Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8wa1_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ASP 1.A O no hydrogen 3.073 N/A PHE 6.A N PHE 2.A O no hydrogen 2.905 N/A LYS 7.A N SER 3.A O no hydrogen 2.899 N/A GLU 8.A N HIS 4.A O no hydrogen 2.908 N/A PHE 9.A N VAL 5.A O no hydrogen 2.898 N/A ALA 10.A N PHE 6.A O no hydrogen 2.901 N/A ALA 11.A N LYS 7.A O no hydrogen 2.900 N/A ARG 12.A N GLU 8.A O no hydrogen 2.903 N/A GLY 13.A N ALA 10.A O no hydrogen 3.405 N/A ASP 14.A N PHE 9.A O no hydrogen 2.720 N/A SER 18.A N ASP 14.A O no hydrogen 3.121 N/A LEU 19.A N TRP 15.A O no hydrogen 2.901 N/A ARG 20.A N GLN 16.A O no hydrogen 2.908 N/A LEU 21.A N ARG 17.A O no hydrogen 2.897 N/A PHE 22.A N SER 18.A O no hydrogen 2.900 N/A LYS 23.A N LEU 19.A O no hydrogen 2.901 N/A TYR 24.A N ARG 20.A O no hydrogen 2.909 N/A MET 25.A N LEU 21.A O no hydrogen 2.890 N/A GLN 26.A N PHE 22.A O no hydrogen 2.903 N/A ARG 27.A N TYR 24.A O no hydrogen 3.355 N/A GLN 28.A N MET 25.A O no hydrogen 3.094 N/A TYR 38.A N ASN 34.A O no hydrogen 3.143 N/A THR 39.A N GLU 35.A O no hydrogen 2.901 N/A LEU 40.A N HIS 36.A O no hydrogen 2.903 N/A MET 41.A N ILE 37.A O no hydrogen 2.901 N/A ILE 42.A N TYR 38.A O no hydrogen 2.898 N/A GLY 43.A N THR 39.A O no hydrogen 2.903 N/A ILE 44.A N LEU 40.A O no hydrogen 2.904 N/A LEU 45.A N MET 41.A O no hydrogen 2.901 N/A GLY 46.A N ILE 42.A O no hydrogen 2.897 N/A ARG 47.A N GLY 43.A O no hydrogen 2.906 N/A GLY 49.A N GLY 46.A O no hydrogen 3.274 N/A LEU 50.A N LEU 45.A O no hydrogen 2.735 N/A ALA 54.A N LEU 50.A O no hydrogen 3.024 N/A PHE 55.A N LEU 51.A O no hydrogen 2.900 N/A GLU 56.A N ASP 52.A O no hydrogen 2.905 N/A ILE 57.A N LYS 53.A O no hydrogen 2.902 N/A PHE 58.A N ALA 54.A O no hydrogen 2.903 N/A ASP 59.A N PHE 55.A O no hydrogen 2.896 N/A GLU 60.A N GLU 56.A O no hydrogen 2.902 N/A MET 61.A N PHE 58.A O no hydrogen 3.452 N/A HIS 64.A N GLU 60.A O no hydrogen 3.136 N/A HIS 64.A N MET 61.A O no hydrogen 3.277 N/A VAL 66.A N MET 61.A O no hydrogen 2.808 N/A SER 72.A N THR 69.A O no hydrogen 3.272 N/A THR 74.A N VAL 70.A O no hydrogen 2.907 N/A ALA 75.A N PHE 71.A O no hydrogen 2.898 N/A ILE 76.A N SER 72.A O no hydrogen 2.904 N/A ILE 77.A N TYR 73.A O no hydrogen 2.899 N/A ASN 78.A N THR 74.A O no hydrogen 2.898 N/A ALA 79.A N ALA 75.A O no hydrogen 2.902 N/A TYR 80.A N ILE 76.A O no hydrogen 2.908 N/A GLY 81.A N ILE 77.A O no hydrogen 2.893 N/A ARG 82.A N ASN 78.A O no hydrogen 2.902 N/A ASN 83.A N TYR 80.A O no hydrogen 3.327 N/A GLY 84.A N GLY 81.A O no hydrogen 3.098 N/A GLN 85.A N TYR 80.A O no hydrogen 3.010 N/A SER 89.A N GLN 85.A O no hydrogen 3.197 N/A LEU 90.A N TYR 86.A O no hydrogen 2.913 N/A GLN 91.A N GLY 87.A O no hydrogen 2.895 N/A LEU 92.A N THR 88.A O no hydrogen 2.896 N/A LEU 93.A N SER 89.A O no hydrogen 2.904 N/A GLU 94.A N LEU 90.A O no hydrogen 2.907 N/A LYS 95.A N GLN 91.A O no hydrogen 2.894 N/A MET 96.A N LEU 92.A O no hydrogen 2.898 N/A LYS 97.A N LEU 93.A O no hydrogen 2.902 N/A GLN 98.A N GLU 94.A O no hydrogen 2.903 N/A GLU 99.A N LYS 95.A O no hydrogen 2.935 N/A LYS 100.A N LYS 97.A O no hydrogen 3.402 N/A ILE 101.A N MET 96.A O no hydrogen 3.050 N/A TYR 108.A N SER 104.A O no hydrogen 3.141 N/A ASN 109.A N ILE 105.A O no hydrogen 2.908 N/A THR 110.A N LEU 106.A O no hydrogen 2.895 N/A VAL 111.A N THR 107.A O no hydrogen 2.901 N/A ILE 112.A N TYR 108.A O no hydrogen 2.905 N/A ASN 113.A N ASN 109.A O no hydrogen 2.901 N/A SER 114.A N THR 110.A O no hydrogen 2.889 N/A CYS 115.A N VAL 111.A O no hydrogen 2.903 N/A ALA 116.A N ILE 112.A O no hydrogen 2.905 N/A ARG 117.A N ASN 113.A O no hydrogen 2.898 N/A GLY 118.A N SER 114.A O no hydrogen 2.897 N/A HIS 120.A N CYS 115.A O no hydrogen 3.028 N/A GLY 124.A N GLU 121.A O no hydrogen 3.255 N/A LEU 125.A N GLU 121.A O no hydrogen 3.495 N/A LEU 126.A N TRP 122.A O no hydrogen 2.909 N/A SER 127.A N GLU 123.A O no hydrogen 2.897 N/A LEU 128.A N GLY 124.A O no hydrogen 2.900 N/A PHE 129.A N LEU 125.A O no hydrogen 2.903 N/A ALA 130.A N LEU 126.A O no hydrogen 2.903 N/A GLU 131.A N SER 127.A O no hydrogen 2.896 N/A MET 132.A N LEU 128.A O no hydrogen 2.900 N/A ARG 133.A N PHE 129.A O no hydrogen 2.899 N/A HIS 134.A N ALA 130.A O no hydrogen 2.899 N/A GLU 135.A N GLU 131.A O no hydrogen 3.120 N/A GLU 135.A N MET 132.A O no hydrogen 3.142 N/A GLY 136.A N ARG 133.A O no hydrogen 3.366 N/A ILE 137.A N MET 132.A O no hydrogen 3.141 N/A TYR 144.A N ASP 140.A O no hydrogen 2.549 N/A ASN 145.A N LEU 141.A O no hydrogen 2.907 N/A THR 146.A N VAL 142.A O no hydrogen 2.898 N/A LEU 147.A N THR 143.A O no hydrogen 2.886 N/A LEU 148.A N TYR 144.A O no hydrogen 2.908 N/A SER 149.A N ASN 145.A O no hydrogen 2.904 N/A ALA 150.A N THR 146.A O no hydrogen 2.897 N/A SER 153.A N SER 149.A O no hydrogen 2.887 N/A ARG 154.A N ALA 150.A O no hydrogen 2.921 N/A GLY 155.A N SER 152.A O no hydrogen 3.114 N/A ALA 160.A N LEU 156.A O no hydrogen 2.712 N/A GLU 161.A N GLY 157.A O no hydrogen 2.918 N/A MET 162.A N ASP 158.A O no hydrogen 2.884 N/A VAL 163.A N GLU 159.A O no hydrogen 2.890 N/A PHE 164.A N ALA 160.A O no hydrogen 2.914 N/A ARG 165.A N GLU 161.A O no hydrogen 2.901 N/A THR 166.A N MET 162.A O no hydrogen 2.881 N/A GLU 169.A N ARG 165.A O no hydrogen 2.893 N/A GLY 171.A N ASN 168.A O no hydrogen 3.204 N/A SER 180.A N VAL 176.A O no hydrogen 2.845 N/A TYR 181.A N THR 177.A O no hydrogen 2.926 N/A LEU 182.A N THR 178.A O no hydrogen 2.882 N/A VAL 183.A N TYR 179.A O no hydrogen 2.899 N/A ASP 184.A N SER 180.A O no hydrogen 2.908 N/A THR 185.A N TYR 181.A O no hydrogen 2.910 N/A PHE 186.A N LEU 182.A O no hydrogen 2.892 N/A GLY 187.A N VAL 183.A O no hydrogen 2.918 N/A GLY 190.A N PHE 186.A O no hydrogen 2.715 N/A GLU 197.A N GLU 193.A O no hydrogen 3.376 N/A LEU 198.A N LYS 194.A O no hydrogen 2.892 N/A MET 200.A N SER 196.A O no hydrogen 2.901 N/A GLU 201.A N GLU 197.A O no hydrogen 2.899 N/A MET 202.A N LEU 198.A O no hydrogen 2.901 N/A GLU 203.A N LEU 199.A O no hydrogen 2.907 N/A ALA 204.A N MET 200.A O no hydrogen 2.896 N/A TYR 214.A N GLU 210.A O no hydrogen 2.999 N/A ASN 215.A N VAL 211.A O no hydrogen 2.894 N/A VAL 216.A N THR 212.A O no hydrogen 2.891 N/A LEU 217.A N SER 213.A O no hydrogen 2.906 N/A LEU 218.A N TYR 214.A O no hydrogen 2.907 N/A GLU 219.A N ASN 215.A O no hydrogen 2.883 N/A ALA 220.A N VAL 216.A O no hydrogen 2.899 N/A TYR 221.A N LEU 217.A O no hydrogen 2.911 N/A ALA 222.A N LEU 218.A O no hydrogen 2.896 N/A HIS 223.A N GLU 219.A O no hydrogen 2.895 N/A SER 224.A N ALA 220.A O no hydrogen 3.112 N/A GLY 225.A N TYR 221.A O no hydrogen 3.145 N/A GLY 225.A N ALA 222.A O no hydrogen 3.056 N/A SER 226.A N TYR 221.A O no hydrogen 3.035 N/A ALA 230.A N SER 226.A O no hydrogen 3.083 N/A MET 231.A N MET 227.A O no hydrogen 2.951 N/A ASP 232.A N LYS 228.A O no hydrogen 2.919 N/A VAL 233.A N GLU 229.A O no hydrogen 2.887 N/A PHE 234.A N ALA 230.A O no hydrogen 2.909 N/A ARG 235.A N MET 231.A O no hydrogen 2.901 N/A GLN 236.A N ASP 232.A O no hydrogen 2.893 N/A MET 237.A N VAL 233.A O no hydrogen 2.889 N/A GLN 238.A N PHE 234.A O no hydrogen 2.934 N/A THR 239.A N ARG 235.A O no hydrogen 2.885 N/A ALA 240.A N GLN 236.A O no hydrogen 2.893 N/A SER 250.A N ALA 246.A O no hydrogen 2.881 N/A VAL 251.A N GLU 247.A O no hydrogen 2.923 N/A LEU 252.A N THR 248.A O no hydrogen 2.888 N/A LEU 253.A N TYR 249.A O no hydrogen 2.888 N/A ASN 254.A N SER 250.A O no hydrogen 2.894 N/A LEU 255.A N VAL 251.A O no hydrogen 2.969 N/A TYR 256.A N LEU 252.A O no hydrogen 2.607 N/A GLY 257.A N LEU 253.A O no hydrogen 2.669 N/A LYS 258.A N ASN 254.A O no hydrogen 3.009 N/A ASN 259.A N LEU 255.A O no hydrogen 3.065 N/A GLY 260.A N TYR 256.A O no hydrogen 2.698 N/A ARG 266.A N TYR 262.A O no hydrogen 3.334 N/A ASP 267.A N ASP 263.A O no hydrogen 2.956 N/A LEU 268.A N GLN 264.A O no hydrogen 2.805 N/A PHE 269.A N VAL 265.A O no hydrogen 2.940 N/A LEU 270.A N ARG 266.A O no hydrogen 2.935 N/A GLU 271.A N ASP 267.A O no hydrogen 2.717 N/A MET 272.A N LEU 268.A O no hydrogen 2.935 N/A LYS 273.A N PHE 269.A O no hydrogen 2.900 N/A MET 274.A N LEU 270.A O no hydrogen 2.896 N/A SER 275.A N GLU 271.A O no hydrogen 2.901 N/A THR 277.A N MET 272.A O no hydrogen 2.873 N/A TYR 284.A N ASP 280.A O no hydrogen 3.079 N/A ASN 285.A N ALA 281.A O no hydrogen 2.904 N/A ILE 286.A N ASP 282.A O no hydrogen 2.903 N/A LEU 287.A N THR 283.A O no hydrogen 2.931 N/A ILE 288.A N TYR 284.A O no hydrogen 2.898 N/A GLN 289.A N ASN 285.A O no hydrogen 3.018 N/A VAL 290.A N ILE 286.A O no hydrogen 3.125 N/A PHE 291.A N LEU 287.A O no hydrogen 2.898 N/A GLY 292.A N ILE 288.A O no hydrogen 2.754 N/A GLU 293.A N GLN 289.A O no hydrogen 3.055 N/A GLY 294.A N VAL 290.A O no hydrogen 3.161 N/A GLY 295.A N PHE 291.A O no hydrogen 2.848 N/A VAL 300.A N TYR 296.A O no hydrogen 2.820 N/A VAL 301.A N PHE 297.A O no hydrogen 3.104 N/A THR 302.A N LYS 298.A O no hydrogen 2.902 N/A LEU 303.A N GLU 299.A O no hydrogen 2.867 N/A PHE 304.A N VAL 300.A O no hydrogen 2.906 N/A HIS 305.A N VAL 301.A O no hydrogen 2.919 N/A ASP 306.A N THR 302.A O no hydrogen 2.879 N/A MET 307.A N LEU 303.A O no hydrogen 2.871 N/A VAL 308.A N PHE 304.A O no hydrogen 2.922 N/A GLU 310.A N ASP 306.A O no hydrogen 2.895 N/A TYR 319.A N ASN 315.A O no hydrogen 2.998 N/A TYR 319.A OH HIS 341.A ND1 no hydrogen 2.740 N/A GLU 320.A N MET 316.A O no hydrogen 2.906 N/A GLY 321.A N GLU 317.A O no hydrogen 2.888 N/A LEU 322.A N THR 318.A O no hydrogen 2.924 N/A ILE 323.A N TYR 319.A O no hydrogen 2.906 N/A TYR 324.A N GLU 320.A O no hydrogen 2.891 N/A ALA 325.A N GLY 321.A O no hydrogen 2.922 N/A CYS 326.A N LEU 322.A O no hydrogen 2.913 N/A GLY 327.A N ILE 323.A O no hydrogen 2.873 N/A LYS 328.A N TYR 324.A O no hydrogen 2.908 N/A GLY 329.A N ALA 325.A O no hydrogen 2.908 N/A GLY 330.A N CYS 326.A O no hydrogen 2.885 N/A LEU 331.A N CYS 326.A O no hydrogen 2.754 N/A LYS 336.A N HIS 332.A O no hydrogen 3.207 N/A ARG 337.A N ASP 333.A O no hydrogen 2.906 N/A ILE 338.A N ASP 334.A O no hydrogen 2.899 N/A LEU 339.A N ALA 335.A O no hydrogen 2.905 N/A LEU 340.A N LYS 336.A O no hydrogen 2.890 N/A HIS 341.A N ARG 337.A O no hydrogen 2.903 N/A HIS 341.A ND1 TYR 319.A OH no hydrogen 2.740 N/A MET 342.A N ILE 338.A O no hydrogen 2.903 N/A ASN 343.A N LEU 339.A O no hydrogen 2.901 N/A GLY 344.A N LEU 340.A O no hydrogen 2.894 N/A GLN 345.A N HIS 341.A O no hydrogen 2.913 N/A GLY 346.A N ASN 343.A O no hydrogen 3.208 N/A LEU 347.A N MET 342.A O no hydrogen 3.243 N/A SER 351.A OG SER 382.A OG no hydrogen 3.191 N/A SER 351.A OG ARG 383.A O no hydrogen 3.301 N/A TYR 354.A N SER 350.A O no hydrogen 3.004 N/A THR 355.A N SER 351.A O no hydrogen 2.894 N/A THR 355.A OG1 SER 351.A O no hydrogen 2.487 N/A GLY 356.A N LYS 352.A O no hydrogen 2.921 N/A VAL 357.A N VAL 353.A O no hydrogen 2.915 N/A ILE 358.A N TYR 354.A O no hydrogen 2.892 N/A GLU 359.A N THR 355.A O no hydrogen 2.914 N/A ALA 360.A N GLY 356.A O no hydrogen 2.918 N/A TYR 361.A N VAL 357.A O no hydrogen 2.902 N/A GLY 362.A N ILE 358.A O no hydrogen 2.887 N/A GLN 363.A N GLU 359.A O no hydrogen 2.920 N/A ALA 364.A N ALA 360.A O no hydrogen 3.378 N/A ALA 365.A N GLY 362.A O no hydrogen 3.087 N/A LEU 366.A N TYR 361.A O no hydrogen 2.793 N/A TYR 367.A N ALA 365.A O no hydrogen 2.956 N/A ALA 370.A N LEU 366.A O no hydrogen 3.239 N/A VAL 371.A N TYR 367.A O no hydrogen 2.910 N/A VAL 372.A N GLU 368.A O no hydrogen 2.918 N/A ALA 373.A N GLU 369.A O no hydrogen 2.895 N/A PHE 374.A N ALA 370.A O no hydrogen 2.914 N/A ASN 375.A N VAL 371.A O no hydrogen 2.907 N/A THR 376.A N VAL 372.A O no hydrogen 2.889 N/A THR 376.A OG1 VAL 372.A O no hydrogen 3.050 N/A THR 376.A OG1 ALA 373.A O no hydrogen 2.531 N/A MET 377.A N ALA 373.A O no hydrogen 2.900 N/A ASN 378.A N PHE 374.A O no hydrogen 2.923 N/A GLU 379.A N ASN 375.A O no hydrogen 2.970 N/A VAL 380.A N THR 376.A O no hydrogen 2.726 N/A ARG 383.A NH2 VAL 415.A O no hydrogen 3.230 N/A THR 388.A OG1 MET 385.A O no hydrogen 2.701 N/A PHE 389.A N MET 385.A O no hydrogen 3.435 N/A ASN 390.A N VAL 386.A O no hydrogen 2.921 N/A ASN 390.A ND2 GLU 387.A OE1 no hydrogen 3.322 N/A SER 391.A N GLU 387.A O no hydrogen 2.895 N/A SER 391.A OG THR 355.A O no hydrogen 3.450 N/A LEU 392.A N THR 388.A O no hydrogen 2.921 N/A ILE 393.A N PHE 389.A O no hydrogen 2.903 N/A HIS 394.A N ASN 390.A O no hydrogen 2.890 N/A ALA 395.A N SER 391.A O no hydrogen 2.908 N/A PHE 396.A N LEU 392.A O no hydrogen 2.904 N/A ALA 397.A N ILE 393.A O no hydrogen 2.873 N/A LYS 398.A N HIS 394.A O no hydrogen 3.295 N/A GLY 400.A N ALA 397.A O no hydrogen 3.028 N/A LEU 401.A N PHE 396.A O no hydrogen 2.700 N/A SER 405.A N LEU 401.A O no hydrogen 3.146 N/A SER 405.A OG LEU 401.A O no hydrogen 2.752 N/A GLU 406.A N TYR 402.A O no hydrogen 3.089 N/A ALA 407.A N LYS 403.A O no hydrogen 3.442 N/A ILE 408.A N GLU 404.A O no hydrogen 2.917 N/A TRP 409.A N SER 405.A O no hydrogen 2.887 N/A PHE 410.A N GLU 406.A O no hydrogen 2.921 N/A ARG 411.A N ALA 407.A O no hydrogen 2.914 N/A MET 412.A N ILE 408.A O no hydrogen 2.873 N/A GLY 413.A N TRP 409.A O no hydrogen 2.935 N/A GLU 414.A N PHE 410.A O no hydrogen 2.907 N/A VAL 415.A N ARG 411.A O no hydrogen 2.887 N/A GLY 416.A N MET 412.A O no hydrogen 3.219 N/A ASN 420.A N SER 423.A OG no hydrogen 3.273 N/A SER 423.A OG ASN 420.A O no hydrogen 2.505 N/A SER 423.A OG ASN 420.A OD1 no hydrogen 3.055 N/A PHE 424.A N ASN 420.A O no hydrogen 3.290 N/A ASN 425.A N ARG 421.A O no hydrogen 2.918 N/A GLY 426.A N ASP 422.A O no hydrogen 2.884 N/A MET 427.A N SER 423.A O no hydrogen 2.902 N/A ILE 428.A N PHE 424.A O no hydrogen 2.915 N/A GLU 429.A N ASN 425.A O no hydrogen 2.911 N/A GLY 430.A N GLY 426.A O no hydrogen 2.870 N/A TYR 431.A N MET 427.A O no hydrogen 2.939 N/A ARG 432.A N ILE 428.A O no hydrogen 2.883 N/A GLN 433.A N GLU 429.A O no hydrogen 2.898 N/A GLN 433.A NE2 MET 612.A O no hydrogen 3.610 N/A GLY 434.A N GLY 430.A O no hydrogen 3.370 N/A GLN 436.A NE2 GLU 439.A OE1 no hydrogen 3.352 N/A GLU 439.A N GLN 436.A O no hydrogen 3.289 N/A ALA 440.A N PHE 437.A O no hydrogen 3.141 N/A LYS 442.A N GLU 438.A O no hydrogen 2.942 N/A ALA 443.A N GLU 439.A O no hydrogen 2.844 N/A TYR 444.A N ALA 440.A O no hydrogen 2.945 N/A VAL 445.A N ILE 441.A O no hydrogen 2.897 N/A GLU 446.A N LYS 442.A O no hydrogen 2.899 N/A MET 447.A N ALA 443.A O no hydrogen 2.860 N/A GLU 448.A N TYR 444.A O no hydrogen 2.949 N/A LYS 449.A N VAL 445.A O no hydrogen 2.881 N/A ALA 450.A N GLU 446.A O no hydrogen 3.168 N/A CYS 452.A N MET 447.A O no hydrogen 2.924 N/A THR 458.A OG1 ASP 455.A O no hydrogen 2.465 N/A LEU 459.A N ASP 455.A O no hydrogen 2.941 N/A GLU 460.A N GLU 456.A O no hydrogen 2.885 N/A ALA 461.A N ARG 457.A O no hydrogen 2.925 N/A VAL 462.A N THR 458.A O no hydrogen 2.875 N/A LEU 463.A N LEU 459.A O no hydrogen 2.907 N/A SER 464.A N GLU 460.A O no hydrogen 2.891 N/A SER 464.A OG GLU 460.A O no hydrogen 2.893 N/A SER 464.A OG GLU 460.A OE1 no hydrogen 3.106 N/A VAL 465.A N ALA 461.A O no hydrogen 2.888 N/A VAL 465.A N VAL 462.A O no hydrogen 3.122 N/A CYS 467.A N LEU 463.A O no hydrogen 3.183 N/A CYS 467.A N SER 464.A O no hydrogen 2.984 N/A PHE 468.A N SER 464.A O no hydrogen 3.126 N/A LEU 471.A N ALA 469.A O no hydrogen 2.791 N/A SER 475.A OG VAL 472.A O no hydrogen 2.463 N/A SER 475.A OG GLU 476.A OE2 no hydrogen 2.894 N/A GLN 478.A N GLU 474.A O no hydrogen 3.463 N/A PHE 479.A N SER 475.A O no hydrogen 3.152 N/A GLN 480.A N GLU 476.A O no hydrogen 3.059 N/A GLU 481.A N GLU 477.A O no hydrogen 2.910 N/A ILE 482.A N GLN 478.A O no hydrogen 2.908 N/A LYS 483.A N PHE 479.A O no hydrogen 2.882 N/A SER 484.A N GLN 480.A O no hydrogen 2.913 N/A SER 484.A OG GLN 480.A O no hydrogen 2.807 N/A LEU 485.A N ILE 482.A O no hydrogen 3.136 N/A GLY 486.A N ILE 482.A O no hydrogen 2.532 N/A CYS 494.A N SER 490.A O no hydrogen 2.395 N/A CYS 495.A N ILE 491.A O no hydrogen 2.908 N/A CYS 495.A SG ILE 491.A O no hydrogen 3.182 N/A MET 496.A N ILE 492.A O no hydrogen 2.896 N/A MET 497.A N CYS 493.A O no hydrogen 2.919 N/A LEU 498.A N CYS 494.A O no hydrogen 2.879 N/A ALA 499.A N CYS 495.A O no hydrogen 2.892 N/A ILE 500.A N MET 496.A O no hydrogen 2.905 N/A TYR 501.A N MET 497.A O no hydrogen 2.921 N/A TYR 501.A OH GLU 476.A OE1 no hydrogen 2.284 N/A ALA 502.A N LEU 498.A O no hydrogen 2.860 N/A LYS 503.A N ALA 499.A O no hydrogen 2.909 N/A SER 504.A N ILE 500.A O no hydrogen 3.352 N/A ASN 515.A N HIS 511.A O no hydrogen 2.899 N/A ASP 516.A N GLU 512.A O no hydrogen 2.885 N/A THR 519.A OG1 ASP 516.A O no hydrogen 2.896 N/A ASN 520.A N ASP 516.A O no hydrogen 2.834 N/A THR 522.A N ASN 520.A OD1 no hydrogen 3.105 N/A THR 522.A OG1 ASN 520.A OD1 no hydrogen 2.336 N/A GLN 527.A N SER 523.A O no hydrogen 3.057 N/A VAL 528.A N ASP 524.A O no hydrogen 2.930 N/A ILE 529.A N MET 525.A O no hydrogen 2.803 N/A GLN 531.A NE2 GLN 527.A O no hydrogen 3.496 N/A ILE 533.A N ILE 529.A O no hydrogen 2.492 N/A HIS 534.A N GLY 530.A O no hydrogen 3.380 N/A TRP 543.A N ASP 539.A O no hydrogen 2.524 N/A GLN 544.A N GLU 540.A O no hydrogen 2.816 N/A MET 545.A N ASN 541.A O no hydrogen 3.039 N/A VAL 546.A N ASN 542.A O no hydrogen 2.918 N/A GLU 547.A N TRP 543.A O no hydrogen 2.906 N/A TYR 548.A N GLN 544.A O no hydrogen 2.980 N/A VAL 549.A N MET 545.A O no hydrogen 2.934 N/A PHE 550.A N VAL 546.A O no hydrogen 2.872 N/A ASP 551.A N GLU 547.A O no hydrogen 2.923 N/A LYS 552.A N TYR 548.A O no hydrogen 2.923 N/A LEU 553.A N PHE 550.A O no hydrogen 3.393 N/A SER 555.A OG ASN 554.A OD1 no hydrogen 3.290 N/A CYS 558.A SG LYS 328.A O no hydrogen 3.247 N/A CYS 558.A SG GLY 329.A O no hydrogen 3.280 N/A LEU 560.A N GLU 556.A OE1 no hydrogen 3.301 N/A LEU 560.A N GLU 556.A OE2 no hydrogen 2.700 N/A SER 561.A N GLU 556.A OE2 no hydrogen 2.386 N/A ARG 563.A NH1 GLU 429.A OE1 no hydrogen 3.411 N/A PHE 564.A N LEU 560.A O no hydrogen 2.756 N/A TYR 565.A N SER 561.A O no hydrogen 2.919 N/A ASN 566.A N MET 562.A O no hydrogen 2.891 N/A THR 567.A N ARG 563.A O no hydrogen 2.888 N/A THR 567.A OG1 ARG 563.A O no hydrogen 2.977 N/A THR 567.A OG1 PHE 564.A O no hydrogen 2.569 N/A LEU 568.A N PHE 564.A O no hydrogen 2.917 N/A ILE 569.A N TYR 565.A O no hydrogen 2.902 N/A GLU 570.A N ASN 566.A O no hydrogen 2.909 N/A ALA 571.A N THR 567.A O no hydrogen 2.895 N/A LEU 572.A N LEU 568.A O no hydrogen 2.929 N/A TRP 573.A N ILE 569.A O no hydrogen 3.271 N/A TRP 574.A NE1 ALA 502.A O no hydrogen 2.798 N/A ARG 580.A N GLN 577.A O no hydrogen 3.005 N/A ARG 580.A NE MET 532.A O no hydrogen 2.657 N/A ARG 580.A NH1 ASP 538.A OD2 no hydrogen 3.283 N/A ARG 580.A NH2 ASP 538.A OD2 no hydrogen 3.113 N/A ALA 582.A N GLU 579.A O no hydrogen 3.234 N/A ARG 583.A N ARG 580.A O no hydrogen 3.321 N/A VAL 584.A N ALA 581.A O no hydrogen 3.117 N/A ASN 586.A N ALA 582.A O no hydrogen 3.234 N/A GLU 587.A N ARG 583.A O no hydrogen 2.666 N/A ALA 588.A N VAL 584.A O no hydrogen 2.894 N/A THR 589.A N LEU 585.A O no hydrogen 2.938 N/A THR 589.A OG1 LEU 585.A O no hydrogen 3.277 N/A THR 589.A OG1 ASN 586.A O no hydrogen 2.544 N/A THR 589.A OG1 ASN 586.A OD1 no hydrogen 3.269 N/A LYS 590.A N GLU 587.A O no hydrogen 3.192 N/A ARG 591.A NH2 TYR 565.A OH no hydrogen 3.025 N/A GLY 592.A N ALA 588.A O no hydrogen 3.118 N/A LEU 593.A N ALA 588.A O no hydrogen 3.263 N/A ARG 599.A N SER 606.A O no hydrogen 3.244 N/A ARG 599.A NH1 ARG 600.A O no hydrogen 3.387 N/A ASN 601.A N VAL 604.A O no hydrogen 3.121 N/A LYS 602.A N ASN 601.A OD1 no hydrogen 2.537 N/A SER 606.A N ARG 599.A O no hydrogen 3.218 N/A SER 606.A OG SER 643.A O no hydrogen 3.008 N/A VAL 607.A N SER 643.A O no hydrogen 3.254 N/A ASP 608.A N LEU 597.A O no hydrogen 3.005 N/A VAL 609.A N VAL 645.A O no hydrogen 2.771 N/A HIS 610.A ND1 VAL 646.A O no hydrogen 3.218 N/A ARG 611.A NH2 PRO 595.A O no hydrogen 3.009 N/A MET 612.A N VAL 609.A O no hydrogen 3.492 N/A GLY 615.A N GLU 570.A OE1 no hydrogen 2.868 N/A GLY 616.A N GLU 570.A OE2 no hydrogen 2.534 N/A ALA 617.A N TRP 613.A O no hydrogen 2.682 N/A CYS 618.A N PRO 614.A O no hydrogen 2.899 N/A CYS 618.A SG PRO 614.A O no hydrogen 3.229 N/A THR 619.A N GLY 615.A O no hydrogen 2.935 N/A THR 619.A OG1 GLY 615.A O no hydrogen 3.159 N/A THR 619.A OG1 GLY 616.A O no hydrogen 2.689 N/A ALA 620.A N GLY 616.A O no hydrogen 2.872 N/A ILE 621.A N ALA 617.A O no hydrogen 2.908 N/A SER 622.A N CYS 618.A O no hydrogen 2.907 N/A VAL 623.A N THR 619.A O no hydrogen 2.918 N/A TRP 624.A N ALA 620.A O no hydrogen 2.881 N/A LEU 625.A N ILE 621.A O no hydrogen 2.883 N/A ASN 626.A N SER 622.A O no hydrogen 2.907 N/A ASP 627.A N VAL 623.A O no hydrogen 2.880 N/A MET 628.A N TRP 624.A O no hydrogen 2.928 N/A GLU 629.A N ASN 626.A O no hydrogen 3.077 N/A GLU 630.A N ASP 627.A O no hydrogen 3.002 N/A LEU 631.A N MET 628.A O no hydrogen 3.396 N/A PHE 632.A N GLU 629.A O no hydrogen 3.093 N/A GLY 635.A N LEU 631.A O no hydrogen 2.509 N/A GLN 640.A N LEU 603.A O no hydrogen 3.079 N/A GLN 640.A N GLN 640.A OE1 no hydrogen 2.653 N/A ALA 642.A N CYS 690.A O no hydrogen 2.757 N/A SER 643.A N TRP 605.A O no hydrogen 3.430 N/A SER 643.A OG ILE 688.A O no hydrogen 3.400 N/A VAL 644.A N ILE 688.A O no hydrogen 2.522 N/A VAL 645.A N VAL 607.A O no hydrogen 2.778 N/A VAL 647.A N GLY 686.A O no hydrogen 3.105 N/A SER 654.A N GLU 652.A O no hydrogen 2.858 N/A SER 654.A OG LYS 653.A O no hydrogen 2.697 N/A ASP 659.A N ILE 656.A O no hydrogen 3.185 N/A LYS 664.A N PHE 660.A O no hydrogen 3.413 N/A ALA 665.A N PRO 661.A O no hydrogen 3.215 N/A ALA 666.A N VAL 662.A O no hydrogen 2.920 N/A TYR 667.A N ALA 663.A O no hydrogen 2.914 N/A SER 668.A N LYS 664.A O no hydrogen 2.907 N/A SER 668.A OG LYS 664.A O no hydrogen 2.791 N/A PHE 669.A N ALA 665.A O no hydrogen 2.908 N/A LEU 670.A N ALA 666.A O no hydrogen 2.948 N/A LYS 671.A N TYR 667.A O no hydrogen 2.882 N/A ASP 672.A N SER 668.A O no hydrogen 2.916 N/A THR 673.A N PHE 669.A O no hydrogen 2.915 N/A THR 673.A OG1 PHE 669.A O no hydrogen 2.577 N/A VAL 674.A N LEU 670.A O no hydrogen 3.387 N/A SER 677.A N SER 675.A O no hydrogen 2.671 N/A SER 677.A OG GLN 694.A OE1 no hydrogen 3.361 N/A CYS 679.A N VAL 689.A O no hydrogen 3.449 N/A ASN 684.A ND2 GLU 652.A OE1 no hydrogen 2.897 N/A GLY 686.A N ASN 684.A OD1 no hydrogen 2.847 N/A ILE 688.A N VAL 644.A O no hydrogen 3.134 N/A VAL 689.A N CYS 679.A O no hydrogen 3.344 N/A CYS 690.A N ALA 642.A O no hydrogen 2.563 N/A CYS 690.A SG SER 677.A OG no hydrogen 3.710 N/A CYS 690.A SG GLN 691.A O no hydrogen 3.556 N/A CYS 690.A SG GLN 694.A OE1 no hydrogen 4.018 N/A GLN 691.A N GLN 694.A OE1 no hydrogen 3.507 N/A LEU 695.A N GLN 691.A O no hydrogen 2.707 N/A LYS 696.A N LYS 692.A O no hydrogen 2.898 N/A ARG 697.A N THR 693.A O no hydrogen 3.139 N/A ILE 698.A N GLN 694.A O no hydrogen 2.932 N/A PHE 699.A N LEU 695.A O no hydrogen 2.897 N/A SER 700.A N LYS 696.A O no hydrogen 3.220 N/A SER 700.A OG LYS 696.A O no hydrogen 3.315 N/A SER 700.A OG ARG 697.A O no hydrogen 2.752 N/A