Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3fsi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N THR 1.A O no hydrogen 3.246 N/A GLN 8.A NE2 ASN 219.A OD1 no hydrogen 2.987 N/A ALA 9.A N PHE 6.A O no hydrogen 3.115 N/A TRP 10.A NE1 TRP 2.A O no hydrogen 3.139 N/A ALA 11.A N ALA 224.A O no hydrogen 2.896 N/A GLU 12.A N GLU 12.A OE2 no hydrogen 2.689 N/A THR 13.A N TRP 10.A O no hydrogen 3.118 N/A THR 13.A OG1 PRO 7.A O no hydrogen 2.723 N/A GLY 14.A N TRP 10.A O no hydrogen 2.736 N/A LEU 18.A N GLY 221.A O no hydrogen 2.781 N/A ALA 19.A N CYS 127.A O no hydrogen 2.699 N/A GLN 22.A N ALA 19.A O no hydrogen 3.156 N/A GLN 22.A NE2 ASP 176.A OD1 no hydrogen 2.741 N/A LEU 25.A N ARG 129.A O no hydrogen 2.895 N/A ILE 27.A N SER 134.A OG no hydrogen 2.810 N/A LYS 30.A N ARG 91.A O no hydrogen 2.946 N/A LYS 30.A NZ LYS 90.A O no hydrogen 2.997 N/A SER 33.A N LYS 30.A O no hydrogen 3.171 N/A SER 33.A OG LYS 30.A O no hydrogen 3.569 N/A SER 33.A OG ARG 91.A O no hydrogen 2.639 N/A ILE 38.A N ASN 72.A O no hydrogen 2.673 N/A GLN 40.A NE2 TYR 41.A O no hydrogen 2.965 N/A GLN 40.A NE2 LEU 75.A O no hydrogen 2.921 N/A ALA 47.A N SER 44.A OG no hydrogen 3.186 N/A ARG 48.A N SER 44.A O no hydrogen 3.083 N/A ARG 48.A NH1 MET 43.A O no hydrogen 3.148 N/A LEU 49.A N GLN 45.A O no hydrogen 2.868 N/A GLY 50.A N GLU 46.A O no hydrogen 3.108 N/A ILE 51.A N ALA 47.A O no hydrogen 2.931 N/A LYS 52.A N ARG 48.A O no hydrogen 2.795 N/A LYS 52.A NZ ASP 144.A OD2 no hydrogen 2.997 N/A HIS 54.A N ILE 51.A O no hydrogen 2.930 N/A ILE 55.A N ILE 51.A O no hydrogen 3.186 N/A GLN 56.A N LYS 52.A O no hydrogen 2.921 N/A ARG 57.A N PRO 53.A O no hydrogen 3.015 N/A LEU 58.A N HIS 54.A O no hydrogen 3.028 N/A LEU 59.A N ILE 55.A O no hydrogen 2.928 N/A ASP 60.A N GLN 56.A O no hydrogen 2.868 N/A GLN 61.A N ARG 57.A O no hydrogen 2.843 N/A GLY 62.A N LEU 59.A O no hydrogen 3.028 N/A ILE 63.A N LEU 58.A O no hydrogen 2.909 N/A LEU 64.A N LEU 58.A O no hydrogen 3.136 N/A VAL 65.A N THR 154.A O no hydrogen 2.945 N/A CYS 67.A N GLN 152.A O no hydrogen 3.095 N/A SER 69.A N GLN 152.A OE1 no hydrogen 2.836 N/A SER 69.A OG TRP 71.A O no hydrogen 3.494 N/A SER 69.A OG PRO 136.A O no hydrogen 2.727 N/A TRP 71.A N SER 69.A OG no hydrogen 3.004 N/A ASN 72.A N VAL 36.A O no hydrogen 2.956 N/A ASN 72.A ND2 ILE 38.A O no hydrogen 2.731 N/A THR 73.A N ALA 139.A O no hydrogen 3.138 N/A THR 73.A OG1 ALA 139.A O no hydrogen 3.537 N/A LEU 75.A N GLN 40.A OE1 no hydrogen 2.901 N/A LEU 76.A N VAL 82.A O no hydrogen 2.775 N/A TYR 79.A OH GLU 46.A OE2 no hydrogen 3.074 N/A GLN 83.A NE2 THR 73.A OG1 no hydrogen 2.778 N/A GLN 83.A NE2 PHE 138.A O no hydrogen 2.941 N/A ASP 84.A N PRO 74.A O no hydrogen 2.831 N/A ARG 86.A N ASP 84.A OD1 no hydrogen 3.234 N/A ARG 86.A NE ASP 84.A OD1 no hydrogen 2.923 N/A ARG 86.A NH2 ASP 84.A OD2 no hydrogen 2.950 N/A VAL 88.A N LEU 85.A O no hydrogen 3.005 N/A ASN 89.A N LEU 85.A O no hydrogen 2.780 N/A ASN 89.A ND2 GLY 161.A O no hydrogen 3.196 N/A LYS 90.A N ARG 86.A O no hydrogen 3.058 N/A LYS 90.A NZ GLU 87.A OE2 no hydrogen 3.034 N/A ARG 91.A N VAL 88.A O no hydrogen 2.934 N/A ARG 91.A NE THR 34.A O no hydrogen 3.278 N/A ARG 91.A NH1 GLU 87.A O no hydrogen 2.788 N/A ARG 91.A NH1 GLU 87.A OE1 no hydrogen 3.039 N/A VAL 92.A N ASN 89.A O no hydrogen 3.206 N/A GLU 93.A N PRO 28.A O no hydrogen 3.046 N/A THR 98.A OG1 GLU 171.A OE2 no hydrogen 2.731 N/A ASN 104.A N ASN 101.A OD1 no hydrogen 2.940 N/A LEU 105.A N ASN 101.A O no hydrogen 2.988 N/A LEU 106.A N PRO 102.A O no hydrogen 2.910 N/A SER 107.A N ASN 104.A O no hydrogen 3.019 N/A SER 107.A OG ASN 104.A O no hydrogen 2.441 N/A GLY 108.A N LEU 105.A O no hydrogen 3.157 N/A LEU 109.A N LEU 106.A O no hydrogen 3.215 N/A SER 112.A OG HIS 113.A ND1 no hydrogen 2.678 N/A HIS 113.A N PRO 110.A O no hydrogen 2.968 N/A HIS 113.A ND1 SER 112.A OG no hydrogen 2.678 N/A HIS 113.A NE2 ASP 186.A O no hydrogen 2.962 N/A GLN 114.A NE2 PRO 111.A O no hydrogen 2.831 N/A TRP 115.A N ALA 200.A O no hydrogen 3.061 N/A TYR 116.A N GLN 233.A O no hydrogen 2.787 N/A THR 117.A N LEU 198.A O no hydrogen 2.965 N/A THR 117.A OG1 THR 210.A OG1 no hydrogen 2.814 N/A VAL 118.A N GLN 230.A O no hydrogen 2.815 N/A LEU 119.A N LEU 196.A O no hydrogen 2.931 N/A LEU 121.A N ASP 194.A O no hydrogen 2.861 N/A LYS 122.A N ARG 223.A O no hydrogen 2.739 N/A CYS 127.A N ALA 124.A O no hydrogen 2.905 N/A CYS 127.A SG ASP 123.A O no hydrogen 3.820 N/A CYS 127.A SG GLY 221.A O no hydrogen 3.859 N/A LEU 128.A N PHE 125.A O no hydrogen 3.019 N/A ARG 129.A NH2 GLN 22.A O no hydrogen 2.794 N/A LEU 130.A N THR 156.A O no hydrogen 2.905 N/A HIS 131.A N LEU 25.A O no hydrogen 2.730 N/A SER 134.A N HIS 131.A O no hydrogen 2.898 N/A GLN 135.A N HIS 131.A O no hydrogen 3.117 N/A GLN 135.A NE2 LEU 130.A O no hydrogen 3.006 N/A LEU 137.A N SER 134.A O no hydrogen 3.253 N/A PHE 138.A N GLN 135.A O no hydrogen 3.244 N/A ALA 139.A N PRO 136.A O no hydrogen 3.385 N/A PHE 140.A N LEU 153.A O no hydrogen 2.952 N/A TRP 142.A N GLY 151.A O no hydrogen 2.722 N/A ARG 143.A NE ILE 149.A O no hydrogen 3.330 N/A ARG 143.A NH2 ILE 149.A O no hydrogen 2.644 N/A GLY 151.A N SER 150.A OG no hydrogen 2.542 N/A GLN 152.A NE2 SER 69.A O no hydrogen 3.289 N/A GLN 152.A NE2 TRP 71.A O no hydrogen 2.993 N/A GLN 152.A NE2 ASN 72.A OD1 no hydrogen 3.035 N/A LEU 153.A N PHE 140.A O no hydrogen 2.880 N/A THR 154.A N VAL 65.A O no hydrogen 2.907 N/A THR 154.A OG1 GLN 135.A O no hydrogen 2.608 N/A TRP 155.A NE1 GLN 83.A OE1 no hydrogen 2.935 N/A THR 156.A N ILE 63.A O no hydrogen 2.980 N/A THR 156.A OG1 GLY 62.A O no hydrogen 2.730 N/A THR 156.A OG1 ILE 63.A O no hydrogen 3.477 N/A ARG 157.A NH1 GLY 17.A O no hydrogen 3.236 N/A ARG 157.A NH1 PHE 126.A O no hydrogen 2.457 N/A LEU 158.A N LEU 128.A O no hydrogen 2.886 N/A LYS 163.A N ASN 89.A OD1 no hydrogen 2.857 N/A LYS 163.A NZ ASN 89.A O no hydrogen 2.863 N/A LYS 163.A NZ VAL 92.A O no hydrogen 2.753 N/A LYS 163.A NZ ASP 94.A OD1 no hydrogen 2.720 N/A ASN 164.A ND2 GLU 93.A O no hydrogen 3.564 N/A SER 165.A N PHE 162.A O no hydrogen 3.098 N/A SER 165.A OG PRO 159.A O no hydrogen 2.736 N/A LEU 168.A N ASN 164.A O no hydrogen 2.910 N/A PHE 169.A N SER 165.A O no hydrogen 2.904 N/A ASP 170.A N PRO 166.A O no hydrogen 2.976 N/A GLU 171.A N THR 167.A O no hydrogen 2.934 N/A ALA 172.A N LEU 168.A O no hydrogen 2.954 N/A LEU 173.A N PHE 169.A O no hydrogen 2.884 N/A HIS 174.A N ASP 170.A O no hydrogen 3.051 N/A ARG 175.A N GLU 171.A O no hydrogen 3.110 N/A ARG 175.A NE GLN 22.A OE1 no hydrogen 3.068 N/A ARG 175.A NH2 GLN 22.A OE1 no hydrogen 2.873 N/A ASP 176.A N ALA 172.A O no hydrogen 3.083 N/A LEU 177.A N LEU 173.A O no hydrogen 2.863 N/A ARG 181.A N LEU 177.A O no hydrogen 3.149 N/A ARG 181.A NH1 LEU 189.A O no hydrogen 2.971 N/A ARG 181.A NH2 LEU 189.A O no hydrogen 2.978 N/A ARG 181.A NH2 GLN 191.A OE1 no hydrogen 2.868 N/A ILE 182.A N ALA 178.A O no hydrogen 3.214 N/A GLN 183.A N ASP 179.A O no hydrogen 2.879 N/A HIS 184.A N PHE 180.A O no hydrogen 3.000 N/A LEU 187.A N HIS 184.A O no hydrogen 3.082 N/A ILE 188.A N ALA 199.A O no hydrogen 2.976 N/A LEU 190.A N LEU 197.A O no hydrogen 2.809 N/A TYR 192.A N ASP 195.A O no hydrogen 2.940 N/A VAL 193.A N ASP 170.A OD1 no hydrogen 2.809 N/A ASP 195.A N TYR 192.A O no hydrogen 2.979 N/A LEU 196.A N LEU 119.A O no hydrogen 2.754 N/A LEU 197.A N LEU 190.A O no hydrogen 2.969 N/A LEU 198.A N THR 117.A O no hydrogen 2.834 N/A ALA 199.A N ILE 188.A O no hydrogen 2.784 N/A ALA 200.A N TRP 115.A O no hydrogen 2.928 N/A THR 201.A OG1 ASP 205.A OD1 no hydrogen 3.408 N/A ASP 205.A N SER 202.A OG no hydrogen 3.165 N/A CYS 206.A N SER 202.A O no hydrogen 3.042 N/A CYS 206.A SG TRP 115.A O no hydrogen 3.709 N/A CYS 206.A SG THR 117.A OG1 no hydrogen 3.465 N/A GLN 207.A N GLU 203.A O no hydrogen 2.971 N/A GLN 208.A N LEU 204.A O no hydrogen 2.948 N/A GLY 209.A N ASP 205.A O no hydrogen 2.823 N/A THR 210.A N CYS 206.A O no hydrogen 2.789 N/A THR 210.A OG1 THR 117.A OG1 no hydrogen 2.814 N/A THR 210.A OG1 CYS 206.A O no hydrogen 2.640 N/A ARG 211.A N GLN 207.A O no hydrogen 2.987 N/A ALA 212.A N GLN 208.A O no hydrogen 3.134 N/A LEU 213.A N GLY 209.A O no hydrogen 2.878 N/A LEU 214.A N THR 210.A O no hydrogen 2.916 N/A GLN 215.A N ARG 211.A O no hydrogen 2.985 N/A THR 216.A N ALA 212.A O no hydrogen 2.985 N/A THR 216.A OG1 ALA 212.A O no hydrogen 2.812 N/A LEU 217.A N LEU 213.A O no hydrogen 2.821 N/A GLY 218.A N LEU 214.A O no hydrogen 2.920 N/A ASN 219.A N GLN 215.A O no hydrogen 3.008 N/A LEU 220.A N THR 216.A O no hydrogen 2.986 N/A GLY 221.A N LEU 217.A O no hydrogen 3.170 N/A GLY 221.A N GLY 218.A O no hydrogen 3.208 N/A TYR 222.A N LEU 217.A O no hydrogen 2.958 N/A TYR 222.A OH ASP 176.A OD2 no hydrogen 2.673 N/A ARG 223.A NE GLY 14.A O no hydrogen 3.204 N/A ARG 223.A NE GLY 15.A O no hydrogen 3.085 N/A ARG 223.A NH1 GLY 218.A O no hydrogen 3.261 N/A ARG 223.A NH1 TYR 222.A O no hydrogen 2.871 N/A ARG 223.A NH2 GLY 14.A O no hydrogen 3.325 N/A ALA 224.A N ALA 9.A O no hydrogen 2.797 N/A SER 225.A N ASP 120.A O no hydrogen 2.918 N/A ALA 226.A N GLU 12.A OE2 no hydrogen 2.988 N/A LYS 227.A N GLU 12.A OE1 no hydrogen 3.216 N/A LYS 228.A N SER 225.A OG no hydrogen 3.175 N/A ALA 229.A N SER 225.A O no hydrogen 3.070 N/A GLN 230.A N VAL 118.A O no hydrogen 3.101 N/A GLN 230.A NE2 LYS 237.A O no hydrogen 2.931 N/A CYS 232.A N THR 117.A OG1 no hydrogen 2.915 N/A GLN 233.A N TYR 116.A O no hydrogen 2.809 N/A VAL 236.A N LEU 243.A O no hydrogen 2.982 N/A LYS 237.A N GLN 230.A OE1 no hydrogen 2.904 N/A TYR 238.A N TYR 241.A O no hydrogen 2.793 N/A TYR 238.A OH ASP 195.A O no hydrogen 2.893 N/A TYR 241.A N TYR 238.A O no hydrogen 2.871 N/A LEU 243.A N VAL 236.A O no hydrogen 2.716 N/A LYS 244.A N GLN 247.A O no hydrogen 3.469 N/A LYS 244.A NZ GLN 235.A OE1 no hydrogen 3.565 N/A GLY 246.A N TYR 116.A OH no hydrogen 3.181 N/A GLN 247.A N LYS 244.A O no hydrogen 2.965 N/A ARG 248.A NH2 LEU 242.A O no hydrogen 3.440 N/A