Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mr3_D.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.D N LEU 3.D O no hydrogen 2.923 N/A LEU 8.D N GLN 4.D O no hydrogen 2.900 N/A GLU 9.D N LYS 5.D O no hydrogen 2.891 N/A ALA 10.D N GLN 6.D O no hydrogen 2.913 N/A VAL 11.D N LEU 7.D O no hydrogen 2.891 N/A GLU 12.D N LEU 8.D O no hydrogen 2.904 N/A HIS 13.D N GLU 9.D O no hydrogen 2.896 N/A LYS 14.D N VAL 11.D O no hydrogen 2.816 N/A GLN 15.D N ALA 10.D O no hydrogen 3.231 N/A VAL 21.D N ARG 17.D O no hydrogen 2.981 N/A GLN 22.D N PRO 18.D O no hydrogen 2.993 N/A PHE 23.D N LEU 19.D O no hydrogen 2.849 N/A ALA 24.D N ASP 20.D O no hydrogen 2.980 N/A LEU 25.D N VAL 21.D O no hydrogen 2.952 N/A THR 26.D N GLN 22.D O no hydrogen 2.921 N/A THR 26.D OG1 GLN 22.D O no hydrogen 2.979 N/A THR 26.D OG1 PHE 23.D O no hydrogen 3.239 N/A VAL 27.D N PHE 23.D O no hydrogen 2.936 N/A ALA 28.D N ALA 24.D O no hydrogen 2.965 N/A GLY 29.D N LEU 25.D O no hydrogen 2.869 N/A GLU 31.D N ALA 28.D O no hydrogen 3.293 N/A HIS 32.D ND1 SER 73.D OG no hydrogen 2.754 N/A VAL 35.D N HIS 32.D O no hydrogen 3.315 N/A THR 36.D OG1 PRO 33.D O no hydrogen 2.538 N/A LEU 37.D N PRO 33.D O no hydrogen 2.905 N/A ALA 38.D N ALA 34.D O no hydrogen 2.915 N/A ALA 39.D N VAL 35.D O no hydrogen 2.883 N/A ALA 40.D N THR 36.D O no hydrogen 2.954 N/A LEU 41.D N LEU 37.D O no hydrogen 2.940 N/A LEU 42.D N ALA 38.D O no hydrogen 2.877 N/A SER 43.D N ALA 39.D O no hydrogen 2.897 N/A SER 43.D OG ASP 20.D O no hydrogen 3.567 N/A SER 43.D OG ASP 20.D OD1 no hydrogen 3.141 N/A SER 43.D OG ALA 39.D O no hydrogen 2.935 N/A SER 43.D OG ALA 40.D O no hydrogen 2.675 N/A HIS 44.D N ALA 40.D O no hydrogen 2.982 N/A ASP 45.D N LEU 41.D O no hydrogen 2.851 N/A ALA 46.D N LEU 42.D O no hydrogen 2.901 N/A GLY 47.D N SER 43.D O no hydrogen 2.895 N/A GLU 48.D N HIS 44.D O no hydrogen 2.922 N/A HIS 50.D N ASP 45.D O no hydrogen 3.123 N/A VAL 51.D N ARG 597.D O no hydrogen 2.943 N/A CYS 52.D N ARG 597.D O no hydrogen 2.727 N/A ARG 57.D N PRO 54.D O no hydrogen 3.154 N/A GLU 59.D N LEU 55.D O no hydrogen 3.054 N/A ASN 60.D N ARG 57.D O no hydrogen 3.257 N/A GLU 62.D N ASN 61.D OD1 no hydrogen 2.640 N/A HIS 65.D NE2 THR 70.D OG1 no hydrogen 2.570 N/A THR 70.D N PRO 66.D O no hydrogen 2.998 N/A THR 70.D OG1 HIS 65.D NE2 no hydrogen 2.570 N/A THR 70.D OG1 PRO 66.D O no hydrogen 3.136 N/A CYS 71.D N LEU 67.D O no hydrogen 2.863 N/A CYS 71.D SG LEU 67.D O no hydrogen 3.170 N/A CYS 71.D SG LEU 68.D O no hydrogen 3.595 N/A VAL 72.D N LEU 68.D O no hydrogen 2.986 N/A SER 73.D OG HIS 32.D ND1 no hydrogen 2.754 N/A CYS 84.D N ASN 80.D O no hydrogen 2.957 N/A CYS 84.D SG LEU 78.D O no hydrogen 3.410 N/A CYS 84.D SG ASN 80.D O no hydrogen 3.181 N/A LEU 85.D N TRP 81.D O no hydrogen 2.880 N/A LEU 86.D N GLU 82.D O no hydrogen 2.932 N/A ALA 87.D N GLU 83.D O no hydrogen 2.940 N/A SER 88.D OG LEU 85.D O no hydrogen 3.452 N/A ALA 90.D N SER 88.D OG no hydrogen 3.318 N/A SER 92.D N MET 100.D O no hydrogen 3.060 N/A MET 100.D N ALA 90.D O no hydrogen 3.268 N/A ILE 101.D N TYR 108.D O no hydrogen 3.118 N/A LEU 102.D N SER 92.D O no hydrogen 2.950 N/A LEU 107.D N LEU 53.D O no hydrogen 2.773 N/A TYR 108.D N ILE 101.D O no hydrogen 3.480 N/A ASN 110.D ND2 THR 98.D O no hydrogen 3.341 N/A TRP 113.D N LEU 109.D O no hydrogen 2.698 N/A CYS 114.D N ASN 110.D O no hydrogen 2.926 N/A CYS 114.D SG ASN 110.D O no hydrogen 3.850 N/A CYS 114.D SG ARG 111.D O no hydrogen 3.201 N/A CYS 114.D SG ASN 115.D OD1 no hydrogen 3.281 N/A ASN 115.D N ARG 111.D O no hydrogen 3.002 N/A GLU 116.D N MET 112.D O no hydrogen 2.900 N/A ARG 117.D N TRP 113.D O no hydrogen 2.887 N/A THR 118.D N CYS 114.D O no hydrogen 2.947 N/A THR 118.D OG1 CYS 114.D O no hydrogen 2.574 N/A VAL 119.D N ASN 115.D O no hydrogen 2.990 N/A ALA 120.D N GLU 116.D O no hydrogen 2.906 N/A ARG 121.D N ARG 117.D O no hydrogen 2.903 N/A PHE 122.D N THR 118.D O no hydrogen 2.976 N/A PHE 123.D N VAL 119.D O no hydrogen 2.955 N/A GLU 125.D N ARG 121.D O no hydrogen 3.188 N/A VAL 126.D N ARG 121.D O no hydrogen 3.377 N/A ASN 127.D ND2 PHE 123.D O no hydrogen 3.502 N/A ILE 130.D N THR 163.D O no hydrogen 3.316 N/A LEU 136.D N ASP 133.D OD2 no hydrogen 3.005 N/A LEU 137.D N ASP 133.D O no hydrogen 2.970 N/A ALA 138.D N GLU 134.D O no hydrogen 2.836 N/A GLN 139.D N ALA 135.D O no hydrogen 2.925 N/A THR 140.D N LEU 136.D O no hydrogen 2.911 N/A THR 140.D OG1 LEU 136.D O no hydrogen 3.008 N/A THR 140.D OG1 LEU 137.D O no hydrogen 2.556 N/A LEU 141.D N LEU 137.D O no hydrogen 2.892 N/A ASP 142.D N ALA 138.D O no hydrogen 2.953 N/A LYS 143.D N GLN 139.D O no hydrogen 2.961 N/A LYS 143.D NZ GLN 139.D O no hydrogen 3.237 N/A LEU 144.D N THR 140.D O no hydrogen 2.978 N/A SER 148.D OG SER 148.D O no hydrogen 2.396 N/A LYS 155.D NZ VAL 147.D O no hydrogen 2.740 N/A VAL 156.D N ASN 152.D O no hydrogen 2.964 N/A ALA 157.D N TRP 153.D O no hydrogen 2.848 N/A ALA 158.D N GLN 154.D O no hydrogen 2.938 N/A ALA 159.D N LYS 155.D O no hydrogen 2.971 N/A VAL 160.D N VAL 156.D O no hydrogen 2.945 N/A ALA 161.D N ALA 157.D O no hydrogen 2.890 N/A LEU 162.D N ALA 158.D O no hydrogen 2.972 N/A THR 163.D N ALA 159.D O no hydrogen 2.914 N/A THR 163.D OG1 ALA 159.D O no hydrogen 2.491 N/A ARG 164.D N VAL 160.D O no hydrogen 2.972 N/A ARG 164.D NE HIS 128.D O no hydrogen 3.075 N/A ARG 164.D NH1 ASP 350.D OD2 no hydrogen 3.097 N/A ARG 164.D NH2 HIS 128.D O no hydrogen 2.634 N/A ARG 165.D NH2 ASP 288.D O no hydrogen 2.459 N/A SER 167.D N VAL 292.D O no hydrogen 3.257 N/A SER 167.D OG ALA 161.D O no hydrogen 3.394 N/A SER 167.D OG ARG 164.D O no hydrogen 3.462 N/A ILE 169.D N PHE 294.D O no hydrogen 3.321 N/A SER 170.D N CYS 353.D O no hydrogen 3.432 N/A GLY 171.D N SER 170.D OG no hydrogen 2.452 N/A THR 175.D OG1 GLY 172.D O no hydrogen 2.337 N/A LYS 177.D NZ GLY 171.D O no hydrogen 2.751 N/A LYS 177.D NZ GLY 172.D O no hydrogen 2.641 N/A THR 180.D N GLY 176.D O no hydrogen 2.934 N/A THR 180.D OG1 GLY 176.D O no hydrogen 3.537 N/A THR 180.D OG1 LYS 177.D O no hydrogen 2.496 N/A VAL 181.D N LYS 177.D O no hydrogen 2.915 N/A ALA 182.D N THR 178.D O no hydrogen 2.889 N/A LYS 183.D N THR 179.D O no hydrogen 2.939 N/A LEU 184.D N THR 180.D O no hydrogen 2.865 N/A LEU 185.D N VAL 181.D O no hydrogen 2.879 N/A ALA 186.D N ALA 182.D O no hydrogen 2.957 N/A ALA 187.D N LYS 183.D O no hydrogen 2.901 N/A LEU 188.D N LEU 184.D O no hydrogen 2.935 N/A ILE 189.D N LEU 185.D O no hydrogen 2.928 N/A GLN 190.D N ALA 186.D O no hydrogen 2.941 N/A MET 191.D N ALA 187.D O no hydrogen 2.890 N/A MET 191.D N LEU 188.D O no hydrogen 3.263 N/A ALA 192.D N LEU 188.D O no hydrogen 2.934 N/A ARG 198.D N ASP 264.D OD2 no hydrogen 3.485 N/A ILE 199.D N CYS 197.D O no hydrogen 3.119 N/A ARG 200.D N VAL 265.D O no hydrogen 2.926 N/A ALA 202.D N VAL 267.D O no hydrogen 2.900 N/A ALA 209.D N THR 205.D O no hydrogen 2.921 N/A ALA 210.D N GLY 206.D O no hydrogen 2.909 N/A ARG 211.D N LYS 207.D O no hydrogen 2.965 N/A LEU 212.D N ALA 208.D O no hydrogen 2.869 N/A THR 213.D N ALA 209.D O no hydrogen 2.930 N/A THR 213.D OG1 ALA 209.D O no hydrogen 3.426 N/A THR 213.D OG1 ALA 210.D O no hydrogen 2.348 N/A GLU 214.D N ALA 210.D O no hydrogen 3.018 N/A SER 215.D N ARG 211.D O no hydrogen 2.908 N/A SER 215.D OG ARG 211.D O no hydrogen 3.201 N/A SER 215.D OG GLU 214.D OE1 no hydrogen 3.237 N/A LEU 216.D N LEU 212.D O no hydrogen 2.965 N/A GLY 217.D N THR 213.D O no hydrogen 2.880 N/A LYS 218.D N GLU 214.D O no hydrogen 2.973 N/A ALA 219.D N SER 215.D O no hydrogen 2.946 N/A LEU 220.D N LEU 216.D O no hydrogen 2.861 N/A ARG 221.D N GLY 217.D O no hydrogen 2.989 N/A GLN 222.D N LYS 218.D O no hydrogen 2.949 N/A LEU 223.D N ALA 219.D O no hydrogen 2.928 N/A GLU 228.D N GLU 228.D OE1 no hydrogen 2.909 N/A GLN 229.D NE2 ASP 193.D OD1 no hydrogen 3.222 N/A LYS 230.D N THR 226.D O no hydrogen 2.896 N/A LYS 231.D N ASP 227.D O no hydrogen 2.898 N/A ARG 232.D N GLU 228.D O no hydrogen 2.910 N/A LEU 243.D N THR 239.D O no hydrogen 2.910 N/A LEU 244.D N LEU 240.D O no hydrogen 2.918 N/A GLY 245.D N HIS 241.D O no hydrogen 2.879 N/A ALA 246.D N HIS 241.D O no hydrogen 3.136 N/A ARG 254.D N GLY 245.D O no hydrogen 2.747 N/A GLY 258.D N HIS 256.D ND1 no hydrogen 3.012 N/A ASN 259.D N HIS 256.D O no hydrogen 2.983 N/A ASN 259.D ND2 ARG 254.D O no hydrogen 2.958 N/A LEU 261.D N ALA 285.D O no hydrogen 3.252 N/A ASP 264.D N ARG 198.D O no hydrogen 2.840 N/A VAL 265.D N ARG 198.D O no hydrogen 3.311 N/A LEU 266.D N ARG 291.D O no hydrogen 2.916 N/A VAL 267.D N ARG 200.D O no hydrogen 3.150 N/A VAL 268.D N ILE 293.D O no hydrogen 3.079 N/A ASP 269.D N ALA 202.D O no hydrogen 2.980 N/A ALA 271.D N LEU 295.D O no hydrogen 2.793 N/A SER 272.D OG LEU 301.D O no hydrogen 3.241 N/A LEU 276.D N GLY 307.D O no hydrogen 3.435 N/A MET 278.D N ASP 275.D OD1 no hydrogen 2.761 N/A MET 279.D N ASP 275.D O no hydrogen 2.867 N/A SER 280.D N LEU 276.D O no hydrogen 2.946 N/A ARG 281.D N PRO 277.D O no hydrogen 2.932 N/A LEU 282.D N MET 278.D O no hydrogen 2.904 N/A ILE 283.D N MET 279.D O no hydrogen 2.895 N/A ASP 284.D N SER 280.D O no hydrogen 3.000 N/A ALA 285.D N LEU 282.D O no hydrogen 3.177 N/A LEU 286.D N ILE 283.D O no hydrogen 3.366 N/A ARG 291.D N ASP 264.D O no hydrogen 3.205 N/A VAL 292.D N ARG 165.D O no hydrogen 3.300 N/A ILE 293.D N LEU 266.D O no hydrogen 3.010 N/A PHE 294.D N SER 167.D O no hydrogen 3.178 N/A LEU 295.D N VAL 268.D O no hydrogen 3.226 N/A ASP 299.D N ASP 297.D OD1 no hydrogen 3.074 N/A SER 303.D OG GLY 307.D O no hydrogen 2.715 N/A GLY 307.D N GLY 49.D O no hydrogen 3.064 N/A ILE 313.D N VAL 309.D O no hydrogen 2.908 N/A CYS 314.D N LEU 310.D O no hydrogen 2.887 N/A ALA 315.D N GLY 311.D O no hydrogen 2.917 N/A TYR 316.D N ILE 313.D O no hydrogen 3.121 N/A ALA 317.D N CYS 314.D O no hydrogen 3.254 N/A ALA 319.D N TYR 316.D O no hydrogen 3.427 N/A ARG 325.D NH1 GLN 328.D OE1 no hydrogen 2.542 N/A ALA 326.D N THR 322.D O no hydrogen 2.871 N/A GLN 328.D N GLU 324.D O no hydrogen 2.942 N/A LEU 329.D N ARG 325.D O no hydrogen 2.897 N/A SER 330.D N ALA 326.D O no hydrogen 2.900 N/A SER 330.D OG ALA 326.D O no hydrogen 2.920 N/A SER 330.D OG THR 335.D O no hydrogen 3.358 N/A ARG 331.D N ARG 327.D O no hydrogen 2.890 N/A LEU 332.D N GLN 328.D O no hydrogen 2.962 N/A THR 333.D N LEU 329.D O no hydrogen 2.911 N/A GLY 334.D N SER 330.D O no hydrogen 3.269 N/A GLY 340.D N PHE 321.D O no hydrogen 3.087 N/A ARG 349.D N ALA 345.D O no hydrogen 2.891 N/A ARG 349.D NE GLY 320.D O no hydrogen 2.863 N/A ARG 349.D NH2 ALA 319.D O no hydrogen 3.377 N/A ASP 350.D N ALA 346.D O no hydrogen 2.926 N/A SER 351.D N SER 347.D O no hydrogen 2.925 N/A SER 351.D OG SER 347.D O no hydrogen 2.392 N/A LEU 352.D N LEU 348.D O no hydrogen 3.229 N/A CYS 353.D N VAL 168.D O no hydrogen 2.874 N/A CYS 353.D SG LEU 354.D O no hydrogen 3.532 N/A ARG 360.D N GLY 174.D O no hydrogen 3.370 N/A ARG 360.D NH2 GLU 545.D OE1 no hydrogen 2.641 N/A GLY 366.D N ASP 392.D OD1 no hydrogen 3.056 N/A ILE 367.D N ASP 392.D OD2 no hydrogen 3.090 N/A GLN 369.D N SER 365.D O no hydrogen 2.936 N/A LEU 370.D N GLY 366.D O no hydrogen 2.907 N/A ALA 371.D N ILE 367.D O no hydrogen 2.877 N/A ALA 372.D N GLY 368.D O no hydrogen 2.929 N/A ALA 373.D N GLN 369.D O no hydrogen 2.934 N/A ILE 374.D N LEU 370.D O no hydrogen 2.885 N/A ARG 376.D N ALA 373.D O no hydrogen 2.971 N/A ARG 376.D NH1 ALA 372.D O no hydrogen 3.317 N/A VAL 382.D N ASP 378.D O no hydrogen 2.927 N/A LYS 383.D N LYS 379.D O no hydrogen 2.892 N/A THR 384.D N THR 380.D O no hydrogen 2.864 N/A THR 384.D OG1 THR 380.D O no hydrogen 2.366 N/A VAL 385.D N ALA 381.D O no hydrogen 2.985 N/A PHE 386.D N VAL 382.D O no hydrogen 2.925 N/A GLN 387.D N LYS 383.D O no hydrogen 2.931 N/A GLN 388.D N PHE 386.D O no hydrogen 2.775 N/A ASP 389.D N GLN 387.D O no hydrogen 2.713 N/A THR 391.D OG1 PHE 390.D O no hydrogen 2.661 N/A LYS 395.D NZ GLU 583.D OE1 no hydrogen 3.247 N/A ARG 396.D N LEU 579.D O no hydrogen 3.095 N/A ARG 396.D NH1 LYS 395.D O no hydrogen 2.525 N/A LEU 398.D N ARG 396.D O no hydrogen 2.904 N/A GLN 399.D N ASP 403.D OD2 no hydrogen 3.011 N/A SER 400.D N ASP 403.D OD2 no hydrogen 3.428 N/A GLY 401.D N SER 400.D OG no hydrogen 2.712 N/A ASP 403.D N SER 400.D O no hydrogen 3.143 N/A TYR 404.D N SER 400.D O no hydrogen 2.902 N/A TYR 404.D OH PRO 448.D O no hydrogen 2.824 N/A ILE 405.D N GLY 401.D O no hydrogen 2.909 N/A MET 407.D N ASP 403.D O no hydrogen 2.904 N/A LEU 408.D N TYR 404.D O no hydrogen 2.932 N/A GLU 409.D N ILE 405.D O no hydrogen 2.912 N/A GLU 410.D N ALA 406.D O no hydrogen 2.881 N/A ALA 411.D N MET 407.D O no hydrogen 2.894 N/A LEU 412.D N LEU 408.D O no hydrogen 2.991 N/A ALA 413.D N GLU 409.D O no hydrogen 2.880 N/A GLY 414.D N GLU 410.D O no hydrogen 2.899 N/A TYR 415.D N ALA 411.D O no hydrogen 2.932 N/A GLY 416.D N ALA 413.D O no hydrogen 3.422 N/A TYR 418.D OH GLY 479.D O no hydrogen 2.631 N/A LEU 419.D N TYR 415.D O no hydrogen 2.949 N/A ASP 420.D N GLY 416.D O no hydrogen 2.875 N/A LEU 421.D N ARG 417.D O no hydrogen 2.903 N/A LEU 422.D N TYR 418.D O no hydrogen 2.892 N/A GLN 423.D N LEU 419.D O no hydrogen 2.897 N/A ALA 424.D N LEU 421.D O no hydrogen 3.047 N/A ARG 425.D N LEU 422.D O no hydrogen 3.349 N/A ARG 425.D NH1 ASP 503.D O no hydrogen 3.447 N/A ARG 425.D NH2 ASP 503.D O no hydrogen 3.311 N/A ILE 431.D N GLU 427.D O no hydrogen 2.939 N/A ILE 432.D N PRO 428.D O no hydrogen 2.950 N/A GLN 433.D N ASP 429.D O no hydrogen 2.923 N/A ALA 434.D N LEU 430.D O no hydrogen 2.838 N/A PHE 435.D N ILE 431.D O no hydrogen 2.928 N/A ASN 436.D N GLN 433.D O no hydrogen 3.247 N/A ASN 436.D ND2 ILE 432.D O no hydrogen 3.696 N/A GLN 439.D N HIS 548.D O no hydrogen 3.190 N/A GLN 439.D NE2 THR 533.D O no hydrogen 3.189 N/A LEU 441.D N ALA 550.D O no hydrogen 2.599 N/A CYS 442.D SG LEU 444.D O no hydrogen 3.243 N/A ALA 452.D N ARG 445.D O no hydrogen 3.453 N/A LEU 454.D N GLY 450.D O no hydrogen 2.910 N/A ASN 455.D N VAL 451.D O no hydrogen 2.918 N/A ASN 455.D ND2 VAL 451.D O no hydrogen 2.646 N/A GLU 456.D N ALA 452.D O no hydrogen 2.911 N/A ARG 457.D N GLY 453.D O no hydrogen 2.960 N/A ILE 458.D N LEU 454.D O no hydrogen 2.920 N/A GLU 459.D N ASN 455.D O no hydrogen 2.914 N/A GLN 460.D N GLU 456.D O no hydrogen 2.906 N/A PHE 461.D N ARG 457.D O no hydrogen 2.902 N/A MET 462.D N ILE 458.D O no hydrogen 2.983 N/A GLN 463.D N GLU 459.D O no hydrogen 2.885 N/A GLN 464.D N GLN 460.D O no hydrogen 2.905 N/A LYS 465.D N PHE 461.D O no hydrogen 2.949 N/A HIS 469.D ND1 ARG 470.D O no hydrogen 2.649 N/A ARG 470.D NE GLN 463.D OE1 no hydrogen 2.551 N/A SER 474.D N HIS 471.D O no hydrogen 2.922 N/A SER 474.D OG TRP 476.D O no hydrogen 2.963 N/A TRP 476.D N SER 474.D OG no hydrogen 3.019 N/A TYR 477.D OH GLU 459.D OE2 no hydrogen 2.319 N/A GLY 479.D N ALA 501.D O no hydrogen 2.660 N/A VAL 482.D N GLY 499.D O no hydrogen 2.936 N/A MET 483.D N GLU 531.D O no hydrogen 3.281 N/A ASP 488.D N LEU 493.D O no hydrogen 3.379 N/A GLY 492.D N SER 489.D O no hydrogen 3.195 N/A ASN 495.D N ASN 487.D OD1 no hydrogen 2.502 N/A GLY 496.D N ILE 484.D O no hydrogen 2.936 N/A ILE 498.D N ASP 497.D OD1 no hydrogen 2.577 N/A GLY 499.D N VAL 482.D O no hydrogen 3.213 N/A ILE 500.D N TRP 511.D O no hydrogen 3.322 N/A ALA 501.D N ARG 480.D O no hydrogen 3.067 N/A ARG 504.D NH1 ALA 426.D O no hydrogen 2.914 N/A ARG 504.D NH2 ALA 426.D O no hydrogen 2.686 N/A VAL 510.D N VAL 522.D O no hydrogen 3.190 N/A TRP 511.D N ILE 500.D O no hydrogen 3.174 N/A TRP 511.D NE1 LEU 502.D O no hydrogen 3.270 N/A PHE 512.D N LYS 520.D O no hydrogen 2.839 N/A MET 514.D N ASN 518.D O no hydrogen 3.096 N/A GLY 517.D N MET 514.D O no hydrogen 3.126 N/A LYS 520.D N PHE 512.D O no hydrogen 3.273 N/A LYS 520.D NZ LEU 491.D O no hydrogen 2.369 N/A VAL 522.D N VAL 510.D O no hydrogen 3.101 N/A ARG 526.D N GLN 523.D O no hydrogen 2.887 N/A LEU 527.D N PRO 524.D O no hydrogen 3.514 N/A THR 532.D OG1 GLU 459.D OE2 no hydrogen 3.274 N/A TRP 534.D N ASN 455.D OD1 no hydrogen 2.830 N/A TRP 534.D NE1 TYR 477.D OH no hydrogen 2.947 N/A MET 536.D N LEU 440.D O no hydrogen 3.240 N/A VAL 538.D N CYS 442.D O no hydrogen 3.238 N/A LYS 540.D N THR 537.D O no hydrogen 3.226 N/A LYS 540.D NZ ASN 495.D OD1 no hydrogen 3.216 N/A SER 541.D N VAL 538.D O no hydrogen 2.978 N/A SER 541.D OG VAL 538.D O no hydrogen 2.410 N/A SER 544.D N SER 541.D O no hydrogen 3.410 N/A PHE 546.D N ARG 572.D O no hydrogen 3.103 N/A HIS 548.D NE2 SER 578.D OG no hydrogen 2.662 N/A ILE 552.D N LEU 441.D O no hydrogen 3.358 N/A LEU 553.D N TYR 580.D O no hydrogen 2.988 N/A ARG 563.D NE ILE 590.D O no hydrogen 3.497 N/A VAL 566.D N THR 562.D O no hydrogen 2.949 N/A TYR 567.D N ARG 563.D O no hydrogen 2.865 N/A TYR 567.D OH ASP 297.D OD2 no hydrogen 2.825 N/A THR 568.D N GLU 564.D O no hydrogen 2.944 N/A ALA 569.D N LEU 565.D O no hydrogen 2.951 N/A VAL 570.D N VAL 566.D O no hydrogen 2.918 N/A THR 571.D N TYR 567.D O no hydrogen 2.905 N/A THR 571.D OG1 TYR 567.D O no hydrogen 2.500 N/A ARG 572.D NH1 SER 544.D O no hydrogen 2.578 N/A ARG 574.D NE ASP 547.D OD1 no hydrogen 2.363 N/A ARG 574.D NH2 GLU 545.D O no hydrogen 2.579 N/A ARG 574.D NH2 ASP 547.D OD1 no hydrogen 2.991 N/A SER 578.D OG ALA 549.D O no hydrogen 3.109 N/A LEU 586.D N ASP 582.D O no hydrogen 2.918 N/A SER 587.D N GLU 583.D O no hydrogen 2.872 N/A SER 587.D OG ASP 378.D OD2 no hydrogen 2.907 N/A ALA 588.D N ARG 584.D O no hydrogen 2.940 N/A ALA 589.D N ILE 585.D O no hydrogen 2.903 N/A ILE 590.D N LEU 586.D O no hydrogen 2.936 N/A ALA 591.D N SER 587.D O no hydrogen 2.893 N/A THR 592.D N ALA 588.D O no hydrogen 2.938 N/A THR 592.D OG1 ALA 588.D O no hydrogen 3.076 N/A THR 592.D OG1 ALA 589.D O no hydrogen 3.177 N/A ARG 593.D N ALA 591.D O no hydrogen 2.719 N/A ARG 593.D NE THR 594.D O no hydrogen 2.754 N/A ARG 593.D NH2 THR 594.D O no hydrogen 3.559 N/A THR 594.D OG1 GLU 595.D O no hydrogen 3.462 N/A ARG 596.D NH1 SER 303.D O no hydrogen 3.095 N/A ARG 596.D NH2 SER 303.D O no hydrogen 2.962 N/A ARG 597.D N HIS 50.D ND1 no hydrogen 3.059 N/A SER 598.D OG ARG 596.D O no hydrogen 3.164 N/A GLY 599.D N GLU 116.D OE1 no hydrogen 3.342 N/A LEU 603.D N GLY 599.D O no hydrogen 2.932 N/A PHE 604.D N LEU 600.D O no hydrogen 2.888 N/A SER 606.D N LEU 603.D O no hydrogen 3.288 N/A SER 606.D OG ALA 602.D O no hydrogen 3.243 N/A SER 606.D OG LEU 603.D O no hydrogen 3.423 N/A