Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ca8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N ASN 184.A OD1 no hydrogen 3.013 N/A SER 6.A OG THR 9.A OG1 no hydrogen 3.204 N/A THR 9.A N SER 6.A OG no hydrogen 3.017 N/A THR 9.A OG1 SER 6.A OG no hydrogen 3.204 N/A THR 9.A OG1 ASP 249.A OD1 no hydrogen 2.496 N/A ILE 10.A N SER 6.A O no hydrogen 2.916 N/A ASP 11.A N PRO 7.A O no hydrogen 2.982 N/A ALA 12.A N ALA 8.A O no hydrogen 3.000 N/A ILE 13.A N THR 9.A O no hydrogen 2.957 N/A ASN 14.A N ILE 10.A O no hydrogen 2.971 N/A ASN 14.A ND2 LEU 182.A O no hydrogen 2.942 N/A VAL 15.A N ASP 11.A O no hydrogen 2.874 N/A ILE 16.A N ALA 12.A O no hydrogen 3.129 N/A GLY 17.A N ILE 13.A O no hydrogen 2.772 N/A GLN 18.A N ASN 14.A O no hydrogen 2.967 N/A TRP 19.A N VAL 15.A O no hydrogen 3.098 N/A LEU 20.A N ILE 16.A O no hydrogen 2.938 N/A ALA 21.A N GLY 17.A O no hydrogen 3.018 N/A GLN 22.A N GLN 18.A O no hydrogen 2.934 N/A GLN 22.A NE2 GLN 18.A OE1 no hydrogen 3.020 N/A SER 26.A N ASP 23.A OD1 no hydrogen 3.303 N/A SER 26.A OG ASP 23.A OD1 no hydrogen 2.509 N/A GLY 27.A N ASP 24.A O no hydrogen 2.906 N/A VAL 29.A N SER 26.A O no hydrogen 3.125 N/A TYR 31.A OH SER 174.A O no hydrogen 2.688 N/A GLN 32.A N PRO 30.A O no hydrogen 2.972 N/A ALA 33.A N GLN 57.A OE1 no hydrogen 3.207 N/A ASP 34.A N THR 142.A O no hydrogen 2.952 N/A ASP 34.A N THR 142.A OG1 no hydrogen 3.200 N/A CYS 35.A SG.A VAL 36.A O no hydrogen 3.646 N/A CYS 35.A SG.A PRO 60.A O no hydrogen 3.763 N/A VAL 36.A N PRO 60.A O no hydrogen 3.054 N/A ILE 37.A N ILE 144.A O no hydrogen 2.632 N/A LEU 38.A N LEU 62.A O no hydrogen 2.825 N/A ALA 39.A N VAL 146.A O no hydrogen 2.846 N/A GLY 40.A N SER 64.A O no hydrogen 2.702 N/A ASN 41.A ND2 ALA 39.A O no hydrogen 2.859 N/A VAL 43.A N ASN 41.A OD1 no hydrogen 2.890 N/A THR 46.A OG1 PRO 176.A O no hydrogen 2.884 N/A ILE 47.A N VAL 43.A O no hydrogen 3.083 N/A ASP 48.A N MET 44.A O no hydrogen 2.765 N/A ALA 49.A N PRO 45.A O no hydrogen 2.946 N/A ALA 50.A N THR 46.A O no hydrogen 3.207 N/A CYS 51.A N ILE 47.A O no hydrogen 3.245 N/A CYS 51.A SG ILE 47.A O no hydrogen 3.544 N/A LYS 52.A N.A ASP 48.A O no hydrogen 2.952 N/A LYS 52.A N.B ASP 48.A O no hydrogen 2.970 N/A LYS 52.A NZ.A ASP 56.A OD1 no hydrogen 3.350 N/A LYS 52.A NZ.A ASP 56.A OD2 no hydrogen 2.272 N/A ILE 53.A N ALA 49.A O no hydrogen 3.192 N/A ALA 54.A N ALA 50.A O no hydrogen 3.103 N/A ARG 55.A N CYS 51.A O no hydrogen 2.903 N/A ARG 55.A NE ASP 56.A OD1 no hydrogen 3.111 N/A ARG 55.A NH2 ASP 56.A OD1 no hydrogen 3.110 N/A ASP 56.A N LYS 52.A O.A no hydrogen 2.791 N/A ASP 56.A N LYS 52.A O.B no hydrogen 2.695 N/A GLN 57.A N ILE 53.A O no hydrogen 2.864 N/A GLN 57.A NE2 TYR 31.A O no hydrogen 2.487 N/A GLN 58.A N ARG 55.A O no hydrogen 3.323 N/A ILE 59.A N ALA 54.A O no hydrogen 3.237 N/A LEU 61.A N LYS 112.A O no hydrogen 2.921 N/A LEU 62.A N VAL 36.A O no hydrogen 2.804 N/A ILE 63.A N TRP 114.A O no hydrogen 2.868 N/A SER 64.A N LEU 38.A O no hydrogen 2.978 N/A SER 64.A OG GLU 116.A OE2 no hydrogen 2.546 N/A SER 64.A OG ASN 125.A O no hydrogen 3.170 N/A SER 64.A OG SER 129.A OG no hydrogen 3.265 N/A GLY 65.A N GLU 116.A O no hydrogen 2.849 N/A GLY 66.A N SER 119.A O no hydrogen 2.800 N/A GLY 68.A N THR 71.A OG1 no hydrogen 2.836 N/A SER 70.A OG GLU 94.A OE1 no hydrogen 3.276 N/A THR 71.A N GLY 68.A O no hydrogen 3.146 N/A THR 71.A OG1 GLY 68.A O no hydrogen 3.152 N/A THR 71.A OG1 GLU 94.A OE1 no hydrogen 2.724 N/A LEU 74.A N SER 70.A O no hydrogen 3.001 N/A TYR 75.A N THR 71.A O no hydrogen 2.996 N/A TYR 75.A OH ARG 92.A O no hydrogen 2.676 N/A SER 76.A N THR 72.A O no hydrogen 3.131 N/A ALA 77.A N PHE 73.A O no hydrogen 2.875 N/A ILE 78.A N LEU 74.A O no hydrogen 2.962 N/A ALA 79.A N TYR 75.A O no hydrogen 3.248 N/A GLN 80.A N SER 76.A O no hydrogen 3.119 N/A HIS 81.A N ILE 78.A O no hydrogen 2.940 N/A HIS 83.A N HIS 81.A ND1 no hydrogen 3.025 N/A TYR 84.A N HIS 81.A ND1 no hydrogen 3.036 N/A TYR 84.A OH ASP 48.A OD1 no hydrogen 2.517 N/A THR 86.A OG1 HIS 83.A O no hydrogen 3.567 N/A ILE 87.A N TYR 84.A O no hydrogen 2.960 N/A ARG 92.A N THR 89.A O no hydrogen 2.996 N/A ARG 92.A NH1 ARG 88.A O no hydrogen 2.810 N/A ARG 92.A NH1 ASP 100.A OD1 no hydrogen 2.886 N/A ARG 92.A NH2 ASP 100.A OD1 no hydrogen 2.893 N/A GLU 94.A N GLY 66.A O no hydrogen 2.897 N/A ALA 95.A N GLY 65.A O no hydrogen 2.778 N/A THR 96.A N ALA 93.A O no hydrogen 3.166 N/A ILE 97.A N ALA 93.A O no hydrogen 3.360 N/A LEU 98.A N GLU 94.A O no hydrogen 2.937 N/A ALA 99.A N ALA 95.A O no hydrogen 2.911 N/A ASP 100.A N THR 96.A O no hydrogen 3.280 N/A ASP 100.A N ILE 97.A O no hydrogen 3.005 N/A ILE 101.A N ILE 97.A O no hydrogen 3.334 N/A ALA 102.A N LEU 98.A O no hydrogen 3.030 N/A HIS 103.A N ALA 99.A O no hydrogen 2.878 N/A HIS 103.A ND1 ILE 108.A O no hydrogen 2.837 N/A GLN 104.A N ASP 100.A O no hydrogen 2.645 N/A PHE 105.A N ILE 101.A O no hydrogen 3.095 N/A TRP 106.A N ILE 101.A O no hydrogen 3.059 N/A TRP 106.A NE1 ASP 48.A OD1 no hydrogen 3.278 N/A ILE 108.A N ALA 102.A O no hydrogen 3.078 N/A LYS 112.A N PRO 109.A O no hydrogen 2.906 N/A ILE 113.A N HIS 110.A O no hydrogen 3.065 N/A TRP 114.A N LEU 61.A O no hydrogen 2.874 N/A GLU 116.A N ILE 63.A O no hydrogen 2.800 N/A GLN 118.A N GLU 116.A OE1 no hydrogen 2.975 N/A GLN 118.A NE2 ASP 117.A OD2 no hydrogen 3.181 N/A SER 119.A N GLU 116.A OE1 no hydrogen 3.213 N/A SER 119.A OG GLU 116.A OE2 no hydrogen 2.778 N/A SER 119.A OG ASN 125.A OD1 no hydrogen 2.811 N/A THR 120.A N GLU 124.A OE2 no hydrogen 2.891 N/A THR 120.A OG1 GLU 124.A OE2 no hydrogen 3.168 N/A CYS 122.A SG.A THR 155.A OG1 no hydrogen 3.329 N/A CYS 122.A SG.B THR 155.A OG1 no hydrogen 3.682 N/A GLU 124.A N ASN 121.A O no hydrogen 3.058 N/A GLU 124.A N ASN 121.A OD1 no hydrogen 2.928 N/A ASN 125.A N ASN 121.A O no hydrogen 2.917 N/A ALA 126.A N CYS 122.A O.A no hydrogen 3.091 N/A ALA 126.A N CYS 122.A O.B no hydrogen 3.011 N/A ARG 127.A N GLY 123.A O no hydrogen 2.789 N/A ARG 127.A NH1 ARG 127.A O no hydrogen 3.093 N/A PHE 128.A N GLU 124.A O no hydrogen 2.834 N/A SER 129.A N ASN 125.A O no hydrogen 3.084 N/A SER 129.A OG ASN 125.A O no hydrogen 2.630 N/A ILE 130.A N ALA 126.A O no hydrogen 3.011 N/A ALA 131.A N ARG 127.A O no hydrogen 3.011 N/A LEU 132.A N PHE 128.A O no hydrogen 3.088 N/A LEU 133.A N SER 129.A O no hydrogen 2.942 N/A ASN 134.A N ILE 130.A O no hydrogen 2.931 N/A ASN 134.A N ALA 131.A O no hydrogen 3.260 N/A GLN 135.A N LEU 132.A O no hydrogen 3.139 N/A ALA 136.A N LEU 133.A O no hydrogen 3.183 N/A ARG 139.A NH1.A ASN 134.A O no hydrogen 3.299 N/A ARG 139.A NH1.A ALA 136.A O no hydrogen 3.031 N/A ARG 139.A NH1.B HIS 141.A NE2 no hydrogen 3.280 N/A ARG 139.A NH2.A ASN 134.A O no hydrogen 3.090 N/A HIS 141.A N ASP 34.A OD1 no hydrogen 2.814 N/A THR 142.A N ASP 34.A OD1 no hydrogen 3.253 N/A ALA 143.A N ARG 171.A O no hydrogen 2.786 N/A ILE 144.A N CYS 35.A O.A no hydrogen 2.982 N/A ILE 144.A N CYS 35.A O.B no hydrogen 3.113 N/A VAL 145.A N LEU 173.A O no hydrogen 2.721 N/A VAL 146.A N ILE 37.A O no hydrogen 2.815 N/A GLN 147.A N GLN 152.A OE1 no hydrogen 3.053 N/A GLN 147.A NE2 THR 155.A OG1 no hydrogen 3.018 N/A ASP 148.A N GLN 147.A OE1 no hydrogen 2.937 N/A THR 150.A N ASP 148.A OD1 no hydrogen 2.819 N/A THR 150.A OG1 ASP 148.A OD1 no hydrogen 2.464 N/A MET 151.A N ASP 148.A O no hydrogen 2.890 N/A GLN 152.A N PRO 149.A O no hydrogen 3.473 N/A GLN 152.A NE2 VAL 145.A O no hydrogen 2.896 N/A ARG 153.A NE TRP 19.A O no hydrogen 2.911 N/A ARG 153.A NH1 ASP 24.A OD2 no hydrogen 3.049 N/A ARG 153.A NH2 TRP 19.A O no hydrogen 2.981 N/A ARG 153.A NH2 ASP 24.A OD1 no hydrogen 2.616 N/A ARG 154.A NE GLU 211.A OE1 no hydrogen 3.368 N/A ARG 154.A NE GLU 211.A OE2 no hydrogen 2.772 N/A ARG 154.A NH2 GLU 211.A OE1 no hydrogen 3.010 N/A THR 155.A N MET 151.A O no hydrogen 2.987 N/A THR 155.A OG1 MET 151.A O no hydrogen 2.953 N/A MET 156.A N GLN 152.A O no hydrogen 2.985 N/A ALA 157.A N ARG 153.A O no hydrogen 2.972 N/A THR 158.A N ARG 154.A O no hydrogen 2.951 N/A THR 158.A N THR 155.A O no hydrogen 3.137 N/A THR 158.A OG1 ARG 154.A O no hydrogen 2.741 N/A PHE 159.A N THR 155.A O no hydrogen 3.010 N/A ARG 160.A N MET 156.A O no hydrogen 2.905 N/A ARG 160.A NE ASP 165.A OD1 no hydrogen 2.766 N/A ARG 160.A NH1 ASP 23.A OD1 no hydrogen 3.433 N/A ARG 160.A NH1 ASP 23.A OD2 no hydrogen 3.106 N/A ARG 160.A NH2 ASP 23.A OD1 no hydrogen 3.143 N/A ARG 160.A NH2 ASP 165.A OD1 no hydrogen 3.529 N/A ARG 160.A NH2 TRP 172.A O no hydrogen 2.677 N/A ARG 161.A N ALA 157.A O no hydrogen 3.189 N/A ARG 161.A N THR 158.A O no hydrogen 3.140 N/A ARG 161.A NE ASP 228.A OD1 no hydrogen 3.211 N/A ARG 161.A NH1 ARG 161.A O no hydrogen 2.994 N/A ARG 161.A NH2 ASP 228.A OD2 no hydrogen 2.901 N/A MET 162.A N THR 158.A O no hydrogen 3.274 N/A MET 162.A N PHE 159.A O no hydrogen 3.089 N/A THR 163.A N PHE 159.A O no hydrogen 3.180 N/A THR 163.A OG1 PHE 159.A O no hydrogen 3.387 N/A THR 163.A OG1 GLY 164.A O no hydrogen 2.743 N/A GLY 164.A N ARG 160.A O no hydrogen 2.718 N/A ASN 166.A N ASP 165.A OD2 no hydrogen 2.839 N/A ASP 168.A N ASN 166.A OD1 no hydrogen 2.646 N/A ALA 169.A N ASN 166.A O no hydrogen 2.824 N/A ARG 171.A N ASP 165.A OD2 no hydrogen 2.738 N/A TRP 172.A N ASP 165.A OD1 no hydrogen 3.437 N/A TRP 172.A NE1 THR 163.A OG1 no hydrogen 2.828 N/A LEU 173.A N ALA 143.A O no hydrogen 2.878 N/A TYR 175.A N VAL 145.A O no hydrogen 3.036 N/A GLN 181.A N ASN 193.A OD1 no hydrogen 2.851 N/A LEU 182.A N ASN 14.A OD1 no hydrogen 2.901 N/A GLY 183.A N ILE 190.A O no hydrogen 2.988 N/A ASN 184.A ND2 LEU 5.A O no hydrogen 2.703 N/A ASN 185.A N SER 188.A O no hydrogen 2.863 N/A SER 188.A N ASN 185.A O no hydrogen 2.980 N/A SER 188.A OG PHE 2.A O no hydrogen 2.446 N/A VAL 189.A N PHE 2.A O no hydrogen 3.339 N/A ILE 190.A N GLY 183.A O no hydrogen 2.924 N/A ILE 192.A N GLN 181.A O no hydrogen 2.722 N/A ASN 193.A ND2 VAL 179.A O no hydrogen 2.979 N/A GLN 194.A NE2 ILE 192.A O no hydrogen 3.088 N/A TRP 199.A NE1 ASP 148.A OD2 no hydrogen 2.941 N/A ARG 203.A NH1 LEU 261.A O no hydrogen 3.551 N/A TYR 204.A N PRO 200.A O no hydrogen 3.024 N/A LEU 205.A N VAL 201.A O no hydrogen 2.839 N/A SER 206.A N GLU 202.A O no hydrogen 3.010 N/A LEU 207.A N ARG 203.A O no hydrogen 3.050 N/A LEU 208.A N TYR 204.A O no hydrogen 2.876 N/A THR 209.A N LEU 205.A O no hydrogen 2.947 N/A THR 209.A OG1 LEU 205.A O no hydrogen 2.754 N/A THR 209.A OG1 SER 206.A O no hydrogen 3.425 N/A GLY 210.A N SER 206.A O no hydrogen 2.844 N/A GLU 211.A N LEU 207.A O no hydrogen 2.995 N/A GLU 211.A N LEU 208.A O no hydrogen 3.373 N/A ARG 214.A NH1 GLU 211.A OE1 no hydrogen 3.139 N/A LEU 215.A N GLU 211.A O no hydrogen 2.954 N/A ARG 216.A N LEU 212.A O no hydrogen 2.999 N/A ASP 218.A N ARG 216.A O no hydrogen 2.997 N/A ASP 220.A N ASP 218.A OD2 no hydrogen 2.950 N/A GLY 221.A N ASP 218.A O no hydrogen 3.029 N/A TYR 222.A N ARG 214.A O no hydrogen 2.803 N/A ARG 225.A N ASP 217.A OD1 no hydrogen 2.881 N/A GLY 226.A N GLY 223.A O no hydrogen 2.875 N/A ARG 227.A N GLY 221.A O no hydrogen 2.989 N/A ASP 228.A N GLY 223.A O no hydrogen 2.836 N/A PHE 229.A N TYR 222.A O no hydrogen 2.827 N/A ILE 230.A N TYR 222.A O no hydrogen 3.056 N/A VAL 231.A N ALA 157.A O no hydrogen 3.108 N/A HIS 232.A ND1 ASP 217.A OD2 no hydrogen 2.788 N/A HIS 232.A NE2 ASP 234.A OD2 no hydrogen 2.655 N/A ILE 240.A N PRO 236.A O no hydrogen 3.041 N/A HIS 241.A N ALA 237.A O no hydrogen 3.008 N/A ALA 242.A N GLU 238.A O no hydrogen 3.031 N/A TRP 243.A N VAL 239.A O no hydrogen 2.845 N/A GLN 244.A N ILE 240.A O no hydrogen 2.875 N/A THR 245.A N HIS 241.A O no hydrogen 2.947 N/A THR 245.A OG1 HIS 241.A O no hydrogen 3.085 N/A LEU 246.A N ALA 242.A O no hydrogen 3.046 N/A LYS 247.A N TRP 243.A O no hydrogen 3.021 N/A HIS 248.A N GLN 244.A O no hydrogen 3.031 N/A HIS 248.A N THR 245.A O no hydrogen 3.343 N/A HIS 248.A ND1 GLN 244.A O no hydrogen 2.513 N/A ASP 249.A N LEU 246.A O no hydrogen 3.064 N/A LEU 252.A N ASP 249.A OD2 no hydrogen 3.000 N/A ILE 253.A N ASP 249.A O no hydrogen 2.996 N/A GLU 254.A N ALA 250.A O no hydrogen 3.014 N/A ALA 255.A N VAL 251.A O no hydrogen 2.953 N/A MET 256.A N.A LEU 252.A O no hydrogen 2.979 N/A MET 256.A N.B LEU 252.A O no hydrogen 2.982 N/A GLU 257.A N ILE 253.A O no hydrogen 2.844 N/A SER 258.A N GLU 254.A O no hydrogen 3.082 N/A SER 258.A OG GLU 254.A O no hydrogen 2.794 N/A ARG 259.A N MET 256.A O.B no hydrogen 3.385 N/A