Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gdi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH TRP 71.A O no hydrogen 3.372 N/A SER 5.A OG TYR 4.A O no hydrogen 2.557 N/A GLU 10.A N GLU 7.A O no hydrogen 2.856 N/A SER 14.A OG GLN 37.A OE1 no hydrogen 3.288 N/A PHE 20.A N ALA 108.A O no hydrogen 2.939 N/A VAL 22.A N LEU 106.A O no hydrogen 3.250 N/A ALA 23.A N TYR 33.A O no hydrogen 2.677 N/A VAL 24.A N CYS 104.A O no hydrogen 2.888 N/A SER 25.A N LYS 30.A O no hydrogen 2.942 N/A VAL 27.A N SER 25.A OG no hydrogen 3.199 N/A SER 28.A N SER 25.A OG no hydrogen 2.730 N/A SER 28.A OG SER 25.A OG no hydrogen 3.402 N/A GLY 29.A N SER 25.A O no hydrogen 2.897 N/A ILE 31.A N ALA 45.A O no hydrogen 2.708 N/A LEU 32.A N ALA 23.A O no hydrogen 2.863 N/A TYR 33.A N ALA 23.A O no hydrogen 3.315 N/A SER 35.A N ALA 21.A O no hydrogen 2.633 N/A SER 35.A OG ASN 36.A O no hydrogen 3.461 N/A GLN 37.A NE2 ASN 16.A O no hydrogen 2.890 N/A ILE 41.A N GLN 37.A O no hydrogen 2.984 N/A PHE 42.A N ALA 39.A O no hydrogen 3.207 N/A LYS 46.A N GLU 49.A OE2 no hydrogen 3.268 N/A PHE 47.A N GLY 29.A O no hydrogen 2.974 N/A GLU 49.A N LYS 46.A O no hydrogen 3.102 N/A PHE 50.A N PHE 47.A O no hydrogen 3.053 N/A LEU 51.A N VAL 48.A O no hydrogen 3.049 N/A ALA 52.A N ARG 79.A O no hydrogen 2.947 N/A ASP 55.A N ALA 52.A O no hydrogen 2.909 N/A PHE 59.A N ASP 55.A O no hydrogen 2.877 N/A HIS 60.A N VAL 56.A O no hydrogen 3.099 N/A SER 61.A N SER 57.A O no hydrogen 3.089 N/A TYR 62.A N VAL 58.A O no hydrogen 3.069 N/A THR 63.A N HIS 60.A O no hydrogen 3.211 N/A THR 63.A OG1 PHE 59.A O no hydrogen 2.534 N/A THR 63.A OG1 HIS 60.A O no hydrogen 3.215 N/A THR 64.A OG1 HIS 60.A O no hydrogen 2.764 N/A THR 64.A OG1 SER 61.A O no hydrogen 2.819 N/A LYS 67.A N THR 64.A O no hydrogen 2.899 N/A LYS 67.A NZ SER 61.A O no hydrogen 2.725 N/A TRP 71.A N LEU 97.A O no hydrogen 3.334 N/A SER 75.A OG THR 94.A OG1 no hydrogen 2.788 N/A PHE 76.A N MET 93.A O no hydrogen 2.986 N/A CYS 78.A N PHE 91.A O no hydrogen 3.009 N/A CYS 78.A SG ASP 55.A O no hydrogen 3.741 N/A CYS 78.A SG PHE 77.A O no hydrogen 3.530 N/A ARG 79.A N ASP 55.A OD2 no hydrogen 3.233 N/A ARG 79.A NE ASP 55.A OD2 no hydrogen 3.017 N/A ARG 79.A NH1 ASP 154.A OD2 no hydrogen 2.974 N/A ARG 79.A NH2 ASP 55.A OD1 no hydrogen 2.946 N/A ARG 79.A NH2 ASP 55.A OD2 no hydrogen 3.535 N/A ARG 79.A NH2 ASP 154.A OD1 no hydrogen 2.936 N/A ARG 79.A NH2 ASP 154.A OD2 no hydrogen 3.320 N/A VAL 80.A N GLN 89.A O no hydrogen 3.101 N/A SER 81.A N PHE 50.A O no hydrogen 2.746 N/A SER 81.A OG GLY 83.A O no hydrogen 3.521 N/A SER 81.A OG ARG 87.A O no hydrogen 3.122 N/A GLN 89.A N VAL 80.A O no hydrogen 3.099 N/A GLN 89.A NE2 ILE 41.A O no hydrogen 3.234 N/A PHE 91.A N CYS 78.A O no hydrogen 2.746 N/A ARG 92.A N GLU 109.A O no hydrogen 2.723 N/A MET 93.A N PHE 76.A O no hydrogen 2.832 N/A THR 94.A N LEU 107.A O no hydrogen 3.008 N/A THR 94.A OG1 SER 75.A OG no hydrogen 2.788 N/A TYR 96.A N LEU 105.A O no hydrogen 2.728 N/A LEU 97.A N PRO 69.A O no hydrogen 3.430 N/A VAL 98.A N CYS 103.A O no hydrogen 3.400 N/A VAL 100.A N GLN 101.A O no hydrogen 2.602 N/A CYS 103.A N VAL 98.A O no hydrogen 2.660 N/A CYS 103.A SG VAL 98.A O no hydrogen 3.263 N/A CYS 104.A N VAL 24.A O no hydrogen 3.148 N/A CYS 104.A SG TYR 96.A O no hydrogen 3.748 N/A CYS 104.A SG LEU 105.A O no hydrogen 3.602 N/A LEU 105.A N TYR 96.A O no hydrogen 2.706 N/A LEU 106.A N VAL 22.A O no hydrogen 2.907 N/A LEU 107.A N THR 94.A O no hydrogen 3.045 N/A ALA 108.A N PHE 20.A O no hydrogen 2.902 N/A GLU 109.A N ARG 92.A O no hydrogen 2.771 N/A ARG 110.A N ASP 18.A O no hydrogen 2.949 N/A ARG 110.A NE GLN 89.A OE1 no hydrogen 3.102 N/A ARG 110.A NH2 GLN 89.A OE1 no hydrogen 3.524 N/A VAL 111.A N PRO 90.A O no hydrogen 3.121 N/A SER 113.A OG GLU 235.A O no hydrogen 2.393 N/A GLY 114.A N PRO 146.A O no hydrogen 3.071 N/A TYR 115.A N SER 113.A OG no hydrogen 3.282 N/A TYR 115.A OH LEU 147.A O no hydrogen 2.828 N/A GLU 116.A N SER 113.A O no hydrogen 3.176 N/A ARG 119.A NE GLU 235.A OE2 no hydrogen 2.837 N/A ARG 119.A NH2 GLU 235.A OE1 no hydrogen 3.417 N/A ARG 119.A NH2 GLU 235.A OE2 no hydrogen 2.784 N/A ILE 120.A N GLY 114.A O no hydrogen 2.963 N/A LYS 124.A N PRO 121.A O no hydrogen 2.754 N/A ARG 125.A N PRO 122.A O no hydrogen 3.442 N/A PHE 127.A N HIS 226.A O no hydrogen 2.998 N/A THR 128.A N ASP 141.A OD1 no hydrogen 2.604 N/A THR 129.A N GLY 224.A O no hydrogen 2.983 N/A THR 130.A N ALA 139.A O no hydrogen 3.045 N/A HIS 131.A N ILE 222.A O no hydrogen 2.889 N/A HIS 131.A NE2 HIS 176.A NE2 no hydrogen 3.158 N/A THR 132.A N LEU 136.A O no hydrogen 3.315 N/A THR 132.A OG1 ASN 134.A OD1 no hydrogen 2.593 N/A THR 132.A OG1 LEU 136.A O no hydrogen 3.304 N/A CYS 135.A N THR 132.A O no hydrogen 2.793 N/A CYS 135.A SG PRO 133.A O no hydrogen 3.621 N/A LEU 136.A N ASN 134.A OD1 no hydrogen 3.145 N/A PHE 137.A N THR 158.A O no hydrogen 3.079 N/A GLN 138.A N THR 130.A O no hydrogen 2.711 N/A ALA 139.A N THR 130.A O no hydrogen 3.467 N/A ASP 141.A N THR 128.A O no hydrogen 3.146 N/A ARG 143.A NE ASP 141.A OD2 no hydrogen 2.882 N/A ALA 144.A N ASP 141.A O no hydrogen 2.869 N/A VAL 145.A N GLU 142.A O no hydrogen 3.308 N/A LEU 147.A N ALA 144.A O no hydrogen 2.954 N/A LEU 148.A N ALA 144.A O no hydrogen 2.772 N/A LEU 148.A N VAL 145.A O no hydrogen 3.368 N/A GLY 149.A N VAL 145.A O no hydrogen 2.927 N/A TYR 150.A OH GLN 163.A OE1 no hydrogen 3.052 N/A LEU 151.A N ASP 154.A OD2 no hydrogen 2.862 N/A ASP 154.A N LEU 151.A O no hydrogen 2.746 N/A LEU 155.A N PRO 152.A O no hydrogen 3.227 N/A ILE 156.A N PRO 152.A O no hydrogen 3.128 N/A GLU 157.A N PHE 137.A O no hydrogen 3.077 N/A THR 158.A N LEU 155.A O no hydrogen 3.185 N/A THR 158.A OG1 LEU 155.A O no hydrogen 2.937 N/A VAL 160.A N CYS 135.A O no hydrogen 2.911 N/A VAL 162.A N PRO 159.A O no hydrogen 3.338 N/A GLN 163.A N VAL 160.A O no hydrogen 3.150 N/A LEU 164.A N LEU 161.A O no hydrogen 3.184 N/A HIS 165.A N ARG 193.A O no hydrogen 3.108 N/A ASP 168.A N HIS 165.A O no hydrogen 2.829 N/A ARG 169.A NE LEU 161.A O no hydrogen 2.759 N/A ARG 169.A NE LEU 164.A O no hydrogen 3.217 N/A ARG 169.A NH2 VAL 162.A O no hydrogen 3.003 N/A ARG 169.A NH2 LEU 164.A O no hydrogen 3.222 N/A MET 172.A N ARG 169.A O no hydrogen 2.803 N/A LEU 173.A N PRO 170.A O no hydrogen 3.062 N/A ILE 175.A N LEU 171.A O no hydrogen 2.986 N/A HIS 176.A N MET 172.A O no hydrogen 2.995 N/A HIS 176.A ND1 MET 172.A O no hydrogen 2.665 N/A HIS 176.A NE2 HIS 131.A NE2 no hydrogen 3.158 N/A LYS 177.A N LEU 173.A O no hydrogen 3.277 N/A LYS 178.A N ALA 174.A O no hydrogen 3.115 N/A ILE 179.A N ILE 175.A O no hydrogen 2.940 N/A LEU 180.A N HIS 176.A O no hydrogen 3.079 N/A GLN 181.A N LYS 177.A O no hydrogen 3.156 N/A ALA 182.A N LYS 178.A O no hydrogen 2.614 N/A GLY 183.A N LEU 180.A O no hydrogen 3.200 N/A GLN 185.A N ALA 182.A O no hydrogen 3.030 N/A PHE 187.A N TRP 208.A O no hydrogen 3.145 N/A TYR 189.A N THR 206.A O no hydrogen 2.784 N/A ILE 192.A N LEU 204.A O no hydrogen 3.156 N/A ARG 193.A N ASP 168.A OD1 no hydrogen 2.876 N/A ARG 193.A NE ASP 168.A OD1 no hydrogen 3.464 N/A PHE 194.A N ILE 202.A O no hydrogen 3.042 N/A ARG 195.A N GLN 163.A O no hydrogen 2.699 N/A ARG 195.A NH1 VAL 162.A O no hydrogen 3.273 N/A THR 196.A N GLU 200.A O no hydrogen 2.755 N/A THR 196.A OG1 GLU 200.A O no hydrogen 2.883 N/A ARG 197.A N LEU 148.A O no hydrogen 2.846 N/A GLY 199.A N THR 196.A O no hydrogen 3.056 N/A ILE 202.A N PHE 194.A O no hydrogen 2.993 N/A THR 203.A N VAL 230.A O no hydrogen 2.910 N/A LEU 204.A N ILE 192.A O no hydrogen 2.753 N/A ASP 205.A N LYS 227.A O no hydrogen 2.845 N/A THR 206.A N TYR 189.A O no hydrogen 2.929 N/A SER 207.A N ARG 225.A O no hydrogen 3.196 N/A TRP 208.A N PHE 187.A O no hydrogen 2.835 N/A SER 209.A N ILE 223.A O no hydrogen 2.927 N/A SER 209.A OG GLY 184.A O no hydrogen 2.962 N/A PHE 211.A N PHE 221.A O no hydrogen 2.970 N/A ASN 213.A N LYS 218.A O no hydrogen 2.923 N/A SER 216.A N ASN 213.A OD1 no hydrogen 2.821 N/A ARG 217.A N ASN 213.A O no hydrogen 2.687 N/A ARG 217.A NH1 VAL 268.A O no hydrogen 2.935 N/A LYS 218.A N SER 216.A OG no hydrogen 3.225 N/A LYS 218.A NZ MET 265.A O no hydrogen 2.774 N/A SER 220.A N PHE 211.A O no hydrogen 2.908 N/A ILE 222.A N HIS 131.A O no hydrogen 2.776 N/A ILE 223.A N SER 209.A O no hydrogen 2.849 N/A GLY 224.A N THR 129.A O no hydrogen 2.836 N/A ARG 225.A N SER 207.A O no hydrogen 3.040 N/A HIS 226.A N PHE 127.A O no hydrogen 2.696 N/A LYS 227.A N ASP 205.A O no hydrogen 2.970 N/A LYS 227.A NZ ASP 205.A OD1 no hydrogen 3.428 N/A VAL 228.A N ARG 125.A O no hydrogen 3.070 N/A ARG 229.A N THR 203.A O no hydrogen 2.849 N/A VAL 230.A N THR 203.A O no hydrogen 3.344 N/A ASN 234.A N GLU 200.A OE2 no hydrogen 2.513 N/A PHE 238.A N ASP 236.A OD1 no hydrogen 2.960 N/A ALA 239.A N ASP 236.A OD1 no hydrogen 3.176 N/A THR 248.A OG1 LYS 247.A O no hydrogen 2.763 N/A GLN 254.A N HIS 250.A O no hydrogen 3.066 N/A LEU 256.A N SER 252.A O no hydrogen 2.887 N/A THR 257.A N VAL 253.A O no hydrogen 2.814 N/A THR 257.A OG1 VAL 253.A O no hydrogen 2.788 N/A GLU 258.A N GLN 254.A O no hydrogen 3.031 N/A GLN 259.A N GLU 255.A O no hydrogen 3.196 N/A ILE 260.A N LEU 256.A O no hydrogen 3.051 N/A ILE 260.A N THR 257.A O no hydrogen 2.924 N/A HIS 261.A N THR 257.A O no hydrogen 2.942 N/A ARG 262.A N GLU 258.A O no hydrogen 2.994 N/A LEU 263.A N GLN 259.A O no hydrogen 3.366 N/A LEU 264.A N ILE 260.A O no hydrogen 2.960 N/A MET 265.A N ARG 262.A O no hydrogen 3.117 N/A GLN 266.A N LEU 263.A O no hydrogen 3.364 N/A VAL 268.A N ARG 217.A O no hydrogen 2.728 N/A