Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ild_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG ASP 123.A OD1 no hydrogen 2.954 N/A ILE 7.A N ASP 123.A OD2 no hydrogen 2.925 N/A ASN 9.A N SER 5.A O no hydrogen 3.237 N/A MET 10.A N ILE 6.A O no hydrogen 2.971 N/A LEU 11.A N ILE 7.A O no hydrogen 3.099 N/A GLN 12.A N ALA 8.A O no hydrogen 3.249 N/A HIS 14.A ND1 THR 19.A O no hydrogen 2.868 N/A PHE 18.A N ASN 16.A OD1 no hydrogen 2.827 N/A THR 19.A N ASN 16.A O no hydrogen 2.906 N/A TYR 21.A OH GLN 12.A O no hydrogen 2.697 N/A TYR 23.A N SER 60.A O no hydrogen 3.311 N/A TYR 23.A OH GLU 125.A OE2 no hydrogen 2.585 N/A ASP 24.A N SER 60.A OG no hydrogen 2.651 N/A THR 25.A N ASP 24.A OD1 no hydrogen 2.660 N/A THR 25.A OG1 ASP 24.A OD1 no hydrogen 3.543 N/A ASN 26.A ND2 SER 60.A O no hydrogen 3.074 N/A ASN 26.A ND2 ASN 254.A OD1 no hydrogen 2.979 N/A TYR 27.A N GLN 58.A O no hydrogen 3.039 N/A LEU 28.A N VAL 251.A O no hydrogen 2.934 N/A ILE 29.A N LYS 56.A O no hydrogen 2.780 N/A TYR 30.A N VAL 249.A O no hydrogen 2.874 N/A THR 31.A N GLU 54.A O no hydrogen 2.867 N/A THR 31.A OG1 GLU 54.A O no hydrogen 2.469 N/A GLN 32.A N VAL 247.A O no hydrogen 2.856 N/A GLN 32.A NE2 THR 33.A O no hydrogen 3.338 N/A THR 33.A N LYS 52.A O no hydrogen 2.687 N/A THR 33.A OG1 ASP 35.A O no hydrogen 3.109 N/A THR 33.A OG1 GLN 244.A OE1 no hydrogen 2.895 N/A SER 34.A N THR 245.A O no hydrogen 2.833 N/A SER 34.A OG ASP 35.A OD1 no hydrogen 2.663 N/A SER 34.A OG THR 245.A O no hydrogen 3.342 N/A ASN 37.A ND2 ASP 239.A OD1 no hydrogen 3.292 N/A LYS 38.A NZ GLU 48.A O no hydrogen 3.260 N/A ALA 40.A N ASN 37.A OD1 no hydrogen 3.495 N/A ALA 42.A N GLU 39.A O no hydrogen 3.397 N/A TYR 44.A N ILE 41.A O no hydrogen 2.892 N/A TYR 44.A OH THR 139.A OG1 no hydrogen 2.676 N/A ALA 47.A N TYR 44.A O no hydrogen 3.183 N/A ALA 50.A N ALA 47.A O no hydrogen 3.253 N/A ARG 51.A N GLN 87.A OE1 no hydrogen 2.844 N/A ARG 51.A NE ASP 53.A OD1 no hydrogen 2.919 N/A GLU 54.A N THR 31.A O no hydrogen 3.221 N/A VAL 55.A N TRP 86.A O no hydrogen 2.841 N/A LYS 56.A N ILE 29.A O no hydrogen 2.808 N/A LYS 56.A NZ GLN 228.A OE1 no hydrogen 2.833 N/A LYS 56.A NZ GLU 235.A OE2 no hydrogen 2.943 N/A PHE 57.A N SER 84.A O no hydrogen 3.069 N/A GLN 58.A N TYR 27.A O no hydrogen 2.863 N/A GLN 58.A NE2 THR 25.A O no hydrogen 3.156 N/A LEU 59.A N GLN 82.A O no hydrogen 2.831 N/A SER 60.A N ASN 26.A OD1 no hydrogen 2.882 N/A SER 60.A OG THR 81.A OG1 no hydrogen 2.537 N/A LEU 61.A N TYR 80.A O no hydrogen 2.852 N/A ALA 62.A N TYR 21.A O no hydrogen 2.656 N/A PHE 63.A N ALA 78.A O no hydrogen 2.530 N/A LEU 65.A N LEU 76.A O no hydrogen 2.957 N/A ARG 67.A NE MET 10.A O no hydrogen 3.269 N/A ARG 67.A NE LEU 11.A O no hydrogen 3.227 N/A ARG 67.A NH2 MET 10.A O no hydrogen 3.216 N/A GLY 68.A N SER 74.A O no hydrogen 2.804 N/A LEU 70.A N SER 74.A OG no hydrogen 2.824 N/A GLY 71.A N GLY 68.A O no hydrogen 3.075 N/A SER 74.A OG GLY 71.A O no hydrogen 2.699 N/A VAL 75.A N GLY 109.A O no hydrogen 2.763 N/A LEU 76.A N TRP 66.A O no hydrogen 3.024 N/A GLY 77.A N PHE 107.A O no hydrogen 2.926 N/A ALA 78.A N PHE 63.A O no hydrogen 2.937 N/A SER 79.A N GLN 105.A O no hydrogen 3.356 N/A TYR 80.A N LEU 61.A O no hydrogen 2.667 N/A TYR 80.A OH GLN 82.A OE1 no hydrogen 2.671 N/A THR 81.A N GLU 103.A O no hydrogen 3.035 N/A THR 81.A OG1 SER 60.A OG no hydrogen 2.537 N/A GLN 82.A N LEU 59.A O no hydrogen 2.809 N/A GLN 82.A NE2 SER 84.A OG no hydrogen 3.225 N/A LYS 83.A N ASN 101.A O no hydrogen 3.358 N/A SER 84.A N PHE 57.A O no hydrogen 2.758 N/A SER 84.A OG THR 100.A OG1 no hydrogen 3.146 N/A TRP 85.A N GLU 99.A O no hydrogen 2.836 N/A TRP 85.A NE1 GLU 235.A OE2 no hydrogen 2.651 N/A TRP 86.A N VAL 55.A O no hydrogen 3.200 N/A TRP 86.A NE1 SER 95.A O no hydrogen 3.112 N/A GLN 87.A N PRO 96.A O no hydrogen 2.765 N/A GLN 87.A NE2 ARG 51.A O no hydrogen 2.885 N/A GLN 87.A NE2 GLU 54.A OE2 no hydrogen 2.927 N/A LEU 88.A N TRP 86.A O no hydrogen 2.668 N/A SER 89.A OG ASP 53.A OD2 no hydrogen 2.694 N/A ASN 90.A N GLN 87.A O no hydrogen 3.115 N/A ASN 90.A ND2 ASN 49.A O no hydrogen 2.733 N/A ASN 90.A ND2 GLN 87.A OE1 no hydrogen 2.983 N/A SER 91.A N SER 89.A O no hydrogen 2.640 N/A GLU 93.A N ASN 90.A O no hydrogen 3.148 N/A SER 94.A N SER 91.A O no hydrogen 2.943 N/A SER 95.A N ASN 90.A O no hydrogen 3.084 N/A SER 95.A OG LEU 88.A O no hydrogen 2.502 N/A ARG 98.A N TRP 85.A O no hydrogen 2.871 N/A ARG 98.A NE GLU 54.A OE1 no hydrogen 3.082 N/A ARG 98.A NE GLU 54.A OE2 no hydrogen 2.539 N/A ARG 98.A NH1 ASP 239.A OD2 no hydrogen 2.791 N/A ARG 98.A NH2 GLU 54.A OE1 no hydrogen 2.647 N/A GLU 99.A N TRP 85.A O no hydrogen 3.311 N/A THR 100.A OG1 SER 84.A OG no hydrogen 3.146 N/A ASN 101.A N LYS 83.A O no hydrogen 2.983 N/A ASN 101.A ND2 GLU 99.A OE2 no hydrogen 3.202 N/A TYR 102.A N SER 132.A O no hydrogen 2.878 N/A GLU 103.A N THR 81.A O no hydrogen 2.769 N/A GLN 105.A N SER 79.A O no hydrogen 2.880 N/A GLN 105.A NE2 TYR 23.A OH no hydrogen 2.971 N/A GLN 105.A NE2 SER 79.A OG no hydrogen 2.811 N/A LEU 106.A N TYR 128.A O no hydrogen 3.078 N/A PHE 107.A N GLY 77.A O no hydrogen 2.846 N/A LEU 108.A N MET 126.A O no hydrogen 2.727 N/A GLY 109.A N VAL 75.A O no hydrogen 2.651 N/A PHE 110.A N VAL 124.A O no hydrogen 2.816 N/A ALA 111.A N ASN 73.A O no hydrogen 2.820 N/A THR 112.A N ARG 122.A O no hydrogen 2.686 N/A THR 112.A OG1 LEU 121.A O no hydrogen 2.743 N/A ARG 115.A NH1 THR 120.A OG1 no hydrogen 3.017 N/A PHE 116.A N TRP 119.A O no hydrogen 2.799 N/A TRP 119.A N PHE 116.A O no hydrogen 2.828 N/A THR 120.A N GLU 153.A O no hydrogen 2.714 N/A LEU 121.A N TYR 114.A O no hydrogen 2.934 N/A ARG 122.A N MET 151.A O no hydrogen 2.822 N/A ASP 123.A N MET 151.A O no hydrogen 3.330 N/A VAL 124.A N PHE 110.A O no hydrogen 3.181 N/A GLU 125.A N ARG 149.A O no hydrogen 2.870 N/A MET 126.A N LEU 108.A O no hydrogen 2.912 N/A GLY 127.A N TYR 147.A O no hydrogen 3.080 N/A TYR 128.A N LEU 106.A O no hydrogen 2.759 N/A ASN 129.A N ARG 145.A O no hydrogen 2.638 N/A ASN 129.A ND2 GLU 103.A OE2 no hydrogen 2.964 N/A ASN 129.A ND2 GLN 105.A OE1 no hydrogen 2.967 N/A HIS 130.A N PRO 104.A O no hydrogen 3.211 N/A ASP 131.A N TRP 143.A O no hydrogen 3.156 N/A SER 132.A N TYR 102.A O no hydrogen 3.238 N/A ASN 133.A N ARG 141.A O no hydrogen 3.157 N/A ASN 133.A ND2 GLU 99.A OE1 no hydrogen 2.711 N/A ASN 133.A ND2 GLU 99.A OE2 no hydrogen 3.361 N/A ASN 133.A ND2 THR 139.A O no hydrogen 3.119 N/A ARG 135.A N ASN 133.A OD1 no hydrogen 3.234 N/A ARG 135.A NH2 PHE 97.A O no hydrogen 3.461 N/A THR 139.A OG1 TYR 44.A OH no hydrogen 2.676 N/A SER 140.A OG ARG 135.A O no hydrogen 2.813 N/A SER 140.A OG ASP 172.A OD2 no hydrogen 3.101 N/A ARG 141.A N ASN 133.A OD1 no hydrogen 3.105 N/A SER 142.A N ASN 173.A OD1 no hydrogen 2.715 N/A TRP 143.A N ASP 131.A O no hydrogen 3.020 N/A ARG 145.A N ASN 129.A O no hydrogen 2.884 N/A ARG 145.A NH2 ASN 129.A OD1 no hydrogen 3.275 N/A LEU 146.A N TYR 165.A O no hydrogen 2.832 N/A TYR 147.A N GLY 127.A O no hydrogen 2.927 N/A TYR 147.A OH GLU 125.A OE2 no hydrogen 2.755 N/A THR 148.A N PRO 163.A O no hydrogen 3.053 N/A ARG 149.A N GLU 125.A O no hydrogen 2.668 N/A ARG 149.A NE GLU 125.A OE1 no hydrogen 2.663 N/A ARG 149.A NH1 GLU 160.A OE1 no hydrogen 2.687 N/A ARG 149.A NH2 ASP 123.A OD2 no hydrogen 2.834 N/A ARG 149.A NH2 GLU 125.A OE1 no hydrogen 2.800 N/A LEU 150.A N VAL 161.A O no hydrogen 2.917 N/A MET 151.A N ASP 123.A O no hydrogen 3.165 N/A ALA 152.A N VAL 159.A O no hydrogen 2.790 N/A GLU 153.A N THR 120.A O no hydrogen 2.933 N/A ASN 154.A N TRP 157.A O no hydrogen 3.112 N/A TRP 157.A N ASN 154.A O no hydrogen 3.234 N/A LEU 158.A N GLY 188.A O no hydrogen 2.840 N/A VAL 159.A N ALA 152.A O no hydrogen 2.839 N/A GLU 160.A N LYS 186.A O no hydrogen 2.911 N/A VAL 161.A N LEU 150.A O no hydrogen 2.845 N/A LYS 162.A N GLN 184.A O no hydrogen 2.841 N/A LYS 162.A NZ GLN 105.A OE1 no hydrogen 2.940 N/A TRP 164.A N TYR 182.A O no hydrogen 2.854 N/A TYR 165.A N LEU 146.A O no hydrogen 2.767 N/A VAL 167.A N ALA 144.A O no hydrogen 3.089 N/A ASN 169.A ND2 ASP 171.A OD2 no hydrogen 2.441 N/A ASP 171.A N ASN 169.A OD1 no hydrogen 2.810 N/A ASN 173.A N THR 170.A O no hydrogen 2.804 N/A ASN 173.A ND2 SER 142.A O no hydrogen 2.782 N/A ASN 173.A ND2 ASN 173.A O no hydrogen 2.734 N/A ASP 175.A N ASP 175.A OD1 no hydrogen 2.539 N/A ILE 176.A N ASN 173.A O no hydrogen 3.098 N/A LYS 178.A N ASP 175.A O no hydrogen 2.787 N/A LYS 178.A NZ TYR 179.A OH no hydrogen 3.511 N/A TYR 179.A N ILE 176.A O no hydrogen 2.994 N/A MET 180.A N ILE 176.A O no hydrogen 2.978 N/A GLY 181.A N THR 177.A O no hydrogen 2.781 N/A GLN 184.A N LYS 162.A O no hydrogen 3.051 N/A LEU 185.A N GLY 200.A O no hydrogen 2.816 N/A LYS 186.A N GLU 160.A O no hydrogen 2.943 N/A LYS 186.A NZ GLU 160.A OE2 no hydrogen 3.420 N/A ILE 187.A N ALA 198.A O no hydrogen 2.740 N/A GLY 188.A N LEU 158.A O no hydrogen 2.942 N/A TYR 189.A N LEU 196.A O no hydrogen 2.716 N/A HIS 190.A N ASN 156.A O no hydrogen 2.755 N/A HIS 190.A ND1 GLY 192.A O no hydrogen 2.798 N/A HIS 190.A NE2 PHE 257.A O no hydrogen 2.392 N/A LEU 191.A N ALA 194.A O no hydrogen 2.879 N/A ALA 194.A N LEU 191.A O no hydrogen 3.024 N/A VAL 195.A N SER 216.A O no hydrogen 3.045 N/A LEU 196.A N TYR 189.A O no hydrogen 2.948 N/A SER 197.A N GLY 214.A O no hydrogen 2.901 N/A ALA 198.A N ILE 187.A O no hydrogen 2.793 N/A LYS 199.A N GLU 212.A O no hydrogen 3.006 N/A GLY 200.A N LEU 185.A O no hydrogen 2.847 N/A GLN 201.A N GLY 210.A O no hydrogen 3.191 N/A GLN 201.A NE2 TYR 230.A OH no hydrogen 3.464 N/A ASN 203.A N TYR 208.A O no hydrogen 2.838 N/A ASN 203.A ND2 THR 177.A O no hydrogen 2.807 N/A TRP 204.A NE1 TYR 183.A OH no hydrogen 2.655 N/A ASN 205.A N ASN 203.A OD1 no hydrogen 2.968 N/A THR 206.A N ASN 203.A OD1 no hydrogen 3.038 N/A THR 206.A OG1 LYS 178.A O no hydrogen 2.585 N/A GLY 207.A N ASN 203.A O no hydrogen 3.018 N/A TYR 208.A N THR 206.A OG1 no hydrogen 3.335 N/A GLY 210.A N GLN 201.A O no hydrogen 2.958 N/A ALA 211.A N SER 231.A O no hydrogen 2.956 N/A LEU 213.A N VAL 229.A O no hydrogen 3.167 N/A GLY 214.A N SER 197.A O no hydrogen 2.815 N/A LEU 215.A N THR 227.A O no hydrogen 3.104 N/A SER 216.A N VAL 195.A O no hydrogen 2.983 N/A SER 216.A OG ASP 255.A OD2 no hydrogen 2.474 N/A TYR 217.A N LEU 225.A O no hydrogen 3.075 N/A ILE 219.A N VAL 223.A O no hydrogen 2.714 N/A THR 220.A N VAL 223.A O no hydrogen 2.868 N/A HIS 222.A N THR 220.A OG1 no hydrogen 3.075 N/A VAL 223.A N THR 220.A OG1 no hydrogen 3.377 N/A ARG 224.A N MET 252.A O no hydrogen 2.771 N/A ARG 224.A NE SER 216.A OG no hydrogen 3.039 N/A ARG 224.A NH2 ASP 193.A O no hydrogen 2.624 N/A ARG 224.A NH2 SER 216.A O no hydrogen 3.462 N/A ARG 224.A NH2 SER 216.A OG no hydrogen 3.285 N/A LEU 225.A N TYR 217.A O no hydrogen 2.896 N/A TYR 226.A N GLY 250.A O no hydrogen 2.761 N/A THR 227.A N LEU 215.A O no hydrogen 2.929 N/A GLN 228.A N GLY 248.A O no hydrogen 2.919 N/A GLN 228.A NE2 TYR 27.A OH no hydrogen 3.053 N/A GLN 228.A NE2 TYR 226.A OH no hydrogen 3.133 N/A VAL 229.A N LEU 213.A O no hydrogen 3.037 N/A TYR 230.A N ARG 246.A O no hydrogen 2.556 N/A TYR 230.A OH TYR 233.A O no hydrogen 2.625 N/A SER 231.A N ALA 211.A O no hydrogen 2.998 N/A SER 231.A OG THR 245.A OG1 no hydrogen 3.218 N/A GLY 232.A N GLN 244.A O no hydrogen 2.797 N/A TYR 233.A N GLY 209.A O no hydrogen 2.718 N/A SER 236.A OG ASP 239.A OD2 no hydrogen 3.391 N/A LEU 237.A N ASN 101.A OD1 no hydrogen 2.784 N/A ILE 238.A N GLU 99.A OE2 no hydrogen 2.513 N/A ASP 239.A N SER 236.A O no hydrogen 3.086 N/A TYR 240.A N LEU 237.A O no hydrogen 2.969 N/A TYR 240.A OH ASP 175.A OD1 no hydrogen 2.614 N/A PHE 242.A N ASP 239.A O no hydrogen 2.805 N/A GLN 244.A NE2 ASP 239.A OD2 no hydrogen 3.194 N/A THR 245.A N SER 34.A OG no hydrogen 2.848 N/A THR 245.A OG1 SER 231.A OG no hydrogen 3.218 N/A ARG 246.A N TYR 230.A O no hydrogen 2.538 N/A ARG 246.A NE THR 31.A OG1 no hydrogen 3.207 N/A ARG 246.A NH1 GLU 235.A OE1 no hydrogen 3.028 N/A ARG 246.A NH1 GLN 244.A OE1 no hydrogen 3.108 N/A ARG 246.A NH2 GLU 54.A OE1 no hydrogen 2.257 N/A VAL 247.A N GLN 32.A O no hydrogen 3.237 N/A GLY 248.A N GLN 228.A O no hydrogen 2.904 N/A VAL 249.A N TYR 30.A O no hydrogen 2.880 N/A GLY 250.A N TYR 226.A O no hydrogen 2.878 N/A VAL 251.A N LEU 28.A O no hydrogen 3.142 N/A MET 252.A N ARG 224.A O no hydrogen 2.838 N/A LEU 253.A N ASN 26.A O no hydrogen 2.725 N/A ASN 254.A ND2 ASP 24.A O no hydrogen 2.830 N/A ASN 254.A ND2 ASP 255.A O no hydrogen 3.613 N/A LEU 256.A N ASP 255.A OD1 no hydrogen 2.685 N/A