Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pr1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 6.A N HIS 2.A O no hydrogen 3.197 N/A ALA 7.A N ARG 3.A O no hydrogen 3.402 N/A ARG 8.A N LYS 4.A O no hydrogen 3.370 N/A LEU 9.A N LEU 5.A O no hydrogen 2.871 N/A ASP 10.A N GLN 6.A O no hydrogen 2.924 N/A GLN 11.A N ALA 7.A O no hydrogen 2.901 N/A MET 12.A N ARG 8.A O no hydrogen 2.971 N/A ARG 13.A N LEU 9.A O no hydrogen 2.918 N/A LYS 14.A N ASP 10.A O no hydrogen 2.922 N/A PHE 15.A N GLN 11.A O no hydrogen 2.893 N/A ARG 16.A N MET 12.A O no hydrogen 2.917 N/A ARG 17.A N ARG 13.A O no hydrogen 2.902 N/A GLN 18.A N LYS 14.A O no hydrogen 2.979 N/A HIS 19.A N PHE 15.A O no hydrogen 2.920 N/A GLU 20.A N ARG 16.A O no hydrogen 2.908 N/A GLN 21.A N ARG 17.A O no hydrogen 2.974 N/A LEU 22.A N GLN 18.A O no hydrogen 2.944 N/A ARG 23.A N HIS 19.A O no hydrogen 2.841 N/A ALA 24.A N GLU 20.A O no hydrogen 2.941 N/A ILE 26.A N LEU 22.A O no hydrogen 2.958 N/A VAL 29.A N VAL 25.A O no hydrogen 2.950 N/A LEU 30.A N ILE 26.A O no hydrogen 2.920 N/A ASN 41.A N ALA 37.A O no hydrogen 2.980 N/A ALA 42.A N ALA 38.A O no hydrogen 2.911 N/A ILE 43.A N ASP 39.A O no hydrogen 2.975 N/A GLU 44.A N ALA 40.A O no hydrogen 2.934 N/A GLU 45.A N ASN 41.A O no hydrogen 2.870 N/A VAL 46.A N ALA 42.A O no hydrogen 3.005 N/A ASN 47.A N ILE 43.A O no hydrogen 2.905 N/A LEU 48.A N GLU 44.A O no hydrogen 2.781 N/A ALA 49.A N GLU 45.A O no hydrogen 2.904 N/A TYR 50.A N VAL 46.A O no hydrogen 2.904 N/A GLU 51.A N ASN 47.A O no hydrogen 2.975 N/A ASN 52.A N LEU 48.A O no hydrogen 2.850 N/A VAL 53.A N ALA 49.A O no hydrogen 2.932 N/A LYS 54.A N TYR 50.A O no hydrogen 2.854 N/A GLU 55.A N GLU 51.A O no hydrogen 3.001 N/A VAL 56.A N VAL 53.A O no hydrogen 3.027 N/A THR 66.A N SER 62.A O no hydrogen 3.131 N/A GLU 67.A N LYS 63.A O no hydrogen 2.943 N/A ALA 68.A N GLU 64.A O no hydrogen 2.896 N/A TRP 69.A N GLY 65.A O no hydrogen 2.885 N/A GLU 70.A N THR 66.A O no hydrogen 2.928 N/A ALA 71.A N GLU 67.A O no hydrogen 2.917 N/A ALA 72.A N ALA 68.A O no hydrogen 2.948 N/A MET 73.A N TRP 69.A O no hydrogen 2.905 N/A LYS 74.A N GLU 70.A O no hydrogen 2.921 N/A ARG 75.A N ALA 71.A O no hydrogen 2.972 N/A TYR 76.A N ALA 72.A O no hydrogen 2.932 N/A ASP 77.A N MET 73.A O no hydrogen 2.792 N/A GLU 78.A N LYS 74.A O no hydrogen 2.937 N/A ARG 79.A N ARG 75.A O no hydrogen 3.013 N/A ILE 80.A N TYR 76.A O no hydrogen 2.999 N/A ASP 81.A N ASP 77.A O no hydrogen 2.929 N/A ARG 82.A N GLU 78.A O no hydrogen 2.934 N/A VAL 83.A N ARG 79.A O no hydrogen 3.016 N/A GLU 84.A N ILE 80.A O no hydrogen 2.797 N/A THR 85.A N ASP 81.A O no hydrogen 2.939 N/A ARG 86.A N ARG 82.A O no hydrogen 3.075 N/A ILE 87.A N VAL 83.A O no hydrogen 2.962 N/A THR 88.A N GLU 84.A O no hydrogen 2.842 N/A ALA 89.A N THR 85.A O no hydrogen 2.897 N/A ARG 90.A N ARG 86.A O no hydrogen 3.008 N/A LEU 91.A N ILE 87.A O no hydrogen 2.778 N/A ARG 92.A N THR 88.A O no hydrogen 3.003 N/A ASP 93.A N ALA 89.A O no hydrogen 2.949 N/A GLN 94.A N LEU 91.A O no hydrogen 3.243 N/A GLY 96.A N ARG 92.A O no hydrogen 2.942 N/A THR 97.A N ASP 93.A O no hydrogen 2.855 N/A PHE 105.A N ALA 101.A O no hydrogen 2.794 N/A ARG 106.A N ASN 102.A O no hydrogen 2.921 N/A ILE 107.A N GLU 103.A O no hydrogen 2.926 N/A PHE 108.A N MET 104.A O no hydrogen 2.863 N/A SER 109.A N PHE 105.A O no hydrogen 2.827 N/A ARG 110.A N ARG 106.A O no hydrogen 2.971 N/A PHE 111.A N PHE 108.A O no hydrogen 3.178 N/A VAL 116.A N ASN 112.A O no hydrogen 2.982 N/A ARG 117.A N ALA 113.A O no hydrogen 2.915 N/A GLY 122.A N PRO 118.A O no hydrogen 2.952 N/A ALA 123.A N HIS 119.A O no hydrogen 2.931 N/A ILE 124.A N ILE 120.A O no hydrogen 2.489 N/A THR 129.A N ARG 125.A O no hydrogen 3.172 N/A LEU 131.A N TYR 127.A O no hydrogen 2.942 N/A ILE 132.A N GLN 128.A O no hydrogen 2.907 N/A GLN 133.A N THR 129.A O no hydrogen 2.910 N/A ARG 134.A N GLN 130.A O no hydrogen 2.856 N/A VAL 135.A N LEU 131.A O no hydrogen 2.951 N/A LYS 136.A N ILE 132.A O no hydrogen 2.791 N/A ASP 137.A N GLN 133.A O no hydrogen 2.903 N/A ASP 138.A N ARG 134.A O no hydrogen 2.964 N/A ILE 139.A N VAL 135.A O no hydrogen 2.877 N/A GLU 140.A N LYS 136.A O no hydrogen 2.857 N/A SER 141.A N ASP 137.A O no hydrogen 2.932 N/A LEU 142.A N ASP 138.A O no hydrogen 2.966 N/A HIS 143.A N ILE 139.A O no hydrogen 2.809 N/A ASP 144.A N GLU 140.A O no hydrogen 2.898 N/A LYS 145.A N SER 141.A O no hydrogen 2.881 N/A PHE 146.A N LEU 142.A O no hydrogen 2.957 N/A VAL 148.A N ASP 144.A O no hydrogen 3.484 N/A SER 153.A N GLN 149.A O no hydrogen 2.728 N/A MET 158.A N GLN 154.A O no hydrogen 2.951 N/A SER 159.A N ALA 155.A O no hydrogen 2.831 N/A HIS 160.A N CYS 156.A O no hydrogen 2.959 N/A VAL 161.A N LYS 157.A O no hydrogen 2.848 N/A ARG 162.A N MET 158.A O no hydrogen 2.914 N/A LEU 164.A N SER 159.A O no hydrogen 2.658 N/A GLY 169.A N PRO 165.A O no hydrogen 2.797 N/A SER 170.A N PRO 166.A O no hydrogen 2.857 N/A ILE 171.A N VAL 167.A O no hydrogen 3.042 N/A ILE 172.A N SER 168.A O no hydrogen 2.951 N/A TRP 173.A N GLY 169.A O no hydrogen 2.866 N/A ALA 174.A N SER 170.A O no hydrogen 2.939 N/A LYS 175.A N ILE 171.A O no hydrogen 2.875 N/A GLN 176.A N ILE 172.A O no hydrogen 2.961 N/A ILE 177.A N TRP 173.A O no hydrogen 2.970 N/A ASP 178.A N ALA 174.A O no hydrogen 2.912 N/A ARG 179.A N LYS 175.A O no hydrogen 2.843 N/A GLN 180.A N GLN 176.A O no hydrogen 2.959 N/A LEU 181.A N ILE 177.A O no hydrogen 2.971 N/A THR 182.A N ASP 178.A O no hydrogen 2.889 N/A ALA 183.A N ARG 179.A O no hydrogen 2.959 N/A TYR 184.A N GLN 180.A O no hydrogen 2.885 N/A MET 185.A N LEU 181.A O no hydrogen 2.960 N/A LYS 186.A N THR 182.A O no hydrogen 2.986 N/A ARG 187.A N ALA 183.A O no hydrogen 2.915 N/A VAL 188.A N TYR 184.A O no hydrogen 2.925 N/A GLU 189.A N MET 185.A O no hydrogen 2.941 N/A ASP 190.A N LYS 186.A O no hydrogen 2.921 N/A VAL 191.A N ARG 187.A O no hydrogen 2.909 N/A LEU 192.A N VAL 188.A O no hydrogen 3.047 N/A HIS 199.A N TRP 196.A O no hydrogen 3.407 N/A GLN 203.A N HIS 199.A O no hydrogen 2.956 N/A LEU 205.A N GLU 201.A O no hydrogen 2.955 N/A LYS 206.A N GLY 202.A O no hydrogen 2.905 N/A GLN 207.A N GLN 203.A O no hydrogen 2.906 N/A ASP 208.A N LYS 204.A O no hydrogen 2.902 N/A GLY 209.A N LEU 205.A O no hydrogen 2.929 N/A ASP 210.A N LYS 206.A O no hydrogen 2.911 N/A SER 211.A N GLN 207.A O no hydrogen 2.961 N/A PHE 212.A N ASP 208.A O no hydrogen 2.871 N/A ARG 213.A N GLY 209.A O no hydrogen 2.800 N/A MET 214.A N ASP 210.A O no hydrogen 2.955 N/A LYS 215.A N SER 211.A O no hydrogen 2.976 N/A LEU 216.A N ARG 213.A O no hydrogen 2.990 N/A ASP 223.A N GLN 219.A O no hydrogen 2.935 N/A ASP 224.A N GLU 220.A O no hydrogen 2.879 N/A TRP 225.A N ILE 221.A O no hydrogen 2.898 N/A ALA 226.A N PHE 222.A O no hydrogen 2.917 N/A ARG 227.A N ASP 223.A O no hydrogen 2.894 N/A LYS 228.A N ASP 224.A O no hydrogen 2.915 N/A VAL 229.A N TRP 225.A O no hydrogen 3.031 N/A GLN 230.A N ALA 226.A O no hydrogen 2.966 N/A GLN 231.A N ARG 227.A O no hydrogen 2.882 N/A ARG 232.A N LYS 228.A O no hydrogen 2.846 N/A ASN 233.A N VAL 229.A O no hydrogen 2.728 N/A ILE 240.A N LEU 332.A O no hydrogen 3.299 N/A THR 242.A N LYS 246.A O no hydrogen 2.512 N/A LYS 246.A N THR 242.A O no hydrogen 2.879 N/A LEU 256.A N GLU 252.A O no hydrogen 3.077 N/A SER 257.A N ILE 253.A O no hydrogen 3.194 N/A LYS 258.A N ILE 254.A O no hydrogen 3.042 N/A GLU 259.A N THR 255.A O no hydrogen 2.867 N/A VAL 260.A N LEU 256.A O no hydrogen 2.903 N/A ARG 261.A N SER 257.A O no hydrogen 2.929 N/A ASN 262.A N LYS 258.A O no hydrogen 2.964 N/A LEU 263.A N GLU 259.A O no hydrogen 3.122 N/A LYS 264.A N VAL 260.A O no hydrogen 2.974 N/A LEU 266.A N ASN 262.A O no hydrogen 2.920 N/A VAL 275.A N PRO 271.A O no hydrogen 2.887 N/A ASN 276.A N LEU 272.A O no hydrogen 2.932 N/A LYS 277.A N ALA 273.A O no hydrogen 2.874 N/A ALA 278.A N ILE 274.A O no hydrogen 2.875 N/A HIS 279.A N VAL 275.A O no hydrogen 2.878 N/A GLN 280.A N ASN 276.A O no hydrogen 2.950 N/A ALA 281.A N LYS 277.A O no hydrogen 2.929 N/A ASN 282.A N ALA 278.A O no hydrogen 2.885 N/A GLN 283.A N HIS 279.A O no hydrogen 2.871 N/A LEU 284.A N GLN 280.A O no hydrogen 2.870 N/A ILE 289.A N TYR 285.A O no hydrogen 3.184 N/A SER 290.A N PRO 286.A O no hydrogen 2.961 N/A LEU 291.A N PHE 287.A O no hydrogen 2.935 N/A ILE 292.A N ALA 288.A O no hydrogen 2.874 N/A GLU 293.A N ILE 289.A O no hydrogen 2.835 N/A SER 294.A N SER 290.A O no hydrogen 3.018 N/A VAL 295.A N LEU 291.A O no hydrogen 2.926 N/A ARG 296.A N ILE 292.A O no hydrogen 2.896 N/A THR 297.A N GLU 293.A O no hydrogen 2.893 N/A TYR 298.A N SER 294.A O no hydrogen 2.927 N/A GLU 299.A N VAL 295.A O no hydrogen 2.793 N/A ARG 300.A N ARG 296.A O no hydrogen 3.003 N/A THR 301.A N THR 297.A O no hydrogen 2.945 N/A CYS 302.A N TYR 298.A O no hydrogen 2.750 N/A GLU 303.A N GLU 299.A O no hydrogen 2.913 N/A LYS 304.A N ARG 300.A O no hydrogen 3.005 N/A VAL 305.A N THR 301.A O no hydrogen 2.862 N/A GLU 306.A N CYS 302.A O no hydrogen 2.897 N/A GLU 307.A N GLU 303.A O no hydrogen 2.990 N/A ARG 308.A N VAL 305.A O no hydrogen 3.395 N/A LEU 314.A N ILE 311.A O no hydrogen 2.835 N/A VAL 315.A N ILE 311.A O no hydrogen 2.962 N/A LYS 319.A N VAL 315.A O no hydrogen 2.935 N/A LYS 320.A N ALA 316.A O no hydrogen 2.897 N/A GLU 321.A N GLY 317.A O no hydrogen 3.001 N/A VAL 322.A N LEU 318.A O no hydrogen 2.963 N/A GLN 323.A N LYS 319.A O no hydrogen 2.895 N/A ALA 324.A N LYS 320.A O no hydrogen 2.876 N/A LEU 325.A N GLU 321.A O no hydrogen 2.961 N/A ILE 326.A N VAL 322.A O no hydrogen 2.928 N/A ALA 327.A N GLN 323.A O no hydrogen 2.976 N/A GLU 328.A N ALA 324.A O no hydrogen 2.917 N/A GLY 329.A N LEU 325.A O no hydrogen 2.878 N/A SER 336.A N VAL 333.A O no hydrogen 3.303 N/A VAL 343.A N LEU 339.A O no hydrogen 2.937 N/A GLN 344.A N ASP 340.A O no hydrogen 2.998 N/A ARG 345.A N PRO 341.A O no hydrogen 2.908 N/A LEU 346.A N TYR 342.A O no hydrogen 2.837 N/A ALA 347.A N VAL 343.A O no hydrogen 2.968 N/A THR 349.A N ARG 345.A O no hydrogen 2.977 N/A VAL 350.A N LEU 346.A O no hydrogen 2.950 N/A PHE 351.A N ALA 347.A O no hydrogen 2.969 N/A ASN 352.A N GLU 348.A O no hydrogen 2.986 N/A PHE 353.A N THR 349.A O no hydrogen 2.945 N/A GLN 354.A N VAL 350.A O no hydrogen 2.922 N/A GLU 355.A N PHE 351.A O no hydrogen 2.958 N/A LYS 356.A N ASN 352.A O no hydrogen 3.036 N/A VAL 357.A N PHE 353.A O no hydrogen 2.993 N/A ASP 358.A N GLN 354.A O no hydrogen 3.051 N/A ASP 359.A N GLU 355.A O no hydrogen 3.004 N/A LEU 360.A N LYS 356.A O no hydrogen 2.965 N/A LEU 361.A N VAL 357.A O no hydrogen 2.819 N/A ILE 362.A N ASP 358.A O no hydrogen 3.137 N/A ILE 363.A N ASP 359.A O no hydrogen 3.067 N/A GLU 364.A N LEU 360.A O no hydrogen 2.822 N/A GLU 365.A N LEU 361.A O no hydrogen 3.024 N/A LYS 366.A N ILE 362.A O no hydrogen 3.109 N/A ILE 367.A N ILE 363.A O no hydrogen 3.006 N/A ASP 368.A N GLU 364.A O no hydrogen 2.926 N/A LEU 369.A N GLU 365.A O no hydrogen 2.928 N/A GLU 370.A N LYS 366.A O no hydrogen 2.942 N/A VAL 371.A N ILE 367.A O no hydrogen 2.883 N/A SER 373.A N LEU 369.A O no hydrogen 3.128 N/A SER 373.A N GLU 370.A O no hydrogen 3.293 N/A THR 376.A N SER 373.A O no hydrogen 3.302 N/A ASP 380.A N MET 378.A O no hydrogen 2.983 N/A SER 385.A N HIS 381.A O no hydrogen 2.860 N/A GLU 386.A N LYS 382.A O no hydrogen 2.820 N/A ILE 387.A N THR 383.A O no hydrogen 3.027 N/A LEU 388.A N PHE 384.A O no hydrogen 3.023 N/A ASN 389.A N SER 385.A O no hydrogen 2.916 N/A ARG 390.A N GLU 386.A O no hydrogen 2.923 N/A VAL 391.A N ILE 387.A O no hydrogen 2.971 N/A GLN 392.A N LEU 388.A O no hydrogen 2.886 N/A LYS 393.A N ASN 389.A O no hydrogen 2.964 N/A ALA 394.A N ARG 390.A O no hydrogen 2.950 N/A VAL 395.A N VAL 391.A O no hydrogen 2.874 N/A ASP 396.A N GLN 392.A O no hydrogen 2.999 N/A ASP 397.A N LYS 393.A O no hydrogen 2.955 N/A LEU 398.A N ALA 394.A O no hydrogen 2.909 N/A ASN 399.A N VAL 395.A O no hydrogen 2.879 N/A LEU 400.A N ASP 396.A O no hydrogen 2.951 N/A HIS 401.A N LEU 398.A O no hydrogen 3.139 N/A SER 404.A N LEU 314.A O no hydrogen 3.355 N/A TRP 409.A N ASN 405.A O no hydrogen 3.232 N/A VAL 410.A N LEU 406.A O no hydrogen 3.022 N/A ASN 411.A N PRO 407.A O no hydrogen 2.909 N/A LYS 412.A N ILE 408.A O no hydrogen 2.951 N/A LEU 413.A N TRP 409.A O no hydrogen 2.983 N/A ASP 414.A N VAL 410.A O no hydrogen 2.835 N/A MET 415.A N ASN 411.A O no hydrogen 2.969 N/A GLU 416.A N LYS 412.A O no hydrogen 2.969 N/A ILE 417.A N LEU 413.A O no hydrogen 2.939 N/A GLU 418.A N ASP 414.A O no hydrogen 2.912 N/A ARG 419.A N MET 415.A O no hydrogen 2.915 N/A ILE 420.A N GLU 416.A O no hydrogen 2.962 N/A LEU 421.A N ILE 417.A O no hydrogen 2.855 N/A GLY 422.A N GLU 418.A O no hydrogen 2.917 N/A VAL 423.A N ARG 419.A O no hydrogen 3.053 N/A ARG 424.A N ILE 420.A O no hydrogen 2.917 N/A LEU 425.A N LEU 421.A O no hydrogen 2.934 N/A GLN 426.A N GLY 422.A O no hydrogen 2.937 N/A ALA 427.A N VAL 423.A O no hydrogen 3.037 N/A GLY 428.A N ARG 424.A O no hydrogen 2.915 N/A LEU 429.A N LEU 425.A O no hydrogen 2.929 N/A ARG 430.A N GLN 426.A O no hydrogen 3.087 N/A ALA 431.A N ALA 427.A O no hydrogen 2.917 N/A TRP 432.A N GLY 428.A O no hydrogen 2.961 N/A THR 433.A N LEU 429.A O no hydrogen 2.980 N/A GLN 434.A N ARG 430.A O no hydrogen 2.918 N/A VAL 435.A N ALA 431.A O no hydrogen 3.004 N/A LEU 436.A N TRP 432.A O no hydrogen 2.918 N/A LEU 437.A N THR 433.A O no hydrogen 3.386 N/A GLY 438.A N VAL 435.A O no hydrogen 3.292 N/A HIS 470.A N VAL 616.A O no hydrogen 2.888 N/A GLU 471.A N ASN 482.A O no hydrogen 3.269 N/A LEU 472.A N ASP 618.A O no hydrogen 2.528 N/A ARG 473.A N TYR 480.A O no hydrogen 3.034 N/A THR 475.A N VAL 478.A O no hydrogen 3.397 N/A TYR 480.A N ARG 473.A O no hydrogen 3.222 N/A ASN 482.A N GLU 471.A O no hydrogen 2.919 N/A CYS 488.A N PRO 484.A O no hydrogen 3.042 N/A ARG 489.A N ILE 485.A O no hydrogen 2.968 N/A TYR 490.A N GLU 486.A O no hydrogen 2.896 N/A LYS 491.A N GLU 487.A O no hydrogen 2.795 N/A LEU 492.A N CYS 488.A O no hydrogen 3.088 N/A TYR 493.A N ARG 489.A O no hydrogen 2.946 N/A GLN 494.A N LYS 491.A O no hydrogen 2.938 N/A GLU 495.A N LYS 491.A O no hydrogen 3.076 N/A MET 496.A N LEU 492.A O no hydrogen 2.995 N/A PHE 497.A N TYR 493.A O no hydrogen 2.946 N/A ALA 498.A N GLN 494.A O no hydrogen 2.884 N/A TRP 499.A N GLU 495.A O no hydrogen 2.930 N/A LYS 500.A N MET 496.A O no hydrogen 2.834 N/A MET 501.A N PHE 497.A O no hydrogen 2.902 N/A VAL 502.A N ALA 498.A O no hydrogen 2.956 N/A VAL 503.A N LYS 500.A O no hydrogen 3.050 N/A LEU 504.A N LYS 500.A O no hydrogen 2.816 N/A ARG 508.A N LYS 527.A O no hydrogen 2.570 N/A HIS 519.A N VAL 516.A O no hydrogen 3.029 N/A LYS 527.A N THR 523.A O no hydrogen 2.796 N/A PHE 528.A N GLU 524.A O no hydrogen 2.792 N/A TYR 529.A N LEU 506.A O no hydrogen 2.934 N/A LEU 543.A N PRO 540.A O no hydrogen 2.945 N/A GLU 545.A N VAL 541.A O no hydrogen 2.957 N/A SER 546.A N ALA 542.A O no hydrogen 2.853 N/A TYR 547.A N LEU 543.A O no hydrogen 2.884 N/A SER 548.A N GLU 544.A O no hydrogen 2.828 N/A ALA 549.A N GLU 545.A O no hydrogen 2.961 N/A VAL 550.A N SER 546.A O no hydrogen 2.897 N/A MET 551.A N TYR 547.A O no hydrogen 2.848 N/A GLY 552.A N SER 548.A O no hydrogen 2.862 N/A ILE 553.A N ALA 549.A O no hydrogen 2.952 N/A VAL 554.A N VAL 550.A O no hydrogen 2.859 N/A SER 555.A N MET 551.A O no hydrogen 2.862 N/A GLU 556.A N GLY 552.A O no hydrogen 2.950 N/A VAL 557.A N ILE 553.A O no hydrogen 2.931 N/A GLU 558.A N VAL 554.A O no hydrogen 2.849 N/A GLN 559.A N SER 555.A O no hydrogen 2.880 N/A TYR 560.A N GLU 556.A O no hydrogen 3.015 N/A VAL 561.A N VAL 557.A O no hydrogen 2.915 N/A LYS 562.A N GLU 558.A O no hydrogen 3.000 N/A VAL 563.A N TYR 560.A O no hydrogen 3.272 N/A LEU 565.A N VAL 561.A O no hydrogen 2.899 N/A GLN 566.A N VAL 563.A O no hydrogen 3.368 N/A TRP 571.A N GLN 568.A O no hydrogen 2.899 N/A ASP 572.A N GLN 568.A O no hydrogen 2.867 N/A TYR 579.A N ALA 575.A O no hydrogen 2.908 N/A ASN 580.A N GLU 576.A O no hydrogen 2.882 N/A LEU 582.A N ILE 578.A O no hydrogen 2.939 N/A GLY 583.A N TYR 579.A O no hydrogen 3.171 N/A LYS 588.A N ASP 585.A O no hydrogen 3.263 N/A GLN 590.A N LEU 586.A O no hydrogen 2.961 N/A ALA 591.A N ASN 587.A O no hydrogen 2.908 N/A LEU 592.A N LYS 588.A O no hydrogen 2.897 N/A LEU 593.A N TRP 589.A O no hydrogen 2.978 N/A VAL 594.A N GLN 590.A O no hydrogen 3.008 N/A GLN 595.A N ALA 591.A O no hydrogen 2.922 N/A ILE 596.A N LEU 592.A O no hydrogen 2.918 N/A ARG 597.A N LEU 593.A O no hydrogen 3.008 N/A LYS 598.A N VAL 594.A O no hydrogen 2.887 N/A ALA 599.A N GLN 595.A O no hydrogen 2.856 N/A ARG 600.A N ILE 596.A O no hydrogen 2.919 N/A GLY 601.A N ARG 597.A O no hydrogen 2.942 N/A THR 602.A N LYS 598.A O no hydrogen 2.982 N/A PHE 603.A N ALA 599.A O no hydrogen 2.877 N/A LYS 610.A N ILE 617.A O no hydrogen 3.388 N/A PHE 612.A N VAL 615.A O no hydrogen 2.958 N/A VAL 615.A N PHE 612.A O no hydrogen 2.812 N/A VAL 616.A N VAL 468.A O no hydrogen 3.137 N/A ILE 617.A N LYS 610.A O no hydrogen 2.965 N/A ASP 618.A N HIS 470.A O no hydrogen 2.527 N/A TYR 619.A N THR 608.A O no hydrogen 3.194 N/A GLN 623.A N TYR 619.A O no hydrogen 3.053 N/A SER 624.A N GLY 620.A O no hydrogen 3.000 N/A LYS 625.A N LYS 621.A O no hydrogen 2.984 N/A VAL 626.A N VAL 622.A O no hydrogen 2.793 N/A ASN 627.A N GLN 623.A O no hydrogen 2.946 N/A LEU 628.A N SER 624.A O no hydrogen 2.948 N/A LYS 629.A N LYS 625.A O no hydrogen 2.943 N/A TYR 630.A N VAL 626.A O no hydrogen 2.794 N/A ASP 631.A N ASN 627.A O no hydrogen 2.926 N/A SER 632.A N LEU 628.A O no hydrogen 3.056 N/A TRP 633.A N LYS 629.A O no hydrogen 2.758 N/A HIS 634.A N TYR 630.A O no hydrogen 2.906 N/A LYS 635.A N ASP 631.A O no hydrogen 2.947 N/A GLU 636.A N SER 632.A O no hydrogen 2.895 N/A VAL 637.A N TRP 633.A O no hydrogen 2.989 N/A LEU 638.A N HIS 634.A O no hydrogen 2.854 N/A SER 639.A N LYS 635.A O no hydrogen 2.797 N/A LYS 640.A N GLU 636.A O no hydrogen 2.985 N/A PHE 641.A N VAL 637.A O no hydrogen 2.924 N/A GLY 642.A N LEU 638.A O no hydrogen 2.936 N/A GLN 643.A N SER 639.A O no hydrogen 2.878 N/A MET 644.A N LYS 640.A O no hydrogen 2.949 N/A LEU 645.A N PHE 641.A O no hydrogen 2.915 N/A GLY 646.A N GLY 642.A O no hydrogen 2.842 N/A SER 647.A N GLN 643.A O no hydrogen 2.953 N/A ASN 648.A N MET 644.A O no hydrogen 3.002 N/A MET 649.A N LEU 645.A O no hydrogen 2.881 N/A THR 650.A N GLY 646.A O no hydrogen 2.864 N/A GLU 651.A N SER 647.A O no hydrogen 3.028 N/A PHE 652.A N ASN 648.A O no hydrogen 2.921 N/A HIS 653.A N MET 649.A O no hydrogen 2.925 N/A SER 654.A N THR 650.A O no hydrogen 2.943 N/A GLN 655.A N GLU 651.A O no hydrogen 3.014 N/A ILE 656.A N PHE 652.A O no hydrogen 2.934 N/A SER 657.A N HIS 653.A O no hydrogen 2.969 N/A LYS 658.A N SER 654.A O no hydrogen 2.951 N/A SER 659.A N GLN 655.A O no hydrogen 2.900 N/A ARG 660.A N ILE 656.A O no hydrogen 2.894 N/A GLN 661.A N SER 657.A O no hydrogen 2.943 N/A GLU 662.A N LYS 658.A O no hydrogen 2.975 N/A LEU 663.A N SER 659.A O no hydrogen 2.915 N/A GLU 664.A N ARG 660.A O no hydrogen 2.923 N/A GLN 665.A N GLN 661.A O no hydrogen 2.943 N/A HIS 666.A N GLU 662.A O no hydrogen 3.162 N/A VAL 677.A N THR 673.A O no hydrogen 2.884 N/A VAL 677.A N SER 674.A O no hydrogen 3.270 N/A THR 678.A N SER 674.A O no hydrogen 3.011 N/A PHE 679.A N ASP 675.A O no hydrogen 3.054 N/A ILE 680.A N ALA 676.A O no hydrogen 2.885 N/A THR 681.A N VAL 677.A O no hydrogen 2.877 N/A TYR 682.A N THR 678.A O no hydrogen 3.036 N/A VAL 683.A N PHE 679.A O no hydrogen 2.865 N/A GLN 684.A N ILE 680.A O no hydrogen 2.882 N/A SER 685.A N THR 681.A O no hydrogen 2.967 N/A LEU 686.A N TYR 682.A O no hydrogen 2.997 N/A LYS 687.A N VAL 683.A O no hydrogen 2.784 N/A ARG 688.A N GLN 684.A O no hydrogen 2.912 N/A LYS 689.A N SER 685.A O no hydrogen 2.978 N/A ILE 690.A N LYS 687.A O no hydrogen 3.491 N/A PHE 693.A N LYS 689.A O no hydrogen 2.907 N/A GLU 694.A N ILE 690.A O no hydrogen 2.872 N/A LYS 695.A N LYS 691.A O no hydrogen 2.955 N/A GLN 696.A N GLN 692.A O no hydrogen 2.855 N/A VAL 697.A N PHE 693.A O no hydrogen 2.923 N/A GLU 698.A N GLU 694.A O no hydrogen 2.971 N/A LEU 699.A N LYS 695.A O no hydrogen 2.952 N/A TYR 700.A N GLN 696.A O no hydrogen 2.903 N/A ARG 701.A N VAL 697.A O no hydrogen 2.848 N/A ASN 702.A N GLU 698.A O no hydrogen 2.965 N/A GLY 703.A N LEU 699.A O no hydrogen 2.907 N/A GLN 704.A N TYR 700.A O no hydrogen 2.880 N/A ARG 705.A N ARG 701.A O no hydrogen 3.017 N/A LEU 706.A N ASN 702.A O no hydrogen 2.986 N/A LEU 707.A N GLY 703.A O no hydrogen 2.937 N/A GLU 708.A N GLN 704.A O no hydrogen 2.889 N/A LYS 709.A N ARG 705.A O no hydrogen 2.846 N/A GLN 710.A N LEU 706.A O no hydrogen 2.711 N/A PHE 712.A N LEU 707.A O no hydrogen 2.720 N/A TRP 718.A N PRO 715.A O no hydrogen 3.254 N/A ILE 724.A N TYR 720.A O no hydrogen 2.603 N/A GLU 725.A N ILE 721.A O no hydrogen 2.890 N/A GLY 726.A N ASP 722.A O no hydrogen 2.880 N/A GLU 727.A N ASN 723.A O no hydrogen 2.854 N/A TRP 728.A N ILE 724.A O no hydrogen 2.794 N/A GLY 729.A N GLU 725.A O no hydrogen 2.889 N/A ALA 730.A N GLY 726.A O no hydrogen 2.861 N/A PHE 731.A N GLU 727.A O no hydrogen 2.793 N/A ASN 732.A N TRP 728.A O no hydrogen 2.859 N/A ASP 733.A N GLY 729.A O no hydrogen 2.906 N/A ILE 734.A N ALA 730.A O no hydrogen 2.869 N/A MET 735.A N PHE 731.A O no hydrogen 2.844 N/A ARG 736.A N ASN 732.A O no hydrogen 2.893 N/A ARG 737.A N ASP 733.A O no hydrogen 2.973 N/A LYS 738.A N ILE 734.A O no hydrogen 2.932 N/A ASP 739.A N MET 735.A O no hydrogen 2.886 N/A SER 740.A N ARG 736.A O no hydrogen 2.915 N/A ALA 741.A N ARG 737.A O no hydrogen 2.879 N/A ILE 742.A N LYS 738.A O no hydrogen 2.867 N/A GLN 743.A N ASP 739.A O no hydrogen 2.896 N/A GLN 744.A N SER 740.A O no hydrogen 2.876 N/A GLN 745.A N ALA 741.A O no hydrogen 2.877 N/A VAL 746.A N ILE 742.A O no hydrogen 2.889 N/A ALA 747.A N GLN 744.A O no hydrogen 3.413 N/A LEU 749.A N GLN 745.A O no hydrogen 2.915 N/A GLN 750.A N ALA 747.A O no hydrogen 3.136 N/A MET 751.A N ALA 747.A O no hydrogen 3.057 N/A LYS 752.A N ASN 748.A O no hydrogen 3.040 N/A ILE 753.A N LEU 749.A O no hydrogen 2.770 N/A VAL 754.A N GLN 750.A O no hydrogen 3.013 N/A GLN 755.A N MET 751.A O no hydrogen 2.878 N/A GLU 756.A N LYS 752.A O no hydrogen 2.905 N/A ASP 757.A N ILE 753.A O no hydrogen 2.823 N/A ARG 758.A N VAL 754.A O no hydrogen 3.016 N/A ALA 759.A N GLN 755.A O no hydrogen 2.984 N/A VAL 760.A N GLU 756.A O no hydrogen 2.890 N/A GLU 761.A N ASP 757.A O no hydrogen 2.933 N/A SER 762.A N ARG 758.A O no hydrogen 2.888 N/A ARG 763.A N ALA 759.A O no hydrogen 2.946 N/A THR 764.A N VAL 760.A O no hydrogen 2.735 N/A THR 765.A N GLU 761.A O no hydrogen 2.986 N/A ASP 766.A N SER 762.A O no hydrogen 2.979 N/A LEU 767.A N ARG 763.A O no hydrogen 2.925 N/A LEU 768.A N THR 764.A O no hydrogen 2.844 N/A THR 769.A N THR 765.A O no hydrogen 3.017 N/A ASP 770.A N ASP 766.A O no hydrogen 2.914 N/A TRP 771.A N LEU 767.A O no hydrogen 2.817 N/A GLU 772.A N LEU 768.A O no hydrogen 2.873 N/A LYS 773.A N THR 769.A O no hydrogen 3.006 N/A THR 774.A N ASP 770.A O no hydrogen 2.972 N/A LEU 787.A N PRO 783.A O no hydrogen 2.881 N/A GLN 788.A N GLU 784.A O no hydrogen 2.915 N/A ALA 789.A N GLU 785.A O no hydrogen 2.902 N/A LEU 790.A N ALA 786.A O no hydrogen 2.911 N/A THR 791.A N LEU 787.A O no hydrogen 2.871 N/A ILE 792.A N GLN 788.A O no hydrogen 2.951 N/A TYR 793.A N ALA 789.A O no hydrogen 2.964 N/A GLU 794.A N LEU 790.A O no hydrogen 2.830 N/A GLY 795.A N THR 791.A O no hydrogen 2.922 N/A LYS 796.A N ILE 792.A O no hydrogen 2.940 N/A PHE 797.A N TYR 793.A O no hydrogen 2.892 N/A GLY 798.A N GLU 794.A O no hydrogen 2.853 N/A ARG 799.A N GLY 795.A O no hydrogen 2.940 N/A LEU 800.A N LYS 796.A O no hydrogen 2.975 N/A LYS 801.A N PHE 797.A O no hydrogen 2.789 N/A ASP 802.A N GLY 798.A O no hydrogen 2.917 N/A ASP 803.A N ARG 799.A O no hydrogen 2.941 N/A ARG 804.A N LEU 800.A O no hydrogen 2.900 N/A GLU 805.A N LYS 801.A O no hydrogen 2.850 N/A LYS 806.A N ASP 802.A O no hydrogen 2.875 N/A CYS 807.A N ASP 803.A O no hydrogen 3.000 N/A ALA 808.A N ARG 804.A O no hydrogen 2.806 N/A LYS 809.A N GLU 805.A O no hydrogen 2.859 N/A ALA 810.A N LYS 806.A O no hydrogen 3.016 N/A LYS 811.A N CYS 807.A O no hydrogen 2.890 N/A GLU 812.A N ALA 808.A O no hydrogen 2.869 N/A ALA 813.A N LYS 809.A O no hydrogen 2.942 N/A GLU 815.A N GLU 812.A O no hydrogen 3.450 N/A LEU 821.A N ASP 818.A O no hydrogen 3.015 N/A ARG 828.A N GLY 824.A O no hydrogen 2.870 N/A VAL 829.A N SER 825.A O no hydrogen 2.906 N/A GLN 830.A N GLU 826.A O no hydrogen 2.993 N/A VAL 831.A N GLU 827.A O no hydrogen 2.878 N/A ALA 832.A N ARG 828.A O no hydrogen 2.943 N/A LEU 833.A N VAL 829.A O no hydrogen 2.871 N/A GLU 834.A N GLN 830.A O no hydrogen 2.917 N/A GLU 835.A N VAL 831.A O no hydrogen 2.860 N/A LEU 836.A N ALA 832.A O no hydrogen 2.845 N/A GLN 837.A N LEU 833.A O no hydrogen 2.833 N/A ASP 838.A N GLU 834.A O no hydrogen 2.928 N/A LEU 839.A N GLU 835.A O no hydrogen 2.882 N/A LYS 840.A N LEU 836.A O no hydrogen 2.791 N/A GLY 841.A N GLN 837.A O no hydrogen 2.925 N/A VAL 842.A N ASP 838.A O no hydrogen 2.945 N/A TRP 843.A N LEU 839.A O no hydrogen 2.804 N/A SER 844.A N LYS 840.A O no hydrogen 2.880 N/A GLU 845.A N GLY 841.A O no hydrogen 2.989 N/A LEU 846.A N VAL 842.A O no hydrogen 2.805 N/A SER 847.A N TRP 843.A O no hydrogen 2.789 N/A LYS 848.A N SER 844.A O no hydrogen 3.026 N/A VAL 849.A N GLU 845.A O no hydrogen 2.876 N/A TRP 850.A N LEU 846.A O no hydrogen 2.756 N/A GLU 851.A N SER 847.A O no hydrogen 2.894 N/A GLN 852.A N LYS 848.A O no hydrogen 3.006 N/A ILE 853.A N VAL 849.A O no hydrogen 2.833 N/A ASP 854.A N TRP 850.A O no hydrogen 2.877 N/A GLN 855.A N GLU 851.A O no hydrogen 2.947 N/A MET 856.A N GLN 852.A O no hydrogen 2.922 N/A