Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1u4g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N VAL 26.A O no hydrogen 2.693 N/A ALA 3.A N LEU 24.A O no hydrogen 2.731 N/A GLY 4.A N PRO 59.A O no hydrogen 2.747 N/A GLY 5.A N TYR 17.A O no hydrogen 3.262 N/A GLY 7.A N TYR 15.A O no hydrogen 2.900 N/A GLY 8.A N ASP 75.A OD1 no hydrogen 2.818 N/A ASN 9.A N GLY 13.A O no hydrogen 3.323 N/A ASN 9.A ND2 ASP 189.A O no hydrogen 2.935 N/A GLN 10.A N GLY 68.A O no hydrogen 2.818 N/A LYS 11.A NZ TYR 188.A O no hydrogen 2.820 N/A LYS 11.A NZ LYS 191.A O no hydrogen 2.765 N/A LYS 11.A NZ GLY 193.A O no hydrogen 2.946 N/A LYS 11.A NZ GLY 195.A O no hydrogen 2.902 N/A ILE 12.A N ASN 9.A OD1 no hydrogen 2.984 N/A GLY 13.A N ASN 9.A O no hydrogen 2.749 N/A TYR 15.A N GLY 7.A O no hydrogen 3.187 N/A TYR 15.A OH ASP 75.A OD2 no hydrogen 2.737 N/A THR 16.A N ASP 20.A OD2 no hydrogen 2.767 N/A TYR 17.A N GLY 5.A O no hydrogen 2.786 N/A TYR 17.A OH ASP 75.A OD2 no hydrogen 2.614 N/A GLY 18.A N TYR 21.A O no hydrogen 2.793 N/A SER 19.A N THR 16.A O no hydrogen 3.142 N/A ASP 20.A N THR 16.A O no hydrogen 2.860 N/A TYR 21.A N THR 16.A O no hydrogen 3.373 N/A LEU 24.A N ALA 3.A O no hydrogen 2.768 N/A VAL 26.A N ALA 1.A O no hydrogen 2.885 N/A ASN 27.A N GLU 31.A O no hydrogen 3.166 N/A ARG 29.A NE GLU 31.A OE1 no hydrogen 3.049 N/A ARG 29.A NE GLU 31.A OE2 no hydrogen 3.066 N/A ARG 29.A NH2 GLU 31.A OE1 no hydrogen 3.085 N/A CYS 30.A N ASN 27.A O no hydrogen 2.922 N/A CYS 30.A SG PHE 56.A O no hydrogen 3.178 N/A MET 32.A N PHE 54.A O no hydrogen 2.863 N/A ASP 33.A N GLU 31.A O no hydrogen 2.802 N/A ASP 34.A N VAL 37.A O no hydrogen 3.113 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.813 N/A ASN 36.A N ASP 34.A OD1 no hydrogen 2.777 N/A VAL 37.A N ASP 34.A OD1 no hydrogen 2.613 N/A ILE 38.A N LEU 100.A O no hydrogen 2.769 N/A THR 39.A N MET 32.A O no hydrogen 3.033 N/A THR 39.A OG1 HIS 77.A ND1 no hydrogen 2.829 N/A VAL 40.A N MET 102.A O no hydrogen 2.742 N/A MET 42.A N VAL 104.A O no hydrogen 2.871 N/A ASN 43.A N ASP 41.A OD2 no hydrogen 2.918 N/A SER 44.A N HIS 105.A O no hydrogen 2.719 N/A SER 44.A OG GLY 107.A O no hydrogen 3.548 N/A SER 45.A N MET 42.A O no hydrogen 2.912 N/A ASP 47.A N SER 45.A OG no hydrogen 2.958 N/A SER 49.A N ASP 47.A OD1 no hydrogen 2.774 N/A SER 49.A OG ASP 47.A OD1 no hydrogen 2.648 N/A LYS 50.A N ASP 47.A O no hydrogen 3.415 N/A LYS 50.A NZ ASP 41.A O no hydrogen 3.474 N/A PHE 54.A N THR 39.A O no hydrogen 2.822 N/A ARG 55.A NE ARG 29.A O no hydrogen 2.885 N/A PHE 56.A N CYS 30.A O no hydrogen 3.098 N/A ASN 61.A N GLY 4.A O no hydrogen 2.941 N/A VAL 66.A N ALA 69.A O no hydrogen 3.032 N/A ASN 67.A ND2 ASP 124.A O no hydrogen 2.877 N/A ASN 67.A ND2 ALA 126.A O no hydrogen 3.314 N/A ASN 67.A ND2 PHE 129.A O no hydrogen 3.077 N/A ALA 69.A N VAL 66.A O no hydrogen 2.877 N/A TYR 70.A N GLY 8.A O no hydrogen 2.978 N/A SER 71.A OG TYR 63.A O no hydrogen 3.034 N/A ASN 74.A N SER 71.A OG no hydrogen 3.232 N/A ASN 74.A ND2 ASN 61.A OD1 no hydrogen 2.813 N/A ASP 75.A N SER 71.A O no hydrogen 3.160 N/A ALA 76.A N PRO 72.A O no hydrogen 2.804 N/A HIS 77.A N LEU 73.A O no hydrogen 3.017 N/A HIS 77.A ND1 THR 39.A OG1 no hydrogen 2.829 N/A HIS 77.A NE2 ILE 25.A O no hydrogen 2.803 N/A PHE 78.A N ASN 74.A O no hydrogen 3.052 N/A PHE 79.A N ASP 75.A O no hydrogen 2.818 N/A GLY 80.A N ALA 76.A O no hydrogen 2.875 N/A GLY 81.A N HIS 77.A O no hydrogen 3.155 N/A VAL 82.A N PHE 78.A O no hydrogen 2.938 N/A VAL 83.A N PHE 79.A O no hydrogen 2.971 N/A PHE 84.A N GLY 80.A O no hydrogen 3.018 N/A LYS 85.A N GLY 81.A O no hydrogen 2.949 N/A LEU 86.A N VAL 82.A O no hydrogen 2.880 N/A TYR 87.A N VAL 83.A O no hydrogen 3.187 N/A TYR 87.A OH SER 143.A OG no hydrogen 2.874 N/A ARG 88.A N PHE 84.A O no hydrogen 3.050 N/A ARG 88.A NE ASP 89.A OD2 no hydrogen 2.873 N/A ARG 88.A NH1 ASP 89.A OD2 no hydrogen 3.161 N/A ASP 89.A N LYS 85.A O no hydrogen 2.774 N/A TRP 90.A N LEU 86.A O no hydrogen 2.889 N/A PHE 91.A N TYR 87.A O no hydrogen 2.968 N/A GLY 92.A N ARG 88.A O no hydrogen 2.858 N/A THR 93.A N TYR 87.A O no hydrogen 3.421 N/A THR 93.A OG1 SER 94.A O no hydrogen 3.369 N/A SER 94.A OG LEU 96.A O no hydrogen 2.999 N/A LEU 96.A N SER 94.A OG no hydrogen 3.415 N/A THR 97.A N GLN 149.A OE1 no hydrogen 2.867 N/A LEU 100.A N ASN 36.A O no hydrogen 3.061 N/A MET 102.A N ILE 38.A O no hydrogen 2.773 N/A LYS 103.A N MET 120.A O no hydrogen 2.805 N/A LYS 103.A NZ LYS 50.A O no hydrogen 2.799 N/A VAL 104.A N VAL 40.A O no hydrogen 2.904 N/A HIS 105.A ND1 ASP 124.A OD1 no hydrogen 2.770 N/A TYR 106.A N PHE 122.A O no hydrogen 3.072 N/A GLY 107.A N SER 45.A O no hydrogen 2.971 N/A ALA 113.A N ASN 112.A OD1 no hydrogen 3.025 N/A TYR 114.A N LEU 121.A O no hydrogen 2.761 N/A TRP 115.A NE1 GLU 148.A OE1 no hydrogen 2.957 N/A ASP 116.A N ALA 119.A O no hydrogen 3.032 N/A THR 118.A N ASP 116.A OD1 no hydrogen 2.762 N/A ALA 119.A N ASP 116.A OD1 no hydrogen 2.730 N/A MET 120.A N TYR 101.A O no hydrogen 2.948 N/A LEU 121.A N TYR 114.A O no hydrogen 2.784 N/A PHE 122.A N LYS 103.A O no hydrogen 2.834 N/A GLY 123.A N ASN 112.A O no hydrogen 2.931 N/A GLY 125.A N VAL 110.A O no hydrogen 2.869 N/A ALA 126.A N GLU 111.A OE1 no hydrogen 2.859 N/A THR 127.A N GLU 111.A OE2 no hydrogen 3.046 N/A MET 128.A N GLU 111.A OE2 no hydrogen 2.860 N/A PHE 129.A N GLU 111.A OE1 no hydrogen 2.977 N/A TYR 130.A N ILE 190.A O no hydrogen 2.850 N/A LEU 132.A N GLY 123.A O no hydrogen 3.110 N/A VAL 133.A N PRO 131.A O no hydrogen 2.872 N/A SER 134.A OG ASP 136.A OD2 no hydrogen 2.422 N/A VAL 137.A N SER 134.A OG no hydrogen 3.257 N/A ALA 138.A N SER 134.A O no hydrogen 2.980 N/A ALA 139.A N LEU 135.A O no hydrogen 2.962 N/A HIS 140.A N ASP 136.A O no hydrogen 2.956 N/A GLU 141.A N VAL 137.A O no hydrogen 2.960 N/A VAL 142.A N ALA 138.A O no hydrogen 3.013 N/A SER 143.A N ALA 139.A O no hydrogen 2.892 N/A SER 143.A OG TYR 87.A OH no hydrogen 2.874 N/A SER 143.A OG ALA 139.A O no hydrogen 2.683 N/A HIS 144.A N HIS 140.A O no hydrogen 3.288 N/A HIS 144.A N GLU 141.A O no hydrogen 3.131 N/A HIS 144.A ND1 ASN 163.A OD1 no hydrogen 2.699 N/A GLY 145.A N VAL 142.A O no hydrogen 2.960 N/A PHE 146.A N VAL 142.A O no hydrogen 3.212 N/A THR 147.A N SER 143.A O no hydrogen 2.912 N/A THR 147.A OG1 SER 143.A O no hydrogen 3.243 N/A THR 147.A OG1 ASN 255.A OD1 no hydrogen 2.980 N/A GLU 148.A N HIS 144.A O no hydrogen 2.905 N/A GLN 149.A N GLY 145.A O no hydrogen 2.969 N/A ASN 150.A N THR 147.A O no hydrogen 2.999 N/A ASN 150.A ND2 PHE 146.A O no hydrogen 2.752 N/A GLY 152.A N THR 147.A O no hydrogen 2.794 N/A ILE 154.A N ALA 261.A O no hydrogen 3.051 N/A TYR 155.A OH HIS 144.A ND1 no hydrogen 3.383 N/A TYR 155.A OH GLU 148.A OE2 no hydrogen 2.775 N/A ARG 156.A N ILE 154.A O no hydrogen 2.932 N/A SER 159.A OG ILE 154.A O no hydrogen 2.874 N/A SER 159.A OG ARG 156.A O no hydrogen 2.879 N/A GLY 160.A N ARG 156.A O no hydrogen 2.922 N/A GLY 161.A N GLY 157.A O no hydrogen 3.190 N/A MET 162.A N GLN 158.A O no hydrogen 2.896 N/A ASN 163.A N SER 159.A O no hydrogen 2.886 N/A ASN 163.A ND2 LEU 153.A O no hydrogen 2.900 N/A GLU 164.A N GLY 160.A O no hydrogen 3.004 N/A ALA 165.A N GLY 161.A O no hydrogen 2.838 N/A PHE 166.A N MET 162.A O no hydrogen 2.877 N/A SER 167.A N ASN 163.A O no hydrogen 3.254 N/A SER 167.A OG HIS 140.A O no hydrogen 2.784 N/A ASP 168.A N GLU 164.A O no hydrogen 3.005 N/A MET 169.A N ALA 165.A O no hydrogen 2.803 N/A ALA 170.A N PHE 166.A O no hydrogen 2.918 N/A GLY 171.A N SER 167.A O no hydrogen 3.213 N/A GLU 172.A N ASP 168.A O no hydrogen 3.267 N/A ALA 173.A N MET 169.A O no hydrogen 2.863 N/A ALA 174.A N ALA 170.A O no hydrogen 2.871 N/A GLU 175.A N GLY 171.A O no hydrogen 3.160 N/A PHE 176.A N GLU 172.A O no hydrogen 2.925 N/A TYR 177.A N ALA 173.A O no hydrogen 2.776 N/A TYR 177.A OH ASP 89.A OD1 no hydrogen 2.578 N/A MET 178.A N ALA 174.A O no hydrogen 2.953 N/A ARG 179.A N GLU 175.A O no hydrogen 2.773 N/A GLY 180.A N PHE 176.A O no hydrogen 2.721 N/A ASN 182.A ND2 THR 244.A OG1 no hydrogen 2.589 N/A PHE 184.A N GLU 172.A OE2 no hydrogen 2.713 N/A LEU 185.A N ASP 183.A OD2 no hydrogen 2.977 N/A ILE 186.A N ARG 198.A O no hydrogen 2.962 N/A GLY 187.A N ASP 136.A OD1 no hydrogen 2.910 N/A TYR 188.A N LEU 185.A O no hydrogen 3.370 N/A ILE 190.A N GLY 187.A O no hydrogen 3.119 N/A LYS 191.A N TYR 188.A O no hydrogen 3.392 N/A LYS 192.A N MET 128.A O no hydrogen 2.954 N/A LYS 192.A NZ ASN 67.A OD1 no hydrogen 2.728 N/A LYS 192.A NZ ALA 126.A O no hydrogen 2.877 N/A ALA 196.A N TYR 199.A OH no hydrogen 2.982 N/A LEU 197.A N ILE 186.A O no hydrogen 2.878 N/A ARG 198.A N ILE 186.A O no hydrogen 3.224 N/A ARG 198.A NE ASP 168.A OD1 no hydrogen 2.887 N/A ARG 198.A NH1 ASP 168.A OD2 no hydrogen 3.016 N/A GLN 202.A NE2 SER 204.A OG no hydrogen 3.097 N/A SER 204.A N ASP 211.A OD1 no hydrogen 2.648 N/A SER 204.A OG ASP 211.A OD1 no hydrogen 3.295 N/A SER 204.A OG ASP 211.A OD2 no hydrogen 2.614 N/A ARG 205.A N GLN 202.A O no hydrogen 2.975 N/A ARG 205.A NH1 ASP 201.A OD2 no hydrogen 3.151 N/A ASP 206.A N PRO 203.A O no hydrogen 3.174 N/A GLY 207.A N SER 204.A O no hydrogen 2.811 N/A ARG 208.A N ASP 206.A OD2 no hydrogen 2.789 N/A ARG 208.A NE GLY 207.A O no hydrogen 2.943 N/A SER 209.A N ASP 206.A OD2 no hydrogen 2.790 N/A SER 209.A OG ASP 206.A OD1 no hydrogen 2.627 N/A SER 209.A OG ASP 206.A OD2 no hydrogen 3.521 N/A SER 209.A OG HIS 223.A O no hydrogen 3.309 N/A ILE 210.A N HIS 224.A O no hydrogen 3.173 N/A ASP 211.A N GLN 215.A OE1 no hydrogen 2.926 N/A ALA 213.A N VAL 293.A O no hydrogen 2.804 N/A SER 214.A N ASN 212.A OD1 no hydrogen 2.884 N/A SER 214.A OG ASN 212.A OD1 no hydrogen 3.197 N/A GLN 215.A N ASN 212.A O no hydrogen 2.938 N/A TYR 216.A N ALA 213.A O no hydrogen 3.070 N/A ILE 220.A N TYR 217.A O no hydrogen 3.167 N/A HIS 223.A N ASP 221.A OD1 no hydrogen 2.676 N/A HIS 223.A ND1 ASP 221.A OD1 no hydrogen 2.983 N/A HIS 224.A N ASP 221.A O no hydrogen 2.888 N/A SER 225.A N ASP 221.A O no hydrogen 2.943 N/A SER 225.A OG ASP 221.A O no hydrogen 3.374 N/A SER 225.A OG VAL 222.A O no hydrogen 3.492 N/A SER 226.A OG VAL 222.A O no hydrogen 3.516 N/A GLY 227.A N HIS 224.A O no hydrogen 3.347 N/A VAL 228.A N SER 225.A O no hydrogen 3.433 N/A TYR 229.A OH TYR 265.A O no hydrogen 2.692 N/A ASN 230.A N SER 226.A O no hydrogen 2.902 N/A ASN 230.A ND2 ASP 168.A OD1 no hydrogen 2.882 N/A ARG 231.A N GLY 227.A O no hydrogen 2.891 N/A ARG 231.A NH1 ASP 211.A O no hydrogen 2.861 N/A ALA 232.A N VAL 228.A O no hydrogen 3.119 N/A PHE 233.A N TYR 229.A O no hydrogen 2.929 N/A TYR 234.A N ASN 230.A O no hydrogen 2.985 N/A LEU 235.A N ARG 231.A O no hydrogen 2.828 N/A LEU 236.A N ALA 232.A O no hydrogen 2.933 N/A ALA 237.A N PHE 233.A O no hydrogen 2.820 N/A ASN 238.A N TYR 234.A O no hydrogen 3.079 N/A ASN 238.A ND2 TYR 234.A O no hydrogen 2.845 N/A SER 239.A N LEU 236.A O no hydrogen 2.981 N/A SER 239.A OG LEU 235.A O no hydrogen 2.760 N/A SER 239.A OG LEU 236.A O no hydrogen 3.434 N/A TRP 242.A N SER 239.A O no hydrogen 2.906 N/A TRP 242.A NE1 ASP 285.A OD2 no hydrogen 2.885 N/A ARG 245.A NE GLU 249.A OE2 no hydrogen 3.049 N/A LYS 246.A N ASP 243.A OD2 no hydrogen 2.836 N/A LYS 246.A NZ GLY 241.A O no hydrogen 2.780 N/A ALA 247.A N ASP 243.A O no hydrogen 3.042 N/A PHE 248.A N THR 244.A O no hydrogen 2.965 N/A GLU 249.A N ARG 245.A O no hydrogen 2.832 N/A VAL 250.A N LYS 246.A O no hydrogen 3.336 N/A VAL 252.A N PHE 248.A O no hydrogen 2.827 N/A ASP 253.A N GLU 249.A O no hydrogen 2.966 N/A ALA 254.A N VAL 250.A O no hydrogen 3.146 N/A ASN 255.A N PHE 251.A O no hydrogen 2.908 N/A ARG 256.A N VAL 252.A O no hydrogen 2.829 N/A ARG 256.A NH2 PHE 91.A O no hydrogen 3.278 N/A TYR 257.A N ASP 253.A O no hydrogen 2.779 N/A TYR 258.A N ALA 254.A O no hydrogen 2.954 N/A TYR 258.A OH ASN 278.A OD1 no hydrogen 2.939 N/A TRP 259.A N ALA 254.A O no hydrogen 2.810 N/A TRP 259.A NE1 GLY 268.A O no hydrogen 2.882 N/A THR 260.A N SER 263.A OG no hydrogen 2.775 N/A THR 260.A OG1 SER 263.A OG no hydrogen 3.205 N/A THR 262.A N THR 260.A OG1 no hydrogen 3.361 N/A SER 263.A N THR 260.A O no hydrogen 3.336 N/A SER 263.A OG THR 260.A O no hydrogen 3.337 N/A SER 263.A OG THR 260.A OG1 no hydrogen 3.205 N/A ASN 264.A N SER 267.A OG no hydrogen 2.916 N/A TYR 265.A OH SER 225.A O no hydrogen 2.666 N/A SER 267.A OG ASN 264.A O no hydrogen 3.375 N/A GLY 268.A N ASN 264.A O no hydrogen 2.815 N/A ALA 269.A N TYR 265.A O no hydrogen 3.071 N/A ALA 269.A N ASN 266.A O no hydrogen 3.220 N/A CYS 270.A SG ASN 266.A O no hydrogen 3.689 N/A ILE 273.A N ALA 269.A O no hydrogen 2.982 N/A ARG 274.A N CYS 270.A O no hydrogen 2.922 N/A SER 275.A N GLY 271.A O no hydrogen 2.933 N/A SER 275.A OG GLY 271.A O no hydrogen 2.738 N/A ALA 276.A N VAL 272.A O no hydrogen 3.019 N/A GLN 277.A N ILE 273.A O no hydrogen 3.098 N/A ASN 278.A N ARG 274.A O no hydrogen 2.904 N/A ARG 279.A N SER 275.A O no hydrogen 3.086 N/A ARG 279.A NE ASP 253.A OD1 no hydrogen 2.646 N/A ARG 279.A NH2 ASP 253.A OD1 no hydrogen 3.341 N/A ARG 279.A NH2 ASP 253.A OD2 no hydrogen 3.005 N/A ASN 280.A N GLN 277.A O no hydrogen 3.032 N/A ASN 280.A ND2 GLN 277.A O no hydrogen 3.252 N/A TYR 281.A N ALA 276.A O no hydrogen 2.780 N/A TYR 281.A OH GLU 249.A OE1 no hydrogen 2.651 N/A ASP 285.A N SER 282.A OG no hydrogen 3.054 N/A VAL 286.A N SER 282.A O no hydrogen 3.460 N/A THR 287.A N ALA 283.A O no hydrogen 2.878 N/A THR 287.A OG1 ALA 283.A O no hydrogen 2.756 N/A ARG 288.A N ALA 284.A O no hydrogen 2.807 N/A ALA 289.A N ASP 285.A O no hydrogen 3.012 N/A PHE 290.A N VAL 286.A O no hydrogen 3.081 N/A SER 291.A N THR 287.A O no hydrogen 2.947 N/A SER 291.A OG THR 287.A O no hydrogen 3.266 N/A SER 291.A OG ARG 288.A O no hydrogen 3.068 N/A THR 292.A N ARG 288.A O no hydrogen 2.995 N/A THR 292.A OG1 ARG 288.A O no hydrogen 2.803 N/A VAL 293.A N PHE 290.A O no hydrogen 2.965 N/A GLY 294.A N SER 291.A O no hydrogen 3.041 N/A VAL 295.A N PHE 290.A O no hydrogen 2.876 N/A