Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dkt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N GLN 25.A O no hydrogen 2.886 N/A VAL 8.A N ASP 27.A O no hydrogen 3.508 N/A THR 14.A N LEU 95.A O no hydrogen 2.986 N/A ALA 16.A N TYR 97.A O no hydrogen 3.046 N/A CYS 18.A N THR 99.A O no hydrogen 2.920 N/A CYS 18.A SG THR 24.A OG1 no hydrogen 3.453 N/A LEU 20.A N VAL 101.A O no hydrogen 2.954 N/A THR 22.A N VAL 19.A O no hydrogen 3.188 N/A THR 22.A OG1 GLN 2.A O no hydrogen 3.317 N/A LEU 23.A N ALA 1.A O no hydrogen 3.396 N/A THR 24.A N LEU 66.A O no hydrogen 2.956 N/A GLN 25.A N THR 4.A O no hydrogen 3.051 N/A LEU 26.A N VAL 64.A O no hydrogen 2.951 N/A ASP 27.A N ILE 6.A O no hydrogen 2.887 N/A SER 30.A N ASP 27.A OD1 no hydrogen 3.467 N/A SER 31.A OG VAL 8.A O no hydrogen 2.249 N/A ALA 32.A N CYS 29.A O no hydrogen 2.969 N/A THR 37.A OG1 SER 38.A OG no hydrogen 2.936 N/A SER 38.A N TYR 85.A O no hydrogen 2.843 N/A SER 38.A OG THR 37.A OG1 no hydrogen 2.936 N/A PHE 39.A N TRP 56.A O no hydrogen 2.989 N/A SER 40.A N SER 83.A O no hydrogen 2.886 N/A ASN 42.A N GLN 81.A O no hydrogen 2.962 N/A SER 44.A N LYS 79.A O no hydrogen 2.959 N/A SER 44.A OG GLN 78.A OE1 no hydrogen 2.603 N/A SER 44.A OG LYS 79.A O no hydrogen 3.315 N/A GLY 46.A N GLN 78.A OE1 no hydrogen 3.299 N/A VAL 47.A N SER 44.A O no hydrogen 2.917 N/A VAL 48.A N THR 67.A O no hydrogen 2.903 N/A ASP 50.A N THR 65.A O no hydrogen 2.913 N/A ALA 52.A N GLU 63.A O no hydrogen 2.851 N/A THR 55.A OG1 TYR 85.A OH no hydrogen 3.008 N/A LEU 58.A N THR 37.A O no hydrogen 3.012 N/A GLY 61.A N ASP 59.A OD1 no hydrogen 2.895 N/A VAL 62.A N ASP 59.A O no hydrogen 3.266 N/A GLU 63.A N ALA 52.A O no hydrogen 2.980 N/A THR 65.A N ASP 50.A O no hydrogen 2.901 N/A LEU 66.A N THR 24.A O no hydrogen 2.841 N/A THR 67.A N VAL 48.A O no hydrogen 2.941 N/A LYS 69.A N GLY 46.A O no hydrogen 3.086 N/A SER 72.A N ALA 100.A O no hydrogen 2.630 N/A SER 72.A OG ASP 77.A OD1 no hydrogen 2.749 N/A SER 74.A N ASP 77.A OD2 no hydrogen 2.722 N/A THR 75.A OG1 ASP 177.A OD1 no hydrogen 3.103 N/A GLY 76.A N THR 99.A OG1 no hydrogen 3.096 N/A ASP 77.A N SER 74.A O no hydrogen 3.197 N/A GLN 78.A N LEU 98.A O no hydrogen 3.378 N/A LYS 79.A N SER 44.A OG no hydrogen 2.860 N/A VAL 80.A N LEU 96.A O no hydrogen 2.865 N/A GLN 81.A N ASN 42.A O no hydrogen 2.853 N/A ILE 82.A N ALA 94.A O no hydrogen 2.913 N/A SER 83.A N SER 40.A O no hydrogen 2.877 N/A TYR 84.A N VAL 92.A O no hydrogen 2.892 N/A TYR 84.A OH ILE 28.A O no hydrogen 3.178 N/A TYR 85.A N SER 38.A O no hydrogen 2.964 N/A THR 89.A N GLY 86.A O no hydrogen 3.446 N/A THR 89.A OG1 PRO 90.A O no hydrogen 3.529 N/A VAL 92.A N TYR 84.A O no hydrogen 2.883 N/A ALA 94.A N ILE 82.A O no hydrogen 2.835 N/A LEU 96.A N VAL 80.A O no hydrogen 2.904 N/A TYR 97.A N THR 14.A O no hydrogen 2.803 N/A LEU 98.A N GLN 78.A O no hydrogen 2.799 N/A THR 99.A N ALA 16.A O no hydrogen 3.171 N/A ALA 100.A N SER 72.A OG no hydrogen 2.809 N/A VAL 101.A N CYS 18.A O no hydrogen 3.009 N/A GLU 102.A N LYS 173.A O no hydrogen 2.891 N/A SER 104.A N SER 171.A O no hydrogen 2.928 N/A SER 104.A OG GLU 102.A OE2 no hydrogen 3.277 N/A CYS 106.A N THR 169.A O no hydrogen 2.861 N/A CYS 106.A SG SER 104.A O no hydrogen 3.841 N/A THR 110.A OG1 ASP 108.A OD1 no hydrogen 3.392 N/A THR 110.A OG1 THR 112.A OG1 no hydrogen 3.142 N/A ARG 111.A NH1 THR 125.A O no hydrogen 2.338 N/A ARG 111.A NH1 GLY 127.A O no hydrogen 3.562 N/A ARG 111.A NH2 GLY 132.A O no hydrogen 2.743 N/A THR 112.A N ASP 108.A OD1 no hydrogen 3.068 N/A THR 112.A OG1 THR 110.A OG1 no hydrogen 3.142 N/A GLY 113.A N ASP 108.A OD2 no hydrogen 2.725 N/A LYS 116.A N ALA 107.A O no hydrogen 2.892 N/A LYS 116.A NZ VAL 115.A O no hydrogen 3.519 N/A ASP 120.A N ASP 120.A OD2 no hydrogen 2.351 N/A GLN 121.A NE2 THR 118.A OG1 no hydrogen 2.880 N/A ARG 122.A N GLN 121.A OE1 no hydrogen 1.978 N/A TRP 124.A NE1 ALA 133.A O no hydrogen 2.912 N/A THR 125.A N GLN 131.A O no hydrogen 2.761 N/A GLY 127.A N TRP 632.A O no hydrogen 2.933 N/A GLY 130.A N GLY 127.A O no hydrogen 3.392 N/A GLN 131.A N THR 125.A OG1 no hydrogen 2.639 N/A GLN 131.A NE2 THR 123.A O no hydrogen 2.718 N/A GLY 132.A N ILE 109.A O no hydrogen 2.912 N/A ALA 133.A N VAL 268.A O no hydrogen 3.113 N/A LEU 135.A N ARG 270.A O no hydrogen 2.945 N/A ASN 138.A N ALA 231.A O no hydrogen 3.181 N/A CYS 139.A SG VAL 137.A O no hydrogen 3.720 N/A ARG 141.A N GLY 359.A O no hydrogen 3.423 N/A ASP 142.A N ASP 150.A OD1 no hydrogen 3.238 N/A ASP 150.A N ASP 140.A O no hydrogen 2.840 N/A CYS 151.A SG ASN 138.A O no hydrogen 2.854 N/A GLU 155.A N ASP 153.A OD1 no hydrogen 3.017 N/A LEU 162.A N SER 159.A O no hydrogen 3.222 N/A GLN 163.A N GLU 160.A O no hydrogen 2.853 N/A ASP 164.A N ASP 161.A O no hydrogen 2.923 N/A MET 165.A N LEU 162.A O no hydrogen 2.986 N/A SER 166.A N VAL 229.A O no hydrogen 2.903 N/A SER 166.A OG ILE 134.A O no hydrogen 3.032 N/A MET 168.A N PHE 227.A O no hydrogen 2.917 N/A THR 169.A N CYS 106.A O no hydrogen 2.874 N/A LEU 170.A N MET 225.A O no hydrogen 2.885 N/A SER 171.A N SER 104.A O no hydrogen 2.904 N/A SER 171.A OG ASN 224.A OD1 no hydrogen 2.695 N/A THR 172.A N HIS 223.A O no hydrogen 2.924 N/A THR 172.A OG1 HIS 223.A O no hydrogen 3.261 N/A LYS 173.A N GLU 102.A O no hydrogen 2.886 N/A THR 174.A N GLY 221.A O no hydrogen 2.944 N/A THR 174.A OG1 PRO 175.A O no hydrogen 3.155 N/A THR 174.A OG1 GLY 221.A O no hydrogen 3.471 N/A ASP 177.A N ASP 177.A OD2 no hydrogen 2.441 N/A PHE 178.A N PRO 175.A O no hydrogen 3.393 N/A THR 180.A N ASP 177.A O no hydrogen 2.928 N/A THR 180.A OG1 ASP 177.A O no hydrogen 2.385 N/A ASN 181.A N PHE 178.A O no hydrogen 2.976 N/A HIS 182.A ND1 PHE 178.A O no hydrogen 3.274 N/A THR 183.A N LEU 250.A O no hydrogen 2.926 N/A VAL 185.A N SER 248.A O no hydrogen 2.942 N/A LEU 186.A N HIS 214.A O no hydrogen 2.881 N/A HIS 187.A N THR 246.A O no hydrogen 2.889 N/A HIS 187.A NE2 SER 248.A OG no hydrogen 2.811 N/A VAL 188.A N PRO 212.A O no hydrogen 2.849 N/A GLU 192.A N ALA 189.A O no hydrogen 2.894 N/A LYS 195.A N GLU 192.A O no hydrogen 3.007 N/A LYS 195.A NZ ASP 194.A OD1 no hydrogen 3.335 N/A LYS 195.A NZ ASP 194.A OD2 no hydrogen 2.881 N/A VAL 196.A N MET 193.A O no hydrogen 3.460 N/A ARG 197.A N GLU 230.A O no hydrogen 2.914 N/A ARG 197.A NH1 CYS 151.A O no hydrogen 3.322 N/A ARG 197.A NH2 CYS 151.A O no hydrogen 2.832 N/A VAL 198.A N LEU 207.A O no hydrogen 3.040 N/A PHE 199.A N TYR 228.A O no hydrogen 2.883 N/A GLN 200.A N SER 204.A O no hydrogen 2.499 N/A ALA 201.A N ASP 226.A O no hydrogen 2.891 N/A SER 204.A N GLN 200.A O no hydrogen 3.159 N/A VAL 206.A N VAL 198.A O no hydrogen 2.978 N/A GLY 208.A N TRP 211.A O no hydrogen 3.247 N/A TRP 211.A N GLY 208.A O no hydrogen 2.845 N/A HIS 214.A N LEU 186.A O no hydrogen 2.913 N/A TYR 215.A OH GLU 259.A OE2 no hydrogen 3.118 N/A LEU 216.A N LEU 184.A O no hydrogen 2.888 N/A GLY 221.A N THR 174.A OG1 no hydrogen 3.091 N/A HIS 223.A N THR 172.A O no hydrogen 2.895 N/A MET 225.A N LEU 170.A O no hydrogen 2.940 N/A PHE 227.A N MET 168.A O no hydrogen 2.848 N/A TYR 228.A N PHE 199.A O no hydrogen 2.875 N/A VAL 229.A N SER 166.A O no hydrogen 2.861 N/A GLU 230.A N ARG 197.A O no hydrogen 2.911 N/A ALA 231.A N LEU 136.A O no hydrogen 3.024 N/A LEU 232.A N LYS 195.A O no hydrogen 2.955 N/A ASP 236.A N PHE 239.A O no hydrogen 2.742 N/A THR 237.A N ASP 236.A OD1 no hydrogen 2.881 N/A THR 237.A OG1 ASP 238.A OD1 no hydrogen 3.511 N/A ASP 238.A N ASP 238.A OD1 no hydrogen 2.538 N/A PHE 239.A N ASP 236.A O no hydrogen 2.818 N/A ILE 243.A N PHE 269.A O no hydrogen 2.829 N/A THR 244.A N GLU 192.A OE2 no hydrogen 3.092 N/A LEU 245.A N VAL 267.A O no hydrogen 3.174 N/A THR 246.A N HIS 187.A O no hydrogen 2.921 N/A THR 246.A OG1 SER 266.A OG no hydrogen 3.062 N/A ILE 247.A N ASP 265.A O no hydrogen 2.669 N/A SER 248.A N VAL 185.A O no hydrogen 2.871 N/A SER 248.A OG HIS 187.A NE2 no hydrogen 2.811 N/A LEU 249.A N PHE 263.A O no hydrogen 2.797 N/A LEU 250.A N THR 183.A O no hydrogen 2.884 N/A ASP 251.A N ALA 260.A O no hydrogen 2.885 N/A THR 252.A N ASN 181.A O no hydrogen 2.896 N/A THR 252.A OG1 ASN 181.A O no hydrogen 2.973 N/A SER 253.A N ASP 251.A OD2 no hydrogen 2.945 N/A SER 253.A OG ASP 251.A OD1 no hydrogen 3.355 N/A SER 253.A OG ASP 251.A OD2 no hydrogen 2.907 N/A ALA 260.A N ASP 251.A O no hydrogen 2.998 N/A VAL 262.A N LEU 249.A O no hydrogen 2.862 N/A GLN 264.A NE2 SER 248.A OG no hydrogen 3.151 N/A ASP 265.A N ILE 247.A O no hydrogen 2.894 N/A SER 266.A OG THR 246.A OG1 no hydrogen 3.062 N/A VAL 267.A N LEU 245.A O no hydrogen 3.060 N/A PHE 269.A N ILE 243.A O no hydrogen 2.781 N/A ARG 270.A N ALA 133.A O no hydrogen 2.746 N/A ARG 270.A NH1 PRO 240.A O no hydrogen 3.515 N/A VAL 271.A N GLY 241.A O no hydrogen 2.800 N/A ALA 272.A N LEU 135.A O no hydrogen 2.703 N/A TRP 274.A N GLN 427.A OE1 no hydrogen 2.856 N/A TRP 274.A NE1 VAL 339.A O no hydrogen 3.167 N/A ILE 275.A N TYR 329.A O no hydrogen 2.958 N/A MET 276.A N GLN 430.A OE1 no hydrogen 3.362 N/A ASN 279.A ND2 PHE 451.A O no hydrogen 3.500 N/A GLN 281.A N PRO 278.A O no hydrogen 2.978 N/A GLN 281.A NE2 LYS 625.A O no hydrogen 2.583 N/A GLN 284.A N ARG 623.A O no hydrogen 2.866 N/A VAL 286.A N LYS 306.A O no hydrogen 2.796 N/A TYR 287.A N ASN 621.A O no hydrogen 2.729 N/A ALA 288.A N THR 308.A O no hydrogen 3.204 N/A CYS 289.A SG ASP 318.A O no hydrogen 3.354 N/A SER 295.A OG ASP 291.A O no hydrogen 2.673 N/A SER 295.A OG PHE 292.A O no hydrogen 2.637 N/A VAL 296.A N PHE 292.A O no hydrogen 3.003 N/A THR 297.A OG1 LEU 293.A O no hydrogen 2.770 N/A THR 298.A N LYS 294.A O no hydrogen 2.890 N/A THR 298.A OG1 SER 295.A O no hydrogen 3.415 N/A LEU 299.A N SER 295.A O no hydrogen 2.966 N/A ALA 300.A N VAL 296.A O no hydrogen 2.865 N/A MET 301.A N THR 297.A O no hydrogen 2.898 N/A LYS 302.A N THR 298.A O no hydrogen 2.902 N/A ALA 303.A N LEU 299.A O no hydrogen 3.001 N/A LYS 304.A N MET 301.A O no hydrogen 2.420 N/A CYS 305.A N ALA 300.A O no hydrogen 3.074 N/A CYS 305.A SG ALA 303.A O no hydrogen 3.442 N/A LYS 306.A N GLN 284.A O no hydrogen 3.302 N/A LYS 306.A NZ LEU 307.A O no hydrogen 3.123 N/A THR 308.A N VAL 286.A O no hydrogen 3.061 N/A CYS 310.A N ALA 288.A O no hydrogen 3.224 N/A CYS 310.A SG PRO 311.A O no hydrogen 3.820 N/A CYS 310.A SG GLU 314.A OE1 no hydrogen 3.286 N/A CYS 310.A SG ASN 315.A OD1 no hydrogen 3.024 N/A ASN 315.A N PRO 311.A O no hydrogen 3.190 N/A MET 316.A N GLU 312.A O no hydrogen 2.644 N/A ASP 318.A N ASN 315.A O no hydrogen 3.377 N/A TRP 320.A N ASP 318.A OD1 no hydrogen 3.131 N/A GLN 322.A N CYS 618.A O no hydrogen 3.006 N/A GLN 322.A NE2 THR 620.A O no hydrogen 3.425 N/A GLU 326.A N PHE 341.A O no hydrogen 2.918 N/A GLY 328.A N VAL 339.A O no hydrogen 2.875 N/A TYR 329.A N ILE 275.A O no hydrogen 2.931 N/A ILE 330.A N LEU 337.A O no hydrogen 2.868 N/A ALA 332.A N LYS 335.A O no hydrogen 2.563 N/A HIS 334.A NE2 ASP 164.A O no hydrogen 3.099 N/A LYS 335.A N ALA 332.A O no hydrogen 2.795 N/A LEU 337.A N ILE 330.A O no hydrogen 2.955 N/A VAL 339.A N GLY 328.A O no hydrogen 2.933 N/A VAL 340.A N GLY 363.A O no hydrogen 2.807 N/A PHE 341.A N GLU 326.A O no hydrogen 2.886 N/A ASP 342.A N VAL 365.A O no hydrogen 2.906 N/A SER 343.A N GLU 324.A O no hydrogen 2.730 N/A SER 343.A OG ASP 378.A O no hydrogen 2.566 N/A ARG 345.A NE GLU 324.A OE2 no hydrogen 2.882 N/A ARG 345.A NH2 ASP 318.A OD1 no hydrogen 3.068 N/A ARG 345.A NH2 ASP 318.A OD2 no hydrogen 2.936 N/A ASN 346.A N GLU 324.A OE1 no hydrogen 2.992 N/A ASN 346.A ND2 GLN 370.A O no hydrogen 3.269 N/A ASN 346.A ND2 GLN 370.A OE1 no hydrogen 2.796 N/A ARG 347.A N GLU 324.A OE2 no hydrogen 3.474 N/A GLY 348.A N ASP 318.A OD2 no hydrogen 3.299 N/A LYS 350.A NZ GLU 351.A OE1 no hydrogen 3.396 N/A PHE 352.A N LEU 349.A O no hydrogen 2.689 N/A LYS 355.A N PHE 352.A O no hydrogen 3.282 N/A ARG 356.A N PHE 352.A O no hydrogen 2.962 N/A ARG 356.A NE GLU 314.A OE2 no hydrogen 3.243 N/A ARG 356.A NH2 GLU 314.A OE2 no hydrogen 2.480 N/A VAL 357.A N PHE 352.A O no hydrogen 3.431 N/A GLY 359.A N PHE 362.A O no hydrogen 3.396 N/A PHE 362.A N GLY 359.A O no hydrogen 3.064 N/A GLY 363.A N PRO 338.A O no hydrogen 2.710 N/A TYR 364.A OH ASP 342.A OD2 no hydrogen 2.501 N/A VAL 365.A N VAL 340.A O no hydrogen 2.859 N/A THR 366.A OG1 ASP 342.A O no hydrogen 2.862 N/A ARG 367.A NE ASP 236.A OD2 no hydrogen 2.797 N/A ARG 367.A NH1 THR 366.A O no hydrogen 2.574 N/A ARG 367.A NH2 ASP 236.A OD2 no hydrogen 3.026 N/A SER 375.A N ASP 378.A OD1 no hydrogen 3.015 N/A LEU 377.A N SER 375.A OG no hydrogen 3.405 N/A SER 379.A OG GLY 376.A O no hydrogen 3.074 N/A PHE 380.A N ASP 323.A O no hydrogen 2.812 N/A ASN 382.A N SER 379.A O no hydrogen 2.925 N/A ASN 382.A ND2 LEU 377.A O no hydrogen 3.215 N/A ASN 382.A ND2 GLY 404.A O no hydrogen 3.163 N/A LEU 383.A N PHE 380.A O no hydrogen 3.187 N/A GLU 384.A N LEU 402.A O no hydrogen 2.908 N/A SER 386.A N ARG 400.A O no hydrogen 2.932 N/A SER 386.A OG PRO 387.A O no hydrogen 2.938 N/A VAL 389.A N TYR 396.A O no hydrogen 2.910 N/A VAL 391.A N LYS 394.A O no hydrogen 2.939 N/A LYS 394.A N VAL 391.A O no hydrogen 2.808 N/A TYR 396.A N VAL 389.A O no hydrogen 2.866 N/A GLY 399.A N TYR 396.A O no hydrogen 3.136 N/A ARG 400.A N SER 386.A OG no hydrogen 3.115 N/A ARG 400.A NE GLU 529.A O no hydrogen 3.406 N/A ARG 400.A NH1 ALA 431.A O no hydrogen 2.549 N/A LEU 402.A N GLU 384.A O no hydrogen 2.867 N/A PHE 403.A N VAL 433.A O no hydrogen 2.935 N/A GLY 404.A N ASN 382.A OD1 no hydrogen 3.072 N/A SER 406.A OG ASP 405.A OD1 no hydrogen 3.445 N/A SER 406.A OG ARG 414.A O no hydrogen 3.471 N/A SER 410.A N SER 413.A OG no hydrogen 2.938 N/A SER 413.A OG SER 410.A O no hydrogen 3.139 N/A ARG 414.A NE ASP 438.A OD2 no hydrogen 2.936 N/A ARG 414.A NH1 SER 441.A O no hydrogen 2.931 N/A ARG 414.A NH2 ASP 438.A O no hydrogen 3.357 N/A ARG 414.A NH2 ASP 438.A OD2 no hydrogen 3.289 N/A ARG 414.A NH2 LEU 440.A O no hydrogen 2.800 N/A ARG 414.A NH2 SER 441.A O no hydrogen 3.302 N/A GLN 415.A NE2 MET 416.A O no hydrogen 2.491 N/A HIS 417.A N ASP 378.A OD2 no hydrogen 2.928 N/A GLN 418.A NE2 ASP 422.A OD2 no hydrogen 2.629 N/A ALA 419.A N HIS 417.A ND1 no hydrogen 3.413 N/A GLN 421.A N HIS 417.A O no hydrogen 3.283 N/A GLN 421.A NE2 MET 416.A O no hydrogen 2.902 N/A ASP 422.A N GLN 418.A O no hydrogen 2.892 N/A PHE 423.A N ALA 419.A O no hydrogen 2.895 N/A LEU 424.A N LEU 420.A O no hydrogen 2.871 N/A SER 425.A N GLN 421.A O no hydrogen 2.917 N/A SER 425.A OG GLN 421.A O no hydrogen 3.361 N/A ALA 426.A N ASP 422.A O no hydrogen 2.939 N/A GLN 427.A N LEU 424.A O no hydrogen 3.339 N/A GLN 427.A NE2 PRO 235.A O no hydrogen 3.129 N/A GLN 427.A NE2 PHE 423.A O no hydrogen 2.830 N/A GLN 428.A NE2 ALA 426.A O no hydrogen 3.533 N/A GLN 430.A NE2 MET 276.A O no hydrogen 3.044 N/A GLN 430.A NE2 LEU 398.A O no hydrogen 2.817 N/A VAL 433.A N ILE 401.A O no hydrogen 2.457 N/A LEU 435.A N PHE 403.A O no hydrogen 2.951 N/A TYR 436.A N ASN 522.A OD1 no hydrogen 2.694 N/A SER 437.A N ASP 405.A O no hydrogen 2.873 N/A SER 437.A OG ASN 382.A OD1 no hydrogen 3.523 N/A SER 437.A OG GLY 443.A O no hydrogen 2.517 N/A ASP 438.A N ASP 405.A O no hydrogen 3.020 N/A TRP 439.A NE1 TYR 436.A O no hydrogen 2.681 N/A LEU 440.A N SER 437.A O no hydrogen 3.050 N/A SER 441.A N ALA 552.A O no hydrogen 2.899 N/A HIS 444.A N GLU 447.A OE2 no hydrogen 2.641 N/A HIS 444.A NE2 GLY 376.A O no hydrogen 2.767 N/A VAL 445.A N ASN 382.A OD1 no hydrogen 3.253 N/A GLU 447.A N HIS 444.A O no hydrogen 3.059 N/A PHE 448.A N VAL 445.A O no hydrogen 3.246 N/A LEU 449.A N VAL 445.A O no hydrogen 3.019 N/A SER 450.A N LEU 463.A O no hydrogen 2.915 N/A VAL 452.A N ARG 461.A O no hydrogen 2.928 N/A ALA 454.A N GLY 459.A O no hydrogen 2.797 N/A ARG 457.A NH2 ASP 536.A OD2 no hydrogen 3.535 N/A LYS 458.A NZ ASP 536.A OD2 no hydrogen 3.299 N/A GLY 459.A N ASP 456.A O no hydrogen 2.790 N/A ARG 461.A N VAL 452.A O no hydrogen 2.877 N/A ARG 461.A NH1 PHE 460.A O no hydrogen 3.197 N/A ARG 461.A NH2 ASP 456.A OD1 no hydrogen 3.555 N/A ARG 461.A NH2 ASP 456.A OD2 no hydrogen 3.402 N/A LEU 462.A N ASP 536.A O no hydrogen 2.865 N/A LEU 463.A N SER 450.A O no hydrogen 2.830 N/A LEU 464.A N ILE 538.A O no hydrogen 3.051 N/A ALA 465.A N PHE 448.A O no hydrogen 3.072 N/A SER 466.A N ILE 540.A O no hydrogen 2.526 N/A ARG 468.A NE GLU 516.A OE2 no hydrogen 2.947 N/A ARG 468.A NH2 GLU 516.A OE1 no hydrogen 3.469 N/A SER 469.A N SER 466.A OG no hydrogen 3.111 N/A CYS 470.A N SER 466.A O no hydrogen 3.238 N/A TYR 471.A N PRO 467.A O no hydrogen 2.909 N/A LYS 472.A N ARG 468.A O no hydrogen 2.914 N/A LEU 473.A N SER 469.A O no hydrogen 2.973 N/A PHE 474.A N CYS 470.A O no hydrogen 2.915 N/A GLN 475.A N TYR 471.A O no hydrogen 2.897 N/A GLN 475.A NE2 GLN 475.A O no hydrogen 3.340 N/A GLN 475.A NE2 ASN 479.A OD1 no hydrogen 3.318 N/A GLU 476.A N LYS 472.A O no hydrogen 2.903 N/A GLN 477.A N LEU 473.A O no hydrogen 2.956 N/A GLN 477.A NE2 LEU 473.A O no hydrogen 3.398 N/A GLN 478.A N PHE 474.A O no hydrogen 2.874 N/A ASN 479.A N GLN 475.A O no hydrogen 2.894 N/A GLU 480.A N GLU 476.A O no hydrogen 3.150 N/A GLY 481.A N GLN 478.A O no hydrogen 2.673 N/A HIS 482.A N GLN 477.A O no hydrogen 3.059 N/A ALA 485.A N HIS 482.A O no hydrogen 2.687 N/A LEU 487.A N GLN 497.A O no hydrogen 2.629 N/A PHE 488.A N PHE 575.A O no hydrogen 3.107 N/A GLN 497.A N LEU 487.A O no hydrogen 3.164 N/A ILE 499.A N ALA 485.A O no hydrogen 3.073 N/A LYS 500.A N GLY 483.A O no hydrogen 3.067 N/A ASN 501.A N LYS 498.A O no hydrogen 2.778 N/A ILE 502.A N LYS 498.A O no hydrogen 3.214 N/A LEU 503.A N ILE 499.A O no hydrogen 2.930 N/A SER 504.A N LYS 500.A O no hydrogen 3.171 N/A SER 504.A OG LYS 500.A O no hydrogen 3.249 N/A SER 504.A OG ASN 501.A O no hydrogen 3.055 N/A ASN 505.A N ILE 502.A O no hydrogen 3.021 N/A ARG 509.A N ASN 505.A O no hydrogen 3.352 N/A ARG 509.A NH1 LEU 503.A O no hydrogen 2.321 N/A GLU 510.A N LYS 506.A O no hydrogen 2.936 N/A HIS 511.A N THR 507.A O no hydrogen 2.941 N/A ASN 512.A N LEU 508.A O no hydrogen 2.917 N/A ASN 512.A ND2 LEU 508.A O no hydrogen 2.693 N/A ASN 512.A ND2 PHE 544.A O no hydrogen 3.320 N/A SER 513.A N ARG 509.A O no hydrogen 2.895 N/A PHE 514.A N GLU 510.A O no hydrogen 2.934 N/A VAL 515.A N HIS 511.A O no hydrogen 2.926 N/A GLU 516.A N ASN 512.A O no hydrogen 2.893 N/A ARG 517.A N SER 513.A O no hydrogen 2.925 N/A CYS 518.A N PHE 514.A O no hydrogen 2.975 N/A CYS 518.A SG PHE 514.A O no hydrogen 3.314 N/A ILE 519.A N VAL 515.A O no hydrogen 2.916 N/A ASP 520.A N GLU 516.A O no hydrogen 2.924 N/A TRP 521.A N ARG 517.A O no hydrogen 2.914 N/A ASN 522.A N CYS 518.A O no hydrogen 3.057 N/A ASN 522.A ND2 TYR 436.A O no hydrogen 2.743 N/A ASN 522.A ND2 CYS 518.A O no hydrogen 3.189 N/A ARG 523.A N ILE 519.A O no hydrogen 2.882 N/A ARG 523.A NE GLU 534.A OE2 no hydrogen 3.133 N/A ARG 523.A NH1 ASP 539.A OD1 no hydrogen 3.277 N/A ARG 523.A NH1 ASP 539.A OD2 no hydrogen 2.884 N/A ARG 523.A NH2 GLU 534.A OE1 no hydrogen 2.498 N/A ARG 523.A NH2 GLU 534.A OE2 no hydrogen 3.473 N/A ARG 523.A NH2 ASP 539.A OD1 no hydrogen 3.385 N/A GLU 524.A N ASP 520.A O no hydrogen 2.959 N/A LEU 525.A N TRP 521.A O no hydrogen 2.993 N/A LEU 526.A N ASN 522.A O no hydrogen 2.859 N/A LYS 527.A N ARG 523.A O no hydrogen 2.923 N/A LYS 527.A NZ GLU 534.A OE2 no hydrogen 2.944 N/A ARG 528.A N GLU 524.A O no hydrogen 2.936 N/A GLU 529.A N LEU 525.A O no hydrogen 2.930 N/A LEU 530.A N LEU 526.A O no hydrogen 2.896 N/A LEU 532.A N LYS 527.A O no hydrogen 3.100 N/A ALA 533.A N ASP 536.A OD2 no hydrogen 3.025 N/A ASP 536.A N ALA 533.A O no hydrogen 2.978 N/A ILE 537.A N GLU 534.A O no hydrogen 2.944 N/A ILE 538.A N LEU 462.A O no hydrogen 2.770 N/A ILE 540.A N LEU 464.A O no hydrogen 2.747 N/A GLN 542.A N SER 466.A O no hydrogen 3.134 N/A GLN 542.A NE2 LEU 543.A O no hydrogen 2.988 N/A GLN 542.A NE2 PHE 556.A O no hydrogen 3.031 N/A PHE 544.A N ASN 512.A OD1 no hydrogen 2.744 N/A LYS 545.A N GLU 553.A O no hydrogen 2.858 N/A LYS 545.A NZ ALA 554.A O no hydrogen 3.037 N/A LEU 546.A N HIS 511.A ND1 no hydrogen 3.296 N/A LYS 547.A N LYS 551.A O no hydrogen 2.749 N/A LYS 551.A N GLU 548.A O no hydrogen 3.046 N/A LYS 551.A NZ ASP 438.A O no hydrogen 2.654 N/A ALA 552.A N TRP 439.A O no hydrogen 3.091 N/A GLU 553.A N LYS 545.A O no hydrogen 2.891 N/A PHE 555.A N LEU 543.A O no hydrogen 2.732 N/A ASN 558.A ND2 GLU 447.A O no hydrogen 2.604 N/A MET 559.A N GLN 542.A OE1 no hydrogen 3.211 N/A LEU 563.A N GLY 570.A O no hydrogen 3.064 N/A LEU 565.A N HIS 568.A O no hydrogen 3.190 N/A HIS 568.A N LEU 565.A O no hydrogen 2.749 N/A LEU 569.A N GLN 599.A O no hydrogen 2.891 N/A GLY 570.A N LEU 563.A O no hydrogen 2.770 N/A LYS 573.A N ILE 603.A O no hydrogen 2.708 N/A LYS 573.A NZ GLU 586.A OE1 no hydrogen 3.562 N/A LYS 573.A NZ GLU 586.A OE2 no hydrogen 2.684 N/A ILE 579.A N ARG 582.A O no hydrogen 2.797 N/A ARG 582.A N ILE 579.A O no hydrogen 2.928 N/A CYS 583.A SG PRO 574.A O no hydrogen 3.933 N/A CYS 584.A N PRO 577.A O no hydrogen 3.202 N/A CYS 584.A SG PRO 577.A O no hydrogen 3.288 N/A GLU 587.A N CYS 583.A O no hydrogen 3.122 N/A LYS 588.A N CYS 584.A O no hydrogen 2.910 N/A VAL 589.A N LEU 585.A O no hydrogen 2.905 N/A CYS 590.A N GLU 586.A O no hydrogen 2.893 N/A CYS 590.A SG GLU 586.A O no hydrogen 3.029 N/A SER 591.A N GLU 587.A O no hydrogen 2.921 N/A SER 591.A OG GLU 587.A O no hydrogen 3.481 N/A SER 591.A OG LYS 588.A O no hydrogen 2.484 N/A LEU 592.A N LYS 588.A O no hydrogen 2.987 N/A LEU 592.A N VAL 589.A O no hydrogen 2.827 N/A LEU 593.A N VAL 589.A O no hydrogen 2.873 N/A GLU 594.A N CYS 590.A O no hydrogen 2.877 N/A LEU 596.A N LEU 593.A O no hydrogen 2.808 N/A GLY 597.A N GLU 594.A O no hydrogen 2.697 N/A GLN 599.A N LYS 567.A O no hydrogen 2.904 N/A THR 601.A N LEU 569.A O no hydrogen 2.917 N/A ILE 603.A N ILE 571.A O no hydrogen 2.915 N/A PHE 606.A N ASN 604.A OD1 no hydrogen 2.680 N/A TYR 609.A N ASP 605.A O no hydrogen 2.441 N/A HIS 610.A N ASP 605.A O no hydrogen 3.340 N/A HIS 610.A N ASP 605.A OD1 no hydrogen 3.219 N/A HIS 610.A ND1 GLU 615.A OE1 no hydrogen 2.992 N/A ILE 611.A N PHE 606.A O no hydrogen 3.112 N/A ARG 612.A N TYR 609.A O no hydrogen 2.457 N/A HIS 613.A N HIS 610.A O no hydrogen 3.252 N/A GLY 614.A N TYR 609.A O no hydrogen 3.286 N/A CYS 618.A N GLU 615.A O no hydrogen 3.205 N/A GLY 619.A N GLU 615.A O no hydrogen 3.219 N/A THR 620.A OG1 TYR 287.A O no hydrogen 2.839 N/A ASN 621.A N TYR 287.A O no hydrogen 2.930 N/A ASN 621.A ND2 MET 321.A O no hydrogen 2.900 N/A ASN 621.A ND2 MET 325.A O no hydrogen 3.117 N/A VAL 622.A N ASN 621.A OD1 no hydrogen 2.810 N/A ARG 623.A N GLU 285.A O no hydrogen 3.015 N/A ARG 623.A NE GLN 284.A OE1 no hydrogen 2.990 N/A ARG 623.A NH1 GLU 285.A OE2 no hydrogen 3.087 N/A ARG 623.A NH2 GLN 284.A OE1 no hydrogen 3.223 N/A ARG 624.A NH2 VAL 564.A O no hydrogen 2.573 N/A LYS 625.A N PRO 282.A O no hydrogen 2.967 N/A LYS 625.A NZ PRO 626.A O no hydrogen 3.079 N/A LYS 630.A NZ SER 628.A O no hydrogen 3.201 N/A TRP 631.A NE1 GLN 331.A O no hydrogen 2.886 N/A ASN 633.A N LYS 630.A O no hydrogen 2.814 N/A MET 634.A N TRP 631.A O no hydrogen 3.110 N/A