Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1q3d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N TYR 22.A O no hydrogen 2.969 N/A THR 5.A OG1 SER 21.A OG no hydrogen 2.815 N/A VAL 6.A N VAL 20.A O no hydrogen 2.919 N/A ALA 8.A N GLN 18.A O no hydrogen 2.836 N/A THR 9.A N PHE 81.A O no hydrogen 3.160 N/A GLY 11.A N ARG 79.A O no hydrogen 2.716 N/A GLN 12.A NE2 LEU 78.A O no hydrogen 3.612 N/A ARG 16.A N PRO 14.A O no hydrogen 2.815 N/A GLN 18.A N ALA 8.A O no hydrogen 2.865 N/A VAL 20.A N VAL 6.A O no hydrogen 2.848 N/A SER 21.A OG THR 5.A OG1 no hydrogen 2.815 N/A TYR 22.A N THR 4.A O no hydrogen 3.025 N/A THR 23.A N LYS 40.A O no hydrogen 2.808 N/A THR 23.A OG1 LYS 2.A O no hydrogen 2.677 N/A THR 23.A OG1 ASP 24.A OD1 no hydrogen 3.263 N/A LYS 26.A N GLN 38.A O no hydrogen 3.304 N/A ILE 28.A N VAL 36.A O no hydrogen 2.881 N/A GLY 29.A N VAL 36.A O no hydrogen 3.172 N/A GLY 34.A N GLY 31.A O no hydrogen 2.859 N/A VAL 35.A N LYS 52.A O no hydrogen 3.070 N/A VAL 36.A N GLY 29.A O no hydrogen 2.931 N/A TYR 37.A N ILE 50.A O no hydrogen 2.888 N/A GLN 38.A N LYS 26.A O no hydrogen 2.843 N/A ALA 39.A N VAL 48.A O no hydrogen 2.840 N/A LYS 40.A N THR 23.A O no hydrogen 2.818 N/A LEU 41.A N GLU 46.A O no hydrogen 2.751 N/A CYS 42.A N SER 21.A O no hydrogen 2.821 N/A GLY 45.A N LEU 41.A O no hydrogen 2.732 N/A VAL 48.A N ALA 39.A O no hydrogen 2.868 N/A ALA 49.A N LEU 92.A O no hydrogen 2.873 N/A ILE 50.A N TYR 37.A O no hydrogen 2.800 N/A LYS 51.A N LEU 90.A O no hydrogen 2.920 N/A LYS 51.A NZ GLU 63.A OE1 no hydrogen 2.855 N/A LYS 51.A NZ GLU 63.A OE2 no hydrogen 3.291 N/A LYS 52.A N VAL 35.A O no hydrogen 2.719 N/A VAL 53.A N LEU 88.A O no hydrogen 3.066 N/A GLN 55.A N VAL 86.A O no hydrogen 2.912 N/A GLN 55.A NE2 PHE 59.A O no hydrogen 3.022 N/A PHE 59.A N ASP 56.A O no hydrogen 3.425 N/A ASN 61.A ND2 GLN 55.A OE1 no hydrogen 3.272 N/A LEU 64.A N ASN 61.A OD1 no hydrogen 2.814 N/A GLN 65.A N ASN 61.A O no hydrogen 3.054 N/A ILE 66.A N ARG 62.A O no hydrogen 3.107 N/A MET 67.A N GLU 63.A O no hydrogen 2.875 N/A ARG 68.A N LEU 64.A O no hydrogen 3.004 N/A LYS 69.A N ILE 66.A O no hydrogen 3.161 N/A LEU 70.A N MET 67.A O no hydrogen 3.381 N/A ASP 71.A N TYR 131.A OH no hydrogen 3.060 N/A HIS 72.A NE2 GLU 320.A OE2 no hydrogen 2.911 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 2.857 N/A ILE 75.A N HIS 72.A O no hydrogen 3.139 N/A VAL 76.A N LEU 158.A O no hydrogen 2.830 N/A ARG 77.A N ASP 93.A OD2 no hydrogen 2.915 N/A ARG 77.A NH1 GLN 12.A OE1 no hydrogen 2.755 N/A ARG 79.A N VAL 91.A O no hydrogen 2.717 N/A ARG 79.A NE ASP 93.A OD1 no hydrogen 2.934 N/A ARG 79.A NH1 GLU 46.A OE1 no hydrogen 3.090 N/A ARG 79.A NH2 GLU 46.A OE2 no hydrogen 3.200 N/A ARG 79.A NH2 ASP 93.A OD1 no hydrogen 3.083 N/A TYR 80.A N VAL 91.A O no hydrogen 3.494 N/A PHE 81.A N THR 9.A O no hydrogen 3.170 N/A PHE 82.A N ASN 89.A O no hydrogen 2.965 N/A SER 84.A N TYR 87.A O no hydrogen 2.881 N/A SER 84.A OG ASN 89.A OD1 no hydrogen 2.908 N/A TYR 87.A N SER 84.A O no hydrogen 2.687 N/A LEU 88.A N VAL 53.A O no hydrogen 2.814 N/A ASN 89.A N PHE 82.A O no hydrogen 2.883 N/A LEU 90.A N LYS 51.A O no hydrogen 2.975 N/A VAL 91.A N TYR 80.A O no hydrogen 2.717 N/A LEU 92.A N ALA 49.A O no hydrogen 2.618 N/A ASP 93.A N ARG 77.A O no hydrogen 3.288 N/A GLU 97.A N LEU 149.A O no hydrogen 3.037 N/A VAL 99.A N LEU 147.A O no hydrogen 2.973 N/A TYR 100.A N PRO 144.A O no hydrogen 3.382 N/A ARG 101.A N THR 98.A OG1 no hydrogen 3.038 N/A ARG 101.A NE GLU 97.A OE1 no hydrogen 3.325 N/A ARG 101.A NE GLU 97.A OE2 no hydrogen 3.308 N/A ARG 101.A NH2 GLU 97.A OE2 no hydrogen 2.586 N/A VAL 102.A N THR 98.A O no hydrogen 3.149 N/A ALA 103.A N VAL 99.A O no hydrogen 2.882 N/A ARG 104.A N TYR 100.A O no hydrogen 3.020 N/A HIS 105.A N ARG 101.A O no hydrogen 3.080 N/A TYR 106.A N VAL 102.A O no hydrogen 3.357 N/A SER 107.A N ALA 103.A O no hydrogen 2.954 N/A SER 107.A OG GLY 213.A O no hydrogen 2.983 N/A ARG 108.A N ARG 104.A O no hydrogen 3.085 N/A LYS 110.A N SER 107.A O no hydrogen 3.154 N/A GLN 111.A N TYR 106.A O no hydrogen 2.954 N/A GLN 111.A NE2 ALA 109.A O no hydrogen 3.309 N/A TYR 117.A N PRO 114.A O no hydrogen 2.999 N/A VAL 118.A N PRO 114.A O no hydrogen 3.461 N/A LYS 119.A N VAL 115.A O no hydrogen 3.063 N/A LYS 119.A NZ GLU 296.A OE1 no hydrogen 2.861 N/A LEU 120.A N ILE 116.A O no hydrogen 3.097 N/A TYR 121.A N TYR 117.A O no hydrogen 2.926 N/A MET 122.A N VAL 118.A O no hydrogen 3.042 N/A TYR 123.A N LYS 119.A O no hydrogen 3.005 N/A TYR 123.A OH LEU 313.A O no hydrogen 2.686 N/A GLN 124.A N LEU 120.A O no hydrogen 3.245 N/A GLN 124.A NE2 LEU 120.A O no hydrogen 2.890 N/A GLN 124.A NE2 ALA 154.A O no hydrogen 2.900 N/A LEU 125.A N TYR 121.A O no hydrogen 3.051 N/A PHE 126.A N MET 122.A O no hydrogen 3.004 N/A ARG 127.A N TYR 123.A O no hydrogen 3.011 N/A ARG 127.A NE GLU 320.A OE2 no hydrogen 2.758 N/A ARG 127.A NH1 ASN 315.A OD1 no hydrogen 2.864 N/A ARG 127.A NH2 ASN 315.A OD1 no hydrogen 3.304 N/A ARG 127.A NH2 GLU 320.A OE1 no hydrogen 3.016 N/A ARG 127.A NH2 GLU 320.A OE2 no hydrogen 3.286 N/A SER 128.A N GLN 124.A O no hydrogen 3.062 N/A SER 128.A OG LEU 125.A O no hydrogen 2.766 N/A LEU 129.A N LEU 125.A O no hydrogen 2.996 N/A ALA 130.A N PHE 126.A O no hydrogen 2.933 N/A TYR 131.A N ARG 127.A O no hydrogen 3.097 N/A ILE 132.A N SER 128.A O no hydrogen 3.068 N/A HIS 133.A N LEU 129.A O no hydrogen 2.825 N/A HIS 133.A NE2 ASP 199.A OD2 no hydrogen 2.933 N/A SER 134.A N ALA 130.A O no hydrogen 3.082 N/A SER 134.A N TYR 131.A O no hydrogen 3.204 N/A SER 134.A OG TYR 131.A O no hydrogen 2.662 N/A SER 134.A OG GLN 319.A OE1 no hydrogen 2.902 N/A PHE 135.A N ILE 132.A O no hydrogen 3.083 N/A GLY 136.A N HIS 133.A O no hydrogen 2.783 N/A ILE 137.A N ILE 132.A O no hydrogen 3.079 N/A CYS 138.A N LYS 165.A O no hydrogen 3.036 N/A CYS 138.A SG ASP 199.A OD1 no hydrogen 3.637 N/A CYS 138.A SG ASP 199.A OD2 no hydrogen 3.473 N/A HIS 139.A N ASP 199.A OD2 no hydrogen 2.814 N/A HIS 139.A NE2 CYS 159.A O no hydrogen 3.087 N/A ARG 140.A N ASP 199.A OD1 no hydrogen 2.938 N/A ARG 140.A NE SER 163.A O no hydrogen 2.766 N/A ARG 140.A NH1 TYR 194.A OH no hydrogen 2.875 N/A ARG 140.A NH2 SER 163.A O no hydrogen 3.079 N/A ASP 141.A N HIS 139.A ND1 no hydrogen 3.039 N/A LYS 143.A NZ ASP 141.A OD2 no hydrogen 3.495 N/A LYS 143.A NZ SER 179.A OG no hydrogen 3.170 N/A ASN 146.A N LYS 143.A O no hydrogen 2.928 N/A ASN 146.A ND2 ASP 141.A O no hydrogen 2.919 N/A LEU 147.A N PRO 144.A O no hydrogen 3.294 N/A LEU 148.A N LYS 157.A O no hydrogen 3.003 N/A LEU 149.A N GLU 97.A O no hydrogen 2.820 N/A ASP 150.A N VAL 155.A O no hydrogen 3.091 N/A ASP 152.A N ASP 150.A OD1 no hydrogen 3.154 N/A ALA 154.A N ASP 150.A O no hydrogen 2.850 N/A VAL 155.A N THR 153.A OG1 no hydrogen 3.303 N/A LEU 156.A N GLN 124.A OE1 no hydrogen 3.062 N/A LYS 157.A N LEU 148.A O no hydrogen 2.886 N/A LYS 157.A NZ CYS 73.A O no hydrogen 3.085 N/A LEU 158.A N ASN 74.A O no hydrogen 2.883 N/A CYS 159.A N ASN 146.A O no hydrogen 3.051 N/A CYS 159.A SG ASN 146.A O no hydrogen 3.780 N/A CYS 159.A SG ASN 146.A OD1 no hydrogen 4.018 N/A GLY 162.A N ASP 160.A OD1 no hydrogen 3.052 N/A ALA 164.A N PHE 161.A O no hydrogen 3.185 N/A LYS 165.A N CYS 138.A O no hydrogen 3.040 N/A LYS 165.A NZ ASN 173.A OD1 no hydrogen 2.443 N/A LEU 167.A N GLY 136.A O no hydrogen 3.030 N/A GLU 171.A N VAL 168.A O no hydrogen 2.957 N/A ASN 173.A N THR 192.A O no hydrogen 2.842 N/A CYS 178.A SG TYR 182.A O no hydrogen 3.583 N/A CYS 178.A SG SER 202.A OG no hydrogen 3.651 N/A SER 179.A OG ASP 141.A OD1 no hydrogen 3.007 N/A ARG 180.A NH1 ASP 220.A OD2 no hydrogen 2.995 N/A TYR 182.A N SER 179.A O no hydrogen 2.984 N/A TYR 182.A OH GLU 209.A OE1 no hydrogen 2.582 N/A ARG 183.A NH1 SER 175.A O no hydrogen 2.905 N/A ARG 183.A NH1 ILE 177.A O no hydrogen 3.285 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.825 N/A LEU 187.A N ALA 184.A O no hydrogen 2.973 N/A ILE 188.A N ALA 184.A O no hydrogen 3.233 N/A PHE 189.A N PRO 185.A O no hydrogen 2.803 N/A GLY 190.A N LEU 187.A O no hydrogen 2.950 N/A ALA 191.A N GLU 186.A O no hydrogen 2.953 N/A TYR 194.A OH VAL 174.A O no hydrogen 2.618 N/A SER 197.A N THR 195.A OG1 no hydrogen 3.209 N/A SER 197.A OG THR 195.A OG1 no hydrogen 2.852 N/A ILE 198.A N THR 195.A O no hydrogen 3.240 N/A ASP 199.A N SER 196.A O no hydrogen 3.003 N/A TRP 201.A N SER 197.A O no hydrogen 3.226 N/A SER 202.A N ILE 198.A O no hydrogen 3.083 N/A SER 202.A OG TYR 182.A O no hydrogen 2.740 N/A SER 202.A OG ILE 198.A O no hydrogen 3.301 N/A ALA 203.A N ASP 199.A O no hydrogen 3.009 N/A GLY 204.A N VAL 200.A O no hydrogen 2.912 N/A CYS 205.A N TRP 201.A O no hydrogen 2.940 N/A CYS 205.A SG TYR 181.A O no hydrogen 3.641 N/A CYS 205.A SG TRP 201.A O no hydrogen 3.554 N/A VAL 206.A N SER 202.A O no hydrogen 3.023 N/A LEU 207.A N ALA 203.A O no hydrogen 2.986 N/A ALA 208.A N GLY 204.A O no hydrogen 2.977 N/A GLU 209.A N CYS 205.A O no hydrogen 3.069 N/A LEU 210.A N VAL 206.A O no hydrogen 3.033 N/A LEU 211.A N LEU 207.A O no hydrogen 3.102 N/A LEU 212.A N ALA 208.A O no hydrogen 2.867 N/A GLY 213.A N GLU 209.A O no hydrogen 2.917 N/A ASP 224.A N SER 221.A OG no hydrogen 3.296 N/A GLN 225.A N SER 221.A O no hydrogen 3.058 N/A GLN 225.A NE2 GLY 219.A O no hydrogen 2.941 N/A LEU 226.A N GLY 222.A O no hydrogen 2.846 N/A VAL 227.A N VAL 223.A O no hydrogen 3.108 N/A GLU 228.A N ASP 224.A O no hydrogen 3.180 N/A ILE 229.A N GLN 225.A O no hydrogen 2.965 N/A ILE 230.A N LEU 226.A O no hydrogen 2.864 N/A LYS 231.A N VAL 227.A O no hydrogen 2.986 N/A LYS 231.A NZ GLU 228.A OE1 no hydrogen 3.328 N/A VAL 232.A N ILE 229.A O no hydrogen 3.018 N/A LEU 233.A N ILE 229.A O no hydrogen 2.751 N/A GLY 234.A N ILE 230.A O no hydrogen 2.636 N/A THR 235.A N ILE 250.A O no hydrogen 2.933 N/A THR 235.A OG1 PRO 248.A O no hydrogen 3.057 N/A THR 235.A OG1 ILE 250.A O no hydrogen 3.163 N/A THR 237.A N GLN 240.A OE1 no hydrogen 2.959 N/A GLN 240.A N THR 237.A OG1 no hydrogen 3.053 N/A ILE 241.A N THR 237.A O no hydrogen 3.050 N/A ARG 242.A N ARG 238.A O no hydrogen 3.108 N/A GLU 243.A N GLU 239.A O no hydrogen 3.264 N/A MET 244.A N GLN 240.A O no hydrogen 3.310 N/A MET 244.A N ILE 241.A O no hydrogen 3.195 N/A ASN 245.A N ILE 241.A O no hydrogen 2.623 N/A ILE 250.A N THR 235.A OG1 no hydrogen 2.667 N/A HIS 253.A N VAL 232.A O no hydrogen 3.413 N/A HIS 253.A ND1 PRO 254.A O no hydrogen 3.052 N/A LYS 257.A N PRO 254.A O no hydrogen 2.887 N/A VAL 258.A N TRP 255.A O no hydrogen 3.066 N/A THR 263.A N ARG 260.A O no hydrogen 3.446 N/A THR 263.A OG1 ARG 260.A O no hydrogen 3.243 N/A GLU 266.A N GLU 266.A OE2 no hydrogen 2.415 N/A ALA 267.A N PRO 264.A O no hydrogen 3.110 N/A ILE 268.A N PRO 264.A O no hydrogen 3.379 N/A ALA 269.A N PRO 265.A O no hydrogen 2.959 N/A LEU 270.A N GLU 266.A O no hydrogen 2.967 N/A CYS 271.A N ALA 267.A O no hydrogen 3.156 N/A CYS 271.A SG ALA 267.A O no hydrogen 3.793 N/A SER 272.A N ILE 268.A O no hydrogen 3.102 N/A SER 272.A OG ALA 269.A O no hydrogen 2.881 N/A ARG 273.A N ALA 269.A O no hydrogen 3.218 N/A ARG 273.A N LEU 270.A O no hydrogen 2.932 N/A LEU 274.A N CYS 271.A O no hydrogen 3.060 N/A LEU 275.A N CYS 271.A O no hydrogen 2.947 N/A TYR 277.A OH GLY 234.A O no hydrogen 2.785 N/A THR 278.A OG1 GLU 243.A OE1 no hydrogen 2.876 N/A ALA 281.A N THR 278.A O no hydrogen 2.960 N/A ARG 282.A N PRO 279.A O no hydrogen 3.249 N/A ARG 282.A NE GLU 276.A O no hydrogen 2.832 N/A ARG 282.A NH1 GLU 186.A OE1 no hydrogen 3.526 N/A ARG 282.A NH1 GLU 186.A OE2 no hydrogen 2.827 N/A ARG 282.A NH1 SER 197.A O no hydrogen 3.130 N/A ARG 282.A NH2 GLU 186.A OE1 no hydrogen 2.814 N/A ARG 282.A NH2 GLU 276.A O no hydrogen 2.999 N/A LEU 283.A N ARG 273.A O no hydrogen 3.238 N/A THR 284.A N GLU 287.A OE2 no hydrogen 3.077 N/A GLU 287.A N THR 284.A OG1 no hydrogen 3.267 N/A ALA 288.A N THR 284.A O no hydrogen 2.903 N/A CYS 289.A N PRO 285.A O no hydrogen 2.999 N/A CYS 289.A SG TYR 123.A O no hydrogen 3.814 N/A CYS 289.A SG PRO 285.A O no hydrogen 3.655 N/A ALA 290.A N LEU 286.A O no hydrogen 3.259 N/A HIS 291.A N ALA 288.A O no hydrogen 2.883 N/A PHE 293.A N HIS 291.A ND1 no hydrogen 2.984 N/A PHE 294.A N HIS 291.A O no hydrogen 3.002 N/A ASP 295.A N SER 292.A O no hydrogen 2.889 N/A LEU 297.A N PHE 294.A O no hydrogen 2.984 N/A ARG 298.A N ASP 295.A O no hydrogen 2.725 N/A ARG 298.A NH1 CYS 289.A O no hydrogen 2.987 N/A ARG 298.A NH2 HIS 291.A O no hydrogen 3.022 N/A ARG 298.A NH2 ASP 295.A OD1 no hydrogen 2.911 N/A ASP 299.A N GLU 296.A O no hydrogen 3.194 N/A ASN 301.A N ASP 299.A OD1 no hydrogen 2.515 N/A VAL 302.A N ASP 299.A O no hydrogen 3.241 N/A LEU 304.A N ARG 308.A O no hydrogen 2.951 N/A ASN 306.A ND2 ASP 152.A O no hydrogen 3.031 N/A GLY 307.A N LEU 304.A O no hydrogen 2.932 N/A ARG 308.A N ASN 306.A OD1 no hydrogen 2.903 N/A PHE 316.A N PHE 314.A O no hydrogen 2.761 N/A GLU 320.A N THR 317.A OG1 no hydrogen 3.245 N/A LEU 321.A N THR 317.A O no hydrogen 3.027 N/A SER 322.A N GLN 319.A O no hydrogen 3.280 N/A SER 322.A OG GLN 319.A O no hydrogen 2.699 N/A ASN 324.A N LEU 321.A O no hydrogen 2.833 N/A LEU 327.A N ASN 324.A O no hydrogen 2.963 N/A ALA 328.A N PRO 325.A O no hydrogen 2.901 N/A THR 329.A N PRO 326.A O no hydrogen 3.007 N/A THR 329.A OG1 PRO 326.A O no hydrogen 2.960 N/A ILE 330.A N LEU 327.A O no hydrogen 2.844 N/A LEU 331.A N LEU 327.A O no hydrogen 2.836 N/A ILE 332.A N ALA 328.A O no hydrogen 3.121 N/A ALA 336.A N PRO 333.A O no hydrogen 2.741 N/A ARG 337.A N PRO 334.A O no hydrogen 2.642 N/A ARG 337.A NE ILE 332.A O no hydrogen 2.979 N/A ARG 337.A NH2 ILE 332.A O no hydrogen 3.103 N/A