Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qyt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 3.A N LEU 30.A O no hydrogen 3.009 N/A LYS 4.A N ASP 78.A OD2 no hydrogen 2.942 N/A ILE 5.A N GLU 32.A O no hydrogen 2.978 N/A ALA 6.A N TYR 79.A O no hydrogen 2.839 N/A VAL 7.A N SER 34.A O no hydrogen 2.839 N/A PHE 8.A N LEU 81.A O no hydrogen 2.867 N/A GLY 9.A N ILE 36.A O no hydrogen 3.264 N/A GLY 15.A N GLY 11.A O no hydrogen 2.655 N/A TYR 16.A N GLY 12.A O no hydrogen 3.024 N/A TYR 17.A N VAL 13.A O no hydrogen 3.034 N/A TYR 17.A OH GLU 149.A OE2 no hydrogen 2.637 N/A GLY 18.A N GLY 14.A O no hydrogen 2.739 N/A ALA 19.A N GLY 15.A O no hydrogen 2.786 N/A ALA 21.A N GLY 18.A O no hydrogen 2.864 N/A LEU 22.A N ALA 19.A O no hydrogen 2.992 N/A ALA 24.A N LEU 20.A O no hydrogen 2.909 N/A ALA 25.A N ALA 21.A O no hydrogen 3.086 N/A ALA 25.A N LEU 22.A O no hydrogen 3.318 N/A ALA 26.A N LEU 22.A O no hydrogen 3.155 N/A THR 27.A OG1 ARG 23.A O no hydrogen 2.746 N/A GLU 32.A N ILE 3.A O no hydrogen 2.849 N/A VAL 33.A N THR 65.A OG1 no hydrogen 2.953 N/A SER 34.A N ILE 5.A O no hydrogen 2.941 N/A TRP 35.A N CYS 66.A O no hydrogen 2.907 N/A ILE 36.A N VAL 7.A O no hydrogen 2.778 N/A ALA 37.A N THR 68.A O no hydrogen 2.967 N/A ARG 38.A NH1 ASP 69.A O no hydrogen 3.496 N/A HIS 41.A NE2 LEU 10.A O no hydrogen 2.836 N/A LEU 42.A N ARG 38.A O no hydrogen 3.011 N/A GLU 43.A N GLY 39.A O no hydrogen 2.778 N/A ALA 44.A N ALA 40.A O no hydrogen 2.814 N/A ILE 45.A N HIS 41.A O no hydrogen 3.031 N/A ARG 46.A N LEU 42.A O no hydrogen 3.041 N/A ARG 46.A NH1 VAL 67.A O no hydrogen 3.070 N/A ALA 47.A N GLU 43.A O no hydrogen 3.040 N/A ALA 48.A N ALA 44.A O no hydrogen 2.969 N/A GLY 49.A N ARG 46.A O no hydrogen 3.258 N/A GLY 50.A N ILE 45.A O no hydrogen 2.961 N/A LEU 51.A N ALA 62.A O no hydrogen 2.838 N/A ARG 52.A N GLY 140.A O no hydrogen 3.096 N/A ARG 52.A NE ASP 59.A OD1 no hydrogen 2.908 N/A ARG 52.A NH2 ASP 59.A OD1 no hydrogen 3.444 N/A ARG 52.A NH2 ASP 59.A OD2 no hydrogen 2.642 N/A VAL 53.A N PHE 60.A O no hydrogen 2.863 N/A VAL 54.A N ILE 142.A O no hydrogen 2.892 N/A THR 55.A N ARG 58.A O no hydrogen 2.920 N/A THR 55.A OG1 ASP 147.A OD1 no hydrogen 2.760 N/A THR 55.A OG1 ASP 147.A OD2 no hydrogen 3.522 N/A SER 57.A N THR 55.A OG1 no hydrogen 3.218 N/A SER 57.A OG ASP 147.A OD1 no hydrogen 3.469 N/A SER 57.A OG ASP 147.A OD2 no hydrogen 2.794 N/A ARG 58.A N THR 55.A OG1 no hydrogen 2.989 N/A ARG 58.A NE ASP 147.A OD1 no hydrogen 3.044 N/A ARG 58.A NH1 TYR 16.A OH no hydrogen 3.065 N/A ARG 58.A NH1 ASP 147.A OD1 no hydrogen 2.895 N/A ARG 58.A NH2 TYR 16.A OH no hydrogen 3.169 N/A PHE 60.A N VAL 53.A O no hydrogen 2.877 N/A ALA 62.A N LEU 51.A O no hydrogen 2.881 N/A THR 65.A N VAL 33.A O no hydrogen 2.864 N/A THR 65.A OG1 VAL 33.A O no hydrogen 3.440 N/A CYS 66.A N VAL 33.A O no hydrogen 3.314 N/A THR 68.A N TRP 35.A O no hydrogen 3.073 N/A THR 68.A OG1 GLU 73.A OE1 no hydrogen 2.620 N/A ASN 70.A N THR 68.A OG1 no hydrogen 3.109 N/A ALA 72.A N ASN 70.A OD1 no hydrogen 3.152 N/A GLU 73.A N ASN 70.A O no hydrogen 2.947 N/A VAL 74.A N PRO 71.A O no hydrogen 3.140 N/A GLY 75.A N PRO 71.A O no hydrogen 3.238 N/A ASP 78.A N LYS 4.A O no hydrogen 2.663 N/A TYR 79.A N LYS 4.A O no hydrogen 3.193 N/A TYR 79.A OH ASP 163.A O no hydrogen 2.662 N/A ILE 80.A N LYS 103.A O no hydrogen 2.857 N/A LEU 81.A N ALA 6.A O no hydrogen 2.856 N/A PHE 82.A N LEU 105.A O no hydrogen 2.823 N/A CYS 83.A N PHE 8.A O no hydrogen 2.766 N/A ASP 86.A N THR 84.A OG1 no hydrogen 2.874 N/A ARG 90.A N ASP 88.A OD1 no hydrogen 2.664 N/A ARG 90.A NE GLU 94.A OE2 no hydrogen 3.183 N/A GLY 91.A N ASP 88.A O no hydrogen 2.989 N/A ALA 93.A N GLU 89.A O no hydrogen 3.139 N/A GLU 94.A N ARG 90.A O no hydrogen 3.035 N/A ILE 95.A N GLY 91.A O no hydrogen 3.201 N/A ILE 95.A N VAL 92.A O no hydrogen 3.217 N/A ARG 96.A N VAL 92.A O no hydrogen 3.056 N/A ARG 96.A NH1 TYR 119.A O no hydrogen 3.360 N/A GLY 99.A N THR 102.A OG1 no hydrogen 2.749 N/A THR 102.A N GLY 99.A O no hydrogen 3.450 N/A THR 102.A OG1 VAL 77.A O no hydrogen 2.658 N/A THR 102.A OG1 GLY 99.A O no hydrogen 3.416 N/A LYS 103.A N ASP 78.A O no hydrogen 2.932 N/A LYS 103.A NZ ASN 101.A O no hydrogen 3.095 N/A LYS 103.A NZ ASP 163.A OD2 no hydrogen 2.759 N/A ILE 104.A N VAL 124.A O no hydrogen 2.788 N/A LEU 105.A N ILE 80.A O no hydrogen 2.742 N/A LEU 107.A N PHE 82.A O no hydrogen 3.070 N/A ARG 116.A N ASP 112.A O no hydrogen 3.046 N/A ARG 117.A NE VAL 125.A O no hydrogen 3.121 N/A ARG 117.A NH2 VAL 125.A O no hydrogen 2.765 N/A THR 118.A N ARG 116.A O no hydrogen 2.947 N/A THR 118.A OG1 ARG 116.A O no hydrogen 2.824 N/A TYR 119.A OH GLU 89.A OE2 no hydrogen 2.592 N/A VAL 124.A N PRO 121.A O no hydrogen 2.955 N/A TRP 126.A N ILE 104.A O no hydrogen 2.763 N/A LYS 127.A N GLY 154.A O no hydrogen 2.925 N/A LYS 127.A NZ GLU 115.A OE1 no hydrogen 2.924 N/A LYS 127.A NZ ASP 185.A OD1 no hydrogen 2.568 N/A CYS 129.A N TYR 152.A O no hydrogen 3.040 N/A CYS 129.A SG TYR 187.A O no hydrogen 3.829 N/A TYR 131.A N LEU 150.A O no hydrogen 2.817 N/A ARG 135.A N THR 143.A O no hydrogen 2.930 N/A SER 137.A N LEU 141.A O no hydrogen 2.920 N/A SER 137.A OG THR 143.A OG1 no hydrogen 2.636 N/A GLY 140.A N HIS 41.A ND1 no hydrogen 2.880 N/A LEU 141.A N ALA 138.A O no hydrogen 2.909 N/A ILE 142.A N ARG 52.A O no hydrogen 2.810 N/A THR 143.A N ARG 135.A O no hydrogen 2.926 N/A THR 143.A OG1 SER 137.A OG no hydrogen 2.636 N/A LEU 144.A N VAL 54.A O no hydrogen 2.873 N/A GLU 145.A N SER 133.A O no hydrogen 2.968 N/A LEU 150.A N TYR 131.A O no hydrogen 2.905 N/A PHE 151.A N ARG 177.A O no hydrogen 3.092 N/A TYR 152.A N CYS 129.A O no hydrogen 2.935 N/A PHE 153.A N TYR 179.A O no hydrogen 3.022 N/A GLY 154.A N LYS 127.A O no hydrogen 2.956 N/A SER 155.A N GLU 164.A OE1 no hydrogen 3.007 N/A SER 155.A OG GLU 164.A OE2 no hydrogen 2.950 N/A LEU 157.A N SER 155.A OG no hydrogen 3.219 N/A GLN 160.A NE2 ASN 180.A O no hydrogen 3.144 N/A THR 161.A N GLU 164.A OE2 no hydrogen 2.936 N/A GLU 164.A N THR 161.A OG1 no hydrogen 3.368 N/A VAL 165.A N THR 161.A O no hydrogen 2.967 N/A ARG 166.A N ASP 162.A O no hydrogen 2.859 N/A ARG 166.A NE TYR 79.A OH no hydrogen 2.840 N/A ARG 166.A NH2 TYR 79.A OH no hydrogen 3.524 N/A LEU 167.A N ASP 163.A O no hydrogen 2.894 N/A ALA 168.A N GLU 164.A O no hydrogen 2.852 N/A GLU 169.A N VAL 165.A O no hydrogen 3.018 N/A LEU 170.A N ARG 166.A O no hydrogen 3.050 N/A LEU 171.A N LEU 167.A O no hydrogen 2.751 N/A THR 172.A N ALA 168.A O no hydrogen 3.006 N/A ALA 173.A N GLU 169.A O no hydrogen 2.935 N/A ALA 174.A N LEU 171.A O no hydrogen 3.199 N/A GLY 175.A N THR 172.A O no hydrogen 2.922 N/A ILE 176.A N LEU 171.A O no hydrogen 3.091 N/A ARG 177.A N GLU 149.A OE1 no hydrogen 2.800 N/A ARG 177.A NE GLU 149.A O no hydrogen 2.580 N/A ARG 177.A NH2 GLU 149.A O no hydrogen 2.988 N/A ALA 178.A N ILE 176.A O no hydrogen 2.951 N/A TYR 179.A N PHE 151.A O no hydrogen 2.853 N/A ASN 180.A ND2 PHE 153.A O no hydrogen 2.990 N/A ASN 180.A ND2 GLU 164.A OE1 no hydrogen 2.733 N/A ASP 183.A N ASP 183.A OD1 no hydrogen 2.744 N/A TRP 186.A N ASP 183.A O no hydrogen 3.092 N/A ILE 188.A N ILE 184.A O no hydrogen 3.131 N/A LYS 190.A N TYR 187.A O no hydrogen 2.948 N/A LYS 190.A NZ ASN 109.A OD1 no hydrogen 2.584 N/A LYS 190.A NZ VAL 130.A O no hydrogen 3.002 N/A PHE 191.A N ILE 188.A O no hydrogen 3.111 N/A SER 193.A N PHE 191.A O no hydrogen 2.705 N/A SER 193.A OG LEU 252.A O no hydrogen 2.440 N/A SER 193.A OG TYR 269.A OH no hydrogen 2.735 N/A THR 195.A OG1 GLN 247.A OE1 no hydrogen 3.026 N/A ALA 196.A N ILE 192.A O no hydrogen 2.821 N/A THR 197.A N SER 193.A O no hydrogen 2.880 N/A ALA 198.A N VAL 194.A O no hydrogen 2.847 N/A THR 199.A N THR 195.A O no hydrogen 3.018 N/A THR 199.A OG1 THR 195.A O no hydrogen 3.157 N/A ALA 200.A N ALA 196.A O no hydrogen 3.014 N/A ALA 200.A N THR 197.A O no hydrogen 3.247 N/A TYR 201.A N THR 197.A O no hydrogen 2.864 N/A PHE 202.A N ALA 198.A O no hydrogen 2.965 N/A LYS 204.A N THR 199.A O no hydrogen 3.419 N/A LYS 204.A NZ GLU 212.A OE2 no hydrogen 3.404 N/A SER 208.A N PRO 205.A O no hydrogen 3.041 N/A SER 208.A OG GLU 212.A OE2 no hydrogen 3.236 N/A ILE 209.A N PRO 205.A O no hydrogen 3.097 N/A LEU 210.A N ILE 206.A O no hydrogen 2.783 N/A THR 211.A OG1 GLY 207.A O no hydrogen 3.377 N/A THR 211.A OG1 SER 208.A O no hydrogen 3.290 N/A GLU 212.A N SER 208.A O no hydrogen 3.371 N/A HIS 213.A N ILE 209.A O no hydrogen 2.786 N/A HIS 213.A ND1 GLU 216.A OE2 no hydrogen 2.874 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.709 N/A LEU 217.A N HIS 213.A O no hydrogen 2.819 N/A LEU 218.A N GLU 214.A O no hydrogen 2.819 N/A SER 219.A N PRO 215.A O no hydrogen 2.850 N/A SER 219.A OG PRO 215.A O no hydrogen 3.019 N/A LEU 220.A N GLU 216.A O no hydrogen 3.009 N/A LEU 221.A N LEU 217.A O no hydrogen 3.041 N/A GLU 222.A N LEU 218.A O no hydrogen 2.952 N/A GLU 223.A N SER 219.A O no hydrogen 3.109 N/A VAL 224.A N LEU 220.A O no hydrogen 3.055 N/A ALA 225.A N LEU 221.A O no hydrogen 3.066 N/A GLU 226.A N GLU 222.A O no hydrogen 2.796 N/A LEU 227.A N GLU 223.A O no hydrogen 2.810 N/A PHE 228.A N VAL 224.A O no hydrogen 3.078 N/A ARG 229.A N ALA 225.A O no hydrogen 2.810 N/A ALA 230.A N GLU 226.A O no hydrogen 3.023 N/A ALA 230.A N LEU 227.A O no hydrogen 3.057 N/A LYS 231.A N LEU 227.A O no hydrogen 3.168 N/A LYS 231.A NZ TYR 255.A OH no hydrogen 2.853 N/A TYR 232.A N PHE 228.A O no hydrogen 3.062 N/A GLN 234.A N TYR 232.A O no hydrogen 2.446 N/A GLN 242.A N ASP 238.A O no hydrogen 2.605 N/A LEU 243.A N VAL 239.A O no hydrogen 2.819 N/A LEU 244.A N VAL 240.A O no hydrogen 2.786 N/A ASP 245.A N GLN 241.A O no hydrogen 3.013 N/A GLN 247.A NE2 LEU 243.A O no hydrogen 3.681 N/A ARG 248.A N ASP 245.A O no hydrogen 2.910 N/A ARG 248.A NH2 GLU 214.A OE1 no hydrogen 2.994 N/A THR 253.A OG1 GLU 250.A OE1 no hydrogen 3.329 N/A VAL 257.A N THR 253.A O no hydrogen 3.297 N/A ARG 258.A N GLY 254.A O no hydrogen 3.155 N/A GLU 259.A N TYR 255.A O no hydrogen 2.802 N/A ALA 260.A N VAL 256.A O no hydrogen 3.127 N/A GLU 261.A N VAL 257.A O no hydrogen 3.143 N/A ALA 262.A N ARG 258.A O no hydrogen 3.296 N/A ALA 262.A N GLU 259.A O no hydrogen 2.986 N/A LEU 263.A N GLU 259.A O no hydrogen 2.969 N/A ARG 264.A NH1 ALA 262.A O no hydrogen 2.768 N/A VAL 265.A N ALA 260.A O no hydrogen 2.828 N/A TYR 269.A OH SER 193.A OG no hydrogen 2.735 N/A LYS 270.A N LEU 267.A O no hydrogen 3.107 N/A LYS 270.A NZ ASP 266.A OD2 no hydrogen 3.331 N/A ARG 271.A N PRO 268.A O no hydrogen 2.832 N/A ARG 271.A NH1 TYR 201.A OH no hydrogen 2.864 N/A ARG 273.A N LYS 270.A O no hydrogen 3.169 N/A GLU 274.A N ARG 271.A O no hydrogen 3.162 N/A LEU 275.A N TYR 272.A O no hydrogen 3.432 N/A VAL 276.A N TYR 272.A O no hydrogen 2.915 N/A SER 277.A OG ARG 273.A O no hydrogen 3.098 N/A