Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yu9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N SER 1.A OG no hydrogen 3.234 N/A GLU 5.A N ALA 2.A O no hydrogen 2.922 N/A GLU 6.A N TRP 3.A O no hydrogen 2.857 N/A ASN 8.A N GLU 5.A O no hydrogen 2.949 N/A TYR 9.A N GLU 6.A O no hydrogen 3.020 N/A HIS 10.A N LYS 7.A O no hydrogen 3.424 N/A GLN 11.A NE2 TYR 9.A O no hydrogen 3.000 N/A ALA 13.A N GLU 322.A O no hydrogen 2.963 N/A LEU 15.A N GLU 322.A OE2 no hydrogen 2.762 N/A SER 18.A OG ASN 16.A OD1 no hydrogen 3.142 N/A ALA 19.A N ASN 16.A OD1 no hydrogen 2.869 N/A LEU 20.A N ASN 16.A O no hydrogen 2.945 N/A ARG 21.A N SER 17.A O no hydrogen 2.930 N/A GLN 22.A N SER 18.A O no hydrogen 2.915 N/A ILE 23.A N ALA 19.A O no hydrogen 2.913 N/A ALA 24.A N LEU 20.A O no hydrogen 2.955 N/A GLU 25.A N ARG 21.A O no hydrogen 3.115 N/A GLU 25.A N GLN 22.A O no hydrogen 3.216 N/A GLY 26.A N GLN 22.A O no hydrogen 3.020 N/A GLY 26.A N ILE 23.A O no hydrogen 2.983 N/A THR 27.A OG1 GLU 135.A OE2 no hydrogen 2.649 N/A SER 28.A N GLU 135.A OE2 no hydrogen 2.787 N/A SER 28.A OG GLU 31.A OE2 no hydrogen 3.272 N/A GLU 31.A N SER 28.A OG no hydrogen 3.137 N/A MET 32.A N SER 28.A O no hydrogen 3.041 N/A TRP 33.A N ILE 29.A O no hydrogen 2.886 N/A TRP 33.A NE1 GLU 301.A OE2 no hydrogen 2.904 N/A GLN 34.A N SER 30.A O no hydrogen 3.051 N/A GLN 34.A NE2 ASN 35.A OD1 no hydrogen 2.730 N/A ASN 35.A N GLU 31.A O no hydrogen 2.890 N/A ASP 36.A N MET 32.A O no hydrogen 2.760 N/A LEU 37.A N MET 32.A O no hydrogen 2.849 N/A GLN 38.A N TRP 33.A O no hydrogen 2.921 N/A GLN 38.A NE2 GLU 301.A OE2 no hydrogen 3.069 N/A LEU 40.A N LEU 37.A O no hydrogen 2.864 N/A LEU 41.A N GLN 38.A O no hydrogen 2.988 N/A ARG 44.A N SER 110.A OG no hydrogen 2.836 N/A ARG 44.A NE TYR 108.A O no hydrogen 2.817 N/A ARG 44.A NH1 ILE 42.A O no hydrogen 2.791 N/A ARG 44.A NH1 VAL 121.A O no hydrogen 2.723 N/A ARG 44.A NH2 VAL 121.A O no hydrogen 3.381 N/A ARG 44.A NH2 GLY 122.A O no hydrogen 3.344 N/A SER 48.A N TYR 45.A O no hydrogen 3.158 N/A SER 48.A OG TYR 45.A O no hydrogen 2.824 N/A SER 51.A N SER 48.A OG no hydrogen 2.963 N/A TYR 52.A N SER 48.A O no hydrogen 3.432 N/A ALA 53.A N PRO 49.A O no hydrogen 2.977 N/A ALA 54.A N GLY 50.A O no hydrogen 2.750 N/A ARG 55.A N SER 51.A O no hydrogen 3.172 N/A ARG 55.A NH1 SER 51.A OG no hydrogen 2.881 N/A ARG 55.A NH1 TYR 108.A OH no hydrogen 2.756 N/A GLN 56.A N TYR 52.A O no hydrogen 2.903 N/A HIS 57.A N ALA 53.A O no hydrogen 2.827 N/A HIS 57.A NE2 ASP 36.A O no hydrogen 2.872 N/A ILE 58.A N ALA 54.A O no hydrogen 2.687 N/A MET 59.A N ARG 55.A O no hydrogen 2.927 N/A GLN 60.A N GLN 56.A O no hydrogen 2.917 N/A ARG 61.A N HIS 57.A O no hydrogen 3.067 N/A ARG 61.A NE ASP 36.A OD1 no hydrogen 2.791 N/A ARG 61.A NH2 ASP 36.A OD1 no hydrogen 3.051 N/A ILE 62.A N ILE 58.A O no hydrogen 3.175 N/A GLN 63.A N MET 59.A O no hydrogen 2.952 N/A ARG 64.A N GLN 60.A O no hydrogen 3.144 N/A LEU 65.A N ILE 62.A O no hydrogen 3.089 N/A GLN 66.A N ASP 141.A OD2 no hydrogen 2.811 N/A ALA 67.A N ASP 141.A OD1 no hydrogen 2.900 N/A TRP 69.A N ALA 67.A O no hydrogen 2.835 N/A VAL 70.A N THR 93.A O no hydrogen 2.840 N/A GLU 72.A N ILE 91.A O no hydrogen 3.025 N/A ASP 74.A N ASN 89.A O no hydrogen 2.900 N/A THR 75.A OG1 SER 88.A OG.A no hydrogen 2.691 N/A PHE 76.A N PHE 87.A O no hydrogen 2.919 N/A SER 78.A N ARG 85.A O no hydrogen 2.910 N/A SER 78.A OG GLN 79.A O no hydrogen 2.791 N/A THR 80.A N GLN 79.A OE1 no hydrogen 2.953 N/A THR 80.A OG1 GLY 83.A O no hydrogen 2.661 N/A GLU 82.A N THR 80.A OG1 no hydrogen 2.930 N/A GLY 83.A N THR 80.A O no hydrogen 2.978 N/A ARG 85.A N SER 78.A O no hydrogen 2.829 N/A ARG 85.A NH1 GLU 84.A O no hydrogen 2.829 N/A PHE 87.A N PHE 76.A O no hydrogen 2.922 N/A SER 88.A N ASP 164.A OD2 no hydrogen 2.836 N/A SER 88.A OG.A THR 75.A OG1 no hydrogen 2.691 N/A ASN 89.A N ASP 74.A O no hydrogen 2.753 N/A ASN 89.A ND2 ASP 74.A OD2 no hydrogen 2.841 N/A ASN 89.A ND2 GLY 180.A O no hydrogen 2.920 N/A ILE 90.A N PHE 162.A O no hydrogen 2.975 N/A ILE 91.A N GLU 72.A O no hydrogen 3.019 N/A SER 92.A N LEU 160.A O no hydrogen 2.839 N/A THR 93.A N VAL 70.A O no hydrogen 3.015 N/A THR 93.A OG1 GLN 159.A OE1 no hydrogen 3.001 N/A LEU 94.A N LEU 158.A O no hydrogen 2.915 N/A ASN 95.A ND2 SER 157.A OG no hydrogen 2.707 N/A ALA 98.A N ASN 95.A O no hydrogen 2.958 N/A LYS 99.A N ASP 155.A OD2 no hydrogen 3.036 N/A LYS 99.A NZ ASP 155.A OD2 no hydrogen 2.821 N/A ARG 100.A N ASP 155.A O no hydrogen 3.279 N/A ARG 100.A NE ASP 207.A OD1 no hydrogen 2.919 N/A ARG 100.A NH1 GLU 6.A OE1 no hydrogen 2.885 N/A ARG 100.A NH2 ASP 207.A OD2 no hydrogen 2.809 N/A HIS 101.A N GLY 205.A O no hydrogen 2.814 N/A HIS 101.A NE2 LEU 94.A O no hydrogen 3.012 N/A HIS 101.A NE2 ASN 95.A O no hydrogen 3.002 N/A LEU 102.A N SER 157.A O no hydrogen 2.953 N/A VAL 103.A N LEU 208.A O no hydrogen 3.183 N/A LEU 104.A N GLN 159.A O no hydrogen 2.945 N/A ALA 105.A N VAL 210.A O no hydrogen 2.930 N/A CYS 106.A N ILE 161.A O no hydrogen 3.194 N/A CYS 106.A SG HIS 107.A O no hydrogen 3.856 N/A HIS 107.A ND1 ASP 109.A OD1 no hydrogen 2.766 N/A HIS 107.A NE2 ASP 125.A OD1 no hydrogen 2.887 N/A TYR 108.A N PHE 163.A O no hydrogen 2.923 N/A TYR 108.A OH SER 88.A O no hydrogen 2.617 N/A SER 110.A N ARG 44.A O no hydrogen 3.324 N/A LYS 111.A NZ ALA 168.A O no hydrogen 2.991 N/A TRP 116.A N ARG 118.A O no hydrogen 3.058 N/A ALA 123.A N ASP 299.A O no hydrogen 3.101 N/A THR 124.A N ASP 299.A OD1 no hydrogen 2.930 N/A THR 124.A OG1 ASP 299.A OD1 no hydrogen 3.292 N/A THR 124.A OG1 ASP 299.A OD2 no hydrogen 3.031 N/A ASP 125.A N GLY 122.A O no hydrogen 3.155 N/A SER 126.A OG.B HIS 107.A O no hydrogen 2.311 N/A ALA 127.A N GLY 122.A O no hydrogen 3.155 N/A VAL 128.A N ALA 123.A O no hydrogen 2.901 N/A CYS 130.A N SER 126.A O no hydrogen 3.115 N/A CYS 130.A SG HIS 107.A O no hydrogen 3.630 N/A CYS 130.A SG SER 126.A O no hydrogen 3.376 N/A ALA 131.A N ALA 127.A O no hydrogen 2.950 N/A MET 132.A N VAL 128.A O no hydrogen 2.685 N/A MET 133.A N PRO 129.A O no hydrogen 3.022 N/A LEU 134.A N CYS 130.A O no hydrogen 3.075 N/A GLU 135.A N ALA 131.A O no hydrogen 2.854 N/A LEU 136.A N MET 132.A O no hydrogen 2.879 N/A ALA 137.A N MET 133.A O no hydrogen 3.035 N/A ARG 138.A N LEU 134.A O no hydrogen 3.000 N/A ARG 138.A NE GLU 135.A OE1 no hydrogen 2.876 N/A ARG 138.A NH2 GLY 26.A O no hydrogen 3.544 N/A ARG 138.A NH2 GLU 135.A OE1 no hydrogen 3.128 N/A ARG 138.A NH2 GLU 135.A OE2 no hydrogen 2.638 N/A ALA 139.A N GLU 135.A O no hydrogen 2.644 N/A LEU 140.A N LEU 136.A O no hydrogen 2.909 N/A ASP 141.A N ARG 138.A O no hydrogen 3.105 N/A LEU 144.A N LEU 140.A O no hydrogen 2.908 N/A LEU 145.A N ASP 141.A O no hydrogen 2.931 N/A SER 146.A N LYS 143.A O no hydrogen 3.202 N/A SER 146.A OG LYS 143.A O no hydrogen 2.658 N/A LEU 147.A N LEU 144.A O no hydrogen 3.026 N/A LYS 148.A N LEU 145.A O no hydrogen 3.066 N/A THR 149.A N SER 146.A O no hydrogen 2.848 N/A SER 151.A OG SER 152.A OG no hydrogen 2.777 N/A SER 152.A OG SER 151.A OG no hydrogen 2.777 N/A SER 157.A N ARG 100.A O no hydrogen 2.965 N/A SER 157.A OG LEU 94.A O no hydrogen 3.248 N/A LEU 158.A N SER 157.A OG no hydrogen 2.713 N/A GLN 159.A N LEU 102.A O no hydrogen 2.873 N/A LEU 160.A N SER 92.A O no hydrogen 2.764 N/A ILE 161.A N LEU 104.A O no hydrogen 2.799 N/A PHE 162.A N ILE 90.A O no hydrogen 2.837 N/A PHE 163.A N CYS 106.A O no hydrogen 2.889 N/A ASP 164.A N ASN 89.A OD1 no hydrogen 2.837 N/A GLY 165.A N ASP 164.A OD1 no hydrogen 2.844 N/A GLU 166.A N ASP 109.A OD1 no hydrogen 3.208 N/A GLU 167.A N ASP 109.A OD2 no hydrogen 2.951 N/A PHE 169.A N ASP 176.A OD1 no hydrogen 2.922 N/A LEU 170.A N ASP 176.A OD2 no hydrogen 2.985 N/A SER 173.A N ASP 176.A O no hydrogen 3.291 N/A SER 173.A OG GLN 175.A OE1 no hydrogen 2.937 N/A ASP 176.A N SER 173.A O no hydrogen 3.099 N/A ASP 176.A N SER 173.A OG no hydrogen 2.834 N/A SER 177.A OG SER 173.A O no hydrogen 2.693 N/A LEU 178.A N GLU 166.A O no hydrogen 3.167 N/A TYR 179.A N GLY 165.A O no hydrogen 2.948 N/A TYR 179.A OH ASP 176.A OD1 no hydrogen 2.484 N/A SER 181.A OG LEU 178.A O no hydrogen 3.509 N/A SER 181.A OG ASP 271.A OD1 no hydrogen 2.720 N/A ARG 182.A N LEU 178.A O no hydrogen 2.731 N/A ARG 182.A NE SER 177.A O no hydrogen 3.278 N/A ARG 182.A NH2 SER 177.A O no hydrogen 2.919 N/A HIS 183.A N TYR 179.A O no hydrogen 3.160 N/A HIS 183.A ND1 ASP 74.A OD2 no hydrogen 2.848 N/A LEU 184.A N GLY 180.A O no hydrogen 3.001 N/A ALA 185.A N SER 181.A O no hydrogen 3.059 N/A ALA 186.A N ARG 182.A O no hydrogen 3.391 N/A LYS 187.A N HIS 183.A O no hydrogen 3.075 N/A LYS 187.A NZ.B ASP 74.A OD1 no hydrogen 3.100 N/A MET 188.A N LEU 184.A O no hydrogen 2.854 N/A ALA 189.A N ALA 185.A O no hydrogen 2.871 N/A SER 190.A N ALA 186.A O no hydrogen 3.164 N/A SER 190.A N LYS 187.A O no hydrogen 3.176 N/A SER 190.A OG ALA 186.A O no hydrogen 3.297 N/A SER 190.A OG LYS 187.A O no hydrogen 3.136 N/A THR 191.A N MET 188.A O no hydrogen 3.303 N/A THR 191.A OG1 LYS 187.A O no hydrogen 2.681 N/A HIS 193.A N THR 200.A O no hydrogen 2.995 N/A HIS 193.A NE2 ALA 98.A O no hydrogen 2.758 N/A ALA 197.A N PRO 194.A O no hydrogen 3.049 N/A THR 200.A N ARG 198.A O no hydrogen 2.943 N/A THR 200.A OG1 HIS 193.A O no hydrogen 2.564 N/A SER 201.A N HIS 204.A ND1 no hydrogen 2.970 N/A GLN 202.A N THR 191.A O no hydrogen 2.908 N/A LEU 203.A N SER 201.A OG no hydrogen 2.874 N/A GLY 205.A N GLN 202.A O no hydrogen 3.057 N/A MET 206.A N LEU 203.A O no hydrogen 3.197 N/A ASP 207.A N HIS 101.A O no hydrogen 2.992 N/A LEU 209.A N PRO 281.A O no hydrogen 2.847 N/A VAL 210.A N VAL 103.A O no hydrogen 2.754 N/A LEU 211.A N LEU 283.A O no hydrogen 3.045 N/A LEU 212.A N ALA 105.A O no hydrogen 2.754 N/A ASP 213.A N LEU 285.A O no hydrogen 3.140 N/A THR 221.A OG1 SER 288.A O no hydrogen 2.613 N/A PHE 222.A N TYR 258.A O no hydrogen 2.841 N/A ASN 224.A N TYR 262.A O no hydrogen 2.987 N/A SER 229.A N PHE 226.A O no hydrogen 3.034 N/A SER 229.A OG PHE 226.A O no hydrogen 3.272 N/A SER 229.A OG VAL 282.A O no hydrogen 2.649 N/A ALA 230.A N PRO 227.A O no hydrogen 3.058 N/A ARG 231.A NH1 HIS 10.A O no hydrogen 2.753 N/A ARG 231.A NH2 HIS 10.A O no hydrogen 2.958 N/A PHE 233.A N SER 229.A O no hydrogen 2.933 N/A GLU 234.A N ALA 230.A O no hydrogen 2.910 N/A ARG 235.A N ARG 231.A O no hydrogen 3.224 N/A ARG 235.A NH2 GLU 322.A OE1 no hydrogen 2.763 N/A LEU 236.A N TRP 232.A O no hydrogen 3.331 N/A GLN 237.A N PHE 233.A O no hydrogen 3.172 N/A ALA 238.A N GLU 234.A O no hydrogen 2.873 N/A ILE 239.A N ARG 235.A O no hydrogen 2.746 N/A GLU 240.A N LEU 236.A O no hydrogen 2.914 N/A HIS 241.A N GLN 237.A O no hydrogen 2.987 N/A GLU 242.A N ALA 238.A O no hydrogen 2.931 N/A LEU 243.A N ILE 239.A O no hydrogen 2.970 N/A HIS 244.A N GLU 240.A O no hydrogen 2.977 N/A GLU 245.A N HIS 241.A O no hydrogen 2.884 N/A LEU 246.A N GLU 242.A O no hydrogen 2.946 N/A GLY 247.A N HIS 244.A O no hydrogen 3.058 N/A LEU 248.A N LEU 243.A O no hydrogen 3.004 N/A LYS 250.A N ASN 311.A OD1 no hydrogen 2.897 N/A HIS 252.A NE2 GLU 240.A OE2 no hydrogen 2.734 N/A GLY 256.A N SER 253.A OG no hydrogen 2.886 N/A ARG 257.A N LEU 254.A O no hydrogen 3.085 N/A TYR 258.A N GLU 240.A OE2 no hydrogen 2.691 N/A PHE 259.A N GLU 240.A OE1 no hydrogen 2.961 N/A GLN 260.A N PHE 222.A O no hydrogen 2.991 N/A GLN 260.A NE2 ARG 257.A O no hydrogen 2.774 N/A GLN 260.A NE2 TYR 258.A O no hydrogen 3.212 N/A SER 263.A OG ASN 224.A O no hydrogen 2.992 N/A ASP 271.A N ASP 270.A OD1 no hydrogen 2.777 N/A ILE 273.A N ASP 270.A O no hydrogen 2.905 N/A PHE 275.A N HIS 272.A O no hydrogen 3.021 N/A LEU 276.A N HIS 272.A O no hydrogen 2.878 N/A ARG 277.A N ILE 273.A O no hydrogen 2.898 N/A ARG 278.A N PHE 275.A O no hydrogen 2.984 N/A ARG 278.A NH1 PRO 274.A O no hydrogen 2.860 N/A GLY 279.A N LEU 276.A O no hydrogen 2.913 N/A VAL 280.A N PHE 275.A O no hydrogen 3.097 N/A LEU 283.A N LEU 209.A O no hydrogen 2.832 N/A HIS 284.A NE2 ASP 270.A OD2 no hydrogen 2.825 N/A LEU 285.A N LEU 211.A O no hydrogen 2.812 N/A SER 288.A N THR 221.A O no hydrogen 2.819 N/A TRP 294.A N PRO 291.A O no hydrogen 2.944 N/A ASP 299.A N THR 296.A O no hydrogen 2.892 N/A ASN 300.A N ASP 298.A O no hydrogen 2.777 N/A ASN 303.A N ASN 300.A O no hydrogen 3.269 N/A ASN 303.A N ASN 300.A OD1 no hydrogen 2.926 N/A LEU 304.A N GLU 301.A O no hydrogen 3.203 N/A ASP 305.A N GLY 216.A O no hydrogen 2.813 N/A SER 307.A OG ASP 251.A OD2 no hydrogen 3.290 N/A THR 308.A N ASP 305.A OD2 no hydrogen 3.163 N/A THR 308.A OG1 ASP 305.A OD2 no hydrogen 2.494 N/A ILE 309.A N ASP 305.A O no hydrogen 3.204 N/A ASP 310.A N GLU 306.A O no hydrogen 2.855 N/A ASN 311.A N SER 307.A O no hydrogen 2.945 N/A ASN 311.A ND2 LYS 250.A O no hydrogen 2.876 N/A ASN 311.A ND2 TYR 258.A OH no hydrogen 3.060 N/A LEU 312.A N THR 308.A O no hydrogen 2.875 N/A ASN 313.A N ILE 309.A O no hydrogen 2.698 N/A LYS 314.A N ASP 310.A O no hydrogen 3.094 N/A LYS 314.A NZ LEU 248.A O no hydrogen 2.807 N/A ILE 315.A N ASN 311.A O no hydrogen 3.057 N/A LEU 316.A N LEU 312.A O no hydrogen 2.887 N/A GLN 317.A N ASN 313.A O no hydrogen 2.971 N/A GLN 317.A NE2 THR 27.A OG1 no hydrogen 3.038 N/A VAL 318.A N LYS 314.A O no hydrogen 3.077 N/A PHE 319.A N ILE 315.A O no hydrogen 3.019 N/A VAL 320.A N LEU 316.A O no hydrogen 2.886 N/A LEU 321.A N GLN 317.A O no hydrogen 3.028 N/A GLU 322.A N VAL 318.A O no hydrogen 2.894 N/A TYR 323.A N PHE 319.A O no hydrogen 3.024 N/A TYR 323.A OH ASP 207.A OD2 no hydrogen 2.522 N/A LEU 324.A N VAL 320.A O no hydrogen 2.984 N/A HIS 325.A N GLU 322.A O no hydrogen 3.195 N/A HIS 325.A ND1 GLU 322.A O no hydrogen 3.217 N/A LEU 326.A N LEU 321.A O no hydrogen 2.832 N/A