Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3iw8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 PRO 87.A O no hydrogen 2.869 N/A TYR 6.A N VAL 17.A O no hydrogen 2.839 N/A TYR 6.A OH TYR 21.A O no hydrogen 2.676 N/A GLN 8.A N TRP 15.A O no hydrogen 2.934 N/A LEU 10.A N THR 13.A O no hydrogen 2.817 N/A THR 13.A N LEU 10.A O no hydrogen 2.992 N/A THR 13.A OG1 LEU 10.A O no hydrogen 3.304 N/A TRP 15.A N GLN 8.A O no hydrogen 2.761 N/A GLU 16.A N TYR 98.A OH no hydrogen 3.178 N/A VAL 17.A N TYR 6.A O no hydrogen 3.081 N/A GLU 19.A N THR 4.A O no hydrogen 2.997 N/A ARG 20.A NE ASP 38.A OD1 no hydrogen 2.958 N/A ARG 20.A NH2 ASP 38.A OD2 no hydrogen 2.718 N/A TYR 21.A N PRO 18.A O no hydrogen 3.031 N/A TYR 21.A OH ASP 83.A OD1 no hydrogen 2.738 N/A GLN 22.A N PHE 37.A O no hydrogen 2.825 N/A GLN 22.A NE2 GLU 19.A O no hydrogen 2.596 N/A SER 25.A N ALA 35.A O no hydrogen 2.929 N/A VAL 27.A N VAL 33.A O no hydrogen 2.762 N/A SER 29.A OG ASN 11.A OD1 no hydrogen 3.003 N/A VAL 33.A N GLY 28.A O no hydrogen 2.904 N/A CYS 34.A N VAL 47.A O no hydrogen 3.017 N/A ALA 35.A N SER 25.A O no hydrogen 2.812 N/A ALA 36.A N VAL 45.A O no hydrogen 2.695 N/A PHE 37.A N GLN 22.A O no hydrogen 2.836 N/A ASP 38.A N LEU 43.A O no hydrogen 2.795 N/A THR 39.A N ARG 20.A O no hydrogen 2.911 N/A THR 39.A OG1 ARG 20.A O no hydrogen 3.188 N/A LYS 40.A N ASP 38.A OD1 no hydrogen 3.132 N/A THR 41.A N ASP 38.A O no hydrogen 3.328 N/A THR 41.A OG1 ASP 38.A OD2 no hydrogen 2.798 N/A GLY 42.A N ASP 38.A O no hydrogen 2.757 N/A LEU 43.A N THR 41.A OG1 no hydrogen 3.290 N/A VAL 45.A N ALA 36.A O no hydrogen 2.839 N/A ALA 46.A N THR 101.A O no hydrogen 2.901 N/A VAL 47.A N CYS 34.A O no hydrogen 2.876 N/A LYS 48.A N LEU 99.A O no hydrogen 2.792 N/A LYS 48.A NZ GLU 66.A OE1 no hydrogen 3.184 N/A LYS 49.A N SER 32.A O no hydrogen 2.953 N/A LYS 49.A NZ THR 13.A OG1 no hydrogen 3.420 N/A LEU 50.A N VAL 97.A O no hydrogen 2.897 N/A SER 51.A N TYR 30.A O no hydrogen 3.254 N/A GLN 55.A N ARG 52.A O no hydrogen 3.425 N/A HIS 59.A N SER 56.A OG no hydrogen 3.233 N/A HIS 59.A ND1 ARG 52.A O no hydrogen 2.534 N/A ALA 60.A N SER 56.A O no hydrogen 2.837 N/A LYS 61.A N ILE 57.A O no hydrogen 2.842 N/A LYS 61.A NZ ARG 312.A O no hydrogen 3.165 N/A ARG 62.A N ILE 58.A O no hydrogen 2.960 N/A THR 63.A N HIS 59.A O no hydrogen 2.921 N/A THR 63.A OG1 PRO 53.A O no hydrogen 3.167 N/A THR 63.A OG1 HIS 59.A O no hydrogen 2.915 N/A TYR 64.A N ALA 60.A O no hydrogen 3.167 N/A ARG 65.A N LYS 61.A O no hydrogen 3.019 N/A GLU 66.A N ARG 62.A O no hydrogen 2.917 N/A LEU 67.A N THR 63.A O no hydrogen 2.918 N/A ARG 68.A N TYR 64.A O no hydrogen 2.932 N/A ARG 68.A NH1 ASP 306.A O no hydrogen 3.039 N/A LEU 69.A N ARG 65.A O no hydrogen 2.923 N/A LEU 70.A N GLU 66.A O no hydrogen 3.029 N/A LYS 71.A N LEU 67.A O no hydrogen 2.930 N/A LYS 71.A NZ GLU 326.A O no hydrogen 2.892 N/A LYS 71.A NZ GLU 326.A OE1 no hydrogen 2.852 N/A HIS 72.A N ARG 68.A O no hydrogen 3.078 N/A HIS 72.A N LEU 69.A O no hydrogen 3.156 N/A HIS 72.A NE2 ASP 303.A O no hydrogen 2.755 N/A MET 73.A N LEU 69.A O no hydrogen 3.141 N/A LYS 74.A N TYR 135.A OH no hydrogen 2.820 N/A ASN 77.A N HIS 75.A ND1 no hydrogen 2.832 N/A ASN 77.A ND2 LEU 159.A O no hydrogen 3.075 N/A VAL 78.A N HIS 75.A O no hydrogen 3.239 N/A ILE 79.A N ILE 161.A O no hydrogen 2.806 N/A LEU 82.A N VAL 100.A O no hydrogen 2.719 N/A ASP 83.A N VAL 100.A O no hydrogen 3.349 N/A PHE 85.A N TYR 98.A O no hydrogen 2.946 N/A THR 86.A OG1 ASP 96.A O no hydrogen 3.003 N/A ALA 88.A N THR 86.A OG1 no hydrogen 3.239 N/A GLU 93.A N SER 90.A OG no hydrogen 3.102 N/A PHE 94.A N LEU 91.A O no hydrogen 3.240 N/A ASN 95.A ND2 GLU 93.A O no hydrogen 3.619 N/A TYR 98.A N PHE 85.A O no hydrogen 3.018 N/A LEU 99.A N LYS 48.A O no hydrogen 2.824 N/A VAL 100.A N ASP 83.A O no hydrogen 2.887 N/A THR 101.A N ALA 46.A O no hydrogen 2.987 N/A THR 101.A OG1 GLY 80.A O no hydrogen 2.661 N/A LEU 103.A N ARG 44.A O no hydrogen 2.990 N/A ASP 107.A N ASN 110.A OD1 no hydrogen 2.921 N/A LEU 108.A N PRO 148.A O no hydrogen 3.365 N/A LEU 108.A N LEU 151.A O no hydrogen 2.925 N/A ASN 110.A N ASP 107.A O no hydrogen 2.945 N/A ASN 110.A N ASP 107.A OD2 no hydrogen 2.913 N/A ILE 111.A N ASP 107.A O no hydrogen 3.217 N/A VAL 112.A N LEU 108.A O no hydrogen 2.922 N/A LYS 113.A N ASN 109.A O no hydrogen 3.000 N/A GLN 115.A N VAL 112.A O no hydrogen 3.210 N/A GLN 115.A NE2 LYS 113.A O no hydrogen 3.439 N/A LEU 117.A N LEU 198.A O no hydrogen 2.913 N/A HIS 121.A N THR 118.A OG1 no hydrogen 3.252 N/A HIS 121.A NE2 SER 157.A OG no hydrogen 2.761 N/A VAL 122.A N THR 118.A O no hydrogen 2.955 N/A GLN 123.A N ASP 119.A O no hydrogen 2.953 N/A PHE 124.A N ASP 120.A O no hydrogen 3.281 N/A LEU 125.A N HIS 121.A O no hydrogen 3.024 N/A ILE 126.A N VAL 122.A O no hydrogen 2.979 N/A TYR 127.A N GLN 123.A O no hydrogen 2.888 N/A TYR 127.A OH GLU 299.A OE1 no hydrogen 2.613 N/A GLN 128.A N PHE 124.A O no hydrogen 3.266 N/A GLN 128.A NE2 PHE 124.A O no hydrogen 3.260 N/A GLN 128.A NE2 SER 157.A O no hydrogen 2.856 N/A ILE 129.A N LEU 125.A O no hydrogen 3.114 N/A LEU 130.A N ILE 126.A O no hydrogen 2.917 N/A ARG 131.A N TYR 127.A O no hydrogen 2.841 N/A ARG 131.A NE ASP 298.A O no hydrogen 2.850 N/A ARG 131.A NH1 GLU 76.A OE1 no hydrogen 3.557 N/A ARG 131.A NH1 ASN 77.A OD1 no hydrogen 2.807 N/A ARG 131.A NH2 GLU 76.A OE1 no hydrogen 3.527 N/A ARG 131.A NH2 ASP 298.A O no hydrogen 3.016 N/A ARG 131.A NH2 ASP 298.A OD2 no hydrogen 3.237 N/A GLY 132.A N GLN 128.A O no hydrogen 3.007 N/A LEU 133.A N ILE 129.A O no hydrogen 2.870 N/A LYS 134.A N LEU 130.A O no hydrogen 2.845 N/A LYS 134.A NZ GLU 299.A O no hydrogen 2.629 N/A TYR 135.A N ARG 131.A O no hydrogen 3.418 N/A TYR 135.A OH HIS 72.A O no hydrogen 3.222 N/A ILE 136.A N GLY 132.A O no hydrogen 2.906 N/A HIS 137.A N LEU 133.A O no hydrogen 2.774 N/A HIS 137.A NE2 ASP 187.A OD1 no hydrogen 2.723 N/A SER 138.A N LYS 134.A O no hydrogen 2.975 N/A SER 138.A OG LYS 134.A O no hydrogen 3.490 N/A SER 138.A OG TYR 135.A O no hydrogen 2.692 N/A ALA 139.A N TYR 135.A O no hydrogen 3.310 N/A ALA 139.A N ILE 136.A O no hydrogen 3.106 N/A ASP 140.A N HIS 137.A O no hydrogen 2.849 N/A ILE 141.A N ILE 136.A O no hydrogen 3.393 N/A HIS 143.A N ASP 187.A OD1 no hydrogen 2.867 N/A ARG 144.A N ASP 187.A OD2 no hydrogen 2.826 N/A LYS 147.A NZ ASP 145.A OD1 no hydrogen 3.375 N/A ASN 150.A N LYS 147.A O no hydrogen 2.906 N/A LEU 151.A N PRO 148.A O no hydrogen 3.130 N/A ALA 152.A N LYS 160.A O no hydrogen 2.846 N/A VAL 153.A N ALA 106.A O no hydrogen 2.997 N/A ASN 154.A N GLU 158.A O no hydrogen 3.027 N/A ASN 154.A ND2 GLU 158.A OE2 no hydrogen 3.150 N/A SER 157.A N ASN 154.A O no hydrogen 2.580 N/A SER 157.A OG HIS 121.A NE2 no hydrogen 2.761 N/A GLU 158.A N ASN 154.A OD1 no hydrogen 3.031 N/A LEU 159.A N GLN 128.A OE1 no hydrogen 2.947 N/A LYS 160.A N ALA 152.A O no hydrogen 2.864 N/A LYS 160.A NZ GLU 76.A O no hydrogen 2.717 N/A ILE 161.A N ASN 77.A O no hydrogen 2.865 N/A LEU 162.A N ASN 150.A O no hydrogen 2.914 N/A GLY 165.A N ASP 163.A OD2 no hydrogen 3.279 N/A TRP 169.A N ALA 166.A O no hydrogen 3.313 N/A TRP 169.A NE1 GLY 207.A O no hydrogen 2.860 N/A TYR 170.A OH GLU 197.A OE1 no hydrogen 2.537 N/A ARG 171.A N ARG 168.A O no hydrogen 3.388 N/A GLU 174.A N GLU 174.A OE2 no hydrogen 2.818 N/A ILE 175.A N ALA 172.A O no hydrogen 3.004 N/A MET 176.A N ALA 172.A O no hydrogen 3.221 N/A LEU 177.A N GLU 174.A O no hydrogen 3.299 N/A ASN 178.A N ILE 175.A O no hydrogen 3.063 N/A TRP 179.A N GLU 174.A O no hydrogen 3.020 N/A ASN 183.A ND2 THR 185.A OG1 no hydrogen 2.985 N/A GLN 184.A NE2 HIS 137.A O no hydrogen 2.822 N/A THR 185.A OG1 ASN 183.A OD1 no hydrogen 3.083 N/A THR 185.A OG1 SER 275.A O no hydrogen 2.834 N/A VAL 186.A N ASN 183.A O no hydrogen 3.073 N/A ASP 187.A N GLN 184.A O no hydrogen 2.914 N/A TRP 189.A N THR 185.A O no hydrogen 3.024 N/A SER 190.A N VAL 186.A O no hydrogen 3.377 N/A SER 190.A OG TYR 170.A O no hydrogen 2.626 N/A SER 190.A OG VAL 186.A O no hydrogen 3.327 N/A VAL 191.A N ASP 187.A O no hydrogen 3.021 N/A GLY 192.A N ILE 188.A O no hydrogen 3.013 N/A CYS 193.A N TRP 189.A O no hydrogen 3.052 N/A CYS 193.A SG TRP 189.A O no hydrogen 3.453 N/A ILE 194.A N SER 190.A O no hydrogen 2.926 N/A MET 195.A N VAL 191.A O no hydrogen 2.744 N/A ALA 196.A N GLY 192.A O no hydrogen 2.844 N/A GLU 197.A N CYS 193.A O no hydrogen 3.314 N/A LEU 198.A N ILE 194.A O no hydrogen 3.040 N/A LEU 199.A N MET 195.A O no hydrogen 3.232 N/A THR 200.A N ALA 196.A O no hydrogen 3.063 N/A THR 200.A OG1 ALA 196.A O no hydrogen 3.067 N/A GLY 201.A N GLU 197.A O no hydrogen 2.825 N/A ARG 202.A N THR 200.A OG1 no hydrogen 3.049 N/A GLY 207.A N PHE 205.A O no hydrogen 2.876 N/A THR 208.A N ASP 212.A OD1 no hydrogen 3.072 N/A HIS 210.A NE2 MET 176.A O no hydrogen 2.664 N/A ASP 212.A N ASP 209.A OD2 no hydrogen 2.913 N/A GLN 213.A N ASP 209.A O no hydrogen 3.082 N/A GLN 213.A NE2 TRP 169.A O no hydrogen 3.513 N/A GLN 213.A NE2 PHE 205.A O no hydrogen 2.982 N/A LYS 215.A N ILE 211.A O no hydrogen 3.064 N/A LEU 216.A N ASP 212.A O no hydrogen 2.910 N/A ILE 217.A N GLN 213.A O no hydrogen 3.097 N/A LEU 218.A N LEU 214.A O no hydrogen 2.962 N/A ARG 219.A N LYS 215.A O no hydrogen 3.111 N/A LEU 220.A N LEU 216.A O no hydrogen 3.354 N/A LEU 220.A N ILE 217.A O no hydrogen 2.922 N/A VAL 221.A N ILE 217.A O no hydrogen 2.912 N/A GLY 222.A N LEU 218.A O no hydrogen 2.817 N/A THR 223.A N MET 247.A O no hydrogen 3.285 N/A LEU 229.A N GLY 225.A O no hydrogen 2.896 N/A LYS 230.A N ALA 226.A O no hydrogen 2.959 N/A LYS 231.A N LEU 228.A O no hydrogen 2.879 N/A LYS 231.A NZ ASP 274.A OD1 no hydrogen 3.198 N/A LYS 231.A NZ ASP 274.A OD2 no hydrogen 2.701 N/A LYS 231.A NZ ASP 276.A OD1 no hydrogen 2.998 N/A ILE 232.A N LEU 229.A O no hydrogen 3.160 N/A SER 236.A OG SER 234.A OG no hydrogen 3.138 N/A ALA 237.A N SER 234.A OG no hydrogen 3.280 N/A ARG 238.A N SER 234.A O no hydrogen 3.008 N/A ASN 239.A N GLU 235.A O no hydrogen 2.994 N/A TYR 240.A N SER 236.A O no hydrogen 2.928 N/A ILE 241.A N ALA 237.A O no hydrogen 2.942 N/A GLN 242.A N ARG 238.A O no hydrogen 2.919 N/A SER 243.A N TYR 240.A O no hydrogen 3.261 N/A SER 243.A OG ASN 239.A O no hydrogen 3.026 N/A LEU 244.A N ILE 241.A O no hydrogen 3.282 N/A LYS 249.A NZ MET 250.A O no hydrogen 3.524 N/A MET 250.A N LEU 220.A O no hydrogen 3.017 N/A ALA 253.A N ASN 251.A OD1 no hydrogen 3.262 N/A ASN 254.A N ASN 251.A O no hydrogen 2.817 N/A VAL 255.A N PHE 252.A O no hydrogen 3.111 N/A PHE 256.A N PHE 252.A O no hydrogen 2.826 N/A ALA 259.A N PHE 256.A O no hydrogen 3.215 N/A ASN 260.A ND2 ASP 119.A OD2 no hydrogen 2.968 N/A LEU 262.A N ASN 260.A OD1 no hydrogen 2.923 N/A VAL 264.A N ASN 260.A O no hydrogen 3.109 N/A ASP 265.A N PRO 261.A O no hydrogen 2.909 N/A LEU 266.A N LEU 262.A O no hydrogen 2.999 N/A LEU 267.A N ALA 263.A O no hydrogen 2.981 N/A GLU 268.A N VAL 264.A O no hydrogen 2.965 N/A LYS 269.A N ASP 265.A O no hydrogen 3.220 N/A LYS 269.A NZ ASP 265.A OD2 no hydrogen 2.733 N/A MET 270.A N LEU 266.A O no hydrogen 2.932 N/A MET 270.A N LEU 267.A O no hydrogen 3.201 N/A LEU 271.A N LEU 267.A O no hydrogen 2.955 N/A SER 275.A OG ASN 183.A OD1 no hydrogen 2.770 N/A ASP 276.A N ASP 274.A OD1 no hydrogen 3.114 N/A LYS 277.A N ASP 274.A O no hydrogen 2.845 N/A LYS 277.A NZ GLU 227.A OE2 no hydrogen 3.226 N/A ARG 278.A N SER 275.A O no hydrogen 3.299 N/A ARG 278.A NE VAL 272.A O no hydrogen 2.752 N/A ARG 278.A NH1 GLU 174.A OE1 no hydrogen 2.804 N/A ARG 278.A NH1 THR 185.A O no hydrogen 3.185 N/A ARG 278.A NH2 GLU 174.A OE2 no hydrogen 2.881 N/A ARG 278.A NH2 VAL 272.A O no hydrogen 3.478 N/A ARG 278.A NH2 LEU 273.A O no hydrogen 2.854 N/A ILE 279.A N LYS 269.A O no hydrogen 2.922 N/A THR 280.A N GLN 283.A OE1 no hydrogen 3.102 N/A GLN 283.A N THR 280.A OG1 no hydrogen 3.176 N/A ALA 284.A N THR 280.A O no hydrogen 2.955 N/A LEU 285.A N ALA 281.A O no hydrogen 3.050 N/A ALA 286.A N GLN 283.A O no hydrogen 3.147 N/A HIS 287.A N ALA 284.A O no hydrogen 2.953 N/A HIS 287.A NE2 ASP 265.A OD2 no hydrogen 2.860 N/A TYR 289.A N HIS 287.A ND1 no hydrogen 2.993 N/A TYR 289.A OH ASP 119.A OD1 no hydrogen 2.532 N/A PHE 290.A N HIS 287.A O no hydrogen 3.056 N/A ALA 291.A N ALA 288.A O no hydrogen 3.070 N/A GLN 292.A NE2 ASP 120.A OD2 no hydrogen 3.272 N/A TYR 293.A N PHE 290.A O no hydrogen 2.837 N/A HIS 294.A N PHE 290.A O no hydrogen 2.795 N/A HIS 294.A ND1 GLU 299.A OE1 no hydrogen 2.756 N/A ASP 295.A N GLU 299.A OE1 no hydrogen 3.098 N/A ASP 297.A N ASP 295.A OD1 no hydrogen 2.906 N/A ASP 298.A N ASP 295.A O no hydrogen 2.875 N/A ALA 302.A N SER 138.A OG no hydrogen 2.756 N/A TYR 305.A OH GLU 310.A OE2 no hydrogen 2.608 N/A GLN 307.A NE2 ASP 140.A O no hydrogen 2.964 N/A GLN 307.A NE2 TYR 305.A O no hydrogen 3.122 N/A SER 308.A N ASP 306.A OD1 no hydrogen 2.808 N/A SER 308.A OG ASP 306.A OD1 no hydrogen 2.661 N/A SER 308.A OG ASP 306.A OD2 no hydrogen 3.543 N/A SER 311.A N SER 308.A O no hydrogen 3.292 N/A SER 311.A OG GLN 307.A O no hydrogen 2.712 N/A ARG 312.A NE LEU 309.A O no hydrogen 2.743 N/A ARG 312.A NH2 LEU 309.A O no hydrogen 3.284 N/A LEU 315.A N GLU 318.A OE1 no hydrogen 2.957 N/A TRP 319.A N LEU 315.A O no hydrogen 2.995 N/A LYS 320.A N ILE 316.A O no hydrogen 2.848 N/A LYS 320.A NZ ASN 95.A OD1 no hydrogen 3.319 N/A SER 321.A N ASP 317.A O no hydrogen 3.085 N/A LEU 322.A N GLU 318.A O no hydrogen 3.019 N/A THR 323.A N TRP 319.A O no hydrogen 2.837 N/A THR 323.A OG1 TRP 319.A O no hydrogen 2.748 N/A TYR 324.A N LYS 320.A O no hydrogen 2.844 N/A ASP 325.A N SER 321.A O no hydrogen 3.065 N/A GLU 326.A N LEU 322.A O no hydrogen 3.165 N/A VAL 327.A N THR 323.A O no hydrogen 2.973 N/A ILE 328.A N TYR 324.A O no hydrogen 2.965 N/A SER 329.A N ASP 325.A O no hydrogen 2.931 N/A SER 329.A OG ASP 325.A O no hydrogen 3.171 N/A SER 329.A OG GLU 326.A O no hydrogen 3.286 N/A PHE 330.A N VAL 327.A O no hydrogen 3.219 N/A