Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8p0x_O.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A N HIS 829.A O no hydrogen 3.038 N/A GLU 16.A N ASN 12.A O no hydrogen 2.400 N/A PHE 17.A N TYR 13.A O no hydrogen 2.779 N/A ALA 18.A N LYS 14.A O no hydrogen 2.742 N/A SER 19.A N ALA 15.A O no hydrogen 2.907 N/A CYS 20.A N GLU 16.A O no hydrogen 2.909 N/A ARG 21.A N PHE 17.A O no hydrogen 2.253 N/A ASP 31.A N GLU 28.A O no hydrogen 2.908 N/A LYS 36.A N HIS 33.A O no hydrogen 2.567 N/A PHE 42.A N GLY 39.A O no hydrogen 2.898 N/A ASN 47.A N PRO 44.A O no hydrogen 3.273 N/A ARG 49.A N TRP 45.A O no hydrogen 2.776 N/A GLY 50.A N THR 46.A O no hydrogen 2.856 N/A GLU 51.A N ASN 47.A O no hydrogen 3.032 N/A ILE 52.A N LYS 48.A O no hydrogen 2.822 N/A LEU 53.A N ARG 49.A O no hydrogen 2.850 N/A ALA 54.A N GLY 50.A O no hydrogen 2.962 N/A ARG 55.A N GLU 51.A O no hydrogen 2.919 N/A TYR 56.A N ILE 52.A O no hydrogen 2.785 N/A THR 57.A N ARG 55.A O no hydrogen 2.693 N/A LEU 62.A N LEU 107.A O no hydrogen 2.862 N/A ILE 64.A N LEU 104.A O no hydrogen 2.724 N/A LEU 66.A N LYS 102.A O no hydrogen 2.984 N/A MET 68.A N SER 100.A O no hydrogen 2.597 N/A LYS 85.A N ALA 81.A O no hydrogen 2.234 N/A VAL 86.A N MET 82.A O no hydrogen 2.935 N/A ARG 87.A N SER 83.A O no hydrogen 2.913 N/A THR 88.A N GLU 84.A O no hydrogen 2.730 N/A ARG 89.A N LYS 85.A O no hydrogen 3.004 N/A GLU 91.A N ARG 87.A O no hydrogen 2.877 N/A GLU 92.A N THR 88.A O no hydrogen 2.955 N/A ASP 94.A N LEU 90.A O no hydrogen 2.888 N/A ASP 95.A N GLU 92.A O no hydrogen 3.190 N/A GLU 97.A N ASP 94.A O no hydrogen 2.744 N/A GLU 98.A N ASP 94.A O no hydrogen 2.915 N/A GLY 99.A N PHE 96.A O no hydrogen 3.204 N/A LYS 102.A N LEU 66.A O no hydrogen 2.876 N/A LEU 104.A N ILE 64.A O no hydrogen 2.586 N/A LEU 107.A N LEU 62.A O no hydrogen 2.254 N/A TYR 112.A N THR 108.A O no hydrogen 3.156 N/A VAL 113.A N GLN 109.A O no hydrogen 2.965 N/A ASN 114.A N GLN 110.A O no hydrogen 2.844 N/A ARG 115.A N ASP 111.A O no hydrogen 2.951 N/A ILE 116.A N TYR 112.A O no hydrogen 2.887 N/A GLU 117.A N VAL 113.A O no hydrogen 2.844 N/A GLU 118.A N ASN 114.A O no hydrogen 2.825 N/A LEU 119.A N ARG 115.A O no hydrogen 3.006 N/A ASN 120.A N ILE 116.A O no hydrogen 2.803 N/A GLN 121.A N GLU 117.A O no hydrogen 2.865 N/A SER 122.A N GLU 118.A O no hydrogen 2.958 N/A LEU 123.A N LEU 119.A O no hydrogen 2.912 N/A LYS 124.A N ASN 120.A O no hydrogen 2.881 N/A ASP 125.A N GLN 121.A O no hydrogen 2.857 N/A ALA 126.A N SER 122.A O no hydrogen 2.931 N/A TRP 127.A N LEU 123.A O no hydrogen 2.866 N/A ALA 128.A N LYS 124.A O no hydrogen 2.844 N/A SER 129.A N ASP 125.A O no hydrogen 2.514 N/A ASP 130.A N TRP 127.A O no hydrogen 2.884 N/A LYS 132.A N ASP 130.A O no hydrogen 2.618 N/A ALA 135.A N GLN 131.A O no hydrogen 2.423 N/A LEU 136.A N LYS 132.A O no hydrogen 2.847 N/A LYS 137.A N VAL 133.A O no hydrogen 2.868 N/A ILE 138.A N LYS 134.A O no hydrogen 2.912 N/A VAL 139.A N ALA 135.A O no hydrogen 2.881 N/A ILE 140.A N LEU 136.A O no hydrogen 2.853 N/A GLN 141.A N LYS 137.A O no hydrogen 2.895 N/A CYS 142.A N ILE 138.A O no hydrogen 2.919 N/A SER 143.A N VAL 139.A O no hydrogen 2.952 N/A LYS 144.A N ILE 140.A O no hydrogen 2.889 N/A LEU 145.A N GLN 141.A O no hydrogen 2.877 N/A LEU 146.A N CYS 142.A O no hydrogen 2.915 N/A SER 147.A N SER 143.A O no hydrogen 2.876 N/A ASP 148.A N LYS 144.A O no hydrogen 3.110 N/A ASP 148.A N LEU 145.A O no hydrogen 3.116 N/A TYR 155.A N VAL 151.A O no hydrogen 2.760 N/A SER 157.A N PHE 154.A O no hydrogen 2.741 N/A LYS 158.A N PHE 154.A O no hydrogen 3.352 N/A PHE 159.A N TYR 155.A O no hydrogen 2.859 N/A VAL 160.A N PRO 156.A O no hydrogen 2.861 N/A LEU 161.A N SER 157.A O no hydrogen 2.940 N/A ILE 162.A N LYS 158.A O no hydrogen 2.929 N/A THR 163.A N PHE 159.A O no hydrogen 2.817 N/A ASP 164.A N VAL 160.A O no hydrogen 2.894 N/A ILE 165.A N LEU 161.A O no hydrogen 2.927 N/A LEU 166.A N ILE 162.A O no hydrogen 2.849 N/A ASP 167.A N THR 163.A O no hydrogen 2.807 N/A THR 168.A N ASP 164.A O no hydrogen 3.024 N/A PHE 169.A N ILE 165.A O no hydrogen 2.902 N/A GLY 170.A N LEU 166.A O no hydrogen 2.776 N/A LYS 171.A N ASP 167.A O no hydrogen 2.887 N/A LEU 172.A N THR 168.A O no hydrogen 2.886 N/A VAL 173.A N PHE 169.A O no hydrogen 2.806 N/A TYR 174.A N GLY 170.A O no hydrogen 2.912 N/A GLU 175.A N LYS 171.A O no hydrogen 2.943 N/A ARG 176.A N LEU 172.A O no hydrogen 2.865 N/A ILE 177.A N VAL 173.A O no hydrogen 2.963 N/A PHE 178.A N TYR 174.A O no hydrogen 2.873 N/A SER 179.A N GLU 175.A O no hydrogen 2.879 N/A MET 180.A N ARG 176.A O no hydrogen 2.879 N/A CYS 181.A N ILE 177.A O no hydrogen 2.814 N/A VAL 182.A N PHE 178.A O no hydrogen 2.385 N/A PHE 192.A N PRO 189.A O no hydrogen 3.053 N/A ASN 196.A N SER 193.A O no hydrogen 2.902 N/A ALA 197.A N PRO 194.A O no hydrogen 3.343 N/A LYS 202.A N ASN 198.A O no hydrogen 2.762 N/A GLU 203.A N ASP 199.A O no hydrogen 2.912 N/A THR 204.A N THR 200.A O no hydrogen 2.872 N/A CYS 205.A N ALA 201.A O no hydrogen 2.939 N/A LEU 206.A N LYS 202.A O no hydrogen 2.800 N/A ASN 207.A N GLU 203.A O no hydrogen 2.834 N/A TRP 208.A N THR 204.A O no hydrogen 3.013 N/A PHE 209.A N CYS 205.A O no hydrogen 2.835 N/A PHE 210.A N LEU 206.A O no hydrogen 2.795 N/A LYS 211.A N ASN 207.A O no hydrogen 2.929 N/A ILE 212.A N TRP 208.A O no hydrogen 2.936 N/A ALA 213.A N PHE 209.A O no hydrogen 2.801 N/A SER 214.A N PHE 210.A O no hydrogen 2.659 N/A ILE 215.A N ILE 212.A O no hydrogen 2.881 N/A ARG 221.A N GLU 217.A O no hydrogen 3.356 N/A PHE 222.A N LEU 218.A O no hydrogen 2.894 N/A TYR 223.A N ILE 219.A O no hydrogen 3.053 N/A VAL 224.A N PRO 220.A O no hydrogen 2.902 N/A GLU 225.A N ARG 221.A O no hydrogen 2.972 N/A ALA 226.A N PHE 222.A O no hydrogen 2.963 N/A ILE 228.A N VAL 224.A O no hydrogen 2.918 N/A LEU 229.A N GLU 225.A O no hydrogen 2.914 N/A LYS 230.A N SER 227.A O no hydrogen 2.937 N/A ASN 232.A N ILE 228.A O no hydrogen 3.011 N/A ASN 232.A N LEU 229.A O no hydrogen 3.143 N/A LYS 233.A N LYS 230.A O no hydrogen 2.870 N/A PHE 234.A N CYS 231.A O no hydrogen 2.642 N/A LEU 235.A N ASN 232.A O no hydrogen 2.641 N/A SER 236.A N ASN 232.A O no hydrogen 2.322 N/A ILE 240.A N SER 236.A O no hydrogen 3.392 N/A ILE 240.A N LYS 237.A O no hydrogen 3.296 N/A GLU 242.A N THR 238.A O no hydrogen 2.832 N/A CYS 243.A N GLY 239.A O no hydrogen 2.847 N/A LEU 244.A N ILE 240.A O no hydrogen 3.035 N/A LEU 244.A N SER 241.A O no hydrogen 3.025 N/A ARG 246.A N GLU 242.A O no hydrogen 3.396 N/A LEU 247.A N CYS 243.A O no hydrogen 2.400 N/A THR 248.A N LEU 244.A O no hydrogen 2.857 N/A CYS 249.A N PRO 245.A O no hydrogen 2.884 N/A MET 250.A N ARG 246.A O no hydrogen 2.660 N/A ILE 251.A N LEU 247.A O no hydrogen 2.512 N/A ARG 252.A N CYS 249.A O no hydrogen 3.099 N/A GLY 253.A N MET 250.A O no hydrogen 3.083 N/A ILE 254.A N ILE 251.A O no hydrogen 3.039 N/A SER 260.A N ASP 256.A O no hydrogen 3.065 N/A VAL 261.A N PRO 257.A O no hydrogen 2.873 N/A TYR 262.A N LEU 258.A O no hydrogen 2.923 N/A ALA 263.A N VAL 259.A O no hydrogen 2.777 N/A ARG 264.A N SER 260.A O no hydrogen 2.944 N/A ALA 265.A N VAL 261.A O no hydrogen 2.882 N/A TYR 266.A N TYR 262.A O no hydrogen 2.902 N/A LEU 267.A N ALA 263.A O no hydrogen 2.911 N/A CYS 268.A N ARG 264.A O no hydrogen 2.816 N/A ARG 269.A N ALA 265.A O no hydrogen 2.981 N/A VAL 270.A N TYR 266.A O no hydrogen 2.979 N/A GLY 271.A N LEU 267.A O no hydrogen 2.797 N/A MET 272.A N CYS 268.A O no hydrogen 2.886 N/A GLU 273.A N ARG 269.A O no hydrogen 2.987 N/A VAL 274.A N VAL 270.A O no hydrogen 2.917 N/A ALA 275.A N GLY 271.A O no hydrogen 3.214 N/A LYS 279.A N PRO 276.A O no hydrogen 2.876 N/A THR 281.A N HIS 277.A O no hydrogen 3.083 N/A LEU 282.A N LEU 278.A O no hydrogen 2.830 N/A ASN 283.A N LYS 279.A O no hydrogen 2.847 N/A LYS 284.A N GLU 280.A O no hydrogen 3.039 N/A ASN 285.A N THR 281.A O no hydrogen 2.877 N/A PHE 286.A N LEU 282.A O no hydrogen 2.777 N/A PHE 287.A N ASN 283.A O no hydrogen 2.913 N/A ASP 288.A N LYS 284.A O no hydrogen 3.026 N/A PHE 289.A N ASN 285.A O no hydrogen 2.784 N/A LEU 290.A N PHE 286.A O no hydrogen 2.921 N/A THR 292.A N ASP 288.A O no hydrogen 2.972 N/A PHE 293.A N PHE 289.A O no hydrogen 2.809 N/A LYS 294.A N LEU 290.A O no hydrogen 2.977 N/A GLN 295.A N LEU 291.A O no hydrogen 2.913 N/A ILE 296.A N THR 292.A O no hydrogen 2.800 N/A HIS 297.A N PHE 293.A O no hydrogen 3.029 N/A GLY 298.A N GLN 295.A O no hydrogen 2.451 N/A VAL 301.A N GLY 298.A O no hydrogen 3.262 N/A ASN 303.A N ASP 299.A O no hydrogen 2.847 N/A GLN 304.A N THR 300.A O no hydrogen 2.951 N/A LEU 305.A N VAL 301.A O no hydrogen 2.898 N/A VAL 306.A N GLN 302.A O no hydrogen 2.936 N/A VAL 307.A N ASN 303.A O no hydrogen 2.851 N/A GLN 308.A N GLN 304.A O no hydrogen 2.960 N/A GLY 309.A N LEU 305.A O no hydrogen 2.511 N/A VAL 310.A N LEU 305.A O no hydrogen 3.238 N/A TYR 315.A N GLU 311.A O no hydrogen 2.673 N/A LEU 316.A N LEU 312.A O no hydrogen 2.553 N/A LEU 318.A N TYR 315.A O no hydrogen 3.260 N/A TYR 319.A N LEU 316.A O no hydrogen 3.313 N/A MET 323.A N TYR 319.A O no hydrogen 3.070 N/A ASP 324.A N PRO 320.A O no hydrogen 2.774 N/A TRP 325.A N PRO 321.A O no hydrogen 2.985 N/A ILE 326.A N ALA 322.A O no hydrogen 2.941 N/A PHE 327.A N MET 323.A O no hydrogen 2.836 N/A GLN 328.A N ASP 324.A O no hydrogen 2.848 N/A CYS 329.A N TRP 325.A O no hydrogen 2.881 N/A ILE 330.A N ILE 326.A O no hydrogen 2.939 N/A SER 331.A N PHE 327.A O no hydrogen 2.761 N/A TYR 332.A N GLN 328.A O no hydrogen 2.901 N/A ALA 334.A N SER 331.A O no hydrogen 3.143 N/A LEU 339.A N PRO 335.A O no hydrogen 2.776 N/A THR 340.A N GLU 336.A O no hydrogen 2.797 N/A GLU 341.A N ALA 337.A O no hydrogen 2.918 N/A MET 342.A N LEU 338.A O no hydrogen 2.876 N/A MET 343.A N LEU 339.A O no hydrogen 2.912 N/A GLU 344.A N THR 340.A O no hydrogen 2.837 N/A ARG 345.A N GLU 341.A O no hydrogen 3.022 N/A CYS 346.A N MET 342.A O no hydrogen 2.932 N/A LYS 347.A N MET 343.A O no hydrogen 2.781 N/A LYS 348.A N GLU 344.A O no hydrogen 2.868 N/A LEU 349.A N ARG 345.A O no hydrogen 2.890 N/A LEU 356.A N ASN 352.A O no hydrogen 2.926 N/A ASN 357.A N ALA 353.A O no hydrogen 2.914 N/A SER 358.A N LEU 354.A O no hydrogen 2.963 N/A VAL 359.A N LEU 355.A O no hydrogen 2.877 N/A MET 360.A N LEU 356.A O no hydrogen 2.870 N/A SER 361.A N ASN 357.A O no hydrogen 2.897 N/A ALA 362.A N SER 358.A O no hydrogen 2.906 N/A PHE 363.A N VAL 359.A O no hydrogen 2.639 N/A ILE 368.A N ARG 364.A O no hydrogen 2.773 N/A ALA 369.A N ALA 365.A O no hydrogen 2.718 N/A THR 370.A N GLU 366.A O no hydrogen 3.010 N/A ARG 371.A N PHE 367.A O no hydrogen 3.286 N/A SER 372.A N ALA 369.A O no hydrogen 2.987 N/A PHE 375.A N ARG 371.A O no hydrogen 2.867 N/A ILE 376.A N SER 372.A O no hydrogen 3.238 N/A ILE 376.A N MET 373.A O no hydrogen 2.981 N/A MET 378.A N ASP 374.A O no hydrogen 2.882 N/A ILE 379.A N PHE 375.A O no hydrogen 2.746 N/A LYS 380.A N ILE 376.A O no hydrogen 3.030 N/A GLU 381.A N GLY 377.A O no hydrogen 2.828 N/A CYS 382.A N ILE 379.A O no hydrogen 2.877 N/A PHE 387.A N ASP 383.A O no hydrogen 2.692 N/A LEU 392.A N PRO 388.A O no hydrogen 3.049 N/A PHE 393.A N LYS 389.A O no hydrogen 2.777 N/A ARG 394.A N HIS 390.A O no hydrogen 2.861 N/A SER 395.A N LEU 391.A O no hydrogen 3.015 N/A LEU 396.A N LEU 392.A O no hydrogen 2.899 N/A GLY 397.A N PHE 393.A O no hydrogen 2.676 N/A LEU 398.A N ARG 394.A O no hydrogen 3.080 N/A ASN 399.A N SER 395.A O no hydrogen 3.009 N/A LEU 400.A N LEU 396.A O no hydrogen 2.738 N/A ALA 401.A N GLY 397.A O no hydrogen 2.925 N/A LEU 402.A N LEU 398.A O no hydrogen 3.077 N/A ALA 403.A N ASN 399.A O no hydrogen 2.833 N/A ARG 410.A N PRO 406.A O no hydrogen 2.772 N/A LEU 411.A N GLU 407.A O no hydrogen 2.831 N/A GLN 412.A N SER 408.A O no hydrogen 2.949 N/A ILE 413.A N ASP 409.A O no hydrogen 2.837 N/A LEU 414.A N ARG 410.A O no hydrogen 2.767 N/A ASN 415.A N LEU 411.A O no hydrogen 2.984 N/A GLU 416.A N GLN 412.A O no hydrogen 2.866 N/A ALA 417.A N ILE 413.A O no hydrogen 2.808 N/A TRP 418.A N LEU 414.A O no hydrogen 2.924 N/A LYS 419.A N ASN 415.A O no hydrogen 2.945 N/A VAL 420.A N GLU 416.A O no hydrogen 3.002 N/A ILE 421.A N ALA 417.A O no hydrogen 2.589 N/A THR 422.A N TRP 418.A O no hydrogen 2.653 N/A LYS 423.A N VAL 420.A O no hydrogen 2.933 N/A LEU 424.A N ILE 421.A O no hydrogen 2.844 N/A TYR 430.A N ASN 426.A O no hydrogen 2.786 N/A ILE 431.A N PRO 427.A O no hydrogen 2.813 N/A ASN 432.A N GLN 428.A O no hydrogen 2.852 N/A CYS 433.A N ASP 429.A O no hydrogen 3.053 N/A ALA 434.A N TYR 430.A O no hydrogen 2.897 N/A GLU 435.A N ILE 431.A O no hydrogen 2.868 N/A TRP 437.A N CYS 433.A O no hydrogen 3.106 N/A VAL 438.A N ALA 434.A O no hydrogen 2.823 N/A GLU 439.A N VAL 436.A O no hydrogen 3.346 N/A THR 441.A N TRP 437.A O no hydrogen 2.936 N/A CYS 442.A N VAL 438.A O no hydrogen 2.833 N/A LYS 443.A N GLU 439.A O no hydrogen 2.847 N/A HIS 444.A N TYR 440.A O no hydrogen 3.041 N/A PHE 445.A N THR 441.A O no hydrogen 2.723 N/A VAL 450.A N THR 446.A O no hydrogen 2.904 N/A ASN 451.A N LYS 447.A O no hydrogen 2.826 N/A THR 452.A N ARG 448.A O no hydrogen 2.891 N/A VAL 453.A N GLU 449.A O no hydrogen 2.995 N/A LEU 454.A N VAL 450.A O no hydrogen 2.803 N/A ALA 455.A N ASN 451.A O no hydrogen 2.941 N/A ASP 456.A N THR 452.A O no hydrogen 3.017 N/A VAL 457.A N VAL 453.A O no hydrogen 2.923 N/A ILE 458.A N LEU 454.A O no hydrogen 2.917 N/A LYS 459.A N ALA 455.A O no hydrogen 2.905 N/A HIS 460.A N ASP 456.A O no hydrogen 2.879 N/A MET 461.A N VAL 457.A O no hydrogen 2.721 N/A ALA 466.A N PRO 463.A O no hydrogen 2.837 N/A GLU 468.A N ASP 464.A O no hydrogen 2.788 N/A ASP 469.A N ARG 465.A O no hydrogen 2.823 N/A SER 470.A N ALA 466.A O no hydrogen 2.640 N/A TYR 471.A N GLU 468.A O no hydrogen 2.995 N/A LEU 474.A N SER 470.A O no hydrogen 3.249 N/A GLN 475.A N TYR 471.A O no hydrogen 2.849 N/A LEU 476.A N PRO 472.A O no hydrogen 2.901 N/A ILE 477.A N GLN 473.A O no hydrogen 2.804 N/A ILE 478.A N LEU 474.A O no hydrogen 2.895 N/A LYS 479.A N GLN 475.A O no hydrogen 2.877 N/A LYS 480.A N LEU 476.A O no hydrogen 2.907 N/A VAL 481.A N ILE 477.A O no hydrogen 2.915 N/A ILE 482.A N ILE 478.A O no hydrogen 2.777 N/A ALA 483.A N LYS 479.A O no hydrogen 2.871 N/A HIS 484.A N LYS 480.A O no hydrogen 2.871 N/A PHE 485.A N ILE 482.A O no hydrogen 2.884 N/A LEU 491.A N ASP 487.A O no hydrogen 3.153 N/A PHE 492.A N PHE 488.A O no hydrogen 3.092 N/A SER 493.A N SER 489.A O no hydrogen 2.733 N/A VAL 494.A N VAL 490.A O no hydrogen 2.799 N/A GLU 495.A N LEU 491.A O no hydrogen 2.921 N/A LYS 496.A N VAL 494.A O no hydrogen 2.468 N/A LEU 498.A N GLU 495.A O no hydrogen 2.470 N/A PHE 500.A N LYS 496.A O no hydrogen 2.813 N/A LEU 501.A N PHE 497.A O no hydrogen 2.720 N/A ASP 502.A N LEU 498.A O no hydrogen 2.849 N/A MET 503.A N PRO 499.A O no hydrogen 2.760 N/A MET 503.A N PHE 500.A O no hydrogen 2.979 N/A PHE 504.A N LEU 501.A O no hydrogen 3.047 N/A ARG 510.A N LYS 506.A O no hydrogen 3.162 N/A VAL 511.A N GLU 507.A O no hydrogen 2.839 N/A GLU 512.A N SER 508.A O no hydrogen 2.796 N/A VAL 513.A N VAL 509.A O no hydrogen 3.030 N/A CYS 514.A N ARG 510.A O no hydrogen 2.841 N/A LYS 515.A N VAL 511.A O no hydrogen 2.834 N/A CYS 516.A N GLU 512.A O no hydrogen 3.059 N/A ILE 517.A N VAL 513.A O no hydrogen 2.758 N/A MET 518.A N CYS 514.A O no hydrogen 2.880 N/A ASP 519.A N LYS 515.A O no hydrogen 3.031 N/A ALA 520.A N CYS 516.A O no hydrogen 2.944 N/A PHE 521.A N ILE 517.A O no hydrogen 2.865 N/A ILE 522.A N MET 518.A O no hydrogen 2.787 N/A LYS 523.A N ASP 519.A O no hydrogen 2.899 N/A HIS 524.A N ALA 520.A O no hydrogen 2.854 N/A GLN 525.A N PHE 521.A O no hydrogen 2.488 N/A LEU 535.A N ASP 531.A O no hydrogen 2.556 N/A ASN 536.A N PRO 532.A O no hydrogen 2.775 N/A ALA 537.A N VAL 533.A O no hydrogen 2.999 N/A LEU 538.A N ILE 534.A O no hydrogen 2.921 N/A LEU 539.A N LEU 535.A O no hydrogen 2.759 N/A HIS 540.A N ASN 536.A O no hydrogen 2.844 N/A VAL 541.A N ALA 537.A O no hydrogen 2.976 N/A CYS 542.A N LEU 538.A O no hydrogen 2.794 N/A LYS 543.A N LEU 539.A O no hydrogen 2.817 N/A THR 544.A N HIS 540.A O no hydrogen 2.812 N/A MET 545.A N VAL 541.A O no hydrogen 2.887 N/A HIS 546.A N CYS 542.A O no hydrogen 2.828 N/A ASP 547.A N LYS 543.A O no hydrogen 2.865 N/A SER 548.A N THR 544.A O no hydrogen 2.838 N/A VAL 549.A N HIS 546.A O no hydrogen 3.129 N/A LYS 558.A N LEU 554.A O no hydrogen 2.801 N/A ARG 559.A N GLU 555.A O no hydrogen 2.821 N/A MET 560.A N ASP 556.A O no hydrogen 2.882 N/A LEU 561.A N GLU 557.A O no hydrogen 2.881 N/A SER 562.A N LYS 558.A O no hydrogen 2.895 N/A TYR 563.A N ARG 559.A O no hydrogen 2.862 N/A LEU 564.A N MET 560.A O no hydrogen 2.867 N/A ILE 565.A N LEU 561.A O no hydrogen 2.909 N/A ASN 566.A N SER 562.A O no hydrogen 2.729 N/A GLY 567.A N TYR 563.A O no hydrogen 2.904 N/A GLY 567.A N LEU 564.A O no hydrogen 3.082 N/A PHE 568.A N LEU 564.A O no hydrogen 3.424 N/A ILE 569.A N ILE 565.A O no hydrogen 3.063 N/A LYS 570.A N GLY 567.A O no hydrogen 2.933 N/A VAL 572.A N ILE 569.A O no hydrogen 2.962 N/A SER 573.A N THR 529.A O no hydrogen 2.910 N/A ASP 577.A N GLY 575.A O no hydrogen 2.660 N/A GLN 581.A N ASP 577.A O no hydrogen 2.487 N/A LEU 582.A N PHE 578.A O no hydrogen 2.793 N/A SER 583.A N GLU 579.A O no hydrogen 2.772 N/A PHE 584.A N GLN 580.A O no hydrogen 2.913 N/A TYR 585.A N GLN 581.A O no hydrogen 2.869 N/A VAL 586.A N LEU 582.A O no hydrogen 2.924 N/A GLU 587.A N SER 583.A O no hydrogen 2.883 N/A SER 588.A N PHE 584.A O no hydrogen 2.916 N/A ARG 589.A N TYR 585.A O no hydrogen 2.877 N/A SER 590.A N VAL 586.A O no hydrogen 2.814 N/A MET 591.A N GLU 587.A O no hydrogen 2.911 N/A MET 591.A N SER 588.A O no hydrogen 3.229 N/A PHE 592.A N SER 588.A O no hydrogen 2.686 N/A CYS 593.A N MET 591.A O no hydrogen 2.722 N/A LEU 599.A N LEU 595.A O no hydrogen 3.232 N/A VAL 600.A N GLU 596.A O no hydrogen 2.773 N/A GLN 601.A N PRO 597.A O no hydrogen 2.875 N/A LEU 602.A N VAL 598.A O no hydrogen 2.894 N/A ILE 603.A N LEU 599.A O no hydrogen 2.866 N/A HIS 604.A N VAL 600.A O no hydrogen 2.899 N/A SER 605.A N GLN 601.A O no hydrogen 3.021 N/A VAL 606.A N LEU 602.A O no hydrogen 3.002 N/A ASN 607.A N ILE 603.A O no hydrogen 2.833 N/A ARG 608.A N HIS 604.A O no hydrogen 2.793 N/A LEU 609.A N SER 605.A O no hydrogen 2.934 N/A ALA 610.A N VAL 606.A O no hydrogen 2.892 N/A MET 611.A N ASN 607.A O no hydrogen 2.758 N/A GLU 612.A N ARG 608.A O no hydrogen 2.951 N/A THR 613.A N LEU 609.A O no hydrogen 2.762 N/A ARG 614.A N ALA 610.A O no hydrogen 2.929 N/A LYS 615.A N MET 611.A O no hydrogen 2.954 N/A VAL 616.A N GLU 612.A O no hydrogen 2.753 N/A MET 617.A N THR 613.A O no hydrogen 2.994 N/A LYS 618.A N ARG 614.A O no hydrogen 3.181 N/A ASN 620.A N MET 617.A O no hydrogen 2.822 N/A ALA 626.A N SER 622.A O no hydrogen 3.153 N/A ALA 627.A N ARG 623.A O no hydrogen 2.939 N/A PHE 628.A N LYS 624.A O no hydrogen 2.822 N/A VAL 629.A N THR 625.A O no hydrogen 2.847 N/A ARG 630.A N ALA 626.A O no hydrogen 2.927 N/A ALA 631.A N ALA 627.A O no hydrogen 2.850 N/A CYS 632.A N PHE 628.A O no hydrogen 2.928 N/A VAL 633.A N VAL 629.A O no hydrogen 2.862 N/A ALA 634.A N ARG 630.A O no hydrogen 2.942 N/A TYR 635.A N ALA 631.A O no hydrogen 2.893 N/A CYS 636.A N CYS 632.A O no hydrogen 2.914 N/A PHE 637.A N VAL 633.A O no hydrogen 2.895 N/A ILE 638.A N ALA 634.A O no hydrogen 2.732 N/A THR 639.A N TYR 635.A O no hydrogen 3.041 N/A ILE 640.A N CYS 636.A O no hydrogen 3.160 N/A LEU 643.A N THR 639.A O no hydrogen 3.211 N/A LEU 643.A N ILE 640.A O no hydrogen 3.124 N/A ARG 649.A N GLY 645.A O no hydrogen 2.801 N/A LEU 650.A N ILE 646.A O no hydrogen 2.758 N/A ASN 651.A N PHE 647.A O no hydrogen 2.945 N/A LEU 652.A N THR 648.A O no hydrogen 2.793 N/A TYR 653.A N ARG 649.A O no hydrogen 2.811 N/A LEU 654.A N LEU 650.A O no hydrogen 2.976 N/A HIS 655.A N ASN 651.A O no hydrogen 2.767 N/A SER 656.A N LEU 652.A O no hydrogen 2.702 N/A GLY 657.A N TYR 653.A O no hydrogen 2.707 N/A GLN 658.A N LEU 654.A O no hydrogen 2.814 N/A VAL 659.A N HIS 655.A O no hydrogen 2.894 N/A ALA 660.A N SER 656.A O no hydrogen 2.858 N/A LEU 661.A N GLY 657.A O no hydrogen 2.757 N/A ALA 662.A N GLN 658.A O no hydrogen 2.845 N/A ASN 663.A N VAL 659.A O no hydrogen 2.822 N/A ALA 669.A N CYS 665.A O no hydrogen 2.680 N/A ASP 670.A N LEU 666.A O no hydrogen 2.921 N/A ALA 671.A N SER 667.A O no hydrogen 2.824 N/A PHE 672.A N GLN 668.A O no hydrogen 2.896 N/A PHE 673.A N ALA 669.A O no hydrogen 3.032 N/A PHE 673.A N ASP 670.A O no hydrogen 3.113 N/A LYS 674.A N ASP 670.A O no hydrogen 2.811 N/A ALA 675.A N ALA 671.A O no hydrogen 3.009 N/A ALA 676.A N PHE 672.A O no hydrogen 2.820 N/A ILE 677.A N PHE 673.A O no hydrogen 2.837 N/A SER 678.A N LYS 674.A O no hydrogen 2.894 N/A LEU 679.A N ALA 675.A O no hydrogen 2.749 N/A VAL 680.A N ALA 676.A O no hydrogen 2.979 N/A VAL 680.A N ILE 677.A O no hydrogen 2.767 N/A VAL 683.A N VAL 680.A O no hydrogen 3.047 N/A ILE 687.A N ARG 694.A O no hydrogen 3.034 N/A ILE 689.A N LYS 692.A O no hydrogen 2.593 N/A LYS 692.A N ILE 689.A O no hydrogen 2.533 N/A ARG 694.A N ILE 687.A O no hydrogen 2.745 N/A SER 698.A N PRO 695.A O no hydrogen 3.328 N/A LEU 700.A N SER 696.A O no hydrogen 2.986 N/A LEU 701.A N GLU 697.A O no hydrogen 2.930 N/A GLU 702.A N SER 698.A O no hydrogen 2.667 N/A PHE 703.A N PHE 699.A O no hydrogen 2.969 N/A LEU 704.A N LEU 700.A O no hydrogen 2.809 N/A CYS 705.A N LEU 701.A O no hydrogen 3.465 N/A PHE 707.A N PHE 703.A O no hydrogen 2.952 N/A PHE 708.A N LEU 704.A O no hydrogen 2.746 N/A SER 709.A N CYS 705.A O no hydrogen 2.974 N/A LEU 711.A N PHE 707.A O no hydrogen 2.912 N/A HIS 720.A N HIS 717.A O no hydrogen 2.879 N/A PHE 724.A N GLY 721.A O no hydrogen 2.450 N/A VAL 726.A N LEU 723.A O no hydrogen 2.807 N/A ARG 727.A N LEU 723.A O no hydrogen 3.329 N/A GLU 728.A N PHE 724.A O no hydrogen 2.637 N/A LEU 729.A N LEU 725.A O no hydrogen 2.287 N/A LEU 730.A N VAL 726.A O no hydrogen 2.808 N/A ASN 731.A N ARG 727.A O no hydrogen 2.739 N/A VAL 732.A N GLU 728.A O no hydrogen 2.915 N/A ILE 733.A N LEU 729.A O no hydrogen 2.957 N/A GLN 734.A N LEU 730.A O no hydrogen 2.859 N/A ASP 735.A N ASN 731.A O no hydrogen 2.818 N/A TYR 736.A N VAL 732.A O no hydrogen 2.818 N/A TYR 736.A N ILE 733.A O no hydrogen 2.830 N/A TRP 738.A N TYR 736.A O no hydrogen 2.964 N/A SER 742.A N GLU 739.A O no hydrogen 2.731 N/A ASP 743.A N ASN 741.A O no hydrogen 2.501 N/A LYS 745.A N SER 742.A O no hydrogen 3.150 N/A ARG 747.A N ASP 743.A O no hydrogen 2.836 N/A ILE 748.A N GLU 744.A O no hydrogen 2.843 N/A TYR 749.A N LYS 745.A O no hydrogen 2.864 N/A THR 750.A N ILE 746.A O no hydrogen 2.864 N/A CYS 751.A N ARG 747.A O no hydrogen 2.974 N/A VAL 752.A N ILE 748.A O no hydrogen 2.793 N/A LEU 753.A N TYR 749.A O no hydrogen 2.877 N/A HIS 754.A N THR 750.A O no hydrogen 2.799 N/A LEU 755.A N CYS 751.A O no hydrogen 2.926 N/A LEU 756.A N VAL 752.A O no hydrogen 2.807 N/A SER 757.A N LEU 753.A O no hydrogen 2.790 N/A ALA 758.A N HIS 754.A O no hydrogen 2.984 N/A MET 759.A N LEU 755.A O no hydrogen 2.806 N/A SER 760.A N LEU 756.A O no hydrogen 2.824 N/A SER 760.A N SER 757.A O no hydrogen 3.064 N/A GLN 761.A N ALA 758.A O no hydrogen 2.920 N/A ILE 768.A N VAL 771.A O no hydrogen 3.274 N/A VAL 771.A N ILE 768.A O no hydrogen 2.725 N/A LEU 777.A N ASN 774.A O no hydrogen 2.635 N/A GLY 779.A N ASP 775.A O no hydrogen 3.233 N/A LEU 785.A N ASP 781.A O no hydrogen 2.494 N/A ALA 786.A N SER 782.A O no hydrogen 2.798 N/A GLU 787.A N PHE 784.A O no hydrogen 2.954 N/A ASN 789.A N LEU 785.A O no hydrogen 2.866 N/A LYS 790.A N ALA 786.A O no hydrogen 2.705 N/A LEU 791.A N GLU 787.A O no hydrogen 3.046 N/A CYS 792.A N ASN 788.A O no hydrogen 2.845 N/A GLU 793.A N ASN 789.A O no hydrogen 2.801 N/A THR 794.A N LYS 790.A O no hydrogen 2.878 N/A VAL 795.A N LEU 791.A O no hydrogen 2.991 N/A MET 796.A N CYS 792.A O no hydrogen 2.727 N/A ALA 797.A N GLU 793.A O no hydrogen 2.907 N/A GLN 798.A N THR 794.A O no hydrogen 3.002 N/A ILE 799.A N VAL 795.A O no hydrogen 2.782 N/A LEU 800.A N MET 796.A O no hydrogen 2.906 N/A GLU 801.A N ALA 797.A O no hydrogen 2.975 N/A HIS 802.A N GLN 798.A O no hydrogen 2.982 N/A LEU 803.A N ILE 799.A O no hydrogen 2.844 N/A LYS 804.A N LEU 800.A O no hydrogen 2.983 N/A THR 805.A N GLU 801.A O no hydrogen 2.938 N/A LEU 806.A N HIS 802.A O no hydrogen 2.745 N/A ALA 807.A N LEU 803.A O no hydrogen 2.939 N/A LYS 808.A N LYS 804.A O no hydrogen 2.958 N/A ASP 809.A N THR 805.A O no hydrogen 2.529 N/A GLU 810.A N ALA 807.A O no hydrogen 3.236 N/A ALA 811.A N LEU 806.A O no hydrogen 3.008 N/A GLN 815.A N ALA 811.A O no hydrogen 2.547 N/A SER 816.A N LEU 812.A O no hydrogen 2.905 N/A SER 817.A N LYS 813.A O no hydrogen 2.995 N/A LEU 818.A N ARG 814.A O no hydrogen 2.899 N/A GLY 819.A N GLN 815.A O no hydrogen 2.868 N/A LEU 820.A N SER 816.A O no hydrogen 2.959 N/A SER 821.A N SER 817.A O no hydrogen 2.894 N/A PHE 822.A N LEU 818.A O no hydrogen 2.909 N/A PHE 823.A N GLY 819.A O no hydrogen 2.797 N/A ASN 824.A N LEU 820.A O no hydrogen 2.823 N/A SER 825.A N SER 821.A O no hydrogen 2.840 N/A ILE 826.A N PHE 822.A O no hydrogen 2.749 N/A LEU 827.A N PHE 823.A O no hydrogen 2.856 N/A ALA 828.A N SER 825.A O no hydrogen 2.956 N/A HIS 829.A N ILE 826.A O no hydrogen 2.542 N/A GLY 830.A N ILE 826.A O no hydrogen 2.575 N/A ASP 831.A N HIS 7.A O no hydrogen 2.939 N/A ASN 838.A N ASN 834.A O no hydrogen 2.782 N/A GLN 839.A N ASN 835.A O no hydrogen 2.778 N/A LEU 840.A N LYS 836.A O no hydrogen 2.819 N/A SER 841.A N LEU 837.A O no hydrogen 2.817 N/A VAL 842.A N ASN 838.A O no hydrogen 2.941 N/A ASN 843.A N GLN 839.A O no hydrogen 2.749 N/A LEU 844.A N LEU 840.A O no hydrogen 2.888 N/A TRP 845.A N SER 841.A O no hydrogen 2.932 N/A HIS 846.A N VAL 842.A O no hydrogen 2.955 N/A LEU 847.A N ASN 843.A O no hydrogen 2.800 N/A ALA 848.A N LEU 844.A O no hydrogen 2.905 N/A GLN 849.A N TRP 845.A O no hydrogen 3.048 N/A GLY 852.A N GLN 849.A O no hydrogen 2.612 N/A THR 856.A N ALA 854.A O no hydrogen 2.607 N/A MET 859.A N ASP 855.A O no hydrogen 3.066 N/A VAL 860.A N THR 856.A O no hydrogen 2.718 N/A LYS 861.A N ARG 857.A O no hydrogen 3.056 N/A THR 862.A N THR 858.A O no hydrogen 2.675 N/A LEU 863.A N MET 859.A O no hydrogen 2.711 N/A LEU 863.A N VAL 860.A O no hydrogen 3.214 N/A GLU 864.A N VAL 860.A O no hydrogen 2.880 N/A TYR 865.A N LYS 861.A O no hydrogen 3.031 N/A ILE 866.A N THR 862.A O no hydrogen 2.735 N/A LYS 867.A N LEU 863.A O no hydrogen 2.736 N/A LYS 868.A N GLU 864.A O no hydrogen 2.911 N/A GLN 869.A N TYR 865.A O no hydrogen 2.838 N/A GLN 872.A N GLN 869.A O no hydrogen 2.999 N/A THR 876.A N PRO 873.A O no hydrogen 2.876 N/A HIS 877.A N ASP 874.A O no hydrogen 2.823 N/A LEU 878.A N ASP 874.A O no hydrogen 3.480 N/A GLU 880.A N THR 876.A O no hydrogen 2.869 N/A LEU 881.A N HIS 877.A O no hydrogen 2.852 N/A ALA 882.A N LEU 878.A O no hydrogen 2.815 N/A LEU 883.A N THR 879.A O no hydrogen 2.946 N/A ARG 884.A N GLU 880.A O no hydrogen 2.887 N/A LEU 885.A N LEU 881.A O no hydrogen 2.413 N/A