Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2zdg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A N ASP 75.A OD2 no hydrogen 3.027 N/A ARG 2.A NE ASP 33.A OD2 no hydrogen 2.951 N/A ARG 2.A NH1 ASP 33.A OD1 no hydrogen 3.337 N/A ARG 2.A NH1 ASP 33.A OD2 no hydrogen 3.303 N/A VAL 3.A N PRO 31.A O no hydrogen 2.815 N/A LEU 4.A N VAL 76.A O no hydrogen 3.019 N/A LEU 5.A N ASP 33.A O no hydrogen 3.001 N/A ILE 6.A N PHE 78.A O no hydrogen 3.066 N/A ALA 7.A N ALA 35.A O no hydrogen 3.022 N/A GLY 8.A N SER 17.A OG no hydrogen 2.955 N/A GLY 9.A N ILE 37.A O no hydrogen 2.834 N/A SER 11.A OG HIS 82.A O no hydrogen 2.776 N/A GLU 13.A N SER 11.A OG no hydrogen 3.326 N/A HIS 14.A N SER 11.A O no hydrogen 3.080 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.573 N/A SER 17.A N GLU 13.A O no hydrogen 2.976 N/A SER 17.A OG GLY 8.A O no hydrogen 3.568 N/A SER 17.A OG LEU 80.A O no hydrogen 2.532 N/A LEU 18.A N HIS 14.A O no hydrogen 3.276 N/A LEU 19.A N GLU 15.A O no hydrogen 3.045 N/A SER 20.A N VAL 16.A O no hydrogen 2.930 N/A SER 20.A OG VAL 16.A O no hydrogen 3.458 N/A ALA 21.A N SER 17.A O no hydrogen 2.863 N/A GLU 22.A N LEU 18.A O no hydrogen 2.968 N/A GLY 23.A N LEU 19.A O no hydrogen 3.170 N/A VAL 24.A N SER 20.A O no hydrogen 2.915 N/A LEU 25.A N ALA 21.A O no hydrogen 2.857 N/A HIS 27.A N VAL 24.A O no hydrogen 3.094 N/A HIS 27.A ND1 GLY 23.A O no hydrogen 3.005 N/A ILE 28.A N VAL 24.A O no hydrogen 2.789 N/A THR 32.A OG1 PHE 30.A O no hydrogen 2.883 N/A ASP 33.A N VAL 3.A O no hydrogen 2.893 N/A ALA 35.A N LEU 5.A O no hydrogen 2.797 N/A VAL 36.A N LEU 44.A O no hydrogen 3.001 N/A ILE 37.A N ALA 7.A O no hydrogen 2.874 N/A ALA 38.A N ARG 42.A O no hydrogen 2.668 N/A GLN 39.A N ALA 58.A O no hydrogen 2.942 N/A GLY 41.A N ALA 38.A O no hydrogen 2.885 N/A ARG 42.A N ASP 40.A OD1 no hydrogen 3.164 N/A TRP 43.A N HIS 63.A O no hydrogen 2.530 N/A LEU 44.A N VAL 36.A O no hydrogen 2.729 N/A LEU 50.A N GLY 46.A O no hydrogen 3.216 N/A THR 51.A N GLU 47.A O no hydrogen 2.842 N/A THR 51.A OG1 GLU 47.A O no hydrogen 3.059 N/A ALA 52.A N LYS 48.A O no hydrogen 2.925 N/A LEU 53.A N ALA 49.A O no hydrogen 2.906 N/A GLU 54.A N LEU 50.A O no hydrogen 3.129 N/A ALA 55.A N THR 51.A O no hydrogen 3.134 N/A LYS 56.A N ALA 52.A O no hydrogen 3.033 N/A LYS 56.A N LEU 53.A O no hydrogen 2.864 N/A GLY 61.A N ASP 40.A OD2 no hydrogen 3.269 N/A GLU 62.A N TRP 43.A O no hydrogen 2.846 N/A HIS 63.A N TRP 43.A O no hydrogen 2.904 N/A TRP 71.A N LEU 69.A O no hydrogen 2.985 N/A GLU 72.A N GLU 72.A OE1 no hydrogen 2.413 N/A ARG 73.A N SER 70.A O no hydrogen 3.020 N/A ARG 73.A NH1 TYR 74.A OH no hydrogen 3.312 N/A TYR 74.A N TRP 71.A O no hydrogen 3.057 N/A TYR 74.A OH ASP 33.A OD2 no hydrogen 2.888 N/A ASP 75.A N ARG 2.A O no hydrogen 2.950 N/A VAL 77.A N PRO 101.A O no hydrogen 2.944 N/A PHE 78.A N LEU 4.A O no hydrogen 2.649 N/A LEU 80.A N ILE 6.A O no hydrogen 2.850 N/A GLY 83.A N GLU 87.A OE2 no hydrogen 2.837 N/A PHE 85.A N ASP 88.A OD1 no hydrogen 2.731 N/A GLU 87.A N GLY 83.A O no hydrogen 2.721 N/A THR 90.A N ASP 88.A OD2 no hydrogen 2.989 N/A THR 90.A OG1 ASP 88.A OD2 no hydrogen 3.004 N/A GLY 93.A N GLY 89.A O no hydrogen 3.049 N/A PHE 94.A N THR 90.A O no hydrogen 3.027 N/A LEU 95.A N VAL 91.A O no hydrogen 2.868 N/A GLU 96.A N GLN 92.A O no hydrogen 2.808 N/A LEU 97.A N GLY 93.A O no hydrogen 3.151 N/A LEU 98.A N PHE 94.A O no hydrogen 3.051 N/A GLY 99.A N GLU 96.A O no hydrogen 2.862 N/A LYS 100.A N LEU 95.A O no hydrogen 3.094 N/A LYS 100.A NZ TYR 74.A O no hydrogen 3.086 N/A TYR 102.A OH GLU 96.A OE1 no hydrogen 2.891 N/A VAL 103.A N VAL 77.A O no hydrogen 2.868 N/A SER 110.A N GLY 106.A O no hydrogen 2.867 N/A SER 110.A OG ALA 105.A O no hydrogen 3.300 N/A SER 110.A OG GLY 106.A O no hydrogen 2.887 N/A ALA 111.A N VAL 107.A O no hydrogen 2.850 N/A LEU 112.A N ALA 108.A O no hydrogen 2.793 N/A CYS 113.A N ALA 109.A O no hydrogen 2.793 N/A CYS 113.A SG ALA 109.A O no hydrogen 3.401 N/A MET 114.A N SER 110.A O no hydrogen 3.068 N/A ASP 115.A N LEU 112.A O no hydrogen 3.186 N/A LYS 116.A N ALA 155.A O no hydrogen 2.903 N/A ASP 117.A N ASP 115.A OD1 no hydrogen 2.792 N/A LEU 118.A N ASP 115.A OD1 no hydrogen 2.883 N/A SER 119.A N ASP 115.A O no hydrogen 3.034 N/A SER 119.A OG ASP 115.A O no hydrogen 2.693 N/A LYS 120.A NZ LYS 116.A O no hydrogen 3.549 N/A LYS 120.A NZ ASN 264.A O no hydrogen 3.408 N/A ARG 121.A N ASP 117.A O no hydrogen 2.939 N/A ARG 121.A NH1 ASP 117.A OD1 no hydrogen 3.000 N/A ARG 121.A NH1 ASP 117.A OD2 no hydrogen 3.272 N/A VAL 122.A N LEU 118.A O no hydrogen 2.975 N/A LEU 123.A N SER 119.A O no hydrogen 2.859 N/A ALA 124.A N LYS 120.A O no hydrogen 2.825 N/A GLN 125.A N ARG 121.A O no hydrogen 3.192 N/A ALA 126.A N VAL 122.A O no hydrogen 3.115 N/A ALA 126.A N LEU 123.A O no hydrogen 3.210 N/A GLY 127.A N ALA 124.A O no hydrogen 3.079 N/A VAL 128.A N LEU 123.A O no hydrogen 2.901 N/A TRP 133.A NE1 ASP 117.A OD1 no hydrogen 2.914 N/A VAL 134.A N VAL 188.A O no hydrogen 2.893 N/A VAL 136.A N ALA 186.A O no hydrogen 2.810 N/A LYS 138.A N GLU 184.A O no hydrogen 2.912 N/A GLU 140.A N ARG 137.A O no hydrogen 2.970 N/A PHE 150.A N VAL 166.A O no hydrogen 2.771 N/A PHE 151.A N GLU 189.A O no hydrogen 2.981 N/A VAL 152.A N SER 164.A O no hydrogen 2.861 N/A LYS 153.A N VAL 187.A O no hydrogen 3.115 N/A LYS 153.A NZ GLU 189.A OE1 no hydrogen 3.222 N/A LYS 153.A NZ GLU 189.A OE2 no hydrogen 3.099 N/A ALA 155.A N LYS 185.A O no hydrogen 2.889 N/A ASN 156.A N ASP 183.A OD2 no hydrogen 2.468 N/A ASN 156.A ND2 ASP 115.A OD2 no hydrogen 2.798 N/A SER 159.A OG GLU 13.A OE2 no hydrogen 3.055 N/A SER 159.A OG GLY 158.A O no hydrogen 2.444 N/A VAL 161.A N GLY 158.A O no hydrogen 3.289 N/A ILE 163.A N SER 160.A O no hydrogen 3.305 N/A SER 164.A N VAL 152.A O no hydrogen 3.029 N/A ARG 165.A NE GLU 167.A OE2 no hydrogen 2.603 N/A VAL 166.A N PHE 150.A O no hydrogen 2.891 N/A ASP 171.A N ARG 168.A O no hydrogen 3.051 N/A LEU 172.A N PHE 169.A O no hydrogen 2.841 N/A ALA 175.A N ASP 171.A O no hydrogen 3.322 N/A LEU 176.A N LEU 172.A O no hydrogen 3.016 N/A ALA 177.A N GLU 173.A O no hydrogen 3.152 N/A LEU 178.A N ALA 174.A O no hydrogen 3.134 N/A ALA 179.A N ALA 175.A O no hydrogen 2.985 N/A PHE 180.A N LEU 176.A O no hydrogen 2.688 N/A ARG 181.A N LEU 178.A O no hydrogen 2.947 N/A TYR 182.A N ALA 179.A O no hydrogen 3.039 N/A ASP 183.A N ALA 179.A O no hydrogen 3.238 N/A GLU 184.A N ASP 183.A OD1 no hydrogen 2.944 N/A LYS 185.A N ASP 183.A OD1 no hydrogen 3.303 N/A LYS 185.A NZ ASP 115.A OD1 no hydrogen 3.174 N/A LYS 185.A NZ ASP 115.A OD2 no hydrogen 2.949 N/A LYS 185.A NZ ASP 117.A OD2 no hydrogen 3.214 N/A ALA 186.A N VAL 136.A O no hydrogen 2.918 N/A VAL 187.A N LYS 153.A O no hydrogen 2.908 N/A VAL 188.A N VAL 134.A O no hydrogen 2.891 N/A GLU 189.A N PHE 151.A O no hydrogen 3.075 N/A LYS 190.A N PRO 132.A O no hydrogen 2.988 N/A ALA 191.A N PRO 149.A O no hydrogen 3.046 N/A ARG 196.A N LEU 256.A O no hydrogen 2.902 N/A ARG 196.A NE GLU 215.A OE2 no hydrogen 2.878 N/A ARG 196.A NH2 GLU 215.A OE1 no hydrogen 2.773 N/A ARG 196.A NH2 GLU 215.A OE2 no hydrogen 3.344 N/A ARG 196.A NH2 PRO 224.A O no hydrogen 3.124 N/A LEU 198.A N PHE 254.A O no hydrogen 2.888 N/A GLU 199.A N GLY 214.A O no hydrogen 2.881 N/A VAL 200.A N VAL 252.A O no hydrogen 3.019 N/A GLY 201.A N SER 211.A OG no hydrogen 3.008 N/A VAL 202.A N ALA 250.A O no hydrogen 2.855 N/A LEU 203.A N GLU 209.A O no hydrogen 3.038 N/A GLY 204.A N GLY 248.A O no hydrogen 2.933 N/A ASN 205.A ND2 LEU 299.A O no hydrogen 3.033 N/A VAL 206.A N VAL 246.A O no hydrogen 2.856 N/A PHE 207.A N ASN 205.A O no hydrogen 2.779 N/A GLU 209.A N LEU 203.A O no hydrogen 2.782 N/A SER 211.A N GLY 201.A O no hydrogen 2.849 N/A SER 211.A OG GLY 201.A O no hydrogen 3.386 N/A SER 211.A OG PRO 212.A O no hydrogen 3.027 N/A GLY 214.A N GLU 199.A O no hydrogen 2.742 N/A GLU 215.A N LEU 220.A O no hydrogen 3.130 N/A VAL 216.A N GLU 197.A O no hydrogen 2.949 N/A ARG 217.A N GLU 218.A O no hydrogen 3.091 N/A LEU 220.A N GLU 215.A O no hydrogen 2.797 N/A ALA 223.A N VAL 213.A O no hydrogen 2.920 N/A LEU 225.A N ALA 223.A O no hydrogen 2.739 N/A THR 229.A N ASP 226.A OD2 no hydrogen 2.725 N/A THR 229.A OG1 ASP 226.A OD1 no hydrogen 3.347 N/A THR 229.A OG1 ASP 226.A OD2 no hydrogen 2.576 N/A GLN 230.A N ASP 226.A O no hydrogen 3.126 N/A GLN 230.A NE2 GLN 234.A OE1 no hydrogen 2.826 N/A GLU 231.A N PRO 227.A O no hydrogen 3.129 N/A THR 232.A N GLY 228.A O no hydrogen 3.100 N/A THR 232.A OG1 GLY 228.A O no hydrogen 3.099 N/A VAL 233.A N THR 229.A O no hydrogen 3.026 N/A GLN 234.A N GLN 230.A O no hydrogen 3.376 N/A GLN 234.A NE2 SER 211.A O no hydrogen 2.766 N/A GLU 235.A N GLU 231.A O no hydrogen 2.956 N/A LEU 236.A N THR 232.A O no hydrogen 2.708 N/A ALA 237.A N VAL 233.A O no hydrogen 2.946 N/A LEU 238.A N GLN 234.A O no hydrogen 2.974 N/A LYS 239.A N GLU 235.A O no hydrogen 3.039 N/A LYS 239.A NZ ALA 126.A O no hydrogen 2.960 N/A ALA 240.A N LEU 236.A O no hydrogen 2.973 N/A TYR 241.A N ALA 237.A O no hydrogen 2.999 N/A TYR 241.A OH GLY 204.A O no hydrogen 2.711 N/A LYS 242.A N LEU 238.A O no hydrogen 2.968 N/A VAL 243.A N LYS 239.A O no hydrogen 2.880 N/A LEU 244.A N ALA 240.A O no hydrogen 2.999 N/A GLY 245.A N LYS 242.A O no hydrogen 3.066 N/A VAL 246.A N TYR 241.A O no hydrogen 3.240 N/A ARG 247.A NH1 LEU 299.A O no hydrogen 3.368 N/A ARG 247.A NH1 THR 302.A OXT no hydrogen 2.947 N/A ARG 247.A NH2 THR 302.A OXT no hydrogen 2.908 N/A GLY 248.A N ASN 205.A OD1 no hydrogen 2.839 N/A MET 249.A N ARG 247.A O no hydrogen 3.057 N/A ALA 250.A N VAL 202.A O no hydrogen 3.234 N/A ARG 251.A N ASN 267.A O no hydrogen 2.933 N/A ARG 251.A NE ASP 253.A OD1 no hydrogen 2.964 N/A ARG 251.A NH1 ASP 253.A OD1 no hydrogen 3.517 N/A ARG 251.A NH1 ASP 253.A OD2 no hydrogen 2.914 N/A VAL 252.A N VAL 200.A O no hydrogen 2.848 N/A ASP 253.A N GLU 265.A O no hydrogen 2.871 N/A PHE 254.A N LEU 198.A O no hydrogen 2.775 N/A PHE 255.A N TYR 262.A O no hydrogen 2.891 N/A LEU 256.A N ARG 196.A O no hydrogen 2.840 N/A ALA 257.A N GLU 260.A O no hydrogen 2.997 N/A GLU 260.A N ALA 257.A O no hydrogen 2.832 N/A TYR 262.A N PHE 255.A O no hydrogen 3.055 N/A LEU 263.A N PRO 129.A O no hydrogen 2.884 N/A ASN 264.A N ASP 253.A O no hydrogen 2.781 N/A GLU 265.A N ASP 253.A O no hydrogen 3.392 N/A ASN 267.A N ARG 251.A O no hydrogen 2.803 N/A ASN 267.A ND2 ARG 251.A O no hydrogen 2.967 N/A ASN 267.A ND2 ASP 253.A OD2 no hydrogen 2.911 N/A ILE 269.A N GLU 87.A OE1 no hydrogen 3.086 N/A PHE 272.A N SER 20.A OG no hydrogen 2.687 N/A THR 273.A N SER 276.A OG no hydrogen 2.844 N/A THR 273.A OG1 THR 275.A OG1 no hydrogen 3.202 N/A THR 273.A OG1 SER 276.A OG no hydrogen 2.787 N/A THR 275.A N THR 273.A OG1 no hydrogen 3.260 N/A THR 275.A OG1 THR 273.A OG1 no hydrogen 3.202 N/A SER 276.A N THR 273.A O no hydrogen 2.842 N/A SER 276.A OG THR 273.A O no hydrogen 3.338 N/A SER 276.A OG THR 273.A OG1 no hydrogen 2.787 N/A TYR 278.A OH VAL 202.A O no hydrogen 2.797 N/A ARG 280.A N SER 276.A O no hydrogen 3.061 N/A LEU 281.A N MET 277.A O no hydrogen 2.757 N/A PHE 282.A N TYR 278.A O no hydrogen 3.215 N/A GLU 283.A N PRO 279.A O no hydrogen 2.865 N/A ALA 284.A N ARG 280.A O no hydrogen 2.979 N/A GLY 285.A N PHE 282.A O no hydrogen 2.876 N/A GLY 286.A N GLU 283.A O no hydrogen 3.066 N/A VAL 287.A N PHE 282.A O no hydrogen 2.811 N/A TYR 289.A OH PHE 272.A O no hydrogen 2.656 N/A LEU 292.A N ALA 288.A O no hydrogen 2.803 N/A LEU 293.A N TYR 289.A O no hydrogen 3.180 N/A ARG 294.A N PRO 290.A O no hydrogen 2.986 N/A ARG 295.A N GLU 291.A O no hydrogen 2.891 N/A ARG 295.A NH2 GLU 209.A OE1 no hydrogen 2.688 N/A LEU 296.A N LEU 292.A O no hydrogen 3.049 N/A VAL 297.A N LEU 293.A O no hydrogen 3.181 N/A GLU 298.A N ARG 294.A O no hydrogen 2.967 N/A LEU 299.A N ARG 295.A O no hydrogen 2.744 N/A ALA 300.A N LEU 296.A O no hydrogen 2.929 N/A LEU 301.A N GLU 298.A O no hydrogen 3.139 N/A THR 302.A N LEU 299.A O no hydrogen 3.178 N/A THR 302.A OG1 THR 302.A O no hydrogen 2.739 N/A