Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4liu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH ILE 31.A O no hydrogen 2.654 N/A THR 5.A N GLY 26.A O no hydrogen 3.093 N/A THR 5.A OG1 ARG 25.A O no hydrogen 3.100 N/A THR 5.A OG1 GLY 26.A O no hydrogen 3.409 N/A ASP 10.A N ASN 7.A OD1 no hydrogen 3.211 N/A PHE 11.A N ASN 7.A O no hydrogen 3.027 N/A LEU 12.A N TRP 8.A O no hydrogen 2.892 N/A GLU 13.A N PRO 9.A O no hydrogen 2.922 N/A ARG 14.A N ASP 10.A O no hydrogen 2.892 N/A HIS 15.A N PHE 11.A O no hydrogen 2.852 N/A HIS 15.A ND1 ARG 19.A O no hydrogen 2.837 N/A TRP 16.A N PHE 11.A O no hydrogen 2.986 N/A GLN 17.A N TYR 163.A OH no hydrogen 2.721 N/A GLN 17.A NE2 ASP 126.A OD1 no hydrogen 2.472 N/A GLN 17.A NE2 ASP 126.A OD2 no hydrogen 3.227 N/A LYS 18.A N HIS 15.A O no hydrogen 2.784 N/A LYS 18.A NZ LEU 12.A O no hydrogen 2.983 N/A LYS 18.A NZ TRP 16.A O no hydrogen 2.897 N/A ARG 19.A N HIS 15.A O no hydrogen 2.861 N/A VAL 21.A N TYR 163.A O no hydrogen 2.970 N/A LEU 23.A N ILE 161.A O no hydrogen 2.594 N/A LYS 24.A NZ GLU 157.A OE2 no hydrogen 3.475 N/A LYS 24.A NZ ASP 160.A OD2 no hydrogen 2.807 N/A ARG 25.A N ASP 160.A OD1 no hydrogen 2.810 N/A GLY 26.A N LEU 23.A O no hydrogen 3.154 N/A PHE 27.A N GLY 159.A O no hydrogen 3.025 N/A ASN 28.A ND2 ASN 29.A OD1 no hydrogen 3.627 N/A SER 35.A N GLU 38.A OE2 no hydrogen 3.087 N/A GLU 38.A N SER 35.A OG no hydrogen 3.351 N/A LEU 39.A N SER 35.A O no hydrogen 2.957 N/A ALA 40.A N PRO 36.A O no hydrogen 2.912 N/A GLY 41.A N ASP 37.A O no hydrogen 2.901 N/A LEU 42.A N GLU 38.A O no hydrogen 2.911 N/A ALA 43.A N LEU 39.A O no hydrogen 3.171 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.481 N/A VAL 47.A N GLU 44.A O no hydrogen 3.267 N/A ARG 50.A N LEU 80.A O no hydrogen 2.922 N/A LEU 51.A N SER 62.A O no hydrogen 2.854 N/A VAL 52.A N SER 78.A O no hydrogen 2.879 N/A SER 53.A N GLN 60.A O no hydrogen 2.908 N/A HIS 54.A N ASN 76.A O no hydrogen 3.240 N/A HIS 54.A NE2 GLY 115.A O no hydrogen 2.776 N/A GLN 55.A N LYS 58.A O no hydrogen 3.112 N/A GLN 60.A N SER 53.A O no hydrogen 2.889 N/A SER 62.A N LEU 51.A O no hydrogen 2.912 N/A SER 62.A OG GLN 60.A OE1 no hydrogen 3.458 N/A GLY 64.A N SER 49.A O no hydrogen 2.768 N/A PHE 66.A N ALA 43.A O no hydrogen 3.115 N/A TYR 69.A OH ALA 40.A O no hydrogen 3.193 N/A ASN 76.A N PRO 114.A O no hydrogen 2.915 N/A TRP 77.A NE1 GLY 73.A O no hydrogen 2.942 N/A SER 78.A N VAL 52.A O no hydrogen 2.899 N/A SER 78.A OG PHE 111.A O no hydrogen 3.025 N/A LEU 79.A N PHE 111.A O no hydrogen 2.867 N/A LEU 80.A N ARG 50.A O no hydrogen 2.873 N/A VAL 81.A N ILE 109.A O no hydrogen 2.881 N/A GLN 82.A N ASP 48.A O no hydrogen 2.924 N/A VAL 84.A N LEU 108.A O no hydrogen 2.939 N/A ASN 85.A ND2 ASP 107.A OD1 no hydrogen 3.172 N/A HIS 86.A N ALA 83.A O no hydrogen 2.897 N/A HIS 86.A ND1 GLU 257.A O no hydrogen 2.812 N/A HIS 86.A NE2 ASP 107.A OD1 no hydrogen 2.849 N/A TRP 87.A N VAL 84.A O no hydrogen 2.871 N/A HIS 88.A ND1 THR 91.A OG1 no hydrogen 3.108 N/A THR 91.A OG1 HIS 88.A ND1 no hydrogen 3.108 N/A ALA 92.A N HIS 88.A O no hydrogen 3.023 N/A ALA 93.A N GLU 89.A O no hydrogen 2.939 N/A LEU 94.A N THR 91.A O no hydrogen 3.062 N/A ARG 98.A N ARG 95.A O no hydrogen 3.234 N/A ARG 98.A NH1 SER 317.A O no hydrogen 2.806 N/A ARG 98.A NH2 SER 317.A O no hydrogen 3.239 N/A LEU 100.A N PHE 97.A O no hydrogen 3.120 N/A ARG 104.A N PRO 101.A O no hydrogen 3.219 N/A ARG 104.A NE ARG 185.A O no hydrogen 3.342 N/A ARG 104.A NH2 ASP 126.A OD1 no hydrogen 3.554 N/A ARG 104.A NH2 ARG 185.A O no hydrogen 3.433 N/A ILE 105.A N ASP 102.A O no hydrogen 3.245 N/A ASP 106.A N GLY 183.A O no hydrogen 2.862 N/A LEU 108.A N ASN 85.A OD1 no hydrogen 2.948 N/A SER 110.A N ASN 179.A O no hydrogen 2.916 N/A PHE 111.A N LEU 79.A O no hydrogen 2.896 N/A SER 112.A N ALA 178.A O no hydrogen 2.926 N/A GLY 115.A N ALA 174.A O no hydrogen 2.810 N/A GLY 116.A N VAL 113.A O no hydrogen 2.850 N/A HIS 121.A N HIS 170.A O no hydrogen 2.926 N/A VAL 127.A N ILE 164.A O no hydrogen 3.141 N/A PHE 128.A N VAL 182.A O no hydrogen 2.930 N/A ILE 129.A N LEU 162.A O no hydrogen 2.894 N/A ILE 130.A N TYR 180.A O no hydrogen 2.874 N/A GLN 131.A N ASP 160.A O no hydrogen 2.857 N/A GLN 131.A NE2 GLY 132.A O no hydrogen 2.789 N/A THR 133.A N ASP 32.A OD1 no hydrogen 3.005 N/A THR 133.A N ASP 32.A OD2 no hydrogen 3.362 N/A ARG 135.A NH2 GLU 157.A OE1 no hydrogen 3.449 N/A ARG 136.A N LEU 156.A O no hydrogen 3.030 N/A ARG 136.A NH1 ASN 179.A OD1 no hydrogen 3.043 N/A ARG 136.A NH2 GLY 116.A O no hydrogen 3.107 N/A ARG 137.A N TYR 173.A O no hydrogen 2.890 N/A ARG 137.A NE ASP 153.A OD1 no hydrogen 2.953 N/A ARG 137.A NH1 TYR 173.A OH no hydrogen 2.774 N/A ARG 137.A NH2 ASP 153.A OD1 no hydrogen 3.519 N/A ARG 137.A NH2 ASP 153.A OD2 no hydrogen 2.803 N/A TRP 138.A N GLU 154.A O no hydrogen 2.890 N/A TRP 138.A NE1 ASN 179.A OD1 no hydrogen 3.027 N/A ARG 139.A N GLU 171.A O no hydrogen 2.888 N/A ARG 139.A NH2 PHE 148.A O no hydrogen 2.853 N/A VAL 140.A N ILE 152.A O no hydrogen 2.868 N/A GLY 141.A N PRO 169.A O no hydrogen 3.045 N/A ILE 151.A N VAL 140.A O no hydrogen 2.635 N/A ILE 152.A N VAL 140.A O no hydrogen 2.956 N/A GLU 154.A N TRP 138.A O no hydrogen 2.938 N/A LEU 156.A N ARG 136.A O no hydrogen 2.820 N/A GLU 157.A N ASP 160.A OD2 no hydrogen 3.033 N/A GLY 159.A N GLN 131.A O no hydrogen 2.963 N/A ASP 160.A N GLU 157.A O no hydrogen 2.970 N/A ILE 161.A N LEU 23.A O no hydrogen 3.170 N/A LEU 162.A N ILE 129.A O no hydrogen 2.888 N/A TYR 163.A N VAL 21.A O no hydrogen 2.883 N/A TYR 163.A OH ASP 126.A OD2 no hydrogen 2.696 N/A ILE 164.A N VAL 127.A O no hydrogen 3.075 N/A GLY 167.A N ASP 123.A O no hydrogen 2.810 N/A HIS 170.A N HIS 121.A O no hydrogen 2.868 N/A HIS 170.A ND1 PHE 168.A O no hydrogen 2.969 N/A GLU 171.A N ARG 139.A O no hydrogen 2.911 N/A TYR 173.A N ARG 137.A O no hydrogen 2.945 N/A ALA 174.A N GLY 116.A O no hydrogen 3.127 N/A LEU 175.A N ARG 135.A O no hydrogen 3.015 N/A ALA 178.A N SER 112.A O no hydrogen 2.893 N/A ASN 179.A ND2 GLN 131.A OE1 no hydrogen 2.853 N/A TYR 180.A N ILE 130.A O no hydrogen 2.887 N/A TYR 180.A OH ASP 32.A OD2 no hydrogen 2.406 N/A TYR 180.A OH ILE 34.A O no hydrogen 3.381 N/A VAL 182.A N PHE 128.A O no hydrogen 2.873 N/A GLY 183.A N ASP 107.A O no hydrogen 3.228 N/A PHE 184.A N ASP 126.A O no hydrogen 3.027 N/A ARG 185.A N ARG 104.A O no hydrogen 2.691 N/A ARG 185.A NH1 GLN 253.A O no hydrogen 3.294 N/A ARG 185.A NH2 GLN 253.A O no hydrogen 3.146 N/A GLU 191.A N ASN 188.A OD1 no hydrogen 2.994 N/A LEU 192.A N ASN 188.A O no hydrogen 3.337 N/A ILE 193.A N THR 189.A O no hydrogen 2.902 N/A SER 194.A N ARG 190.A O no hydrogen 2.924 N/A SER 194.A OG ARG 190.A O no hydrogen 3.201 N/A GLY 195.A N GLU 191.A O no hydrogen 2.912 N/A PHE 196.A N LEU 192.A O no hydrogen 2.897 N/A ALA 197.A N ILE 193.A O no hydrogen 2.936 N/A ASP 198.A N SER 194.A O no hydrogen 2.911 N/A TYR 199.A N GLY 195.A O no hydrogen 2.909 N/A VAL 200.A N PHE 196.A O no hydrogen 2.900 N/A LEU 201.A N ALA 197.A O no hydrogen 2.915 N/A GLN 202.A N ASP 198.A O no hydrogen 2.907 N/A ARG 203.A N TYR 199.A O no hydrogen 3.144 N/A GLU 204.A N LEU 201.A O no hydrogen 3.258 N/A LEU 205.A N VAL 200.A O no hydrogen 2.858 N/A ASN 208.A N ASN 208.A OD1 no hydrogen 2.602 N/A ARG 218.A NH1 ASP 223.A O no hydrogen 2.908 N/A ARG 218.A NH1 GLU 228.A OE1 no hydrogen 2.969 N/A ARG 218.A NH2 PRO 216.A O no hydrogen 2.972 N/A ARG 218.A NH2 GLU 228.A OE2 no hydrogen 2.880 N/A ASP 223.A N HIS 220.A O no hydrogen 2.971 N/A LEU 225.A N GLU 228.A OE1 no hydrogen 3.042 N/A GLU 228.A N LEU 225.A O no hydrogen 3.137 N/A LYS 230.A N GLN 227.A O no hydrogen 2.913 N/A LYS 230.A NZ SER 211.A O no hydrogen 3.237 N/A LEU 231.A N GLU 228.A O no hydrogen 2.945 N/A ARG 232.A NH2 ASP 229.A OD1 no hydrogen 2.722 N/A GLU 233.A N ASP 229.A O no hydrogen 2.890 N/A GLU 235.A N GLU 233.A O no hydrogen 2.902 N/A ASN 238.A N LEU 234.A O no hydrogen 2.934 N/A GLN 239.A N LEU 236.A O no hydrogen 3.312 N/A GLN 239.A NE2 GLU 235.A OE2 no hydrogen 2.998 N/A GLN 245.A N GLU 241.A O no hydrogen 2.902 N/A TRP 246.A N HIS 242.A O no hydrogen 2.910 N/A PHE 247.A N PHE 243.A O no hydrogen 2.914 N/A GLY 248.A N LYS 244.A O no hydrogen 2.901 N/A GLU 249.A N GLN 245.A O no hydrogen 2.926 N/A PHE 250.A N PHE 247.A O no hydrogen 3.076 N/A ILE 251.A N PHE 247.A O no hydrogen 2.895 N/A SER 252.A OG GLY 248.A O no hydrogen 2.739 N/A GLN 253.A NE2 GLU 249.A O no hydrogen 2.715 N/A SER 254.A OG HIS 256.A O no hydrogen 3.458 N/A ARG 255.A NH1.A TYR 125.A OH no hydrogen 3.270 N/A TYR 267.A N ASN 343.A OD1 no hydrogen 2.653 N/A GLU 271.A N GLN 268.A O no hydrogen 2.846 N/A ILE 272.A N GLN 268.A O no hydrogen 3.258 N/A TYR 273.A N PRO 269.A O no hydrogen 2.910 N/A TYR 273.A OH GLU 331.A OE2 no hydrogen 2.897 N/A ASP 274.A N ASP 270.A O no hydrogen 2.898 N/A ALA 275.A N GLU 271.A O no hydrogen 2.908 N/A LEU 276.A N ILE 272.A O no hydrogen 2.927 N/A LYS 277.A N TYR 273.A O no hydrogen 2.905 N/A GLN 278.A N ASP 274.A O no hydrogen 2.927 N/A GLY 279.A N LEU 276.A O no hydrogen 3.127 N/A GLU 280.A N ALA 275.A O no hydrogen 3.072 N/A VAL 281.A N GLU 350.A OE2 no hydrogen 2.802 N/A LEU 282.A N LEU 321.A O no hydrogen 2.714 N/A VAL 283.A N PHE 348.A O no hydrogen 2.865 N/A ARG 284.A N ILE 319.A O no hydrogen 2.757 N/A ARG 284.A NH1 LEU 288.A O no hydrogen 3.566 N/A ARG 284.A NH2 LEU 315.A O no hydrogen 3.092 N/A ARG 284.A NH2 ALA 316.A O no hydrogen 2.775 N/A LEU 285.A N TYR 346.A O no hydrogen 2.881 N/A LEU 288.A N LEU 285.A O no hydrogen 3.151 N/A ARG 289.A NE ILE 251.A O no hydrogen 2.940 N/A ARG 289.A NH1 ILE 105.A O no hydrogen 2.721 N/A ARG 289.A NH2 TRP 103.A O no hydrogen 2.999 N/A ARG 289.A NH2 ILE 251.A O no hydrogen 2.957 N/A LEU 291.A N TYR 298.A O no hydrogen 2.923 N/A ILE 293.A N ASP 296.A O no hydrogen 3.109 N/A ASP 296.A N ILE 293.A O no hydrogen 3.284 N/A VAL 297.A N ILE 304.A O no hydrogen 3.005 N/A TYR 298.A N LEU 291.A O no hydrogen 2.867 N/A ALA 299.A N GLU 302.A O no hydrogen 3.122 N/A ASN 300.A N ARG 289.A O no hydrogen 3.185 N/A ASN 300.A ND2 TYR 346.A OH no hydrogen 3.215 N/A GLY 301.A N SER 252.A OG no hydrogen 2.934 N/A GLU 302.A N ALA 299.A O no hydrogen 3.069 N/A LYS 303.A NZ ASP 305.A OD2 no hydrogen 3.446 N/A ILE 304.A N VAL 297.A O no hydrogen 2.787 N/A HIS 308.A NE2 ASP 332.A OD2 no hydrogen 2.860 N/A LEU 312.A N HIS 308.A O no hydrogen 3.207 N/A ASP 313.A N ARG 309.A O no hydrogen 2.902 N/A ALA 314.A N PRO 310.A O no hydrogen 2.901 N/A LEU 315.A N ALA 311.A O no hydrogen 2.904 N/A ALA 316.A N LEU 312.A O no hydrogen 2.907 N/A SER 317.A N ASP 313.A O no hydrogen 2.910 N/A SER 317.A OG ASP 313.A O no hydrogen 3.112 N/A SER 317.A OG ASN 318.A OD1 no hydrogen 2.844 N/A ASN 318.A N ALA 314.A O no hydrogen 2.856 N/A LEU 321.A N LEU 282.A O no hydrogen 2.559 N/A THR 322.A N ASN 325.A OD1 no hydrogen 2.918 N/A THR 322.A OG1 GLU 324.A OE1 no hydrogen 3.064 N/A THR 322.A OG1 ASN 325.A OD1 no hydrogen 3.331 N/A ASN 325.A N THR 322.A O no hydrogen 3.066 N/A GLY 327.A N ALA 323.A O no hydrogen 2.932 N/A ALA 329.A N PHE 326.A O no hydrogen 3.412 N/A GLU 331.A N ASP 328.A O no hydrogen 3.425 N/A ASP 332.A N ALA 329.A O no hydrogen 3.161 N/A SER 334.A N ASP 332.A OD1 no hydrogen 2.905 N/A LEU 336.A N ASP 332.A O no hydrogen 2.982 N/A ALA 337.A N PRO 333.A O no hydrogen 2.889 N/A ALA 339.A N LEU 336.A O no hydrogen 2.902 N/A ALA 340.A N ALA 337.A O no hydrogen 2.907 N/A VAL 342.A N LEU 338.A O no hydrogen 2.896 N/A ASN 343.A N ALA 339.A O no hydrogen 2.888 N/A ASN 343.A ND2 TYR 267.A O no hydrogen 3.210 N/A SER 344.A N ALA 340.A O no hydrogen 2.912 N/A SER 344.A OG ALA 340.A O no hydrogen 3.018 N/A GLY 345.A N VAL 342.A O no hydrogen 2.868 N/A TYR 346.A N LEU 341.A O no hydrogen 3.057 N/A PHE 348.A N VAL 283.A O no hydrogen 2.921 N/A GLU 350.A N VAL 281.A O no hydrogen 2.859 N/A GLY 351.A N PHE 349.A O no hydrogen 2.552 N/A