Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2g52_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ALA 125.A O no hydrogen 2.771 N/A ILE 1.A N ASP 179.A OD2 no hydrogen 2.557 N/A VAL 2.A N ASP 174.A O no hydrogen 2.802 N/A THR 5.A N LYS 139.A O no hydrogen 2.794 N/A ALA 7.A N LEU 137.A O no hydrogen 2.948 N/A SER 8.A N ASP 11.A OD2 no hydrogen 2.761 N/A ASP 11.A N SER 8.A O no hydrogen 3.059 N/A ILE 15.A N PHE 12.A O no hydrogen 3.031 N/A VAL 16.A N GLY 28.A O no hydrogen 2.961 N/A SER 17.A N ARG 54.A O no hydrogen 3.064 N/A ILE 18.A N CYS 26.A O no hydrogen 2.824 N/A SER 19.A N GLN 52.A O no hydrogen 2.923 N/A SER 19.A OG GLN 52.A O no hydrogen 3.569 N/A ARG 20.A N GLY 23.A O no hydrogen 2.878 N/A ASN 21.A N GLY 50.A O no hydrogen 3.006 N/A GLY 23.A N ARG 20.A O no hydrogen 3.121 N/A TRP 25.A NE1 CYS 42.A O no hydrogen 2.810 N/A CYS 26.A N ILE 18.A O no hydrogen 2.942 N/A CYS 26.A SG TRP 25.A O no hydrogen 3.156 N/A GLY 27.A N SER 180.A O no hydrogen 2.889 N/A GLY 28.A N VAL 16.A O no hydrogen 2.843 N/A SER 29.A N LEU 37.A O no hydrogen 2.855 N/A LEU 30.A N PHE 14.A O no hydrogen 2.750 N/A LEU 31.A N THR 35.A O no hydrogen 2.879 N/A ASN 32.A ND2 ALA 224.A O no hydrogen 2.765 N/A ASN 34.A N ASN 32.A OD1 no hydrogen 3.047 N/A THR 35.A N ASN 32.A O no hydrogen 3.437 N/A THR 35.A OG1 ASN 32.A OD1 no hydrogen 2.730 N/A THR 35.A OG1 ASN 34.A OD1 no hydrogen 3.118 N/A THR 35.A OG1 ALA 224.A O no hydrogen 3.233 N/A VAL 36.A N LEU 88.A O no hydrogen 2.945 N/A LEU 37.A N SER 29.A O no hydrogen 2.737 N/A THR 38.A N ALA 86.A O no hydrogen 3.027 N/A THR 38.A OG1 GLY 27.A O no hydrogen 2.788 N/A HIS 41.A N ASP 84.A OD1 no hydrogen 2.781 N/A HIS 41.A ND1 ASP 84.A OD2 no hydrogen 2.802 N/A CYS 42.A N ALA 39.A O no hydrogen 3.074 N/A CYS 42.A SG THR 38.A OG1 no hydrogen 3.736 N/A CYS 42.A SG SER 180.A O no hydrogen 3.452 N/A VAL 43.A N ALA 40.A O no hydrogen 3.053 N/A SER 44.A N ALA 40.A O no hydrogen 2.752 N/A TYR 46.A N VAL 43.A O no hydrogen 3.255 N/A GLY 50.A N ALA 47.A O no hydrogen 3.189 N/A PHE 51.A N GLN 48.A O no hydrogen 3.246 N/A GLN 52.A N SER 19.A O no hydrogen 3.145 N/A ILE 53.A N SER 67.A O no hydrogen 2.921 N/A ARG 54.A N SER 17.A O no hydrogen 2.902 N/A ARG 54.A NE ARG 60.A O no hydrogen 3.278 N/A ARG 54.A NH1 GLY 63.A O no hydrogen 2.960 N/A ALA 55.A N ILE 65.A O no hydrogen 2.938 N/A SER 57.A OG SER 59.A O no hydrogen 3.462 N/A SER 57.A OG SER 62.A O no hydrogen 2.743 N/A SER 59.A N SER 57.A OG no hydrogen 3.150 N/A ARG 60.A N VAL 135.A O no hydrogen 3.088 N/A ARG 60.A NE PRO 134.A O no hydrogen 2.833 N/A ARG 60.A NH2 THR 133.A O no hydrogen 3.072 N/A THR 61.A N SER 59.A OG no hydrogen 2.987 N/A THR 61.A OG1 SER 59.A OG no hydrogen 3.069 N/A THR 61.A OG1 SER 62.A OG no hydrogen 3.388 N/A SER 62.A OG THR 61.A OG1 no hydrogen 3.388 N/A ILE 65.A N ALA 55.A O no hydrogen 2.882 N/A SER 67.A N ILE 53.A O no hydrogen 2.900 N/A SER 67.A OG SER 68.A O no hydrogen 2.689 N/A SER 67.A OG THR 92.A O no hydrogen 3.545 N/A SER 70.A N LYS 89.A O no hydrogen 2.788 N/A ARG 73.A N ILE 87.A O no hydrogen 2.897 N/A HIS 75.A N LEU 85.A O no hydrogen 2.973 N/A SER 77.A N HIS 75.A ND1 no hydrogen 3.197 N/A TYR 78.A N HIS 75.A O no hydrogen 3.016 N/A SER 79.A N ASN 82.A O no hydrogen 2.982 N/A ASN 82.A N SER 79.A O no hydrogen 2.798 N/A ASN 83.A ND2 SER 77.A O no hydrogen 2.969 N/A ALA 86.A N THR 38.A O no hydrogen 2.930 N/A ILE 87.A N ARG 73.A O no hydrogen 2.815 N/A LEU 88.A N VAL 36.A O no hydrogen 2.678 N/A LYS 89.A N SER 71.A O no hydrogen 2.879 N/A LYS 89.A NZ THR 35.A OG1 no hydrogen 2.441 N/A LYS 89.A NZ TYR 223.A O no hydrogen 3.077 N/A LYS 89.A NZ ALA 224.A O no hydrogen 2.889 N/A LEU 90.A N ASN 34.A O no hydrogen 2.922 N/A SER 91.A N SER 68.A O no hydrogen 2.905 N/A THR 92.A N SER 67.A OG no hydrogen 2.904 N/A ILE 94.A N ALA 33.A O no hydrogen 2.738 N/A GLY 97.A N ILE 100.A O no hydrogen 2.813 N/A ILE 100.A N GLY 97.A O no hydrogen 3.023 N/A GLY 101.A N PRO 13.A O no hydrogen 3.135 N/A TYR 102.A OH ILE 94.A O no hydrogen 2.668 N/A ALA 103.A N LEU 30.A O no hydrogen 2.848 N/A ALA 106.A N LEU 191.A O no hydrogen 2.987 N/A GLY 109.A N GLY 214.A O no hydrogen 3.240 N/A SER 110.A N ALA 107.A O no hydrogen 2.945 N/A SER 110.A OG ALA 107.A O no hydrogen 2.688 N/A GLY 115.A N ILE 144.A O no hydrogen 2.828 N/A SER 116.A N VAL 113.A O no hydrogen 3.059 N/A SER 116.A OG VAL 113.A O no hydrogen 2.686 N/A ALA 118.A N VAL 142.A O no hydrogen 2.852 N/A THR 119.A N VAL 185.A O no hydrogen 2.874 N/A THR 119.A OG1 THR 141.A OG1 no hydrogen 2.834 N/A VAL 120.A N VAL 140.A O no hydrogen 2.984 N/A ALA 121.A N PRO 183.A O no hydrogen 3.274 N/A GLY 122.A N LEU 138.A O no hydrogen 2.893 N/A TRP 123.A NE1 LEU 58.A O no hydrogen 2.960 N/A GLY 124.A N ASP 179.A OD1 no hydrogen 2.793 N/A ALA 125.A N GLN 177.A O no hydrogen 2.814 N/A GLY 130.A N SER 127.A O no hydrogen 2.864 N/A LEU 137.A N LEU 58.A O no hydrogen 2.896 N/A LEU 138.A N GLY 122.A O no hydrogen 3.062 N/A LYS 139.A N THR 5.A O no hydrogen 2.946 N/A LYS 139.A NZ ASP 11.A OD2 no hydrogen 2.779 N/A VAL 140.A N VAL 120.A O no hydrogen 2.997 N/A THR 141.A OG1 THR 119.A OG1 no hydrogen 2.834 N/A VAL 142.A N ALA 118.A O no hydrogen 2.815 N/A ILE 144.A N SER 116.A O no hydrogen 2.833 N/A VAL 145.A N CYS 165.A O no hydrogen 2.849 N/A ARG 147.A NE THR 160.A O no hydrogen 3.168 N/A ARG 147.A NE MET 163.A O no hydrogen 3.307 N/A ARG 147.A NH1 ASP 111.A OD2 no hydrogen 2.872 N/A ARG 147.A NH2 ASP 111.A OD1 no hydrogen 2.837 N/A ARG 147.A NH2 ASP 111.A OD2 no hydrogen 3.398 N/A ARG 147.A NH2 MET 163.A O no hydrogen 2.710 N/A THR 149.A N SER 146.A OG no hydrogen 3.142 N/A THR 149.A OG1 SER 146.A OG no hydrogen 2.800 N/A CYS 150.A N SER 146.A O no hydrogen 3.036 N/A ARG 151.A N ARG 147.A O no hydrogen 2.729 N/A ARG 151.A NE ILE 159.A O no hydrogen 3.161 N/A ARG 151.A NH2 ILE 159.A O no hydrogen 3.034 N/A ALA 152.A N ALA 148.A O no hydrogen 2.966 N/A GLN 153.A N THR 149.A O no hydrogen 3.099 N/A GLN 153.A NE2 SER 207.A OG no hydrogen 2.589 N/A TYR 154.A N CYS 150.A O no hydrogen 2.906 N/A TYR 154.A OH SER 207.A O no hydrogen 2.471 N/A GLY 155.A N ARG 151.A O no hydrogen 2.723 N/A ALA 158.A N GLY 155.A O no hydrogen 3.232 N/A ILE 159.A N THR 156.A O no hydrogen 3.400 N/A THR 160.A OG1 ASN 82.A OD1 no hydrogen 2.598 N/A GLN 162.A N THR 160.A OG1 no hydrogen 3.173 N/A MET 163.A N THR 160.A O no hydrogen 3.183 N/A PHE 164.A N TYR 210.A O no hydrogen 2.899 N/A ALA 166.A N GLY 208.A O no hydrogen 3.069 N/A GLY 167.A N PRO 143.A O no hydrogen 2.965 N/A GLY 171.A N VAL 168.A O no hydrogen 2.611 N/A GLY 172.A N ALA 202.A O no hydrogen 2.721 N/A LYS 173.A NZ THR 141.A O no hydrogen 3.076 N/A ASP 174.A N VAL 2.A O no hydrogen 3.079 N/A SER 175.A N ASP 174.A OD1 no hydrogen 2.891 N/A SER 175.A OG ASP 174.A OD1 no hydrogen 3.529 N/A SER 175.A OG TYR 210.A OH no hydrogen 2.893 N/A CYS 176.A N ASP 179.A OD2 no hydrogen 2.864 N/A CYS 176.A SG GLN 177.A OE1 no hydrogen 3.644 N/A ASP 179.A N CYS 176.A O no hydrogen 2.961 N/A SER 180.A OG HIS 41.A NE2 no hydrogen 2.831 N/A GLY 181.A N VAL 195.A O no hydrogen 2.732 N/A GLY 182.A N ASP 179.A O no hydrogen 3.056 N/A ILE 184.A N GLY 193.A O no hydrogen 3.049 N/A VAL 185.A N THR 119.A O no hydrogen 2.728 N/A ASP 186.A N THR 190.A O no hydrogen 2.871 N/A ASN 189.A N ASP 186.A O no hydrogen 2.859 N/A THR 190.A N ASP 186.A OD1 no hydrogen 2.903 N/A LEU 191.A N ARG 104.A O no hydrogen 2.813 N/A ILE 192.A N ILE 184.A O no hydrogen 2.940 N/A GLY 193.A N ILE 184.A O no hydrogen 3.118 N/A ALA 194.A N ALA 211.A O no hydrogen 3.044 N/A VAL 195.A N GLY 182.A O no hydrogen 2.799 N/A SER 196.A N VAL 209.A O no hydrogen 3.088 N/A SER 196.A OG ASP 84.A OD2 no hydrogen 2.563 N/A TRP 197.A N VAL 209.A O no hydrogen 3.081 N/A ASN 199.A N TYR 154.A OH no hydrogen 2.995 N/A CYS 201.A N GLU 128.A OE1 no hydrogen 3.109 N/A CYS 201.A SG SER 175.A O no hydrogen 3.979 N/A CYS 201.A SG GLN 177.A OE1 no hydrogen 3.273 N/A ALA 202.A N ASP 174.A OD2 no hydrogen 2.777 N/A ARG 203.A NE GLU 128.A OE1 no hydrogen 2.903 N/A ARG 203.A NH2 GLU 128.A OE1 no hydrogen 3.471 N/A ARG 203.A NH2 GLU 128.A OE2 no hydrogen 3.024 N/A ASN 205.A N SER 169.A O no hydrogen 3.097 N/A TYR 206.A N ARG 203.A O no hydrogen 3.248 N/A GLY 208.A N ALA 166.A O no hydrogen 2.991 N/A VAL 209.A N TRP 197.A O no hydrogen 2.874 N/A TYR 210.A N PHE 164.A O no hydrogen 2.783 N/A TYR 210.A OH SER 175.A OG no hydrogen 2.893 N/A ALA 211.A N ALA 194.A O no hydrogen 2.854 N/A SER 212.A N GLN 162.A O no hydrogen 3.046 N/A VAL 213.A N ILE 192.A O no hydrogen 3.114 N/A ALA 215.A N SER 212.A OG no hydrogen 3.425 N/A LEU 216.A N SER 212.A O no hydrogen 3.115 N/A LEU 216.A N VAL 213.A O no hydrogen 3.168 N/A ARG 217.A NE ASP 221.A OD1 no hydrogen 2.735 N/A ARG 217.A NH1 ALA 106.A O no hydrogen 2.899 N/A ARG 217.A NH2 ASP 221.A OD1 no hydrogen 2.822 N/A ARG 217.A NH2 ASP 221.A OD2 no hydrogen 2.903 N/A ILE 220.A N LEU 216.A O no hydrogen 3.122 N/A ASP 221.A N ARG 217.A O no hydrogen 2.720 N/A THR 222.A N SER 218.A O no hydrogen 3.192 N/A THR 222.A OG1 SER 218.A O no hydrogen 2.704 N/A TYR 223.A N ILE 220.A O no hydrogen 3.206 N/A