.198 -0.415 -9.385 1.00 23.11 H new ATOM 0 HD22 ASN A 241 5.370 0.787 -8.390 1.00 23.11 H new ATOM 1187 N SER A 242 6.530 6.305 -10.223 1.00 12.45 N ATOM 1188 CA SER A 242 6.018 7.684 -10.075 1.00 53.51 C ATOM 1189 C SER A 242 5.193 8.159 -11.295 1.00 64.11 C ATOM 1190 O SER A 242 4.403 9.064 -11.178 1.00 13.11 O ATOM 1191 CB SER A 242 7.147 8.671 -9.756 1.00 63.54 C ATOM 1192 OG SER A 242 7.781 8.352 -8.518 1.00 22.51 O ATOM 0 H SER A 242 7.546 6.228 -10.179 1.00 12.45 H new ATOM 0 HA SER A 242 5.333 7.662 -9.227 1.00 53.51 H new ATOM 0 HB2 SER A 242 7.884 8.655 -10.559 1.00 63.54 H new ATOM 0 HB3 SER A 242 6.746 9.683 -9.711 1.00 63.54 H new ATOM 0 HG SER A 242 8.274 7.510 -8.610 1.00 22.51 H new ATOM 1198 N SER A 243 5.408 7.570 -12.457 1.00 53.04 N ATOM 1199 CA SER A 243 4.632 7.927 -13.629 1.00 1.10 C ATOM 1200 C SER A 243 3.151 7.482 -13.499 1.00 23.35 C ATOM 1201 O SER A 243 2.240 8.165 -13.991 1.00 2.33 O ATOM 1202 CB SER A 243 5.295 7.348 -14.879 1.00 34.31 C ATOM 1203 OG SER A 243 5.572 5.957 -14.717 1.00 43.34 O ATOM 0 H SER A 243 6.110 6.846 -12.614 1.00 53.04 H new ATOM 0 HA SER A 243 4.615 9.013 -13.718 1.00 1.10 H new ATOM 0 HB2 SER A 243 4.644 7.494 -15.741 1.00 34.31 H new ATOM 0 HB3 SER A 243 6.221 7.885 -15.085 1.00 34.31 H new ATOM 0 HG SER A 243 5.994 5.611 -15.531 1.00 43.34 H new ATOM 1209 N ASN A 244 2.947 6.345 -12.828 1.00 30.25 N ATOM 1210 CA ASN A 244 1.627 5.742 -12.571 1.00 44.43 C ATOM 1211 C ASN A 244 1.759 4.795 -11.405 1.00 32.34 C ATOM 1212 O ASN A 244 2.267 3.686 -11.576 1.00 42.25 O ATOM 1213 CB ASN A 244 1.079 4.922 -13.780 1.00 54.31 C ATOM 1214 CG ASN A 244 0.648 5.744 -14.980 1.00 24.10 C ATOM 1215 OD1 ASN A 244 -0.499 6.183 -15.061 1.00 10.24 O ATOM 1216 ND2 ASN A 244 1.519 5.907 -15.941 1.00 52.32 N ATOM 0 H ASN A 244 3.714 5.800 -12.436 1.00 30.25 H new ATOM 0 HA ASN A 244 0.933 6.560 -12.378 1.00 44.43 H new ATOM 0 HB2 ASN A 244 1.848 4.219 -14.099 1.00 54.31 H new ATOM 0 HB3 ASN A 244 0.228 4.331 -13.441 1.00 54.31 H new ATOM 0 HD21 ASN A 244 1.255 6.410 -16.788 1.00 52.32 H new ATOM 0 HD22 ASN A 244 2.462 5.531 -15.844 1.00 52.32 H new ATOM 1222 N LEU A 245 1.356 5.213 -10.224 1.00 11.25 N ATOM 1223 CA LEU A 245 1.494 4.367 -9.062 1.00 31.03 C ATOM 1224 C LEU A 245 0.255 3.457 -8.972 1.00 20.13 C ATOM 1225 O LEU A 245 -0.801 3.892 -8.573 1.00 44.22 O ATOM 1226 CB LEU A 245 1.560 5.243 -7.790 1.00 1.12 C ATOM 1227 CG LEU A 245 2.349 4.703 -6.588 1.00 14.44 C ATOM 1228 CD1 LEU A 245 2.159 5.572 -5.375 1.00 35.41 C ATOM 1229 CD2 LEU A 245 2.042 3.270 -6.297 1.00 14.33 C ATOM 0 H LEU A 245 0.934 6.125 -10.046 1.00 11.25 H new ATOM 0 HA LEU A 245 2.403 3.771 -9.143 1.00 31.03 H new ATOM 0 HB2 LEU A 245 1.990 6.205 -8.068 1.00 1.12 H new ATOM 0 HB3 LEU A 245 0.538 5.434 -7.461 1.00 1.12 H new ATOM 0 HG LEU A 245 3.404 4.740 -6.861 1.00 14.44 H new ATOM 0 HD11 LEU A 245 2.730 5.163 -4.541 1.00 35.41 H new ATOM 0 HD12 LEU A 245 2.507 6.582 -5.593 1.00 35.41 H new ATOM 0 HD13 LEU A 245 1.102 5.602 -5.111 1.00 35.41 H new ATOM 0 HD21 LEU A 245 2.627 2.940 -5.438 1.00 14.33 H new ATOM 0 HD22 LEU A 245 0.980 3.163 -6.076 1.00 14.33 H new ATOM 0 HD23 LEU A 245 2.295 2.660 -7.164 1.00 14.33 H new ATOM 1237 N ILE A 246 0.386 2.226 -9.342 1.00 74.24 N ATOM 1238 CA ILE A 246 -0.731 1.307 -9.278 1.00 53.24 C ATOM 1239 C ILE A 246 -0.545 0.400 -8.085 1.00 33.42 C ATOM 1240 O ILE A 246 0.404 -0.352 -8.026 1.00 10.00 O ATOM 1241 CB ILE A 246 -0.809 0.426 -10.551 1.00 11.43 C ATOM 1242 CG1 ILE A 246 -0.870 1.299 -11.807 1.00 43.43 C ATOM 1243 CG2 ILE A 246 -2.027 -0.503 -10.485 1.00 11.14 C ATOM 1244 CD1 ILE A 246 -0.858 0.520 -13.107 1.00 42.21 C ATOM 0 H ILE A 246 1.253 1.821 -9.695 1.00 74.24 H new ATOM 0 HA ILE A 246 -1.649 1.888 -9.196 1.00 53.24 H new ATOM 0 HB ILE A 246 0.092 -0.186 -10.601 1.00 11.43 H new ATOM 0 HG12 ILE A 246 -1.774 1.907 -11.769 1.00 43.43 H new ATOM 0 HG13 ILE A 246 -0.023 1.985 -11.800 1.00 43.43 H new ATOM 0 HG21 ILE A 246 -2.067 -1.115 -11.386 1.00 11.14 H new ATOM 0 HG22 ILE A 246 -1.945 -1.149 -9.611 1.00 11.14 H new ATOM 0 HG23 ILE A 246 -2.936 0.094 -10.411 1.00 11.14 H new ATOM 0 HD11 ILE A 246 -0.904 1.213 -13.947 1.00 42.21 H new ATOM 0 HD12 ILE A 246 0.058 -0.067 -13.171 1.00 42.21 H new ATOM 0 HD13 ILE A 246 -1.720 -0.147 -13.140 1.00 42.21 H new ATOM 1251 N ILE A 247 -1.422 0.477 -7.147 1.00 42.35 N ATOM 1252 CA ILE A 247 -1.341 -0.365 -5.982 1.00 55.44 C ATOM 1253 C ILE A 247 -2.581 -1.208 -5.796 1.00 4.52 C ATOM 1254 O ILE A 247 -3.715 -0.742 -5.953 1.00 72.23 O ATOM 1255 CB ILE A 247 -0.978 0.448 -4.694 1.00 61.10 C ATOM 1256 CG1 ILE A 247 0.524 0.724 -4.639 1.00 71.34 C ATOM 1257 CG2 ILE A 247 -1.468 -0.210 -3.427 1.00 25.11 C ATOM 1258 CD1 ILE A 247 0.968 1.563 -3.459 1.00 4.44 C ATOM 0 H ILE A 247 -2.215 1.118 -7.155 1.00 42.35 H new ATOM 0 HA ILE A 247 -0.520 -1.060 -6.156 1.00 55.44 H new ATOM 0 HB ILE A 247 -1.503 1.401 -4.759 1.00 61.10 H new ATOM 0 HG12 ILE A 247 1.054 -0.228 -4.611 1.00 71.34 H new ATOM 0 HG13 ILE A 247 0.821 1.228 -5.559 1.00 71.34 H new ATOM 0 HG21 ILE A 247 -1.187 0.400 -2.568 1.00 25.11 H new ATOM 0 HG22 ILE A 247 -2.553 -0.307 -3.463 1.00 25.11 H new ATOM 0 HG23 ILE A 247 -1.018 -1.199 -3.333 1.00 25.11 H new ATOM 0 HD11 ILE A 247 2.047 1.708 -3.501 1.00 4.44 H new ATOM 0 HD12 ILE A 247 0.470 2.532 -3.494 1.00 4.44 H new ATOM 0 HD13 ILE A 247 0.706 1.054 -2.531 1.00 4.44 H new ATOM 1265 N THR A 248 -2.353 -2.446 -5.514 1.00 72.12 N ATOM 1266 CA THR A 248 -3.386 -3.361 -5.221 1.00 73.24 C ATOM 1267 C THR A 248 -3.352 -3.634 -3.740 1.00 11.51 C ATOM 1268 O THR A 248 -2.371 -4.161 -3.235 1.00 23.43 O ATOM 1269 CB THR A 248 -3.163 -4.675 -5.971 1.00 24.33 C ATOM 1270 OG1 THR A 248 -3.028 -4.402 -7.374 1.00 73.31 O ATOM 1271 CG2 THR A 248 -4.328 -5.639 -5.749 1.00 51.13 C ATOM 0 H THR A 248 -1.418 -2.853 -5.482 1.00 72.12 H new ATOM 0 HA THR A 248 -4.346 -2.943 -5.525 1.00 73.24 H new ATOM 0 HB THR A 248 -2.255 -5.142 -5.590 1.00 24.33 H new ATOM 0 HG1 THR A 248 -2.883 -5.242 -7.858 1.00 73.31 H new ATOM 0 HG21 THR A 248 -4.143 -6.565 -6.294 1.00 51.13 H new ATOM 0 HG22 THR A 248 -4.423 -5.857 -4.685 1.00 51.13 H new ATOM 0 HG23 THR A 248 -5.251 -5.184 -6.110 1.00 51.13 H new ATOM 1277 N VAL A 249 -4.376 -3.247 -3.052 1.00 31.41 N ATOM 1278 CA VAL A 249 -4.478 -3.503 -1.636 1.00 70.15 C ATOM 1279 C VAL A 249 -5.741 -4.265 -1.331 1.00 2.45 C ATOM 1280 O VAL A 249 -6.643 -4.343 -2.152 1.00 71.33 O ATOM 1281 CB VAL A 249 -4.414 -2.213 -0.726 1.00 73.04 C ATOM 1282 CG1 VAL A 249 -3.049 -1.559 -0.743 1.00 41.31 C ATOM 1283 CG2 VAL A 249 -5.501 -1.202 -1.089 1.00 41.43 C ATOM 0 H VAL A 249 -5.170 -2.744 -3.447 1.00 31.41 H new ATOM 0 HA VAL A 249 -3.596 -4.095 -1.390 1.00 70.15 H new ATOM 0 HB VAL A 249 -4.599 -2.555 0.292 1.00 73.04 H new ATOM 0 HG11 VAL A 249 -3.060 -0.678 -0.102 1.00 41.31 H new ATOM 0 HG12 VAL A 249 -2.303 -2.265 -0.377 1.00 41.31 H new ATOM 0 HG13 VAL A 249 -2.800 -1.263 -1.762 1.00 41.31 H new ATOM 0 HG21 VAL A 249 -5.420 -0.331 -0.439 1.00 41.43 H new ATOM 0 HG22 VAL A 249 -5.378 -0.893 -2.127 1.00 41.43 H new ATOM 0 HG23 VAL A 249 -6.482 -1.660 -0.961 1.00 41.43 H new ATOM 1289 N LYS A 250 -5.756 -4.859 -0.200 1.00 21.14 N ATOM 1290 CA LYS A 250 -6.898 -5.535 0.347 1.00 42.41 C ATOM 1291 C LYS A 250 -6.973 -5.165 1.804 1.00 24.51 C ATOM 1292 O LYS A 250 -5.957 -5.148 2.463 1.00 11.33 O ATOM 1293 CB LYS A 250 -6.754 -7.067 0.220 1.00 74.14 C ATOM 1294 CG LYS A 250 -5.400 -7.583 0.689 1.00 72.23 C ATOM 1295 CD LYS A 250 -5.391 -9.070 0.993 1.00 72.43 C ATOM 1296 CE LYS A 250 -6.271 -9.396 2.188 1.00 65.21 C ATOM 1297 NZ LYS A 250 -6.153 -10.818 2.567 1.00 75.21 N ATOM 0 H LYS A 250 -4.939 -4.897 0.410 1.00 21.14 H new ATOM 0 HA LYS A 250 -7.797 -5.240 -0.194 1.00 42.41 H new ATOM 0 HB2 LYS A 250 -7.540 -7.549 0.801 1.00 74.14 H new ATOM 0 HB3 LYS A 250 -6.905 -7.355 -0.820 1.00 74.14 H new ATOM 0 HG2 LYS A 250 -4.654 -7.372 -0.078 1.00 72.23 H new ATOM 0 HG3 LYS A 250 -5.101 -7.036 1.583 1.00 72.23 H new ATOM 0 HD2 LYS A 250 -5.739 -9.623 0.121 1.00 72.43 H new ATOM 0 HD3 LYS A 250 -4.370 -9.396 1.191 1.00 72.43 H new ATOM 0 HE2 LYS A 250 -5.989 -8.767 3.033 1.00 65.21 H new ATOM 0 HE3 LYS A 250 -7.310 -9.165 1.952 1.00 65.21 H new ATOM 0 HZ1 LYS A 250 -6.765 -11.011 3.386 1.00 75.21 H new ATOM 0 HZ2 LYS A 250 -6.445 -11.416 1.768 1.00 75.21 H new ATOM 0 HZ3 LYS A 250 -5.166 -11.030 2.815 1.00 75.21 H new ATOM 1311 N PRO A 251 -8.138 -4.842 2.337 1.00 73.31 N ATOM 1312 CA PRO A 251 -8.250 -4.503 3.741 1.00 23.02 C ATOM 1313 C PRO A 251 -7.822 -5.676 4.632 1.00 71.12 C ATOM 1314 O PRO A 251 -8.149 -6.837 4.332 1.00 44.01 O ATOM 1315 CB PRO A 251 -9.740 -4.200 3.938 1.00 72.35 C ATOM 1316 CG PRO A 251 -10.261 -3.924 2.573 1.00 32.15 C ATOM 1317 CD PRO A 251 -9.422 -4.739 1.636 1.00 34.40 C ATOM 0 HA PRO A 251 -7.607 -3.666 4.012 1.00 23.02 H new ATOM 0 HB2 PRO A 251 -10.257 -5.044 4.395 1.00 72.35 H new ATOM 0 HB3 PRO A 251 -9.885 -3.343 4.596 1.00 72.35 H new ATOM 0 HG2 PRO A 251 -11.313 -4.199 2.494 1.00 32.15 H new ATOM 0 HG3 PRO A 251 -10.191 -2.862 2.336 1.00 32.15 H new ATOM 0 HD2 PRO A 251 -9.860 -5.720 1.453 1.00 34.40 H new ATOM 0 HD3 PRO A 251 -9.313 -4.253 0.667 1.00 34.40 H new