Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jts_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 2.A O no hydrogen 2.831 N/A ILE 6.A N THR 2.A O no hydrogen 3.453 N/A LEU 7.A N VAL 3.A O no hydrogen 2.914 N/A GLU 8.A N ASP 4.A O no hydrogen 2.888 N/A GLN 9.A N ASP 5.A O no hydrogen 2.908 N/A VAL 10.A N ILE 6.A O no hydrogen 2.889 N/A GLU 12.A N GLU 12.A OE2 no hydrogen 2.642 N/A GLN 17.A N GLN 17.A OE1 no hydrogen 2.701 N/A GLN 17.A NE2 GLY 11.A O no hydrogen 2.327 N/A LYS 18.A N GLY 14.A O no hydrogen 2.996 N/A GLN 19.A N TRP 15.A O no hydrogen 2.910 N/A ALA 20.A N PHE 16.A O no hydrogen 2.930 N/A PHE 21.A N GLN 17.A O no hydrogen 2.869 N/A LEU 22.A N LYS 18.A O no hydrogen 2.898 N/A ILE 23.A N GLN 19.A O no hydrogen 2.904 N/A LEU 24.A N ALA 20.A O no hydrogen 2.976 N/A CYS 25.A N PHE 21.A O no hydrogen 2.794 N/A LEU 26.A N LEU 22.A O no hydrogen 2.912 N/A LEU 27.A N ILE 23.A O no hydrogen 2.976 N/A SER 28.A N LEU 24.A O no hydrogen 2.878 N/A ALA 29.A N CYS 25.A O no hydrogen 3.085 N/A ALA 30.A N LEU 27.A O no hydrogen 2.957 N/A PHE 31.A N SER 28.A O no hydrogen 3.087 N/A ILE 34.A N PHE 31.A O no hydrogen 3.319 N/A CYS 35.A N ALA 32.A O no hydrogen 3.223 N/A VAL 36.A N ALA 32.A O no hydrogen 2.820 N/A GLY 37.A N ALA 32.A O no hydrogen 3.302 N/A VAL 39.A N VAL 36.A O no hydrogen 3.357 N/A PHE 40.A N GLY 37.A O no hydrogen 2.908 N/A LEU 41.A N GLY 37.A O no hydrogen 3.334 N/A GLY 42.A N ILE 38.A O no hydrogen 2.785 N/A THR 58.A OG1 ASP 57.A O no hydrogen 2.612 N/A SER 62.A OG LEU 41.A O no hydrogen 2.467 N/A SER 62.A OG PHE 43.A O no hydrogen 3.232 N/A ILE 63.A N LEU 41.A O no hydrogen 3.218 N/A THR 65.A OG1 SER 62.A O no hydrogen 2.845 N/A PHE 67.A N ILE 63.A O no hydrogen 2.927 N/A ASN 68.A N VAL 64.A O no hydrogen 2.798 N/A LEU 69.A N VAL 64.A O no hydrogen 3.451 N/A SER 74.A OG VAL 70.A O no hydrogen 2.367 N/A SER 74.A OG CYS 71.A O no hydrogen 3.260 N/A LYS 76.A N ASP 73.A O no hydrogen 3.164 N/A LEU 79.A N TRP 75.A O no hydrogen 2.812 N/A PHE 80.A N LYS 76.A O no hydrogen 2.502 N/A GLN 81.A N LEU 77.A O no hydrogen 2.920 N/A SER 82.A N ASP 78.A O no hydrogen 2.877 N/A CYS 83.A N LEU 79.A O no hydrogen 2.859 N/A CYS 83.A SG LEU 79.A O no hydrogen 3.562 N/A LEU 84.A N PHE 80.A O no hydrogen 2.951 N/A ASN 85.A N GLN 81.A O no hydrogen 2.875 N/A ASN 85.A ND2 ASP 403.A O no hydrogen 2.633 N/A ALA 86.A N SER 82.A O no hydrogen 2.845 N/A GLY 87.A N CYS 83.A O no hydrogen 2.886 N/A PHE 88.A N LEU 84.A O no hydrogen 2.962 N/A LEU 89.A N ASN 85.A O no hydrogen 2.921 N/A PHE 90.A N ALA 86.A O no hydrogen 2.838 N/A GLY 91.A N GLY 87.A O no hydrogen 2.899 N/A SER 92.A N PHE 88.A O no hydrogen 2.877 N/A SER 92.A OG PHE 88.A O no hydrogen 2.580 N/A SER 92.A OG SER 399.A OG no hydrogen 2.703 N/A LEU 93.A N LEU 89.A O no hydrogen 2.985 N/A GLY 94.A N GLY 91.A O no hydrogen 3.031 N/A VAL 95.A N GLY 91.A O no hydrogen 2.919 N/A GLY 96.A N GLY 94.A O no hydrogen 2.843 N/A ALA 99.A N GLY 96.A O no hydrogen 2.944 N/A ASP 100.A N GLY 96.A O no hydrogen 2.939 N/A ASP 100.A N TYR 97.A O no hydrogen 3.275 N/A ARG 101.A N TYR 97.A O no hydrogen 2.892 N/A GLY 103.A N ASP 100.A O no hydrogen 2.962 N/A CYS 107.A N GLY 103.A O no hydrogen 2.434 N/A CYS 107.A SG PHE 98.A O no hydrogen 3.525 N/A CYS 107.A SG ALA 99.A O no hydrogen 3.401 N/A LEU 108.A N ARG 104.A O no hydrogen 2.914 N/A LEU 109.A N LYS 105.A O no hydrogen 2.928 N/A GLY 110.A N LEU 106.A O no hydrogen 2.903 N/A THR 111.A N CYS 107.A O no hydrogen 2.898 N/A THR 111.A OG1 CYS 107.A O no hydrogen 2.762 N/A THR 111.A OG1 LEU 108.A O no hydrogen 2.830 N/A THR 111.A OG1 ASN 145.A OD1 no hydrogen 2.797 N/A VAL 112.A N LEU 108.A O no hydrogen 2.882 N/A LEU 113.A N LEU 109.A O no hydrogen 3.007 N/A VAL 114.A N GLY 110.A O no hydrogen 2.933 N/A ASN 115.A N THR 111.A O no hydrogen 2.844 N/A ALA 116.A N VAL 112.A O no hydrogen 2.949 N/A VAL 117.A N LEU 113.A O no hydrogen 2.984 N/A SER 118.A N VAL 114.A O no hydrogen 2.881 N/A SER 118.A OG VAL 114.A O no hydrogen 3.529 N/A GLY 119.A N ASN 115.A O no hydrogen 2.892 N/A VAL 120.A N ALA 116.A O no hydrogen 2.978 N/A LEU 121.A N VAL 117.A O no hydrogen 2.904 N/A MET 122.A N SER 118.A O no hydrogen 2.865 N/A ALA 123.A N GLY 119.A O no hydrogen 2.969 N/A PHE 124.A N LEU 121.A O no hydrogen 3.168 N/A SER 125.A OG MET 122.A O no hydrogen 2.905 N/A SER 130.A OG ASN 127.A OD1 no hydrogen 2.345 N/A LEU 132.A N TYR 128.A O no hydrogen 2.866 N/A LEU 133.A N MET 129.A O no hydrogen 2.976 N/A PHE 134.A N SER 130.A O no hydrogen 2.879 N/A ARG 135.A N MET 131.A O no hydrogen 2.914 N/A LEU 136.A N LEU 132.A O no hydrogen 2.953 N/A LEU 137.A N LEU 133.A O no hydrogen 3.013 N/A GLN 138.A N PHE 134.A O no hydrogen 2.824 N/A GLN 138.A NE2 ASN 115.A OD1 no hydrogen 3.552 N/A GLY 139.A N ARG 135.A O no hydrogen 2.912 N/A LEU 140.A N LEU 136.A O no hydrogen 3.088 N/A VAL 141.A N LEU 137.A O no hydrogen 2.933 N/A SER 142.A N GLN 138.A O no hydrogen 2.892 N/A LYS 143.A N GLY 139.A O no hydrogen 3.020 N/A GLY 144.A N LEU 140.A O no hydrogen 3.085 N/A ASN 145.A N VAL 141.A O no hydrogen 2.897 N/A TRP 146.A N SER 142.A O no hydrogen 2.962 N/A MET 147.A N LYS 143.A O no hydrogen 3.045 N/A ALA 148.A N GLY 144.A O no hydrogen 2.971 N/A GLY 149.A N ASN 145.A O no hydrogen 2.930 N/A TYR 150.A N TRP 146.A O no hydrogen 2.940 N/A THR 151.A N MET 147.A O no hydrogen 2.966 N/A THR 151.A OG1 MET 147.A O no hydrogen 3.234 N/A LEU 152.A N ALA 148.A O no hydrogen 2.927 N/A ILE 153.A N GLY 149.A O no hydrogen 2.946 N/A THR 154.A N TYR 150.A O no hydrogen 2.974 N/A GLU 155.A N THR 151.A O no hydrogen 2.907 N/A GLU 155.A N LEU 152.A O no hydrogen 3.163 N/A PHE 156.A N LEU 152.A O no hydrogen 2.942 N/A VAL 157.A N ILE 153.A O no hydrogen 3.185 N/A SER 161.A OG GLU 12.A OE1 no hydrogen 3.468 N/A VAL 165.A N SER 161.A O no hydrogen 2.974 N/A ALA 166.A N ARG 162.A O no hydrogen 2.912 N/A ILE 167.A N ARG 163.A O no hydrogen 2.896 N/A MET 168.A N THR 164.A O no hydrogen 2.926 N/A TYR 169.A N VAL 165.A O no hydrogen 2.888 N/A TYR 169.A OH LEU 24.A O no hydrogen 3.047 N/A GLN 170.A N ALA 166.A O no hydrogen 2.961 N/A MET 171.A N ILE 167.A O no hydrogen 2.893 N/A ALA 172.A N MET 168.A O no hydrogen 2.858 N/A PHE 173.A N TYR 169.A O no hydrogen 2.918 N/A THR 174.A N GLN 170.A O no hydrogen 2.966 N/A THR 174.A OG1 GLN 170.A O no hydrogen 3.286 N/A VAL 175.A N MET 171.A O no hydrogen 2.868 N/A GLY 176.A N ALA 172.A O no hydrogen 2.821 N/A LEU 177.A N PHE 173.A O no hydrogen 2.975 N/A VAL 178.A N THR 174.A O no hydrogen 2.954 N/A ALA 179.A N VAL 175.A O no hydrogen 2.853 N/A LEU 180.A N GLY 176.A O no hydrogen 2.843 N/A THR 181.A N LEU 177.A O no hydrogen 2.954 N/A THR 181.A OG1 LEU 177.A O no hydrogen 3.244 N/A GLY 182.A N VAL 178.A O no hydrogen 2.939 N/A LEU 183.A N ALA 179.A O no hydrogen 2.872 N/A ALA 184.A N LEU 180.A O no hydrogen 2.852 N/A TYR 185.A N THR 181.A O no hydrogen 2.949 N/A ALA 186.A N GLY 182.A O no hydrogen 2.930 N/A LEU 187.A N LEU 183.A O no hydrogen 3.426 N/A ARG 191.A N HIS 189.A ND1 no hydrogen 3.164 N/A LEU 193.A N HIS 189.A O no hydrogen 3.261 N/A GLN 194.A N TRP 190.A O no hydrogen 2.911 N/A LEU 195.A N ARG 191.A O no hydrogen 2.959 N/A ALA 196.A N TRP 192.A O no hydrogen 2.859 N/A VAL 197.A N LEU 193.A O no hydrogen 2.894 N/A SER 198.A N GLN 194.A O no hydrogen 2.956 N/A PHE 202.A N SER 198.A O no hydrogen 3.483 N/A LEU 203.A N LEU 199.A O no hydrogen 2.940 N/A PHE 204.A N PRO 200.A O no hydrogen 2.843 N/A LEU 205.A N THR 201.A O no hydrogen 2.986 N/A LEU 206.A N PHE 202.A O no hydrogen 2.911 N/A TYR 207.A N PHE 204.A O no hydrogen 3.191 N/A TYR 208.A N LEU 205.A O no hydrogen 3.226 N/A CYS 210.A SG TYR 207.A O no hydrogen 3.605 N/A LEU 218.A N SER 214.A O no hydrogen 3.120 N/A LEU 219.A N PRO 215.A O no hydrogen 2.890 N/A SER 220.A N ARG 216.A O no hydrogen 2.913 N/A SER 220.A OG ARG 216.A O no hydrogen 3.079 N/A GLN 221.A N LEU 218.A O no hydrogen 3.179 N/A LYS 222.A N LEU 219.A O no hydrogen 3.109 N/A LYS 222.A NZ VAL 255.A O no hydrogen 3.308 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.611 N/A ILE 228.A N ASN 224.A O no hydrogen 2.878 N/A LYS 229.A N THR 225.A O no hydrogen 2.941 N/A ILE 230.A N GLU 226.A O no hydrogen 2.884 N/A MET 231.A N ALA 227.A O no hydrogen 2.921 N/A ASP 232.A N ILE 228.A O no hydrogen 2.911 N/A HIS 233.A N LYS 229.A O no hydrogen 2.914 N/A ILE 234.A N ILE 230.A O no hydrogen 2.914 N/A ALA 235.A N MET 231.A O no hydrogen 2.898 N/A GLN 236.A N ASP 232.A O no hydrogen 2.877 N/A LYS 237.A N HIS 233.A O no hydrogen 2.905 N/A LYS 237.A N ILE 234.A O no hydrogen 3.145 N/A ASN 238.A N ILE 234.A O no hydrogen 3.310 N/A LYS 240.A N ALA 235.A O no hydrogen 2.845 N/A MET 248.A N ALA 244.A O no hydrogen 2.897 N/A LEU 249.A N ASP 245.A O no hydrogen 2.914 N/A VAL 255.A N GLU 252.A O no hydrogen 3.022 N/A ARG 268.A N ASP 265.A O no hydrogen 3.213 N/A ARG 273.A N THR 269.A O no hydrogen 3.183 N/A LYS 274.A N PRO 270.A O no hydrogen 2.902 N/A ARG 275.A N ARG 271.A O no hydrogen 2.917 N/A THR 276.A N LEU 272.A O no hydrogen 2.895 N/A THR 276.A OG1 LEU 272.A O no hydrogen 2.990 N/A THR 276.A OG1 ARG 273.A O no hydrogen 2.646 N/A PHE 277.A N ARG 273.A O no hydrogen 2.930 N/A ILE 278.A N LYS 274.A O no hydrogen 2.926 N/A LEU 279.A N ARG 275.A O no hydrogen 2.909 N/A MET 280.A N THR 276.A O no hydrogen 2.853 N/A TYR 281.A N PHE 277.A O no hydrogen 2.990 N/A LEU 282.A N ILE 278.A O no hydrogen 2.912 N/A TRP 283.A N LEU 279.A O no hydrogen 2.848 N/A PHE 284.A N MET 280.A O no hydrogen 2.973 N/A THR 285.A N TYR 281.A O no hydrogen 3.062 N/A THR 285.A OG1 TYR 281.A O no hydrogen 2.959 N/A ASP 286.A N LEU 282.A O no hydrogen 2.848 N/A SER 287.A N TRP 283.A O no hydrogen 3.338 N/A VAL 288.A N PHE 284.A O no hydrogen 3.009 N/A LEU 289.A N THR 285.A O no hydrogen 2.947 N/A TYR 290.A N ASP 286.A O no hydrogen 2.959 N/A GLN 291.A N SER 287.A O no hydrogen 2.954 N/A GLY 292.A N VAL 288.A O no hydrogen 3.333 N/A LEU 293.A N LEU 289.A O no hydrogen 2.822 N/A ILE 294.A N TYR 290.A O no hydrogen 2.961 N/A LEU 295.A N GLN 291.A O no hydrogen 2.901 N/A HIS 296.A N GLY 292.A O no hydrogen 3.107 N/A MET 297.A N ILE 294.A O no hydrogen 2.875 N/A LEU 309.A N TYR 305.A O no hydrogen 2.952 N/A TYR 310.A N LEU 306.A O no hydrogen 2.865 N/A SER 311.A N ASP 307.A O no hydrogen 2.901 N/A ALA 312.A N PHE 308.A O no hydrogen 2.858 N/A LEU 313.A N LEU 309.A O no hydrogen 3.217 N/A GLU 315.A N ALA 312.A O no hydrogen 3.176 N/A GLY 318.A N VAL 314.A O no hydrogen 3.447 N/A ALA 319.A N GLU 315.A O no hydrogen 2.532 N/A PHE 320.A N ILE 316.A O no hydrogen 2.918 N/A ILE 321.A N PRO 317.A O no hydrogen 2.919 N/A ALA 322.A N GLY 318.A O no hydrogen 2.892 N/A LEU 323.A N ALA 319.A O no hydrogen 2.892 N/A ILE 324.A N PHE 320.A O no hydrogen 2.960 N/A THR 325.A N ILE 321.A O no hydrogen 2.940 N/A ALA 336.A N ILE 332.A O no hydrogen 2.918 N/A MET 337.A N TYR 333.A O no hydrogen 2.899 N/A SER 338.A N PRO 334.A O no hydrogen 2.899 N/A SER 338.A OG MET 335.A O no hydrogen 2.637 N/A SER 338.A OG GLY 370.A O no hydrogen 3.505 N/A ASN 339.A N MET 335.A O no hydrogen 2.879 N/A LEU 340.A N ALA 336.A O no hydrogen 2.930 N/A LEU 341.A N MET 337.A O no hydrogen 2.896 N/A ALA 342.A N SER 338.A O no hydrogen 2.882 N/A GLY 343.A N ASN 339.A O no hydrogen 2.918 N/A ALA 344.A N LEU 340.A O no hydrogen 2.917 N/A ALA 345.A N LEU 341.A O no hydrogen 2.870 N/A CYS 346.A N ALA 342.A O no hydrogen 2.906 N/A CYS 346.A SG ALA 342.A O no hydrogen 3.384 N/A LEU 347.A N GLY 343.A O no hydrogen 2.921 N/A VAL 348.A N ALA 345.A O no hydrogen 3.394 N/A ILE 352.A N VAL 348.A O no hydrogen 3.212 N/A SER 353.A OG ASP 355.A OD1 no hydrogen 2.315 N/A LEU 356.A N SER 353.A O no hydrogen 3.447 N/A ILE 362.A N TRP 358.A O no hydrogen 2.933 N/A ILE 363.A N LEU 359.A O no hydrogen 2.933 N/A MET 364.A N ASN 360.A O no hydrogen 2.940 N/A CYS 365.A N ILE 361.A O no hydrogen 2.892 N/A CYS 365.A SG ILE 361.A O no hydrogen 3.280 N/A VAL 366.A N ILE 362.A O no hydrogen 2.967 N/A GLY 367.A N ILE 363.A O no hydrogen 2.934 N/A ARG 368.A N MET 364.A O no hydrogen 2.954 N/A ARG 368.A NH2 TYR 290.A OH no hydrogen 2.475 N/A MET 369.A N CYS 365.A O no hydrogen 2.953 N/A GLY 370.A N VAL 366.A O no hydrogen 2.962 N/A ILE 371.A N GLY 367.A O no hydrogen 3.019 N/A THR 372.A N ARG 368.A O no hydrogen 2.955 N/A THR 372.A OG1 ARG 368.A O no hydrogen 2.812 N/A THR 372.A OG1 MET 369.A O no hydrogen 2.811 N/A ILE 373.A N MET 369.A O no hydrogen 2.938 N/A ALA 374.A N GLY 370.A O no hydrogen 2.942 N/A GLN 376.A N THR 372.A O no hydrogen 2.994 N/A MET 377.A N ILE 373.A O no hydrogen 2.908 N/A ILE 378.A N ALA 374.A O no hydrogen 2.900 N/A CYS 379.A N ILE 375.A O no hydrogen 3.044 N/A VAL 381.A N MET 377.A O no hydrogen 2.890 N/A ASN 382.A N ILE 378.A O no hydrogen 2.902 N/A ASN 382.A ND2 GLY 394.A O no hydrogen 2.936 N/A ALA 383.A N CYS 379.A O no hydrogen 2.982 N/A GLU 384.A N LEU 380.A O no hydrogen 2.878 N/A LEU 385.A N VAL 381.A O no hydrogen 2.889 N/A VAL 390.A N PRO 387.A O no hydrogen 2.911 N/A ARG 391.A N PRO 387.A O no hydrogen 2.531 N/A ASN 392.A ND2 ASP 100.A OD2 no hydrogen 3.153 N/A SER 399.A N VAL 395.A O no hydrogen 2.706 N/A SER 399.A OG SER 92.A OG no hydrogen 2.703 N/A SER 400.A N MET 396.A O no hydrogen 2.588 N/A ASP 403.A N SER 399.A O no hydrogen 3.125 N/A GLY 406.A N CYS 402.A O no hydrogen 2.928 N/A ILE 407.A N ASP 403.A O no hydrogen 2.897 N/A ILE 408.A N ILE 404.A O no hydrogen 2.900 N/A THR 409.A N GLY 405.A O no hydrogen 2.943 N/A THR 409.A OG1 GLY 405.A O no hydrogen 3.011 N/A ILE 412.A N ILE 408.A O no hydrogen 2.942 N/A VAL 413.A N THR 409.A O no hydrogen 3.023 N/A PHE 414.A N PRO 410.A O no hydrogen 2.921 N/A ARG 415.A N PHE 411.A O no hydrogen 2.949 N/A LEU 416.A N ILE 412.A O no hydrogen 2.840 N/A ARG 417.A N VAL 413.A O no hydrogen 2.913 N/A GLU 418.A N ARG 415.A O no hydrogen 3.227 N/A VAL 419.A N ARG 415.A O no hydrogen 2.929 N/A TRP 420.A N LEU 416.A O no hydrogen 3.072 N/A LEU 423.A N TRP 420.A O no hydrogen 2.975 N/A LEU 427.A N LEU 423.A O no hydrogen 2.949 N/A PHE 428.A N PRO 424.A O no hydrogen 2.890 N/A ALA 429.A N LEU 425.A O no hydrogen 2.895 N/A VAL 430.A N ILE 426.A O no hydrogen 2.885 N/A LEU 431.A N LEU 427.A O no hydrogen 2.996 N/A GLY 432.A N PHE 428.A O no hydrogen 2.898 N/A LEU 433.A N ALA 429.A O no hydrogen 2.883 N/A LEU 434.A N VAL 430.A O no hydrogen 2.945 N/A ALA 435.A N LEU 431.A O no hydrogen 2.920 N/A ALA 436.A N GLY 432.A O no hydrogen 2.899 N/A GLY 437.A N LEU 433.A O no hydrogen 2.899 N/A VAL 438.A N LEU 434.A O no hydrogen 2.949 N/A THR 439.A N ALA 435.A O no hydrogen 2.627 N/A THR 453.A OG1 THR 453.A O no hydrogen 2.545 N/A GLU 458.A N LYS 455.A O no hydrogen 3.347 N/A ASN 459.A N LYS 455.A O no hydrogen 2.898 N/A GLY 461.A N GLU 458.A O no hydrogen 3.441 N/A