Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fsg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N TYR 11.A O no hydrogen 2.864 N/A THR 5.A N ILE 9.A O no hydrogen 2.997 N/A THR 5.A OG1 SER 7.A OG no hydrogen 2.716 N/A THR 5.A OG1 ILE 9.A O no hydrogen 3.449 N/A ARG 6.A N GLU 78.A OE1 no hydrogen 2.762 N/A SER 7.A N GLU 78.A OE2 no hydrogen 3.106 N/A SER 7.A OG THR 5.A OG1 no hydrogen 2.716 N/A SER 7.A OG GLU 78.A OE2 no hydrogen 2.954 N/A ASN 8.A N THR 5.A O no hydrogen 3.069 N/A ILE 9.A N THR 5.A OG1 no hydrogen 2.997 N/A SER 10.A N SER 57.A OG no hydrogen 2.820 N/A SER 10.A OG ASP 51.A OD2 no hydrogen 3.542 N/A TYR 11.A N TYR 3.A O no hydrogen 2.897 N/A PHE 12.A N TYR 49.A O no hydrogen 3.089 N/A ILE 14.A N ARG 47.A O no hydrogen 2.981 N/A ILE 20.A N GLN 46.A O no hydrogen 2.881 N/A ILE 21.A N ILE 86.A O no hydrogen 2.813 N/A PHE 22.A N ILE 48.A O no hydrogen 2.782 N/A LEU 23.A N TYR 88.A O no hydrogen 2.785 N/A HIS 24.A ND1 GLY 25.A O no hydrogen 2.863 N/A SER 27.A OG GLU 175.A OE2 no hydrogen 2.590 N/A LEU 28.A N GLY 25.A O no hydrogen 3.028 N/A LYS 30.A N ASP 51.A OD1 no hydrogen 2.813 N/A LYS 30.A NZ GLU 2.A OE1 no hydrogen 3.135 N/A LYS 30.A NZ SER 10.A OG no hydrogen 3.094 N/A LYS 30.A NZ ASP 51.A OD2 no hydrogen 2.488 N/A GLN 31.A N ASP 29.A OD1 no hydrogen 3.002 N/A SER 32.A N ASP 29.A O no hydrogen 2.957 N/A SER 32.A OG ASP 29.A O no hydrogen 2.776 N/A THR 33.A OG1 LYS 30.A O no hydrogen 3.179 N/A PHE 35.A N THR 33.A O no hydrogen 3.049 N/A PHE 36.A N THR 33.A O no hydrogen 3.007 N/A LEU 39.A N PHE 36.A O no hydrogen 2.952 N/A VAL 42.A N LEU 39.A O no hydrogen 3.254 N/A TYR 45.A N VAL 42.A O no hydrogen 2.861 N/A GLN 46.A N THR 18.A O no hydrogen 2.943 N/A GLN 46.A NE2 SER 13.A OG no hydrogen 3.006 N/A ARG 47.A N ILE 14.A O no hydrogen 2.702 N/A ARG 47.A NE GLU 37.A OE2 no hydrogen 2.950 N/A ARG 47.A NH1 GLU 37.A OE1 no hydrogen 2.883 N/A ARG 47.A NH2 TYR 45.A O no hydrogen 2.977 N/A ILE 48.A N ILE 20.A O no hydrogen 2.904 N/A TYR 49.A N PHE 12.A O no hydrogen 3.005 N/A TYR 49.A OH GLU 37.A OE2 no hydrogen 2.664 N/A LEU 50.A N PHE 22.A O no hydrogen 3.313 N/A ASP 51.A N SER 10.A O no hydrogen 2.876 N/A LEU 52.A N HIS 24.A NE2 no hydrogen 2.864 N/A GLY 54.A N SER 57.A O no hydrogen 3.005 N/A GLY 54.A N ASP 58.A O no hydrogen 3.245 N/A ASN 56.A N ASP 51.A OD2 no hydrogen 2.985 N/A ASN 56.A ND2 GLU 2.A OE1 no hydrogen 2.613 N/A ASN 56.A ND2 GLU 2.A OE2 no hydrogen 2.922 N/A SER 57.A OG ASP 51.A O no hydrogen 2.749 N/A SER 65.A N ASN 186.A O no hydrogen 2.913 N/A SER 65.A OG TYR 92.A OH no hydrogen 2.509 N/A SER 65.A OG TYR 187.A O no hydrogen 2.662 N/A ASN 67.A N THR 64.A OG1 no hydrogen 3.129 N/A VAL 68.A N THR 64.A O no hydrogen 2.978 N/A LEU 69.A N SER 65.A O no hydrogen 2.829 N/A GLU 70.A N ASP 66.A O no hydrogen 3.060 N/A THR 71.A N ASN 67.A O no hydrogen 2.953 N/A THR 71.A OG1 ASN 67.A O no hydrogen 2.823 N/A LEU 72.A N VAL 68.A O no hydrogen 2.854 N/A ILE 73.A N LEU 69.A O no hydrogen 2.744 N/A GLU 74.A N GLU 70.A O no hydrogen 2.912 N/A ALA 75.A N THR 71.A O no hydrogen 2.823 N/A ILE 76.A N LEU 72.A O no hydrogen 2.933 N/A GLU 77.A N ILE 73.A O no hydrogen 3.048 N/A GLU 78.A N GLU 74.A O no hydrogen 3.054 N/A ILE 79.A N ALA 75.A O no hydrogen 3.089 N/A ILE 80.A N ILE 76.A O no hydrogen 2.842 N/A GLY 81.A N GLU 77.A O no hydrogen 2.810 N/A ARG 83.A N ILE 80.A O no hydrogen 3.189 N/A PHE 85.A N GLN 107.A O no hydrogen 2.862 N/A ILE 86.A N PRO 19.A O no hydrogen 2.780 N/A LEU 87.A N GLY 110.A O no hydrogen 2.926 N/A TYR 88.A N ILE 21.A O no hydrogen 3.068 N/A TYR 88.A OH THR 114.A OG1 no hydrogen 2.667 N/A GLY 89.A N PHE 112.A O no hydrogen 2.981 N/A HIS 90.A N LEU 23.A O no hydrogen 3.138 N/A HIS 90.A ND1 THR 114.A OG1 no hydrogen 2.624 N/A SER 91.A N THR 114.A O no hydrogen 3.249 N/A SER 91.A N CYS 115.A O no hydrogen 3.111 N/A SER 91.A OG HIS 239.A NE2 no hydrogen 3.421 N/A TYR 92.A N SER 91.A OG no hydrogen 2.745 N/A TYR 92.A OH SER 65.A OG no hydrogen 2.509 N/A TYR 95.A N SER 91.A O no hydrogen 3.245 N/A TYR 95.A OH GLU 192.A OE1 no hydrogen 2.472 N/A LEU 96.A N TYR 92.A O no hydrogen 3.016 N/A ALA 97.A N GLY 93.A O no hydrogen 2.867 N/A GLN 98.A N GLY 94.A O no hydrogen 2.980 N/A GLN 98.A NE2 GLY 94.A O no hydrogen 2.812 N/A GLN 98.A NE2 VAL 117.A O no hydrogen 3.096 N/A ALA 99.A N TYR 95.A O no hydrogen 3.055 N/A ILE 100.A N LEU 96.A O no hydrogen 2.829 N/A ALA 101.A N ALA 97.A O no hydrogen 2.966 N/A PHE 102.A N GLN 98.A O no hydrogen 2.810 N/A HIS 103.A N ALA 99.A O no hydrogen 3.007 N/A HIS 103.A ND1 ALA 99.A O no hydrogen 2.998 N/A LEU 104.A N ILE 100.A O no hydrogen 2.734 N/A GLN 107.A N LEU 104.A O no hydrogen 3.183 N/A THR 108.A N LEU 104.A O no hydrogen 3.102 N/A THR 108.A OG1 LEU 104.A O no hydrogen 2.912 N/A LEU 109.A N PHE 85.A O no hydrogen 2.791 N/A VAL 111.A N PRO 203.A O no hydrogen 2.977 N/A PHE 112.A N LEU 87.A O no hydrogen 2.961 N/A LEU 113.A N LYS 205.A O no hydrogen 2.849 N/A THR 114.A N GLY 89.A O no hydrogen 2.920 N/A THR 114.A OG1 TYR 88.A OH no hydrogen 2.667 N/A THR 114.A OG1 HIS 90.A ND1 no hydrogen 2.624 N/A CYS 115.A SG GLY 238.A O no hydrogen 3.682 N/A CYS 115.A SG HIS 239.A O no hydrogen 3.620 N/A VAL 117.A N SER 91.A O no hydrogen 3.184 N/A THR 119.A OG1 GLU 218.A OE1 no hydrogen 2.372 N/A ALA 120.A N GLU 192.A OE1 no hydrogen 2.973 N/A SER 123.A N ASP 121.A OD1 no hydrogen 2.935 N/A SER 123.A OG ASP 121.A OD1 no hydrogen 2.589 N/A LYS 124.A N ASP 121.A O no hydrogen 2.901 N/A ARG 125.A N HIS 122.A O no hydrogen 3.183 N/A ARG 125.A NE THR 119.A O no hydrogen 2.824 N/A ARG 125.A NH1 VAL 213.A O no hydrogen 2.999 N/A ARG 125.A NH2 ALA 120.A O no hydrogen 2.681 N/A LEU 126.A N GLU 218.A OE2 no hydrogen 2.924 N/A GLY 128.A N ASP 211.A O no hydrogen 2.897 N/A HIS 130.A NE2 ASN 153.A O no hydrogen 2.654 N/A ASN 132.A ND2 LEU 151.A O no hydrogen 2.917 N/A ILE 133.A N VAL 154.A O no hydrogen 2.838 N/A GLU 135.A N ILE 156.A O no hydrogen 2.863 N/A GLU 136.A N ILE 156.A O no hydrogen 3.380 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.861 N/A TYR 146.A N ASN 143.A O no hydrogen 2.936 N/A PHE 147.A N LYS 144.A O no hydrogen 3.031 N/A PHE 150.A N TYR 146.A O no hydrogen 3.108 N/A LEU 151.A N PHE 147.A O no hydrogen 2.971 N/A SER 152.A N ALA 148.A O no hydrogen 2.737 N/A SER 152.A OG ALA 148.A O no hydrogen 3.388 N/A SER 152.A OG ASP 149.A O no hydrogen 2.619 N/A ASN 153.A ND2 PHE 150.A O no hydrogen 3.563 N/A VAL 154.A N ASP 243.A OD1 no hydrogen 2.804 N/A ILE 155.A N ASP 243.A OD1 no hydrogen 2.926 N/A ILE 156.A N ILE 133.A O no hydrogen 2.960 N/A ASN 157.A ND2 GLU 135.A OE1 no hydrogen 2.725 N/A ASN 158.A N GLU 136.A OE1 no hydrogen 2.889 N/A ASN 158.A ND2 GLU 136.A OE1 no hydrogen 2.983 N/A ASN 158.A ND2 ASP 137.A O no hydrogen 3.474 N/A GLN 159.A NE2 ASP 163.A OD1 no hydrogen 2.747 N/A ALA 160.A N ASN 157.A O no hydrogen 3.101 N/A ALA 160.A N ASN 157.A OD1 no hydrogen 2.872 N/A TRP 161.A N ASN 157.A O no hydrogen 3.216 N/A HIS 162.A N ASN 158.A O no hydrogen 2.984 N/A ASP 163.A N GLN 159.A O no hydrogen 2.933 N/A TYR 164.A N ALA 160.A O no hydrogen 2.810 N/A GLN 165.A N TRP 161.A O no hydrogen 3.053 N/A GLN 165.A NE2 ASN 143.A OD1 no hydrogen 2.634 N/A ASN 166.A N HIS 162.A O no hydrogen 2.964 N/A LEU 167.A N ASP 163.A O no hydrogen 2.932 N/A ILE 168.A N TYR 164.A O no hydrogen 2.816 N/A ILE 169.A N TYR 164.A O no hydrogen 3.161 N/A GLY 171.A N ILE 168.A O no hydrogen 3.163 N/A LEU 172.A N ILE 168.A O no hydrogen 3.183 N/A GLN 173.A N ILE 169.A O no hydrogen 2.954 N/A GLN 173.A NE2 TYR 146.A OH no hydrogen 3.315 N/A LYS 174.A N GLY 171.A O no hydrogen 3.032 N/A LYS 174.A NZ ASN 56.A OD1 no hydrogen 3.281 N/A GLU 175.A N GLY 171.A O no hydrogen 2.843 N/A ASP 176.A N GLY 54.A O no hydrogen 2.915 N/A PHE 179.A N ASP 176.A OD1 no hydrogen 2.868 N/A ILE 180.A N ASP 176.A O no hydrogen 3.030 N/A ASP 181.A N LYS 177.A O no hydrogen 2.944 N/A GLN 182.A N THR 178.A O no hydrogen 2.926 N/A LEU 183.A N PHE 179.A O no hydrogen 2.837 N/A GLN 184.A N ILE 180.A O no hydrogen 2.968 N/A ASN 185.A N GLN 182.A O no hydrogen 2.865 N/A ASN 186.A N LEU 183.A O no hydrogen 2.910 N/A PHE 189.A N TYR 95.A OH no hydrogen 2.880 N/A GLU 192.A N PHE 189.A O no hydrogen 3.043 N/A LYS 194.A N PHE 191.A O no hydrogen 3.015 N/A LEU 195.A N PHE 191.A O no hydrogen 3.253 N/A LYS 196.A N GLU 192.A O no hydrogen 3.202 N/A LYS 196.A N GLU 193.A O no hydrogen 3.179 N/A LYS 196.A NZ THR 119.A OG1 no hydrogen 2.812 N/A LYS 196.A NZ GLU 192.A OE2 no hydrogen 3.466 N/A ASN 197.A N LYS 194.A O no hydrogen 3.174 N/A ILE 198.A N LYS 194.A O no hydrogen 2.781 N/A ASN 199.A ND2 GLU 227.A OE2 no hydrogen 2.846 N/A PHE 204.A N ASN 228.A O no hydrogen 3.252 N/A LYS 205.A N VAL 111.A O no hydrogen 2.943 N/A LYS 205.A NZ HIS 251.A ND1 no hydrogen 2.942 N/A LYS 205.A NZ HIS 251.A O no hydrogen 3.267 N/A ILE 206.A N GLU 230.A O no hydrogen 2.962 N/A ARG 209.A N LEU 234.A O no hydrogen 3.066 N/A ASN 210.A N THR 237.A O no hydrogen 2.871 N/A ASN 210.A ND2 LYS 129.A O no hydrogen 2.812 N/A ASP 211.A N GLY 208.A O no hydrogen 3.385 N/A GLN 212.A N GLN 212.A OE1 no hydrogen 2.665 N/A GLN 212.A NE2 SER 152.A O no hydrogen 3.049 N/A VAL 213.A N ASP 211.A OD1 no hydrogen 2.778 N/A VAL 214.A N ASP 211.A OD1 no hydrogen 2.824 N/A GLN 219.A N GLN 219.A OE1 no hydrogen 2.761 N/A GLN 219.A NE2 PRO 116.A O no hydrogen 2.823 N/A GLN 219.A NE2 VAL 214.A O no hydrogen 3.059 N/A LEU 220.A N TYR 216.A O no hydrogen 3.015 N/A LYS 221.A N GLN 217.A O no hydrogen 3.055 N/A LEU 222.A N GLN 219.A O no hydrogen 3.094 N/A ILE 223.A N LEU 220.A O no hydrogen 2.892 N/A HIS 225.A NE2 LYS 196.A O no hydrogen 2.763 N/A ASN 226.A N ILE 223.A O no hydrogen 3.169 N/A GLU 227.A N ASN 199.A OD1 no hydrogen 3.005 N/A ASN 228.A ND2 TYR 200.A O no hydrogen 3.511 N/A GLY 229.A N ASN 226.A O no hydrogen 2.896 N/A GLU 230.A N PHE 204.A O no hydrogen 2.857 N/A VAL 232.A N ILE 206.A O no hydrogen 2.839 N/A LEU 234.A N VAL 207.A O no hydrogen 3.253 N/A THR 237.A OG1 ASN 235.A O no hydrogen 2.800 N/A GLY 238.A N ASP 243.A OD2 no hydrogen 2.778 N/A HIS 239.A ND1 ASP 211.A OD2 no hydrogen 2.810 N/A ASP 243.A N ASN 240.A O no hydrogen 3.221 N/A GLN 244.A N LEU 241.A O no hydrogen 2.974 N/A GLN 244.A NE2 THR 237.A OG1 no hydrogen 3.113 N/A GLU 246.A N GLU 246.A OE1 no hydrogen 2.766 N/A VAL 248.A N GLN 244.A O no hydrogen 3.137 N/A GLY 249.A N ARG 245.A O no hydrogen 3.158 N/A PHE 250.A N GLU 246.A O no hydrogen 2.907 N/A HIS 251.A N ALA 247.A O no hydrogen 2.937 N/A PHE 252.A N VAL 248.A O no hydrogen 2.841 N/A ASP 253.A N GLY 249.A O no hydrogen 3.131 N/A LEU 254.A N PHE 250.A O no hydrogen 3.019 N/A PHE 255.A N HIS 251.A O no hydrogen 2.925 N/A LEU 256.A N PHE 252.A O no hydrogen 3.003 N/A ASP 257.A N ASP 253.A O no hydrogen 2.989 N/A GLU 258.A N LEU 254.A O no hydrogen 3.101 N/A LEU 259.A N PHE 255.A O no hydrogen 3.336 N/A ASN 260.A N LEU 256.A O no hydrogen 2.856 N/A SER 261.A N ASP 257.A O no hydrogen 3.197 N/A SER 261.A N GLU 258.A O no hydrogen 3.327 N/A