Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1a3b_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 143.A O no hydrogen 2.802 N/A ILE 1.A N ASP 198.A OD1 no hydrogen 3.464 N/A ILE 1.A N ASP 198.A OD2 no hydrogen 2.538 N/A VAL 2.A N ASP 193.A O no hydrogen 2.876 N/A SER 5.A N VAL 156.A O no hydrogen 2.932 N/A ALA 7.A N LEU 154.A O no hydrogen 2.800 N/A MET 11.A N GLU 8.A O no hydrogen 3.125 N/A SER 12.A OG GLN 15.A OE1 no hydrogen 2.981 N/A GLN 15.A N SER 12.A O no hydrogen 2.958 N/A GLN 15.A NE2 THR 139.A O no hydrogen 3.171 N/A VAL 16.A N ALA 30.A O no hydrogen 2.896 N/A MET 17.A N ARG 62.A O no hydrogen 2.969 N/A LEU 18.A N CYS 28.A O no hydrogen 2.825 N/A PHE 19.A N LEU 60.A O no hydrogen 2.999 N/A ARG 20.A N GLU 25.A O no hydrogen 2.820 N/A ARG 20.A NH1 GLU 25.A OE2 no hydrogen 3.078 N/A LYS 21.A N ASP 58.A O no hydrogen 3.136 N/A LYS 21.A NZ ASN 57.A O no hydrogen 3.037 N/A GLU 25.A N ARG 20.A O no hydrogen 3.293 N/A LEU 27.A N LEU 18.A O no hydrogen 2.716 N/A CYS 28.A N LEU 18.A O no hydrogen 3.417 N/A CYS 28.A SG LEU 27.A O no hydrogen 2.674 N/A GLY 29.A N SER 199.A O no hydrogen 2.765 N/A SER 31.A N LEU 39.A O no hydrogen 2.844 N/A SER 31.A OG LEU 39.A O no hydrogen 3.532 N/A SER 31.A OG GLN 215.A OE1 no hydrogen 2.553 N/A LEU 32.A N TRP 14.A O no hydrogen 2.798 N/A ILE 33.A N TRP 37.A O no hydrogen 3.073 N/A ARG 36.A N SER 34.A OG no hydrogen 3.045 N/A ARG 36.A NE LEU 105.A O no hydrogen 2.626 N/A ARG 36.A NH2 LEU 105.A O no hydrogen 2.672 N/A VAL 38.A N MET 103.A O no hydrogen 2.971 N/A LEU 39.A N SER 31.A O no hydrogen 2.759 N/A THR 40.A N ALA 101.A O no hydrogen 2.991 N/A THR 40.A OG1 GLY 29.A O no hydrogen 2.953 N/A ALA 41.A N THR 40.A OG1 no hydrogen 2.761 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.841 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.634 N/A CYS 44.A N ALA 41.A O no hydrogen 3.047 N/A LEU 45.A N ALA 42.A O no hydrogen 2.910 N/A LEU 46.A N ALA 42.A O no hydrogen 2.767 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.583 N/A ASP 58.A N THR 55I.A O no hydrogen 3.219 N/A LEU 59.A N GLU 56.A O no hydrogen 3.111 N/A LEU 60.A N PHE 19.A O no hydrogen 2.967 N/A VAL 61.A N SER 79.A O no hydrogen 2.792 N/A ARG 62.A N MET 17.A O no hydrogen 2.937 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 2.680 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 3.240 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 2.946 N/A ILE 63.A N LYS 77.A O no hydrogen 2.881 N/A LYS 65.A NZ SER 67.A O no hydrogen 3.037 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.731 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.907 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 2.867 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 2.815 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.848 N/A ARG 68.A N SER 152.A O no hydrogen 2.898 N/A ARG 68.A NE PRO 151.A O no hydrogen 2.751 N/A ARG 70.A N SER 67.A OG no hydrogen 3.375 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.815 N/A ILE 75.A N GLU 72.A O no hydrogen 3.040 N/A GLU 76.A N GLU 72.A O no hydrogen 2.863 N/A LYS 77.A N ILE 63.A O no hydrogen 2.780 N/A SER 79.A N VAL 61.A O no hydrogen 2.763 N/A GLU 82.A N LYS 104.A O no hydrogen 2.704 N/A LYS 83.A N LYS 104.A O no hydrogen 3.388 N/A LYS 83.A NZ GLU 56.A OE2 no hydrogen 3.488 N/A ILE 84.A N GLU 56.A OE2 no hydrogen 2.942 N/A TYR 85.A N LEU 102.A O no hydrogen 2.759 N/A HIS 87.A N ILE 100.A O no hydrogen 3.243 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.859 N/A TYR 90.A N HIS 87.A O no hydrogen 3.041 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.635 N/A ASN 91.A N ASP 97.A O no hydrogen 2.818 N/A ASN 95.A ND2 ARG 174.A O no hydrogen 2.851 N/A ASP 97.A N ASN 95.A OD1 no hydrogen 3.213 N/A ARG 98.A NH1 ARG 89.A O no hydrogen 2.777 N/A ILE 100.A N ARG 98.A O no hydrogen 2.952 N/A ALA 101.A N THR 40.A O no hydrogen 2.886 N/A LEU 102.A N TYR 85.A O no hydrogen 2.758 N/A MET 103.A N VAL 38.A O no hydrogen 2.832 N/A LYS 104.A N LYS 83.A O no hydrogen 2.834 N/A LYS 104.A NZ GLU 82.A OE2 no hydrogen 3.300 N/A LEU 105.A N ARG 36.A O no hydrogen 2.888 N/A LYS 106.A N MET 80.A O no hydrogen 3.015 N/A VAL 109.A N ASP 35.A O no hydrogen 2.878 N/A SER 112.A N ILE 115.A O no hydrogen 2.921 N/A TYR 114.A N SER 112.A OG no hydrogen 3.036 N/A ILE 115.A N SER 112.A O no hydrogen 3.420 N/A HIS 116.A N PRO 13.A O no hydrogen 3.074 N/A VAL 118.A N LEU 32.A O no hydrogen 2.998 N/A CYS 119.A N TRP 213.A O no hydrogen 3.191 N/A THR 125.A N ASP 122.A OD1 no hydrogen 2.672 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 3.280 N/A THR 125.A OG1 ASP 122.A OD2 no hydrogen 3.391 N/A ALA 126.A N ASP 122.A O no hydrogen 3.140 N/A LEU 130.A N ALA 126.A O no hydrogen 2.928 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.811 N/A GLN 131.A NE2 SER 128B.A O no hydrogen 2.786 N/A GLY 133.A N ILE 161.A O no hydrogen 2.917 N/A TYR 134.A N GLN 131.A O no hydrogen 3.046 N/A LYS 135.A NZ TYR 184.A OH no hydrogen 3.284 N/A GLY 136.A N LEU 159.A O no hydrogen 2.912 N/A ARG 137.A N VAL 204.A O no hydrogen 2.653 N/A ARG 137.A NE ASN 158.A OD1 no hydrogen 3.126 N/A VAL 138.A N VAL 157.A O no hydrogen 2.951 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.325 N/A GLY 140.A N GLN 155.A O no hydrogen 3.173 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 2.938 N/A GLY 142.A N ASP 198.A OD1 no hydrogen 2.758 N/A ASN 143.A N GLU 196.A O no hydrogen 2.890 N/A LEU 144.A N GLY 149.A O no hydrogen 2.826 N/A LEU 154.A N HIS 66.A O no hydrogen 2.692 N/A GLN 155.A N GLY 140.A O no hydrogen 3.051 N/A VAL 156.A N SER 5.A O no hydrogen 2.854 N/A VAL 157.A N VAL 138.A O no hydrogen 3.068 N/A LEU 159.A N GLY 136.A O no hydrogen 2.958 N/A ILE 161.A N TYR 134.A O no hydrogen 2.851 N/A VAL 162.A N CYS 181.A O no hydrogen 2.917 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.691 N/A ARG 164.A NH1 THR 176.A O no hydrogen 3.054 N/A ARG 164.A NH1 MET 179.A O no hydrogen 3.062 N/A ARG 164.A NH2 MET 179.A O no hydrogen 2.670 N/A VAL 166.A N GLU 163.A O no hydrogen 3.058 N/A CYS 167.A N GLU 163.A O no hydrogen 2.978 N/A CYS 167.A SG VAL 162.A O no hydrogen 3.481 N/A CYS 167.A SG GLU 163.A O no hydrogen 3.329 N/A LYS 168.A N ARG 164.A O no hydrogen 2.956 N/A ASP 169.A N PRO 165.A O no hydrogen 2.927 N/A SER 170.A N CYS 167.A O no hydrogen 3.299 N/A SER 170.A OG CYS 167.A O no hydrogen 2.681 N/A THR 171.A OG1 GLU 223.A OE2 no hydrogen 2.600 N/A ILE 173.A N THR 171.A OG1 no hydrogen 3.088 N/A ARG 174.A NE GLU 94A.A OE2 no hydrogen 2.941 N/A ARG 174.A NH2 GLU 94A.A OE1 no hydrogen 3.023 N/A THR 176.A OG1 ASP 97.A OD1 no hydrogen 2.510 N/A ASN 178.A N THR 176.A OG1 no hydrogen 3.174 N/A ASN 178.A ND2 ASP 97.A OD1 no hydrogen 3.071 N/A MET 179.A N THR 176.A O no hydrogen 3.104 N/A PHE 180.A N TYR 234.A O no hydrogen 3.088 N/A ALA 182.A N GLY 232.A O no hydrogen 2.898 N/A LYS 185.A N GLU 188B.A OE1 no hydrogen 2.608 N/A LYS 185.A NZ GLU 163.A OE1 no hydrogen 2.738 N/A ARG 191.A NE ASP 226A.A OD2 no hydrogen 2.706 N/A ARG 191.A NH1 ASP 228.A OD1 no hydrogen 2.906 N/A ARG 191.A NH2 ASP 228.A OD1 no hydrogen 2.804 N/A ARG 191.A NH2 ASP 226A.A O no hydrogen 2.785 N/A GLY 192.A N ASP 226A.A OD1 no hydrogen 2.863 N/A ASP 193.A N VAL 2.A O no hydrogen 3.317 N/A ALA 194.A N ASP 193.A OD1 no hydrogen 2.679 N/A CYS 195.A N ASP 198.A OD2 no hydrogen 2.800 N/A CYS 195.A SG LYS 145.A O no hydrogen 3.363 N/A ASP 198.A N CYS 195.A O no hydrogen 2.897 N/A SER 199.A OG HIS 43.A NE2 no hydrogen 3.200 N/A GLY 200.A N VAL 219.A O no hydrogen 3.016 N/A GLY 201.A N ASP 198.A O no hydrogen 3.078 N/A PHE 203.A N GLY 217.A O no hydrogen 2.806 N/A VAL 204.A N ARG 137.A O no hydrogen 2.790 N/A MET 205.A N TYR 214.A O no hydrogen 2.927 N/A SER 207.A N ARG 212.A O no hydrogen 2.877 N/A TYR 214.A N MET 205.A O no hydrogen 2.881 N/A TYR 214.A OH ASN 210B.A OD1 no hydrogen 2.903 N/A GLN 215.A N CYS 119.A O no hydrogen 2.824 N/A GLN 215.A NE2 GLY 217.A O no hydrogen 3.221 N/A MET 216.A N PHE 203.A O no hydrogen 3.015 N/A GLY 217.A N PHE 203.A O no hydrogen 3.114 N/A ILE 218.A N THR 235.A O no hydrogen 3.182 N/A VAL 219.A N GLY 201.A O no hydrogen 2.940 N/A SER 220.A N PHE 233.A O no hydrogen 3.049 N/A SER 220.A OG ASP 99.A OD2 no hydrogen 2.748 N/A TRP 221.A N PHE 233.A O no hydrogen 3.234 N/A CYS 225.A SG ALA 194.A O no hydrogen 3.938 N/A ARG 227.A NE GLU 146.A OE1 no hydrogen 3.084 N/A ARG 227.A NE GLU 146.A OE2 no hydrogen 3.054 N/A ARG 227.A NH2 GLU 146.A OE2 no hydrogen 2.652 N/A LYS 230.A N ARG 227.A O no hydrogen 3.140 N/A LYS 230.A NZ SER 170.A O no hydrogen 3.271 N/A LYS 230.A NZ GLU 223.A OE1 no hydrogen 2.335 N/A GLY 232.A N ALA 182.A O no hydrogen 3.106 N/A PHE 233.A N TRP 221.A O no hydrogen 2.798 N/A TYR 234.A N PHE 180.A O no hydrogen 2.810 N/A THR 235.A N ILE 218.A O no hydrogen 2.878 N/A THR 235.A OG1 ASP 99.A O no hydrogen 2.648 N/A HIS 236.A N ASN 178.A O no hydrogen 2.847 N/A VAL 237.A N MET 216.A O no hydrogen 3.067 N/A ARG 239.A N HIS 236.A O no hydrogen 3.193 N/A ARG 239.A NH1 ASN 178.A OD1 no hydrogen 3.064 N/A LEU 240.A N VAL 237.A O no hydrogen 3.040 N/A LYS 241.A N PHE 238.A O no hydrogen 3.228 N/A LYS 241.A NZ PRO 121.A O no hydrogen 2.868 N/A ILE 244.A N LEU 240.A O no hydrogen 3.239 N/A GLN 245.A N LYS 241.A O no hydrogen 2.880 N/A LYS 246.A N LYS 242.A O no hydrogen 3.081 N/A VAL 247.A N TRP 243.A O no hydrogen 3.041 N/A ILE 248.A N ILE 244.A O no hydrogen 3.087 N/A ASP 249.A N GLN 245.A O no hydrogen 2.690 N/A GLN 250.A N LYS 246.A O no hydrogen 2.839 N/A PHE 251.A N VAL 247.A O no hydrogen 2.711 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.726 N/A ARG 73A.A N TYR 71.A O no hydrogen 3.007 N/A GLU 94A.A N ASN 91.A OD1 no hydrogen 2.968 N/A ALA 127A.A N ARG 123.A O no hydrogen 2.829 N/A GLY 183A.A N PRO 160.A O no hydrogen 2.844 N/A PHE 209A.A N SER 207.A OG no hydrogen 3.126 N/A ASP 226A.A N ASP 193.A OD2 no hydrogen 2.938 N/A SER 128B.A N GLU 124.A O no hydrogen 2.782 N/A SER 128B.A OG GLU 124.A O no hydrogen 2.772 N/A SER 128B.A OG GLU 124.A OE1 no hydrogen 3.516 N/A SER 128B.A OG THR 125.A O no hydrogen 2.688 N/A GLU 188B.A N LYS 185.A O no hydrogen 2.936 N/A LEU 129C.A N THR 125.A O no hydrogen 2.981 N/A TRP 50D.A N TYR 47A.A O no hydrogen 2.851 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.991 N/A LYS 52F.A N TYR 47A.A O no hydrogen 3.195 N/A LYS 52F.A NZ HIS 43.A O no hydrogen 3.245 N/A PHE 54H.A N LEU 45.A O no hydrogen 2.954 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.823 N/A THR 55I.A OG1 GLU 56.A OE1 no hydrogen 2.910 N/A