Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8gry_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 6.A NZ LEU 2.A O no hydrogen 2.476 N/A ALA 7.A N ILE 3.A O no hydrogen 2.935 N/A GLU 8.A N GLU 4.A O no hydrogen 2.900 N/A SER 9.A N GLU 5.A O no hydrogen 2.927 N/A SER 9.A OG GLU 5.A O no hydrogen 2.991 N/A SER 9.A OG LYS 6.A O no hydrogen 2.638 N/A PHE 10.A N LYS 6.A O no hydrogen 2.941 N/A LEU 11.A N ALA 7.A O no hydrogen 2.906 N/A ASN 12.A N GLU 8.A O no hydrogen 2.918 N/A ASN 12.A ND2 GLU 8.A OE2 no hydrogen 2.352 N/A LYS 13.A N SER 9.A O no hydrogen 2.999 N/A PHE 14.A N PHE 10.A O no hydrogen 2.923 N/A ASN 15.A N LEU 11.A O no hydrogen 2.902 N/A GLN 16.A N ASN 12.A O no hydrogen 2.960 N/A GLU 17.A N LYS 13.A O no hydrogen 3.003 N/A ALA 18.A N PHE 14.A O no hydrogen 2.861 N/A GLU 19.A N ASN 15.A O no hydrogen 2.984 N/A LEU 21.A N GLU 17.A O no hydrogen 3.026 N/A SER 22.A N ALA 18.A O no hydrogen 2.870 N/A TYR 23.A N GLU 19.A O no hydrogen 2.959 N/A GLN 24.A N ASP 20.A O no hydrogen 2.945 N/A SER 25.A N LEU 21.A O no hydrogen 2.984 N/A SER 26.A N SER 22.A O no hydrogen 2.901 N/A SER 26.A OG SER 22.A O no hydrogen 3.479 N/A LEU 27.A N TYR 23.A O no hydrogen 2.881 N/A ALA 28.A N GLN 24.A O no hydrogen 2.980 N/A SER 29.A N SER 25.A O no hydrogen 2.930 N/A TRP 30.A N SER 26.A O no hydrogen 2.913 N/A ASN 31.A N LEU 27.A O no hydrogen 2.894 N/A ASN 31.A ND2 LEU 27.A O no hydrogen 3.036 N/A TYR 32.A N ALA 28.A O no hydrogen 2.943 N/A ASN 33.A N SER 29.A O no hydrogen 2.926 N/A THR 34.A N TRP 30.A O no hydrogen 2.889 N/A THR 34.A OG1 TRP 30.A O no hydrogen 2.986 N/A ASN 35.A N ASN 31.A O no hydrogen 3.386 N/A THR 37.A OG1 ILE 36.A O no hydrogen 2.632 N/A GLU 38.A N GLU 38.A OE1 no hydrogen 2.646 N/A ASN 40.A ND2 ASN 35.A O no hydrogen 2.353 N/A ALA 41.A N THR 37.A O no hydrogen 2.999 N/A GLN 42.A N GLU 38.A O no hydrogen 2.922 N/A LYS 43.A N GLU 39.A O no hydrogen 2.924 N/A MET 44.A N ASN 40.A O no hydrogen 2.902 N/A ASN 45.A N ALA 41.A O no hydrogen 2.947 N/A GLU 46.A N GLN 42.A O no hydrogen 3.004 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.940 N/A ALA 47.A N LYS 43.A O no hydrogen 2.880 N/A ALA 48.A N MET 44.A O no hydrogen 2.919 N/A ALA 49.A N ASN 45.A O no hydrogen 2.957 N/A LYS 50.A NZ GLU 46.A O no hydrogen 3.370 N/A SER 52.A N ALA 48.A O no hydrogen 2.957 N/A SER 52.A OG GLU 56.A OE2 no hydrogen 2.464 N/A ALA 53.A N ALA 49.A O no hydrogen 2.939 N/A PHE 54.A N LYS 50.A O no hydrogen 2.908 N/A TYR 55.A N TRP 51.A O no hydrogen 2.933 N/A GLU 56.A N SER 52.A O no hydrogen 2.929 N/A GLU 57.A N ALA 53.A O no hydrogen 2.936 N/A GLN 58.A N PHE 54.A O no hydrogen 2.920 N/A SER 59.A N TYR 55.A O no hydrogen 2.909 N/A SER 59.A OG LEU 82.A O no hydrogen 3.137 N/A LYS 60.A N GLU 56.A O no hydrogen 2.925 N/A ILE 61.A N GLU 57.A O no hydrogen 2.938 N/A ALA 62.A N GLN 58.A O no hydrogen 2.907 N/A ASN 64.A ND2 ILE 61.A O no hydrogen 2.516 N/A GLN 78.A NE2 THR 74.A O no hydrogen 2.701 N/A LEU 79.A N ILE 75.A O no hydrogen 2.930 N/A LYS 80.A N LYS 76.A O no hydrogen 2.897 N/A ALA 81.A N ARG 77.A O no hydrogen 2.902 N/A LEU 82.A N GLN 78.A O no hydrogen 2.922 N/A GLN 83.A N LEU 79.A O no hydrogen 2.912 N/A GLN 83.A NE2 ALA 62.A O no hydrogen 2.914 N/A GLN 83.A NE2 PHE 65.A O no hydrogen 3.476 N/A GLN 84.A N LYS 80.A O no hydrogen 3.210 N/A SER 85.A N GLN 83.A O no hydrogen 2.643 N/A ALA 89.A N GLY 86.A O no hydrogen 3.005 N/A SER 91.A OG ASP 93.A OD1 no hydrogen 2.493 N/A LYS 94.A N ASP 93.A OD1 no hydrogen 2.614 N/A LYS 94.A NZ GLU 171.A OE2 no hydrogen 3.094 N/A ASN 95.A N SER 91.A O no hydrogen 3.293 N/A LYS 96.A N PRO 92.A O no hydrogen 2.924 N/A GLN 97.A N ASP 93.A O no hydrogen 2.938 N/A LEU 98.A N LYS 94.A O no hydrogen 2.890 N/A ASN 99.A N ASN 95.A O no hydrogen 2.936 N/A ASN 99.A ND2 ASN 95.A O no hydrogen 3.438 N/A THR 100.A N LYS 96.A O no hydrogen 2.895 N/A THR 100.A OG1 LYS 96.A O no hydrogen 2.728 N/A THR 100.A OG1 GLN 97.A O no hydrogen 2.576 N/A ILE 101.A N GLN 97.A O no hydrogen 2.948 N/A LEU 102.A N LEU 98.A O no hydrogen 2.929 N/A ASN 103.A N ASN 99.A O no hydrogen 2.946 N/A THR 104.A N THR 100.A O no hydrogen 2.879 N/A THR 104.A OG1 THR 100.A O no hydrogen 2.518 N/A MET 105.A N ILE 101.A O no hydrogen 2.908 N/A SER 106.A N LEU 102.A O no hydrogen 2.964 N/A THR 107.A N ASN 103.A O no hydrogen 2.893 N/A THR 107.A OG1 ASN 103.A O no hydrogen 2.642 N/A THR 107.A OG1 THR 104.A O no hydrogen 2.793 N/A ILE 108.A N THR 104.A O no hydrogen 2.899 N/A TYR 109.A N MET 105.A O no hydrogen 2.945 N/A SER 110.A N SER 106.A O no hydrogen 2.922 N/A SER 110.A OG THR 107.A O no hydrogen 2.843 N/A THR 111.A N THR 107.A O no hydrogen 2.910 N/A THR 111.A OG1 THR 111.A O no hydrogen 2.625 N/A GLY 112.A N TYR 109.A O no hydrogen 3.502 N/A VAL 114.A N PHE 124.A O no hydrogen 3.435 N/A ASN 116.A ND2 GLU 122.A OE2 no hydrogen 3.215 N/A SER 117.A OG ASN 116.A OD1 no hydrogen 3.557 N/A ASN 119.A ND2 GLN 121.A OE1 no hydrogen 3.694 N/A CYS 123.A SG PRO 120.A O no hydrogen 3.243 N/A GLY 129.A N GLU 127.A O no hydrogen 3.120 N/A ASP 131.A N LEU 126.A O no hydrogen 3.381 N/A ILE 133.A N GLY 129.A O no hydrogen 3.163 N/A MET 134.A N LEU 130.A O no hydrogen 2.911 N/A ALA 135.A N GLU 132.A O no hydrogen 3.204 N/A THR 136.A N GLU 132.A O no hydrogen 2.924 N/A THR 136.A OG1 THR 136.A O no hydrogen 2.628 N/A ARG 142.A N ASP 139.A OD2 no hydrogen 2.694 N/A ARG 143.A NE HIS 247.A O no hydrogen 3.053 N/A LEU 144.A N TYR 140.A O no hydrogen 2.964 N/A TRP 145.A N ASN 141.A O no hydrogen 2.929 N/A ALA 146.A N ARG 142.A O no hydrogen 2.964 N/A TRP 147.A N ARG 143.A O no hydrogen 2.920 N/A GLU 148.A N LEU 144.A O no hydrogen 2.947 N/A GLY 149.A N TRP 145.A O no hydrogen 2.899 N/A TRP 150.A N ALA 146.A O no hydrogen 2.970 N/A ARG 151.A N TRP 147.A O no hydrogen 2.935 N/A ARG 151.A NH1 MET 252.A O no hydrogen 2.935 N/A ALA 152.A N GLU 148.A O no hydrogen 2.924 N/A GLU 153.A N GLY 149.A O no hydrogen 2.929 N/A VAL 154.A N TRP 150.A O no hydrogen 2.952 N/A GLY 155.A N ARG 151.A O no hydrogen 2.891 N/A LYS 156.A N ALA 152.A O no hydrogen 2.972 N/A GLN 157.A N VAL 154.A O no hydrogen 3.322 N/A GLN 157.A NE2 GLU 153.A O no hydrogen 3.126 N/A LEU 158.A N GLY 155.A O no hydrogen 3.071 N/A ARG 159.A N GLY 155.A O no hydrogen 2.952 N/A ARG 159.A NE GLU 163.A OE2 no hydrogen 2.913 N/A TYR 162.A N LEU 158.A O no hydrogen 3.134 N/A GLU 163.A N ARG 159.A O no hydrogen 3.008 N/A GLU 164.A N LEU 161.A O no hydrogen 3.292 N/A TYR 165.A N LEU 161.A O no hydrogen 2.921 N/A TYR 165.A OH ASP 491.A OD2 no hydrogen 2.299 N/A VAL 166.A N TYR 162.A O no hydrogen 2.957 N/A LEU 168.A N GLU 164.A O no hydrogen 3.067 N/A LYS 169.A N TYR 165.A O no hydrogen 2.909 N/A LYS 169.A NZ TYR 181.A OH no hydrogen 2.664 N/A LYS 169.A NZ ASP 491.A OD2 no hydrogen 2.473 N/A ASN 170.A N VAL 166.A O no hydrogen 2.929 N/A GLU 171.A N VAL 167.A O no hydrogen 2.943 N/A MET 172.A N LEU 168.A O no hydrogen 2.904 N/A ALA 173.A N LYS 169.A O no hydrogen 2.916 N/A ARG 174.A N ASN 170.A O no hydrogen 2.916 N/A ARG 174.A NH2 ASP 180.A OD1 no hydrogen 3.066 N/A ALA 175.A N GLU 171.A O no hydrogen 2.937 N/A ASN 176.A N ALA 173.A O no hydrogen 3.141 N/A ASN 177.A N ARG 174.A O no hydrogen 3.282 N/A TYR 184.A N ASP 180.A O no hydrogen 3.421 N/A TRP 185.A N TYR 181.A O no hydrogen 2.958 N/A ARG 186.A N GLY 182.A O no hydrogen 2.896 N/A ARG 186.A NH2 ASP 183.A OD1 no hydrogen 2.671 N/A ASP 188.A N TRP 185.A O no hydrogen 3.450 N/A TYR 189.A N ARG 186.A O no hydrogen 3.279 N/A TYR 189.A OH THR 499.A OG1 no hydrogen 3.361 N/A ALA 191.A N TYR 199.A O no hydrogen 3.150 N/A TYR 197.A OH GLU 553.A OE1 no hydrogen 3.288 N/A TYR 199.A N ALA 191.A O no hydrogen 2.689 N/A TYR 199.A OH ASP 207.A OD2 no hydrogen 2.489 N/A ARG 201.A NH1 GLU 190.A OE1 no hydrogen 2.939 N/A LEU 204.A N ARG 201.A O no hydrogen 2.918 N/A ASP 207.A N GLN 203.A O no hydrogen 3.083 N/A VAL 208.A N LEU 204.A O no hydrogen 3.453 N/A GLU 209.A N ILE 205.A O no hydrogen 2.981 N/A ASN 210.A N GLU 206.A O no hydrogen 2.994 N/A THR 211.A N ASP 207.A O no hydrogen 2.964 N/A THR 211.A OG1 VAL 208.A O no hydrogen 2.309 N/A THR 211.A OG1 TYR 498.A OH no hydrogen 2.465 N/A PHE 212.A N VAL 208.A O no hydrogen 3.027 N/A LYS 213.A N GLU 209.A O no hydrogen 3.253 N/A LYS 213.A N ASN 210.A O no hydrogen 2.954 N/A GLU 214.A N THR 211.A O no hydrogen 2.955 N/A ILE 215.A N PHE 212.A O no hydrogen 2.938 N/A LYS 216.A N PHE 212.A O no hydrogen 3.187 N/A LYS 216.A NZ GLU 220.A OE2 no hydrogen 2.588 N/A TYR 219.A N ILE 215.A O no hydrogen 3.069 N/A GLU 220.A N LYS 216.A O no hydrogen 3.149 N/A LEU 222.A N LEU 218.A O no hydrogen 3.314 N/A HIS 223.A N TYR 219.A O no hydrogen 2.913 N/A ALA 224.A N GLU 220.A O no hydrogen 3.031 N/A ALA 224.A N GLN 221.A O no hydrogen 2.952 N/A TYR 225.A N GLN 221.A O no hydrogen 3.172 N/A VAL 226.A N LEU 222.A O no hydrogen 3.126 N/A ARG 227.A N HIS 223.A O no hydrogen 3.349 N/A ARG 227.A NH1 GLY 242.A O no hydrogen 3.421 N/A ARG 227.A NH1 GLY 587.A O no hydrogen 3.251 N/A THR 228.A N ALA 224.A O no hydrogen 3.206 N/A THR 228.A OG1 TYR 225.A O no hydrogen 3.171 N/A LYS 229.A N TYR 225.A O no hydrogen 3.469 N/A LEU 230.A N VAL 226.A O no hydrogen 2.612 N/A MET 231.A N ARG 227.A O no hydrogen 2.936 N/A MET 231.A N THR 228.A O no hydrogen 2.941 N/A GLU 232.A N LYS 229.A O no hydrogen 2.922 N/A TYR 234.A N LEU 230.A O no hydrogen 3.323 N/A GLY 242.A N SER 239.A O no hydrogen 3.319 N/A CYS 243.A SG SER 589.A O no hydrogen 3.319 N/A LEU 244.A N GLY 468.A O no hydrogen 3.375 N/A HIS 247.A N HIS 247.A ND1 no hydrogen 2.861 N/A LEU 248.A N PRO 245.A O no hydrogen 3.500 N/A MET 252.A N ASP 251.A OD1 no hydrogen 2.513 N/A TRP 253.A NE1 SER 484.A O no hydrogen 2.943 N/A ASN 259.A ND2 GLY 250.A O no hydrogen 2.967 N/A LEU 260.A N TRP 257.A O no hydrogen 3.430 N/A TYR 261.A N THR 258.A O no hydrogen 2.922 N/A LEU 263.A N LEU 260.A O no hydrogen 3.184 N/A THR 264.A N LEU 260.A O no hydrogen 3.067 N/A THR 264.A N TYR 261.A O no hydrogen 3.197 N/A THR 264.A OG1 LEU 260.A O no hydrogen 2.956 N/A LYS 270.A NZ GLU 415.A OE1 no hydrogen 2.515 N/A THR 276.A OG1 ASP 274.A OD1 no hydrogen 2.842 N/A THR 276.A OG1 ASP 274.A OD2 no hydrogen 3.188 N/A MET 279.A N VAL 275.A O no hydrogen 3.146 N/A VAL 280.A N THR 276.A O no hydrogen 2.915 N/A ASN 281.A N ASP 277.A O no hydrogen 2.897 N/A GLN 282.A N ALA 278.A O no hydrogen 2.894 N/A SER 283.A N VAL 280.A O no hydrogen 3.419 N/A SER 283.A OG GLN 282.A O no hydrogen 2.586 N/A SER 283.A OG SER 283.A O no hydrogen 2.488 N/A TRP 284.A N MET 279.A O no hydrogen 3.248 N/A GLU 287.A N ASP 285.A OD2 no hydrogen 3.115 N/A ARG 288.A N ASP 285.A O no hydrogen 3.085 N/A LYS 291.A N GLU 287.A O no hydrogen 2.919 N/A GLU 292.A N ARG 288.A O no hydrogen 2.897 N/A ALA 293.A N ILE 289.A O no hydrogen 2.944 N/A GLU 294.A N PHE 290.A O no hydrogen 2.894 N/A LYS 295.A N LYS 291.A O no hydrogen 2.901 N/A PHE 296.A N GLU 292.A O no hydrogen 2.925 N/A PHE 297.A N ALA 293.A O no hydrogen 2.937 N/A VAL 298.A N GLU 294.A O no hydrogen 2.868 N/A SER 299.A N LYS 295.A O no hydrogen 2.919 N/A SER 299.A N PHE 296.A O no hydrogen 3.193 N/A SER 299.A OG PHE 296.A O no hydrogen 2.843 N/A SER 299.A OG SER 527.A OG no hydrogen 3.262 N/A GLY 301.A N VAL 298.A O no hydrogen 2.824 N/A MET 305.A N GLU 294.A OE2 no hydrogen 3.337 N/A PHE 309.A N THR 306.A O no hydrogen 3.176 N/A ASN 312.A N GLY 308.A O no hydrogen 2.913 N/A ASN 312.A ND2 ASP 337.A OD1 no hydrogen 3.427 N/A SER 313.A N PHE 309.A O no hydrogen 3.331 N/A SER 313.A OG PHE 309.A O no hydrogen 2.412 N/A ARG 322.A N ASP 320.A O no hydrogen 2.639 N/A HIS 327.A ND1 PRO 328.A O no hydrogen 3.304 N/A THR 329.A N LYS 341.A O no hydrogen 2.927 N/A THR 329.A OG1 HIS 327.A O no hydrogen 3.168 N/A TRP 331.A N ARG 339.A O no hydrogen 2.875 N/A LEU 333.A N ASP 337.A O no hydrogen 3.294 N/A ARG 339.A N TRP 331.A O no hydrogen 2.935 N/A ARG 339.A NE ASP 337.A OD1 no hydrogen 3.469 N/A ARG 339.A NE ASP 337.A OD2 no hydrogen 2.495 N/A LYS 341.A N THR 329.A O no hydrogen 2.898 N/A LYS 341.A NZ VAL 325.A O no hydrogen 3.181 N/A LYS 341.A NZ HIS 327.A O no hydrogen 3.035 N/A THR 344.A OG1 LEU 315.A O no hydrogen 2.646 N/A THR 347.A OG1 VAL 346.A O no hydrogen 2.542 N/A ASN 350.A N ASP 349.A OD1 no hydrogen 2.409 N/A PHE 351.A N THR 347.A O no hydrogen 3.305 N/A LEU 352.A N MET 348.A O no hydrogen 2.974 N/A THR 353.A N ASP 349.A O no hydrogen 2.901 N/A THR 353.A OG1 ASP 349.A O no hydrogen 2.707 N/A ALA 354.A N ASN 350.A O no hydrogen 2.859 N/A HIS 355.A N PHE 351.A O no hydrogen 3.011 N/A HIS 356.A N LEU 352.A O no hydrogen 2.946 N/A HIS 356.A NE2 GLU 384.A OE2 no hydrogen 3.179 N/A GLU 357.A N THR 353.A O no hydrogen 2.925 N/A MET 358.A N ALA 354.A O no hydrogen 2.892 N/A GLY 359.A N HIS 355.A O no hydrogen 2.945 N/A HIS 360.A N HIS 356.A O no hydrogen 3.025 N/A HIS 360.A NE2 GLU 384.A OE2 no hydrogen 3.154 N/A ILE 361.A N GLU 357.A O no hydrogen 2.942 N/A GLN 362.A N MET 358.A O no hydrogen 2.873 N/A GLN 362.A NE2 PRO 303.A O no hydrogen 2.893 N/A TYR 363.A N GLY 359.A O no hydrogen 2.990 N/A ASP 364.A N HIS 360.A O no hydrogen 2.962 N/A MET 365.A N ILE 361.A O no hydrogen 2.892 N/A ALA 366.A N GLN 362.A O no hydrogen 2.891 N/A TYR 367.A N TYR 363.A O no hydrogen 3.042 N/A TYR 367.A OH ASP 364.A OD1 no hydrogen 2.703 N/A ALA 368.A N MET 365.A O no hydrogen 3.370 N/A LEU 374.A N PRO 371.A O no hydrogen 3.388 N/A ARG 375.A N PHE 372.A O no hydrogen 3.174 N/A ARG 375.A NE GLN 370.A O no hydrogen 3.308 N/A ARG 375.A NH2 GLN 370.A O no hydrogen 3.092 N/A GLU 380.A N GLU 380.A OE1 no hydrogen 2.978 N/A GLY 381.A N ASN 379.A OD1 no hydrogen 3.244 N/A ALA 385.A N GLY 381.A O no hydrogen 2.904 N/A VAL 386.A N PHE 382.A O no hydrogen 2.931 N/A GLY 387.A N HIS 383.A O no hydrogen 2.985 N/A GLU 388.A N GLU 384.A O no hydrogen 2.870 N/A ILE 389.A N ALA 385.A O no hydrogen 2.949 N/A MET 390.A N VAL 386.A O no hydrogen 2.984 N/A SER 391.A N GLY 387.A O no hydrogen 2.960 N/A LEU 392.A N GLU 388.A O no hydrogen 2.888 N/A SER 393.A N ILE 389.A O no hydrogen 2.944 N/A ALA 394.A N MET 390.A O no hydrogen 2.930 N/A ALA 395.A N SER 391.A O no hydrogen 2.952 N/A THR 396.A OG1 SER 393.A O no hydrogen 3.056 N/A THR 396.A OG1 ASP 525.A OD1 no hydrogen 2.289 N/A THR 396.A OG1 ASP 525.A OD2 no hydrogen 3.115 N/A LEU 400.A N THR 396.A O no hydrogen 3.301 N/A LYS 401.A N PRO 397.A O no hydrogen 2.912 N/A LYS 401.A NZ PRO 407.A O no hydrogen 3.245 N/A LYS 401.A NZ SER 408.A O no hydrogen 2.544 N/A SER 402.A N LYS 398.A O no hydrogen 2.896 N/A SER 402.A OG LYS 398.A O no hydrogen 3.158 N/A ILE 403.A N HIS 399.A O no hydrogen 2.930 N/A GLY 404.A N LEU 400.A O no hydrogen 3.065 N/A PHE 410.A N SER 408.A O no hydrogen 3.047 N/A GLU 415.A N ASP 413.A OD1 no hydrogen 3.047 N/A ILE 418.A N ASN 414.A O no hydrogen 2.915 N/A ASN 419.A N GLU 415.A O no hydrogen 2.913 N/A PHE 420.A N THR 416.A O no hydrogen 2.925 N/A LEU 421.A N GLU 417.A O no hydrogen 2.914 N/A LEU 422.A N ILE 418.A O no hydrogen 2.881 N/A LYS 423.A N ASN 419.A O no hydrogen 2.963 N/A GLN 424.A N PHE 420.A O no hydrogen 2.957 N/A ALA 425.A N LEU 421.A O no hydrogen 2.884 N/A LEU 426.A N LEU 422.A O no hydrogen 2.916 N/A THR 427.A N LYS 423.A O no hydrogen 2.965 N/A THR 427.A OG1 LYS 423.A O no hydrogen 2.965 N/A ILE 428.A N GLN 424.A O no hydrogen 2.962 N/A ILE 428.A N ALA 425.A O no hydrogen 3.146 N/A VAL 429.A N ALA 425.A O no hydrogen 2.887 N/A GLY 430.A N ALA 425.A O no hydrogen 3.435 N/A THR 431.A N ILE 428.A O no hydrogen 3.112 N/A THR 431.A OG1 ARG 255.A O no hydrogen 3.343 N/A LEU 432.A N ILE 428.A O no hydrogen 3.037 N/A THR 435.A N THR 431.A O no hydrogen 3.264 N/A THR 435.A OG1 THR 431.A O no hydrogen 3.411 N/A TYR 436.A N LEU 432.A O no hydrogen 3.027 N/A TYR 436.A OH GLU 209.A OE2 no hydrogen 2.771 N/A MET 437.A N PRO 433.A O no hydrogen 2.884 N/A LEU 438.A N PHE 434.A O no hydrogen 2.963 N/A GLU 439.A N THR 435.A O no hydrogen 2.981 N/A LYS 440.A N TYR 436.A O no hydrogen 2.936 N/A TRP 441.A N MET 437.A O no hydrogen 2.903 N/A ARG 442.A N LEU 438.A O no hydrogen 2.986 N/A ARG 442.A NH1 TYR 492.A O no hydrogen 3.167 N/A ARG 442.A NH2 TYR 492.A O no hydrogen 2.656 N/A TRP 443.A N GLU 439.A O no hydrogen 2.917 N/A MET 444.A N LYS 440.A O no hydrogen 2.912 N/A VAL 445.A N TRP 441.A O no hydrogen 2.927 N/A PHE 446.A N ARG 442.A O no hydrogen 2.952 N/A GLN 447.A N TRP 443.A O no hydrogen 3.353 N/A ARG 452.A NH1 GLU 163.A O no hydrogen 3.500 N/A GLN 454.A N PRO 451.A O no hydrogen 3.347 N/A THR 456.A N GLU 477.A OE1 no hydrogen 3.414 N/A THR 456.A OG1 GLU 477.A OE1 no hydrogen 3.039 N/A TRP 459.A N TRP 455.A O no hydrogen 2.926 N/A TRP 460.A N THR 456.A O no hydrogen 2.926 N/A TRP 460.A NE1 ASP 481.A OD2 no hydrogen 2.286 N/A GLU 461.A N LYS 457.A O no hydrogen 2.892 N/A MET 462.A N LYS 458.A O no hydrogen 2.930 N/A LYS 463.A N TRP 459.A O no hydrogen 2.929 N/A ARG 464.A N TRP 460.A O no hydrogen 2.875 N/A ARG 464.A NH1 THR 590.A O no hydrogen 3.485 N/A GLU 465.A N GLU 461.A O no hydrogen 2.929 N/A GLU 465.A N MET 462.A O no hydrogen 3.110 N/A ILE 466.A N MET 462.A O no hydrogen 2.860 N/A GLY 468.A N LYS 463.A O no hydrogen 2.939 N/A VAL 469.A N LYS 463.A O no hydrogen 3.193 N/A VAL 470.A N LEU 244.A O no hydrogen 3.177 N/A GLU 471.A N GLU 471.A OE1 no hydrogen 3.071 N/A HIS 475.A ND1 ASP 481.A OD2 no hydrogen 3.128 N/A TYR 479.A N ASP 476.A O no hydrogen 3.146 N/A SER 484.A N ASP 481.A O no hydrogen 3.118 N/A SER 484.A OG ASP 481.A O no hydrogen 3.318 N/A HIS 487.A NE2 TYR 497.A OH no hydrogen 2.857 N/A SER 489.A N LEU 485.A O no hydrogen 3.177 N/A SER 489.A OG LEU 485.A O no hydrogen 3.063 N/A SER 489.A OG PHE 486.A O no hydrogen 3.078 N/A SER 489.A OG ASN 490.A OD1 no hydrogen 2.544 N/A ASN 490.A N PHE 486.A O no hydrogen 2.895 N/A TYR 492.A N HIS 487.A O no hydrogen 3.020 N/A TYR 497.A OH HIS 487.A NE2 no hydrogen 2.857 N/A TYR 498.A OH THR 211.A OG1 no hydrogen 2.465 N/A THR 499.A N ILE 495.A O no hydrogen 3.010 N/A THR 499.A OG1 TYR 189.A OH no hydrogen 3.361 N/A THR 499.A OG1 ILE 495.A O no hydrogen 3.138 N/A THR 499.A OG1 ARG 496.A O no hydrogen 2.703 N/A ARG 500.A N ARG 496.A O no hydrogen 2.889 N/A THR 501.A N TYR 497.A O no hydrogen 2.919 N/A THR 501.A OG1 TYR 497.A O no hydrogen 3.131 N/A ILE 502.A N TYR 498.A O no hydrogen 3.005 N/A TYR 503.A N THR 499.A O no hydrogen 2.911 N/A GLN 504.A N ARG 500.A O no hydrogen 2.949 N/A PHE 507.A N TYR 503.A O no hydrogen 2.987 N/A GLN 508.A N GLN 504.A O no hydrogen 2.907 N/A GLU 509.A N PHE 505.A O no hydrogen 2.917 N/A ALA 510.A N GLN 506.A O no hydrogen 2.962 N/A LEU 511.A N PHE 507.A O no hydrogen 2.945 N/A CYS 512.A N GLN 508.A O no hydrogen 2.891 N/A CYS 512.A SG GLN 508.A O no hydrogen 3.250 N/A GLN 513.A N GLU 509.A O no hydrogen 2.917 N/A ALA 514.A N ALA 510.A O no hydrogen 2.958 N/A ALA 515.A N CYS 512.A O no hydrogen 2.944 N/A LYS 516.A NZ GLU 531.A OE1 no hydrogen 3.273 N/A LYS 523.A NZ GLU 417.A OE2 no hydrogen 3.230 N/A ILE 526.A N SER 393.A OG no hydrogen 3.323 N/A SER 527.A OG SER 299.A OG no hydrogen 3.262 N/A GLY 533.A N SER 529.A O no hydrogen 3.506 N/A GLN 534.A N THR 530.A O no hydrogen 2.909 N/A LYS 535.A N GLU 531.A O no hydrogen 2.911 N/A LEU 536.A N ALA 532.A O no hydrogen 2.928 N/A LEU 537.A N GLY 533.A O no hydrogen 2.886 N/A ASN 538.A N GLN 534.A O no hydrogen 2.929 N/A MET 539.A N LEU 536.A O no hydrogen 3.035 N/A LEU 540.A N LEU 536.A O no hydrogen 2.922 N/A LEU 542.A N MET 539.A O no hydrogen 3.117 N/A ASN 544.A N LEU 374.A O no hydrogen 3.222 N/A SER 545.A OG LEU 542.A O no hydrogen 3.186 N/A TRP 548.A NE1 TYR 189.A O no hydrogen 3.001 N/A LEU 550.A N PRO 547.A O no hydrogen 3.258 N/A LEU 552.A N TRP 548.A O no hydrogen 2.913 N/A GLU 553.A N THR 549.A O no hydrogen 2.909 N/A ASN 554.A N LEU 550.A O no hydrogen 2.881 N/A ASN 554.A ND2 ASN 538.A O no hydrogen 3.426 N/A VAL 555.A N ALA 551.A O no hydrogen 2.952 N/A VAL 556.A N LEU 552.A O no hydrogen 2.881 N/A GLY 557.A N LEU 552.A O no hydrogen 3.323 N/A SER 558.A OG ASN 560.A O no hydrogen 2.630 N/A ARG 559.A NE GLU 553.A OE1 no hydrogen 2.570 N/A ASN 560.A N SER 558.A OG no hydrogen 3.249 N/A ASP 562.A N GLN 506.A OE1 no hydrogen 3.066 N/A LYS 564.A N ASP 562.A OD1 no hydrogen 2.336 N/A LEU 566.A N VAL 563.A O no hydrogen 3.194 N/A ASN 568.A N LYS 564.A O no hydrogen 2.937 N/A TYR 569.A N PRO 565.A O no hydrogen 2.872 N/A PHE 570.A N LEU 566.A O no hydrogen 2.953 N/A PHE 574.A N PHE 570.A O no hydrogen 2.951 N/A VAL 575.A N GLN 571.A O no hydrogen 2.960 N/A TRP 576.A N PRO 572.A O no hydrogen 2.930 N/A LEU 577.A N LEU 573.A O no hydrogen 2.880 N/A LYS 578.A N PHE 574.A O no hydrogen 2.977 N/A GLU 579.A N VAL 575.A O no hydrogen 2.903 N/A GLN 580.A N TRP 576.A O no hydrogen 2.892 N/A ASN 581.A N LEU 577.A O no hydrogen 2.926 N/A ASN 581.A ND2 LEU 577.A O no hydrogen 3.445 N/A SER 584.A OG ASN 581.A OD1 no hydrogen 2.766 N/A SER 589.A OG ASP 591.A OD2 no hydrogen 2.234 N/A ASP 591.A N SER 589.A OG no hydrogen 3.409 N/A