Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w21_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N GLU 17.A O no hydrogen 2.712 N/A GLN 7.A N VAL 36.A O no hydrogen 2.772 N/A LEU 8.A N ARG 15.A O no hydrogen 2.836 N/A PHE 10.A N ASP 33.A OD2 no hydrogen 2.923 N/A THR 12.A N ARG 9.A O no hydrogen 3.201 N/A THR 12.A OG1 ALA 13.A O no hydrogen 3.366 N/A ARG 15.A N LEU 8.A O no hydrogen 2.882 N/A ARG 15.A NH2 GLU 17.A OE1 no hydrogen 3.392 N/A GLU 17.A N ALA 6.A O no hydrogen 3.004 N/A ALA 22.A N THR 19.A OG1 no hydrogen 2.931 N/A ALA 23.A N THR 19.A O no hydrogen 3.202 N/A ILE 24.A N ILE 20.A O no hydrogen 3.061 N/A HIS 25.A N ALA 21.A O no hydrogen 2.839 N/A ALA 26.A N ALA 22.A O no hydrogen 2.876 N/A LEU 27.A N ALA 23.A O no hydrogen 2.945 N/A ASP 28.A N ILE 24.A O no hydrogen 2.807 N/A ALA 29.A N HIS 25.A O no hydrogen 2.800 N/A ASP 30.A N LEU 27.A O no hydrogen 2.760 N/A GLU 31.A N ALA 26.A O no hydrogen 2.869 N/A ILE 35.A N LEU 211.A O no hydrogen 2.662 N/A VAL 36.A N GLN 7.A O no hydrogen 2.954 N/A ILE 38.A N GLY 207.A O no hydrogen 2.959 N/A VAL 39.A N GLY 207.A O no hydrogen 3.067 N/A GLU 43.A N PRO 40.A O no hydrogen 3.052 N/A ARG 44.A NE VAL 39.A O no hydrogen 2.876 N/A ARG 44.A NH2 VAL 39.A O no hydrogen 3.087 N/A ALA 46.A N GLU 43.A O no hydrogen 3.047 N/A ASP 49.A N ASP 45.A O no hydrogen 2.920 N/A GLY 52.A N ASP 50.A OD1 no hydrogen 3.022 N/A PHE 53.A N ASP 50.A O no hydrogen 3.192 N/A SER 54.A N GLU 51.A O no hydrogen 3.084 N/A THR 58.A N GLN 61.A OE1 no hydrogen 3.116 N/A LEU 59.A N ASP 243.A OXT no hydrogen 2.839 N/A GLN 61.A N THR 58.A OG1 no hydrogen 3.027 N/A LEU 62.A N THR 58.A O no hydrogen 2.962 N/A GLN 63.A N LEU 59.A O no hydrogen 2.822 N/A GLN 63.A NE2 ASP 134.A O no hydrogen 2.884 N/A GLN 63.A NE2 VAL 135.A O no hydrogen 3.112 N/A ARG 64.A N GLN 61.A O no hydrogen 3.146 N/A GLU 65.A N LEU 62.A O no hydrogen 3.119 N/A GLY 67.A N ASP 140.A OD1 no hydrogen 2.931 N/A LEU 70.A N GLN 66.A O no hydrogen 3.272 N/A VAL 71.A N GLY 67.A O no hydrogen 3.237 N/A SER 72.A N ASP 68.A O no hydrogen 3.084 N/A LYS 73.A N LYS 69.A O no hydrogen 2.868 N/A LYS 73.A NZ GLU 76.A OE1 no hydrogen 3.192 N/A LYS 73.A NZ GLU 76.A OE2 no hydrogen 3.258 N/A ALA 74.A N LEU 70.A O no hydrogen 2.890 N/A ALA 75.A N VAL 71.A O no hydrogen 3.071 N/A GLU 76.A N SER 72.A O no hydrogen 3.203 N/A TYR 77.A N LYS 73.A O no hydrogen 2.791 N/A TYR 77.A OH ASP 243.A O no hydrogen 2.676 N/A PHE 78.A N ALA 74.A O no hydrogen 2.890 N/A GLY 79.A N ALA 75.A O no hydrogen 2.804 N/A ILE 80.A N GLU 76.A O no hydrogen 2.909 N/A ALA 81.A N TYR 77.A O no hydrogen 3.055 N/A VAL 84.A N ILE 80.A O no hydrogen 3.143 N/A VAL 84.A N ALA 81.A O no hydrogen 3.233 N/A ASN 85.A N ALA 81.A O no hydrogen 2.923 N/A ASN 85.A ND2 GLU 115.A OE1 no hydrogen 3.170 N/A ASN 85.A ND2 PHE 116.A O no hydrogen 2.738 N/A LEU 88.A N VAL 84.A O no hydrogen 3.101 N/A ARG 89.A N ASN 85.A O no hydrogen 2.747 N/A ARG 89.A NE ASP 86.A OD1 no hydrogen 2.966 N/A ARG 89.A NH1 GLU 115.A OE1 no hydrogen 3.445 N/A ARG 89.A NH1 GLU 115.A OE2 no hydrogen 3.168 N/A ARG 89.A NH2 ASP 86.A OD1 no hydrogen 2.737 N/A ARG 89.A NH2 GLU 115.A OE1 no hydrogen 2.777 N/A ARG 89.A NH2 GLU 115.A OE2 no hydrogen 3.559 N/A THR 90.A N GLY 87.A O no hydrogen 2.944 N/A THR 91.A N LEU 88.A O no hydrogen 2.918 N/A ARG 92.A N ASP 50.A OD2 no hydrogen 2.838 N/A ARG 95.A N THR 91.A O no hydrogen 2.894 N/A ARG 95.A NE THR 90.A O no hydrogen 3.264 N/A ARG 95.A NH2 THR 90.A O no hydrogen 3.112 N/A LEU 96.A N ARG 92.A O no hydrogen 2.819 N/A PHE 97.A N VAL 94.A O no hydrogen 2.960 N/A SER 98.A N VAL 94.A O no hydrogen 2.969 N/A ASP 99.A N ARG 95.A O no hydrogen 2.688 N/A ALA 100.A N LEU 96.A O no hydrogen 3.400 N/A LEU 101.A N PHE 97.A O no hydrogen 2.964 N/A LYS 104.A N TRP 240.A O no hydrogen 3.079 N/A LYS 104.A NZ ASP 102.A OD1 no hydrogen 3.527 N/A ILE 108.A N VAL 114.A O no hydrogen 2.942 N/A ASP 111.A N GLY 109.A O no hydrogen 2.775 N/A PHE 116.A N LEU 106.A O no hydrogen 2.928 N/A LEU 117.A N TYR 77.A OH no hydrogen 3.175 N/A LEU 118.A N ASN 85.A OD1 no hydrogen 2.867 N/A THR 120.A N GLY 230.A O no hydrogen 3.066 N/A THR 120.A OG1 ASP 243.A OD2 no hydrogen 2.838 N/A ARG 121.A NH1 TRP 48.A O no hydrogen 2.796 N/A ARG 122.A N THR 229.A O no hydrogen 2.627 N/A TYR 124.A N ARG 227.A O no hydrogen 2.804 N/A HIS 131.A N HIS 218.A O no hydrogen 2.900 N/A ASP 133.A N SER 214.A O no hydrogen 2.770 N/A SER 136.A N ASP 134.A OD1 no hydrogen 2.814 N/A SER 136.A OG ASP 134.A OD1 no hydrogen 2.740 N/A TYR 137.A N ASP 134.A O no hydrogen 2.905 N/A TYR 137.A OH PRO 174.A O no hydrogen 2.606 N/A GLY 138.A N SER 136.A O no hydrogen 2.941 N/A ARG 139.A N GLN 63.A O no hydrogen 2.796 N/A ARG 139.A NE ASP 181.A OD2 no hydrogen 3.019 N/A ARG 139.A NH1 ARG 64.A O no hydrogen 3.246 N/A ARG 139.A NH2 ASP 181.A OD1 no hydrogen 2.780 N/A ASN 143.A N ASP 140.A OD2 no hydrogen 3.036 N/A ASN 143.A ND2 ASP 140.A OD1 no hydrogen 2.819 N/A TRP 144.A N ASP 140.A O no hydrogen 2.875 N/A TRP 144.A NE1 VAL 135.A O no hydrogen 2.891 N/A LYS 147.A NZ VAL 142.A O no hydrogen 3.082 N/A LYS 147.A NZ TRP 144.A O no hydrogen 2.948 N/A ARG 148.A NH1 GLU 237.A OE2 no hydrogen 3.262 N/A ARG 148.A NH2 GLU 237.A OE2 no hydrogen 2.840 N/A SER 149.A OG ASP 134.A OD1 no hydrogen 3.536 N/A SER 149.A OG ASP 134.A OD2 no hydrogen 2.428 N/A GLN 153.A N PHE 150.A O no hydrogen 3.009 N/A LEU 154.A N LEU 233.A O no hydrogen 2.920 N/A GLY 155.A N PHE 212.A O no hydrogen 2.811 N/A GLY 156.A N LEU 231.A O no hydrogen 2.912 N/A PHE 157.A N THR 210.A O no hydrogen 2.925 N/A THR 159.A N GLN 208.A O no hydrogen 2.989 N/A ILE 160.A N ARG 228.A O no hydrogen 2.835 N/A GLN 161.A N ARG 228.A O no hydrogen 3.162 N/A ASP 164.A N SER 225.A OG no hydrogen 2.588 N/A ASN 165.A N THR 224.A OG1 no hydrogen 2.728 N/A ASP 166.A N ALA 163.A O no hydrogen 2.825 N/A GLY 168.A N GLU 221.A OE1 no hydrogen 2.634 N/A TRP 170.A N LEU 217.A O no hydrogen 2.934 N/A ASP 171.A N ALA 199.A O no hydrogen 2.745 N/A ASN 172.A N TRP 170.A O no hydrogen 2.845 N/A ARG 173.A NH1 PRO 151.A O no hydrogen 2.814 N/A ARG 173.A NH2 PRO 151.A O no hydrogen 3.559 N/A ARG 177.A NE TYR 137.A O no hydrogen 2.889 N/A ARG 177.A NH2 TYR 137.A O no hydrogen 3.143 N/A ALA 179.A N SER 176.A OG no hydrogen 3.205 N/A LEU 180.A N SER 176.A O no hydrogen 3.288 N/A ASP 181.A N ARG 177.A O no hydrogen 2.795 N/A GLU 182.A N ALA 178.A O no hydrogen 2.855 N/A HIS 183.A NE2 PRO 130.A O no hydrogen 2.719 N/A ALA 184.A N ASP 181.A O no hydrogen 2.893 N/A GLU 185.A N GLU 182.A O no hydrogen 2.728 N/A ARG 187.A N HIS 183.A O no hydrogen 3.299 N/A GLU 188.A N GLU 185.A O no hydrogen 3.344 N/A THR 189.A N TYR 186.A O no hydrogen 3.299 N/A GLY 190.A N TYR 186.A O no hydrogen 2.651 N/A ALA 193.A N GLU 185.A OE2 no hydrogen 2.851 N/A LEU 195.A N ILE 192.A O no hydrogen 2.773 N/A ALA 198.A N LEU 195.A O no hydrogen 3.118 N/A LYS 203.A NZ GLU 221.A OE1 no hydrogen 2.643 N/A GLN 205.A N GLN 208.A OE1 no hydrogen 2.753 N/A GLY 207.A N THR 159.A O no hydrogen 2.802 N/A GLN 208.A N GLN 205.A O no hydrogen 2.902 N/A GLN 208.A NE2 ASP 37.A OD1 no hydrogen 2.848 N/A THR 210.A N PHE 157.A O no hydrogen 2.789 N/A LEU 211.A N ILE 35.A O no hydrogen 2.903 N/A PHE 212.A N GLY 155.A O no hydrogen 2.926 N/A GLN 213.A N ASP 33.A O no hydrogen 3.185 N/A GLN 213.A NE2 PRO 151.A O no hydrogen 3.643 N/A SER 214.A N GLN 153.A O no hydrogen 2.976 N/A SER 214.A OG ASP 133.A O no hydrogen 2.854 N/A SER 214.A OG GLN 153.A O no hydrogen 3.418 N/A LYS 215.A NZ ASP 134.A OD2 no hydrogen 2.867 N/A ASN 216.A N GLN 213.A O no hydrogen 3.337 N/A ASN 216.A ND2 GLN 213.A O no hydrogen 3.626 N/A LEU 217.A N ASN 172.A O no hydrogen 2.811 N/A HIS 218.A N HIS 131.A O no hydrogen 2.839 N/A HIS 218.A ND1 ASN 216.A O no hydrogen 2.925 N/A ALA 219.A N VAL 169.A O no hydrogen 3.003 N/A GLU 221.A N GLY 168.A O no hydrogen 2.801 N/A CYS 223.A SG GLU 221.A O no hydrogen 3.779 N/A THR 226.A OG1 GLU 125.A OE2 no hydrogen 3.015 N/A ARG 227.A N TYR 124.A O no hydrogen 2.873 N/A ARG 228.A N GLN 161.A O no hydrogen 2.661 N/A THR 229.A N ARG 122.A O no hydrogen 2.960 N/A LEU 231.A N GLY 156.A O no hydrogen 2.917 N/A PHE 232.A N PHE 242.A O no hydrogen 2.750 N/A LEU 233.A N LEU 154.A O no hydrogen 2.879 N/A ILE 234.A N ARG 241.A O no hydrogen 2.976 N/A THR 236.A N GLY 239.A O no hydrogen 2.925 N/A THR 236.A OG1 GLY 239.A O no hydrogen 2.692 N/A ASP 238.A N THR 236.A OG1 no hydrogen 3.147 N/A GLY 239.A N THR 236.A O no hydrogen 2.966 N/A ARG 241.A N ILE 234.A O no hydrogen 2.850 N/A ARG 241.A NH1 ASP 238.A O no hydrogen 3.478 N/A ARG 241.A NH1 TRP 240.A O no hydrogen 3.035 N/A ARG 241.A NH2 ASP 238.A O no hydrogen 3.177 N/A ASP 243.A N LEU 117.A O no hydrogen 2.929 N/A