Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jwo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLY 36.A O no hydrogen 2.577 N/A THR 4.A N VAL 13.A O no hydrogen 2.886 N/A THR 4.A OG1 GLN 5.A O no hydrogen 3.397 N/A GLN 5.A NE2 ILE 9.A O no hydrogen 3.051 N/A LEU 6.A N LEU 11.A O no hydrogen 2.971 N/A ARG 8.A N GLY 190.A O no hydrogen 2.863 N/A ARG 8.A NH1 LEU 164.A O no hydrogen 3.032 N/A ARG 8.A NH2 LEU 164.A O no hydrogen 2.781 N/A ARG 8.A NH2 GLY 190.A O no hydrogen 2.973 N/A ILE 9.A N LEU 6.A O no hydrogen 3.257 N/A VAL 13.A N THR 4.A O no hydrogen 2.914 N/A SER 14.A N ASN 38.A OD1 no hydrogen 2.841 N/A SER 14.A OG LEU 16.A O no hydrogen 2.836 N/A SER 14.A OG ASN 38.A OD1 no hydrogen 3.326 N/A ARG 15.A N GLU 2.A O no hydrogen 3.047 N/A ARG 15.A NH1 LEU 246.A O no hydrogen 2.518 N/A ARG 15.A NH2 THR 252.A O no hydrogen 3.047 N/A VAL 17.A N PRO 254.A O no hydrogen 3.018 N/A LEU 18.A N PHE 39.A O no hydrogen 2.878 N/A GLY 19.A N VAL 256.A O no hydrogen 2.791 N/A THR 20.A N ALA 43.A O no hydrogen 2.968 N/A GLU 24.A N ASP 21.A OD2 no hydrogen 3.310 N/A SER 25.A OG ASP 21.A O no hydrogen 2.879 N/A HIS 26.A N GLU 22.A O no hydrogen 3.043 N/A HIS 26.A NE2 ILE 53.A O no hydrogen 2.890 N/A ALA 27.A N ALA 23.A O no hydrogen 3.143 N/A ILE 28.A N GLU 24.A O no hydrogen 3.183 N/A MET 29.A N SER 25.A O no hydrogen 2.922 N/A ASP 30.A N HIS 26.A O no hydrogen 3.216 N/A ALA 31.A N ALA 27.A O no hydrogen 3.017 N/A ALA 32.A N ILE 28.A O no hydrogen 2.788 N/A LEU 33.A N MET 29.A O no hydrogen 3.095 N/A ASP 34.A N ASP 30.A O no hydrogen 3.079 N/A ALA 35.A N ALA 31.A O no hydrogen 2.972 N/A GLY 36.A N LEU 33.A O no hydrogen 2.885 N/A ILE 37.A N ALA 32.A O no hydrogen 2.902 N/A ASN 38.A N SER 14.A OG no hydrogen 3.159 N/A ASN 38.A ND2 LYS 12.A O no hydrogen 3.123 N/A PHE 40.A N VAL 69.A O no hydrogen 2.947 N/A ASP 41.A N LEU 18.A O no hydrogen 2.858 N/A THR 42.A N ALA 71.A O no hydrogen 3.230 N/A THR 42.A OG1 ASN 46.A OD1 no hydrogen 3.037 N/A THR 42.A OG1 THR 72.A OG1 no hydrogen 3.068 N/A ALA 43.A N ASP 41.A OD1 no hydrogen 3.477 N/A ASN 44.A N GLU 45.A O no hydrogen 3.150 N/A ASN 46.A ND2 GLU 51.A OE1 no hydrogen 3.225 N/A ASN 46.A ND2 LYS 73.A O no hydrogen 3.005 N/A GLU 51.A N LYS 47.A O no hydrogen 3.509 N/A GLU 52.A N GLY 48.A O no hydrogen 3.039 N/A ILE 53.A N ARG 49.A O no hydrogen 2.927 N/A LEU 54.A N THR 50.A O no hydrogen 3.067 N/A GLY 55.A N GLU 51.A O no hydrogen 2.827 N/A SER 56.A N GLU 52.A O no hydrogen 2.948 N/A SER 56.A OG HIS 26.A NE2 no hydrogen 2.868 N/A SER 56.A OG ILE 53.A O no hydrogen 2.985 N/A TRP 57.A N ILE 53.A O no hydrogen 3.000 N/A TRP 57.A NE1 ASP 30.A OD1 no hydrogen 2.841 N/A PHE 58.A N LEU 54.A O no hydrogen 2.928 N/A ALA 59.A N GLY 55.A O no hydrogen 2.983 N/A GLN 60.A N TRP 57.A O no hydrogen 3.302 N/A GLY 61.A N PHE 58.A O no hydrogen 3.025 N/A ARG 64.A NE ASP 30.A OD1 no hydrogen 3.065 N/A ARG 64.A NH1 ASP 30.A OD1 no hydrogen 3.377 N/A ARG 64.A NH1 ASP 30.A OD2 no hydrogen 2.935 N/A ARG 64.A NH2 GLY 61.A O no hydrogen 2.982 N/A ARG 65.A NE THR 103.A OG1 no hydrogen 2.864 N/A ARG 65.A NH1 HIS 105.A O no hydrogen 2.727 N/A ARG 65.A NH1 ASP 107.A OD1 no hydrogen 3.371 N/A ARG 65.A NH1 ASP 107.A OD2 no hydrogen 3.037 N/A ARG 65.A NH2 ARG 65.A O no hydrogen 3.051 N/A ARG 65.A NH2 VAL 68.A O no hydrogen 3.184 N/A ARG 65.A NH2 ASP 107.A OD2 no hydrogen 2.956 N/A LYS 67.A N ARG 64.A O no hydrogen 3.076 N/A VAL 68.A N ARG 64.A O no hydrogen 3.273 N/A VAL 68.A N ARG 65.A O no hydrogen 3.303 N/A VAL 69.A N ASN 38.A O no hydrogen 2.684 N/A LEU 70.A N ASP 107.A OD2 no hydrogen 2.749 N/A ALA 71.A N PHE 40.A O no hydrogen 2.866 N/A THR 72.A N LEU 108.A O no hydrogen 2.959 N/A THR 72.A OG1 THR 42.A OG1 no hydrogen 3.068 N/A THR 72.A OG1 GLU 51.A OE1 no hydrogen 2.844 N/A LYS 73.A N THR 72.A OG1 no hydrogen 2.849 N/A LYS 73.A NZ GLN 168.A OE1 no hydrogen 2.625 N/A VAL 74.A N GLN 110.A O no hydrogen 2.927 N/A TYR 75.A OH GLU 51.A OE2 no hydrogen 2.499 N/A HIS 82.A N TRP 79.A O no hydrogen 3.092 N/A LYS 84.A NZ ASP 115.A OD1 no hydrogen 3.154 N/A LYS 84.A NZ ASP 117.A OD2 no hydrogen 3.354 N/A LEU 85.A N ASP 115.A OD2 no hydrogen 3.025 N/A ALA 87.A N GLU 122.A OE2 no hydrogen 2.925 N/A ASN 89.A N SER 86.A OG no hydrogen 3.052 N/A ASN 89.A ND2 LYS 84.A O no hydrogen 2.791 N/A ILE 90.A N SER 86.A O no hydrogen 2.966 N/A ARG 91.A N ALA 87.A O no hydrogen 3.061 N/A ARG 92.A N LEU 88.A O no hydrogen 3.344 N/A ARG 92.A NH2 ASN 89.A OD1 no hydrogen 3.060 N/A SER 93.A N ASN 89.A O no hydrogen 3.054 N/A SER 93.A OG ASN 89.A O no hydrogen 2.657 N/A SER 93.A OG ASN 89.A OD1 no hydrogen 3.215 N/A VAL 94.A N ILE 90.A O no hydrogen 3.079 N/A ASP 95.A N ARG 91.A O no hydrogen 3.211 N/A ALA 96.A N ARG 92.A O no hydrogen 3.068 N/A SER 97.A N SER 93.A O no hydrogen 2.886 N/A SER 97.A OG GLU 51.A OE1 no hydrogen 2.776 N/A SER 97.A OG GLU 51.A OE2 no hydrogen 3.416 N/A SER 97.A OG TYR 75.A OH no hydrogen 3.297 N/A SER 97.A OG SER 93.A O no hydrogen 3.122 N/A LEU 98.A N VAL 94.A O no hydrogen 2.853 N/A LYS 99.A N ASP 95.A O no hydrogen 3.281 N/A ARG 100.A N ALA 96.A O no hydrogen 3.062 N/A ARG 100.A NH2 TYR 75.A OH no hydrogen 2.994 N/A LEU 101.A N SER 97.A O no hydrogen 2.854 N/A GLY 102.A N LYS 99.A O no hydrogen 3.151 N/A THR 103.A N LEU 98.A O no hydrogen 3.430 N/A THR 103.A OG1 HIS 105.A O no hydrogen 3.482 N/A HIS 105.A ND1 ASP 104.A OD1 no hydrogen 2.798 N/A ILE 106.A N LYS 135.A O no hydrogen 2.862 N/A LEU 108.A N LEU 70.A O no hydrogen 2.949 N/A TYR 109.A N TYR 138.A O no hydrogen 2.947 N/A GLN 110.A N THR 72.A O no hydrogen 2.843 N/A GLN 110.A NE2 ASP 41.A OD1 no hydrogen 3.060 N/A GLN 110.A NE2 THR 72.A O no hydrogen 3.087 N/A PHE 111.A N GLY 140.A O no hydrogen 3.000 N/A HIS 112.A N HIS 112.A ND1 no hydrogen 2.997 N/A HIS 113.A ND1 VAL 114.A O no hydrogen 2.755 N/A VAL 114.A N ASN 143.A O no hydrogen 3.089 N/A ASP 117.A N ASP 115.A OD1 no hydrogen 2.938 N/A THR 118.A N ASP 115.A O no hydrogen 3.374 N/A THR 118.A OG1 ASP 115.A OD2 no hydrogen 2.638 N/A ILE 123.A N PRO 119.A O no hydrogen 3.147 N/A TRP 124.A N TRP 120.A O no hydrogen 2.852 N/A TRP 124.A NE1 ALA 152.A O no hydrogen 2.854 N/A GLN 125.A N ASP 121.A O no hydrogen 3.023 N/A ALA 126.A N GLU 122.A O no hydrogen 3.087 N/A MET 127.A N ILE 123.A O no hydrogen 3.001 N/A ASP 128.A N TRP 124.A O no hydrogen 2.747 N/A VAL 129.A N GLN 125.A O no hydrogen 2.941 N/A LEU 130.A N ALA 126.A O no hydrogen 3.434 N/A VAL 131.A N MET 127.A O no hydrogen 2.971 N/A ARG 132.A N ASP 128.A O no hydrogen 2.967 N/A GLN 133.A N VAL 129.A O no hydrogen 3.089 N/A GLY 134.A N VAL 131.A O no hydrogen 3.045 N/A LYS 135.A N LEU 130.A O no hydrogen 2.895 N/A LYS 135.A NZ GLN 133.A OE1 no hydrogen 2.887 N/A LEU 137.A N ILE 106.A O no hydrogen 3.154 N/A TYR 138.A N ASP 107.A O no hydrogen 2.788 N/A GLY 140.A N TYR 109.A O no hydrogen 2.916 N/A SER 141.A N SER 166.A O no hydrogen 2.840 N/A SER 141.A OG SER 166.A O no hydrogen 3.321 N/A SER 141.A OG GLU 167.A OE1 no hydrogen 2.526 N/A SER 142.A OG PHE 111.A O no hydrogen 2.979 N/A ASN 143.A N GLN 168.A O no hydrogen 2.933 N/A ASN 143.A ND2 HIS 112.A O no hydrogen 2.959 N/A PHE 144.A N GLU 167.A OE2 no hydrogen 2.927 N/A ALA 145.A N ASN 148.A OD1 no hydrogen 2.893 N/A ASN 148.A N ALA 145.A O no hydrogen 3.080 N/A ILE 149.A N ALA 145.A O no hydrogen 3.313 N/A ALA 150.A N GLY 146.A O no hydrogen 3.122 N/A GLN 151.A N TRP 147.A O no hydrogen 2.950 N/A ALA 152.A N ASN 148.A O no hydrogen 2.909 N/A ASN 153.A N ILE 149.A O no hydrogen 3.047 N/A ASN 153.A ND2 LEU 164.A O no hydrogen 3.053 N/A GLU 154.A N ALA 150.A O no hydrogen 3.027 N/A THR 155.A N GLN 151.A O no hydrogen 3.137 N/A THR 155.A OG1 GLN 151.A O no hydrogen 2.772 N/A ALA 156.A N ALA 152.A O no hydrogen 3.126 N/A ALA 157.A N ASN 153.A O no hydrogen 2.959 N/A ARG 158.A N GLU 154.A O no hydrogen 3.101 N/A HIS 159.A N ALA 156.A O no hydrogen 3.085 N/A GLY 160.A N ALA 157.A O no hydrogen 2.983 N/A ARG 161.A N ALA 156.A O no hydrogen 3.037 N/A LEU 164.A N ASN 153.A OD1 no hydrogen 2.952 N/A VAL 165.A N VAL 139.A O no hydrogen 2.961 N/A GLU 167.A N GLY 192.A O no hydrogen 2.893 N/A GLN 168.A N SER 141.A O no hydrogen 2.795 N/A CYS 169.A N ILE 194.A O no hydrogen 3.030 N/A TYR 171.A N TRP 196.A O no hydrogen 3.509 N/A TYR 171.A OH GLU 179.A OE2 no hydrogen 2.442 N/A ASN 172.A N GLU 175.A O no hydrogen 3.062 N/A ASN 172.A ND2 SER 197.A O no hydrogen 2.866 N/A ASN 172.A ND2 HIS 200.A ND1 no hydrogen 3.341 N/A GLU 175.A N ASN 172.A OD1 no hydrogen 2.689 N/A ARG 176.A NE GLU 179.A OE1 no hydrogen 3.125 N/A ARG 176.A NH1 ASP 284.A OD1 no hydrogen 2.995 N/A ARG 176.A NH1 PHE 287.A O no hydrogen 2.627 N/A ARG 176.A NH2 GLU 179.A OE1 no hydrogen 3.413 N/A ARG 176.A NH2 GLU 179.A OE2 no hydrogen 3.510 N/A ARG 176.A NH2 ASP 284.A OD1 no hydrogen 3.296 N/A ARG 177.A N GLU 175.A OE2 no hydrogen 3.315 N/A ARG 177.A NE GLU 175.A OE2 no hydrogen 2.709 N/A ARG 177.A NH1 GLU 175.A OE1 no hydrogen 2.853 N/A ARG 177.A NH1 GLU 175.A OE2 no hydrogen 3.443 N/A GLU 179.A N ARG 176.A O no hydrogen 2.802 N/A MET 180.A N ARG 177.A O no hydrogen 3.066 N/A VAL 183.A N ALA 178.A O no hydrogen 3.001 N/A ALA 185.A N GLU 181.A O no hydrogen 2.944 N/A ALA 186.A N VAL 182.A O no hydrogen 2.854 N/A ARG 187.A N VAL 183.A O no hydrogen 2.955 N/A GLU 188.A N PRO 184.A O no hydrogen 2.983 N/A TYR 189.A N ALA 185.A O no hydrogen 3.019 N/A TYR 189.A OH GLU 154.A OE1 no hydrogen 2.665 N/A GLY 190.A N ARG 187.A O no hydrogen 3.242 N/A LEU 191.A N ALA 186.A O no hydrogen 2.794 N/A GLY 192.A N VAL 165.A O no hydrogen 2.829 N/A VAL 193.A N GLY 250.A O no hydrogen 3.226 N/A ILE 194.A N GLU 167.A O no hydrogen 2.856 N/A ALA 195.A N GLY 253.A O no hydrogen 3.040 N/A TRP 196.A N CYS 169.A O no hydrogen 2.902 N/A HIS 200.A N SER 197.A O no hydrogen 3.050 N/A GLY 201.A N SER 197.A OG no hydrogen 3.235 N/A GLY 202.A N LEU 199.A O no hydrogen 3.272 N/A LEU 203.A N HIS 200.A O no hydrogen 3.200 N/A LEU 204.A N LEU 199.A O no hydrogen 2.943 N/A GLY 205.A N GLY 202.A O no hydrogen 2.767 N/A ILE 208.A N GLU 227.A OE1 no hydrogen 2.934 N/A ARG 209.A N GLU 227.A OE2 no hydrogen 3.081 N/A ARG 209.A NH1 ASP 231.A OD1 no hydrogen 2.986 N/A ARG 209.A NH2 ASP 231.A OD1 no hydrogen 2.984 N/A ARG 209.A NH2 ASP 231.A OD2 no hydrogen 3.122 N/A LYS 210.A N GLY 206.A O no hydrogen 3.156 N/A GLU 211.A N ALA 207.A O no hydrogen 3.220 N/A GLN 212.A N ILE 208.A O no hydrogen 3.030 N/A GLN 219.A N ASP 216.A OD2 no hydrogen 3.005 N/A ARG 220.A N ASP 216.A O no hydrogen 2.906 N/A ARG 220.A NH1 GLU 211.A OE2 no hydrogen 2.822 N/A ARG 220.A NH2 GLU 211.A OE2 no hydrogen 2.905 N/A GLU 221.A N PRO 217.A O no hydrogen 3.063 N/A GLN 222.A N GLN 218.A O no hydrogen 3.249 N/A GLN 222.A NE2 ILE 286.A O no hydrogen 2.698 N/A ILE 223.A N GLN 219.A O no hydrogen 3.062 N/A GLN 224.A N ARG 220.A O no hydrogen 2.840 N/A GLN 224.A NE2 GLN 224.A O no hydrogen 3.555 N/A GLN 224.A NE2 ASP 228.A OD1 no hydrogen 2.810 N/A ARG 225.A N GLU 221.A O no hydrogen 2.979 N/A TYR 226.A N GLN 222.A O no hydrogen 2.984 N/A TYR 226.A OH LEU 204.A O no hydrogen 3.314 N/A TYR 226.A OH PRO 237.A O no hydrogen 2.655 N/A GLU 227.A N ILE 223.A O no hydrogen 2.812 N/A ASP 228.A N GLN 224.A O no hydrogen 2.709 N/A LEU 229.A N ARG 225.A O no hydrogen 2.882 N/A LEU 230.A N TYR 226.A O no hydrogen 3.148 N/A ASP 231.A N GLU 227.A O no hydrogen 3.084 N/A LYS 232.A N ASP 228.A O no hydrogen 3.128 N/A HIS 233.A N LEU 229.A O no hydrogen 3.228 N/A HIS 233.A N LEU 230.A O no hydrogen 3.302 N/A GLY 234.A N ASP 231.A O no hydrogen 3.210 N/A LEU 235.A N LEU 230.A O no hydrogen 2.957 N/A GLU 239.A N GLU 236.A O no hydrogen 3.073 N/A VAL 240.A N GLU 236.A O no hydrogen 3.104 N/A ALA 241.A N PRO 237.A O no hydrogen 3.161 N/A ALA 243.A N GLU 239.A O no hydrogen 2.979 N/A TRP 244.A N VAL 240.A O no hydrogen 2.746 N/A LEU 246.A N LEU 242.A O no hydrogen 3.201 N/A THR 247.A N TRP 244.A O no hydrogen 3.056 N/A THR 247.A OG1 TRP 244.A O no hydrogen 2.607 N/A ARG 248.A N LEU 245.A O no hydrogen 2.943 N/A ARG 248.A NE TYR 171.A OH no hydrogen 3.114 N/A VAL 251.A N ARG 248.A O no hydrogen 3.143 N/A THR 252.A N VAL 193.A O no hydrogen 2.757 N/A THR 252.A OG1 VAL 193.A O no hydrogen 3.405 N/A GLY 253.A N VAL 193.A O no hydrogen 3.444 N/A ILE 255.A N ALA 195.A O no hydrogen 3.084 N/A VAL 256.A N VAL 17.A O no hydrogen 2.842 N/A ARG 259.A N GLN 263.A OE1 no hydrogen 2.795 N/A ARG 259.A NH1 THR 20.A O no hydrogen 2.972 N/A GLN 263.A N THR 260.A OG1 no hydrogen 3.014 N/A LEU 264.A N THR 260.A O no hydrogen 2.829 N/A ALA 265.A N ALA 261.A O no hydrogen 2.821 N/A SER 266.A N ASP 262.A O no hydrogen 3.161 N/A SER 266.A OG GLU 239.A OE1 no hydrogen 2.998 N/A ALA 267.A N GLN 263.A O no hydrogen 3.111 N/A ALA 267.A N LEU 264.A O no hydrogen 2.823 N/A VAL 268.A N LEU 264.A O no hydrogen 2.909 N/A ARG 269.A N ALA 265.A O no hydrogen 3.004 N/A ALA 270.A N SER 266.A O no hydrogen 3.034 N/A ALA 271.A N ALA 267.A O no hydrogen 3.118 N/A ALA 271.A N VAL 268.A O no hydrogen 3.051 N/A GLU 272.A N ARG 269.A O no hydrogen 2.938 N/A LEU 273.A N ALA 270.A O no hydrogen 3.412 N/A VAL 279.A N THR 276.A OG1 no hydrogen 3.254 N/A LEU 280.A N THR 276.A O no hydrogen 2.998 N/A THR 281.A N ASP 277.A O no hydrogen 2.857 N/A THR 281.A OG1 ASP 277.A O no hydrogen 2.607 N/A ALA 282.A N GLU 278.A O no hydrogen 3.006 N/A LEU 283.A N VAL 279.A O no hydrogen 2.728 N/A ASP 284.A N LEU 280.A O no hydrogen 2.872 N/A GLU 285.A N THR 281.A O no hydrogen 2.947 N/A ILE 286.A N ALA 282.A O no hydrogen 2.927 N/A PHE 287.A N LEU 283.A O no hydrogen 2.882 N/A SER 293.A N MET 180.A O no hydrogen 2.920 N/A GLU 295.A N GLU 295.A OE1 no hydrogen 2.864 N/A ALA 296.A N PRO 292.A O no hydrogen 2.839 N/A PHE 297.A N PRO 294.A O no hydrogen 3.136 N/A ALA 298.A N PRO 294.A O no hydrogen 2.949 N/A