Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3n91_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH SER 129.A OG.B no hydrogen 3.286 N/A GLN 4.A N ASP 128.A OD2 no hydrogen 2.922 N/A GLN 4.A NE2 ASP 2.A O no hydrogen 3.151 N/A THR 5.A N GLY 41.A O no hydrogen 2.802 N/A THR 5.A OG1.A SER 129.A O no hydrogen 3.004 N/A THR 5.A OG1.B TYR 3.A O no hydrogen 3.530 N/A VAL 6.A N SER 129.A O no hydrogen 3.036 N/A TYR 7.A N ALA 39.A O no hydrogen 2.962 N/A PHE 8.A N GLN 153.A O no hydrogen 3.005 N/A GLN 11.A NE2 PHE 8.A O no hydrogen 2.986 N/A GLN 11.A NE2 PHE 155.A O no hydrogen 2.932 N/A GLY 13.A N LEU 157.A O no hydrogen 2.882 N/A LEU 14.A N LYS 303.A O no hydrogen 3.010 N/A ARG 15.A N ALA 159.A O no hydrogen 2.923 N/A THR 16.A N GLY 301.A O no hydrogen 2.854 N/A ILE 17.A N LYS 161.A O no hydrogen 2.785 N/A GLU 18.A N ASP 30.A OD2 no hydrogen 2.837 N/A LEU 19.A N VAL 163.A O no hydrogen 3.398 N/A GLY 20.A N ASN 31.A OD1 no hydrogen 2.739 N/A SER 22.A OG GLU 18.A OE2 no hydrogen 3.038 N/A ASN 27.A ND2 GLU 18.A O no hydrogen 2.835 N/A ASN 27.A ND2 GLY 20.A O no hydrogen 2.988 N/A THR 28.A N ASP 26.A OD1 no hydrogen 2.873 N/A THR 28.A OG1 ASP 26.A OD1 no hydrogen 2.627 N/A ASN 31.A N ASN 27.A O no hydrogen 3.084 N/A ASN 31.A ND2 GLY 20.A O no hydrogen 2.828 N/A GLN 32.A N THR 28.A O no hydrogen 3.259 N/A GLN 32.A N LEU 29.A O no hydrogen 2.970 N/A HIS 33.A N ASP 30.A O no hydrogen 2.749 N/A LYS 34.A N LEU 29.A O no hydrogen 2.907 N/A LYS 34.A NZ GLU 98.A OE1 no hydrogen 3.310 N/A ILE 36.A N VAL 97.A O no hydrogen 2.987 N/A ALA 38.A N ALA 95.A O no hydrogen 2.949 N/A ALA 39.A N TYR 7.A O no hydrogen 2.811 N/A TRP 40.A N ILE 94.A O no hydrogen 2.913 N/A GLY 41.A N THR 5.A O no hydrogen 2.685 N/A ASN 46.A ND2 ASN 48.A O no hydrogen 2.903 N/A ASN 46.A ND2 ILE 89.A O no hydrogen 3.364 N/A ASN 46.A ND2 PRO 90.A O no hydrogen 3.072 N/A ASN 46.A ND2 GLN 93.A O no hydrogen 3.459 N/A ASN 48.A N ASN 46.A OD1 no hydrogen 3.299 N/A ASN 48.A ND2 GLY 126.A O no hydrogen 2.783 N/A VAL 50.A N ILE 89.A O no hydrogen 2.950 N/A VAL 51.A N GLN 125.A O no hydrogen 2.858 N/A ILE 52.A N ILE 87.A O no hydrogen 2.811 N/A ASN 53.A N ASN 123.A O no hydrogen 2.951 N/A ASN 53.A ND2 ASN 123.A OD1 no hydrogen 2.677 N/A PHE 54.A N ASP 85.A O no hydrogen 3.167 N/A LYS 55.A N LEU 121.A O no hydrogen 2.984 N/A ASP 57.A N PRO 119.A O no hydrogen 2.901 N/A SER 59.A N ASP 57.A OD1 no hydrogen 3.217 N/A SER 59.A OG ASP 57.A OD1 no hydrogen 2.714 N/A LEU 60.A N ASP 57.A O no hydrogen 3.001 N/A CYS 61.A N GLU 58.A O no hydrogen 3.159 N/A ASP 62.A N SER 59.A O no hydrogen 3.023 N/A LEU 64.A N CYS 61.A O no hydrogen 3.250 N/A TYR 65.A N VAL 308.A O no hydrogen 2.854 N/A PHE 66.A N GLN 71.A O no hydrogen 2.948 N/A LYS 67.A N GLU 306.A O no hydrogen 3.027 N/A ASP 70.A N PHE 66.A O no hydrogen 2.777 N/A LEU 73.A N LEU 64.A O no hydrogen 3.097 N/A VAL 74.A N ASN 115.A O no hydrogen 3.031 N/A SER 78.A OG ASP 104.A OD2 no hydrogen 3.425 N/A TYR 79.A N PRO 76.A O no hydrogen 2.864 N/A TYR 79.A OH ASP 108.A OD2 no hydrogen 2.589 N/A THR 81.A N GLN 100.A O no hydrogen 2.810 N/A ALA 83.A N GLU 98.A O no hydrogen 2.924 N/A SER 84.A OG ARG 86.A O no hydrogen 3.428 N/A ARG 86.A N SER 84.A OG no hydrogen 3.174 N/A ILE 87.A N ILE 52.A O no hydrogen 2.799 N/A ILE 89.A N VAL 50.A O no hydrogen 2.829 N/A LYS 91.A N ASN 49.A OD1 no hydrogen 3.027 N/A LYS 91.A NZ ARG 47.A O no hydrogen 3.074 N/A GLY 92.A N ASN 46.A O no hydrogen 2.969 N/A GLN 93.A N PRO 90.A O no hydrogen 2.839 N/A ALA 95.A N ALA 38.A O no hydrogen 3.316 N/A VAL 97.A N ILE 36.A O no hydrogen 2.889 N/A GLN 100.A N THR 81.A O no hydrogen 2.935 N/A GLN 100.A NE2 GLN 32.A O no hydrogen 3.276 N/A GLN 100.A NE2 LEU 101.A O no hydrogen 3.165 N/A LEU 101.A N HIS 33.A O no hydrogen 2.857 N/A THR 102.A N TYR 79.A O no hydrogen 2.961 N/A THR 102.A OG1 SER 78.A O no hydrogen 2.667 N/A PHE 105.A N THR 102.A O no hydrogen 2.976 N/A ALA 107.A N ASP 103.A O no hydrogen 2.941 N/A LYS 110.A N ASP 108.A OD1 no hydrogen 2.816 N/A SER 111.A N ASP 108.A O no hydrogen 3.021 N/A SER 111.A OG PHE 105.A O no hydrogen 2.533 N/A SER 113.A N LYS 110.A O no hydrogen 3.166 N/A SER 113.A OG LYS 110.A O no hydrogen 3.085 N/A TYR 116.A OH ASP 108.A OD2 no hydrogen 2.630 N/A VAL 117.A N VAL 74.A O no hydrogen 2.833 N/A ILE 118.A N TYR 158.A O no hydrogen 2.804 N/A LEU 120.A N VAL 156.A O no hydrogen 3.008 N/A LEU 121.A N LYS 55.A O no hydrogen 3.002 N/A GLN 125.A N VAL 51.A O no hydrogen 2.937 N/A ASP 128.A N GLN 4.A O no hydrogen 3.263 N/A SER 129.A N GLN 4.A O no hydrogen 3.378 N/A SER 129.A OG.A ILE 130.A O no hydrogen 2.718 N/A SER 129.A OG.B TYR 3.A OH no hydrogen 3.286 N/A LEU 131.A N VAL 6.A O no hydrogen 3.097 N/A LYS 134.A N ILE 150.A O no hydrogen 2.793 N/A VAL 136.A N ASP 147.A O no hydrogen 2.871 N/A VAL 141.A N ASP 147.A OD2 no hydrogen 3.017 N/A ASN 144.A N VAL 141.A O no hydrogen 2.839 N/A ASN 144.A ND2 ASP 147.A OD2 no hydrogen 3.260 N/A ASP 147.A N ASN 144.A O no hydrogen 3.001 N/A TRP 148.A N ALA 145.A O no hydrogen 3.096 N/A TRP 148.A NE1 VAL 141.A O no hydrogen 3.159 N/A SER 149.A N LYS 134.A O no hydrogen 2.794 N/A SER 149.A OG LYS 134.A O no hydrogen 3.250 N/A ILE 150.A N LYS 134.A O no hydrogen 3.401 N/A GLN 153.A N LEU 131.A O no hydrogen 3.023 N/A VAL 156.A N LEU 120.A O no hydrogen 3.049 N/A LEU 157.A N GLN 11.A O no hydrogen 2.746 N/A TYR 158.A N ILE 118.A O no hydrogen 2.970 N/A ALA 159.A N GLY 13.A O no hydrogen 2.882 N/A VAL 160.A N TYR 116.A O no hydrogen 3.082 N/A LYS 161.A N ARG 15.A O no hydrogen 2.984 N/A LYS 161.A NZ THR 16.A OG1 no hydrogen 3.030 N/A TYR 162.A N SER 111.A O no hydrogen 3.118 N/A VAL 163.A N ILE 17.A O no hydrogen 2.999 N/A ASN 164.A N THR 204.A OG1 no hydrogen 2.977 N/A ASN 164.A ND2 SER 206.A O no hydrogen 3.027 N/A ASN 164.A ND2 ASP 208.A O no hydrogen 3.133 N/A ASN 164.A ND2 ASN 209.A OD1 no hydrogen 2.908 N/A TRP 166.A N ASN 164.A OD1 no hydrogen 3.108 N/A HIS 167.A N ASN 164.A O no hydrogen 3.319 N/A HIS 167.A N ASN 164.A OD1 no hydrogen 3.207 N/A HIS 167.A ND1 THR 204.A OG1 no hydrogen 2.932 N/A GLY 168.A N ILE 202.A O no hydrogen 3.014 N/A GLU 169.A N THR 296.A O no hydrogen 2.813 N/A TYR 170.A N VAL 200.A O no hydrogen 2.825 N/A TYR 170.A OH TRP 166.A O no hydrogen 2.635 N/A LEU 171.A N VAL 293.A O no hydrogen 2.732 N/A ARG 172.A N GLU 198.A O no hydrogen 2.794 N/A ARG 172.A NE GLU 198.A OE1 no hydrogen 3.162 N/A ARG 172.A NH1 ASP 290.A OD1 no hydrogen 3.467 N/A ARG 172.A NH1 ASP 290.A OD2 no hydrogen 2.783 N/A ARG 172.A NH2 GLU 198.A OE1 no hydrogen 3.087 N/A ARG 173.A N THR 291.A O no hydrogen 2.910 N/A ARG 173.A NH2 GLU 259.A OE1 no hydrogen 2.741 N/A GLY 174.A N ARG 189.A O no hydrogen 2.980 N/A ILE 175.A N LYS 289.A O no hydrogen 2.987 N/A ASP 176.A N ILE 187.A O no hydrogen 2.906 N/A HIS 177.A N ALA 287.A O no hydrogen 2.844 N/A HIS 177.A ND1 ASP 186.A OD1 no hydrogen 2.611 N/A ALA 178.A N LYS 185.A O no hydrogen 2.865 N/A THR 179.A N GLN 285.A O no hydrogen 2.930 N/A THR 179.A OG1 SER 184.A OG no hydrogen 3.412 N/A VAL 180.A N THR 183.A O no hydrogen 2.778 N/A ALA 181.A N ASN 283.A O no hydrogen 2.884 N/A THR 183.A N VAL 180.A O no hydrogen 2.949 N/A SER 184.A OG THR 179.A OG1 no hydrogen 3.412 N/A LYS 185.A N ALA 178.A O no hydrogen 2.983 N/A ILE 187.A N ASP 176.A O no hydrogen 2.855 N/A ARG 189.A N GLY 174.A O no hydrogen 3.010 N/A ARG 189.A NE ASP 176.A OD2 no hydrogen 3.043 N/A ARG 189.A NH1 ASP 290.A OD1 no hydrogen 2.939 N/A ARG 189.A NH2 ASP 176.A OD1 no hydrogen 3.057 N/A ARG 189.A NH2 ASP 290.A OD1 no hydrogen 2.707 N/A GLU 191.A N ASP 197.A OD1 no hydrogen 3.008 N/A ASN 196.A N PHE 193.A O no hydrogen 2.794 N/A ASP 197.A N VAL 194.A O no hydrogen 3.170 N/A VAL 200.A N TYR 170.A O no hydrogen 2.882 N/A ILE 202.A N GLY 168.A O no hydrogen 2.934 N/A SER 203.A N LEU 210.A O no hydrogen 3.029 N/A THR 204.A OG1 HIS 167.A ND1 no hydrogen 2.932 N/A LYS 205.A N ASP 208.A O no hydrogen 2.984 N/A SER 206.A N ASP 208.A O no hydrogen 3.224 N/A ASP 208.A N SER 206.A OG no hydrogen 2.988 N/A ASN 209.A N LEU 229.A O no hydrogen 2.833 N/A ASN 209.A ND2 ASN 164.A OD1 no hydrogen 2.986 N/A ASN 209.A ND2 SER 203.A O no hydrogen 2.844 N/A LEU 210.A N SER 203.A O no hydrogen 2.995 N/A LEU 211.A N VAL 227.A O no hydrogen 2.943 N/A THR 212.A OG1 THR 226.A OG1 no hydrogen 2.733 N/A LEU 213.A N TYR 225.A O no hydrogen 2.822 N/A THR 215.A N ILE 223.A O no hydrogen 2.947 N/A LYS 216.A NZ ASP 222.A OD2 no hydrogen 3.425 N/A ASP 217.A N LYS 221.A O no hydrogen 2.975 N/A SER 219.A N ASP 217.A OD1 no hydrogen 2.910 N/A GLY 220.A N ASP 217.A O no hydrogen 3.092 N/A LYS 221.A N ASP 217.A OD1 no hydrogen 3.118 N/A ILE 223.A N THR 215.A O no hydrogen 2.754 N/A TYR 225.A N LEU 213.A O no hydrogen 3.020 N/A THR 226.A OG1 THR 212.A OG1 no hydrogen 2.733 N/A VAL 227.A N LEU 211.A O no hydrogen 2.928 N/A ARG 228.A N HIS 240.A O no hydrogen 2.862 N/A ARG 228.A NH1 ASP 208.A OD2 no hydrogen 2.800 N/A LEU 229.A N ASN 209.A O no hydrogen 2.922 N/A SER 230.A N THR 238.A O no hydrogen 2.983 N/A SER 230.A OG ASP 208.A OD1 no hydrogen 2.981 N/A PHE 231.A N LYS 207.A O no hydrogen 2.938 N/A ALA 232.A N SER 236.A O no hydrogen 2.975 N/A GLY 235.A N ALA 232.A O no hydrogen 3.112 N/A SER 236.A N ASP 234.A OD1 no hydrogen 2.725 N/A SER 236.A OG ASP 234.A OD1 no hydrogen 2.481 N/A SER 236.A OG ASP 234.A OD2 no hydrogen 3.173 N/A CYS 237.A N GLY 252.A O no hydrogen 3.056 N/A THR 238.A N SER 230.A O no hydrogen 3.019 N/A THR 238.A OG1 HIS 240.A NE2 no hydrogen 2.807 N/A VAL 239.A N GLY 250.A O no hydrogen 2.984 N/A HIS 240.A N ARG 228.A O no hydrogen 2.740 N/A HIS 240.A NE2 THR 238.A OG1 no hydrogen 2.807 N/A SER 241.A OG VAL 246.A O no hydrogen 2.725 N/A GLY 242.A N THR 226.A O no hydrogen 2.774 N/A SER 243.A N SER 241.A OG no hydrogen 3.170 N/A SER 243.A OG ASN 245.A OD1 no hydrogen 2.114 N/A ASN 245.A ND2 SER 224.A O no hydrogen 2.900 N/A VAL 246.A N SER 243.A O no hydrogen 3.231 N/A VAL 247.A N ASN 278.A O no hydrogen 3.014 N/A SER 249.A N THR 276.A O no hydrogen 3.081 N/A SER 251.A N ASP 274.A O no hydrogen 3.152 N/A GLY 252.A N CYS 237.A O no hydrogen 2.877 N/A LYS 253.A N TYR 272.A O no hydrogen 2.949 N/A PHE 254.A N GLY 235.A O no hydrogen 2.928 N/A VAL 255.A N ALA 270.A O no hydrogen 2.792 N/A LYS 257.A N ASN 269.A OD1 no hydrogen 2.873 N/A LYS 257.A NZ GLU 21.A OE2 no hydrogen 2.692 N/A LYS 257.A NZ ASN 269.A OD1 no hydrogen 3.029 N/A GLU 259.A N ARG 268.A O no hydrogen 3.138 N/A LYS 260.A NZ LYS 257.A O no hydrogen 2.892 N/A LYS 260.A NZ ASP 267.A OD2 no hydrogen 3.516 N/A ASN 261.A N ASP 267.A OD1 no hydrogen 3.029 N/A SER 262.A N LYS 266.A O no hydrogen 3.284 N/A GLY 265.A N SER 262.A O no hydrogen 3.078 N/A LYS 266.A N LEU 263.A O no hydrogen 3.308 N/A ARG 268.A N GLU 259.A O no hydrogen 2.751 N/A ARG 268.A NE LEU 263.A O no hydrogen 3.188 N/A ASN 269.A ND2 GLU 21.A OE1 no hydrogen 3.039 N/A ALA 270.A N VAL 255.A O no hydrogen 3.113 N/A ILE 271.A N LEU 292.A O no hydrogen 2.872 N/A TYR 272.A N LYS 253.A O no hydrogen 2.835 N/A TYR 272.A OH GLU 259.A OE2 no hydrogen 2.706 N/A LEU 273.A N ASP 290.A O no hydrogen 2.935 N/A ASP 274.A N SER 251.A O no hydrogen 2.947 N/A TYR 275.A N THR 288.A O no hydrogen 2.918 N/A TYR 275.A OH ASP 290.A OD2 no hydrogen 2.895 N/A THR 276.A N SER 249.A O no hydrogen 2.835 N/A VAL 277.A N LEU 286.A O no hydrogen 2.922 N/A ASN 278.A N VAL 247.A O no hydrogen 2.764 N/A LEU 279.A N ILE 284.A O no hydrogen 2.806 N/A ASN 282.A N LEU 279.A O no hydrogen 3.087 N/A ILE 284.A N LEU 279.A O no hydrogen 3.440 N/A GLN 285.A N THR 179.A O no hydrogen 3.050 N/A GLN 285.A NE2 ASN 278.A OD1 no hydrogen 3.481 N/A GLN 285.A NE2 ASN 283.A OD1 no hydrogen 2.903 N/A LEU 286.A N VAL 277.A O no hydrogen 2.928 N/A ALA 287.A N HIS 177.A O no hydrogen 2.959 N/A THR 288.A N TYR 275.A O no hydrogen 2.807 N/A THR 288.A OG1 ASP 176.A OD1 no hydrogen 2.810 N/A LYS 289.A N ILE 175.A O no hydrogen 3.045 N/A ASP 290.A N LEU 273.A O no hydrogen 2.832 N/A THR 291.A N ARG 173.A O no hydrogen 2.687 N/A LEU 292.A N ILE 271.A O no hydrogen 2.710 N/A VAL 293.A N LEU 171.A O no hydrogen 2.854 N/A LEU 294.A N ASN 269.A O no hydrogen 2.738 N/A ARG 295.A N GLU 169.A O no hydrogen 2.870 N/A ARG 295.A NH1 GLU 169.A OE1 no hydrogen 3.144 N/A THR 296.A N GLU 169.A O no hydrogen 3.372 N/A ARG 297.A NE HIS 167.A O no hydrogen 2.820 N/A ARG 297.A NH1 LEU 19.A O no hydrogen 2.968 N/A ARG 297.A NH1 GLU 21.A O no hydrogen 2.748 N/A ARG 297.A NH2 LEU 19.A O no hydrogen 3.021 N/A ASN 298.A N THR 296.A OG1 no hydrogen 3.158 N/A LYS 303.A N LEU 14.A O no hydrogen 3.123 N/A LEU 305.A N TYR 12.A O no hydrogen 3.220 N/A VAL 308.A N TYR 65.A O no hydrogen 2.761 N/A LYS 310.A NZ ASP 70.A OD1 no hydrogen 2.624 N/A LYS 310.A NZ ASP 70.A OD2 no hydrogen 3.343 N/A