Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8s0d_2.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 4.A OE2 no hydrogen 2.726 N/A TRP 5.A N SER 1.A O no hydrogen 3.129 N/A VAL 6.A N VAL 2.A O no hydrogen 2.903 N/A SER 7.A N ARG 3.A O no hydrogen 2.909 N/A SER 7.A N GLU 4.A O no hydrogen 3.193 N/A SER 7.A OG GLU 4.A O no hydrogen 2.430 N/A ARG 12.A N MET 8.A O no hydrogen 3.378 N/A LEU 13.A N ALA 9.A O no hydrogen 2.888 N/A GLU 14.A N GLY 10.A O no hydrogen 2.949 N/A ILE 15.A N PRO 11.A O no hydrogen 2.855 N/A HIS 16.A N ARG 12.A O no hydrogen 2.913 N/A HIS 16.A NE2 GLU 85.A OE1 no hydrogen 2.933 N/A HIS 17.A N LEU 13.A O no hydrogen 2.920 N/A HIS 17.A ND1 LEU 13.A O no hydrogen 2.955 N/A ARG 18.A N GLU 14.A O no hydrogen 2.907 N/A PHE 19.A N ILE 15.A O no hydrogen 2.869 N/A LYS 20.A N HIS 16.A O no hydrogen 2.941 N/A LYS 20.A NZ GLU 85.A OE1 no hydrogen 3.449 N/A ASN 21.A N HIS 17.A O no hydrogen 2.919 N/A ASN 21.A ND2 HIS 17.A O no hydrogen 2.875 N/A PHE 22.A N ARG 18.A O no hydrogen 2.890 N/A LEU 23.A N PHE 19.A O no hydrogen 2.877 N/A ARG 24.A N LYS 20.A O no hydrogen 2.927 N/A THR 25.A N ASN 21.A O no hydrogen 2.904 N/A THR 25.A OG1 ASN 21.A O no hydrogen 2.547 N/A HIS 26.A N PHE 22.A O no hydrogen 2.904 N/A ASP 28.A N HIS 32.A O no hydrogen 2.998 N/A GLY 31.A N ASP 28.A O no hydrogen 3.305 N/A HIS 32.A ND1 ASP 28.A OD2 no hydrogen 3.196 N/A LYS 36.A N ASN 33.A OD1 no hydrogen 2.569 N/A ARG 38.A N VAL 34.A O no hydrogen 2.926 N/A ILE 39.A N PHE 35.A O no hydrogen 2.866 N/A SER 40.A N LYS 36.A O no hydrogen 2.942 N/A SER 40.A OG LYS 36.A O no hydrogen 3.463 N/A SER 40.A OG GLU 37.A O no hydrogen 2.591 N/A ASP 41.A N GLU 37.A O no hydrogen 2.891 N/A MET 42.A N ARG 38.A O no hydrogen 2.906 N/A CYS 43.A N ILE 39.A O no hydrogen 2.868 N/A CYS 43.A SG ILE 39.A O no hydrogen 3.237 N/A CYS 43.A SG TYR 94.A OH no hydrogen 3.569 N/A LYS 44.A N SER 40.A O no hydrogen 2.923 N/A ASN 46.A N CYS 43.A O no hydrogen 3.435 N/A ARG 47.A N MET 42.A O no hydrogen 3.208 N/A ARG 47.A NE GLU 45.A OE1 no hydrogen 2.559 N/A ARG 47.A NH2 GLU 45.A OE1 no hydrogen 2.892 N/A VAL 52.A N ARG 104.A O no hydrogen 2.805 N/A TYR 54.A OH ALA 65.A O no hydrogen 2.942 N/A GLU 55.A N ASN 53.A OD1 no hydrogen 3.136 N/A LEU 57.A N ASN 53.A O no hydrogen 3.244 N/A ALA 58.A N TYR 54.A O no hydrogen 2.892 N/A ALA 59.A N GLU 55.A O no hydrogen 2.905 N/A ARG 60.A N ASP 56.A O no hydrogen 2.918 N/A ARG 60.A NE HIS 26.A ND1 no hydrogen 3.004 N/A ARG 60.A NH2 VAL 27.A O no hydrogen 3.034 N/A GLU 61.A N LEU 57.A O no hydrogen 2.847 N/A TYR 66.A N HIS 62.A O no hydrogen 2.943 N/A PHE 67.A N VAL 63.A O no hydrogen 2.916 N/A LEU 68.A N LEU 64.A O no hydrogen 2.902 N/A GLU 70.A N PHE 67.A O no hydrogen 3.273 N/A ALA 71.A N PHE 67.A O no hydrogen 3.227 N/A ALA 71.A N LEU 68.A O no hydrogen 3.413 N/A GLU 74.A N GLU 74.A OE1 no hydrogen 2.571 N/A LEU 76.A N PRO 72.A O no hydrogen 2.883 N/A GLN 77.A N ALA 73.A O no hydrogen 2.925 N/A ILE 78.A N GLU 74.A O no hydrogen 2.935 N/A PHE 79.A N LEU 75.A O no hydrogen 2.866 N/A ASP 80.A N LEU 76.A O no hydrogen 2.870 N/A GLU 81.A N GLN 77.A O no hydrogen 2.942 N/A ALA 82.A N ILE 78.A O no hydrogen 2.917 N/A ALA 83.A N PHE 79.A O no hydrogen 2.870 N/A LEU 84.A N ASP 80.A O no hydrogen 2.896 N/A GLU 85.A N GLU 81.A O no hydrogen 2.931 N/A VAL 86.A N ALA 82.A O no hydrogen 2.904 N/A VAL 87.A N ALA 83.A O no hydrogen 2.892 N/A LEU 88.A N LEU 84.A O no hydrogen 2.898 N/A ALA 89.A N GLU 85.A O no hydrogen 2.910 N/A MET 90.A N VAL 86.A O no hydrogen 2.905 N/A TYR 91.A N VAL 87.A O no hydrogen 2.711 N/A ARG 96.A N LYS 93.A O no hydrogen 2.924 N/A ILE 97.A N TYR 94.A O no hydrogen 2.991 N/A THR 98.A N TYR 94.A O no hydrogen 2.985 N/A ASN 99.A N ASN 99.A OD1 no hydrogen 2.581 N/A ARG 104.A N LEU 50.A O no hydrogen 2.829 N/A ARG 104.A NE SER 49.A OG no hydrogen 3.166 N/A ARG 104.A NH1 ASN 262.A O no hydrogen 2.858 N/A SER 106.A N VAL 52.A O no hydrogen 3.093 N/A SER 106.A OG VAL 52.A O no hydrogen 3.297 N/A HIS 107.A ND1 ASN 53.A OD1 no hydrogen 3.026 N/A ARG 115.A NE GLU 200.A OE1 no hydrogen 2.809 N/A SER 116.A N GLU 113.A O no hydrogen 3.312 N/A HIS 121.A N ARG 118.A O no hydrogen 2.948 N/A LEU 122.A N GLN 119.A O no hydrogen 3.486 N/A ASN 123.A N TYR 238.A O no hydrogen 2.936 N/A ILE 126.A N GLY 236.A O no hydrogen 2.907 N/A ARG 127.A NH1 SER 106.A O no hydrogen 2.874 N/A THR 128.A N LEU 234.A O no hydrogen 2.895 N/A GLY 130.A N ILE 232.A O no hydrogen 2.930 N/A VAL 131.A N GLN 199.A O no hydrogen 2.950 N/A VAL 132.A N ASP 230.A O no hydrogen 3.035 N/A THR 133.A N ARG 197.A O no hydrogen 3.194 N/A THR 133.A OG1 ARG 197.A O no hydrogen 3.535 N/A THR 136.A N ARG 195.A O no hydrogen 3.356 N/A THR 136.A OG1 ARG 195.A O no hydrogen 3.397 N/A LEU 139.A N TYR 193.A O no hydrogen 2.913 N/A GLN 141.A N GLN 191.A O no hydrogen 2.879 N/A SER 143.A OG LEU 142.A O no hydrogen 2.670 N/A VAL 145.A N PHE 159.A O no hydrogen 2.982 N/A LYS 146.A NZ GLU 187.A OE1 no hydrogen 3.164 N/A ASN 148.A N GLU 182.A O no hydrogen 2.805 N/A CYS 149.A N PHE 154.A O no hydrogen 3.258 N/A LEU 156.A N TYR 147.A O no hydrogen 3.131 N/A PHE 159.A N VAL 145.A O no hydrogen 2.948 N/A GLN 161.A NE2 SER 162.A O no hydrogen 2.625 N/A GLN 161.A NE2 GLN 165.A O no hydrogen 3.209 N/A CYS 172.A N SER 177.A O no hydrogen 3.329 N/A CYS 175.A SG SER 177.A OG no hydrogen 2.885 N/A GLN 176.A N CYS 172.A O no hydrogen 3.157 N/A GLU 182.A N ASN 148.A O no hydrogen 3.418 N/A ASN 184.A N LYS 146.A O no hydrogen 2.906 N/A GLU 186.A N ASN 184.A OD1 no hydrogen 3.253 N/A GLU 187.A N ASN 184.A O no hydrogen 3.345 N/A THR 188.A N ASN 184.A O no hydrogen 3.286 N/A THR 188.A OG1 ASN 184.A O no hydrogen 2.469 N/A ILE 189.A N SER 143.A O no hydrogen 2.949 N/A GLN 191.A N GLN 141.A O no hydrogen 2.901 N/A ASN 192.A ND2 ALA 220.A O no hydrogen 3.320 N/A TYR 193.A N LEU 139.A O no hydrogen 2.908 N/A GLN 194.A N LEU 218.A O no hydrogen 2.926 N/A GLN 194.A NE2 GLY 137.A O no hydrogen 2.798 N/A ARG 195.A N THR 136.A OG1 no hydrogen 3.216 N/A ARG 195.A NE ASP 215.A OD2 no hydrogen 3.075 N/A ARG 195.A NH2 ASP 215.A OD2 no hydrogen 2.715 N/A ILE 196.A N ALA 216.A O no hydrogen 2.909 N/A ARG 197.A NE THR 133.A OG1 no hydrogen 3.162 N/A ILE 198.A N LYS 214.A O no hydrogen 2.894 N/A GLN 199.A N VAL 131.A O no hydrogen 3.053 N/A GLU 200.A N ARG 212.A O no hydrogen 3.128 N/A SER 201.A OG GLU 231.A OE2 no hydrogen 2.843 N/A LYS 204.A N SER 201.A O no hydrogen 3.236 N/A ARG 212.A N GLU 200.A OE2 no hydrogen 2.867 N/A LYS 214.A N ILE 198.A O no hydrogen 2.908 N/A ALA 216.A N ILE 196.A O no hydrogen 2.885 N/A ILE 217.A N ILE 259.A O no hydrogen 3.290 N/A LEU 218.A N GLN 194.A O no hydrogen 2.891 N/A ALA 220.A N ASN 192.A O no hydrogen 3.167 N/A LEU 222.A N LEU 219.A O no hydrogen 3.231 N/A ASP 224.A N GLN 194.A OE1 no hydrogen 3.027 N/A SER 225.A OG LEU 222.A O no hydrogen 2.839 N/A CYS 226.A SG SER 225.A OG no hydrogen 3.660 N/A GLY 229.A N VAL 132.A O no hydrogen 3.025 N/A ASP 230.A N LYS 227.A O no hydrogen 3.264 N/A ILE 232.A N GLY 130.A O no hydrogen 2.878 N/A GLU 233.A N ALA 265.A O no hydrogen 2.841 N/A LEU 234.A N THR 128.A O no hydrogen 2.894 N/A GLY 236.A N ILE 126.A O no hydrogen 2.892 N/A ILE 237.A N LEU 260.A O no hydrogen 2.815 N/A TYR 238.A OH THR 257.A OG1 no hydrogen 2.938 N/A ASN 240.A ND2 ALA 256.A O no hydrogen 3.120 N/A TYR 242.A N ASN 240.A O no hydrogen 2.802 N/A ASP 243.A N ASN 164.A O no hydrogen 3.166 N/A SER 245.A N TYR 242.A O no hydrogen 3.410 N/A SER 245.A OG TYR 242.A O no hydrogen 3.389 N/A ASN 247.A N VAL 254.A O no hydrogen 3.404 N/A ASN 247.A ND2 ASN 250.A O no hydrogen 2.513 N/A ASN 247.A ND2 PHE 252.A O no hydrogen 3.042 N/A THR 248.A OG1 LEU 246.A O no hydrogen 3.474 N/A THR 257.A OG1 TYR 238.A OH no hydrogen 2.938 N/A VAL 258.A N HIS 239.A O no hydrogen 2.929 N/A LEU 260.A N ILE 237.A O no hydrogen 2.950 N/A ALA 261.A N ILE 217.A O no hydrogen 3.455 N/A ALA 265.A N GLU 233.A O no hydrogen 2.937 N/A LYS 266.A NZ ASP 230.A OD2 no hydrogen 3.193 N/A VAL 270.A N ASP 267.A O no hydrogen 3.197 N/A LYS 271.A NZ ASP 267.A OD1 no hydrogen 3.503 N/A LYS 271.A NZ GLU 268.A OE2 no hydrogen 2.682 N/A MET 272.A N GLU 268.A O no hydrogen 2.917 N/A ILE 273.A N ASP 269.A O no hydrogen 2.885 N/A THR 274.A N VAL 270.A O no hydrogen 2.919 N/A THR 274.A OG1 VAL 270.A O no hydrogen 3.017 N/A THR 274.A OG1 LYS 271.A O no hydrogen 2.542 N/A SER 275.A N LYS 271.A O no hydrogen 2.907 N/A SER 275.A OG MET 272.A O no hydrogen 2.688 N/A LEU 276.A N MET 272.A O no hydrogen 2.902 N/A SER 277.A N ILE 273.A O no hydrogen 2.895 N/A SER 277.A OG THR 274.A O no hydrogen 2.680 N/A LYS 278.A N THR 274.A O no hydrogen 3.032 N/A LYS 278.A N SER 275.A O no hydrogen 3.111 N/A ASP 279.A N LEU 276.A O no hydrogen 3.025 N/A LYS 285.A N GLN 281.A O no hydrogen 3.358 N/A LYS 285.A NZ ASP 279.A OD2 no hydrogen 2.866 N/A ILE 286.A N ILE 282.A O no hydrogen 2.901 N/A PHE 287.A N GLY 283.A O no hydrogen 2.921 N/A ALA 288.A N GLU 284.A O no hydrogen 2.896 N/A SER 289.A N ILE 286.A O no hydrogen 3.024 N/A SER 289.A OG LYS 285.A O no hydrogen 2.299 N/A ILE 294.A N ALA 291.A O no hydrogen 3.174 N/A TYR 295.A OH GLN 480.A OE1 no hydrogen 2.680 N/A ILE 300.A N ASP 299.A OD1 no hydrogen 2.785 N/A LYS 301.A N HIS 297.A O no hydrogen 3.370 N/A LYS 301.A NZ ALA 291.A O no hydrogen 3.556 N/A LYS 301.A NZ ILE 294.A O no hydrogen 2.964 N/A ARG 302.A N GLU 298.A O no hydrogen 2.925 N/A GLY 303.A N ASP 299.A O no hydrogen 2.896 N/A LEU 304.A N ILE 300.A O no hydrogen 2.889 N/A ALA 305.A N LYS 301.A O no hydrogen 2.893 N/A LEU 306.A N ARG 302.A O no hydrogen 2.932 N/A ALA 307.A N GLY 303.A O no hydrogen 2.896 N/A LEU 308.A N LEU 304.A O no hydrogen 2.874 N/A PHE 309.A N ALA 305.A O no hydrogen 2.940 N/A GLY 310.A N LEU 306.A O no hydrogen 3.208 N/A GLY 311.A N GLY 324.A O no hydrogen 3.105 N/A LYS 314.A N VAL 322.A O no hydrogen 3.254 N/A LYS 314.A NZ GLU 312.A O no hydrogen 2.827 N/A VAL 322.A N LYS 314.A O no hydrogen 3.120 N/A ARG 323.A NH2 ASN 327.A OD1 no hydrogen 2.628 N/A ARG 323.A NH2 ARG 465.A O no hydrogen 3.185 N/A VAL 328.A N VAL 435.A O no hydrogen 2.923 N/A LEU 329.A N ILE 468.A O no hydrogen 2.905 N/A LEU 330.A N ALA 437.A O no hydrogen 2.887 N/A CYS 331.A N CYS 470.A O no hydrogen 2.899 N/A GLY 332.A N ALA 439.A O no hydrogen 2.924 N/A ASP 333.A N VAL 472.A O no hydrogen 3.197 N/A THR 336.A OG1 ASP 333.A O no hydrogen 2.880 N/A LYS 338.A NZ GLY 332.A O no hydrogen 2.834 N/A LYS 338.A NZ ASP 333.A O no hydrogen 2.959 N/A LYS 338.A NZ ASN 440.A OD1 no hydrogen 2.381 N/A PHE 341.A N LYS 338.A O no hydrogen 3.245 N/A LYS 343.A N SER 339.A O no hydrogen 2.918 N/A TYR 344.A N GLN 340.A O no hydrogen 2.887 N/A ILE 345.A N PHE 341.A O no hydrogen 2.923 N/A GLU 346.A N LEU 342.A O no hydrogen 2.891 N/A LYS 347.A N LYS 343.A O no hydrogen 2.919 N/A VAL 348.A N TYR 344.A O no hydrogen 2.897 N/A SER 349.A N ILE 345.A O no hydrogen 2.666 N/A ILE 353.A N VAL 392.A O no hydrogen 2.920 N/A THR 355.A N LEU 394.A O no hydrogen 2.915 N/A THR 355.A OG1 VAL 363.A O no hydrogen 3.546 N/A GLY 357.A N ASP 396.A O no hydrogen 2.747 N/A GLN 358.A NE2 GLN 358.A O no hydrogen 2.959 N/A SER 361.A OG THR 356.A O no hydrogen 2.539 N/A TYR 368.A N GLU 381.A O no hydrogen 2.910 N/A TYR 368.A OH GLU 381.A OE1 no hydrogen 2.847 N/A GLN 370.A N THR 379.A O no hydrogen 2.937 N/A HIS 372.A N GLU 377.A O no hydrogen 2.941 N/A VAL 374.A N HIS 372.A ND1 no hydrogen 3.062 N/A ARG 376.A N HIS 372.A O no hydrogen 2.845 N/A THR 379.A N GLN 370.A O no hydrogen 2.887 N/A THR 379.A OG1 GLN 370.A O no hydrogen 3.427 N/A GLU 381.A N TYR 368.A O no hydrogen 2.901 N/A ALA 384.A N GLY 364.A O no hydrogen 2.945 N/A LEU 387.A N GLY 383.A O no hydrogen 3.242 N/A ALA 388.A N ALA 384.A O no hydrogen 3.104 N/A ALA 388.A N LEU 385.A O no hydrogen 3.245 N/A ASP 389.A N VAL 386.A O no hydrogen 3.019 N/A ARG 390.A N ARG 432.A O no hydrogen 2.728 N/A ARG 390.A NE ASP 389.A OD2 no hydrogen 3.451 N/A GLY 391.A N ALA 388.A O no hydrogen 2.825 N/A VAL 392.A N ARG 351.A O no hydrogen 2.825 N/A CYS 393.A N THR 434.A O no hydrogen 2.952 N/A LEU 394.A N ILE 353.A O no hydrogen 2.882 N/A ASP 396.A N THR 355.A O no hydrogen 2.899 N/A GLU 397.A N ASP 396.A OD1 no hydrogen 2.571 N/A LYS 400.A N GLU 397.A O no hydrogen 3.154 N/A LYS 400.A NZ GLU 397.A OE1 no hydrogen 3.491 N/A LYS 400.A NZ ASP 399.A OD1 no hydrogen 3.478 N/A ASP 405.A N ASN 402.A OD1 no hydrogen 3.123 N/A ARG 406.A N ASN 402.A O no hydrogen 3.403 N/A ARG 406.A NE MET 401.A O no hydrogen 3.473 N/A THR 407.A N ASP 403.A O no hydrogen 2.915 N/A THR 407.A OG1 ASP 403.A O no hydrogen 2.908 N/A SER 408.A N GLN 404.A O no hydrogen 2.906 N/A SER 408.A OG GLN 404.A O no hydrogen 3.356 N/A SER 408.A OG ASP 405.A O no hydrogen 2.737 N/A ILE 409.A N ASP 405.A O no hydrogen 2.914 N/A HIS 410.A N ARG 406.A O no hydrogen 2.897 N/A GLU 411.A N THR 407.A O no hydrogen 2.937 N/A ALA 412.A N SER 408.A O no hydrogen 2.912 N/A MET 413.A N ILE 409.A O no hydrogen 2.880 N/A GLU 414.A N HIS 410.A O no hydrogen 2.931 N/A GLU 414.A N GLU 411.A O no hydrogen 3.284 N/A GLN 415.A N GLU 411.A O no hydrogen 2.934 N/A ILE 418.A N LEU 429.A O no hydrogen 2.914 N/A ILE 420.A N THR 427.A O no hydrogen 2.904 N/A LYS 422.A N ILE 425.A O no hydrogen 2.908 N/A ILE 425.A N LYS 422.A O no hydrogen 2.893 N/A THR 427.A N ILE 420.A O no hydrogen 2.905 N/A LEU 429.A N ILE 418.A O no hydrogen 2.885 N/A ARG 432.A NE ASP 389.A OD1 no hydrogen 3.268 N/A ARG 432.A NH2 ASP 389.A OD2 no hydrogen 3.059 N/A CYS 433.A SG ALA 431.A O no hydrogen 3.562 N/A THR 434.A N GLY 391.A O no hydrogen 3.235 N/A THR 434.A OG1 ASP 325.A OD1 no hydrogen 3.177 N/A ILE 436.A N CYS 393.A O no hydrogen 3.501 N/A ALA 437.A N VAL 328.A O no hydrogen 2.900 N/A ALA 438.A N ILE 395.A O no hydrogen 3.230 N/A ALA 439.A N LEU 330.A O no hydrogen 2.894 N/A ILE 442.A N ASN 455.A O no hydrogen 2.993 N/A TYR 446.A N ASP 333.A OD1 no hydrogen 3.031 N/A LEU 450.A N ASP 447.A O no hydrogen 3.234 N/A THR 451.A N GLU 454.A OE1 no hydrogen 2.959 N/A THR 451.A OG1 GLU 454.A OE1 no hydrogen 2.568 N/A ASN 455.A N PHE 452.A O no hydrogen 3.121 N/A ASN 455.A ND2 ASP 447.A O no hydrogen 3.466 N/A ASN 455.A ND2 LEU 450.A O no hydrogen 3.613 N/A GLU 460.A N GLU 460.A OE1 no hydrogen 2.677 N/A ILE 463.A N THR 459.A O no hydrogen 3.298 N/A SER 464.A N GLU 460.A O no hydrogen 2.898 N/A PHE 466.A N ILE 463.A O no hydrogen 3.211 N/A ASP 467.A N ASN 327.A O no hydrogen 3.112 N/A ILE 468.A N ASN 327.A O no hydrogen 3.191 N/A CYS 470.A N LEU 329.A O no hydrogen 2.892 N/A VAL 472.A N CYS 331.A O no hydrogen 2.907 N/A ASP 481.A N ASP 477.A O no hydrogen 2.840 N/A GLU 482.A N PRO 478.A O no hydrogen 2.893 N/A MET 483.A N VAL 479.A O no hydrogen 2.943 N/A LEU 484.A N GLN 480.A O no hydrogen 2.901 N/A ALA 485.A N ASP 481.A O no hydrogen 2.881 N/A ARG 486.A N GLU 482.A O no hydrogen 2.919 N/A PHE 487.A N MET 483.A O no hydrogen 2.914 N/A VAL 488.A N LEU 484.A O no hydrogen 2.907 N/A VAL 489.A N ALA 485.A O no hydrogen 2.920 N/A GLY 490.A N ARG 486.A O no hydrogen 2.908 N/A SER 491.A N PHE 487.A O no hydrogen 2.899 N/A HIS 492.A N VAL 488.A O no hydrogen 2.921 N/A HIS 492.A ND1 VAL 488.A O no hydrogen 3.094 N/A VAL 493.A N VAL 489.A O no hydrogen 2.888 N/A ARG 494.A N GLY 490.A O no hydrogen 2.908 N/A HIS 495.A N SER 491.A O no hydrogen 3.400 N/A HIS 496.A N VAL 493.A O no hydrogen 3.373 N/A TYR 502.A OH GLU 298.A OE1 no hydrogen 2.274 N/A LEU 507.A N SER 289.A OG no hydrogen 2.857 N/A LEU 512.A N PRO 508.A O no hydrogen 2.882 N/A LYS 513.A N GLN 509.A O no hydrogen 2.900 N/A LYS 513.A NZ LYS 347.A O no hydrogen 3.516 N/A LYS 513.A NZ VAL 348.A O no hydrogen 3.186 N/A LYS 514.A N GLU 510.A O no hydrogen 2.926 N/A LYS 514.A NZ ASP 269.A OD2 no hydrogen 3.059 N/A TYR 515.A N VAL 511.A O no hydrogen 2.879 N/A TYR 515.A OH ILE 572.A O no hydrogen 3.056 N/A ILE 516.A N LEU 512.A O no hydrogen 2.911 N/A ILE 517.A N LYS 513.A O no hydrogen 2.932 N/A TYR 518.A N LYS 514.A O no hydrogen 2.897 N/A ALA 519.A N TYR 515.A O no hydrogen 2.899 N/A LYS 520.A N ILE 516.A O no hydrogen 2.913 N/A LYS 520.A NZ LEU 308.A O no hydrogen 2.983 N/A GLU 521.A N ILE 517.A O no hydrogen 2.925 N/A GLU 521.A N TYR 518.A O no hydrogen 3.228 N/A ARG 522.A N TYR 518.A O no hydrogen 2.952 N/A ARG 522.A NE GLU 521.A OE2 no hydrogen 2.788 N/A LYS 526.A N ASP 576.A O no hydrogen 2.873 N/A LYS 534.A N ASP 531.A OD2 no hydrogen 2.893 N/A LYS 534.A NZ ASN 584.A OD1 no hydrogen 2.790 N/A ALA 536.A N GLN 532.A O no hydrogen 2.916 N/A LYS 537.A N ASP 533.A O no hydrogen 2.899 N/A MET 538.A N LYS 534.A O no hydrogen 2.928 N/A TYR 539.A N VAL 535.A O no hydrogen 2.898 N/A SER 540.A N ALA 536.A O no hydrogen 2.907 N/A ASP 541.A N LYS 537.A O no hydrogen 2.926 N/A LEU 542.A N MET 538.A O no hydrogen 2.904 N/A ARG 543.A N TYR 539.A O no hydrogen 2.906 N/A ARG 543.A NH2 ILE 554.A O no hydrogen 3.279 N/A LYS 544.A N SER 540.A O no hydrogen 2.907 N/A GLU 545.A N ASP 541.A O no hydrogen 2.944 N/A SER 546.A N LEU 542.A O no hydrogen 2.876 N/A SER 546.A OG LEU 542.A O no hydrogen 2.951 N/A SER 546.A OG ARG 543.A O no hydrogen 2.813 N/A MET 547.A N ARG 543.A O no hydrogen 2.934 N/A ALA 548.A N LYS 544.A O no hydrogen 2.896 N/A THR 549.A N GLU 545.A O no hydrogen 2.916 N/A THR 549.A OG1 GLU 545.A O no hydrogen 3.098 N/A THR 549.A OG1 SER 546.A O no hydrogen 2.570 N/A GLY 550.A N SER 546.A O no hydrogen 2.741 N/A VAL 556.A N THR 555.A OG1 no hydrogen 2.556 N/A GLU 560.A N VAL 556.A O no hydrogen 2.938 N/A SER 561.A N ARG 557.A O no hydrogen 2.887 N/A SER 561.A OG ARG 557.A O no hydrogen 2.788 N/A MET 562.A N HIS 558.A O no hydrogen 2.896 N/A ILE 563.A N ILE 559.A O no hydrogen 2.927 N/A ARG 564.A N GLU 560.A O no hydrogen 2.913 N/A ARG 564.A NE ASP 325.A O no hydrogen 3.095 N/A ARG 564.A NH2 ASP 467.A OD2 no hydrogen 2.616 N/A MET 565.A N SER 561.A O no hydrogen 2.894 N/A ALA 566.A N MET 562.A O no hydrogen 2.881 N/A GLU 567.A N ILE 563.A O no hydrogen 2.942 N/A ALA 568.A N ARG 564.A O no hydrogen 2.914 N/A HIS 569.A N MET 565.A O no hydrogen 2.881 N/A HIS 569.A ND1 ASP 582.A OD1 no hydrogen 2.259 N/A ALA 570.A N ALA 566.A O no hydrogen 2.923 N/A ARG 571.A N GLU 567.A O no hydrogen 2.898 N/A ARG 571.A NH1 GLY 311.A O no hydrogen 2.306 N/A ILE 572.A N ALA 568.A O no hydrogen 2.933 N/A ILE 572.A N HIS 569.A O no hydrogen 3.214 N/A LEU 574.A N ARG 571.A O no hydrogen 3.011 N/A ARG 575.A N ALA 570.A O no hydrogen 3.052 N/A ARG 575.A NH1 ASP 582.A OD2 no hydrogen 3.198 N/A VAL 578.A N LYS 526.A O no hydrogen 2.962 N/A ILE 579.A N ASP 582.A OD2 no hydrogen 3.419 N/A ASN 584.A N GLU 580.A O no hydrogen 2.903 N/A ASN 584.A ND2 GLU 580.A O no hydrogen 3.032 N/A MET 585.A N ASP 581.A O no hydrogen 2.921 N/A ALA 586.A N ASP 582.A O no hydrogen 2.914 N/A ILE 587.A N VAL 583.A O no hydrogen 2.881 N/A ARG 588.A N ASN 584.A O no hydrogen 2.891 N/A ARG 588.A NE GLU 592.A OE2 no hydrogen 2.993 N/A VAL 589.A N MET 585.A O no hydrogen 2.950 N/A MET 590.A N ALA 586.A O no hydrogen 2.895 N/A LEU 591.A N ILE 587.A O no hydrogen 2.880 N/A GLU 592.A N ARG 588.A O no hydrogen 2.901 N/A SER 593.A N VAL 589.A O no hydrogen 2.955 N/A PHE 594.A N MET 590.A O no hydrogen 2.913 N/A ILE 595.A N LEU 591.A O no hydrogen 2.871 N/A ASP 596.A N GLU 592.A O no hydrogen 2.911 N/A THR 597.A N SER 593.A O no hydrogen 2.945 N/A THR 597.A OG1 SER 593.A O no hydrogen 3.338 N/A THR 597.A OG1 PHE 594.A O no hydrogen 2.375 N/A MET 603.A N LYS 599.A O no hydrogen 2.857 N/A ARG 604.A N PHE 600.A O no hydrogen 2.902 N/A SER 605.A N SER 601.A O no hydrogen 2.935 N/A SER 605.A OG SER 601.A O no hydrogen 3.144 N/A SER 605.A OG VAL 602.A O no hydrogen 2.722 N/A MET 606.A N VAL 602.A O no hydrogen 2.911 N/A ARG 607.A N MET 603.A O no hydrogen 2.889 N/A ARG 607.A NH2 ASP 596.A OD1 no hydrogen 3.160 N/A LYS 608.A N ARG 604.A O no hydrogen 2.923 N/A THR 609.A N SER 605.A O no hydrogen 2.915 N/A THR 609.A OG1 SER 605.A O no hydrogen 2.784 N/A PHE 610.A N MET 606.A O no hydrogen 2.988 N/A LEU 614.A N PHE 610.A O no hydrogen 3.283 N/A SER 615.A N ARG 612.A O no hydrogen 3.202 N/A SER 615.A OG ALA 611.A O no hydrogen 2.999 N/A SER 615.A OG ARG 612.A O no hydrogen 2.584 N/A PHE 616.A N TYR 613.A O no hydrogen 3.235 N/A ARG 617.A NH1 ASP 581.A OD1 no hydrogen 2.990 N/A ARG 618.A N SER 615.A O no hydrogen 3.251 N/A ARG 618.A NE LEU 614.A O no hydrogen 2.653 N/A ARG 618.A NH2 GLU 592.A OE2 no hydrogen 2.961 N/A ASN 621.A N ASP 619.A OD1 no hydrogen 2.965 N/A ASN 621.A ND2 ASP 619.A OD1 no hydrogen 2.529 N/A ASN 621.A ND2 ASP 619.A OD2 no hydrogen 3.342 N/A LEU 623.A N ASP 619.A O no hydrogen 3.359 N/A LEU 624.A N ASN 620.A O no hydrogen 2.922 N/A LEU 625.A N ASN 621.A O no hydrogen 2.870 N/A PHE 626.A N GLU 622.A O no hydrogen 2.883 N/A ILE 627.A N LEU 623.A O no hydrogen 2.942 N/A LEU 628.A N LEU 624.A O no hydrogen 2.892 N/A LYS 629.A N LEU 625.A O no hydrogen 2.847 N/A GLN 630.A N PHE 626.A O no hydrogen 2.922 N/A LEU 631.A N ILE 627.A O no hydrogen 2.937 N/A VAL 632.A N LEU 628.A O no hydrogen 2.873 N/A ALA 633.A N LYS 629.A O no hydrogen 2.870 N/A GLU 634.A N GLN 630.A O no hydrogen 2.941 N/A GLN 635.A N LEU 631.A O no hydrogen 2.924 N/A VAL 636.A N VAL 632.A O no hydrogen 2.874 N/A THR 637.A N ALA 633.A O no hydrogen 2.895 N/A THR 637.A OG1 ALA 633.A O no hydrogen 2.705 N/A TYR 638.A N GLU 634.A O no hydrogen 2.931 N/A GLN 639.A N GLN 635.A O no hydrogen 2.908 N/A ARG 640.A N VAL 636.A O no hydrogen 2.882 N/A ASN 641.A N THR 637.A O no hydrogen 2.916 N/A ASN 641.A ND2 THR 637.A O no hydrogen 2.957 N/A ARG 642.A N TYR 638.A O no hydrogen 2.920 N/A ARG 642.A NH1 TYR 638.A OH no hydrogen 2.537 N/A PHE 643.A N GLN 639.A O no hydrogen 2.860 N/A