Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cqe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A N ASP 1.A OD1 no hydrogen 2.575 N/A ILE 4.A N TYR 69.A O no hydrogen 2.796 N/A GLN 8.A N PRO 5.A O no hydrogen 3.263 N/A THR 10.A N LYS 25.A O no hydrogen 3.014 N/A GLY 12.A N LYS 23.A O no hydrogen 2.681 N/A ILE 15.A N VAL 21.A O no hydrogen 2.613 N/A GLY 16.A N VAL 21.A O no hydrogen 3.467 N/A THR 20.A N MET 34.A O no hydrogen 2.761 N/A VAL 21.A N GLY 16.A O no hydrogen 2.894 N/A TYR 22.A N VAL 32.A O no hydrogen 2.735 N/A LYS 23.A N GLN 13.A O no hydrogen 2.905 N/A GLY 24.A N VAL 30.A O no hydrogen 2.798 N/A LYS 25.A N THR 10.A O no hydrogen 2.833 N/A TRP 26.A N GLY 28.A O no hydrogen 2.811 N/A TRP 26.A NE1 GLN 8.A OE1 no hydrogen 2.993 N/A VAL 30.A N GLY 24.A O no hydrogen 3.012 N/A ALA 31.A N THR 79.A O no hydrogen 2.901 N/A VAL 32.A N TYR 22.A O no hydrogen 2.723 N/A LYS 33.A N ILE 77.A O no hydrogen 2.761 N/A MET 34.A N THR 20.A O no hydrogen 2.624 N/A LEU 35.A N LEU 75.A O no hydrogen 2.969 N/A VAL 37.A N LEU 35.A O no hydrogen 2.835 N/A THR 41.A N GLN 44.A OE1 no hydrogen 3.161 N/A GLN 43.A N THR 41.A O no hydrogen 2.557 N/A GLN 44.A N THR 41.A O no hydrogen 3.000 N/A GLN 44.A N THR 41.A OG1 no hydrogen 3.006 N/A LEU 45.A N THR 41.A O no hydrogen 3.105 N/A ALA 47.A N GLN 43.A O no hydrogen 3.358 N/A PHE 48.A N GLN 44.A O no hydrogen 2.847 N/A LYS 49.A N LEU 45.A O no hydrogen 2.939 N/A ASN 50.A N GLN 46.A O no hydrogen 3.058 N/A GLU 51.A N ALA 47.A O no hydrogen 2.916 N/A VAL 52.A N PHE 48.A O no hydrogen 2.750 N/A GLY 53.A N LYS 49.A O no hydrogen 2.952 N/A VAL 54.A N ASN 50.A O no hydrogen 3.386 N/A VAL 54.A N GLU 51.A O no hydrogen 3.078 N/A LEU 55.A N GLU 51.A O no hydrogen 3.188 N/A ARG 56.A N VAL 52.A O no hydrogen 2.938 N/A LYS 57.A N VAL 54.A O no hydrogen 3.088 N/A LYS 57.A NZ LYS 120.A O no hydrogen 2.980 N/A THR 58.A N LEU 55.A O no hydrogen 3.210 N/A THR 58.A OG1 LEU 55.A O no hydrogen 2.717 N/A ARG 59.A N TYR 116.A OH no hydrogen 3.028 N/A ASN 62.A ND2 VAL 140.A O no hydrogen 3.148 N/A ILE 63.A N HIS 60.A O no hydrogen 3.115 N/A LEU 64.A N ILE 142.A O no hydrogen 3.028 N/A LEU 65.A N GLN 80.A OE1 no hydrogen 2.842 N/A MET 67.A N VAL 78.A O no hydrogen 2.887 N/A GLY 68.A N VAL 78.A O no hydrogen 3.287 N/A TYR 69.A N TRP 2.A O no hydrogen 3.128 N/A TYR 69.A OH ASP 1.A OD2 no hydrogen 2.698 N/A SER 70.A N ALA 76.A O no hydrogen 2.856 N/A SER 70.A OG LYS 72.A O no hydrogen 3.132 N/A LEU 75.A N VAL 37.A O no hydrogen 3.489 N/A ALA 76.A N SER 70.A O no hydrogen 3.091 N/A ILE 77.A N LYS 33.A O no hydrogen 2.905 N/A VAL 78.A N GLY 68.A O no hydrogen 2.896 N/A THR 79.A N ALA 31.A O no hydrogen 2.895 N/A THR 79.A OG1 GLN 80.A O no hydrogen 2.824 N/A GLN 80.A N LEU 65.A O no hydrogen 3.080 N/A GLU 83.A N HIS 135.A ND1 no hydrogen 3.109 N/A SER 85.A OG HIS 90.A NE2 no hydrogen 3.252 N/A LEU 87.A N ILE 132.A O no hydrogen 2.757 N/A TYR 88.A N SER 129.A O no hydrogen 2.980 N/A HIS 89.A N SER 86.A OG no hydrogen 3.080 N/A HIS 90.A N SER 86.A O no hydrogen 3.262 N/A HIS 90.A ND1 THR 96.A OG1 no hydrogen 2.681 N/A LEU 91.A N LEU 87.A O no hydrogen 2.870 N/A HIS 92.A N TYR 88.A O no hydrogen 2.936 N/A HIS 92.A NE2 GLU 178.A OE2 no hydrogen 2.409 N/A ALA 93.A N HIS 89.A O no hydrogen 2.955 N/A SER 94.A N HIS 89.A O no hydrogen 3.056 N/A SER 94.A OG HIS 89.A O no hydrogen 3.517 N/A SER 94.A OG THR 96.A OG1 no hydrogen 3.235 N/A THR 96.A N HIS 90.A O no hydrogen 3.035 N/A THR 96.A OG1 HIS 90.A ND1 no hydrogen 2.681 N/A THR 96.A OG1 SER 94.A OG no hydrogen 3.235 N/A LYS 102.A NZ ASP 105.A OD2 no hydrogen 2.742 N/A LYS 102.A NZ ASN 138.A O no hydrogen 3.010 N/A LEU 103.A N GLU 99.A O no hydrogen 3.094 N/A ILE 104.A N MET 100.A O no hydrogen 2.941 N/A ASP 105.A N LYS 101.A O no hydrogen 3.030 N/A ILE 106.A N LYS 102.A O no hydrogen 2.813 N/A ALA 107.A N LEU 103.A O no hydrogen 3.247 N/A ARG 108.A N ILE 104.A O no hydrogen 2.827 N/A ARG 108.A NH1 ASP 105.A OD1 no hydrogen 2.337 N/A GLN 109.A N ASP 105.A O no hydrogen 2.823 N/A GLN 109.A NE2 ASP 105.A OD2 no hydrogen 2.982 N/A GLN 109.A NE2 ASN 138.A O no hydrogen 2.680 N/A THR 110.A N ILE 106.A O no hydrogen 2.765 N/A THR 110.A OG1 ILE 106.A O no hydrogen 2.829 N/A ALA 111.A N ALA 107.A O no hydrogen 2.721 N/A ARG 112.A N ARG 108.A O no hydrogen 2.841 N/A ARG 112.A NE GLU 245.A OE2 no hydrogen 2.845 N/A ARG 112.A NH2 GLU 245.A OE2 no hydrogen 2.968 N/A GLY 113.A N GLN 109.A O no hydrogen 3.125 N/A MET 114.A N THR 110.A O no hydrogen 3.000 N/A ASP 115.A N ALA 111.A O no hydrogen 2.767 N/A TYR 116.A N ARG 112.A O no hydrogen 2.897 N/A TYR 116.A OH LYS 57.A O no hydrogen 3.208 N/A LEU 117.A N GLY 113.A O no hydrogen 2.862 N/A HIS 118.A N MET 114.A O no hydrogen 2.858 N/A ALA 119.A N ASP 115.A O no hydrogen 2.882 N/A LYS 120.A N TYR 116.A O no hydrogen 3.054 N/A LYS 120.A NZ LYS 57.A O no hydrogen 2.866 N/A SER 121.A N HIS 118.A O no hydrogen 2.960 N/A ILE 122.A N LEU 117.A O no hydrogen 2.838 N/A HIS 124.A N ASP 168.A OD2 no hydrogen 2.772 N/A HIS 124.A NE2 GLY 143.A O no hydrogen 2.846 N/A ARG 125.A N ASP 168.A OD1 no hydrogen 3.070 N/A ASP 126.A N HIS 124.A ND1 no hydrogen 3.121 N/A LYS 128.A NZ GLY 147.A O no hydrogen 3.344 N/A SER 129.A OG GLU 178.A OE1 no hydrogen 3.112 N/A SER 129.A OG GLU 178.A OE2 no hydrogen 2.607 N/A ASN 131.A N LYS 128.A O no hydrogen 2.944 N/A ASN 131.A ND2 ASP 126.A O no hydrogen 2.815 N/A ASN 131.A ND2 ASP 126.A OD2 no hydrogen 3.552 N/A ASN 131.A ND2 ASP 144.A OD2 no hydrogen 3.120 N/A ILE 132.A N SER 129.A O no hydrogen 3.431 N/A PHE 133.A N LYS 141.A O no hydrogen 2.722 N/A LEU 134.A N SER 85.A O no hydrogen 3.065 N/A HIS 135.A N THR 139.A O no hydrogen 2.738 N/A GLU 136.A N GLU 83.A O no hydrogen 2.876 N/A ASP 137.A N LEU 134.A O no hydrogen 2.996 N/A ASN 138.A N HIS 135.A O no hydrogen 2.919 N/A THR 139.A N HIS 135.A O no hydrogen 3.120 N/A VAL 140.A N GLN 109.A OE1 no hydrogen 2.830 N/A LYS 141.A N PHE 133.A O no hydrogen 2.695 N/A LYS 141.A NZ VAL 61.A O no hydrogen 2.857 N/A LYS 141.A NZ GLN 80.A OE1 no hydrogen 3.376 N/A ILE 142.A N ASN 62.A O no hydrogen 2.867 N/A GLY 143.A N ASN 131.A O no hydrogen 2.906 N/A SER 148.A OG ASP 126.A OD1 no hydrogen 2.699 N/A TRP 151.A N SER 148.A O no hydrogen 3.095 N/A TRP 151.A NE1 GLU 178.A OE1 no hydrogen 2.817 N/A MET 152.A N ILE 149.A O no hydrogen 3.136 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.948 N/A VAL 156.A N ALA 153.A O no hydrogen 2.681 N/A ILE 157.A N ALA 153.A O no hydrogen 2.764 N/A ARG 158.A N PRO 154.A O no hydrogen 2.820 N/A ARG 158.A NE GLY 200.A O no hydrogen 2.936 N/A ARG 158.A NH2 GLY 200.A O no hydrogen 3.333 N/A SER 164.A N SER 167.A OG no hydrogen 2.621 N/A SER 164.A OG GLN 166.A OE1 no hydrogen 3.524 N/A SER 164.A OG SER 167.A OG no hydrogen 3.275 N/A SER 167.A N SER 164.A OG no hydrogen 3.047 N/A SER 167.A OG PRO 162.A O no hydrogen 3.177 N/A SER 167.A OG SER 164.A O no hydrogen 2.858 N/A SER 167.A OG SER 164.A OG no hydrogen 3.275 N/A ASP 168.A N SER 164.A O no hydrogen 3.194 N/A VAL 169.A N PHE 165.A O no hydrogen 3.112 N/A TYR 170.A N GLN 166.A O no hydrogen 2.964 N/A ALA 171.A N SER 167.A O no hydrogen 2.961 N/A PHE 172.A N ASP 168.A O no hydrogen 2.718 N/A GLY 173.A N VAL 169.A O no hydrogen 2.729 N/A ILE 174.A N TYR 170.A O no hydrogen 2.878 N/A VAL 175.A N ALA 171.A O no hydrogen 2.963 N/A LEU 176.A N PHE 172.A O no hydrogen 2.845 N/A TYR 177.A N GLY 173.A O no hydrogen 2.890 N/A TYR 177.A OH ASP 207.A O no hydrogen 3.036 N/A GLU 178.A N ILE 174.A O no hydrogen 2.828 N/A LEU 179.A N VAL 175.A O no hydrogen 2.900 N/A MET 180.A N LEU 176.A O no hydrogen 2.709 N/A THR 181.A N TYR 177.A O no hydrogen 2.955 N/A THR 181.A OG1 TYR 177.A O no hydrogen 2.725 N/A GLY 182.A N GLU 178.A O no hydrogen 2.778 N/A GLN 183.A N THR 181.A OG1 no hydrogen 2.807 N/A ILE 189.A N TYR 186.A O no hydrogen 2.945 N/A GLN 194.A N ASN 191.A OD1 no hydrogen 2.771 N/A ILE 195.A N ASN 191.A O no hydrogen 3.000 N/A ILE 196.A N ARG 192.A O no hydrogen 2.898 N/A GLU 197.A N ASP 193.A O no hydrogen 2.966 N/A MET 198.A N GLN 194.A O no hydrogen 2.795 N/A VAL 199.A N ILE 195.A O no hydrogen 2.861 N/A GLY 200.A N ILE 196.A O no hydrogen 3.056 N/A ARG 201.A N GLU 197.A O no hydrogen 3.026 N/A ARG 201.A NE SER 203.A OG no hydrogen 2.826 N/A ARG 201.A NH1 GLU 197.A OE2 no hydrogen 3.065 N/A GLY 202.A N VAL 199.A O no hydrogen 3.102 N/A SER 203.A N MET 198.A O no hydrogen 2.925 N/A SER 203.A OG MET 198.A O no hydrogen 3.308 N/A LEU 204.A N MET 198.A O no hydrogen 3.281 N/A SER 209.A N ASP 207.A OD1 no hydrogen 3.073 N/A SER 209.A OG ASP 207.A OD1 no hydrogen 2.713 N/A SER 209.A OG ASP 207.A OD2 no hydrogen 3.546 N/A LYS 210.A N ASP 207.A O no hydrogen 3.196 N/A VAL 211.A N LEU 208.A O no hydrogen 3.207 N/A ARG 212.A N MET 180.A O no hydrogen 2.951 N/A ARG 212.A NH2 LEU 179.A O no hydrogen 3.272 N/A CYS 215.A N ARG 212.A O no hydrogen 3.159 N/A CYS 215.A SG PRO 216.A O no hydrogen 3.668 N/A ARG 218.A NH2 GLU 246.A OE2 no hydrogen 3.354 N/A MET 219.A N PRO 216.A O no hydrogen 2.555 N/A LYS 220.A N PRO 216.A O no hydrogen 3.232 N/A LYS 220.A NZ LEU 208.A O no hydrogen 3.384 N/A ARG 221.A N LYS 217.A O no hydrogen 3.094 N/A LEU 222.A N ARG 218.A O no hydrogen 3.350 N/A MET 223.A N MET 219.A O no hydrogen 2.847 N/A ALA 224.A N LYS 220.A O no hydrogen 3.075 N/A GLU 225.A N ARG 221.A O no hydrogen 3.022 N/A CYS 226.A N LEU 222.A O no hydrogen 3.000 N/A CYS 226.A SG LEU 222.A O no hydrogen 3.451 N/A LEU 227.A N MET 223.A O no hydrogen 3.131 N/A LEU 227.A N ALA 224.A O no hydrogen 3.290 N/A LYS 228.A N GLU 225.A O no hydrogen 3.386 N/A LYS 229.A NZ GLY 202.A O no hydrogen 3.035 N/A ARG 231.A NH2 ASN 161.A O no hydrogen 3.051 N/A GLU 233.A N LYS 230.A O no hydrogen 2.988 N/A ARG 234.A N ARG 231.A O no hydrogen 3.251 N/A ARG 234.A NE LYS 228.A O no hydrogen 2.665 N/A ARG 234.A NH1 GLU 155.A OE2 no hydrogen 2.843 N/A ARG 234.A NH1 GLN 166.A O no hydrogen 2.974 N/A ARG 234.A NH2 GLU 155.A OE1 no hydrogen 3.083 N/A ARG 234.A NH2 LYS 228.A O no hydrogen 2.799 N/A ILE 240.A N SER 236.A O no hydrogen 2.888 N/A LEU 241.A N PHE 237.A O no hydrogen 2.570 N/A ALA 242.A N PRO 238.A O no hydrogen 2.939 N/A GLU 243.A N ARG 239.A O no hydrogen 2.944 N/A ILE 244.A N ILE 240.A O no hydrogen 2.979 N/A GLU 245.A N LEU 241.A O no hydrogen 2.891 N/A GLU 246.A N ALA 242.A O no hydrogen 3.096 N/A LEU 247.A N GLU 243.A O no hydrogen 3.245 N/A ALA 248.A N ILE 244.A O no hydrogen 3.125 N/A ARG 249.A N GLU 246.A O no hydrogen 3.348 N/A