Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fsg_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A N TYR 10.A O no hydrogen 2.815 N/A THR 4.A N ILE 8.A O no hydrogen 2.979 N/A THR 4.A OG1 SER 6.A OG no hydrogen 2.644 N/A ARG 5.A N GLU 78.A OE1 no hydrogen 3.010 N/A ARG 5.A N GLU 78.A OE2 no hydrogen 3.183 N/A SER 6.A OG THR 4.A OG1 no hydrogen 2.644 N/A ASN 7.A N THR 4.A O no hydrogen 2.597 N/A ILE 8.A N THR 4.A OG1 no hydrogen 3.074 N/A SER 9.A N SER 57.A OG no hydrogen 2.939 N/A SER 9.A OG ASP 51.A OD2 no hydrogen 3.551 N/A TYR 10.A N TYR 2.A O no hydrogen 3.008 N/A PHE 11.A N TYR 49.A O no hydrogen 2.963 N/A ILE 13.A N ARG 47.A O no hydrogen 2.984 N/A ILE 19.A N GLN 46.A O no hydrogen 2.783 N/A ILE 20.A N ILE 86.A O no hydrogen 2.803 N/A PHE 21.A N ILE 48.A O no hydrogen 2.804 N/A LEU 22.A N TYR 88.A O no hydrogen 2.938 N/A HIS 23.A ND1 GLY 24.A O no hydrogen 2.765 N/A SER 26.A OG GLU 175.A OE2 no hydrogen 2.643 N/A LEU 27.A N GLY 24.A O no hydrogen 2.975 N/A LYS 29.A N ASP 51.A OD1 no hydrogen 2.860 N/A LYS 29.A NZ GLU 1.A OE2 no hydrogen 2.622 N/A LYS 29.A NZ SER 9.A OG no hydrogen 3.208 N/A LYS 29.A NZ ASP 51.A OD2 no hydrogen 2.776 N/A GLN 30.A N ASP 28.A OD1 no hydrogen 2.972 N/A SER 31.A N ASP 28.A O no hydrogen 2.883 N/A SER 31.A OG ASP 28.A O no hydrogen 2.654 N/A THR 32.A OG1 LYS 29.A O no hydrogen 3.029 N/A CYS 33.A N LYS 29.A O no hydrogen 2.891 N/A LEU 34.A N GLN 30.A O no hydrogen 3.007 N/A PHE 35.A N THR 32.A O no hydrogen 3.120 N/A PHE 36.A N THR 32.A O no hydrogen 2.957 N/A GLU 37.A N CYS 33.A O no hydrogen 3.155 N/A SER 40.A OG GLU 37.A O no hydrogen 2.308 N/A TYR 45.A N VAL 42.A O no hydrogen 2.860 N/A GLN 46.A N THR 17.A O no hydrogen 2.922 N/A GLN 46.A NE2 SER 12.A OG no hydrogen 3.224 N/A ARG 47.A N ILE 13.A O no hydrogen 2.697 N/A ARG 47.A NE GLU 37.A OE1 no hydrogen 3.440 N/A ARG 47.A NE GLU 37.A OE2 no hydrogen 2.804 N/A ARG 47.A NH1 GLU 37.A OE1 no hydrogen 2.761 N/A ARG 47.A NH2 TYR 45.A O no hydrogen 3.205 N/A ILE 48.A N ILE 19.A O no hydrogen 2.757 N/A TYR 49.A N PHE 11.A O no hydrogen 2.957 N/A TYR 49.A OH GLU 37.A OE2 no hydrogen 2.362 N/A LEU 50.A N PHE 21.A O no hydrogen 3.361 N/A ASP 51.A N SER 9.A O no hydrogen 2.929 N/A LEU 52.A N HIS 23.A NE2 no hydrogen 2.993 N/A GLY 54.A N ASP 58.A O no hydrogen 3.025 N/A ASN 56.A N ASP 51.A OD2 no hydrogen 2.927 N/A ASN 56.A ND2 GLU 1.A OE2 no hydrogen 2.940 N/A SER 57.A OG ASP 51.A O no hydrogen 2.631 N/A ASP 58.A N ASN 7.A O no hydrogen 3.080 N/A SER 65.A N ASN 186.A O no hydrogen 2.915 N/A SER 65.A OG TYR 92.A OH no hydrogen 2.795 N/A SER 65.A OG TYR 187.A O no hydrogen 2.466 N/A ASN 67.A N THR 64.A OG1 no hydrogen 3.225 N/A VAL 68.A N THR 64.A O no hydrogen 2.923 N/A LEU 69.A N SER 65.A O no hydrogen 2.918 N/A GLU 70.A N ASP 66.A O no hydrogen 3.098 N/A THR 71.A N ASN 67.A O no hydrogen 3.026 N/A THR 71.A OG1 ASN 67.A O no hydrogen 2.724 N/A LEU 72.A N VAL 68.A O no hydrogen 2.975 N/A ILE 73.A N LEU 69.A O no hydrogen 2.833 N/A GLU 74.A N GLU 70.A O no hydrogen 2.866 N/A ALA 75.A N THR 71.A O no hydrogen 2.786 N/A ILE 76.A N LEU 72.A O no hydrogen 2.823 N/A GLU 77.A N ILE 73.A O no hydrogen 3.178 N/A GLU 78.A N GLU 74.A O no hydrogen 2.917 N/A ILE 79.A N ALA 75.A O no hydrogen 2.897 N/A ILE 80.A N ILE 76.A O no hydrogen 2.715 N/A GLY 81.A N GLU 77.A O no hydrogen 2.807 N/A ARG 83.A N ILE 80.A O no hydrogen 2.982 N/A ARG 83.A NH1 GLN 46.A OE1 no hydrogen 2.924 N/A ARG 83.A NH2 GLN 46.A OE1 no hydrogen 2.746 N/A PHE 85.A N GLN 107.A O no hydrogen 2.851 N/A ILE 86.A N PRO 18.A O no hydrogen 2.785 N/A LEU 87.A N GLY 110.A O no hydrogen 2.949 N/A TYR 88.A N ILE 20.A O no hydrogen 2.890 N/A TYR 88.A OH THR 114.A OG1 no hydrogen 2.772 N/A GLY 89.A N PHE 112.A O no hydrogen 2.962 N/A HIS 90.A N LEU 22.A O no hydrogen 2.973 N/A HIS 90.A ND1 THR 114.A OG1 no hydrogen 2.660 N/A SER 91.A N THR 114.A O no hydrogen 3.019 N/A SER 91.A OG HIS 239.A NE2 no hydrogen 2.612 N/A TYR 92.A OH SER 65.A OG no hydrogen 2.795 N/A GLY 94.A N SER 91.A O no hydrogen 2.698 N/A TYR 95.A N SER 91.A O no hydrogen 3.146 N/A TYR 95.A N TYR 92.A O no hydrogen 2.950 N/A TYR 95.A OH GLU 192.A OE2 no hydrogen 2.575 N/A LEU 96.A N TYR 92.A O no hydrogen 2.949 N/A ALA 97.A N GLY 93.A O no hydrogen 2.811 N/A GLN 98.A N GLY 94.A O no hydrogen 3.047 N/A GLN 98.A NE2 GLY 94.A O no hydrogen 3.042 N/A GLN 98.A NE2 VAL 117.A O no hydrogen 3.138 N/A ALA 99.A N TYR 95.A O no hydrogen 3.321 N/A ILE 100.A N LEU 96.A O no hydrogen 2.923 N/A ALA 101.A N ALA 97.A O no hydrogen 2.942 N/A PHE 102.A N GLN 98.A O no hydrogen 2.986 N/A HIS 103.A N ALA 99.A O no hydrogen 2.935 N/A LEU 104.A N ILE 100.A O no hydrogen 2.752 N/A GLN 107.A N LEU 104.A O no hydrogen 3.034 N/A GLN 107.A NE2 GLY 81.A O no hydrogen 2.934 N/A GLN 107.A NE2 ARG 83.A O no hydrogen 2.598 N/A THR 108.A N LYS 105.A O no hydrogen 3.370 N/A THR 108.A OG1 LEU 104.A O no hydrogen 2.873 N/A LEU 109.A N PHE 85.A O no hydrogen 2.819 N/A VAL 111.A N PRO 203.A O no hydrogen 2.969 N/A PHE 112.A N LEU 87.A O no hydrogen 2.737 N/A LEU 113.A N LYS 205.A O no hydrogen 2.822 N/A THR 114.A N GLY 89.A O no hydrogen 2.935 N/A THR 114.A OG1 TYR 88.A OH no hydrogen 2.772 N/A THR 114.A OG1 HIS 90.A ND1 no hydrogen 2.660 N/A CYS 115.A SG GLY 238.A O no hydrogen 3.814 N/A CYS 115.A SG HIS 239.A O no hydrogen 3.606 N/A VAL 117.A N SER 91.A O no hydrogen 3.199 N/A THR 119.A OG1 GLU 218.A OE1 no hydrogen 2.645 N/A ALA 120.A N GLU 192.A OE2 no hydrogen 2.813 N/A SER 123.A OG ASP 121.A OD2 no hydrogen 2.734 N/A LYS 124.A N ASP 121.A O no hydrogen 3.137 N/A ARG 125.A N HIS 122.A O no hydrogen 2.962 N/A ARG 125.A NE THR 119.A O no hydrogen 2.941 N/A ARG 125.A NE ALA 120.A O no hydrogen 3.398 N/A ARG 125.A NH1 VAL 213.A O no hydrogen 2.925 N/A ARG 125.A NH2 ALA 120.A O no hydrogen 2.922 N/A LEU 126.A N GLU 218.A OE2 no hydrogen 2.905 N/A GLY 128.A N ASP 211.A O no hydrogen 2.729 N/A HIS 130.A NE2 ASN 153.A O no hydrogen 2.805 N/A ASN 132.A ND2 LEU 151.A O no hydrogen 2.944 N/A ILE 133.A N VAL 154.A O no hydrogen 2.831 N/A GLU 135.A N ILE 156.A O no hydrogen 2.815 N/A GLU 136.A N ILE 156.A O no hydrogen 3.390 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.735 N/A TYR 146.A N ASN 143.A O no hydrogen 2.836 N/A PHE 147.A N LYS 144.A O no hydrogen 3.121 N/A PHE 150.A N TYR 146.A O no hydrogen 3.061 N/A LEU 151.A N PHE 147.A O no hydrogen 2.998 N/A SER 152.A N ALA 148.A O no hydrogen 2.938 N/A SER 152.A N ASP 149.A O no hydrogen 3.094 N/A SER 152.A OG.A ALA 148.A O no hydrogen 2.995 N/A SER 152.A OG.B ALA 148.A O no hydrogen 3.567 N/A SER 152.A OG.B ASP 149.A O no hydrogen 2.465 N/A ASN 153.A ND2 PHE 150.A O no hydrogen 3.564 N/A VAL 154.A N ASP 243.A OD1 no hydrogen 3.035 N/A ILE 155.A N ASP 243.A OD1 no hydrogen 3.067 N/A ILE 156.A N ILE 133.A O no hydrogen 2.848 N/A ASN 157.A ND2 GLU 135.A OE1 no hydrogen 2.870 N/A ASN 158.A N GLU 136.A OE1 no hydrogen 2.776 N/A ASN 158.A ND2 HIS 162.A NE2 no hydrogen 2.862 N/A GLN 159.A NE2 GLN 159.A O no hydrogen 3.612 N/A GLN 159.A NE2 ASP 163.A OD1 no hydrogen 3.024 N/A ALA 160.A N ASN 157.A OD1 no hydrogen 2.839 N/A TRP 161.A N ASN 157.A O no hydrogen 3.071 N/A HIS 162.A N ASN 158.A O no hydrogen 2.884 N/A ASP 163.A N GLN 159.A O no hydrogen 2.811 N/A TYR 164.A N ALA 160.A O no hydrogen 2.791 N/A TYR 164.A OH ASP 149.A OD2 no hydrogen 2.315 N/A GLN 165.A N TRP 161.A O no hydrogen 2.857 N/A GLN 165.A NE2 TRP 161.A O no hydrogen 3.273 N/A ASN 166.A N HIS 162.A O no hydrogen 2.846 N/A LEU 167.A N ASP 163.A O no hydrogen 2.854 N/A ILE 168.A N TYR 164.A O no hydrogen 2.997 N/A ILE 169.A N TYR 164.A O no hydrogen 3.376 N/A GLY 171.A N ILE 168.A O no hydrogen 3.160 N/A LEU 172.A N ILE 168.A O no hydrogen 3.285 N/A GLN 173.A N ILE 169.A O no hydrogen 2.878 N/A LYS 174.A N PRO 170.A O no hydrogen 3.136 N/A LYS 174.A N GLY 171.A O no hydrogen 3.125 N/A LYS 174.A NZ ASN 56.A OD1 no hydrogen 3.012 N/A GLU 175.A N GLY 171.A O no hydrogen 2.975 N/A ASP 176.A N GLY 54.A O no hydrogen 3.124 N/A PHE 179.A N ASP 176.A OD1 no hydrogen 3.127 N/A ILE 180.A N ASP 176.A O no hydrogen 2.891 N/A ASP 181.A N LYS 177.A O no hydrogen 3.011 N/A GLN 182.A N THR 178.A O no hydrogen 3.144 N/A GLN 182.A NE2 SER 63.A OG no hydrogen 2.986 N/A LEU 183.A N PHE 179.A O no hydrogen 2.816 N/A GLN 184.A N ILE 180.A O no hydrogen 2.906 N/A GLN 184.A NE2 ILE 180.A O no hydrogen 3.338 N/A ASN 185.A N GLN 182.A O no hydrogen 2.820 N/A ASN 186.A N LEU 183.A O no hydrogen 2.889 N/A PHE 189.A N TYR 95.A OH no hydrogen 2.803 N/A THR 190.A N ASP 66.A OD1 no hydrogen 3.178 N/A THR 190.A OG1 ASP 66.A OD1 no hydrogen 3.268 N/A THR 190.A OG1 ASP 66.A OD2 no hydrogen 3.040 N/A GLU 192.A N PHE 189.A O no hydrogen 3.188 N/A LYS 194.A N PHE 191.A O no hydrogen 3.225 N/A LEU 195.A N GLU 192.A O no hydrogen 2.901 N/A LYS 196.A N GLU 193.A O no hydrogen 3.250 N/A LYS 196.A NZ THR 119.A OG1 no hydrogen 2.715 N/A ASN 199.A ND2 GLU 227.A OE2 no hydrogen 2.491 N/A TYR 200.A OH GLN 98.A O no hydrogen 3.380 N/A PHE 204.A N ASN 228.A O no hydrogen 3.224 N/A LYS 205.A N VAL 111.A O no hydrogen 3.032 N/A LYS 205.A NZ HIS 251.A ND1 no hydrogen 2.865 N/A LYS 205.A NZ HIS 251.A O no hydrogen 3.182 N/A ILE 206.A N GLU 230.A O no hydrogen 2.948 N/A ARG 209.A N LEU 234.A O no hydrogen 2.894 N/A ASN 210.A N THR 237.A O no hydrogen 2.717 N/A ASN 210.A ND2 LYS 129.A O no hydrogen 3.102 N/A ASP 211.A N GLY 208.A O no hydrogen 3.320 N/A GLN 212.A N GLN 212.A OE1 no hydrogen 2.710 N/A GLN 212.A NE2 SER 152.A O no hydrogen 2.881 N/A VAL 213.A N ASP 211.A OD1 no hydrogen 2.906 N/A VAL 214.A N ASP 211.A OD1 no hydrogen 3.006 N/A GLN 219.A N GLN 219.A OE1 no hydrogen 2.668 N/A GLN 219.A NE2 PRO 116.A O no hydrogen 2.959 N/A GLN 219.A NE2 VAL 214.A O no hydrogen 2.973 N/A LEU 220.A N TYR 216.A O no hydrogen 2.944 N/A LYS 221.A N GLN 217.A O no hydrogen 3.083 N/A LEU 222.A N GLU 218.A O no hydrogen 3.123 N/A ILE 223.A N GLN 219.A O no hydrogen 3.228 N/A ILE 223.A N LEU 220.A O no hydrogen 3.174 N/A ASN 224.A N LEU 220.A O no hydrogen 3.195 N/A HIS 225.A N LYS 221.A O no hydrogen 3.386 N/A ASN 226.A N ILE 223.A O no hydrogen 3.054 N/A GLU 227.A N ASN 199.A OD1 no hydrogen 2.918 N/A GLY 229.A N ASN 226.A O no hydrogen 3.042 N/A GLU 230.A N PHE 204.A O no hydrogen 2.871 N/A VAL 232.A N ILE 206.A O no hydrogen 3.019 N/A LEU 234.A N VAL 207.A O no hydrogen 3.222 N/A THR 237.A OG1 ASN 235.A O no hydrogen 2.765 N/A GLY 238.A N ASP 243.A OD2 no hydrogen 2.784 N/A HIS 239.A ND1 ASP 211.A OD2 no hydrogen 2.773 N/A HIS 239.A NE2 SER 91.A OG no hydrogen 2.612 N/A ASP 243.A N ASN 240.A O no hydrogen 2.984 N/A GLN 244.A N LEU 241.A O no hydrogen 2.752 N/A GLN 244.A NE2 ARG 236.A O no hydrogen 3.269 N/A GLN 244.A NE2 THR 237.A OG1 no hydrogen 2.869 N/A VAL 248.A N GLN 244.A O no hydrogen 2.995 N/A GLY 249.A N ARG 245.A O no hydrogen 2.996 N/A PHE 250.A N GLU 246.A O no hydrogen 2.946 N/A HIS 251.A N ALA 247.A O no hydrogen 2.896 N/A PHE 252.A N VAL 248.A O no hydrogen 2.830 N/A PHE 252.A N GLY 249.A O no hydrogen 3.246 N/A ASP 253.A N GLY 249.A O no hydrogen 3.056 N/A LEU 254.A N PHE 250.A O no hydrogen 3.091 N/A PHE 255.A N HIS 251.A O no hydrogen 2.950 N/A LEU 256.A N PHE 252.A O no hydrogen 2.987 N/A ASP 257.A N ASP 253.A O no hydrogen 3.027 N/A GLU 258.A N LEU 254.A O no hydrogen 2.976 N/A LEU 259.A N PHE 255.A O no hydrogen 3.298 N/A LEU 259.A N LEU 256.A O no hydrogen 3.034 N/A ASN 260.A N LEU 256.A O no hydrogen 3.008 N/A ASN 260.A N ASP 257.A O no hydrogen 3.250 N/A