Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e40_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG GLU 113.A OE1 no hydrogen 2.623 N/A SER 1.A OG GLU 113.A OE2 no hydrogen 3.287 N/A PHE 2.A N GLU 113.A OE2 no hydrogen 2.906 N/A ILE 3.A N SER 1.A OG no hydrogen 3.061 N/A ILE 3.A N GLU 113.A OE2 no hydrogen 3.348 N/A LYS 4.A N SER 1.A OG no hydrogen 3.111 N/A ILE 6.A N ILE 3.A O no hydrogen 2.832 N/A TYR 7.A N LYS 4.A O no hydrogen 3.188 N/A TYR 7.A OH THR 174.A OG1 no hydrogen 2.772 N/A ILE 10.A N ILE 6.A O no hydrogen 2.967 N/A ASN 11.A N TYR 7.A O no hydrogen 2.684 N/A SER 12.A N GLN 8.A O no hydrogen 3.051 N/A SER 12.A OG GLN 8.A O no hydrogen 3.314 N/A ILE 13.A N ASP 9.A O no hydrogen 2.802 N/A LEU 14.A N ILE 10.A O no hydrogen 2.956 N/A ILE 15.A N ASN 11.A O no hydrogen 3.257 N/A GLY 16.A N CYS 171.A O no hydrogen 3.087 N/A GLN 17.A N LEU 14.A O no hydrogen 2.969 N/A VAL 19.A N LEU 169.A O no hydrogen 2.934 N/A ARG 21.A N GLU 167.A O no hydrogen 3.295 N/A PHE 26.A N GLY 23.A O no hydrogen 2.895 N/A GLU 27.A N GLU 24.A O no hydrogen 3.120 N/A LYS 28.A N PRO 25.A O no hydrogen 2.866 N/A VAL 30.A N PHE 26.A O no hydrogen 2.975 N/A TYR 31.A N GLU 27.A O no hydrogen 2.916 N/A TYR 31.A OH GLU 47.A OE2 no hydrogen 2.784 N/A LYS 32.A N LYS 28.A O no hydrogen 2.840 N/A PHE 33.A N LEU 29.A O no hydrogen 2.959 N/A LEU 34.A N VAL 30.A O no hydrogen 3.062 N/A LYS 35.A N TYR 31.A O no hydrogen 2.804 N/A GLU 36.A N LYS 32.A O no hydrogen 3.050 N/A ASN 37.A N PHE 33.A O no hydrogen 2.912 N/A LEU 38.A N LEU 34.A O no hydrogen 2.818 N/A LEU 41.A N LEU 38.A O no hydrogen 2.943 N/A THR 42.A OG1 LEU 34.A O no hydrogen 3.149 N/A THR 42.A OG1 LEU 38.A O no hydrogen 2.796 N/A PHE 43.A N LEU 105.A O no hydrogen 2.822 N/A LYS 44.A N GLU 47.A OE2 no hydrogen 2.842 N/A LYS 44.A NZ GLU 27.A OE2 no hydrogen 3.029 N/A GLN 45.A NE2 LEU 77.A O no hydrogen 3.626 N/A GLN 45.A NE2 LEU 78.A O no hydrogen 2.892 N/A TYR 48.A N LYS 44.A O no hydrogen 2.957 N/A LEU 49.A N GLN 45.A O no hydrogen 3.145 N/A ASN 50.A N TYR 46.A O no hydrogen 2.862 N/A ASN 50.A ND2 PHE 94.A O no hydrogen 2.964 N/A ASP 51.A N GLU 47.A O no hydrogen 2.879 N/A LEU 52.A N TYR 48.A O no hydrogen 2.930 N/A PHE 53.A N LEU 49.A O no hydrogen 3.063 N/A MET 54.A N ASN 50.A O no hydrogen 2.905 N/A LYS 55.A N ASP 51.A O no hydrogen 3.111 N/A ASN 56.A N PHE 53.A O no hydrogen 3.050 N/A ASN 56.A ND2 LEU 52.A O no hydrogen 2.814 N/A ILE 59.A N ASN 56.A O no hydrogen 2.871 N/A ARG 65.A N GLY 61.A O no hydrogen 3.343 N/A ARG 65.A NE ILE 59.A O no hydrogen 2.992 N/A ARG 65.A NH1 THR 85.A O no hydrogen 2.814 N/A ARG 65.A NH1 TRP 88.A O no hydrogen 3.087 N/A ARG 65.A NH2 TRP 88.A O no hydrogen 3.538 N/A TYR 66.A N HIS 62.A O no hydrogen 2.782 N/A TYR 66.A OH ARG 80.A O no hydrogen 2.866 N/A LYS 67.A N GLU 63.A O no hydrogen 3.191 N/A LEU 68.A N ARG 65.A O no hydrogen 3.129 N/A PHE 69.A N TYR 66.A O no hydrogen 3.117 N/A SER 71.A OG GLU 149.A OE1 no hydrogen 2.697 N/A SER 71.A OG GLU 149.A OE2 no hydrogen 3.270 N/A THR 73.A N GLU 149.A OE2 no hydrogen 3.359 N/A THR 73.A OG1 GLU 149.A OE2 no hydrogen 2.568 N/A LEU 74.A N SER 71.A OG no hydrogen 3.160 N/A LEU 75.A N SER 71.A O no hydrogen 2.978 N/A PHE 76.A N PRO 72.A O no hydrogen 2.971 N/A LEU 77.A N THR 73.A O no hydrogen 2.950 N/A LEU 78.A N LEU 74.A O no hydrogen 2.880 N/A SER 79.A N LEU 75.A O no hydrogen 3.069 N/A SER 79.A OG LEU 75.A O no hydrogen 2.730 N/A ARG 80.A NE ASP 100.A OD2 no hydrogen 2.934 N/A ARG 80.A NH1 GLU 95.A O no hydrogen 2.806 N/A ARG 80.A NH1 ASP 100.A OD1 no hydrogen 2.810 N/A ARG 80.A NH2 GLU 95.A O no hydrogen 3.310 N/A THR 85.A N GLY 81.A O no hydrogen 2.882 N/A THR 85.A OG1 ARG 80.A O no hydrogen 3.081 N/A THR 85.A OG1 GLY 81.A O no hydrogen 2.681 N/A GLU 86.A N LYS 82.A O no hydrogen 2.874 N/A ASN 87.A N ALA 83.A O no hydrogen 2.949 N/A TRP 88.A NE1 ASN 50.A OD1 no hydrogen 2.880 N/A SER 89.A N ASN 92.A O no hydrogen 3.421 N/A SER 89.A OG GLU 91.A OE1 no hydrogen 3.431 N/A GLU 91.A N SER 89.A OG no hydrogen 3.261 N/A ASN 92.A N SER 89.A O no hydrogen 2.794 N/A PHE 94.A N ASN 50.A OD1 no hydrogen 2.806 N/A ASP 100.A N LYS 97.A O no hydrogen 3.166 N/A THR 101.A OG1 LEU 77.A O no hydrogen 2.730 N/A ALA 102.A N GLN 45.A OE1 no hydrogen 2.927 N/A ASP 103.A N LEU 115.A O no hydrogen 3.041 N/A ILE 104.A N LEU 115.A O no hydrogen 3.017 N/A LEU 105.A N PHE 43.A O no hydrogen 2.689 N/A LEU 106.A N GLU 113.A O no hydrogen 2.862 N/A VAL 107.A N LEU 41.A O no hydrogen 2.925 N/A LYS 108.A N PHE 111.A O no hydrogen 3.137 N/A PHE 111.A N LYS 108.A O no hydrogen 2.908 N/A TYR 112.A N LEU 152.A O no hydrogen 2.813 N/A TYR 112.A OH TYR 48.A OH no hydrogen 2.435 N/A GLU 113.A N LEU 106.A O no hydrogen 2.764 N/A LEU 114.A N ASP 154.A O no hydrogen 2.921 N/A LEU 115.A N ILE 104.A O no hydrogen 2.731 N/A ASP 116.A N ASN 156.A O no hydrogen 2.972 N/A VAL 117.A N ASP 103.A OD1 no hydrogen 3.010 N/A LYS 118.A N LEU 158.A O no hydrogen 2.728 N/A LYS 118.A NZ ASN 130.A O no hydrogen 2.992 N/A ARG 120.A N VAL 160.A O no hydrogen 3.031 N/A ARG 120.A NH1 GLU 159.A OE2 no hydrogen 3.177 N/A ASN 121.A ND2 SER 123.A OG no hydrogen 2.981 N/A ASN 121.A ND2 TRP 162.A O no hydrogen 3.629 N/A ILE 122.A N TRP 162.A O no hydrogen 2.842 N/A ILE 131.A N ILE 197.A O no hydrogen 2.723 N/A ALA 134.A N MET 195.A O no hydrogen 2.693 N/A LYS 136.A N SER 133.A OG no hydrogen 2.932 N/A LYS 136.A NZ THR 101.A OG1 no hydrogen 2.733 N/A LEU 137.A N SER 133.A O no hydrogen 3.055 N/A ALA 138.A N ALA 134.A O no hydrogen 2.928 N/A GLN 139.A N TYR 135.A O no hydrogen 3.006 N/A GLN 139.A NE2 TYR 135.A O no hydrogen 3.101 N/A THR 140.A N LYS 136.A O no hydrogen 2.976 N/A THR 140.A OG1 LYS 136.A O no hydrogen 2.785 N/A CYS 141.A N LEU 137.A O no hydrogen 2.911 N/A CYS 141.A SG LEU 137.A O no hydrogen 3.393 N/A ALA 142.A N ALA 138.A O no hydrogen 2.941 N/A LYS 143.A N GLN 139.A O no hydrogen 2.935 N/A MET 144.A N THR 140.A O no hydrogen 2.823 N/A ILE 145.A N CYS 141.A O no hydrogen 3.046 N/A ASP 146.A N ALA 142.A O no hydrogen 2.962 N/A ASN 147.A N LYS 143.A O no hydrogen 3.136 N/A ASN 147.A ND2 LYS 143.A O no hydrogen 2.810 N/A LYS 148.A N ILE 145.A O no hydrogen 3.218 N/A GLU 149.A N MET 144.A O no hydrogen 2.966 N/A ASP 154.A N TYR 112.A O no hydrogen 2.750 N/A ASN 156.A N LEU 114.A O no hydrogen 2.812 N/A ASN 156.A ND2 GLU 113.A OE1 no hydrogen 2.768 N/A TYR 157.A N ALA 177.A O no hydrogen 2.874 N/A LEU 158.A N ASP 116.A O no hydrogen 3.136 N/A GLU 159.A N SER 175.A O no hydrogen 2.822 N/A VAL 160.A N LYS 118.A O no hydrogen 2.770 N/A ASP 161.A N SER 173.A O no hydrogen 2.916 N/A TRP 162.A N ARG 120.A O no hydrogen 2.878 N/A GLU 163.A N VAL 170.A O no hydrogen 2.876 N/A ASN 165.A N ASP 168.A O no hydrogen 2.753 N/A ASP 168.A N ASN 165.A O no hydrogen 3.308 N/A LEU 169.A N VAL 19.A O no hydrogen 2.859 N/A VAL 170.A N GLU 163.A O no hydrogen 2.893 N/A CYS 171.A N GLN 17.A O no hydrogen 3.054 N/A CYS 171.A SG ASP 161.A O no hydrogen 3.662 N/A CYS 171.A SG SER 173.A O no hydrogen 3.556 N/A VAL 172.A N ASP 161.A O no hydrogen 2.861 N/A SER 173.A OG ASP 161.A OD2 no hydrogen 2.792 N/A THR 174.A OG1 TYR 7.A OH no hydrogen 2.772 N/A THR 174.A OG1 ASN 11.A OD1 no hydrogen 2.790 N/A SER 175.A N GLU 159.A O no hydrogen 3.078 N/A ALA 177.A N TYR 157.A O no hydrogen 3.121 N/A GLU 178.A N GLN 206.A OE1 no hydrogen 2.929 N/A LEU 179.A N ILE 155.A O no hydrogen 2.863 N/A LYS 181.A N GLU 178.A O no hydrogen 3.130 N/A SER 182.A N LEU 179.A O no hydrogen 2.996 N/A SER 182.A OG LEU 179.A O no hydrogen 2.768 N/A GLU 183.A N ASP 205.A OD1 no hydrogen 3.512 N/A GLU 183.A N ASP 205.A OD2 no hydrogen 3.091 N/A GLU 186.A N GLU 183.A O no hydrogen 3.011 N/A LEU 187.A N PRO 184.A O no hydrogen 3.144 N/A ASN 190.A N GLN 196.A O no hydrogen 2.826 N/A ASN 190.A ND2 GLN 198.A OE1 no hydrogen 2.900 N/A ALA 193.A N ASN 190.A OD1 no hydrogen 3.146 N/A ALA 194.A N ALA 192.A O no hydrogen 2.854 N/A MET 195.A N TRP 191.A O no hydrogen 3.085 N/A GLN 196.A N ALA 193.A O no hydrogen 3.107 N/A ILE 197.A N ILE 132.A O no hydrogen 2.878 N/A GLN 198.A N TYR 188.A O no hydrogen 2.925 N/A GLN 198.A NE2 ASN 130.A OD1 no hydrogen 2.957 N/A ARG 202.A N GLU 159.A OE1 no hydrogen 2.954 N/A ARG 202.A NH2 ASP 161.A OD2 no hydrogen 2.945 N/A ASP 203.A N HIS 200.A O no hydrogen 2.817 N/A LEU 204.A N VAL 201.A O no hydrogen 3.046 N/A GLN 206.A NE2 GLU 178.A O no hydrogen 2.977 N/A GLN 206.A NE2 ASP 205.A O no hydrogen 2.860 N/A PHE 208.A N LYS 181.A O no hydrogen 2.975 N/A THR 211.A N GLU 214.A OE2 no hydrogen 2.823 N/A ARG 212.A NH1 PHE 153.A O no hydrogen 3.054 N/A ARG 212.A NH1 ASP 154.A OD1 no hydrogen 3.374 N/A ARG 212.A NH2 ASP 154.A OD1 no hydrogen 3.042 N/A GLU 214.A N THR 211.A OG1 no hydrogen 3.111 N/A TRP 215.A N THR 211.A O no hydrogen 2.916 N/A TRP 215.A NE1 SER 182.A O no hydrogen 2.779 N/A ALA 216.A N ARG 212.A O no hydrogen 2.942 N/A LYS 217.A N GLU 213.A O no hydrogen 3.036 N/A SER 218.A N GLU 214.A O no hydrogen 3.008 N/A TYR 219.A N TRP 215.A O no hydrogen 2.797 N/A TYR 219.A OH ALA 134.A O no hydrogen 2.585 N/A LEU 220.A N ALA 216.A O no hydrogen 3.034 N/A LYS 221.A N LYS 217.A O no hydrogen 2.989 N/A HIS 222.A N SER 218.A O no hydrogen 2.973 N/A HIS 222.A NE2 LEU 187.A O no hydrogen 2.893 N/A PHE 223.A N TYR 219.A O no hydrogen 2.706 N/A VAL 224.A N LEU 220.A O no hydrogen 2.941 N/A THR 225.A N LYS 221.A O no hydrogen 2.967 N/A THR 225.A OG1 LYS 221.A O no hydrogen 2.859 N/A GLN 226.A N HIS 222.A O no hydrogen 2.845 N/A ALA 227.A N PHE 223.A O no hydrogen 2.892 N/A GLU 228.A N VAL 224.A O no hydrogen 3.153 N/A GLN 229.A N THR 225.A O no hydrogen 3.092 N/A ARG 230.A N GLN 226.A O no hydrogen 2.839 N/A ALA 231.A N ALA 227.A O no hydrogen 2.888 N/A ILE 232.A N GLU 228.A O no hydrogen 3.328 N/A SER 233.A N GLN 229.A O no hydrogen 2.872 N/A SER 233.A OG GLN 229.A O no hydrogen 3.247 N/A MET 234.A N ARG 230.A O no hydrogen 2.987 N/A ILE 235.A N ILE 232.A O no hydrogen 3.171 N/A LYS 237.A N SER 233.A O no hydrogen 2.944 N/A PHE 238.A N MET 234.A O no hydrogen 2.701 N/A VAL 239.A N ILE 235.A O no hydrogen 3.123 N/A LYS 240.A N ILE 235.A O no hydrogen 2.874 N/A PHE 242.A N VAL 239.A O no hydrogen 2.996 N/A LYS 243.A N VAL 239.A O no hydrogen 3.109 N/A LYS 243.A N LYS 240.A O no hydrogen 3.313 N/A TYR 245.A N PHE 242.A O no hydrogen 3.033 N/A ILE 246.A N LYS 243.A O no hydrogen 3.142 N/A LEU 247.A N LYS 243.A O no hydrogen 3.128 N/A