Browse entries in the PDBbind-CN Database
HEADER 4ZOM_COMPLEX COMPND 4ZOM_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 223 ALA SER LEU THR GLU ILE GLU HIS LEU VAL GLN SER VAL SEQRES 2 A 223 CYS LYS SER TYR ARG GLU THR CYS GLN LEU ARG LEU GLU SEQRES 3 A 223 ASP LEU LEU ARG GLN ARG SER ASN ILE PHE SER ARG GLU SEQRES 4 A 223 GLU VAL THR GLY TYR GLN ARG LYS SER MET TRP GLU MET SEQRES 5 A 223 TRP GLU ARG CYS ALA HIS HIS LEU THR GLU ALA ILE GLN SEQRES 6 A 223 TYR VAL VAL GLU PHE ALA LYS ARG LEU SER GLY PHE MET SEQRES 7 A 223 GLU LEU CYS GLN ASN ASP GLN ILE VAL LEU LEU LYS ALA SEQRES 8 A 223 GLY ALA MET GLU VAL VAL LEU VAL ARG MET CYS ARG ALA SEQRES 9 A 223 TYR ASN ALA ASP ASN ARG THR VAL PHE PHE GLU GLY LYS SEQRES 10 A 223 TYR GLY GLY MET GLU LEU PHE ARG ALA LEU GLY CYS SER SEQRES 11 A 223 GLU LEU ILE SER SER ILE PHE ASP PHE SER HIS SER LEU SEQRES 12 A 223 SER ALA LEU HIS PHE SER GLU ASP GLU ILE ALA LEU TYR SEQRES 13 A 223 THR ALA LEU VAL LEU ILE ASN ALA HIS ARG PRO GLY LEU SEQRES 14 A 223 GLN GLU LYS ARG LYS VAL GLU GLN LEU GLN TYR ASN LEU SEQRES 15 A 223 GLU LEU ALA PHE HIS HIS HIS LEU CYS LYS THR HIS ARG SEQRES 16 A 223 GLN SER ILE LEU ALA LYS LEU PRO PRO LYS GLY LYS LEU SEQRES 17 A 223 ARG SER LEU CYS SER GLN HIS VAL GLU ARG LEU GLN ILE SEQRES 18 A 223 PHE GLN HET UNN A 235 65 ATOM 1 N ALA A 265 8.714 158.492 -9.221 1.00 75.81 N ATOM 2 CA ALA A 265 9.491 159.752 -8.946 1.00 70.57 C ATOM 3 C ALA A 265 9.811 160.566 -10.240 1.00 63.46 C ATOM 4 O ALA A 265 10.854 160.364 -10.802 1.00 58.68 O ATOM 5 CB ALA A 265 10.732 159.400 -8.150 1.00 60.15 C ATOM 6 HN3 ALA A 265 9.265 157.877 -9.853 1.00 0.00 H ATOM 7 HN2 ALA A 265 7.810 158.736 -9.674 1.00 0.00 H ATOM 8 HN1 ALA A 265 8.532 157.996 -8.325 1.00 0.00 H ATOM 9 N SER A 266 8.914 161.505 -10.632 1.00 63.86 N ATOM 10 CA SER A 266 8.798 162.144 -11.980 1.00 58.17 C ATOM 11 C SER A 266 9.941 163.144 -12.479 1.00 61.11 C ATOM 12 O SER A 266 10.913 163.392 -11.717 1.00 49.77 O ATOM 13 CB SER A 266 7.487 162.907 -12.023 1.00 60.68 C ATOM 14 OG SER A 266 7.273 163.461 -13.323 1.00 65.30 O ATOM 15 HG SER A 266 6.415 163.954 -13.333 1.00 0.00 H ATOM 16 H SER A 266 8.229 161.816 -9.914 1.00 0.00 H ATOM 17 N LEU A 267 9.696 163.808 -13.665 1.00 55.04 N ATOM 18 CA LEU A 267 10.682 164.567 -14.431 1.00 54.55 C ATOM 19 C LEU A 267 10.807 166.046 -14.107 1.00 61.22 C ATOM 20 O LEU A 267 11.966 166.595 -14.014 1.00 64.16 O ATOM 21 CB LEU A 267 10.560 164.341 -15.970 1.00 50.35 C ATOM 22 CG LEU A 267 11.655 164.815 -16.936 1.00 51.17 C ATOM 23 CD1 LEU A 267 13.025 164.165 -16.543 1.00 45.18 C ATOM 24 CD2 LEU A 267 11.295 164.731 -18.453 1.00 46.87 C ATOM 25 H LEU A 267 8.729 163.764 -14.045 1.00 0.00 H ATOM 26 N THR A 268 9.674 166.726 -14.011 1.00 61.33 N ATOM 27 CA THR A 268 9.687 168.112 -13.554 1.00 59.70 C ATOM 28 C THR A 268 10.405 168.062 -12.183 1.00 50.18 C ATOM 29 O THR A 268 11.096 168.948 -11.816 1.00 51.91 O ATOM 30 CB THR A 268 8.261 168.689 -13.511 1.00 63.19 C ATOM 31 OG1 THR A 268 7.654 168.414 -14.795 1.00 61.44 O ATOM 32 CG2 THR A 268 8.311 170.289 -13.238 1.00 64.42 C ATOM 33 HG1 THR A 268 6.731 168.772 -14.806 1.00 0.00 H ATOM 34 H THR A 268 8.773 166.271 -14.262 1.00 0.00 H ATOM 35 N GLU A 269 10.227 166.957 -11.524 1.00 40.77 N ATOM 36 CA GLU A 269 10.722 166.715 -10.245 1.00 50.27 C ATOM 37 C GLU A 269 12.282 166.355 -10.193 1.00 53.77 C ATOM 38 O GLU A 269 12.944 166.612 -9.184 1.00 50.03 O ATOM 39 CB GLU A 269 9.899 165.655 -9.527 1.00 48.14 C ATOM 40 CG GLU A 269 10.610 165.005 -8.329 1.00 52.34 C ATOM 41 CD GLU A 269 9.723 164.187 -7.434 1.00 62.00 C ATOM 42 OE1 GLU A 269 8.525 163.898 -7.826 1.00 66.47 O ATOM 43 OE2 GLU A 269 10.283 163.827 -6.342 1.00 69.37 O ATOM 44 H GLU A 269 9.678 166.202 -11.982 1.00 0.00 H ATOM 45 N ILE A 270 12.823 165.717 -11.203 1.00 50.22 N ATOM 46 CA ILE A 270 14.281 165.557 -11.227 1.00 52.60 C ATOM 47 C ILE A 270 14.904 166.911 -11.689 1.00 42.72 C ATOM 48 O ILE A 270 15.963 167.271 -11.210 1.00 39.47 O ATOM 49 CB ILE A 270 14.773 164.264 -11.987 1.00 53.76 C ATOM 50 CG1 ILE A 270 14.634 164.501 -13.501 1.00 57.93 C ATOM 51 CG2 ILE A 270 14.043 162.979 -11.444 1.00 47.33 C ATOM 52 CD1 ILE A 270 15.822 165.138 -14.159 1.00 56.46 C ATOM 53 H ILE A 270 12.233 165.334 -11.969 1.00 0.00 H ATOM 54 N GLU A 271 14.230 167.677 -12.555 1.00 41.31 N ATOM 55 CA GLU A 271 14.672 169.030 -12.907 1.00 38.83 C ATOM 56 C GLU A 271 14.908 169.904 -11.658 1.00 39.82 C ATOM 57 O GLU A 271 15.910 170.635 -11.606 1.00 33.67 O ATOM 58 CB GLU A 271 13.709 169.787 -13.804 1.00 45.04 C ATOM 59 CG GLU A 271 14.224 169.989 -15.267 1.00 57.58 C ATOM 60 CD GLU A 271 13.064 169.975 -16.376 1.00 64.91 C ATOM 61 OE1 GLU A 271 12.014 170.611 -16.090 1.00 68.81 O ATOM 62 OE2 GLU A 271 13.184 169.341 -17.491 1.00 56.95 O ATOM 63 H GLU A 271 13.365 167.300 -12.992 1.00 0.00 H ATOM 64 N HIS A 272 13.985 169.799 -10.695 1.00 37.54 N ATOM 65 CA HIS A 272 14.104 170.503 -9.435 1.00 41.97 C ATOM 66 C HIS A 272 15.299 169.872 -8.634 1.00 40.31 C ATOM 67 O HIS A 272 16.099 170.621 -8.048 1.00 38.29 O ATOM 68 CB HIS A 272 12.790 170.499 -8.569 1.00 41.80 C ATOM 69 CG HIS A 272 11.618 171.272 -9.136 1.00 43.57 C ATOM 70 ND1 HIS A 272 11.749 172.507 -9.753 1.00 49.63 N ATOM 71 CD2 HIS A 272 10.276 171.032 -9.080 1.00 41.66 C ATOM 72 CE1 HIS A 272 10.556 172.969 -10.090 1.00 41.38 C ATOM 73 NE2 HIS A 272 9.652 172.083 -9.718 1.00 42.94 N ATOM 74 H HIS A 272 13.156 169.193 -10.856 1.00 0.00 H ATOM 75 N LEU A 273 15.397 168.531 -8.631 1.00 37.04 N ATOM 76 CA LEU A 273 16.530 167.783 -8.040 1.00 33.59 C ATOM 77 C LEU A 273 17.935 168.271 -8.601 1.00 33.16 C ATOM 78 O LEU A 273 18.801 168.632 -7.821 1.00 30.92 O ATOM 79 CB LEU A 273 16.221 166.325 -8.113 1.00 33.85 C ATOM 80 CG LEU A 273 17.404 165.424 -7.496 1.00 38.41 C ATOM 81 CD1 LEU A 273 17.493 165.543 -5.967 1.00 35.71 C ATOM 82 CD2 LEU A 273 17.121 163.984 -7.920 1.00 34.64 C ATOM 83 H LEU A 273 14.629 167.985 -9.071 1.00 0.00 H ATOM 84 N VAL A 274 18.033 168.520 -9.885 1.00 29.17 N ATOM 85 CA VAL A 274 19.229 168.998 -10.501 1.00 33.29 C ATOM 86 C VAL A 274 19.550 170.440 -9.939 1.00 39.75 C ATOM 87 O VAL A 274 20.664 170.686 -9.262 1.00 28.83 O ATOM 88 CB VAL A 274 19.090 169.084 -11.972 1.00 36.63 C ATOM 89 CG1 VAL A 274 20.183 169.877 -12.686 1.00 37.67 C ATOM 90 CG2 VAL A 274 19.020 167.683 -12.543 1.00 43.27 C ATOM 91 H VAL A 274 17.198 168.361 -10.484 1.00 0.00 H ATOM 92 N GLN A 275 18.563 171.339 -10.081 1.00 36.91 N ATOM 93 CA GLN A 275 18.708 172.657 -9.541 1.00 36.45 C ATOM 94 C GLN A 275 19.076 172.643 -8.081 1.00 33.51 C ATOM 95 O GLN A 275 19.943 173.428 -7.636 1.00 31.85 O ATOM 96 CB GLN A 275 17.440 173.452 -9.764 1.00 41.90 C ATOM 97 CG GLN A 275 17.259 173.801 -11.254 1.00 44.48 C ATOM 98 CD GLN A 275 15.764 173.935 -11.613 1.00 53.49 C ATOM 99 OE1 GLN A 275 15.011 174.523 -10.880 1.00 58.68 O ATOM 100 NE2 GLN A 275 15.330 173.358 -12.760 1.00 60.56 N ATOM 101 HE22 GLN A 275 16.001 172.856 -13.376 1.00 0.00 H ATOM 102 HE21 GLN A 275 14.326 173.417 -13.024 1.00 0.00 H ATOM 103 H GLN A 275 17.691 171.077 -10.584 1.00 0.00 H ATOM 104 N SER A 276 18.501 171.736 -7.319 1.00 28.66 N ATOM 105 CA SER A 276 18.710 171.714 -5.889 1.00 27.62 C ATOM 106 C SER A 276 20.139 171.253 -5.425 1.00 33.29 C ATOM 107 O SER A 276 20.818 171.933 -4.682 1.00 34.56 O ATOM 108 CB SER A 276 17.766 170.849 -5.342 1.00 27.91 C ATOM 109 OG SER A 276 17.990 170.697 -3.997 1.00 36.66 O ATOM 110 HG SER A 276 17.314 170.081 -3.619 1.00 0.00 H ATOM 111 H SER A 276 17.884 171.021 -7.755 1.00 0.00 H ATOM 112 N VAL A 277 20.570 170.110 -5.938 1.00 29.91 N ATOM 113 CA VAL A 277 21.857 169.637 -5.850 1.00 27.61 C ATOM 114 C VAL A 277 22.887 170.709 -6.238 1.00 27.97 C ATOM 115 O VAL A 277 23.840 170.921 -5.463 1.00 34.47 O ATOM 116 CB VAL A 277 22.058 168.337 -6.672 1.00 27.87 C ATOM 117 CG1 VAL A 277 23.564 167.899 -6.708 1.00 28.56 C ATOM 118 CG2 VAL A 277 21.168 167.214 -6.151 1.00 29.62 C ATOM 119 H VAL A 277 19.879 169.524 -6.448 1.00 0.00 H ATOM 120 N CYS A 278 22.782 171.294 -7.400 1.00 31.73 N ATOM 121 CA CYS A 278 23.646 172.339 -7.862 1.00 31.96 C ATOM 122 C CYS A 278 23.745 173.561 -6.875 1.00 34.77 C ATOM 123 O CYS A 278 24.839 174.084 -6.612 1.00 30.42 O ATOM 124 CB CYS A 278 23.247 172.802 -9.174 1.00 33.60 C ATOM 125 SG CYS A 278 23.612 171.707 -10.648 1.00 40.37 S ATOM 126 H CYS A 278 22.019 170.980 -8.034 1.00 0.00 H ATOM 127 N LYS A 279 22.636 173.949 -6.290 1.00 33.91 N ATOM 128 CA LYS A 279 22.584 174.888 -5.225 1.00 35.16 C ATOM 129 C LYS A 279 23.311 174.439 -4.004 1.00 33.38 C ATOM 130 O LYS A 279 24.175 175.276 -3.479 1.00 32.67 O ATOM 131 CB LYS A 279 21.156 175.305 -4.795 1.00 39.08 C ATOM 132 CG LYS A 279 21.170 176.580 -4.007 1.00 44.52 C ATOM 133 CD LYS A 279 19.774 177.119 -3.626 1.00 55.65 C ATOM 134 CE LYS A 279 19.887 178.713 -3.519 1.00 56.31 C ATOM 135 NZ LYS A 279 18.737 179.431 -2.892 1.00 55.34 N ATOM 136 HZ1 LYS A 279 17.874 179.246 -3.441 1.00 0.00 H ATOM 137 HZ2 LYS A 279 18.608 179.092 -1.917 1.00 0.00 H ATOM 138 HZ3 LYS A 279 18.931 180.453 -2.882 1.00 0.00 H ATOM 139 H LYS A 279 21.739 173.544 -6.627 1.00 0.00 H ATOM 140 N SER A 280 22.995 173.274 -3.432 1.00 30.35 N ATOM 141 CA SER A 280 23.805 172.756 -2.247 1.00 30.98 C ATOM 142 C SER A 280 25.301 172.772 -2.500 1.00 30.32 C ATOM 143 O SER A 280 26.045 173.207 -1.702 1.00 37.68 O ATOM 144 CB SER A 280 23.450 171.312 -1.933 1.00 31.80 C ATOM 145 OG SER A 280 22.090 171.360 -1.959 1.00 33.71 O ATOM 146 HG SER A 280 21.788 171.653 -2.855 1.00 0.00 H ATOM 147 H SER A 280 22.195 172.718 -3.795 1.00 0.00 H ATOM 148 N TYR A 281 25.723 172.463 -3.674 1.00 28.85 N ATOM 149 CA TYR A 281 27.128 172.384 -3.955 1.00 32.41 C ATOM 150 C TYR A 281 27.635 173.821 -3.827 1.00 38.33 C ATOM 151 O TYR A 281 28.640 174.085 -3.107 1.00 33.69 O ATOM 152 CB TYR A 281 27.416 171.915 -5.396 1.00 28.95 C ATOM 153 CG TYR A 281 28.802 171.934 -5.680 1.00 30.32 C ATOM 154 CD1 TYR A 281 29.656 170.962 -5.121 1.00 32.09 C ATOM 155 CD2 TYR A 281 29.333 172.887 -6.524 1.00 33.32 C ATOM 156 CE1 TYR A 281 31.018 171.038 -5.355 1.00 40.37 C ATOM 157 CE2 TYR A 281 30.680 172.960 -6.784 1.00 34.05 C ATOM 158 CZ TYR A 281 31.549 172.108 -6.157 1.00 41.17 C ATOM 159 OH TYR A 281 32.947 172.286 -6.375 1.00 44.05 O ATOM 160 HH TYR A 281 33.449 171.604 -5.862 1.00 0.00 H ATOM 161 H TYR A 281 25.037 172.268 -4.431 1.00 0.00 H ATOM 162 N ARG A 282 27.005 174.722 -4.568 1.00 35.93 N ATOM 163 CA ARG A 282 27.412 176.053 -4.554 1.00 38.10 C ATOM 164 C ARG A 282 27.411 176.656 -3.098 1.00 36.21 C ATOM 165 O ARG A 282 28.229 177.438 -2.815 1.00 38.47 O ATOM 166 CB ARG A 282 26.565 176.864 -5.557 1.00 43.79 C ATOM 167 CG ARG A 282 26.766 178.419 -5.534 1.00 50.09 C ATOM 168 CD ARG A 282 25.905 179.062 -6.667 1.00 50.95 C ATOM 169 NE ARG A 282 25.412 180.377 -6.289 1.00 49.52 N ATOM 170 CZ ARG A 282 25.946 181.517 -6.657 1.00 42.19 C ATOM 171 NH1 ARG A 282 26.966 181.611 -7.461 1.00 39.85 N ATOM 172 NH2 ARG A 282 25.398 182.585 -6.207 1.00 55.84 N ATOM 173 HE ARG A 282 24.570 180.416 -5.679 1.00 0.00 H ATOM 174 HH12 ARG A 282 27.344 182.546 -7.715 1.00 0.00 H ATOM 175 HH11 ARG A 282 27.403 180.751 -7.849 1.00 0.00 H ATOM 176 HH22 ARG A 282 25.782 183.516 -6.468 1.00 0.00 H ATOM 177 HH21 ARG A 282 24.570 182.521 -5.581 1.00 0.00 H ATOM 178 H ARG A 282 26.202 174.433 -5.163 1.00 0.00 H ATOM 179 N GLU A 283 26.544 176.209 -2.214 1.00 33.68 N ATOM 180 CA GLU A 283 26.453 176.726 -0.923 1.00 35.61 C ATOM 181 C GLU A 283 27.404 176.084 0.097 1.00 39.27 C ATOM 182 O GLU A 283 27.372 176.493 1.247 1.00 40.48 O ATOM 183 CB GLU A 283 25.032 176.656 -0.460 1.00 38.90 C ATOM 184 CG GLU A 283 24.268 177.800 -1.168 1.00 51.86 C ATOM 185 CD GLU A 283 22.816 178.081 -0.689 1.00 63.15 C ATOM 186 OE1 GLU A 283 22.280 177.381 0.247 1.00 69.70 O ATOM 187 OE2 GLU A 283 22.224 179.026 -1.309 1.00 67.00 O ATOM 188 H GLU A 283 25.901 175.439 -2.490 1.00 0.00 H ATOM 189 N THR A 284 28.218 175.098 -0.338 1.00 32.69 N ATOM 190 CA THR A 284 29.106 174.353 0.492 1.00 29.51 C ATOM 191 C THR A 284 30.435 174.185 -0.201 1.00 30.16 C ATOM 192 O THR A 284 31.180 173.462 0.267 1.00 27.12 O ATOM 193 CB THR A 284 28.598 172.967 0.736 1.00 29.83 C ATOM 194 OG1 THR A 284 28.390 172.266 -0.500 1.00 29.24 O ATOM 195 CG2 THR A 284 27.299 172.992 1.435 1.00 30.76 C ATOM 196 HG1 THR A 284 27.726 172.755 -1.048 1.00 0.00 H ATOM 197 H THR A 284 28.195 174.865 -1.351 1.00 0.00 H ATOM 198 N CYS A 285 30.740 174.901 -1.290 1.00 32.60 N ATOM 199 CA CYS A 285 32.045 174.692 -1.947 1.00 41.41 C ATOM 200 C CYS A 285 33.151 175.457 -1.344 1.00 48.27 C ATOM 201 O CYS A 285 34.298 175.364 -1.938 1.00 58.13 O ATOM 202 CB CYS A 285 32.088 174.930 -3.456 1.00 45.37 C ATOM 203 SG CYS A 285 31.763 176.712 -3.800 1.00 68.44 S ATOM 204 H CYS A 285 30.066 175.596 -1.669 1.00 0.00 H ATOM 205 N GLN A 286 32.940 176.176 -0.236 1.00 37.89 N ATOM 206 CA GLN A 286 34.131 176.594 0.520 1.00 47.69 C ATOM 207 C GLN A 286 35.090 177.649 -0.123 1.00 48.49 C ATOM 208 O GLN A 286 35.296 178.697 0.457 1.00 51.26 O ATOM 209 CB GLN A 286 34.869 175.312 0.937 1.00 49.98 C ATOM 210 CG GLN A 286 36.335 175.375 1.218 1.00 53.16 C ATOM 211 CD GLN A 286 36.680 174.173 2.091 1.00 60.30 C ATOM 212 OE1 GLN A 286 36.497 172.995 1.681 1.00 58.05 O ATOM 213 NE2 GLN A 286 37.142 174.437 3.334 1.00 62.59 N ATOM 214 HE22 GLN A 286 37.281 175.422 3.639 1.00 0.00 H ATOM 215 HE21 GLN A 286 37.358 173.656 3.985 1.00 0.00 H ATOM 216 H GLN A 286 31.980 176.427 0.076 1.00 0.00 H ATOM 217 N LEU A 287 35.603 177.394 -1.337 1.00 49.78 N ATOM 218 CA LEU A 287 36.314 178.402 -2.172 1.00 50.48 C ATOM 219 C LEU A 287 35.556 178.602 -3.498 1.00 52.39 C ATOM 220 O LEU A 287 35.226 177.651 -4.185 1.00 45.85 O ATOM 221 CB LEU A 287 37.669 177.838 -2.495 1.00 59.33 C ATOM 222 CG LEU A 287 38.677 177.512 -1.346 1.00 63.21 C ATOM 223 CD1 LEU A 287 39.620 176.320 -1.651 1.00 62.58 C ATOM 224 CD2 LEU A 287 39.478 178.813 -1.077 1.00 61.86 C ATOM 225 H LEU A 287 35.497 176.432 -1.718 1.00 0.00 H ATOM 226 N ARG A 288 35.242 179.838 -3.848 1.00 54.66 N ATOM 227 CA ARG A 288 34.525 180.116 -5.125 1.00 53.92 C ATOM 228 C ARG A 288 35.424 179.919 -6.262 1.00 46.13 C ATOM 229 O ARG A 288 36.635 180.271 -6.206 1.00 45.39 O ATOM 230 CB ARG A 288 33.903 181.524 -5.150 1.00 62.36 C ATOM 231 CG ARG A 288 32.744 181.721 -4.168 1.00 66.78 C ATOM 232 CD ARG A 288 32.216 183.133 -4.157 1.00 75.62 C ATOM 233 NE ARG A 288 33.302 184.126 -4.054 1.00 91.28 N ATOM 234 CZ ARG A 288 33.698 184.767 -2.948 1.00 96.90 C ATOM 235 NH1 ARG A 288 33.104 184.566 -1.765 1.00106.65 N ATOM 236 NH2 ARG A 288 34.694 185.644 -3.028 1.00 99.98 N ATOM 237 HE ARG A 288 33.813 184.351 -4.932 1.00 0.00 H ATOM 238 HH12 ARG A 288 33.435 185.079 -0.923 1.00 0.00 H ATOM 239 HH11 ARG A 288 32.312 183.896 -1.688 1.00 0.00 H ATOM 240 HH22 ARG A 288 35.012 186.149 -2.176 1.00 0.00 H ATOM 241 HH21 ARG A 288 35.155 185.825 -3.942 1.00 0.00 H ATOM 242 H ARG A 288 35.499 180.628 -3.223 1.00 0.00 H ATOM 243 N LEU A 289 34.874 179.304 -7.328 1.00 46.29 N ATOM 244 CA LEU A 289 35.621 179.126 -8.573 1.00 45.36 C ATOM 245 C LEU A 289 36.276 180.346 -9.146 1.00 49.40 C ATOM 246 O LEU A 289 37.379 180.247 -9.785 1.00 48.18 O ATOM 247 CB LEU A 289 34.814 178.490 -9.650 1.00 42.13 C ATOM 248 CG LEU A 289 35.657 177.981 -10.795 1.00 45.93 C ATOM 249 CD1 LEU A 289 36.413 176.703 -10.429 1.00 47.00 C ATOM 250 CD2 LEU A 289 34.793 177.673 -12.009 1.00 50.44 C ATOM 251 H LEU A 289 33.899 178.949 -7.264 1.00 0.00 H ATOM 252 N GLU A 290 35.572 181.460 -8.984 1.00 60.97 N ATOM 253 CA GLU A 290 35.988 182.764 -9.579 1.00 65.02 C ATOM 254 C GLU A 290 37.348 183.138 -8.962 1.00 54.80 C ATOM 255 O GLU A 290 38.240 183.621 -9.683 1.00 48.13 O ATOM 256 CB GLU A 290 34.907 183.885 -9.365 1.00 64.15 C ATOM 257 CG GLU A 290 34.770 184.394 -7.914 1.00 71.96 C ATOM 258 CD GLU A 290 33.842 185.590 -7.737 1.00 78.83 C ATOM 259 OE1 GLU A 290 33.539 186.206 -8.817 1.00 84.37 O ATOM 260 OE2 GLU A 290 33.450 185.882 -6.536 1.00 69.92 O ATOM 261 H GLU A 290 34.698 181.423 -8.421 1.00 0.00 H ATOM 262 N ASP A 291 37.433 182.976 -7.635 1.00 49.53 N ATOM 263 CA ASP A 291 38.632 183.360 -6.863 1.00 55.37 C ATOM 264 C ASP A 291 39.780 182.444 -7.210 1.00 49.07 C ATOM 265 O ASP A 291 40.849 182.871 -7.588 1.00 53.69 O ATOM 266 CB ASP A 291 38.367 183.315 -5.385 1.00 61.30 C ATOM 267 CG ASP A 291 37.739 184.582 -4.859 1.00 66.56 C ATOM 268 OD1 ASP A 291 38.338 185.635 -5.199 1.00 77.03 O ATOM 269 OD2 ASP A 291 36.713 184.532 -4.089 1.00 63.38 O ATOM 270 H ASP A 291 36.623 182.564 -7.129 1.00 0.00 H ATOM 271 N LEU A 292 39.507 181.161 -7.253 1.00 45.97 N ATOM 272 CA LEU A 292 40.548 180.267 -7.659 1.00 42.95 C ATOM 273 C LEU A 292 41.121 180.632 -9.003 1.00 48.59 C ATOM 274 O LEU A 292 42.384 180.569 -9.202 1.00 47.83 O ATOM 275 CB LEU A 292 40.135 178.803 -7.625 1.00 36.97 C ATOM 276 CG LEU A 292 39.579 178.253 -6.295 1.00 34.78 C ATOM 277 CD1 LEU A 292 39.037 176.842 -6.489 1.00 34.33 C ATOM 278 CD2 LEU A 292 40.579 178.345 -5.188 1.00 33.68 C ATOM 279 H LEU A 292 38.563 180.805 -7.000 1.00 0.00 H ATOM 280 N LEU A 293 40.225 180.844 -9.990 1.00 56.40 N ATOM 281 CA LEU A 293 40.648 181.251 -11.375 1.00 51.48 C ATOM 282 C LEU A 293 41.498 182.626 -11.358 1.00 47.17 C ATOM 283 O LEU A 293 42.528 182.755 -11.955 1.00 47.23 O ATOM 284 CB LEU A 293 39.451 181.257 -12.297 1.00 48.14 C ATOM 285 CG LEU A 293 38.905 179.863 -12.680 1.00 52.83 C ATOM 286 CD1 LEU A 293 37.698 180.010 -13.568 1.00 52.31 C ATOM 287 CD2 LEU A 293 39.877 178.888 -13.378 1.00 53.03 C ATOM 288 H LEU A 293 39.212 180.722 -9.787 1.00 0.00 H ATOM 289 N ARG A 294 41.055 183.555 -10.581 1.00 49.10 N ATOM 290 CA ARG A 294 41.616 184.807 -10.537 1.00 58.64 C ATOM 291 C ARG A 294 43.012 184.681 -9.941 1.00 64.55 C ATOM 292 O ARG A 294 43.922 185.368 -10.371 1.00 60.38 O ATOM 293 CB ARG A 294 40.676 185.745 -9.743 1.00 63.14 C ATOM 294 CG ARG A 294 40.939 187.247 -9.940 1.00 69.06 C ATOM 295 CD ARG A 294 40.608 188.079 -8.682 1.00 75.50 C ATOM 296 NE ARG A 294 41.305 187.599 -7.463 1.00 79.37 N ATOM 297 CZ ARG A 294 41.158 188.089 -6.229 1.00 81.47 C ATOM 298 NH1 ARG A 294 40.319 189.121 -5.993 1.00 76.80 N ATOM 299 NH2 ARG A 294 41.868 187.540 -5.219 1.00 79.30 N ATOM 300 HE ARG A 294 41.970 186.808 -7.580 1.00 0.00 H ATOM 301 HH12 ARG A 294 40.212 189.494 -5.028 1.00 0.00 H ATOM 302 HH11 ARG A 294 39.780 189.542 -6.776 1.00 0.00 H ATOM 303 HH22 ARG A 294 41.766 187.908 -4.252 1.00 0.00 H ATOM 304 HH21 ARG A 294 42.516 186.749 -5.409 1.00 0.00 H ATOM 305 H ARG A 294 40.243 183.348 -9.965 1.00 0.00 H ATOM 306 N GLN A 295 43.174 183.816 -8.942 1.00 63.15 N ATOM 307 CA GLN A 295 44.404 183.723 -8.211 1.00 59.61 C ATOM 308 C GLN A 295 45.415 182.891 -8.877 1.00 53.72 C ATOM 309 O GLN A 295 46.502 182.698 -8.314 1.00 60.54 O ATOM 310 CB GLN A 295 44.182 183.221 -6.775 1.00 69.47 C ATOM 311 CG GLN A 295 43.417 184.179 -5.849 1.00 65.61 C ATOM 312 CD GLN A 295 44.147 184.467 -4.550 1.00 67.90 C ATOM 313 OE1 GLN A 295 45.195 185.100 -4.582 1.00 79.21 O ATOM 314 NE2 GLN A 295 43.606 184.010 -3.407 1.00 59.41 N ATOM 315 HE22 GLN A 295 42.713 183.477 -3.431 1.00 0.00 H ATOM 316 HE21 GLN A 295 44.080 184.190 -2.499 1.00 0.00 H ATOM 317 H GLN A 295 42.385 183.189 -8.684 1.00 0.00 H ATOM 318 N ARG A 296 45.114 182.392 -10.058 1.00 49.18 N ATOM 319 CA ARG A 296 46.041 181.531 -10.734 1.00 53.46 C ATOM 320 C ARG A 296 47.439 182.212 -10.938 1.00 57.46 C ATOM 321 O ARG A 296 48.443 181.515 -10.996 1.00 64.57 O ATOM 322 CB ARG A 296 45.501 180.952 -12.067 1.00 51.49 C ATOM 323 CG ARG A 296 44.481 179.851 -11.967 1.00 54.98 C ATOM 324 CD ARG A 296 44.106 179.311 -13.350 1.00 58.07 C ATOM 325 NE ARG A 296 43.185 178.137 -13.233 1.00 68.92 N ATOM 326 CZ ARG A 296 42.833 177.269 -14.240 1.00 77.66 C ATOM 327 NH1 ARG A 296 43.291 177.398 -15.492 1.00 71.64 N ATOM 328 NH2 ARG A 296 42.012 176.236 -13.998 1.00 70.79 N ATOM 329 HE ARG A 296 42.770 177.960 -12.296 1.00 0.00 H ATOM 330 HH12 ARG A 296 43.000 176.720 -16.225 1.00 0.00 H ATOM 331 HH11 ARG A 296 43.938 178.177 -15.732 1.00 0.00 H ATOM 332 HH22 ARG A 296 41.753 175.586 -14.768 1.00 0.00 H ATOM 333 HH21 ARG A 296 41.635 176.085 -13.041 1.00 0.00 H ATOM 334 H ARG A 296 44.202 182.623 -10.502 1.00 0.00 H ATOM 335 N SER A 297 47.441 183.534 -11.147 1.00 57.03 N ATOM 336 CA SER A 297 48.602 184.289 -11.500 1.00 54.94 C ATOM 337 C SER A 297 49.461 184.382 -10.205 1.00 54.15 C ATOM 338 O SER A 297 50.624 184.662 -10.338 1.00 55.05 O ATOM 339 CB SER A 297 48.230 185.686 -12.053 1.00 49.62 C ATOM 340 OG SER A 297 48.025 186.710 -11.023 1.00 44.88 O ATOM 341 HG SER A 297 47.792 187.569 -11.456 1.00 0.00 H ATOM 342 H SER A 297 46.540 184.044 -11.046 1.00 0.00 H ATOM 343 N ASN A 298 48.827 184.277 -9.026 1.00 44.43 N ATOM 344 CA ASN A 298 49.495 184.401 -7.740 1.00 50.11 C ATOM 345 C ASN A 298 50.219 182.997 -7.365 1.00 55.72 C ATOM 346 O ASN A 298 49.548 182.022 -6.909 1.00 57.15 O ATOM 347 CB ASN A 298 48.496 184.896 -6.741 1.00 47.42 C ATOM 348 CG ASN A 298 49.069 185.453 -5.445 1.00 46.99 C ATOM 349 OD1 ASN A 298 48.376 185.406 -4.412 1.00 46.19 O ATOM 350 ND2 ASN A 298 50.283 186.041 -5.470 1.00 51.28 N ATOM 351 HD22 ASN A 298 50.833 186.061 -6.352 1.00 0.00 H ATOM 352 HD21 ASN A 298 50.669 186.475 -4.607 1.00 0.00 H ATOM 353 H ASN A 298 47.803 184.097 -9.033 1.00 0.00 H ATOM 354 N ILE A 299 51.520 182.898 -7.706 1.00 45.48 N ATOM 355 CA ILE A 299 52.334 181.722 -7.639 1.00 44.86 C ATOM 356 C ILE A 299 53.288 181.943 -6.448 1.00 54.00 C ATOM 357 O ILE A 299 53.488 183.108 -5.916 1.00 47.77 O ATOM 358 CB ILE A 299 52.962 181.451 -8.995 1.00 48.93 C ATOM 359 CG1 ILE A 299 51.860 181.169 -10.034 1.00 47.06 C ATOM 360 CG2 ILE A 299 53.938 180.276 -8.981 1.00 49.40 C ATOM 361 CD1 ILE A 299 52.271 181.179 -11.513 1.00 52.16 C ATOM 362 H ILE A 299 51.979 183.764 -8.053 1.00 0.00 H ATOM 363 N PHE A 300 53.732 180.808 -5.836 1.00 52.74 N ATOM 364 CA PHE A 300 54.686 180.843 -4.715 1.00 41.75 C ATOM 365 C PHE A 300 56.073 181.141 -5.347 1.00 42.96 C ATOM 366 O PHE A 300 56.388 180.628 -6.391 1.00 42.87 O ATOM 367 CB PHE A 300 54.759 179.550 -3.904 1.00 45.29 C ATOM 368 CG PHE A 300 53.731 179.448 -2.809 1.00 43.39 C ATOM 369 CD1 PHE A 300 53.748 180.299 -1.785 1.00 38.57 C ATOM 370 CD2 PHE A 300 52.630 178.556 -2.933 1.00 42.23 C ATOM 371 CE1 PHE A 300 52.810 180.270 -0.839 1.00 38.30 C ATOM 372 CE2 PHE A 300 51.733 178.495 -1.946 1.00 37.74 C ATOM 373 CZ PHE A 300 51.836 179.341 -0.891 1.00 41.23 C ATOM 374 H PHE A 300 53.385 179.887 -6.172 1.00 0.00 H ATOM 375 N SER A 301 56.814 182.078 -4.747 1.00 40.98 N ATOM 376 CA SER A 301 58.234 182.337 -5.179 1.00 48.79 C ATOM 377 C SER A 301 59.132 181.111 -4.816 1.00 51.56 C ATOM 378 O SER A 301 58.812 180.382 -3.855 1.00 45.66 O ATOM 379 CB SER A 301 58.843 183.531 -4.384 1.00 44.60 C ATOM 380 OG SER A 301 58.839 183.236 -2.980 1.00 48.18 O ATOM 381 HG SER A 301 57.908 183.083 -2.679 1.00 0.00 H ATOM 382 H SER A 301 56.404 182.636 -3.971 1.00 0.00 H ATOM 383 N ARG A 302 60.251 180.997 -5.534 1.00 50.01 N ATOM 384 CA ARG A 302 61.375 180.172 -5.154 1.00 49.26 C ATOM 385 C ARG A 302 61.670 180.220 -3.659 1.00 42.99 C ATOM 386 O ARG A 302 61.787 179.214 -3.050 1.00 45.45 O ATOM 387 CB ARG A 302 62.629 180.509 -6.026 1.00 51.99 C ATOM 388 H ARG A 302 60.318 181.535 -6.422 1.00 0.00 H ATOM 389 N GLU A 303 61.682 181.365 -3.014 1.00 50.66 N ATOM 390 CA GLU A 303 61.851 181.383 -1.512 1.00 48.99 C ATOM 391 C GLU A 303 60.684 180.871 -0.679 1.00 48.36 C ATOM 392 O GLU A 303 60.838 180.222 0.376 1.00 48.93 O ATOM 393 CB GLU A 303 62.334 182.754 -0.923 1.00 51.57 C ATOM 394 CG GLU A 303 61.989 184.063 -1.587 1.00 61.54 C ATOM 395 CD GLU A 303 62.680 184.324 -2.878 1.00 63.12 C ATOM 396 OE1 GLU A 303 63.861 183.947 -2.957 1.00 74.33 O ATOM 397 OE2 GLU A 303 62.037 184.911 -3.787 1.00 63.91 O ATOM 398 H GLU A 303 61.575 182.258 -3.537 1.00 0.00 H ATOM 399 N GLU A 304 59.477 181.210 -1.063 1.00 47.08 N ATOM 400 CA GLU A 304 58.325 180.761 -0.244 1.00 42.94 C ATOM 401 C GLU A 304 58.192 179.186 -0.281 1.00 35.16 C ATOM 402 O GLU A 304 57.865 178.631 0.731 1.00 31.41 O ATOM 403 CB GLU A 304 57.060 181.427 -0.728 1.00 45.33 C ATOM 404 CG GLU A 304 56.990 182.962 -0.422 1.00 49.71 C ATOM 405 CD GLU A 304 55.874 183.672 -1.253 1.00 54.50 C ATOM 406 OE1 GLU A 304 55.041 184.361 -0.550 1.00 56.19 O ATOM 407 OE2 GLU A 304 55.794 183.445 -2.552 1.00 42.33 O ATOM 408 H GLU A 304 59.331 181.780 -1.921 1.00 0.00 H ATOM 409 N VAL A 305 58.530 178.570 -1.387 1.00 29.72 N ATOM 410 CA VAL A 305 58.568 177.187 -1.570 1.00 36.26 C ATOM 411 C VAL A 305 59.649 176.527 -0.589 1.00 38.02 C ATOM 412 O VAL A 305 59.430 175.548 0.073 1.00 43.26 O ATOM 413 CB VAL A 305 58.903 176.887 -3.089 1.00 33.32 C ATOM 414 CG1 VAL A 305 59.166 175.373 -3.376 1.00 36.86 C ATOM 415 CG2 VAL A 305 57.669 177.208 -3.919 1.00 32.09 C ATOM 416 H VAL A 305 58.793 179.164 -2.199 1.00 0.00 H ATOM 417 N THR A 306 60.852 177.040 -0.604 1.00 39.51 N ATOM 418 CA THR A 306 61.891 176.627 0.293 1.00 36.83 C ATOM 419 C THR A 306 61.325 176.688 1.717 1.00 34.06 C ATOM 420 O THR A 306 61.349 175.686 2.493 1.00 34.37 O ATOM 421 CB THR A 306 63.161 177.465 -0.004 1.00 42.16 C ATOM 422 OG1 THR A 306 63.635 177.231 -1.369 1.00 36.49 O ATOM 423 CG2 THR A 306 64.323 177.102 0.975 1.00 41.86 C ATOM 424 HG1 THR A 306 62.927 177.487 -2.012 1.00 0.00 H ATOM 425 H THR A 306 61.065 177.783 -1.300 1.00 0.00 H ATOM 426 N GLY A 307 60.673 177.758 2.103 1.00 30.28 N ATOM 427 CA GLY A 307 60.100 177.772 3.403 1.00 25.71 C ATOM 428 C GLY A 307 59.245 176.635 3.770 1.00 28.08 C ATOM 429 O GLY A 307 59.409 175.961 4.823 1.00 34.34 O ATOM 430 H GLY A 307 60.577 178.579 1.471 1.00 0.00 H ATOM 431 N TYR A 308 58.332 176.253 2.881 1.00 30.01 N ATOM 432 CA TYR A 308 57.480 175.109 3.090 1.00 26.85 C ATOM 433 C TYR A 308 58.238 173.840 3.115 1.00 26.88 C ATOM 434 O TYR A 308 57.904 172.991 3.896 1.00 23.70 O ATOM 435 CB TYR A 308 56.438 175.040 1.936 1.00 31.70 C ATOM 436 CG TYR A 308 55.192 175.732 2.260 1.00 29.83 C ATOM 437 CD1 TYR A 308 54.358 175.238 3.170 1.00 29.95 C ATOM 438 CD2 TYR A 308 54.901 176.929 1.679 1.00 30.58 C ATOM 439 CE1 TYR A 308 53.228 176.006 3.536 1.00 34.68 C ATOM 440 CE2 TYR A 308 53.751 177.633 1.972 1.00 28.54 C ATOM 441 CZ TYR A 308 52.929 177.180 2.843 1.00 29.09 C ATOM 442 OH TYR A 308 51.773 177.927 3.161 1.00 37.59 O ATOM 443 HH TYR A 308 51.247 177.443 3.846 1.00 0.00 H ATOM 444 H TYR A 308 58.229 176.800 2.003 1.00 0.00 H ATOM 445 N GLN A 309 59.214 173.670 2.194 1.00 27.07 N ATOM 446 CA GLN A 309 60.069 172.449 2.146 1.00 29.79 C ATOM 447 C GLN A 309 60.937 172.227 3.433 1.00 31.31 C ATOM 448 O GLN A 309 61.367 171.091 3.693 1.00 29.01 O ATOM 449 CB GLN A 309 61.098 172.626 0.962 1.00 31.06 C ATOM 450 CG GLN A 309 60.367 172.422 -0.370 1.00 29.36 C ATOM 451 CD GLN A 309 61.287 172.615 -1.565 1.00 28.61 C ATOM 452 OE1 GLN A 309 62.157 173.437 -1.564 1.00 33.45 O ATOM 453 NE2 GLN A 309 61.013 171.881 -2.619 1.00 28.31 N ATOM 454 HE22 GLN A 309 60.248 171.177 -2.578 1.00 0.00 H ATOM 455 HE21 GLN A 309 61.561 172.003 -3.495 1.00 0.00 H ATOM 456 H GLN A 309 59.374 174.420 1.492 1.00 0.00 H ATOM 457 N ARG A 310 61.123 173.306 4.247 1.00 32.50 N ATOM 458 CA ARG A 310 62.036 173.219 5.402 1.00 32.89 C ATOM 459 C ARG A 310 61.308 172.725 6.551 1.00 31.60 C ATOM 460 O ARG A 310 61.910 172.262 7.474 1.00 27.90 O ATOM 461 CB ARG A 310 62.597 174.555 5.772 1.00 40.93 C ATOM 462 CG ARG A 310 63.702 175.033 4.904 1.00 44.70 C ATOM 463 CD ARG A 310 64.979 175.263 5.730 1.00 49.76 C ATOM 464 NE ARG A 310 65.024 176.518 6.467 1.00 48.52 N ATOM 465 CZ ARG A 310 65.872 176.803 7.425 1.00 47.53 C ATOM 466 NH1 ARG A 310 66.707 175.895 7.922 1.00 43.21 N ATOM 467 NH2 ARG A 310 65.754 177.988 7.977 1.00 55.45 N ATOM 468 HE ARG A 310 64.327 177.247 6.213 1.00 0.00 H ATOM 469 HH12 ARG A 310 67.367 176.156 8.682 1.00 0.00 H ATOM 470 HH11 ARG A 310 66.700 174.924 7.550 1.00 0.00 H ATOM 471 HH22 ARG A 310 66.398 178.272 8.742 1.00 0.00 H ATOM 472 HH21 ARG A 310 65.016 178.643 7.649 1.00 0.00 H ATOM 473 H ARG A 310 60.618 174.194 4.052 1.00 0.00 H ATOM 474 N LYS A 311 59.965 172.779 6.555 1.00 32.37 N ATOM 475 CA LYS A 311 59.274 172.549 7.786 1.00 26.45 C ATOM 476 C LYS A 311 59.191 171.158 7.977 1.00 25.59 C ATOM 477 O LYS A 311 59.297 170.398 6.951 1.00 27.09 O ATOM 478 CB LYS A 311 57.824 172.998 7.652 1.00 33.78 C ATOM 479 CG LYS A 311 57.553 174.353 7.119 1.00 39.72 C ATOM 480 CD LYS A 311 55.973 174.480 6.990 1.00 45.24 C ATOM 481 CE LYS A 311 55.610 175.888 6.524 1.00 49.77 C ATOM 482 NZ LYS A 311 56.352 176.995 7.235 1.00 51.40 N ATOM 483 HZ1 LYS A 311 56.146 176.951 8.253 1.00 0.00 H ATOM 484 HZ2 LYS A 311 57.374 176.880 7.082 1.00 0.00 H ATOM 485 HZ3 LYS A 311 56.045 177.914 6.858 1.00 0.00 H ATOM 486 H LYS A 311 59.439 172.984 5.681 1.00 0.00 H ATOM 487 N SER A 312 58.905 170.710 9.165 1.00 21.25 N ATOM 488 CA SER A 312 58.885 169.378 9.402 1.00 27.47 C ATOM 489 C SER A 312 57.562 168.698 8.804 1.00 29.31 C ATOM 490 O SER A 312 56.536 169.332 8.719 1.00 28.77 O ATOM 491 CB SER A 312 59.025 168.977 10.832 1.00 26.35 C ATOM 492 OG SER A 312 57.850 169.161 11.663 1.00 26.78 O ATOM 493 HG SER A 312 58.051 168.865 12.586 1.00 0.00 H ATOM 494 H SER A 312 58.691 171.377 9.934 1.00 0.00 H ATOM 495 N MET A 313 57.663 167.426 8.504 1.00 29.63 N ATOM 496 CA MET A 313 56.516 166.650 8.176 1.00 33.63 C ATOM 497 C MET A 313 55.369 166.938 9.140 1.00 36.61 C ATOM 498 O MET A 313 54.199 166.929 8.707 1.00 25.93 O ATOM 499 CB MET A 313 56.836 165.168 8.062 1.00 32.83 C ATOM 500 CG MET A 313 57.152 164.521 9.328 1.00 36.32 C ATOM 501 SD MET A 313 57.671 162.761 9.075 1.00 40.74 S ATOM 502 CE MET A 313 59.227 162.989 8.207 1.00 42.89 C ATOM 503 H MET A 313 58.600 166.975 8.506 1.00 0.00 H ATOM 504 N TRP A 314 55.721 167.242 10.433 1.00 34.53 N ATOM 505 CA TRP A 314 54.723 167.318 11.450 1.00 33.41 C ATOM 506 C TRP A 314 53.924 168.649 11.359 1.00 37.79 C ATOM 507 O TRP A 314 52.740 168.641 11.526 1.00 39.55 O ATOM 508 CB TRP A 314 55.291 167.111 12.816 1.00 34.76 C ATOM 509 CG TRP A 314 55.710 165.710 12.961 1.00 38.80 C ATOM 510 CD1 TRP A 314 56.974 165.233 12.912 1.00 42.35 C ATOM 511 CD2 TRP A 314 54.847 164.600 13.045 1.00 48.37 C ATOM 512 NE1 TRP A 314 56.965 163.838 13.021 1.00 49.29 N ATOM 513 CE2 TRP A 314 55.663 163.425 13.022 1.00 52.89 C ATOM 514 CE3 TRP A 314 53.446 164.463 13.027 1.00 54.98 C ATOM 515 CZ2 TRP A 314 55.129 162.135 13.040 1.00 60.44 C ATOM 516 CZ3 TRP A 314 52.914 163.203 13.038 1.00 64.56 C ATOM 517 CH2 TRP A 314 53.740 162.045 13.059 1.00 66.99 C ATOM 518 HE1 TRP A 314 57.802 163.224 13.089 1.00 0.00 H ATOM 519 H TRP A 314 56.718 167.417 10.671 1.00 0.00 H ATOM 520 N GLU A 315 54.572 169.754 11.070 1.00 38.63 N ATOM 521 CA GLU A 315 53.970 170.978 10.842 1.00 39.07 C ATOM 522 C GLU A 315 53.218 170.981 9.408 1.00 39.06 C ATOM 523 O GLU A 315 52.207 171.643 9.248 1.00 30.31 O ATOM 524 CB GLU A 315 55.057 172.048 10.791 1.00 44.42 C ATOM 525 CG GLU A 315 54.378 173.456 10.826 1.00 58.77 C ATOM 526 CD GLU A 315 55.348 174.635 10.905 1.00 61.78 C ATOM 527 OE1 GLU A 315 56.589 174.433 10.874 1.00 79.12 O ATOM 528 OE2 GLU A 315 54.846 175.769 11.038 1.00 72.30 O ATOM 529 H GLU A 315 55.609 169.705 11.008 1.00 0.00 H ATOM 530 N MET A 316 53.749 170.264 8.404 1.00 30.00 N ATOM 531 CA MET A 316 53.012 170.201 7.189 1.00 29.87 C ATOM 532 C MET A 316 51.680 169.503 7.437 1.00 26.72 C ATOM 533 O MET A 316 50.720 169.891 6.885 1.00 20.90 O ATOM 534 CB MET A 316 53.750 169.471 6.139 1.00 28.78 C ATOM 535 CG MET A 316 54.601 170.416 5.309 1.00 39.13 C ATOM 536 SD MET A 316 53.660 171.854 4.749 1.00 42.73 S ATOM 537 CE MET A 316 53.035 171.263 3.160 1.00 37.05 C ATOM 538 H MET A 316 54.661 169.775 8.510 1.00 0.00 H ATOM 539 N TRP A 317 51.748 168.359 8.112 1.00 28.33 N ATOM 540 CA TRP A 317 50.738 167.608 8.466 1.00 30.52 C ATOM 541 C TRP A 317 49.687 168.255 9.253 1.00 34.00 C ATOM 542 O TRP A 317 48.535 168.128 8.821 1.00 37.20 O ATOM 543 CB TRP A 317 51.158 166.389 9.186 1.00 34.99 C ATOM 544 CG TRP A 317 50.014 165.697 9.826 1.00 42.01 C ATOM 545 CD1 TRP A 317 49.737 165.587 11.189 1.00 46.54 C ATOM 546 CD2 TRP A 317 48.949 165.053 9.161 1.00 48.41 C ATOM 547 NE1 TRP A 317 48.595 164.875 11.381 1.00 48.55 N ATOM 548 CE2 TRP A 317 48.084 164.523 10.169 1.00 45.48 C ATOM 549 CE3 TRP A 317 48.620 164.848 7.806 1.00 39.65 C ATOM 550 CZ2 TRP A 317 46.920 163.798 9.840 1.00 47.66 C ATOM 551 CZ3 TRP A 317 47.496 164.165 7.524 1.00 42.83 C ATOM 552 CH2 TRP A 317 46.653 163.602 8.539 1.00 39.10 C ATOM 553 HE1 TRP A 317 48.179 164.638 12.304 1.00 0.00 H ATOM 554 H TRP A 317 52.696 168.030 8.385 1.00 0.00 H ATOM 555 N GLU A 318 50.024 168.992 10.292 1.00 33.16 N ATOM 556 CA GLU A 318 49.044 169.770 10.971 1.00 36.98 C ATOM 557 C GLU A 318 48.239 170.728 10.041 1.00 32.42 C ATOM 558 O GLU A 318 47.088 170.835 10.144 1.00 32.10 O ATOM 559 CB GLU A 318 49.686 170.691 11.999 1.00 44.15 C ATOM 560 CG GLU A 318 49.822 170.100 13.405 1.00 57.36 C ATOM 561 CD GLU A 318 50.477 171.169 14.357 1.00 68.71 C ATOM 562 OE1 GLU A 318 51.555 170.880 14.968 1.00 65.58 O ATOM 563 OE2 GLU A 318 49.927 172.335 14.420 1.00 73.54 O ATOM 564 H GLU A 318 51.012 169.005 10.618 1.00 0.00 H ATOM 565 N ARG A 319 48.905 171.539 9.295 1.00 30.53 N ATOM 566 CA ARG A 319 48.315 172.388 8.343 1.00 37.24 C ATOM 567 C ARG A 319 47.379 171.637 7.366 1.00 37.73 C ATOM 568 O ARG A 319 46.259 172.060 7.214 1.00 32.50 O ATOM 569 CB ARG A 319 49.334 173.100 7.483 1.00 39.23 C ATOM 570 CG ARG A 319 50.196 174.088 8.221 1.00 42.04 C ATOM 571 CD ARG A 319 50.978 174.955 7.219 1.00 39.35 C ATOM 572 NE ARG A 319 51.772 175.803 7.978 1.00 40.38 N ATOM 573 CZ ARG A 319 52.114 177.066 7.693 1.00 50.18 C ATOM 574 NH1 ARG A 319 51.657 177.738 6.667 1.00 49.26 N ATOM 575 NH2 ARG A 319 52.923 177.716 8.538 1.00 61.05 N ATOM 576 HE ARG A 319 52.143 175.414 8.868 1.00 0.00 H ATOM 577 HH12 ARG A 319 51.967 178.718 6.507 1.00 0.00 H ATOM 578 HH11 ARG A 319 50.984 177.292 6.012 1.00 0.00 H ATOM 579 HH22 ARG A 319 53.203 178.698 8.339 1.00 0.00 H ATOM 580 HH21 ARG A 319 53.272 177.240 9.394 1.00 0.00 H ATOM 581 H ARG A 319 49.939 171.567 9.403 1.00 0.00 H ATOM 582 N CYS A 320 47.885 170.495 6.836 1.00 33.00 N ATOM 583 CA CYS A 320 47.158 169.674 5.858 1.00 34.22 C ATOM 584 C CYS A 320 45.980 169.049 6.535 1.00 34.78 C ATOM 585 O CYS A 320 44.896 169.143 6.026 1.00 36.50 O ATOM 586 CB CYS A 320 48.028 168.588 5.189 1.00 35.87 C ATOM 587 SG CYS A 320 49.334 169.407 4.164 1.00 38.27 S ATOM 588 H CYS A 320 48.832 170.186 7.136 1.00 0.00 H ATOM 589 N ALA A 321 46.103 168.525 7.741 1.00 35.80 N ATOM 590 CA ALA A 321 44.995 167.861 8.364 1.00 31.52 C ATOM 591 C ALA A 321 43.893 168.776 8.779 1.00 34.89 C ATOM 592 O ALA A 321 42.734 168.374 8.719 1.00 34.68 O ATOM 593 CB ALA A 321 45.495 167.075 9.546 1.00 34.51 C ATOM 594 H ALA A 321 47.011 168.594 8.243 1.00 0.00 H ATOM 595 N HIS A 322 44.223 169.979 9.215 1.00 33.91 N ATOM 596 CA HIS A 322 43.236 170.951 9.531 1.00 36.25 C ATOM 597 C HIS A 322 42.421 171.277 8.172 1.00 34.44 C ATOM 598 O HIS A 322 41.294 171.468 8.227 1.00 30.69 O ATOM 599 CB HIS A 322 43.904 172.251 10.147 1.00 35.14 C ATOM 600 CG HIS A 322 43.089 173.495 10.123 1.00 41.49 C ATOM 601 ND1 HIS A 322 42.101 173.770 11.056 1.00 49.75 N ATOM 602 CD2 HIS A 322 43.105 174.580 9.271 1.00 50.63 C ATOM 603 CE1 HIS A 322 41.522 174.942 10.773 1.00 48.51 C ATOM 604 NE2 HIS A 322 42.104 175.449 9.690 1.00 51.47 N ATOM 605 H HIS A 322 45.228 170.220 9.329 1.00 0.00 H ATOM 606 N HIS A 323 43.079 171.522 7.067 1.00 32.76 N ATOM 607 CA HIS A 323 42.421 171.877 5.795 1.00 31.59 C ATOM 608 C HIS A 323 41.534 170.742 5.343 1.00 30.31 C ATOM 609 O HIS A 323 40.431 171.049 4.915 1.00 28.60 O ATOM 610 CB HIS A 323 43.433 172.158 4.740 1.00 31.98 C ATOM 611 CG HIS A 323 44.145 173.412 4.970 1.00 36.05 C ATOM 612 ND1 HIS A 323 45.522 173.464 5.149 1.00 39.48 N ATOM 613 CD2 HIS A 323 43.684 174.695 5.000 1.00 35.96 C ATOM 614 CE1 HIS A 323 45.866 174.746 5.319 1.00 42.24 C ATOM 615 NE2 HIS A 323 44.764 175.507 5.223 1.00 38.16 N ATOM 616 H HIS A 323 44.117 171.464 7.087 1.00 0.00 H ATOM 617 N LEU A 324 41.921 169.502 5.575 1.00 27.46 N ATOM 618 CA LEU A 324 41.121 168.374 5.255 1.00 33.08 C ATOM 619 C LEU A 324 39.879 168.227 6.061 1.00 34.74 C ATOM 620 O LEU A 324 38.820 167.867 5.533 1.00 33.29 O ATOM 621 CB LEU A 324 41.899 167.121 5.444 1.00 37.40 C ATOM 622 CG LEU A 324 42.896 166.972 4.310 1.00 38.89 C ATOM 623 CD1 LEU A 324 44.127 166.226 4.771 1.00 46.59 C ATOM 624 CD2 LEU A 324 42.216 166.121 3.243 1.00 40.56 C ATOM 625 H LEU A 324 42.852 169.344 6.011 1.00 0.00 H ATOM 626 N THR A 325 40.005 168.558 7.358 1.00 37.78 N ATOM 627 CA THR A 325 38.889 168.346 8.269 1.00 36.61 C ATOM 628 C THR A 325 37.784 169.393 7.993 1.00 34.23 C ATOM 629 O THR A 325 36.612 169.012 7.971 1.00 32.95 O ATOM 630 CB THR A 325 39.230 168.278 9.766 1.00 40.65 C ATOM 631 OG1 THR A 325 39.440 169.617 10.239 1.00 49.58 O ATOM 632 CG2 THR A 325 40.466 167.427 10.076 1.00 40.44 C ATOM 633 HG1 THR A 325 40.187 170.030 9.738 1.00 0.00 H ATOM 634 H THR A 325 40.896 168.964 7.709 1.00 0.00 H ATOM 635 N GLU A 326 38.173 170.633 7.699 1.00 31.18 N ATOM 636 CA GLU A 326 37.307 171.659 7.166 1.00 33.79 C ATOM 637 C GLU A 326 36.641 171.218 5.855 1.00 32.67 C ATOM 638 O GLU A 326 35.412 171.368 5.701 1.00 28.78 O ATOM 639 CB GLU A 326 38.144 172.914 6.831 1.00 40.19 C ATOM 640 CG GLU A 326 38.699 173.753 7.990 1.00 55.52 C ATOM 641 CD GLU A 326 37.913 175.119 8.241 1.00 71.33 C ATOM 642 OE1 GLU A 326 36.668 175.013 8.446 1.00 83.15 O ATOM 643 OE2 GLU A 326 38.516 176.276 8.223 1.00 65.07 O ATOM 644 H GLU A 326 39.170 170.879 7.865 1.00 0.00 H ATOM 645 N ALA A 327 37.429 170.635 4.922 1.00 29.36 N ATOM 646 CA ALA A 327 36.866 170.178 3.645 1.00 31.90 C ATOM 647 C ALA A 327 35.840 169.107 3.866 1.00 29.96 C ATOM 648 O ALA A 327 34.776 169.186 3.276 1.00 30.49 O ATOM 649 CB ALA A 327 37.893 169.783 2.627 1.00 28.89 C ATOM 650 H ALA A 327 38.444 170.509 5.111 1.00 0.00 H ATOM 651 N ILE A 328 36.106 168.167 4.743 1.00 29.89 N ATOM 652 CA ILE A 328 35.165 167.017 5.001 1.00 29.65 C ATOM 653 C ILE A 328 33.853 167.603 5.535 1.00 31.41 C ATOM 654 O ILE A 328 32.734 167.213 5.065 1.00 25.10 O ATOM 655 CB ILE A 328 35.852 166.005 5.918 1.00 32.05 C ATOM 656 CG1 ILE A 328 36.875 165.176 5.058 1.00 32.99 C ATOM 657 CG2 ILE A 328 34.941 165.066 6.684 1.00 30.97 C ATOM 658 CD1 ILE A 328 38.030 164.524 5.826 1.00 30.06 C ATOM 659 H ILE A 328 36.996 168.217 5.278 1.00 0.00 H ATOM 660 N GLN A 329 34.003 168.490 6.536 1.00 30.56 N ATOM 661 CA GLN A 329 32.899 169.242 7.071 1.00 33.22 C ATOM 662 C GLN A 329 31.968 169.791 5.971 1.00 26.39 C ATOM 663 O GLN A 329 30.850 169.646 6.020 1.00 26.82 O ATOM 664 CB GLN A 329 33.395 170.480 7.926 1.00 34.77 C ATOM 665 CG GLN A 329 32.233 171.105 8.758 1.00 38.98 C ATOM 666 CD GLN A 329 31.553 170.081 9.718 1.00 40.37 C ATOM 667 OE1 GLN A 329 32.154 169.121 10.153 1.00 47.99 O ATOM 668 NE2 GLN A 329 30.304 170.241 9.923 1.00 42.75 N ATOM 669 HE22 GLN A 329 29.816 171.075 9.537 1.00 0.00 H ATOM 670 HE21 GLN A 329 29.774 169.538 10.476 1.00 0.00 H ATOM 671 H GLN A 329 34.951 168.637 6.937 1.00 0.00 H ATOM 672 N TYR A 330 32.503 170.395 5.001 1.00 27.44 N ATOM 673 CA TYR A 330 31.779 170.857 3.859 1.00 29.26 C ATOM 674 C TYR A 330 31.159 169.793 3.061 1.00 28.19 C ATOM 675 O TYR A 330 30.001 169.980 2.652 1.00 26.59 O ATOM 676 CB TYR A 330 32.586 171.800 2.953 1.00 30.04 C ATOM 677 CG TYR A 330 32.706 173.135 3.549 1.00 40.72 C ATOM 678 CD1 TYR A 330 31.565 173.942 3.734 1.00 50.37 C ATOM 679 CD2 TYR A 330 33.986 173.639 3.997 1.00 49.38 C ATOM 680 CE1 TYR A 330 31.671 175.212 4.347 1.00 59.62 C ATOM 681 CE2 TYR A 330 34.106 174.907 4.624 1.00 54.12 C ATOM 682 CZ TYR A 330 32.979 175.689 4.789 1.00 60.79 C ATOM 683 OH TYR A 330 33.140 176.935 5.349 1.00 64.22 O ATOM 684 HH TYR A 330 32.260 177.385 5.409 1.00 0.00 H ATOM 685 H TYR A 330 33.528 170.566 5.035 1.00 0.00 H ATOM 686 N VAL A 331 31.861 168.719 2.761 1.00 26.27 N ATOM 687 CA VAL A 331 31.240 167.528 2.142 1.00 23.81 C ATOM 688 C VAL A 331 30.156 166.998 2.930 1.00 25.93 C ATOM 689 O VAL A 331 29.202 166.523 2.441 1.00 28.56 O ATOM 690 CB VAL A 331 32.291 166.435 1.939 1.00 21.64 C ATOM 691 CG1 VAL A 331 31.678 165.179 1.375 1.00 22.79 C ATOM 692 CG2 VAL A 331 33.323 167.012 0.940 1.00 21.64 C ATOM 693 H VAL A 331 32.881 168.709 2.965 1.00 0.00 H ATOM 694 N VAL A 332 30.240 167.058 4.228 1.00 30.38 N ATOM 695 CA VAL A 332 29.148 166.420 5.056 1.00 28.44 C ATOM 696 C VAL A 332 27.942 167.372 4.987 1.00 33.10 C ATOM 697 O VAL A 332 26.767 166.895 4.846 1.00 31.47 O ATOM 698 CB VAL A 332 29.644 166.251 6.430 1.00 27.11 C ATOM 699 CG1 VAL A 332 28.535 166.013 7.517 1.00 29.65 C ATOM 700 CG2 VAL A 332 30.623 165.140 6.457 1.00 26.79 C ATOM 701 H VAL A 332 31.042 167.535 4.686 1.00 0.00 H ATOM 702 N GLU A 333 28.175 168.680 5.074 1.00 32.00 N ATOM 703 CA GLU A 333 27.113 169.611 4.844 1.00 32.26 C ATOM 704 C GLU A 333 26.363 169.336 3.539 1.00 29.39 C ATOM 705 O GLU A 333 25.192 169.375 3.590 1.00 31.33 O ATOM 706 CB GLU A 333 27.582 171.078 4.839 1.00 36.39 C ATOM 707 CG GLU A 333 28.087 171.684 6.116 1.00 47.69 C ATOM 708 CD GLU A 333 27.257 171.307 7.397 1.00 54.32 C ATOM 709 OE1 GLU A 333 27.924 171.158 8.471 1.00 51.07 O ATOM 710 OE2 GLU A 333 25.981 171.167 7.328 1.00 52.78 O ATOM 711 H GLU A 333 29.128 169.025 5.309 1.00 0.00 H ATOM 712 N PHE A 334 27.094 169.134 2.406 1.00 27.46 N ATOM 713 CA PHE A 334 26.581 168.893 1.075 1.00 27.57 C ATOM 714 C PHE A 334 25.698 167.733 1.048 1.00 26.89 C ATOM 715 O PHE A 334 24.531 167.819 0.654 1.00 29.65 O ATOM 716 CB PHE A 334 27.772 168.778 0.025 1.00 29.68 C ATOM 717 CG PHE A 334 27.348 168.277 -1.401 1.00 24.34 C ATOM 718 CD1 PHE A 334 26.576 169.044 -2.216 1.00 24.73 C ATOM 719 CD2 PHE A 334 27.856 167.103 -1.916 1.00 25.34 C ATOM 720 CE1 PHE A 334 26.221 168.659 -3.484 1.00 27.51 C ATOM 721 CE2 PHE A 334 27.481 166.675 -3.174 1.00 24.95 C ATOM 722 CZ PHE A 334 26.735 167.512 -4.011 1.00 25.98 C ATOM 723 H PHE A 334 28.129 169.155 2.509 1.00 0.00 H ATOM 724 N ALA A 335 26.088 166.691 1.709 1.00 25.88 N ATOM 725 CA ALA A 335 25.329 165.448 1.705 1.00 25.67 C ATOM 726 C ALA A 335 24.049 165.674 2.370 1.00 32.67 C ATOM 727 O ALA A 335 22.884 165.151 1.879 1.00 32.17 O ATOM 728 CB ALA A 335 26.164 164.393 2.476 1.00 24.96 C ATOM 729 H ALA A 335 26.969 166.743 2.259 1.00 0.00 H ATOM 730 N LYS A 336 24.152 166.396 3.524 1.00 34.30 N ATOM 731 CA LYS A 336 22.987 166.601 4.411 1.00 37.15 C ATOM 732 C LYS A 336 21.955 167.448 3.683 1.00 38.46 C ATOM 733 O LYS A 336 20.807 167.377 4.011 1.00 42.40 O ATOM 734 CB LYS A 336 23.408 167.288 5.719 1.00 37.75 C ATOM 735 CG LYS A 336 23.916 166.341 6.771 1.00 44.87 C ATOM 736 CD LYS A 336 23.626 166.828 8.214 1.00 54.44 C ATOM 737 CE LYS A 336 24.529 167.959 8.622 1.00 54.10 C ATOM 738 NZ LYS A 336 23.776 169.112 9.250 1.00 62.10 N ATOM 739 HZ1 LYS A 336 23.085 169.486 8.568 1.00 0.00 H ATOM 740 HZ2 LYS A 336 23.279 168.778 10.101 1.00 0.00 H ATOM 741 HZ3 LYS A 336 24.448 169.862 9.511 1.00 0.00 H ATOM 742 H LYS A 336 25.069 166.811 3.785 1.00 0.00 H ATOM 743 N ARG A 337 22.357 168.295 2.752 1.00 35.89 N ATOM 744 CA ARG A 337 21.329 168.977 1.941 1.00 37.09 C ATOM 745 C ARG A 337 20.820 168.240 0.668 1.00 37.35 C ATOM 746 O ARG A 337 20.153 168.885 -0.083 1.00 38.28 O ATOM 747 CB ARG A 337 21.934 170.266 1.426 1.00 40.75 C ATOM 748 CG ARG A 337 22.241 171.230 2.523 1.00 38.78 C ATOM 749 CD ARG A 337 22.895 172.389 1.857 1.00 43.29 C ATOM 750 NE ARG A 337 23.362 173.309 2.906 1.00 50.63 N ATOM 751 CZ ARG A 337 23.389 174.654 2.771 1.00 52.08 C ATOM 752 NH1 ARG A 337 22.928 175.260 1.572 1.00 39.61 N ATOM 753 NH2 ARG A 337 23.921 175.363 3.820 1.00 44.07 N ATOM 754 HE ARG A 337 23.691 172.901 3.804 1.00 0.00 H ATOM 755 HH12 ARG A 337 22.950 176.295 1.471 1.00 0.00 H ATOM 756 HH11 ARG A 337 22.569 174.669 0.795 1.00 0.00 H ATOM 757 HH22 ARG A 337 23.969 176.401 3.775 1.00 0.00 H ATOM 758 HH21 ARG A 337 24.276 174.862 4.660 1.00 0.00 H ATOM 759 H ARG A 337 23.369 168.476 2.595 1.00 0.00 H ATOM 760 N LEU A 338 21.186 166.974 0.399 1.00 38.80 N ATOM 761 CA LEU A 338 20.687 166.258 -0.803 1.00 40.89 C ATOM 762 C LEU A 338 19.400 165.553 -0.424 1.00 46.80 C ATOM 763 O LEU A 338 19.242 165.002 0.712 1.00 39.13 O ATOM 764 CB LEU A 338 21.640 165.139 -1.258 1.00 38.30 C ATOM 765 CG LEU A 338 23.022 165.689 -1.672 1.00 37.01 C ATOM 766 CD1 LEU A 338 24.090 164.632 -2.012 1.00 32.69 C ATOM 767 CD2 LEU A 338 22.696 166.610 -2.784 1.00 36.14 C ATOM 768 H LEU A 338 21.834 166.484 1.048 1.00 0.00 H ATOM 769 N SER A 339 18.493 165.501 -1.424 1.00 48.36 N ATOM 770 CA SER A 339 17.115 165.071 -1.115 1.00 52.24 C ATOM 771 C SER A 339 17.151 163.697 -0.579 1.00 43.88 C ATOM 772 O SER A 339 17.905 162.873 -1.072 1.00 38.40 O ATOM 773 CB SER A 339 16.187 165.096 -2.331 1.00 54.59 C ATOM 774 OG SER A 339 15.683 166.392 -2.409 1.00 59.62 O ATOM 775 HG SER A 339 15.072 166.461 -3.185 1.00 0.00 H ATOM 776 H SER A 339 18.761 165.760 -2.395 1.00 0.00 H ATOM 777 N GLY A 340 16.415 163.438 0.514 1.00 39.55 N ATOM 778 CA GLY A 340 16.436 162.079 1.073 1.00 34.38 C ATOM 779 C GLY A 340 17.607 161.606 1.872 1.00 29.58 C ATOM 780 O GLY A 340 17.427 160.667 2.597 1.00 30.95 O ATOM 781 H GLY A 340 15.841 164.184 0.956 1.00 0.00 H ATOM 782 N PHE A 341 18.759 162.282 1.867 1.00 32.35 N ATOM 783 CA PHE A 341 19.897 161.806 2.599 1.00 38.00 C ATOM 784 C PHE A 341 19.600 161.743 4.146 1.00 38.81 C ATOM 785 O PHE A 341 19.901 160.715 4.859 1.00 33.98 O ATOM 786 CB PHE A 341 21.199 162.603 2.306 1.00 38.33 C ATOM 787 CG PHE A 341 22.420 162.059 3.059 1.00 35.52 C ATOM 788 CD1 PHE A 341 23.153 161.049 2.581 1.00 36.07 C ATOM 789 CD2 PHE A 341 22.782 162.592 4.326 1.00 39.64 C ATOM 790 CE1 PHE A 341 24.256 160.552 3.275 1.00 37.20 C ATOM 791 CE2 PHE A 341 23.919 162.119 5.077 1.00 38.96 C ATOM 792 CZ PHE A 341 24.658 161.073 4.513 1.00 35.90 C ATOM 793 H PHE A 341 18.832 163.166 1.324 1.00 0.00 H ATOM 794 N MET A 342 18.994 162.787 4.612 1.00 38.56 N ATOM 795 CA MET A 342 18.699 162.944 6.056 1.00 49.69 C ATOM 796 C MET A 342 17.588 162.045 6.550 1.00 51.20 C ATOM 797 O MET A 342 17.448 161.948 7.728 1.00 39.15 O ATOM 798 CB MET A 342 18.255 164.361 6.359 1.00 54.79 C ATOM 799 CG MET A 342 19.302 165.381 6.004 1.00 60.29 C ATOM 800 SD MET A 342 20.458 165.450 7.320 1.00 79.67 S ATOM 801 CE MET A 342 19.862 167.082 7.975 1.00 68.56 C ATOM 802 H MET A 342 18.705 163.538 3.954 1.00 0.00 H ATOM 803 N GLU A 343 16.858 161.379 5.601 1.00 50.93 N ATOM 804 CA GLU A 343 15.757 160.477 5.897 1.00 47.34 C ATOM 805 C GLU A 343 16.256 159.068 5.998 1.00 40.99 C ATOM 806 O GLU A 343 15.568 158.180 6.421 1.00 41.63 O ATOM 807 CB GLU A 343 14.675 160.664 4.810 1.00 52.58 C ATOM 808 CG GLU A 343 13.789 161.927 4.959 1.00 58.80 C ATOM 809 CD GLU A 343 14.506 163.320 4.615 1.00 65.06 C ATOM 810 OE1 GLU A 343 14.358 164.297 5.395 1.00 53.69 O ATOM 811 OE2 GLU A 343 15.212 163.464 3.535 1.00 68.63 O ATOM 812 H GLU A 343 17.108 161.529 4.603 1.00 0.00 H ATOM 813 N LEU A 344 17.453 158.816 5.566 1.00 43.99 N ATOM 814 CA LEU A 344 18.133 157.466 5.644 1.00 39.53 C ATOM 815 C LEU A 344 18.459 157.306 7.025 1.00 43.02 C ATOM 816 O LEU A 344 18.528 158.316 7.737 1.00 49.46 O ATOM 817 CB LEU A 344 19.509 157.471 4.887 1.00 40.39 C ATOM 818 CG LEU A 344 19.474 157.560 3.355 1.00 39.06 C ATOM 819 CD1 LEU A 344 20.863 157.572 2.696 1.00 37.02 C ATOM 820 CD2 LEU A 344 18.713 156.316 2.843 1.00 42.94 C ATOM 821 H LEU A 344 17.984 159.599 5.134 1.00 0.00 H ATOM 822 N CYS A 345 18.730 156.081 7.458 1.00 46.97 N ATOM 823 CA CYS A 345 19.063 155.942 8.924 1.00 47.02 C ATOM 824 C CYS A 345 20.505 156.442 9.149 1.00 54.39 C ATOM 825 O CYS A 345 21.397 156.399 8.211 1.00 48.53 O ATOM 826 CB CYS A 345 18.961 154.484 9.398 1.00 43.75 C ATOM 827 SG CYS A 345 20.087 153.392 8.463 1.00 54.24 S ATOM 828 H CYS A 345 18.714 155.259 6.820 1.00 0.00 H ATOM 829 N GLN A 346 20.771 156.761 10.400 1.00 53.13 N ATOM 830 CA GLN A 346 22.089 157.203 10.833 1.00 52.85 C ATOM 831 C GLN A 346 23.230 156.250 10.406 1.00 46.52 C ATOM 832 O GLN A 346 24.208 156.716 9.809 1.00 41.47 O ATOM 833 CB GLN A 346 22.106 157.456 12.387 1.00 53.01 C ATOM 834 CG GLN A 346 23.498 157.696 13.040 1.00 54.17 C ATOM 835 CD GLN A 346 23.404 158.269 14.462 1.00 55.55 C ATOM 836 OE1 GLN A 346 23.795 157.639 15.450 1.00 51.54 O ATOM 837 NE2 GLN A 346 22.890 159.483 14.551 1.00 60.10 N ATOM 838 HE22 GLN A 346 22.573 159.978 13.693 1.00 0.00 H ATOM 839 HE21 GLN A 346 22.802 159.944 15.479 1.00 0.00 H ATOM 840 H GLN A 346 20.010 156.694 11.105 1.00 0.00 H ATOM 841 N ASN A 347 23.144 154.956 10.726 1.00 41.09 N ATOM 842 CA ASN A 347 24.229 154.023 10.311 1.00 45.72 C ATOM 843 C ASN A 347 24.518 154.160 8.797 1.00 47.25 C ATOM 844 O ASN A 347 25.688 154.186 8.404 1.00 50.86 O ATOM 845 CB ASN A 347 23.853 152.552 10.585 1.00 48.05 C ATOM 846 CG ASN A 347 24.838 151.548 9.920 1.00 50.21 C ATOM 847 OD1 ASN A 347 25.979 151.493 10.269 1.00 52.54 O ATOM 848 ND2 ASN A 347 24.368 150.805 8.893 1.00 54.15 N ATOM 849 HD22 ASN A 347 23.369 150.876 8.614 1.00 0.00 H ATOM 850 HD21 ASN A 347 25.006 150.162 8.382 1.00 0.00 H ATOM 851 H ASN A 347 22.325 154.602 11.261 1.00 0.00 H ATOM 852 N ASP A 348 23.423 154.285 7.973 1.00 42.85 N ATOM 853 CA ASP A 348 23.566 154.448 6.504 1.00 46.36 C ATOM 854 C ASP A 348 24.103 155.807 6.113 1.00 33.95 C ATOM 855 O ASP A 348 25.100 155.875 5.352 1.00 32.96 O ATOM 856 CB ASP A 348 22.263 154.125 5.709 1.00 49.30 C ATOM 857 CG ASP A 348 21.952 152.654 5.645 1.00 51.13 C ATOM 858 OD1 ASP A 348 22.741 151.837 6.221 1.00 45.68 O ATOM 859 OD2 ASP A 348 20.888 152.357 4.933 1.00 57.08 O ATOM 860 H ASP A 348 22.470 154.265 8.390 1.00 0.00 H ATOM 861 N GLN A 349 23.576 156.850 6.733 1.00 32.89 N ATOM 862 CA GLN A 349 24.274 158.199 6.621 1.00 37.86 C ATOM 863 C GLN A 349 25.785 158.133 6.786 1.00 35.58 C ATOM 864 O GLN A 349 26.611 158.619 5.938 1.00 34.34 O ATOM 865 CB GLN A 349 23.744 159.255 7.547 1.00 39.86 C ATOM 866 CG GLN A 349 22.262 159.384 7.567 1.00 39.89 C ATOM 867 CD GLN A 349 21.794 160.696 8.164 1.00 43.99 C ATOM 868 OE1 GLN A 349 22.623 161.601 8.406 1.00 37.47 O ATOM 869 NE2 GLN A 349 20.400 160.875 8.318 1.00 41.58 N ATOM 870 HE22 GLN A 349 19.749 160.093 8.104 1.00 0.00 H ATOM 871 HE21 GLN A 349 20.026 161.789 8.645 1.00 0.00 H ATOM 872 H GLN A 349 22.701 156.751 7.287 1.00 0.00 H ATOM 873 N ILE A 350 26.170 157.440 7.845 1.00 34.48 N ATOM 874 CA ILE A 350 27.586 157.388 8.204 1.00 34.36 C ATOM 875 C ILE A 350 28.331 156.612 7.215 1.00 32.35 C ATOM 876 O ILE A 350 29.455 157.000 6.924 1.00 34.08 O ATOM 877 CB ILE A 350 27.756 156.785 9.667 1.00 35.84 C ATOM 878 CG1 ILE A 350 27.326 157.934 10.659 1.00 41.13 C ATOM 879 CG2 ILE A 350 29.173 156.401 9.893 1.00 32.81 C ATOM 880 CD1 ILE A 350 26.804 157.456 11.984 1.00 46.31 C ATOM 881 H ILE A 350 25.467 156.934 8.421 1.00 0.00 H ATOM 882 N VAL A 351 27.847 155.419 6.879 1.00 34.59 N ATOM 883 CA VAL A 351 28.548 154.474 5.934 1.00 36.21 C ATOM 884 C VAL A 351 28.788 155.130 4.594 1.00 32.40 C ATOM 885 O VAL A 351 29.881 154.973 4.049 1.00 34.97 O ATOM 886 CB VAL A 351 27.726 153.186 5.646 1.00 38.56 C ATOM 887 CG1 VAL A 351 28.328 152.390 4.501 1.00 40.01 C ATOM 888 CG2 VAL A 351 27.715 152.255 6.947 1.00 41.77 C ATOM 889 H VAL A 351 26.938 155.122 7.289 1.00 0.00 H ATOM 890 N LEU A 352 27.805 155.881 4.099 1.00 31.60 N ATOM 891 CA LEU A 352 28.025 156.644 2.797 1.00 28.16 C ATOM 892 C LEU A 352 29.079 157.708 2.991 1.00 26.77 C ATOM 893 O LEU A 352 30.108 157.825 2.216 1.00 26.32 O ATOM 894 CB LEU A 352 26.717 157.224 2.268 1.00 27.11 C ATOM 895 CG LEU A 352 25.615 156.303 1.890 1.00 29.33 C ATOM 896 CD1 LEU A 352 24.405 156.991 1.276 1.00 29.95 C ATOM 897 CD2 LEU A 352 25.996 155.157 1.014 1.00 30.48 C ATOM 898 H LEU A 352 26.894 155.946 4.597 1.00 0.00 H ATOM 899 N LEU A 353 28.974 158.462 4.092 1.00 28.87 N ATOM 900 CA LEU A 353 30.079 159.560 4.297 1.00 29.31 C ATOM 901 C LEU A 353 31.411 159.019 4.472 1.00 31.85 C ATOM 902 O LEU A 353 32.431 159.560 3.867 1.00 33.79 O ATOM 903 CB LEU A 353 29.774 160.496 5.322 1.00 28.19 C ATOM 904 CG LEU A 353 28.701 161.402 4.870 1.00 33.33 C ATOM 905 CD1 LEU A 353 27.797 161.949 6.072 1.00 33.81 C ATOM 906 CD2 LEU A 353 29.311 162.534 4.088 1.00 32.96 C ATOM 907 H LEU A 353 28.202 158.328 4.776 1.00 0.00 H ATOM 908 N LYS A 354 31.504 157.930 5.238 1.00 37.62 N ATOM 909 CA LYS A 354 32.840 157.291 5.553 1.00 35.99 C ATOM 910 C LYS A 354 33.449 156.780 4.318 1.00 35.64 C ATOM 911 O LYS A 354 34.627 156.892 4.084 1.00 35.80 O ATOM 912 CB LYS A 354 32.531 156.181 6.520 1.00 42.65 C ATOM 913 CG LYS A 354 33.675 155.254 6.958 1.00 49.41 C ATOM 914 CD LYS A 354 33.355 154.635 8.376 1.00 54.74 C ATOM 915 CE LYS A 354 34.025 153.273 8.727 1.00 56.79 C ATOM 916 NZ LYS A 354 35.488 153.210 8.359 1.00 60.22 N ATOM 917 HZ1 LYS A 354 35.593 153.355 7.335 1.00 0.00 H ATOM 918 HZ2 LYS A 354 36.005 153.953 8.870 1.00 0.00 H ATOM 919 HZ3 LYS A 354 35.870 152.278 8.620 1.00 0.00 H ATOM 920 H LYS A 354 30.637 157.510 5.628 1.00 0.00 H ATOM 921 N ALA A 355 32.645 156.242 3.449 1.00 33.27 N ATOM 922 CA ALA A 355 33.154 155.655 2.180 1.00 36.24 C ATOM 923 C ALA A 355 33.451 156.716 1.018 1.00 35.34 C ATOM 924 O ALA A 355 34.461 156.623 0.332 1.00 34.71 O ATOM 925 CB ALA A 355 32.101 154.695 1.617 1.00 35.79 C ATOM 926 H ALA A 355 31.624 156.222 3.645 1.00 0.00 H ATOM 927 N GLY A 356 32.604 157.739 0.944 1.00 30.95 N ATOM 928 CA GLY A 356 32.731 158.709 -0.107 1.00 28.15 C ATOM 929 C GLY A 356 33.387 160.036 0.148 1.00 26.67 C ATOM 930 O GLY A 356 33.794 160.711 -0.828 1.00 29.33 O ATOM 931 H GLY A 356 31.847 157.837 1.650 1.00 0.00 H ATOM 932 N ALA A 357 33.418 160.486 1.391 1.00 26.55 N ATOM 933 CA ALA A 357 33.785 161.868 1.678 1.00 30.66 C ATOM 934 C ALA A 357 35.134 162.310 1.093 1.00 31.60 C ATOM 935 O ALA A 357 35.300 163.377 0.377 1.00 31.73 O ATOM 936 CB ALA A 357 33.705 162.092 3.217 1.00 34.37 C ATOM 937 H ALA A 357 33.177 159.846 2.175 1.00 0.00 H ATOM 938 N MET A 358 36.122 161.504 1.312 1.00 29.51 N ATOM 939 CA MET A 358 37.455 161.840 0.867 1.00 28.62 C ATOM 940 C MET A 358 37.604 161.688 -0.616 1.00 28.00 C ATOM 941 O MET A 358 38.399 162.412 -1.269 1.00 23.75 O ATOM 942 CB MET A 358 38.495 160.772 1.549 1.00 32.98 C ATOM 943 CG MET A 358 39.069 161.182 2.896 1.00 36.84 C ATOM 944 SD MET A 358 39.915 162.864 2.763 1.00 47.75 S ATOM 945 CE MET A 358 41.255 162.504 1.692 1.00 48.00 C ATOM 946 H MET A 358 35.956 160.607 1.812 1.00 0.00 H ATOM 947 N GLU A 359 36.851 160.733 -1.197 1.00 25.79 N ATOM 948 CA GLU A 359 36.722 160.729 -2.680 1.00 26.20 C ATOM 949 C GLU A 359 36.132 162.066 -3.249 1.00 24.66 C ATOM 950 O GLU A 359 36.599 162.658 -4.181 1.00 22.01 O ATOM 951 CB GLU A 359 35.806 159.540 -3.033 1.00 31.41 C ATOM 952 CG GLU A 359 36.322 158.133 -2.687 1.00 34.37 C ATOM 953 CD GLU A 359 35.367 156.976 -3.113 1.00 41.49 C ATOM 954 OE1 GLU A 359 35.419 155.914 -2.484 1.00 49.82 O ATOM 955 OE2 GLU A 359 34.619 157.025 -4.149 1.00 41.75 O ATOM 956 H GLU A 359 36.370 160.013 -0.621 1.00 0.00 H ATOM 957 N VAL A 360 35.052 162.571 -2.608 1.00 23.65 N ATOM 958 CA VAL A 360 34.504 163.878 -3.032 1.00 24.03 C ATOM 959 C VAL A 360 35.572 164.967 -2.810 1.00 21.89 C ATOM 960 O VAL A 360 35.732 165.811 -3.687 1.00 21.80 O ATOM 961 CB VAL A 360 33.237 164.233 -2.244 1.00 21.99 C ATOM 962 CG1 VAL A 360 32.797 165.660 -2.489 1.00 22.09 C ATOM 963 CG2 VAL A 360 32.202 163.350 -2.632 1.00 23.93 C ATOM 964 H VAL A 360 34.612 162.046 -1.826 1.00 0.00 H ATOM 965 N VAL A 361 36.301 164.934 -1.713 1.00 21.34 N ATOM 966 CA VAL A 361 37.324 165.984 -1.420 1.00 22.24 C ATOM 967 C VAL A 361 38.278 165.973 -2.623 1.00 26.30 C ATOM 968 O VAL A 361 38.635 167.045 -3.222 1.00 25.91 O ATOM 969 CB VAL A 361 38.039 165.827 -0.030 1.00 20.13 C ATOM 970 CG1 VAL A 361 39.295 166.796 0.064 1.00 20.29 C ATOM 971 CG2 VAL A 361 37.119 166.053 1.117 1.00 19.86 C ATOM 972 H VAL A 361 36.161 164.158 -1.034 1.00 0.00 H ATOM 973 N LEU A 362 38.723 164.752 -2.962 1.00 26.89 N ATOM 974 CA LEU A 362 39.631 164.619 -4.067 1.00 28.89 C ATOM 975 C LEU A 362 39.082 165.170 -5.359 1.00 30.95 C ATOM 976 O LEU A 362 39.814 165.907 -6.073 1.00 24.44 O ATOM 977 CB LEU A 362 39.850 163.147 -4.318 1.00 37.80 C ATOM 978 CG LEU A 362 40.694 162.879 -5.575 1.00 42.21 C ATOM 979 CD1 LEU A 362 41.974 163.614 -5.551 1.00 40.33 C ATOM 980 CD2 LEU A 362 40.952 161.388 -5.570 1.00 54.69 C ATOM 981 H LEU A 362 38.414 163.913 -2.431 1.00 0.00 H ATOM 982 N VAL A 363 37.786 164.828 -5.695 1.00 24.93 N ATOM 983 CA VAL A 363 37.293 165.376 -6.944 1.00 25.98 C ATOM 984 C VAL A 363 37.198 166.933 -6.805 1.00 28.40 C ATOM 985 O VAL A 363 37.528 167.654 -7.753 1.00 28.03 O ATOM 986 CB VAL A 363 35.909 164.850 -7.298 1.00 25.34 C ATOM 987 CG1 VAL A 363 35.319 165.682 -8.349 1.00 25.07 C ATOM 988 CG2 VAL A 363 35.914 163.376 -7.625 1.00 23.16 C ATOM 989 H VAL A 363 37.201 164.216 -5.090 1.00 0.00 H ATOM 990 N ARG A 364 36.734 167.447 -5.683 1.00 27.67 N ATOM 991 CA ARG A 364 36.680 168.903 -5.532 1.00 30.13 C ATOM 992 C ARG A 364 38.056 169.591 -5.662 1.00 30.69 C ATOM 993 O ARG A 364 38.132 170.635 -6.258 1.00 29.08 O ATOM 994 CB ARG A 364 36.065 169.280 -4.184 1.00 30.07 C ATOM 995 CG ARG A 364 34.591 168.962 -4.076 1.00 30.46 C ATOM 996 CD ARG A 364 34.128 169.393 -2.624 1.00 31.67 C ATOM 997 NE ARG A 364 32.652 169.560 -2.642 1.00 30.44 N ATOM 998 CZ ARG A 364 31.972 170.313 -1.803 1.00 32.04 C ATOM 999 NH1 ARG A 364 32.573 171.005 -0.832 1.00 34.84 N ATOM 1000 NH2 ARG A 364 30.684 170.453 -1.957 1.00 35.40 N ATOM 1001 HE ARG A 364 32.117 169.045 -3.370 1.00 0.00 H ATOM 1002 HH12 ARG A 364 32.008 171.591 -0.185 1.00 0.00 H ATOM 1003 HH11 ARG A 364 33.606 170.958 -0.723 1.00 0.00 H ATOM 1004 HH22 ARG A 364 30.143 171.047 -1.297 1.00 0.00 H ATOM 1005 HH21 ARG A 364 30.198 169.971 -2.740 1.00 0.00 H ATOM 1006 H ARG A 364 36.410 166.826 -4.914 1.00 0.00 H ATOM 1007 N MET A 365 39.128 168.937 -5.290 1.00 37.19 N ATOM 1008 CA MET A 365 40.510 169.487 -5.617 1.00 43.18 C ATOM 1009 C MET A 365 40.807 169.928 -7.041 1.00 42.31 C ATOM 1010 O MET A 365 41.578 170.917 -7.208 1.00 35.78 O ATOM 1011 CB MET A 365 41.631 168.498 -5.332 1.00 50.02 C ATOM 1012 CG MET A 365 42.031 168.526 -3.855 1.00 64.95 C ATOM 1013 SD MET A 365 43.290 167.267 -3.452 1.00 80.40 S ATOM 1014 CE MET A 365 44.585 168.064 -4.446 1.00 74.10 C ATOM 1015 H MET A 365 39.035 168.041 -4.771 1.00 0.00 H ATOM 1016 N CYS A 366 40.223 169.275 -8.036 1.00 37.54 N ATOM 1017 CA CYS A 366 40.535 169.608 -9.420 1.00 42.35 C ATOM 1018 C CYS A 366 40.184 171.039 -9.826 1.00 42.85 C ATOM 1019 O CYS A 366 40.775 171.589 -10.729 1.00 42.20 O ATOM 1020 CB CYS A 366 39.962 168.538 -10.404 1.00 51.72 C ATOM 1021 SG CYS A 366 38.197 168.621 -10.983 1.00 54.64 S ATOM 1022 H CYS A 366 39.538 168.521 -7.828 1.00 0.00 H ATOM 1023 N ARG A 367 39.309 171.697 -9.098 1.00 40.28 N ATOM 1024 CA ARG A 367 38.990 173.123 -9.338 1.00 38.31 C ATOM 1025 C ARG A 367 39.988 174.062 -8.925 1.00 38.85 C ATOM 1026 O ARG A 367 39.918 175.266 -9.292 1.00 31.78 O ATOM 1027 CB ARG A 367 37.801 173.503 -8.415 1.00 42.45 C ATOM 1028 CG ARG A 367 36.564 172.636 -8.752 1.00 48.41 C ATOM 1029 CD ARG A 367 35.570 172.569 -7.626 1.00 51.90 C ATOM 1030 NE ARG A 367 34.864 173.849 -7.493 1.00 50.23 N ATOM 1031 CZ ARG A 367 35.139 174.813 -6.624 1.00 46.40 C ATOM 1032 NH1 ARG A 367 36.149 174.634 -5.725 1.00 40.42 N ATOM 1033 NH2 ARG A 367 34.360 175.930 -6.621 1.00 38.13 N ATOM 1034 HE ARG A 367 34.070 174.017 -8.144 1.00 0.00 H ATOM 1035 HH12 ARG A 367 36.373 175.383 -5.039 1.00 0.00 H ATOM 1036 HH11 ARG A 367 36.695 173.749 -5.725 1.00 0.00 H ATOM 1037 HH22 ARG A 367 34.556 176.699 -5.949 1.00 0.00 H ATOM 1038 HH21 ARG A 367 33.569 176.014 -7.291 1.00 0.00 H ATOM 1039 H ARG A 367 38.823 171.198 -8.326 1.00 0.00 H ATOM 1040 N ALA A 368 40.873 173.585 -7.995 1.00 36.99 N ATOM 1041 CA ALA A 368 41.982 174.433 -7.425 1.00 34.06 C ATOM 1042 C ALA A 368 43.343 174.088 -8.178 1.00 32.98 C ATOM 1043 O ALA A 368 44.395 174.616 -7.857 1.00 33.52 O ATOM 1044 CB ALA A 368 42.080 174.089 -5.905 1.00 35.84 C ATOM 1045 H ALA A 368 40.777 172.602 -7.670 1.00 0.00 H ATOM 1046 N TYR A 369 43.304 173.229 -9.151 1.00 33.27 N ATOM 1047 CA TYR A 369 44.450 172.788 -9.857 1.00 34.96 C ATOM 1048 C TYR A 369 44.504 173.514 -11.195 1.00 44.70 C ATOM 1049 O TYR A 369 43.419 173.771 -11.839 1.00 41.02 O ATOM 1050 CB TYR A 369 44.272 171.380 -10.116 1.00 32.54 C ATOM 1051 CG TYR A 369 45.398 170.835 -10.972 1.00 41.40 C ATOM 1052 CD1 TYR A 369 46.571 170.337 -10.393 1.00 36.80 C ATOM 1053 CD2 TYR A 369 45.260 170.764 -12.367 1.00 40.97 C ATOM 1054 CE1 TYR A 369 47.585 169.810 -11.177 1.00 45.17 C ATOM 1055 CE2 TYR A 369 46.291 170.212 -13.178 1.00 41.17 C ATOM 1056 CZ TYR A 369 47.436 169.709 -12.608 1.00 43.70 C ATOM 1057 OH TYR A 369 48.530 169.270 -13.434 1.00 43.34 O ATOM 1058 HH TYR A 369 49.265 168.941 -12.858 1.00 0.00 H ATOM 1059 H TYR A 369 42.379 172.843 -9.428 1.00 0.00 H ATOM 1060 N ASN A 370 45.731 173.781 -11.660 1.00 46.35 N ATOM 1061 CA ASN A 370 45.966 174.578 -12.900 1.00 44.37 C ATOM 1062 C ASN A 370 46.895 173.801 -13.818 1.00 50.24 C ATOM 1063 O ASN A 370 48.108 173.713 -13.580 1.00 50.31 O ATOM 1064 CB ASN A 370 46.567 175.939 -12.553 1.00 48.46 C ATOM 1065 CG ASN A 370 46.798 176.834 -13.774 1.00 49.29 C ATOM 1066 OD1 ASN A 370 47.484 177.803 -13.664 1.00 49.07 O ATOM 1067 ND2 ASN A 370 46.146 176.565 -14.888 1.00 56.77 N ATOM 1068 HD22 ASN A 370 45.556 175.711 -14.952 1.00 0.00 H ATOM 1069 HD21 ASN A 370 46.222 177.207 -15.703 1.00 0.00 H ATOM 1070 H ASN A 370 46.553 173.419 -11.136 1.00 0.00 H ATOM 1071 N ALA A 371 46.284 173.170 -14.838 1.00 47.49 N ATOM 1072 CA ALA A 371 46.938 172.448 -15.824 1.00 50.34 C ATOM 1073 C ALA A 371 47.984 173.282 -16.556 1.00 50.45 C ATOM 1074 O ALA A 371 48.812 172.644 -17.207 1.00 50.42 O ATOM 1075 CB ALA A 371 45.914 171.888 -16.858 1.00 48.51 C ATOM 1076 H ALA A 371 45.247 173.228 -14.890 1.00 0.00 H ATOM 1077 N ASP A 372 47.949 174.632 -16.492 1.00 50.10 N ATOM 1078 CA ASP A 372 48.850 175.455 -17.350 1.00 54.44 C ATOM 1079 C ASP A 372 50.235 175.055 -16.940 1.00 59.08 C ATOM 1080 O ASP A 372 51.049 174.731 -17.738 1.00 54.98 O ATOM 1081 CB ASP A 372 48.625 176.996 -17.243 1.00 57.31 C ATOM 1082 CG ASP A 372 47.287 177.520 -18.014 1.00 60.67 C ATOM 1083 OD1 ASP A 372 46.942 177.040 -19.151 1.00 63.87 O ATOM 1084 OD2 ASP A 372 46.561 178.375 -17.467 1.00 55.27 O ATOM 1085 H ASP A 372 47.289 175.100 -15.839 1.00 0.00 H ATOM 1086 N ASN A 373 50.468 175.040 -15.628 1.00 70.53 N ATOM 1087 CA ASN A 373 51.835 175.026 -15.059 1.00 58.87 C ATOM 1088 C ASN A 373 52.068 173.943 -13.950 1.00 57.71 C ATOM 1089 O ASN A 373 52.942 174.111 -13.161 1.00 60.78 O ATOM 1090 CB ASN A 373 52.153 176.426 -14.579 1.00 50.02 C ATOM 1091 CG ASN A 373 51.229 176.881 -13.564 1.00 55.73 C ATOM 1092 OD1 ASN A 373 50.265 176.155 -13.241 1.00 59.82 O ATOM 1093 ND2 ASN A 373 51.475 178.062 -13.018 1.00 50.59 N ATOM 1094 HD22 ASN A 373 52.295 178.619 -13.331 1.00 0.00 H ATOM 1095 HD21 ASN A 373 50.848 178.433 -12.276 1.00 0.00 H ATOM 1096 H ASN A 373 49.657 175.038 -14.977 1.00 0.00 H ATOM 1097 N ARG A 374 51.299 172.846 -13.978 1.00 52.40 N ATOM 1098 CA ARG A 374 51.189 171.845 -12.922 1.00 47.43 C ATOM 1099 C ARG A 374 51.169 172.293 -11.443 1.00 39.79 C ATOM 1100 O ARG A 374 51.933 171.852 -10.612 1.00 44.62 O ATOM 1101 CB ARG A 374 52.134 170.712 -13.211 1.00 57.70 C ATOM 1102 CG ARG A 374 52.027 170.287 -14.707 1.00 66.43 C ATOM 1103 CD ARG A 374 52.615 168.915 -14.962 1.00 76.92 C ATOM 1104 NE ARG A 374 51.716 167.787 -14.610 1.00 84.27 N ATOM 1105 CZ ARG A 374 51.696 167.080 -13.469 1.00 81.72 C ATOM 1106 NH1 ARG A 374 50.815 166.075 -13.333 1.00 77.42 N ATOM 1107 NH2 ARG A 374 52.517 167.353 -12.467 1.00 83.21 N ATOM 1108 HE ARG A 374 51.020 167.512 -15.332 1.00 0.00 H ATOM 1109 HH12 ARG A 374 50.790 165.520 -12.454 1.00 0.00 H ATOM 1110 HH11 ARG A 374 50.158 165.852 -14.107 1.00 0.00 H ATOM 1111 HH22 ARG A 374 52.479 166.788 -11.595 1.00 0.00 H ATOM 1112 HH21 ARG A 374 53.200 168.132 -12.552 1.00 0.00 H ATOM 1113 H ARG A 374 50.727 172.694 -14.833 1.00 0.00 H ATOM 1114 N THR A 375 50.289 173.179 -11.118 1.00 34.28 N ATOM 1115 CA THR A 375 50.201 173.784 -9.786 1.00 36.80 C ATOM 1116 C THR A 375 48.792 173.696 -9.209 1.00 34.34 C ATOM 1117 O THR A 375 47.782 173.563 -9.916 1.00 34.39 O ATOM 1118 CB THR A 375 50.575 175.211 -9.804 1.00 34.28 C ATOM 1119 OG1 THR A 375 49.651 175.896 -10.633 1.00 36.71 O ATOM 1120 CG2 THR A 375 51.928 175.286 -10.345 1.00 36.05 C ATOM 1121 HG1 THR A 375 49.689 175.521 -11.548 1.00 0.00 H ATOM 1122 H THR A 375 49.605 173.480 -11.841 1.00 0.00 H ATOM 1123 N VAL A 376 48.728 173.837 -7.896 1.00 34.75 N ATOM 1124 CA VAL A 376 47.525 173.712 -7.121 1.00 31.78 C ATOM 1125 C VAL A 376 47.551 174.839 -6.211 1.00 28.91 C ATOM 1126 O VAL A 376 48.587 175.186 -5.784 1.00 32.03 O ATOM 1127 CB VAL A 376 47.444 172.355 -6.292 1.00 34.44 C ATOM 1128 CG1 VAL A 376 48.276 172.439 -4.994 1.00 36.03 C ATOM 1129 CG2 VAL A 376 46.021 172.069 -5.753 1.00 40.32 C ATOM 1130 H VAL A 376 49.610 174.053 -7.389 1.00 0.00 H ATOM 1131 N PHE A 377 46.371 175.296 -5.781 1.00 31.29 N ATOM 1132 CA PHE A 377 46.257 176.323 -4.791 1.00 34.76 C ATOM 1133 C PHE A 377 46.404 175.756 -3.401 1.00 33.08 C ATOM 1134 O PHE A 377 45.792 174.759 -3.068 1.00 30.53 O ATOM 1135 CB PHE A 377 44.794 176.931 -4.918 1.00 32.12 C ATOM 1136 CG PHE A 377 44.552 178.117 -4.073 1.00 32.30 C ATOM 1137 CD1 PHE A 377 44.831 179.381 -4.541 1.00 32.20 C ATOM 1138 CD2 PHE A 377 43.939 177.974 -2.789 1.00 36.50 C ATOM 1139 CE1 PHE A 377 44.558 180.533 -3.769 1.00 33.64 C ATOM 1140 CE2 PHE A 377 43.649 179.123 -1.990 1.00 33.78 C ATOM 1141 CZ PHE A 377 44.039 180.410 -2.481 1.00 34.73 C ATOM 1142 H PHE A 377 45.502 174.889 -6.182 1.00 0.00 H ATOM 1143 N PHE A 378 47.123 176.471 -2.514 1.00 31.23 N ATOM 1144 CA PHE A 378 47.253 175.973 -1.128 1.00 28.01 C ATOM 1145 C PHE A 378 47.696 177.196 -0.312 1.00 33.71 C ATOM 1146 O PHE A 378 48.729 177.821 -0.644 1.00 35.27 O ATOM 1147 CB PHE A 378 48.343 174.956 -1.123 1.00 30.76 C ATOM 1148 CG PHE A 378 48.714 174.466 0.189 1.00 26.84 C ATOM 1149 CD1 PHE A 378 48.021 173.354 0.683 1.00 27.61 C ATOM 1150 CD2 PHE A 378 49.761 174.937 0.821 1.00 28.02 C ATOM 1151 CE1 PHE A 378 48.355 172.804 1.893 1.00 27.84 C ATOM 1152 CE2 PHE A 378 50.131 174.422 2.124 1.00 30.64 C ATOM 1153 CZ PHE A 378 49.399 173.340 2.638 1.00 28.20 C ATOM 1154 H PHE A 378 47.580 177.360 -2.800 1.00 0.00 H ATOM 1155 N GLU A 379 46.963 177.541 0.716 1.00 31.58 N ATOM 1156 CA GLU A 379 47.321 178.588 1.591 1.00 39.21 C ATOM 1157 C GLU A 379 47.665 179.897 0.822 1.00 43.15 C ATOM 1158 O GLU A 379 48.741 180.411 0.924 1.00 40.78 O ATOM 1159 CB GLU A 379 48.483 178.147 2.429 1.00 38.49 C ATOM 1160 CG GLU A 379 47.949 177.047 3.421 1.00 38.69 C ATOM 1161 CD GLU A 379 48.925 176.630 4.451 1.00 36.78 C ATOM 1162 OE1 GLU A 379 50.102 177.051 4.392 1.00 36.02 O ATOM 1163 OE2 GLU A 379 48.530 175.878 5.323 1.00 38.46 O ATOM 1164 H GLU A 379 46.080 177.022 0.895 1.00 0.00 H ATOM 1165 N GLY A 380 46.758 180.344 -0.049 1.00 40.07 N ATOM 1166 CA GLY A 380 46.796 181.717 -0.455 1.00 37.54 C ATOM 1167 C GLY A 380 47.530 181.765 -1.727 1.00 41.87 C ATOM 1168 O GLY A 380 47.385 182.769 -2.407 1.00 47.87 O ATOM 1169 H GLY A 380 46.032 179.703 -0.428 1.00 0.00 H ATOM 1170 N LYS A 381 48.270 180.719 -2.157 1.00 38.37 N ATOM 1171 CA LYS A 381 48.872 180.765 -3.454 1.00 36.14 C ATOM 1172 C LYS A 381 48.930 179.501 -4.160 1.00 31.51 C ATOM 1173 O LYS A 381 48.455 178.607 -3.589 1.00 37.62 O ATOM 1174 CB LYS A 381 50.257 181.452 -3.365 1.00 39.93 C ATOM 1175 CG LYS A 381 50.223 182.849 -2.678 1.00 44.56 C ATOM 1176 CD LYS A 381 51.588 183.645 -2.652 1.00 53.28 C ATOM 1177 CE LYS A 381 51.638 184.519 -1.342 1.00 54.58 C ATOM 1178 NZ LYS A 381 52.642 185.602 -1.390 1.00 59.19 N ATOM 1179 HZ1 LYS A 381 53.588 185.191 -1.525 1.00 0.00 H ATOM 1180 HZ2 LYS A 381 52.424 186.241 -2.181 1.00 0.00 H ATOM 1181 HZ3 LYS A 381 52.619 186.134 -0.497 1.00 0.00 H ATOM 1182 H LYS A 381 48.401 179.886 -1.549 1.00 0.00 H ATOM 1183 N TYR A 382 49.425 179.445 -5.415 1.00 30.10 N ATOM 1184 CA TYR A 382 49.557 178.303 -6.278 1.00 33.04 C ATOM 1185 C TYR A 382 51.014 177.706 -6.328 1.00 39.82 C ATOM 1186 O TYR A 382 51.986 178.436 -6.403 1.00 40.48 O ATOM 1187 CB TYR A 382 49.211 178.662 -7.705 1.00 36.48 C ATOM 1188 CG TYR A 382 47.658 178.550 -7.993 1.00 43.74 C ATOM 1189 CD1 TYR A 382 47.085 177.346 -8.394 1.00 44.95 C ATOM 1190 CD2 TYR A 382 46.799 179.665 -7.831 1.00 40.39 C ATOM 1191 CE1 TYR A 382 45.691 177.231 -8.640 1.00 43.54 C ATOM 1192 CE2 TYR A 382 45.473 179.563 -7.978 1.00 39.75 C ATOM 1193 CZ TYR A 382 44.899 178.330 -8.393 1.00 46.37 C ATOM 1194 OH TYR A 382 43.523 178.182 -8.619 1.00 46.69 O ATOM 1195 HH TYR A 382 43.238 178.807 -9.332 1.00 0.00 H ATOM 1196 H TYR A 382 49.755 180.349 -5.810 1.00 0.00 H ATOM 1197 N GLY A 383 51.158 176.371 -6.367 1.00 40.01 N ATOM 1198 CA GLY A 383 52.460 175.685 -5.959 1.00 35.27 C ATOM 1199 C GLY A 383 52.515 174.310 -6.617 1.00 34.75 C ATOM 1200 O GLY A 383 51.498 173.570 -6.670 1.00 33.85 O ATOM 1201 H GLY A 383 50.358 175.787 -6.685 1.00 0.00 H ATOM 1202 N GLY A 384 53.672 173.918 -7.108 1.00 30.33 N ATOM 1203 CA GLY A 384 53.848 172.589 -7.687 1.00 31.64 C ATOM 1204 C GLY A 384 53.945 171.555 -6.623 1.00 31.75 C ATOM 1205 O GLY A 384 53.965 171.960 -5.424 1.00 32.95 O ATOM 1206 H GLY A 384 54.481 174.571 -7.083 1.00 0.00 H ATOM 1207 N MET A 385 54.057 170.262 -7.022 1.00 31.57 N ATOM 1208 CA MET A 385 54.185 169.186 -6.103 1.00 36.20 C ATOM 1209 C MET A 385 55.371 169.274 -5.071 1.00 35.03 C ATOM 1210 O MET A 385 55.287 168.784 -3.966 1.00 31.97 O ATOM 1211 CB MET A 385 54.034 167.828 -6.711 1.00 37.93 C ATOM 1212 CG MET A 385 55.210 167.225 -7.538 1.00 48.05 C ATOM 1213 SD MET A 385 54.542 165.605 -8.122 1.00 49.22 S ATOM 1214 CE MET A 385 53.999 165.898 -9.799 1.00 56.53 C ATOM 1215 H MET A 385 54.049 170.051 -8.040 1.00 0.00 H ATOM 1216 N GLU A 386 56.396 170.032 -5.430 1.00 34.97 N ATOM 1217 CA GLU A 386 57.612 170.201 -4.633 1.00 31.66 C ATOM 1218 C GLU A 386 57.321 170.973 -3.381 1.00 34.50 C ATOM 1219 O GLU A 386 57.970 170.719 -2.340 1.00 36.50 O ATOM 1220 CB GLU A 386 58.727 170.886 -5.468 1.00 29.30 C ATOM 1221 CG GLU A 386 58.613 172.401 -5.582 1.00 28.62 C ATOM 1222 CD GLU A 386 57.898 172.890 -6.780 1.00 29.33 C ATOM 1223 OE1 GLU A 386 57.973 174.150 -6.919 1.00 29.67 O ATOM 1224 OE2 GLU A 386 57.348 172.037 -7.627 1.00 26.06 O ATOM 1225 H GLU A 386 56.333 170.539 -6.336 1.00 0.00 H ATOM 1226 N LEU A 387 56.333 171.830 -3.385 1.00 28.54 N ATOM 1227 CA LEU A 387 55.852 172.387 -2.120 1.00 32.36 C ATOM 1228 C LEU A 387 55.667 171.375 -0.937 1.00 31.64 C ATOM 1229 O LEU A 387 55.906 171.719 0.203 1.00 32.93 O ATOM 1230 CB LEU A 387 54.471 173.047 -2.347 1.00 37.12 C ATOM 1231 CG LEU A 387 54.043 174.329 -1.710 1.00 37.12 C ATOM 1232 CD1 LEU A 387 54.819 175.439 -2.345 1.00 37.71 C ATOM 1233 CD2 LEU A 387 52.583 174.591 -2.029 1.00 39.02 C ATOM 1234 H LEU A 387 55.891 172.114 -4.283 1.00 0.00 H ATOM 1235 N PHE A 388 55.187 170.158 -1.233 1.00 29.59 N ATOM 1236 CA PHE A 388 54.818 169.183 -0.270 1.00 28.69 C ATOM 1237 C PHE A 388 55.907 168.123 -0.025 1.00 25.16 C ATOM 1238 O PHE A 388 55.672 167.161 0.634 1.00 24.28 O ATOM 1239 CB PHE A 388 53.490 168.456 -0.799 1.00 31.07 C ATOM 1240 CG PHE A 388 52.320 169.398 -0.933 1.00 30.44 C ATOM 1241 CD1 PHE A 388 51.552 169.734 0.103 1.00 31.67 C ATOM 1242 CD2 PHE A 388 52.030 169.953 -2.122 1.00 34.12 C ATOM 1243 CE1 PHE A 388 50.558 170.697 -0.021 1.00 32.98 C ATOM 1244 CE2 PHE A 388 51.036 170.861 -2.261 1.00 31.00 C ATOM 1245 CZ PHE A 388 50.323 171.234 -1.200 1.00 31.92 C ATOM 1246 H PHE A 388 55.078 169.912 -2.238 1.00 0.00 H ATOM 1247 N ARG A 389 57.137 168.373 -0.378 1.00 27.94 N ATOM 1248 CA ARG A 389 58.325 167.454 -0.158 1.00 27.99 C ATOM 1249 C ARG A 389 58.593 167.061 1.282 1.00 30.56 C ATOM 1250 O ARG A 389 58.905 165.916 1.539 1.00 31.56 O ATOM 1251 CB ARG A 389 59.575 168.194 -0.625 1.00 33.00 C ATOM 1252 CG ARG A 389 60.823 167.377 -0.742 1.00 31.86 C ATOM 1253 CD ARG A 389 62.032 168.140 -0.216 1.00 32.48 C ATOM 1254 NE ARG A 389 62.641 168.800 -1.336 1.00 38.33 N ATOM 1255 CZ ARG A 389 63.573 169.767 -1.320 1.00 41.05 C ATOM 1256 NH1 ARG A 389 63.917 170.267 -2.500 1.00 39.50 N ATOM 1257 NH2 ARG A 389 64.057 170.296 -0.153 1.00 34.00 N ATOM 1258 HE ARG A 389 62.321 168.491 -2.276 1.00 0.00 H ATOM 1259 HH12 ARG A 389 64.633 171.019 -2.557 1.00 0.00 H ATOM 1260 HH11 ARG A 389 63.470 169.907 -3.367 1.00 0.00 H ATOM 1261 HH22 ARG A 389 64.779 171.044 -0.181 1.00 0.00 H ATOM 1262 HH21 ARG A 389 63.703 169.950 0.761 1.00 0.00 H ATOM 1263 H ARG A 389 57.320 169.281 -0.851 1.00 0.00 H ATOM 1264 N ALA A 390 58.364 167.892 2.314 1.00 28.99 N ATOM 1265 CA ALA A 390 58.651 167.297 3.640 1.00 27.73 C ATOM 1266 C ALA A 390 57.683 166.162 4.042 1.00 28.34 C ATOM 1267 O ALA A 390 57.892 165.424 5.024 1.00 27.29 O ATOM 1268 CB ALA A 390 58.603 168.382 4.640 1.00 28.91 C ATOM 1269 H ALA A 390 58.017 168.865 2.192 1.00 0.00 H ATOM 1270 N LEU A 391 56.635 165.928 3.281 1.00 31.54 N ATOM 1271 CA LEU A 391 55.650 164.916 3.653 1.00 27.73 C ATOM 1272 C LEU A 391 56.207 163.607 3.368 1.00 26.34 C ATOM 1273 O LEU A 391 55.779 162.589 3.970 1.00 24.99 O ATOM 1274 CB LEU A 391 54.329 165.136 2.943 1.00 30.62 C ATOM 1275 CG LEU A 391 53.354 166.152 3.622 1.00 32.71 C ATOM 1276 CD1 LEU A 391 52.020 166.295 2.784 1.00 32.74 C ATOM 1277 CD2 LEU A 391 52.948 165.713 5.057 1.00 35.42 C ATOM 1278 H LEU A 391 56.507 166.471 2.403 1.00 0.00 H ATOM 1279 N GLY A 392 57.209 163.545 2.484 1.00 23.92 N ATOM 1280 CA GLY A 392 57.768 162.276 2.130 1.00 25.95 C ATOM 1281 C GLY A 392 56.819 161.308 1.464 1.00 31.15 C ATOM 1282 O GLY A 392 56.967 160.089 1.660 1.00 30.42 O ATOM 1283 H GLY A 392 57.581 164.416 2.055 1.00 0.00 H ATOM 1284 N CYS A 393 55.852 161.869 0.637 1.00 30.98 N ATOM 1285 CA CYS A 393 54.825 161.123 -0.099 1.00 31.60 C ATOM 1286 C CYS A 393 54.758 161.493 -1.575 1.00 29.38 C ATOM 1287 O CYS A 393 53.690 161.760 -2.052 1.00 29.83 O ATOM 1288 CB CYS A 393 53.370 161.464 0.462 1.00 36.93 C ATOM 1289 SG CYS A 393 53.203 160.806 2.151 1.00 46.42 S ATOM 1290 H CYS A 393 55.857 162.904 0.531 1.00 0.00 H ATOM 1291 N SER A 394 55.865 161.561 -2.255 1.00 29.62 N ATOM 1292 CA SER A 394 56.029 161.953 -3.641 1.00 30.25 C ATOM 1293 C SER A 394 55.129 161.108 -4.575 1.00 35.05 C ATOM 1294 O SER A 394 54.546 161.668 -5.502 1.00 29.73 O ATOM 1295 CB SER A 394 57.457 161.580 -4.071 1.00 27.80 C ATOM 1296 OG SER A 394 58.222 162.575 -3.528 1.00 28.86 O ATOM 1297 HG SER A 394 59.173 162.419 -3.754 1.00 0.00 H ATOM 1298 H SER A 394 56.734 161.304 -1.745 1.00 0.00 H ATOM 1299 N GLU A 395 55.086 159.778 -4.343 1.00 34.26 N ATOM 1300 CA GLU A 395 54.290 158.880 -5.136 1.00 40.70 C ATOM 1301 C GLU A 395 52.772 159.272 -5.099 1.00 36.46 C ATOM 1302 O GLU A 395 52.142 159.517 -6.123 1.00 40.96 O ATOM 1303 CB GLU A 395 54.480 157.428 -4.658 1.00 40.87 C ATOM 1304 CG GLU A 395 54.334 156.435 -5.816 1.00 57.00 C ATOM 1305 CD GLU A 395 55.215 155.197 -5.628 1.00 70.69 C ATOM 1306 OE1 GLU A 395 55.742 155.026 -4.448 1.00 74.52 O ATOM 1307 OE2 GLU A 395 55.405 154.477 -6.665 1.00 67.03 O ATOM 1308 H GLU A 395 55.650 159.388 -3.561 1.00 0.00 H ATOM 1309 N LEU A 396 52.222 159.227 -3.906 1.00 34.29 N ATOM 1310 CA LEU A 396 50.854 159.644 -3.642 1.00 33.56 C ATOM 1311 C LEU A 396 50.566 161.068 -4.140 1.00 37.58 C ATOM 1312 O LEU A 396 49.586 161.313 -4.863 1.00 43.98 O ATOM 1313 CB LEU A 396 50.505 159.522 -2.199 1.00 31.92 C ATOM 1314 CG LEU A 396 49.045 160.002 -1.893 1.00 39.62 C ATOM 1315 CD1 LEU A 396 48.066 159.129 -2.718 1.00 43.74 C ATOM 1316 CD2 LEU A 396 48.676 159.974 -0.415 1.00 36.65 C ATOM 1317 H LEU A 396 52.794 158.876 -3.111 1.00 0.00 H ATOM 1318 N ILE A 397 51.438 161.999 -3.836 1.00 33.81 N ATOM 1319 CA ILE A 397 51.142 163.393 -4.269 1.00 37.38 C ATOM 1320 C ILE A 397 51.099 163.411 -5.743 1.00 30.24 C ATOM 1321 O ILE A 397 50.294 164.157 -6.359 1.00 30.35 O ATOM 1322 CB ILE A 397 52.251 164.404 -3.805 1.00 38.69 C ATOM 1323 CG1 ILE A 397 52.416 164.415 -2.324 1.00 42.22 C ATOM 1324 CG2 ILE A 397 51.931 165.806 -4.281 1.00 40.00 C ATOM 1325 CD1 ILE A 397 51.296 165.111 -1.615 1.00 47.69 C ATOM 1326 H ILE A 397 52.306 161.772 -3.311 1.00 0.00 H ATOM 1327 N SER A 398 52.072 162.786 -6.327 1.00 30.01 N ATOM 1328 CA SER A 398 52.206 162.739 -7.769 1.00 32.04 C ATOM 1329 C SER A 398 51.008 162.087 -8.421 1.00 30.25 C ATOM 1330 O SER A 398 50.505 162.656 -9.368 1.00 31.31 O ATOM 1331 CB SER A 398 53.450 162.039 -8.229 1.00 34.50 C ATOM 1332 OG SER A 398 53.388 162.098 -9.650 1.00 45.77 O ATOM 1333 HG SER A 398 52.569 161.639 -9.963 1.00 0.00 H ATOM 1334 H SER A 398 52.781 162.301 -5.741 1.00 0.00 H ATOM 1335 N SER A 399 50.536 160.963 -7.929 1.00 27.12 N ATOM 1336 CA SER A 399 49.285 160.415 -8.494 1.00 35.22 C ATOM 1337 C SER A 399 47.918 161.330 -8.246 1.00 38.03 C ATOM 1338 O SER A 399 46.953 161.317 -9.064 1.00 33.85 O ATOM 1339 CB SER A 399 49.019 159.077 -7.865 1.00 38.70 C ATOM 1340 OG SER A 399 50.311 158.471 -7.712 1.00 48.25 O ATOM 1341 HG SER A 399 50.875 159.041 -7.132 1.00 0.00 H ATOM 1342 H SER A 399 51.032 160.470 -7.159 1.00 0.00 H ATOM 1343 N ILE A 400 47.913 162.124 -7.151 1.00 33.90 N ATOM 1344 CA ILE A 400 46.906 163.192 -6.986 1.00 32.90 C ATOM 1345 C ILE A 400 46.992 164.299 -7.977 1.00 35.09 C ATOM 1346 O ILE A 400 46.002 164.740 -8.533 1.00 35.65 O ATOM 1347 CB ILE A 400 46.927 163.702 -5.596 1.00 30.56 C ATOM 1348 CG1 ILE A 400 46.470 162.527 -4.664 1.00 31.20 C ATOM 1349 CG2 ILE A 400 46.148 164.994 -5.455 1.00 29.85 C ATOM 1350 CD1 ILE A 400 46.606 162.918 -3.136 1.00 31.18 C ATOM 1351 H ILE A 400 48.631 161.980 -6.412 1.00 0.00 H ATOM 1352 N PHE A 401 48.172 164.816 -8.186 1.00 37.52 N ATOM 1353 CA PHE A 401 48.380 165.683 -9.355 1.00 36.77 C ATOM 1354 C PHE A 401 47.925 165.052 -10.693 1.00 41.11 C ATOM 1355 O PHE A 401 47.364 165.811 -11.555 1.00 47.05 O ATOM 1356 CB PHE A 401 49.898 166.146 -9.416 1.00 38.68 C ATOM 1357 CG PHE A 401 50.161 167.386 -8.594 1.00 35.05 C ATOM 1358 CD1 PHE A 401 49.821 167.435 -7.301 1.00 36.18 C ATOM 1359 CD2 PHE A 401 50.609 168.573 -9.200 1.00 41.56 C ATOM 1360 CE1 PHE A 401 50.019 168.567 -6.517 1.00 36.01 C ATOM 1361 CE2 PHE A 401 50.691 169.805 -8.454 1.00 36.98 C ATOM 1362 CZ PHE A 401 50.382 169.777 -7.092 1.00 38.25 C ATOM 1363 H PHE A 401 48.956 164.617 -7.533 1.00 0.00 H ATOM 1364 N ASP A 402 48.132 163.756 -10.946 1.00 42.84 N ATOM 1365 CA ASP A 402 47.739 163.181 -12.301 1.00 48.51 C ATOM 1366 C ASP A 402 46.226 163.017 -12.430 1.00 43.14 C ATOM 1367 O ASP A 402 45.669 163.231 -13.479 1.00 45.84 O ATOM 1368 CB ASP A 402 48.390 161.819 -12.582 1.00 48.59 C ATOM 1369 CG ASP A 402 49.904 161.902 -12.614 1.00 57.79 C ATOM 1370 OD1 ASP A 402 50.565 162.891 -13.174 1.00 58.86 O ATOM 1371 OD2 ASP A 402 50.465 160.936 -12.062 1.00 64.46 O ATOM 1372 H ASP A 402 48.559 163.144 -10.222 1.00 0.00 H ATOM 1373 N PHE A 403 45.578 162.604 -11.367 1.00 40.55 N ATOM 1374 CA PHE A 403 44.134 162.546 -11.350 1.00 39.44 C ATOM 1375 C PHE A 403 43.525 163.950 -11.504 1.00 41.16 C ATOM 1376 O PHE A 403 42.833 164.220 -12.462 1.00 38.90 O ATOM 1377 CB PHE A 403 43.696 161.888 -10.109 1.00 41.68 C ATOM 1378 CG PHE A 403 42.209 161.659 -9.963 1.00 40.74 C ATOM 1379 CD1 PHE A 403 41.407 162.617 -9.401 1.00 42.74 C ATOM 1380 CD2 PHE A 403 41.694 160.429 -10.193 1.00 40.71 C ATOM 1381 CE1 PHE A 403 40.089 162.391 -9.237 1.00 43.49 C ATOM 1382 CE2 PHE A 403 40.397 160.160 -9.989 1.00 45.60 C ATOM 1383 CZ PHE A 403 39.548 161.165 -9.593 1.00 48.01 C ATOM 1384 H PHE A 403 46.112 162.314 -10.523 1.00 0.00 H ATOM 1385 N SER A 404 43.885 164.886 -10.670 1.00 39.39 N ATOM 1386 CA SER A 404 43.540 166.253 -10.936 1.00 38.01 C ATOM 1387 C SER A 404 43.833 166.728 -12.348 1.00 42.12 C ATOM 1388 O SER A 404 43.068 167.524 -12.814 1.00 45.43 O ATOM 1389 CB SER A 404 44.192 167.267 -9.957 1.00 40.16 C ATOM 1390 OG SER A 404 43.671 167.187 -8.558 1.00 41.17 O ATOM 1391 HG SER A 404 44.132 167.860 -7.997 1.00 0.00 H ATOM 1392 H SER A 404 44.421 164.642 -9.813 1.00 0.00 H ATOM 1393 N HIS A 405 44.878 166.304 -13.025 1.00 44.19 N ATOM 1394 CA HIS A 405 45.217 166.832 -14.374 1.00 50.47 C ATOM 1395 C HIS A 405 44.272 166.321 -15.472 1.00 55.57 C ATOM 1396 O HIS A 405 43.685 167.078 -16.248 1.00 60.57 O ATOM 1397 CB HIS A 405 46.647 166.401 -14.744 1.00 53.06 C ATOM 1398 CG HIS A 405 47.278 167.150 -15.902 1.00 54.76 C ATOM 1399 ND1 HIS A 405 47.574 166.521 -17.109 1.00 55.04 N ATOM 1400 CD2 HIS A 405 47.767 168.421 -16.006 1.00 57.22 C ATOM 1401 CE1 HIS A 405 48.212 167.377 -17.897 1.00 58.55 C ATOM 1402 NE2 HIS A 405 48.326 168.546 -17.259 1.00 58.70 N ATOM 1403 H HIS A 405 45.488 165.575 -12.603 1.00 0.00 H ATOM 1404 N SER A 406 44.128 165.036 -15.531 1.00 54.77 N ATOM 1405 CA SER A 406 43.230 164.390 -16.505 1.00 58.91 C ATOM 1406 C SER A 406 41.708 164.633 -16.221 1.00 57.06 C ATOM 1407 O SER A 406 40.818 164.185 -16.936 1.00 62.85 O ATOM 1408 CB SER A 406 43.539 162.863 -16.537 1.00 51.25 C ATOM 1409 OG SER A 406 43.211 162.235 -15.344 1.00 51.86 O ATOM 1410 HG SER A 406 43.732 162.639 -14.606 1.00 0.00 H ATOM 1411 H SER A 406 44.664 164.439 -14.869 1.00 0.00 H ATOM 1412 N LEU A 407 41.429 165.269 -15.106 1.00 57.35 N ATOM 1413 CA LEU A 407 40.078 165.730 -14.769 1.00 52.72 C ATOM 1414 C LEU A 407 39.891 167.131 -15.238 1.00 44.12 C ATOM 1415 O LEU A 407 38.857 167.446 -15.777 1.00 50.47 O ATOM 1416 CB LEU A 407 39.873 165.589 -13.322 1.00 48.32 C ATOM 1417 CG LEU A 407 38.527 165.119 -12.819 1.00 49.68 C ATOM 1418 CD1 LEU A 407 38.146 163.805 -13.446 1.00 51.92 C ATOM 1419 CD2 LEU A 407 38.651 164.959 -11.298 1.00 43.85 C ATOM 1420 H LEU A 407 42.200 165.454 -14.433 1.00 0.00 H ATOM 1421 N SER A 408 40.942 167.952 -15.147 1.00 41.08 N ATOM 1422 CA SER A 408 40.964 169.339 -15.640 1.00 37.63 C ATOM 1423 C SER A 408 40.696 169.442 -17.136 1.00 40.22 C ATOM 1424 O SER A 408 40.290 170.432 -17.574 1.00 43.27 O ATOM 1425 CB SER A 408 42.297 170.035 -15.292 1.00 35.85 C ATOM 1426 OG SER A 408 42.381 170.136 -13.904 1.00 33.05 O ATOM 1427 HG SER A 408 42.354 169.230 -13.506 1.00 0.00 H ATOM 1428 H SER A 408 41.805 167.585 -14.696 1.00 0.00 H ATOM 1429 N ALA A 409 40.916 168.364 -17.873 1.00 48.92 N ATOM 1430 CA ALA A 409 40.720 168.283 -19.348 1.00 53.55 C ATOM 1431 C ALA A 409 39.243 168.195 -19.797 1.00 46.47 C ATOM 1432 O ALA A 409 38.877 168.586 -20.882 1.00 50.61 O ATOM 1433 CB ALA A 409 41.498 167.083 -19.895 1.00 51.25 C ATOM 1434 H ALA A 409 41.251 167.509 -17.385 1.00 0.00 H ATOM 1435 N LEU A 410 38.433 167.658 -18.940 1.00 43.26 N ATOM 1436 CA LEU A 410 37.009 167.676 -19.142 1.00 46.32 C ATOM 1437 C LEU A 410 36.374 169.047 -18.961 1.00 44.67 C ATOM 1438 O LEU A 410 35.229 169.153 -19.246 1.00 48.49 O ATOM 1439 CB LEU A 410 36.362 166.722 -18.110 1.00 48.90 C ATOM 1440 CG LEU A 410 36.398 165.217 -18.447 1.00 52.37 C ATOM 1441 CD1 LEU A 410 37.865 164.687 -18.739 1.00 53.89 C ATOM 1442 CD2 LEU A 410 35.694 164.469 -17.298 1.00 49.89 C ATOM 1443 H LEU A 410 38.821 167.204 -18.088 1.00 0.00 H ATOM 1444 N HIS A 411 37.063 170.045 -18.386 1.00 39.72 N ATOM 1445 CA HIS A 411 36.513 171.307 -18.115 1.00 46.67 C ATOM 1446 C HIS A 411 35.109 171.212 -17.471 1.00 46.66 C ATOM 1447 O HIS A 411 34.142 171.773 -17.891 1.00 47.06 O ATOM 1448 CB HIS A 411 36.458 172.167 -19.426 1.00 50.85 C ATOM 1449 CG HIS A 411 37.801 172.536 -19.940 1.00 54.35 C ATOM 1450 ND1 HIS A 411 38.334 171.976 -21.087 1.00 54.69 N ATOM 1451 CD2 HIS A 411 38.772 173.324 -19.410 1.00 57.08 C ATOM 1452 CE1 HIS A 411 39.568 172.432 -21.268 1.00 58.72 C ATOM 1453 NE2 HIS A 411 39.864 173.238 -20.257 1.00 57.50 N ATOM 1454 H HIS A 411 38.056 169.874 -18.128 1.00 0.00 H ATOM 1455 N PHE A 412 35.080 170.554 -16.371 1.00 45.33 N ATOM 1456 CA PHE A 412 33.986 170.295 -15.612 1.00 44.94 C ATOM 1457 C PHE A 412 33.338 171.543 -15.026 1.00 44.71 C ATOM 1458 O PHE A 412 33.895 172.251 -14.166 1.00 41.20 O ATOM 1459 CB PHE A 412 34.342 169.256 -14.494 1.00 55.36 C ATOM 1460 CG PHE A 412 33.829 167.850 -14.760 1.00 65.81 C ATOM 1461 CD1 PHE A 412 33.559 167.452 -16.061 1.00 68.87 C ATOM 1462 CD2 PHE A 412 33.672 166.925 -13.691 1.00 76.65 C ATOM 1463 CE1 PHE A 412 33.055 166.204 -16.319 1.00 90.57 C ATOM 1464 CE2 PHE A 412 33.177 165.648 -13.936 1.00 85.82 C ATOM 1465 CZ PHE A 412 32.853 165.308 -15.261 1.00 90.07 C ATOM 1466 H PHE A 412 35.987 170.181 -16.026 1.00 0.00 H ATOM 1467 N SER A 413 32.065 171.744 -15.404 1.00 32.47 N ATOM 1468 CA SER A 413 31.423 172.901 -14.913 1.00 27.62 C ATOM 1469 C SER A 413 31.143 172.683 -13.533 1.00 27.45 C ATOM 1470 O SER A 413 31.167 171.510 -13.030 1.00 26.50 O ATOM 1471 CB SER A 413 30.117 173.148 -15.758 1.00 26.49 C ATOM 1472 OG SER A 413 29.176 172.047 -15.564 1.00 27.32 O ATOM 1473 HG SER A 413 29.597 171.200 -15.856 1.00 0.00 H ATOM 1474 H SER A 413 31.574 171.076 -16.031 1.00 0.00 H ATOM 1475 N GLU A 414 30.732 173.738 -12.831 1.00 28.45 N ATOM 1476 CA GLU A 414 30.435 173.532 -11.357 1.00 31.69 C ATOM 1477 C GLU A 414 29.247 172.579 -11.126 1.00 28.52 C ATOM 1478 O GLU A 414 29.123 171.886 -10.124 1.00 28.43 O ATOM 1479 CB GLU A 414 30.191 174.894 -10.672 1.00 35.96 C ATOM 1480 CG GLU A 414 31.434 175.809 -10.676 1.00 37.07 C ATOM 1481 CD GLU A 414 32.399 175.238 -9.565 1.00 41.21 C ATOM 1482 OE1 GLU A 414 32.202 175.567 -8.391 1.00 31.45 O ATOM 1483 OE2 GLU A 414 33.290 174.375 -9.922 1.00 43.37 O ATOM 1484 H GLU A 414 30.619 174.670 -13.278 1.00 0.00 H ATOM 1485 N ASP A 415 28.293 172.622 -12.005 1.00 27.48 N ATOM 1486 CA ASP A 415 27.102 171.798 -11.897 1.00 26.87 C ATOM 1487 C ASP A 415 27.307 170.305 -12.158 1.00 22.38 C ATOM 1488 O ASP A 415 26.638 169.502 -11.593 1.00 26.21 O ATOM 1489 CB ASP A 415 26.139 172.337 -12.855 1.00 33.04 C ATOM 1490 CG ASP A 415 25.530 173.771 -12.402 1.00 40.79 C ATOM 1491 OD1 ASP A 415 25.534 174.099 -11.168 1.00 37.84 O ATOM 1492 OD2 ASP A 415 25.010 174.477 -13.338 1.00 43.71 O ATOM 1493 H ASP A 415 28.385 173.269 -12.814 1.00 0.00 H ATOM 1494 N GLU A 416 28.194 169.982 -13.027 1.00 25.65 N ATOM 1495 CA GLU A 416 28.632 168.622 -13.364 1.00 28.37 C ATOM 1496 C GLU A 416 29.385 167.995 -12.177 1.00 29.82 C ATOM 1497 O GLU A 416 29.106 166.910 -11.773 1.00 28.83 O ATOM 1498 CB GLU A 416 29.484 168.590 -14.645 1.00 30.08 C ATOM 1499 CG GLU A 416 28.758 169.126 -15.878 1.00 30.00 C ATOM 1500 CD GLU A 416 29.656 169.353 -17.126 1.00 33.05 C ATOM 1501 OE1 GLU A 416 30.947 169.534 -17.012 1.00 36.01 O ATOM 1502 OE2 GLU A 416 29.062 169.439 -18.236 1.00 32.42 O ATOM 1503 H GLU A 416 28.648 170.762 -13.544 1.00 0.00 H ATOM 1504 N ILE A 417 30.285 168.713 -11.539 1.00 26.79 N ATOM 1505 CA ILE A 417 30.884 168.276 -10.330 1.00 24.64 C ATOM 1506 C ILE A 417 29.897 168.061 -9.278 1.00 23.93 C ATOM 1507 O ILE A 417 29.977 167.099 -8.452 1.00 23.83 O ATOM 1508 CB ILE A 417 31.842 169.372 -9.841 1.00 27.73 C ATOM 1509 CG1 ILE A 417 33.126 169.337 -10.687 1.00 31.41 C ATOM 1510 CG2 ILE A 417 32.333 169.101 -8.445 1.00 33.68 C ATOM 1511 CD1 ILE A 417 33.958 170.620 -10.622 1.00 37.29 C ATOM 1512 H ILE A 417 30.567 169.632 -11.935 1.00 0.00 H ATOM 1513 N ALA A 418 28.930 168.970 -9.139 1.00 20.73 N ATOM 1514 CA ALA A 418 27.975 168.754 -8.064 1.00 19.54 C ATOM 1515 C ALA A 418 27.252 167.587 -8.334 1.00 18.95 C ATOM 1516 O ALA A 418 27.065 166.788 -7.443 1.00 23.93 O ATOM 1517 CB ALA A 418 26.924 169.983 -7.979 1.00 22.73 C ATOM 1518 H ALA A 418 28.863 169.794 -9.770 1.00 0.00 H ATOM 1519 N LEU A 419 26.812 167.358 -9.559 1.00 19.56 N ATOM 1520 CA LEU A 419 26.036 166.130 -9.793 1.00 22.06 C ATOM 1521 C LEU A 419 26.917 164.845 -9.673 1.00 20.69 C ATOM 1522 O LEU A 419 26.522 163.867 -9.075 1.00 23.49 O ATOM 1523 CB LEU A 419 25.347 166.214 -11.220 1.00 24.73 C ATOM 1524 CG LEU A 419 24.250 167.312 -11.212 1.00 25.55 C ATOM 1525 CD1 LEU A 419 23.969 167.834 -12.617 1.00 24.66 C ATOM 1526 CD2 LEU A 419 22.974 166.840 -10.538 1.00 26.66 C ATOM 1527 H LEU A 419 27.008 168.025 -10.333 1.00 0.00 H ATOM 1528 N TYR A 420 28.123 164.847 -10.179 1.00 21.90 N ATOM 1529 CA TYR A 420 29.031 163.772 -10.093 1.00 21.60 C ATOM 1530 C TYR A 420 29.436 163.385 -8.649 1.00 20.74 C ATOM 1531 O TYR A 420 29.428 162.275 -8.346 1.00 20.48 O ATOM 1532 CB TYR A 420 30.227 164.046 -10.912 1.00 26.09 C ATOM 1533 CG TYR A 420 31.265 162.880 -10.909 1.00 27.82 C ATOM 1534 CD1 TYR A 420 31.032 161.688 -11.526 1.00 30.56 C ATOM 1535 CD2 TYR A 420 32.440 163.050 -10.246 1.00 33.11 C ATOM 1536 CE1 TYR A 420 32.003 160.602 -11.481 1.00 32.04 C ATOM 1537 CE2 TYR A 420 33.445 162.031 -10.257 1.00 39.36 C ATOM 1538 CZ TYR A 420 33.174 160.810 -10.857 1.00 36.75 C ATOM 1539 OH TYR A 420 34.234 159.937 -10.771 1.00 49.36 O ATOM 1540 HH TYR A 420 33.994 159.084 -11.211 1.00 0.00 H ATOM 1541 H TYR A 420 28.435 165.703 -10.681 1.00 0.00 H ATOM 1542 N THR A 421 29.716 164.349 -7.791 1.00 19.19 N ATOM 1543 CA THR A 421 30.002 164.079 -6.420 1.00 19.29 C ATOM 1544 C THR A 421 28.796 163.651 -5.626 1.00 20.33 C ATOM 1545 O THR A 421 28.879 162.902 -4.640 1.00 19.43 O ATOM 1546 CB THR A 421 30.655 165.334 -5.681 1.00 18.98 C ATOM 1547 OG1 THR A 421 29.931 166.593 -5.946 1.00 17.52 O ATOM 1548 CG2 THR A 421 31.936 165.504 -6.199 1.00 17.34 C ATOM 1549 HG1 THR A 421 29.937 166.777 -6.919 1.00 0.00 H ATOM 1550 H THR A 421 29.728 165.334 -8.125 1.00 0.00 H ATOM 1551 N ALA A 422 27.619 164.149 -5.976 1.00 21.83 N ATOM 1552 CA ALA A 422 26.386 163.559 -5.376 1.00 19.52 C ATOM 1553 C ALA A 422 26.324 162.070 -5.666 1.00 20.59 C ATOM 1554 O ALA A 422 26.040 161.266 -4.835 1.00 21.53 O ATOM 1555 CB ALA A 422 25.231 164.252 -5.976 1.00 20.80 C ATOM 1556 H ALA A 422 27.556 164.935 -6.655 1.00 0.00 H ATOM 1557 N LEU A 423 26.754 161.655 -6.833 1.00 24.12 N ATOM 1558 CA LEU A 423 26.799 160.209 -7.148 1.00 25.44 C ATOM 1559 C LEU A 423 27.952 159.410 -6.567 1.00 26.58 C ATOM 1560 O LEU A 423 27.814 158.286 -6.198 1.00 26.81 O ATOM 1561 CB LEU A 423 26.749 159.978 -8.642 1.00 27.91 C ATOM 1562 CG LEU A 423 25.308 160.256 -9.264 1.00 27.86 C ATOM 1563 CD1 LEU A 423 25.467 160.372 -10.751 1.00 31.02 C ATOM 1564 CD2 LEU A 423 24.356 159.113 -9.009 1.00 28.25 C ATOM 1565 H LEU A 423 27.066 162.347 -7.543 1.00 0.00 H ATOM 1566 N VAL A 424 29.083 160.087 -6.272 1.00 28.84 N ATOM 1567 CA VAL A 424 30.143 159.525 -5.536 1.00 26.29 C ATOM 1568 C VAL A 424 29.586 159.110 -4.109 1.00 27.00 C ATOM 1569 O VAL A 424 29.812 157.963 -3.590 1.00 26.47 O ATOM 1570 CB VAL A 424 31.318 160.531 -5.521 1.00 29.03 C ATOM 1571 CG1 VAL A 424 32.387 160.130 -4.436 1.00 30.79 C ATOM 1572 CG2 VAL A 424 32.035 160.596 -6.841 1.00 26.82 C ATOM 1573 H VAL A 424 29.175 161.068 -6.604 1.00 0.00 H ATOM 1574 N LEU A 425 28.913 160.013 -3.455 1.00 26.40 N ATOM 1575 CA LEU A 425 28.421 159.763 -2.118 1.00 25.39 C ATOM 1576 C LEU A 425 27.274 158.783 -2.148 1.00 24.00 C ATOM 1577 O LEU A 425 27.214 157.931 -1.309 1.00 24.66 O ATOM 1578 CB LEU A 425 27.976 161.051 -1.408 1.00 25.34 C ATOM 1579 CG LEU A 425 29.003 162.024 -0.971 1.00 28.88 C ATOM 1580 CD1 LEU A 425 28.459 163.358 -0.468 1.00 29.41 C ATOM 1581 CD2 LEU A 425 29.838 161.255 0.077 1.00 30.04 C ATOM 1582 H LEU A 425 28.726 160.933 -3.903 1.00 0.00 H ATOM 1583 N ILE A 426 26.301 159.018 -3.000 1.00 28.09 N ATOM 1584 CA ILE A 426 25.030 158.188 -2.969 1.00 28.71 C ATOM 1585 C ILE A 426 25.159 156.947 -3.876 1.00 29.23 C ATOM 1586 O ILE A 426 24.836 156.994 -5.020 1.00 30.05 O ATOM 1587 CB ILE A 426 23.833 159.038 -3.376 1.00 28.37 C ATOM 1588 CG1 ILE A 426 23.852 160.327 -2.611 1.00 29.62 C ATOM 1589 CG2 ILE A 426 22.579 158.229 -3.049 1.00 30.97 C ATOM 1590 CD1 ILE A 426 23.464 160.090 -1.136 1.00 29.60 C ATOM 1591 H ILE A 426 26.403 159.779 -3.701 1.00 0.00 H ATOM 1592 N ASN A 427 25.619 155.834 -3.272 1.00 30.55 N ATOM 1593 CA ASN A 427 26.032 154.649 -3.920 1.00 29.56 C ATOM 1594 C ASN A 427 25.568 153.395 -3.020 1.00 33.30 C ATOM 1595 O ASN A 427 26.055 153.189 -1.959 1.00 32.01 O ATOM 1596 CB ASN A 427 27.560 154.679 -4.096 1.00 30.13 C ATOM 1597 CG ASN A 427 28.121 153.393 -4.856 1.00 30.22 C ATOM 1598 OD1 ASN A 427 27.541 152.252 -4.799 1.00 31.21 O ATOM 1599 ND2 ASN A 427 29.319 153.488 -5.281 1.00 30.05 N ATOM 1600 HD22 ASN A 427 29.783 154.418 -5.324 1.00 0.00 H ATOM 1601 HD21 ASN A 427 29.832 152.636 -5.584 1.00 0.00 H ATOM 1602 H ASN A 427 25.675 155.849 -2.234 1.00 0.00 H ATOM 1603 N ALA A 428 24.682 152.551 -3.554 1.00 36.32 N ATOM 1604 CA ALA A 428 24.019 151.548 -2.810 1.00 38.05 C ATOM 1605 C ALA A 428 24.838 150.297 -2.736 1.00 40.91 C ATOM 1606 O ALA A 428 24.358 149.307 -2.185 1.00 52.72 O ATOM 1607 CB ALA A 428 22.631 151.311 -3.330 1.00 34.58 C ATOM 1608 H ALA A 428 24.469 152.636 -4.568 1.00 0.00 H ATOM 1609 N HIS A 429 26.000 150.308 -3.307 1.00 43.38 N ATOM 1610 CA HIS A 429 26.946 149.159 -3.311 1.00 54.38 C ATOM 1611 C HIS A 429 28.050 149.323 -2.209 1.00 49.77 C ATOM 1612 O HIS A 429 28.910 148.482 -2.092 1.00 57.91 O ATOM 1613 CB HIS A 429 27.678 148.972 -4.755 1.00 56.85 C ATOM 1614 CG HIS A 429 26.750 148.616 -5.892 1.00 70.15 C ATOM 1615 ND1 HIS A 429 26.163 147.362 -6.024 1.00 77.86 N ATOM 1616 CD2 HIS A 429 26.277 149.359 -6.930 1.00 72.70 C ATOM 1617 CE1 HIS A 429 25.422 147.334 -7.113 1.00 70.41 C ATOM 1618 NE2 HIS A 429 25.466 148.536 -7.675 1.00 73.41 N ATOM 1619 H HIS A 429 26.292 151.178 -3.796 1.00 0.00 H ATOM 1620 N ARG A 430 28.052 150.435 -1.469 1.00 45.27 N ATOM 1621 CA ARG A 430 28.910 150.552 -0.274 1.00 44.47 C ATOM 1622 C ARG A 430 28.618 149.315 0.726 1.00 46.29 C ATOM 1623 O ARG A 430 27.471 149.192 1.234 1.00 46.01 O ATOM 1624 CB ARG A 430 28.673 151.867 0.421 1.00 34.13 C ATOM 1625 CG ARG A 430 28.977 153.182 -0.378 1.00 31.29 C ATOM 1626 CD ARG A 430 30.404 153.098 -0.983 1.00 29.71 C ATOM 1627 NE ARG A 430 30.763 154.318 -1.540 1.00 27.52 N ATOM 1628 CZ ARG A 430 31.857 154.701 -2.069 1.00 25.91 C ATOM 1629 NH1 ARG A 430 32.804 153.870 -2.369 1.00 32.03 N ATOM 1630 NH2 ARG A 430 31.976 156.004 -2.402 1.00 24.34 N ATOM 1631 HE ARG A 430 30.014 155.039 -1.523 1.00 0.00 H ATOM 1632 HH12 ARG A 430 33.684 154.218 -2.800 1.00 0.00 H ATOM 1633 HH11 ARG A 430 32.684 152.855 -2.179 1.00 0.00 H ATOM 1634 HH22 ARG A 430 32.855 156.352 -2.836 1.00 0.00 H ATOM 1635 HH21 ARG A 430 31.189 156.660 -2.225 1.00 0.00 H ATOM 1636 H ARG A 430 27.439 151.231 -1.739 1.00 0.00 H ATOM 1637 N PRO A 431 29.629 148.499 1.026 1.00 44.87 N ATOM 1638 CA PRO A 431 29.417 147.429 2.060 1.00 49.03 C ATOM 1639 C PRO A 431 29.080 148.031 3.451 1.00 47.59 C ATOM 1640 O PRO A 431 29.659 149.025 3.872 1.00 49.78 O ATOM 1641 CB PRO A 431 30.749 146.688 2.107 1.00 45.79 C ATOM 1642 CG PRO A 431 31.747 147.837 1.751 1.00 51.21 C ATOM 1643 CD PRO A 431 31.047 148.643 0.647 1.00 48.35 C ATOM 1644 N GLY A 432 28.043 147.488 4.075 1.00 44.31 N ATOM 1645 CA GLY A 432 27.686 147.952 5.415 1.00 46.56 C ATOM 1646 C GLY A 432 26.245 148.441 5.481 1.00 50.41 C ATOM 1647 O GLY A 432 25.694 148.608 6.589 1.00 43.48 O ATOM 1648 H GLY A 432 27.488 146.738 3.615 1.00 0.00 H ATOM 1649 N LEU A 433 25.609 148.671 4.301 1.00 49.52 N ATOM 1650 CA LEU A 433 24.290 149.373 4.257 1.00 51.55 C ATOM 1651 C LEU A 433 23.265 148.433 4.683 1.00 52.93 C ATOM 1652 O LEU A 433 23.438 147.262 4.496 1.00 50.69 O ATOM 1653 CB LEU A 433 23.886 149.939 2.839 1.00 50.94 C ATOM 1654 CG LEU A 433 24.820 151.090 2.286 1.00 48.27 C ATOM 1655 CD1 LEU A 433 24.581 151.293 0.808 1.00 46.66 C ATOM 1656 CD2 LEU A 433 24.548 152.390 3.062 1.00 49.47 C ATOM 1657 H LEU A 433 26.048 148.353 3.414 1.00 0.00 H ATOM 1658 N GLN A 434 22.227 148.971 5.291 1.00 50.66 N ATOM 1659 CA GLN A 434 21.284 148.155 5.952 1.00 60.25 C ATOM 1660 C GLN A 434 19.900 148.352 5.376 1.00 62.81 C ATOM 1661 O GLN A 434 19.171 147.392 5.284 1.00 70.12 O ATOM 1662 CB GLN A 434 21.300 148.504 7.460 1.00 68.22 C ATOM 1663 CG GLN A 434 22.429 147.775 8.245 1.00 73.39 C ATOM 1664 CD GLN A 434 22.596 148.238 9.724 1.00 84.39 C ATOM 1665 OE1 GLN A 434 21.651 148.800 10.411 1.00 76.41 O ATOM 1666 NE2 GLN A 434 23.817 148.002 10.232 1.00 75.90 N ATOM 1667 HE22 GLN A 434 24.546 147.548 9.645 1.00 0.00 H ATOM 1668 HE21 GLN A 434 24.034 148.273 11.212 1.00 0.00 H ATOM 1669 H GLN A 434 22.102 150.003 5.284 1.00 0.00 H ATOM 1670 N GLU A 435 19.535 149.586 5.016 1.00 55.06 N ATOM 1671 CA GLU A 435 18.435 149.835 4.101 1.00 55.00 C ATOM 1672 C GLU A 435 18.936 150.085 2.644 1.00 54.64 C ATOM 1673 O GLU A 435 18.714 151.175 2.067 1.00 54.19 O ATOM 1674 CB GLU A 435 17.665 151.084 4.531 1.00 56.11 C ATOM 1675 CG GLU A 435 17.502 151.383 6.033 1.00 66.75 C ATOM 1676 CD GLU A 435 16.996 152.864 6.251 1.00 75.91 C ATOM 1677 OE1 GLU A 435 17.821 153.899 6.001 1.00 68.55 O ATOM 1678 OE2 GLU A 435 15.749 152.977 6.625 1.00 69.78 O ATOM 1679 H GLU A 435 20.057 150.397 5.405 1.00 0.00 H ATOM 1680 N LYS A 436 19.629 149.131 2.056 1.00 48.72 N ATOM 1681 CA LYS A 436 20.129 149.271 0.656 1.00 50.92 C ATOM 1682 C LYS A 436 19.100 149.882 -0.351 1.00 48.12 C ATOM 1683 O LYS A 436 19.432 150.786 -1.167 1.00 42.30 O ATOM 1684 CB LYS A 436 20.607 147.886 0.162 1.00 54.34 C ATOM 1685 CG LYS A 436 20.900 147.776 -1.325 1.00 60.37 C ATOM 1686 CD LYS A 436 21.610 146.478 -1.691 1.00 66.09 C ATOM 1687 CE LYS A 436 22.466 146.622 -2.980 1.00 67.52 C ATOM 1688 NZ LYS A 436 22.637 145.297 -3.608 1.00 65.33 N ATOM 1689 HZ1 LYS A 436 23.117 144.658 -2.942 1.00 0.00 H ATOM 1690 HZ2 LYS A 436 21.704 144.908 -3.852 1.00 0.00 H ATOM 1691 HZ3 LYS A 436 23.210 145.395 -4.470 1.00 0.00 H ATOM 1692 H LYS A 436 19.833 148.257 2.581 1.00 0.00 H ATOM 1693 N ARG A 437 17.881 149.406 -0.283 1.00 42.30 N ATOM 1694 CA ARG A 437 16.833 149.818 -1.254 1.00 48.77 C ATOM 1695 C ARG A 437 16.453 151.279 -1.158 1.00 48.20 C ATOM 1696 O ARG A 437 15.914 151.848 -2.122 1.00 43.85 O ATOM 1697 CB ARG A 437 15.517 148.951 -1.183 1.00 46.99 C ATOM 1698 CG ARG A 437 15.699 147.545 -1.824 1.00 59.60 C ATOM 1699 CD ARG A 437 14.426 146.662 -1.835 1.00 68.21 C ATOM 1700 NE ARG A 437 14.384 145.798 -0.610 1.00 74.38 N ATOM 1701 CZ ARG A 437 13.604 145.940 0.488 1.00 76.19 C ATOM 1702 NH1 ARG A 437 12.686 146.919 0.603 1.00 69.86 N ATOM 1703 NH2 ARG A 437 13.754 145.063 1.508 1.00 78.23 N ATOM 1704 HE ARG A 437 15.036 144.988 -0.603 1.00 0.00 H ATOM 1705 HH12 ARG A 437 12.108 146.991 1.465 1.00 0.00 H ATOM 1706 HH11 ARG A 437 12.555 147.603 -0.170 1.00 0.00 H ATOM 1707 HH22 ARG A 437 13.166 145.152 2.361 1.00 0.00 H ATOM 1708 HH21 ARG A 437 14.457 144.300 1.438 1.00 0.00 H ATOM 1709 H ARG A 437 17.641 148.726 0.466 1.00 0.00 H ATOM 1710 N LYS A 438 16.618 151.883 0.001 1.00 48.48 N ATOM 1711 CA LYS A 438 16.301 153.283 0.035 1.00 49.03 C ATOM 1712 C LYS A 438 17.456 154.178 -0.539 1.00 44.05 C ATOM 1713 O LYS A 438 17.247 155.361 -0.915 1.00 42.82 O ATOM 1714 CB LYS A 438 15.837 153.699 1.421 1.00 56.71 C ATOM 1715 CG LYS A 438 14.884 154.940 1.380 1.00 65.42 C ATOM 1716 CD LYS A 438 14.411 155.333 2.782 1.00 72.15 C ATOM 1717 CE LYS A 438 13.801 154.153 3.571 1.00 76.71 C ATOM 1718 NZ LYS A 438 12.634 154.604 4.395 1.00 80.32 N ATOM 1719 HZ1 LYS A 438 12.948 155.330 5.070 1.00 0.00 H ATOM 1720 HZ2 LYS A 438 11.903 155.002 3.771 1.00 0.00 H ATOM 1721 HZ3 LYS A 438 12.243 153.792 4.914 1.00 0.00 H ATOM 1722 H LYS A 438 16.958 151.375 0.843 1.00 0.00 H ATOM 1723 N VAL A 439 18.670 153.657 -0.532 1.00 39.00 N ATOM 1724 CA VAL A 439 19.851 154.291 -1.124 1.00 34.67 C ATOM 1725 C VAL A 439 19.764 154.187 -2.642 1.00 31.69 C ATOM 1726 O VAL A 439 20.025 155.114 -3.325 1.00 29.54 O ATOM 1727 CB VAL A 439 21.141 153.638 -0.590 1.00 31.87 C ATOM 1728 CG1 VAL A 439 22.307 154.372 -1.180 1.00 35.69 C ATOM 1729 CG2 VAL A 439 21.285 153.948 0.929 1.00 38.62 C ATOM 1730 H VAL A 439 18.796 152.732 -0.074 1.00 0.00 H ATOM 1731 N GLU A 440 19.411 152.995 -3.122 1.00 35.74 N ATOM 1732 CA GLU A 440 19.197 152.650 -4.533 1.00 32.77 C ATOM 1733 C GLU A 440 18.340 153.597 -5.101 1.00 30.35 C ATOM 1734 O GLU A 440 18.727 154.188 -6.130 1.00 27.70 O ATOM 1735 CB GLU A 440 18.656 151.218 -4.710 1.00 33.66 C ATOM 1736 CG GLU A 440 19.747 150.181 -4.663 1.00 36.60 C ATOM 1737 CD GLU A 440 19.252 148.674 -4.766 1.00 50.14 C ATOM 1738 OE1 GLU A 440 18.129 148.303 -4.316 1.00 48.05 O ATOM 1739 OE2 GLU A 440 20.021 147.825 -5.285 1.00 53.95 O ATOM 1740 H GLU A 440 19.273 152.233 -2.428 1.00 0.00 H ATOM 1741 N GLN A 441 17.279 153.947 -4.368 1.00 30.90 N ATOM 1742 CA GLN A 441 16.236 154.830 -4.923 1.00 34.47 C ATOM 1743 C GLN A 441 16.640 156.297 -4.984 1.00 34.13 C ATOM 1744 O GLN A 441 16.306 157.004 -5.953 1.00 38.49 O ATOM 1745 CB GLN A 441 14.914 154.657 -4.161 1.00 39.81 C ATOM 1746 CG GLN A 441 13.716 154.962 -4.998 1.00 52.58 C ATOM 1747 CD GLN A 441 12.344 154.637 -4.310 1.00 64.59 C ATOM 1748 OE1 GLN A 441 12.263 153.968 -3.273 1.00 58.78 O ATOM 1749 NE2 GLN A 441 11.265 155.112 -4.952 1.00 62.96 N ATOM 1750 HE22 GLN A 441 11.381 155.670 -5.822 1.00 0.00 H ATOM 1751 HE21 GLN A 441 10.313 154.922 -4.580 1.00 0.00 H ATOM 1752 H GLN A 441 17.188 153.593 -3.395 1.00 0.00 H ATOM 1753 N LEU A 442 17.455 156.751 -4.037 1.00 29.81 N ATOM 1754 CA LEU A 442 18.130 158.035 -4.181 1.00 29.29 C ATOM 1755 C LEU A 442 19.182 157.954 -5.354 1.00 25.08 C ATOM 1756 O LEU A 442 19.269 158.874 -6.117 1.00 22.87 O ATOM 1757 CB LEU A 442 18.797 158.435 -2.889 1.00 31.97 C ATOM 1758 CG LEU A 442 17.815 158.565 -1.679 1.00 37.86 C ATOM 1759 CD1 LEU A 442 18.668 159.112 -0.457 1.00 38.24 C ATOM 1760 CD2 LEU A 442 16.575 159.457 -1.889 1.00 32.97 C ATOM 1761 H LEU A 442 17.613 156.182 -3.181 1.00 0.00 H ATOM 1762 N GLN A 443 19.921 156.861 -5.439 1.00 21.48 N ATOM 1763 CA GLN A 443 20.970 156.802 -6.451 1.00 24.68 C ATOM 1764 C GLN A 443 20.454 156.876 -7.898 1.00 23.65 C ATOM 1765 O GLN A 443 20.842 157.735 -8.632 1.00 21.20 O ATOM 1766 CB GLN A 443 21.731 155.508 -6.313 1.00 26.34 C ATOM 1767 CG GLN A 443 22.960 155.445 -7.247 1.00 25.69 C ATOM 1768 CD GLN A 443 23.537 154.052 -7.217 1.00 30.99 C ATOM 1769 OE1 GLN A 443 23.784 153.460 -6.135 1.00 29.34 O ATOM 1770 NE2 GLN A 443 23.809 153.505 -8.427 1.00 32.96 N ATOM 1771 HE22 GLN A 443 23.588 154.031 -9.297 1.00 0.00 H ATOM 1772 HE21 GLN A 443 24.239 152.560 -8.486 1.00 0.00 H ATOM 1773 H GLN A 443 19.758 156.059 -4.797 1.00 0.00 H ATOM 1774 N TYR A 444 19.427 156.053 -8.184 1.00 26.24 N ATOM 1775 CA TYR A 444 18.641 156.082 -9.389 1.00 24.85 C ATOM 1776 C TYR A 444 18.128 157.391 -9.789 1.00 26.43 C ATOM 1777 O TYR A 444 18.242 157.744 -11.018 1.00 27.12 O ATOM 1778 CB TYR A 444 17.525 154.967 -9.439 1.00 23.79 C ATOM 1779 CG TYR A 444 18.057 153.520 -9.001 1.00 26.50 C ATOM 1780 CD1 TYR A 444 19.369 153.101 -9.328 1.00 25.01 C ATOM 1781 CD2 TYR A 444 17.181 152.571 -8.479 1.00 25.77 C ATOM 1782 CE1 TYR A 444 19.783 151.782 -9.052 1.00 27.88 C ATOM 1783 CE2 TYR A 444 17.615 151.246 -8.196 1.00 25.47 C ATOM 1784 CZ TYR A 444 18.911 150.901 -8.478 1.00 30.13 C ATOM 1785 OH TYR A 444 19.472 149.555 -8.220 1.00 37.32 O ATOM 1786 HH TYR A 444 19.408 149.352 -7.253 1.00 0.00 H ATOM 1787 H TYR A 444 19.181 155.335 -7.473 1.00 0.00 H ATOM 1788 N ASN A 445 17.486 158.111 -8.904 1.00 26.15 N ATOM 1789 CA ASN A 445 16.996 159.439 -9.267 1.00 26.10 C ATOM 1790 C ASN A 445 18.115 160.395 -9.572 1.00 25.64 C ATOM 1791 O ASN A 445 17.983 161.209 -10.537 1.00 26.52 O ATOM 1792 CB ASN A 445 16.241 160.057 -8.197 1.00 29.68 C ATOM 1793 CG ASN A 445 14.853 159.519 -8.077 1.00 37.83 C ATOM 1794 OD1 ASN A 445 14.254 159.012 -9.064 1.00 42.63 O ATOM 1795 ND2 ASN A 445 14.300 159.647 -6.872 1.00 38.64 N ATOM 1796 HD22 ASN A 445 14.842 160.074 -6.094 1.00 0.00 H ATOM 1797 HD21 ASN A 445 13.326 159.320 -6.709 1.00 0.00 H ATOM 1798 H ASN A 445 17.325 157.739 -7.946 1.00 0.00 H ATOM 1799 N LEU A 446 19.183 160.352 -8.786 1.00 23.84 N ATOM 1800 CA LEU A 446 20.390 161.182 -9.060 1.00 26.30 C ATOM 1801 C LEU A 446 21.064 160.816 -10.380 1.00 24.87 C ATOM 1802 O LEU A 446 21.684 161.704 -10.961 1.00 25.86 O ATOM 1803 CB LEU A 446 21.481 161.100 -7.918 1.00 24.95 C ATOM 1804 CG LEU A 446 21.100 161.937 -6.651 1.00 26.97 C ATOM 1805 CD1 LEU A 446 21.849 161.479 -5.383 1.00 27.44 C ATOM 1806 CD2 LEU A 446 21.332 163.383 -6.865 1.00 26.61 C ATOM 1807 H LEU A 446 19.178 159.723 -7.958 1.00 0.00 H ATOM 1808 N GLU A 447 21.053 159.547 -10.768 1.00 24.17 N ATOM 1809 CA GLU A 447 21.711 159.128 -12.061 1.00 24.80 C ATOM 1810 C GLU A 447 20.899 159.759 -13.219 1.00 25.18 C ATOM 1811 O GLU A 447 21.475 160.423 -14.090 1.00 24.66 O ATOM 1812 CB GLU A 447 21.625 157.615 -12.149 1.00 25.41 C ATOM 1813 CG GLU A 447 22.762 156.939 -11.455 1.00 28.15 C ATOM 1814 CD GLU A 447 22.601 155.446 -11.194 1.00 28.65 C ATOM 1815 OE1 GLU A 447 21.573 154.818 -11.442 1.00 37.52 O ATOM 1816 OE2 GLU A 447 23.524 154.888 -10.698 1.00 32.89 O ATOM 1817 H GLU A 447 20.586 158.832 -10.174 1.00 0.00 H ATOM 1818 N LEU A 448 19.583 159.605 -13.206 1.00 23.20 N ATOM 1819 CA LEU A 448 18.722 160.190 -14.161 1.00 24.45 C ATOM 1820 C LEU A 448 18.874 161.655 -14.259 1.00 25.08 C ATOM 1821 O LEU A 448 18.873 162.270 -15.357 1.00 28.41 O ATOM 1822 CB LEU A 448 17.304 159.804 -13.782 1.00 31.32 C ATOM 1823 CG LEU A 448 16.140 160.548 -14.482 1.00 36.97 C ATOM 1824 CD1 LEU A 448 16.094 160.101 -15.911 1.00 37.69 C ATOM 1825 CD2 LEU A 448 14.865 160.136 -13.729 1.00 40.11 C ATOM 1826 H LEU A 448 19.162 159.023 -12.454 1.00 0.00 H ATOM 1827 N ALA A 449 18.901 162.353 -13.113 1.00 26.04 N ATOM 1828 CA ALA A 449 19.152 163.713 -13.117 1.00 24.36 C ATOM 1829 C ALA A 449 20.445 164.136 -13.800 1.00 23.58 C ATOM 1830 O ALA A 449 20.504 165.113 -14.525 1.00 21.76 O ATOM 1831 CB ALA A 449 19.172 164.121 -11.662 1.00 27.52 C ATOM 1832 H ALA A 449 18.731 161.865 -12.210 1.00 0.00 H ATOM 1833 N PHE A 450 21.531 163.448 -13.522 1.00 22.42 N ATOM 1834 CA PHE A 450 22.798 163.785 -14.189 1.00 21.72 C ATOM 1835 C PHE A 450 22.679 163.576 -15.715 1.00 23.49 C ATOM 1836 O PHE A 450 23.094 164.446 -16.613 1.00 23.37 O ATOM 1837 CB PHE A 450 23.849 162.841 -13.586 1.00 22.06 C ATOM 1838 CG PHE A 450 25.276 163.163 -13.926 1.00 21.15 C ATOM 1839 CD1 PHE A 450 25.707 164.426 -14.083 1.00 25.41 C ATOM 1840 CD2 PHE A 450 26.147 162.145 -14.178 1.00 25.23 C ATOM 1841 CE1 PHE A 450 27.061 164.742 -14.318 1.00 26.56 C ATOM 1842 CE2 PHE A 450 27.482 162.420 -14.477 1.00 25.74 C ATOM 1843 CZ PHE A 450 27.942 163.677 -14.542 1.00 24.35 C ATOM 1844 H PHE A 450 21.494 162.669 -12.834 1.00 0.00 H ATOM 1845 N HIS A 451 22.085 162.464 -16.074 1.00 23.49 N ATOM 1846 CA HIS A 451 21.956 162.158 -17.491 1.00 24.97 C ATOM 1847 C HIS A 451 21.178 163.216 -18.092 1.00 25.24 C ATOM 1848 O HIS A 451 21.552 163.697 -19.187 1.00 22.43 O ATOM 1849 CB HIS A 451 21.288 160.758 -17.689 1.00 26.99 C ATOM 1850 CG HIS A 451 22.302 159.659 -17.760 1.00 29.09 C ATOM 1851 ND1 HIS A 451 23.077 159.298 -16.665 1.00 33.02 N ATOM 1852 CD2 HIS A 451 22.699 158.876 -18.781 1.00 30.93 C ATOM 1853 CE1 HIS A 451 23.945 158.357 -17.003 1.00 34.16 C ATOM 1854 NE2 HIS A 451 23.732 158.079 -18.280 1.00 37.09 N ATOM 1855 H HIS A 451 21.711 161.810 -15.357 1.00 0.00 H ATOM 1856 N HIS A 452 20.013 163.587 -17.418 1.00 24.88 N ATOM 1857 CA HIS A 452 19.106 164.514 -18.046 1.00 23.80 C ATOM 1858 C HIS A 452 19.766 165.852 -18.177 1.00 26.63 C ATOM 1859 O HIS A 452 19.741 166.476 -19.231 1.00 27.92 O ATOM 1860 CB HIS A 452 17.907 164.572 -17.243 1.00 28.12 C ATOM 1861 CG HIS A 452 16.850 165.468 -17.757 1.00 29.51 C ATOM 1862 ND1 HIS A 452 16.215 165.242 -18.922 1.00 34.30 N ATOM 1863 CD2 HIS A 452 16.309 166.588 -17.245 1.00 34.73 C ATOM 1864 CE1 HIS A 452 15.381 166.230 -19.154 1.00 37.90 C ATOM 1865 NE2 HIS A 452 15.404 167.038 -18.128 1.00 35.56 N ATOM 1866 H HIS A 452 19.803 163.200 -16.476 1.00 0.00 H ATOM 1867 N HIS A 453 20.420 166.365 -17.097 1.00 27.69 N ATOM 1868 CA HIS A 453 21.214 167.605 -17.252 1.00 25.05 C ATOM 1869 C HIS A 453 22.295 167.597 -18.288 1.00 26.80 C ATOM 1870 O HIS A 453 22.481 168.662 -18.988 1.00 27.11 O ATOM 1871 CB HIS A 453 21.831 168.035 -15.928 1.00 26.82 C ATOM 1872 CG HIS A 453 22.100 169.497 -15.890 1.00 29.40 C ATOM 1873 ND1 HIS A 453 23.395 170.025 -15.756 1.00 34.06 N ATOM 1874 CD2 HIS A 453 21.274 170.553 -16.095 1.00 31.55 C ATOM 1875 CE1 HIS A 453 23.318 171.338 -15.818 1.00 35.57 C ATOM 1876 NE2 HIS A 453 22.041 171.681 -15.951 1.00 35.87 N ATOM 1877 H HIS A 453 20.362 165.890 -16.173 1.00 0.00 H ATOM 1878 N LEU A 454 23.068 166.498 -18.423 1.00 23.60 N ATOM 1879 CA LEU A 454 23.880 166.399 -19.632 1.00 23.94 C ATOM 1880 C LEU A 454 23.215 166.531 -20.946 1.00 25.78 C ATOM 1881 O LEU A 454 23.766 167.191 -21.904 1.00 28.31 O ATOM 1882 CB LEU A 454 24.771 165.128 -19.578 1.00 25.39 C ATOM 1883 CG LEU A 454 25.687 165.145 -18.367 1.00 25.71 C ATOM 1884 CD1 LEU A 454 26.217 163.750 -18.223 1.00 28.83 C ATOM 1885 CD2 LEU A 454 26.718 166.174 -18.402 1.00 25.13 C ATOM 1886 H LEU A 454 23.084 165.754 -17.697 1.00 0.00 H ATOM 1887 N CYS A 455 22.001 166.006 -21.091 1.00 26.17 N ATOM 1888 CA CYS A 455 21.278 166.197 -22.290 1.00 29.58 C ATOM 1889 C CYS A 455 20.790 167.603 -22.454 1.00 31.83 C ATOM 1890 O CYS A 455 20.837 168.163 -23.540 1.00 32.01 O ATOM 1891 CB CYS A 455 20.103 165.176 -22.457 1.00 30.12 C ATOM 1892 SG CYS A 455 20.662 163.435 -22.465 1.00 37.05 S ATOM 1893 H CYS A 455 21.582 165.452 -20.317 1.00 0.00 H ATOM 1894 N LYS A 456 20.227 168.208 -21.454 1.00 36.06 N ATOM 1895 CA LYS A 456 19.922 169.676 -21.559 1.00 33.20 C ATOM 1896 C LYS A 456 21.083 170.613 -21.926 1.00 30.37 C ATOM 1897 O LYS A 456 20.905 171.675 -22.543 1.00 33.96 O ATOM 1898 CB LYS A 456 19.342 170.149 -20.247 1.00 35.26 C ATOM 1899 CG LYS A 456 17.952 169.816 -20.018 1.00 44.41 C ATOM 1900 CD LYS A 456 17.500 170.534 -18.721 1.00 57.28 C ATOM 1901 CE LYS A 456 16.080 171.050 -18.730 1.00 60.90 C ATOM 1902 NZ LYS A 456 15.938 171.894 -17.532 1.00 69.84 N ATOM 1903 HZ1 LYS A 456 16.122 171.322 -16.683 1.00 0.00 H ATOM 1904 HZ2 LYS A 456 16.620 172.678 -17.579 1.00 0.00 H ATOM 1905 HZ3 LYS A 456 14.972 172.276 -17.491 1.00 0.00 H ATOM 1906 H LYS A 456 19.989 167.683 -20.589 1.00 0.00 H ATOM 1907 N THR A 457 22.323 170.222 -21.637 1.00 30.78 N ATOM 1908 CA THR A 457 23.497 171.119 -21.813 1.00 26.12 C ATOM 1909 C THR A 457 24.369 170.609 -22.989 1.00 26.70 C ATOM 1910 O THR A 457 25.492 171.198 -23.227 1.00 23.80 O ATOM 1911 CB THR A 457 24.348 171.138 -20.539 1.00 26.13 C ATOM 1912 OG1 THR A 457 24.502 169.816 -19.995 1.00 24.51 O ATOM 1913 CG2 THR A 457 23.776 171.937 -19.461 1.00 30.31 C ATOM 1914 HG1 THR A 457 23.611 169.445 -19.774 1.00 0.00 H ATOM 1915 H THR A 457 22.476 169.258 -21.277 1.00 0.00 H ATOM 1916 N HIS A 458 23.992 169.545 -23.666 1.00 27.16 N ATOM 1917 CA HIS A 458 24.727 168.988 -24.834 1.00 29.03 C ATOM 1918 C HIS A 458 26.078 168.446 -24.439 1.00 29.61 C ATOM 1919 O HIS A 458 27.089 168.702 -25.116 1.00 33.39 O ATOM 1920 CB HIS A 458 24.869 170.056 -25.992 1.00 34.79 C ATOM 1921 CG HIS A 458 23.516 170.579 -26.453 1.00 38.87 C ATOM 1922 ND1 HIS A 458 22.572 169.779 -27.046 1.00 44.21 N ATOM 1923 CD2 HIS A 458 22.902 171.739 -26.222 1.00 41.98 C ATOM 1924 CE1 HIS A 458 21.440 170.439 -27.174 1.00 44.20 C ATOM 1925 NE2 HIS A 458 21.622 171.640 -26.699 1.00 37.90 N ATOM 1926 H HIS A 458 23.122 169.061 -23.364 1.00 0.00 H ATOM 1927 N ARG A 459 26.155 167.845 -23.275 1.00 27.68 N ATOM 1928 CA ARG A 459 27.406 167.510 -22.643 1.00 27.27 C ATOM 1929 C ARG A 459 27.501 166.056 -22.378 1.00 26.32 C ATOM 1930 O ARG A 459 28.271 165.672 -21.569 1.00 28.52 O ATOM 1931 CB ARG A 459 27.610 168.344 -21.348 1.00 30.33 C ATOM 1932 CG ARG A 459 28.079 169.769 -21.716 1.00 32.11 C ATOM 1933 CD ARG A 459 29.544 169.752 -21.967 1.00 31.68 C ATOM 1934 NE ARG A 459 30.309 169.710 -20.677 1.00 35.70 N ATOM 1935 CZ ARG A 459 31.625 169.758 -20.586 1.00 35.75 C ATOM 1936 NH1 ARG A 459 32.335 169.720 -21.707 1.00 34.16 N ATOM 1937 NH2 ARG A 459 32.223 169.760 -19.343 1.00 35.43 N ATOM 1938 HE ARG A 459 29.765 169.638 -19.794 1.00 0.00 H ATOM 1939 HH12 ARG A 459 33.374 169.756 -21.666 1.00 0.00 H ATOM 1940 HH11 ARG A 459 31.853 169.654 -22.626 1.00 0.00 H ATOM 1941 HH22 ARG A 459 33.259 169.798 -19.265 1.00 0.00 H ATOM 1942 HH21 ARG A 459 31.638 169.724 -18.484 1.00 0.00 H ATOM 1943 H ARG A 459 25.271 167.599 -22.785 1.00 0.00 H ATOM 1944 N GLN A 460 26.723 165.237 -23.080 1.00 29.66 N ATOM 1945 CA GLN A 460 26.703 163.801 -22.990 1.00 31.83 C ATOM 1946 C GLN A 460 28.050 163.136 -23.226 1.00 28.02 C ATOM 1947 O GLN A 460 28.363 162.120 -22.683 1.00 28.18 O ATOM 1948 CB GLN A 460 25.671 163.193 -24.001 1.00 33.92 C ATOM 1949 CG GLN A 460 24.215 163.723 -23.798 1.00 33.99 C ATOM 1950 CD GLN A 460 23.924 164.852 -24.897 1.00 34.73 C ATOM 1951 OE1 GLN A 460 24.771 165.657 -25.188 1.00 34.49 O ATOM 1952 NE2 GLN A 460 22.831 164.800 -25.529 1.00 30.56 N ATOM 1953 HE22 GLN A 460 22.110 164.098 -25.264 1.00 0.00 H ATOM 1954 HE21 GLN A 460 22.652 165.459 -26.314 1.00 0.00 H ATOM 1955 H GLN A 460 26.067 165.676 -23.758 1.00 0.00 H ATOM 1956 N SER A 461 28.910 163.838 -23.899 1.00 27.31 N ATOM 1957 CA SER A 461 30.226 163.370 -24.212 1.00 30.41 C ATOM 1958 C SER A 461 31.017 163.080 -22.960 1.00 32.95 C ATOM 1959 O SER A 461 31.858 162.113 -22.926 1.00 32.90 O ATOM 1960 CB SER A 461 31.030 164.323 -25.172 1.00 27.53 C ATOM 1961 OG SER A 461 31.182 165.649 -24.559 1.00 32.14 O ATOM 1962 HG SER A 461 31.689 166.239 -25.172 1.00 0.00 H ATOM 1963 H SER A 461 28.630 164.785 -24.226 1.00 0.00 H ATOM 1964 N ILE A 462 30.759 163.869 -21.900 1.00 32.66 N ATOM 1965 CA ILE A 462 31.589 163.700 -20.712 1.00 30.33 C ATOM 1966 C ILE A 462 31.370 162.334 -20.013 1.00 26.91 C ATOM 1967 O ILE A 462 32.237 161.964 -19.290 1.00 32.01 O ATOM 1968 CB ILE A 462 31.440 164.860 -19.748 1.00 34.41 C ATOM 1969 CG1 ILE A 462 30.124 164.814 -18.989 1.00 31.92 C ATOM 1970 CG2 ILE A 462 31.736 166.204 -20.437 1.00 37.11 C ATOM 1971 CD1 ILE A 462 30.232 165.662 -17.763 1.00 36.59 C ATOM 1972 H ILE A 462 29.995 164.574 -21.927 1.00 0.00 H ATOM 1973 N LEU A 463 30.284 161.666 -20.182 1.00 28.16 N ATOM 1974 CA LEU A 463 30.030 160.372 -19.512 1.00 34.01 C ATOM 1975 C LEU A 463 31.162 159.344 -19.800 1.00 34.99 C ATOM 1976 O LEU A 463 31.756 158.896 -18.900 1.00 46.77 O ATOM 1977 CB LEU A 463 28.707 159.798 -19.830 1.00 32.69 C ATOM 1978 CG LEU A 463 27.555 160.426 -19.092 1.00 38.95 C ATOM 1979 CD1 LEU A 463 26.145 160.020 -19.663 1.00 43.16 C ATOM 1980 CD2 LEU A 463 27.550 160.057 -17.622 1.00 41.62 C ATOM 1981 H LEU A 463 29.555 162.051 -20.816 1.00 0.00 H ATOM 1982 N ALA A 464 31.596 159.183 -21.008 1.00 33.99 N ATOM 1983 CA ALA A 464 32.740 158.317 -21.370 1.00 36.18 C ATOM 1984 C ALA A 464 34.185 158.867 -20.861 1.00 41.32 C ATOM 1985 O ALA A 464 35.143 158.129 -20.821 1.00 38.59 O ATOM 1986 CB ALA A 464 32.745 158.185 -22.921 1.00 31.61 C ATOM 1987 H ALA A 464 31.111 159.694 -21.773 1.00 0.00 H ATOM 1988 N LYS A 465 34.307 160.142 -20.420 1.00 43.57 N ATOM 1989 CA LYS A 465 35.634 160.686 -19.933 1.00 41.36 C ATOM 1990 C LYS A 465 35.890 160.659 -18.421 1.00 39.90 C ATOM 1991 O LYS A 465 36.931 161.066 -17.961 1.00 45.04 O ATOM 1992 CB LYS A 465 35.809 162.090 -20.437 1.00 41.21 C ATOM 1993 CG LYS A 465 35.916 162.144 -21.993 1.00 52.11 C ATOM 1994 CD LYS A 465 36.373 163.524 -22.488 1.00 56.83 C ATOM 1995 CE LYS A 465 35.634 163.991 -23.750 1.00 63.10 C ATOM 1996 NZ LYS A 465 35.351 165.498 -23.644 1.00 69.15 N ATOM 1997 HZ1 LYS A 465 34.762 165.681 -22.807 1.00 0.00 H ATOM 1998 HZ2 LYS A 465 36.250 166.013 -23.556 1.00 0.00 H ATOM 1999 HZ3 LYS A 465 34.850 165.816 -24.498 1.00 0.00 H ATOM 2000 H LYS A 465 33.471 160.761 -20.416 1.00 0.00 H ATOM 2001 N LEU A 466 34.906 160.311 -17.682 1.00 37.17 N ATOM 2002 CA LEU A 466 34.913 160.215 -16.300 1.00 41.07 C ATOM 2003 C LEU A 466 35.775 159.064 -15.788 1.00 41.12 C ATOM 2004 O LEU A 466 35.863 158.069 -16.429 1.00 51.48 O ATOM 2005 CB LEU A 466 33.510 159.968 -15.776 1.00 35.61 C ATOM 2006 CG LEU A 466 32.605 161.124 -16.002 1.00 36.31 C ATOM 2007 CD1 LEU A 466 31.191 160.831 -15.440 1.00 38.70 C ATOM 2008 CD2 LEU A 466 33.073 162.387 -15.328 1.00 38.39 C ATOM 2009 H LEU A 466 34.015 160.078 -18.165 1.00 0.00 H ATOM 2010 N PRO A 467 36.390 159.233 -14.610 1.00 45.83 N ATOM 2011 CA PRO A 467 37.209 158.191 -13.949 1.00 49.24 C ATOM 2012 C PRO A 467 36.737 156.756 -14.164 1.00 45.41 C ATOM 2013 O PRO A 467 35.687 156.420 -13.735 1.00 35.27 O ATOM 2014 CB PRO A 467 37.043 158.527 -12.450 1.00 42.35 C ATOM 2015 CG PRO A 467 36.983 160.049 -12.491 1.00 43.59 C ATOM 2016 CD PRO A 467 36.244 160.427 -13.738 1.00 42.77 C ATOM 2017 N PRO A 468 37.563 155.933 -14.845 1.00 57.11 N ATOM 2018 CA PRO A 468 37.272 154.468 -14.782 1.00 57.51 C ATOM 2019 C PRO A 468 36.798 154.032 -13.406 1.00 56.74 C ATOM 2020 O PRO A 468 37.301 154.589 -12.404 1.00 53.92 O ATOM 2021 CB PRO A 468 38.628 153.814 -15.128 1.00 54.89 C ATOM 2022 CG PRO A 468 39.278 154.811 -16.016 1.00 54.33 C ATOM 2023 CD PRO A 468 38.865 156.199 -15.537 1.00 52.60 C ATOM 2024 N LYS A 469 35.823 153.093 -13.424 1.00 65.20 N ATOM 2025 CA LYS A 469 35.213 152.436 -12.252 1.00 64.65 C ATOM 2026 C LYS A 469 36.376 151.994 -11.375 1.00 69.23 C ATOM 2027 O LYS A 469 37.244 151.272 -11.828 1.00 66.81 O ATOM 2028 CB LYS A 469 34.416 151.208 -12.695 1.00 62.98 C ATOM 2029 H LYS A 469 35.468 152.806 -14.358 1.00 0.00 H ATOM 2030 N GLY A 470 36.433 152.522 -10.147 1.00 69.08 N ATOM 2031 CA GLY A 470 37.494 152.183 -9.204 1.00 58.77 C ATOM 2032 C GLY A 470 38.772 153.005 -9.119 1.00 53.40 C ATOM 2033 O GLY A 470 39.494 152.789 -8.154 1.00 49.93 O ATOM 2034 H GLY A 470 35.697 153.196 -9.855 1.00 0.00 H ATOM 2035 N LYS A 471 39.052 153.921 -10.063 1.00 43.76 N ATOM 2036 CA LYS A 471 40.184 154.746 -10.004 1.00 45.42 C ATOM 2037 C LYS A 471 40.122 155.606 -8.782 1.00 47.55 C ATOM 2038 O LYS A 471 41.144 155.758 -8.013 1.00 41.23 O ATOM 2039 CB LYS A 471 40.438 155.613 -11.236 1.00 52.12 C ATOM 2040 CG LYS A 471 41.748 156.485 -11.167 1.00 53.65 C ATOM 2041 CD LYS A 471 42.432 156.789 -12.491 1.00 60.02 C ATOM 2042 CE LYS A 471 41.981 158.059 -13.161 1.00 65.46 C ATOM 2043 NZ LYS A 471 42.973 159.171 -13.107 1.00 69.34 N ATOM 2044 HZ1 LYS A 471 43.174 159.406 -12.114 1.00 0.00 H ATOM 2045 HZ2 LYS A 471 43.851 158.874 -13.579 1.00 0.00 H ATOM 2046 HZ3 LYS A 471 42.583 160.005 -13.590 1.00 0.00 H ATOM 2047 H LYS A 471 38.403 154.021 -10.869 1.00 0.00 H ATOM 2048 N LEU A 472 38.934 156.134 -8.554 1.00 42.30 N ATOM 2049 CA LEU A 472 38.739 156.972 -7.400 1.00 45.81 C ATOM 2050 C LEU A 472 38.852 156.180 -6.026 1.00 48.25 C ATOM 2051 O LEU A 472 39.531 156.634 -5.054 1.00 39.04 O ATOM 2052 CB LEU A 472 37.395 157.734 -7.550 1.00 47.81 C ATOM 2053 CG LEU A 472 36.894 158.526 -6.338 1.00 49.65 C ATOM 2054 CD1 LEU A 472 37.902 159.666 -6.020 1.00 52.84 C ATOM 2055 CD2 LEU A 472 35.525 159.043 -6.611 1.00 47.12 C ATOM 2056 H LEU A 472 38.144 155.946 -9.204 1.00 0.00 H ATOM 2057 N ARG A 473 38.094 155.058 -5.922 1.00 52.76 N ATOM 2058 CA ARG A 473 38.161 154.118 -4.758 1.00 52.42 C ATOM 2059 C ARG A 473 39.602 153.890 -4.325 1.00 48.04 C ATOM 2060 O ARG A 473 39.920 154.111 -3.163 1.00 45.28 O ATOM 2061 CB ARG A 473 37.530 152.718 -5.014 1.00 59.47 C ATOM 2062 CG ARG A 473 36.006 152.607 -4.786 1.00 65.60 C ATOM 2063 CD ARG A 473 35.178 153.297 -5.922 1.00 68.11 C ATOM 2064 NE ARG A 473 33.765 152.919 -5.908 1.00 68.31 N ATOM 2065 CZ ARG A 473 33.265 151.738 -6.315 1.00 78.60 C ATOM 2066 NH1 ARG A 473 34.057 150.766 -6.798 1.00 88.89 N ATOM 2067 NH2 ARG A 473 31.968 151.489 -6.231 1.00 71.91 N ATOM 2068 HE ARG A 473 33.088 153.624 -5.553 1.00 0.00 H ATOM 2069 HH12 ARG A 473 33.643 149.863 -7.105 1.00 0.00 H ATOM 2070 HH11 ARG A 473 35.084 150.917 -6.864 1.00 0.00 H ATOM 2071 HH22 ARG A 473 31.593 150.573 -6.549 1.00 0.00 H ATOM 2072 HH21 ARG A 473 31.324 152.210 -5.847 1.00 0.00 H ATOM 2073 H ARG A 473 37.431 154.840 -6.693 1.00 0.00 H ATOM 2074 N SER A 474 40.437 153.438 -5.252 1.00 47.55 N ATOM 2075 CA SER A 474 41.828 153.029 -5.001 1.00 51.53 C ATOM 2076 C SER A 474 42.769 154.198 -4.728 1.00 47.76 C ATOM 2077 O SER A 474 43.814 154.038 -4.152 1.00 47.52 O ATOM 2078 CB SER A 474 42.425 152.295 -6.225 1.00 51.49 C ATOM 2079 OG SER A 474 42.907 153.304 -7.201 1.00 62.17 O ATOM 2080 HG SER A 474 42.149 153.873 -7.488 1.00 0.00 H ATOM 2081 H SER A 474 40.082 153.368 -6.227 1.00 0.00 H ATOM 2082 N LEU A 475 42.473 155.335 -5.268 1.00 49.18 N ATOM 2083 CA LEU A 475 43.269 156.542 -4.905 1.00 48.12 C ATOM 2084 C LEU A 475 42.896 156.986 -3.474 1.00 45.69 C ATOM 2085 O LEU A 475 43.680 157.518 -2.773 1.00 41.31 O ATOM 2086 CB LEU A 475 43.136 157.622 -5.934 1.00 41.91 C ATOM 2087 CG LEU A 475 44.137 158.764 -5.828 1.00 51.27 C ATOM 2088 CD1 LEU A 475 45.556 158.260 -6.046 1.00 48.94 C ATOM 2089 CD2 LEU A 475 43.836 159.874 -6.839 1.00 50.68 C ATOM 2090 H LEU A 475 41.689 155.407 -5.947 1.00 0.00 H ATOM 2091 N CYS A 476 41.650 156.744 -3.089 1.00 48.17 N ATOM 2092 CA CYS A 476 41.216 156.949 -1.729 1.00 52.55 C ATOM 2093 C CYS A 476 41.677 155.901 -0.723 1.00 49.69 C ATOM 2094 O CYS A 476 41.954 156.232 0.417 1.00 46.85 O ATOM 2095 CB CYS A 476 39.709 157.060 -1.610 1.00 55.32 C ATOM 2096 SG CYS A 476 39.351 158.784 -1.428 1.00 77.89 S ATOM 2097 H CYS A 476 40.965 156.396 -3.790 1.00 0.00 H ATOM 2098 N SER A 477 41.733 154.638 -1.133 1.00 55.43 N ATOM 2099 CA SER A 477 42.366 153.541 -0.325 1.00 58.36 C ATOM 2100 C SER A 477 43.832 153.943 -0.013 1.00 56.21 C ATOM 2101 O SER A 477 44.290 153.830 1.137 1.00 52.48 O ATOM 2102 CB SER A 477 42.304 152.224 -1.079 1.00 53.49 C ATOM 2103 OG SER A 477 43.280 151.340 -0.609 1.00 53.99 O ATOM 2104 HG SER A 477 43.223 150.489 -1.112 1.00 0.00 H ATOM 2105 H SER A 477 41.319 154.398 -2.056 1.00 0.00 H ATOM 2106 N GLN A 478 44.497 154.509 -1.028 1.00 54.32 N ATOM 2107 CA GLN A 478 45.878 154.910 -0.900 1.00 58.85 C ATOM 2108 C GLN A 478 46.055 156.152 -0.037 1.00 58.90 C ATOM 2109 O GLN A 478 47.075 156.255 0.639 1.00 54.69 O ATOM 2110 CB GLN A 478 46.479 155.080 -2.260 1.00 65.77 C ATOM 2111 CG GLN A 478 48.006 155.028 -2.298 1.00 72.29 C ATOM 2112 CD GLN A 478 48.478 155.040 -3.714 1.00 69.02 C ATOM 2113 OE1 GLN A 478 47.772 154.504 -4.542 1.00 71.41 O ATOM 2114 NE2 GLN A 478 49.638 155.664 -4.006 1.00 65.95 N ATOM 2115 HE22 GLN A 478 50.197 156.104 -3.247 1.00 0.00 H ATOM 2116 HE21 GLN A 478 49.973 155.705 -4.990 1.00 0.00 H ATOM 2117 H GLN A 478 44.006 154.664 -1.932 1.00 0.00 H ATOM 2118 N HIS A 479 45.105 157.097 -0.118 1.00 59.76 N ATOM 2119 CA HIS A 479 45.171 158.425 0.571 1.00 62.03 C ATOM 2120 C HIS A 479 44.898 158.242 2.092 1.00 62.62 C ATOM 2121 O HIS A 479 45.717 158.687 2.945 1.00 45.57 O ATOM 2122 CB HIS A 479 44.146 159.384 -0.051 1.00 68.92 C ATOM 2123 CG HIS A 479 44.340 160.829 0.305 1.00 73.94 C ATOM 2124 ND1 HIS A 479 43.611 161.834 -0.304 1.00 72.78 N ATOM 2125 CD2 HIS A 479 45.180 161.448 1.183 1.00 74.38 C ATOM 2126 CE1 HIS A 479 44.006 163.011 0.175 1.00 72.69 C ATOM 2127 NE2 HIS A 479 44.953 162.805 1.078 1.00 62.25 N ATOM 2128 H HIS A 479 44.267 156.893 -0.698 1.00 0.00 H ATOM 2129 N VAL A 480 43.770 157.550 2.385 1.00 61.76 N ATOM 2130 CA VAL A 480 43.315 157.179 3.738 1.00 68.61 C ATOM 2131 C VAL A 480 44.426 156.388 4.507 1.00 72.90 C ATOM 2132 O VAL A 480 44.515 156.510 5.747 1.00 59.59 O ATOM 2133 CB VAL A 480 41.905 156.445 3.715 1.00 67.28 C ATOM 2134 CG1 VAL A 480 41.473 155.861 5.088 1.00 66.19 C ATOM 2135 CG2 VAL A 480 40.824 157.428 3.296 1.00 62.99 C ATOM 2136 H VAL A 480 43.173 157.255 1.586 1.00 0.00 H ATOM 2137 N GLU A 481 45.346 155.820 3.754 1.00 76.24 N ATOM 2138 CA GLU A 481 46.485 155.116 4.287 1.00 81.54 C ATOM 2139 C GLU A 481 47.425 155.954 5.134 1.00 79.06 C ATOM 2140 O GLU A 481 48.008 155.454 6.051 1.00 80.22 O ATOM 2141 CB GLU A 481 47.243 154.428 3.167 1.00 91.23 C ATOM 2142 CG GLU A 481 47.719 153.026 3.493 1.00 91.09 C ATOM 2143 CD GLU A 481 48.877 152.588 2.632 1.00 96.10 C ATOM 2144 OE1 GLU A 481 49.905 153.287 2.600 1.00 97.31 O ATOM 2145 OE2 GLU A 481 48.761 151.541 1.969 1.00 93.28 O ATOM 2146 H GLU A 481 45.245 155.883 2.721 1.00 0.00 H ATOM 2147 N ARG A 482 47.552 157.226 4.839 1.00 30.00 N ATOM 2148 CA ARG A 482 48.162 158.145 5.774 1.00 30.00 C ATOM 2149 C ARG A 482 47.120 158.725 6.726 1.00 30.00 C ATOM 2150 O ARG A 482 46.439 159.710 6.452 1.00 30.00 O ATOM 2151 CB ARG A 482 48.935 159.179 5.005 1.00 20.00 C ATOM 2152 CG ARG A 482 49.725 158.554 3.871 1.00 20.00 C ATOM 2153 CD ARG A 482 51.114 158.247 4.359 1.00 20.00 C ATOM 2154 NE ARG A 482 51.757 157.173 3.639 1.00 20.00 N ATOM 2155 CZ ARG A 482 52.790 156.508 4.117 1.00 20.00 C ATOM 2156 NH1 ARG A 482 53.265 156.812 5.293 1.00 20.00 N ATOM 2157 NH2 ARG A 482 53.350 155.545 3.429 1.00 20.00 N ATOM 2158 HE ARG A 482 51.389 156.913 2.702 1.00 0.00 H ATOM 2159 HH12 ARG A 482 54.080 156.291 5.675 1.00 0.00 H ATOM 2160 HH11 ARG A 482 52.829 157.576 5.848 1.00 0.00 H ATOM 2161 HH22 ARG A 482 54.164 155.031 3.822 1.00 0.00 H ATOM 2162 HH21 ARG A 482 52.981 155.294 2.490 1.00 0.00 H ATOM 2163 H ARG A 482 47.210 157.577 3.922 1.00 0.00 H ATOM 2164 N LEU A 483 46.968 157.968 7.811 1.00 30.00 N ATOM 2165 CA LEU A 483 47.061 158.365 9.193 1.00 30.00 C ATOM 2166 C LEU A 483 48.505 158.500 9.672 1.00 30.00 C ATOM 2167 O LEU A 483 49.073 157.632 10.280 1.00 30.00 O ATOM 2168 CB LEU A 483 46.417 157.251 10.022 1.00 20.00 C ATOM 2169 H LEU A 483 46.756 156.965 7.639 1.00 0.00 H ATOM 2170 N GLN A 484 49.052 159.664 9.409 1.00 80.99 N ATOM 2171 CA GLN A 484 49.934 160.387 10.274 1.00 71.04 C ATOM 2172 C GLN A 484 49.178 160.790 11.524 1.00 71.34 C ATOM 2173 O GLN A 484 49.746 161.290 12.449 1.00 66.69 O ATOM 2174 CB GLN A 484 50.392 161.619 9.530 1.00 66.68 C ATOM 2175 CG GLN A 484 51.261 161.281 8.351 1.00 71.52 C ATOM 2176 CD GLN A 484 51.684 162.463 7.539 1.00 60.72 C ATOM 2177 OE1 GLN A 484 51.036 163.471 7.526 1.00 59.05 O ATOM 2178 NE2 GLN A 484 52.761 162.313 6.834 1.00 59.38 N ATOM 2179 HE22 GLN A 484 53.291 161.419 6.878 1.00 0.00 H ATOM 2180 HE21 GLN A 484 53.095 163.086 6.224 1.00 0.00 H ATOM 2181 H GLN A 484 48.825 160.099 8.492 1.00 0.00 H ATOM 2182 N ILE A 485 47.870 160.633 11.479 1.00 63.13 N ATOM 2183 CA ILE A 485 46.949 160.754 12.610 1.00 69.47 C ATOM 2184 C ILE A 485 47.369 159.930 13.840 1.00 60.89 C ATOM 2185 O ILE A 485 47.236 160.420 14.881 1.00 50.15 O ATOM 2186 CB ILE A 485 45.456 160.354 12.266 1.00 66.13 C ATOM 2187 CG1 ILE A 485 44.791 161.366 11.363 1.00 78.35 C ATOM 2188 CG2 ILE A 485 44.555 160.179 13.526 1.00 64.77 C ATOM 2189 CD1 ILE A 485 44.351 162.658 12.055 1.00 88.79 C ATOM 2190 H ILE A 485 47.454 160.402 10.554 1.00 0.00 H ATOM 2191 N PHE A 486 47.792 158.672 13.668 1.00 67.52 N ATOM 2192 CA PHE A 486 48.255 157.792 14.761 1.00 75.77 C ATOM 2193 C PHE A 486 49.301 158.422 15.671 1.00 70.18 C ATOM 2194 O PHE A 486 49.224 158.239 16.852 1.00 83.94 O ATOM 2195 CB PHE A 486 48.797 156.457 14.211 1.00 83.29 C ATOM 2196 CG PHE A 486 49.356 155.512 15.279 1.00 93.65 C ATOM 2197 CD1 PHE A 486 48.495 154.864 16.189 1.00 95.23 C ATOM 2198 CD2 PHE A 486 50.743 155.258 15.364 1.00 95.02 C ATOM 2199 CE1 PHE A 486 49.005 153.996 17.144 1.00 93.97 C ATOM 2200 CE2 PHE A 486 51.247 154.386 16.320 1.00101.27 C ATOM 2201 CZ PHE A 486 50.381 153.763 17.221 1.00 98.64 C ATOM 2202 H PHE A 486 47.795 158.288 12.701 1.00 0.00 H ATOM 2203 N GLN A 487 50.252 159.163 15.114 1.00 68.36 N ATOM 2204 CA GLN A 487 51.213 159.925 15.893 1.00 71.04 C ATOM 2205 C GLN A 487 50.843 161.421 16.173 1.00 72.53 C ATOM 2206 O GLN A 487 51.519 161.925 17.061 1.00 68.61 O ATOM 2207 CB GLN A 487 52.557 159.828 15.214 1.00 70.78 C ATOM 2208 CG GLN A 487 53.195 158.456 15.241 1.00 76.07 C ATOM 2209 CD GLN A 487 54.091 158.146 14.001 1.00 83.60 C ATOM 2210 OE1 GLN A 487 54.143 158.891 13.021 1.00 76.78 O ATOM 2211 NE2 GLN A 487 54.786 157.011 14.053 1.00 90.83 N ATOM 2212 OXT GLN A 487 49.960 162.196 15.637 1.00 70.14 O ATOM 2213 HE22 GLN A 487 54.723 156.401 14.893 1.00 0.00 H ATOM 2214 HE21 GLN A 487 55.391 156.735 13.254 1.00 0.00 H ATOM 2215 H GLN A 487 50.311 159.199 14.076 1.00 0.00 H TER 2216 GLN A 487 HETATM 2217 O HOH 1 62.021 168.696 3.331 1.00 28.37 O HETATM 2218 O HOH 2 12.929 145.163 3.946 1.00 41.65 O HETATM 2219 O HOH 3 57.063 170.565 2.338 1.00 26.34 O HETATM 2220 O HOH 4 35.878 159.003 2.864 1.00 38.72 O HETATM 2221 O HOH 5 20.929 159.637 16.697 1.00 45.57 O HETATM 2222 O HOH 6 35.840 153.028 11.547 1.00 36.84 O HETATM 2223 O HOH 7 16.386 147.585 1.933 1.00 50.94 O HETATM 2224 O HOH 8 37.217 154.819 4.849 1.00 37.92 O HETATM 2225 O HOH 9 12.737 164.097 1.193 1.00 44.33 O HETATM 2226 O HOH 10 23.524 155.065 17.909 1.00 48.86 O HETATM 2227 O HOH 11 34.882 152.852 4.379 1.00 43.53 O HETATM 2228 C15 UNN A 12 45.751 169.733 -0.014 1.00 -0.05 C HETATM 2229 C16 UNN A 12 45.098 170.087 1.086 1.00 -0.02 C HETATM 2230 C17 UNN A 12 44.166 171.285 1.059 1.00 0.07 C HETATM 2231 C18 UNN A 12 44.467 172.572 1.163 1.00 -0.02 C HETATM 2232 C19 UNN A 12 43.294 173.252 1.127 1.00 0.11 C HETATM 2233 N2 UNN A 12 42.986 174.591 1.250 1.00 -0.23 N HETATM 2234 C20 UNN A 12 43.868 175.619 1.319 1.00 0.20 C HETATM 2235 O1 UNN A 12 45.054 175.544 1.324 1.00 -0.39 O HETATM 2236 C21 UNN A 12 43.302 177.074 1.352 1.00 0.03 C HETATM 2237 H2 UNN A 12 42.203 177.040 1.345 1.00 0.05 H HETATM 2238 H3 UNN A 12 43.657 177.626 0.469 1.00 0.05 H HETATM 2239 H4 UNN A 12 43.647 177.581 2.265 1.00 0.05 H HETATM 2240 H5 UNN A 12 42.015 174.827 1.292 1.00 0.22 H HETATM 2241 N3 UNN A 12 42.243 172.441 0.909 1.00 -0.22 N HETATM 2242 N4 UNN A 12 42.896 171.222 0.841 1.00 -0.22 N HETATM 2243 C22 UNN A 12 42.085 170.028 0.595 1.00 0.07 C HETATM 2244 C24 UNN A 12 41.639 170.238 -0.762 1.00 -0.03 C HETATM 2245 H8 UNN A 12 41.007 169.394 -1.075 1.00 0.03 H HETATM 2246 H9 UNN A 12 42.512 170.310 -1.428 1.00 0.03 H HETATM 2247 H10 UNN A 12 41.058 171.171 -0.817 1.00 0.03 H HETATM 2248 C23 UNN A 12 40.863 170.045 1.541 1.00 -0.03 C HETATM 2249 H11 UNN A 12 40.248 169.150 1.362 1.00 0.03 H HETATM 2250 H12 UNN A 12 40.263 170.947 1.349 1.00 0.03 H HETATM 2251 H13 UNN A 12 41.208 170.050 2.586 1.00 0.03 H HETATM 2252 H7 UNN A 12 42.660 169.097 0.709 1.00 0.06 H HETATM 2253 H6 UNN A 12 45.464 173.000 1.259 1.00 0.03 H HETATM 2254 C25 UNN A 12 45.228 169.400 2.260 1.00 -0.08 C HETATM 2255 C26 UNN A 12 46.036 168.243 2.261 1.00 -0.05 C HETATM 2256 C8 UNN A 12 46.754 167.832 1.104 1.00 0.09 C HETATM 2257 C9 UNN A 12 46.619 168.639 -0.090 1.00 0.07 C HETATM 2258 N1 UNN A 12 47.144 168.317 -1.301 1.00 -0.31 N HETATM 2259 C14 UNN A 12 47.372 166.908 -1.741 1.00 0.03 C HETATM 2260 C13 UNN A 12 48.067 167.165 -3.137 1.00 -0.02 C HETATM 2261 C12 UNN A 12 49.361 167.993 -2.964 1.00 -0.04 C HETATM 2262 C11 UNN A 12 48.066 168.634 -3.463 1.00 -0.02 C HETATM 2263 C10 UNN A 12 47.225 169.331 -2.401 1.00 0.03 C HETATM 2264 H20 UNN A 12 47.716 170.252 -2.052 1.00 0.05 H HETATM 2265 H21 UNN A 12 46.224 169.573 -2.788 1.00 0.05 H HETATM 2266 H19 UNN A 12 47.968 169.060 -4.473 1.00 0.03 H HETATM 2267 H17 UNN A 12 50.208 167.848 -3.651 1.00 0.03 H HETATM 2268 H18 UNN A 12 49.741 168.223 -1.958 1.00 0.03 H HETATM 2269 H16 UNN A 12 47.937 166.362 -3.877 1.00 0.03 H HETATM 2270 H14 UNN A 12 46.426 166.357 -1.851 1.00 0.05 H HETATM 2271 H15 UNN A 12 48.034 166.366 -1.049 1.00 0.05 H HETATM 2272 N UNN A 12 47.646 166.832 1.236 1.00 -0.22 N HETATM 2273 C7 UNN A 12 49.034 167.164 1.026 1.00 0.04 C HETATM 2274 H24 UNN A 12 49.119 168.225 0.749 1.00 0.05 H HETATM 2275 H25 UNN A 12 49.442 166.540 0.217 1.00 0.05 H HETATM 2276 H26 UNN A 12 49.599 166.980 1.952 1.00 0.05 H HETATM 2277 C UNN A 12 47.184 165.664 1.574 1.00 0.23 C HETATM 2278 O UNN A 12 45.964 165.390 1.446 1.00 -0.38 O HETATM 2279 C1 UNN A 12 48.179 164.680 2.138 1.00 0.10 C HETATM 2280 C6 UNN A 12 48.603 164.631 3.555 1.00 0.15 C HETATM 2281 F UNN A 12 48.004 165.457 4.406 1.00 -0.18 F HETATM 2282 C5 UNN A 12 49.526 163.700 3.979 1.00 -0.02 C HETATM 2283 C4 UNN A 12 50.144 162.844 3.052 1.00 -0.06 C HETATM 2284 C3 UNN A 12 49.794 162.846 1.731 1.00 -0.05 C HETATM 2285 C2 UNN A 12 48.823 163.736 1.295 1.00 0.06 C HETATM 2286 CL UNN A 12 48.335 163.910 -0.376 1.00 -0.07 CL HETATM 2287 H29 UNN A 12 50.267 162.163 1.035 1.00 0.06 H HETATM 2288 H28 UNN A 12 50.917 162.165 3.393 1.00 0.06 H HETATM 2289 H27 UNN A 12 49.776 163.628 5.031 1.00 0.06 H HETATM 2290 H23 UNN A 12 46.111 167.652 3.167 1.00 0.05 H HETATM 2291 H22 UNN A 12 44.727 169.733 3.162 1.00 0.05 H HETATM 2292 H1 UNN A 12 45.602 170.328 -0.908 1.00 0.05 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 2228 2229 2257 2292 CONECT 2229 2228 2230 2254 CONECT 2230 2229 2231 2242 CONECT 2231 2230 2232 2253 CONECT 2232 2231 2233 2241 CONECT 2233 2232 2234 2240 CONECT 2234 2233 2235 2236 CONECT 2235 2234 CONECT 2236 2234 2237 2238 2239 CONECT 2237 2236 CONECT 2238 2236 CONECT 2239 2236 CONECT 2240 2233 CONECT 2241 2232 2242 CONECT 2242 2230 2241 2243 CONECT 2243 2242 2244 2248 2252 CONECT 2244 2243 2245 2246 2247 CONECT 2245 2244 CONECT 2246 2244 CONECT 2247 2244 CONECT 2248 2243 2249 2250 2251 CONECT 2249 2248 CONECT 2250 2248 CONECT 2251 2248 CONECT 2252 2243 CONECT 2253 2231 CONECT 2254 2229 2255 2291 CONECT 2255 2254 2256 2290 CONECT 2256 2255 2257 2272 CONECT 2257 2228 2256 2258 CONECT 2258 2257 2259 2263 CONECT 2259 2258 2260 2270 2271 CONECT 2260 2259 2261 2262 2269 CONECT 2261 2260 2262 2267 2268 CONECT 2262 2260 2261 2263 2266 CONECT 2263 2258 2262 2264 2265 CONECT 2264 2263 CONECT 2265 2263 CONECT 2266 2262 CONECT 2267 2261 CONECT 2268 2261 CONECT 2269 2260 CONECT 2270 2259 CONECT 2271 2259 CONECT 2272 2256 2273 2277 CONECT 2273 2272 2274 2275 2276 CONECT 2274 2273 CONECT 2275 2273 CONECT 2276 2273 CONECT 2277 2272 2278 2279 CONECT 2278 2277 CONECT 2279 2277 2280 2285 CONECT 2280 2279 2281 2282 CONECT 2281 2280 CONECT 2282 2280 2283 2289 CONECT 2283 2282 2284 2288 CONECT 2284 2283 2285 2287 CONECT 2285 2279 2284 2286 CONECT 2286 2285 CONECT 2287 2284 CONECT 2288 2283 CONECT 2289 2282 CONECT 2290 2255 CONECT 2291 2254 CONECT 2292 2228 MASTER 0 0 0 0 0 0 0 0 2291 1 69 18 END
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243aa, >3B0W_1|Chains... at 100%
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13aa, >3O1D_2|Chain... at 100%
3o1e
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13aa, >3O1E_2|Chain... at 100%
3oap
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11aa, >3OAP_2|Chain... at 100%
3ozj
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4fhh
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PDBbind
13aa, >4FHH_2|Chain... at 100%
4fhi
RCSB PDB
PDBbind
13aa, >4FHI_2|Chain... at 100%
4k4j
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RCSB PDB
PDBbind
13aa, >4K6I_2|Chain... at 100%
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RCSB PDB
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11aa, >4M8E_2|Chain... at 100%
4m8h
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PDBbind
11aa, >4M8H_2|Chain... at 100%
4nb6
RCSB PDB
PDBbind
251aa, >4NB6_1|Chains... at 97%
4nie
RCSB PDB
PDBbind
12aa, >4NIE_2|Chains... at 100%
4poh
RCSB PDB
PDBbind
13aa, >4POH_2|Chain... at 100%
4poj
RCSB PDB
PDBbind
13aa, >4POJ_2|Chain... at 100%
4pp3
RCSB PDB
PDBbind
13aa, >4PP3_2|Chain... at 100%
4pp5
RCSB PDB
PDBbind
13aa, >4PP5_2|Chain... at 100%
4rme
RCSB PDB
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4wlb
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4xt9
RCSB PDB
PDBbind
243aa, >4XT9_1|Chain... at 100%
4ymq
RCSB PDB
PDBbind
280aa, >4YMQ_1|Chain... at 93%
4zjr
RCSB PDB
PDBbind
225aa, >4ZJR_1|Chains... at 99%
4zjw
RCSB PDB
PDBbind
225aa, >4ZJW_1|Chains... at 99%
4zsh
RCSB PDB
PDBbind
13aa, >4ZSH_2|Chain... at 100%
5aph
RCSB PDB
PDBbind
12aa, >5APH_2|Chain... at 100%
5apj
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PDBbind
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5c4o
RCSB PDB
PDBbind
241aa, >5C4O_1|Chain... at 99%
5c4s
RCSB PDB
PDBbind
241aa, >5C4S_1|Chain... at 99%
5c4t
RCSB PDB
PDBbind
241aa, >5C4T_1|Chain... at 99%
5c4u
RCSB PDB
PDBbind
241aa, >5C4U_1|Chain... at 99%
5eth
RCSB PDB
PDBbind
223aa, >5ETH_1|Chains... at 99%
5g42
RCSB PDB
PDBbind
266aa, >5G42_1|Chain... at 100%
5g43
RCSB PDB
PDBbind
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5g45
RCSB PDB
PDBbind
266aa, >5G45_1|Chain... at 100%
5g46
RCSB PDB
PDBbind
266aa, >5G46_1|Chain... at 100%
5ni5
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PDBbind
15aa, >5NI5_2|Chain... at 100%
5ni7
RCSB PDB
PDBbind
15aa, >5NI7_2|Chain... at 100%
5ni8
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PDBbind
15aa, >5NI8_2|Chain... at 100%
5nib
RCSB PDB
PDBbind
15aa, >5NIB_2|Chain... at 100%
5ntk
RCSB PDB
PDBbind
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5ntp
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238aa, >5NTP_1|Chain... at 98%
5ntq
RCSB PDB
PDBbind
238aa, >5NTQ_1|Chains... at 98%
5ufo
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PDBbind
258aa, >5UFO_1|Chain... at 98%
5ufr
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PDBbind
258aa, >5UFR_1|Chains... at 98%
5uhi
RCSB PDB
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258aa, >5UHI_1|Chains... at 98%
5vb5
RCSB PDB
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280aa, >5VB5_1|Chain... at 93%
5vb6
RCSB PDB
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280aa, >5VB6_1|Chain... at 93%
5vb7
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5w4r
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PDBbind
217aa, >5W4R_1|Chains... at 100%
5w4v
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5yp5
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5yp6
RCSB PDB
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245aa, >5YP6_1|Chain... at 99%
5za1
RCSB PDB
PDBbind
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6b30
RCSB PDB
PDBbind
215aa, >6B30_1|Chains... at 100%
6b31
RCSB PDB
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6br2
RCSB PDB
PDBbind
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6br3
RCSB PDB
PDBbind
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6cn5
RCSB PDB
PDBbind
262aa, >6CN5_1|Chains... at 92%
6cn6
RCSB PDB
PDBbind
259aa, >6CN6_1|Chain... at 93%
6esn
RCSB PDB
PDBbind
12aa, >6ESN_2|Chain... at 100%
6fgq
RCSB PDB
PDBbind
265aa, >6FGQ_1|Chains... at 100%
6r7k
RCSB PDB
PDBbind
15aa, >6R7K_2|Chain... at 100%
6r7j
RCSB PDB
PDBbind
15aa, >6R7J_2|Chain... at 100%
6q7h
RCSB PDB
PDBbind
238aa, >6Q7H_1|Chain... at 98%
6q7a
RCSB PDB
PDBbind
238aa, >6Q7A_1|Chain... at 98%
6q6o
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PDBbind
238aa, >6Q6O_1|Chain... at 98%
6q6m
RCSB PDB
PDBbind
238aa, >6Q6M_1|Chain... at 98%
6nad
RCSB PDB
PDBbind
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6j1l
RCSB PDB
PDBbind
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
4zom
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Nuclear receptor ROR-gamma
Ligand Name
4Q3
EC.Number
E.C.-.-.-.-
Resolution
2.27(Å)
Affinity (Kd/Ki/IC50)
IC50=3nM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) Bioorg.Med.Chem.Lett. Vol. 25: pp. 2985-2990
Ligand Properties
Formula
C
2
7
H
2
9
ClFN
5
O
2
Molecular Weight
510.003
Exact Mass
509.199
No. of atoms
65
No. of bonds
69
Polar Surface Area
70.47
LOGP Value
4.39 (
Computed with XLOGP3
)
5.75 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 1
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 7
No. of Rings: 5
Canonical SMILES
CC(=O)Nc1cc(n(n1)C(C)C)c1ccc(c(c1)N1C[C@@H]2[C@H](C1)C2)N(C(=O)c1c(F)cccc1Cl)C
InChI String
InChI=1S/C27H29ClFN5O2/c1-15(2)34-23(12-25(31-34)30-16(3)35)17-8-9-22(24(11-17)33-13-18-10-19(18)14-33)32(4)27(36)26-20(28)6-5-7-21(26)29/h5-9,11-12,15,18-19H,10,13-14H2,1-4H3,(H,30,31,35)/t18-,19+
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P51449
Entrez Gene ID
NCBI Entrez Gene ID:
6097
ASD
Information of known allosteric effects of PDB entries
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