Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7kli_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLU 6.A OE1 no hydrogen 3.191 N/A LEU 4.A N GLN 32.A OE1 no hydrogen 2.839 N/A LEU 5.A N GLN 32.A O no hydrogen 2.916 N/A GLU 6.A N GLY 3.A O no hydrogen 3.230 N/A GLY 7.A N GLY 33.A O no hydrogen 3.281 N/A LYS 8.A N LEU 5.A O no hydrogen 3.013 N/A LYS 8.A NZ ASP 238.A OD1 no hydrogen 3.232 N/A LYS 8.A NZ ASP 238.A OD2 no hydrogen 2.967 N/A ARG 9.A N ASP 89.A OD2 no hydrogen 2.846 N/A ILE 10.A N GLU 35.A O no hydrogen 2.959 N/A LEU 11.A N GLY 90.A O no hydrogen 2.866 N/A VAL 12.A N VAL 37.A O no hydrogen 2.805 N/A THR 13.A N VAL 92.A O no hydrogen 3.116 N/A THR 13.A OG1 VAL 92.A O no hydrogen 2.735 N/A ILE 16.A N SER 20.A OG.A no hydrogen 3.030 N/A THR 17.A N SER 20.A OG.A no hydrogen 3.114 N/A THR 17.A OG1 SER 19.A OG.B no hydrogen 2.476 N/A SER 19.A N THR 17.A OG1 no hydrogen 3.001 N/A SER 19.A OG.B THR 17.A OG1 no hydrogen 2.476 N/A SER 20.A N THR 17.A O no hydrogen 3.177 N/A SER 20.A N THR 17.A OG1 no hydrogen 3.249 N/A SER 20.A OG.B THR 17.A O no hydrogen 2.473 N/A PHE 23.A N SER 20.A OG.B no hydrogen 3.268 N/A HIS 24.A N SER 20.A O no hydrogen 3.333 N/A ILE 25.A N ILE 21.A O no hydrogen 2.832 N/A ALA 26.A N ALA 22.A O no hydrogen 2.865 N/A LYS 27.A N PHE 23.A O no hydrogen 2.867 N/A LYS 27.A NZ GLU 31.A OE2 no hydrogen 2.681 N/A VAL 28.A N HIS 24.A O no hydrogen 2.940 N/A ALA 29.A N ILE 25.A O no hydrogen 2.899 N/A GLN 30.A N ALA 26.A O no hydrogen 2.949 N/A GLN 30.A NE2 LYS 56.A O no hydrogen 2.890 N/A GLU 31.A N LYS 27.A O no hydrogen 2.951 N/A GLN 32.A N VAL 28.A O no hydrogen 2.922 N/A GLN 32.A N ALA 29.A O no hydrogen 3.075 N/A GLY 33.A N GLN 30.A O no hydrogen 2.992 N/A ALA 34.A N ALA 29.A O no hydrogen 2.949 N/A GLU 35.A N LYS 8.A O no hydrogen 2.794 N/A VAL 37.A N ILE 10.A O no hydrogen 2.954 N/A LEU 38.A N PRO 59.A O no hydrogen 2.874 N/A THR 39.A N VAL 12.A O no hydrogen 3.185 N/A GLY 40.A N LEU 61.A O no hydrogen 3.002 N/A ILE 47.A N ARG 43.A O no hydrogen 2.850 N/A GLU 48.A N LEU 44.A O no hydrogen 2.918 N/A ARG 49.A N ARG 45.A O no hydrogen 3.165 N/A ILE 50.A N LEU 46.A O no hydrogen 2.854 N/A THR 51.A N ILE 47.A O no hydrogen 2.721 N/A THR 51.A OG1 ILE 47.A O no hydrogen 3.196 N/A THR 51.A OG1 GLU 48.A O no hydrogen 2.952 N/A GLN 52.A N GLU 48.A O no hydrogen 3.246 N/A ARG 53.A N ILE 50.A O no hydrogen 2.911 N/A ARG 53.A NH1 ASP 18.A OD2 no hydrogen 2.354 N/A LEU 54.A N THR 51.A O no hydrogen 3.191 N/A LYS 56.A N GLN 30.A OE1 no hydrogen 2.903 N/A LYS 56.A NZ GLN 30.A O no hydrogen 2.991 N/A LEU 61.A N LEU 38.A O no hydrogen 2.800 N/A LEU 63.A N GLY 40.A O no hydrogen 2.813 N/A ASP 64.A N HIS 70.A ND1 no hydrogen 3.002 N/A GLN 66.A N ASP 64.A OD1 no hydrogen 2.910 N/A GLN 66.A NE2 HIS 121.A ND1 no hydrogen 3.411 N/A ASN 67.A N ASP 64.A O no hydrogen 2.868 N/A HIS 70.A N ASN 67.A OD1 no hydrogen 3.015 N/A LEU 71.A N ASN 67.A O no hydrogen 3.011 N/A GLY 72.A N GLU 68.A O no hydrogen 2.872 N/A SER 73.A N GLU 69.A O no hydrogen 3.060 N/A SER 73.A OG GLU 69.A O no hydrogen 3.257 N/A SER 73.A OG HIS 70.A O no hydrogen 3.337 N/A LEU 74.A N LEU 71.A O no hydrogen 3.098 N/A ARG 77.A N SER 73.A O no hydrogen 3.033 N/A ARG 77.A NE SER 73.A OG no hydrogen 2.841 N/A ARG 77.A NH1 GLU 62.A O no hydrogen 2.838 N/A ARG 77.A NH2 GLU 62.A O no hydrogen 3.065 N/A ARG 77.A NH2 HIS 70.A O no hydrogen 3.035 N/A ARG 77.A NH2 SER 73.A OG no hydrogen 3.366 N/A ILE 78.A N LEU 74.A O no hydrogen 2.837 N/A SER 79.A N ALA 75.A O no hydrogen 2.938 N/A SER 79.A OG ALA 75.A O no hydrogen 3.215 N/A GLU 80.A N GLY 76.A O no hydrogen 3.067 N/A VAL 81.A N ARG 77.A O no hydrogen 3.352 N/A ILE 82.A N ILE 78.A O no hydrogen 3.005 N/A GLY 83.A N SER 79.A O no hydrogen 2.827 N/A ASN 86.A N GLY 83.A O no hydrogen 2.808 N/A ASN 86.A ND2 ILE 82.A O no hydrogen 2.855 N/A LEU 88.A N VAL 137.A O no hydrogen 2.748 N/A ASP 89.A N ARG 9.A O no hydrogen 2.665 N/A GLY 90.A N ARG 9.A O no hydrogen 3.177 N/A VAL 91.A N SER 143.A O no hydrogen 2.890 N/A VAL 92.A N LEU 11.A O no hydrogen 2.843 N/A HIS 93.A N VAL 145.A O no hydrogen 2.705 N/A HIS 93.A NE2 SER 126.A OG no hydrogen 2.866 N/A SER 94.A N THR 13.A OG1 no hydrogen 2.998 N/A PHE 97.A N SER 123.A OG no hydrogen 2.917 N/A SER 101.A OG.A ASP 115.A OD2 no hydrogen 2.590 N/A SER 101.A OG.B ASP 115.A OD2 no hydrogen 3.005 N/A GLY 102.A N PRO 99.A O no hydrogen 2.782 N/A MET 103.A N GLN 100.A O no hydrogen 2.958 N/A ASN 106.A ND2 SER 101.A O no hydrogen 2.905 N/A ASN 106.A ND2 PRO 107.A O no hydrogen 3.020 N/A ASP 110.A N PRO 107.A O no hydrogen 2.993 N/A ALA 111.A N PHE 108.A O no hydrogen 3.397 N/A VAL 116.A N PRO 112.A O no hydrogen 3.143 N/A SER 117.A N PHE 113.A O no hydrogen 2.788 N/A LYS 118.A N ALA 114.A O no hydrogen 3.196 N/A GLY 119.A N ASP 115.A O no hydrogen 3.141 N/A PHE 120.A N VAL 116.A O no hydrogen 2.822 N/A HIS 121.A N SER 117.A O no hydrogen 2.801 N/A ILE 122.A N LYS 118.A O no hydrogen 2.994 N/A SER 123.A N GLY 119.A O no hydrogen 2.782 N/A SER 123.A OG PHE 97.A O no hydrogen 2.799 N/A SER 123.A OG GLY 119.A O no hydrogen 3.052 N/A ALA 124.A N PHE 120.A O no hydrogen 2.883 N/A PHE 125.A N PHE 120.A O no hydrogen 2.951 N/A SER 126.A N HIS 121.A O no hydrogen 2.888 N/A SER 126.A OG HIS 93.A NE2 no hydrogen 2.866 N/A SER 126.A OG ILE 122.A O no hydrogen 2.661 N/A TYR 127.A N ALA 124.A O no hydrogen 3.113 N/A TYR 127.A OH SER 186.A OG no hydrogen 2.737 N/A SER 129.A N PHE 125.A O no hydrogen 3.116 N/A LEU 130.A N SER 126.A O no hydrogen 2.856 N/A ALA 131.A N TYR 127.A O no hydrogen 3.095 N/A LYS 132.A N SER 128.A O no hydrogen 2.879 N/A ALA 133.A N SER 129.A O no hydrogen 3.033 N/A VAL 134.A N LEU 130.A O no hydrogen 2.948 N/A VAL 134.A N ALA 131.A O no hydrogen 3.262 N/A LEU 135.A N ALA 131.A O no hydrogen 2.932 N/A VAL 137.A N VAL 134.A O no hydrogen 2.851 N/A MET 138.A N LEU 135.A O no hydrogen 3.063 N/A ASN 139.A N LEU 88.A O no hydrogen 2.843 N/A ASN 139.A ND2 ASP 89.A OD1 no hydrogen 3.058 N/A GLY 141.A N GLY 183.A O no hydrogen 2.731 N/A GLY 142.A N ASN 139.A O no hydrogen 2.904 N/A SER 143.A N ASP 89.A O no hydrogen 2.920 N/A SER 143.A OG LEU 235.A O no hydrogen 2.821 N/A ILE 144.A N ARG 185.A O no hydrogen 2.793 N/A VAL 145.A N VAL 91.A O no hydrogen 2.845 N/A GLY 146.A N ASN 187.A O no hydrogen 2.932 N/A ASP 148.A N VAL 189.A O no hydrogen 2.763 N/A THR 152.A N ASP 150.A OD1 no hydrogen 3.182 N/A THR 152.A OG1 ASP 150.A OD1 no hydrogen 2.750 N/A TYR 158.A N PRO 156.A O no hydrogen 2.706 N/A TYR 158.A OH GLU 209.A OE2 no hydrogen 2.404 N/A TRP 160.A N GLY 102.A O no hydrogen 2.737 N/A TRP 160.A NE1 PHE 108.A O no hydrogen 3.055 N/A MET 161.A N TYR 158.A O no hydrogen 2.843 N/A THR 162.A N TYR 158.A O no hydrogen 3.298 N/A VAL 163.A N ASN 159.A O no hydrogen 3.329 N/A ALA 164.A N TRP 160.A O no hydrogen 2.864 N/A LYS 165.A N MET 161.A O no hydrogen 2.822 N/A LYS 165.A NZ MET 147.A O no hydrogen 2.848 N/A SER 166.A N THR 162.A O no hydrogen 2.937 N/A SER 166.A OG THR 162.A O no hydrogen 3.371 N/A ALA 167.A N VAL 163.A O no hydrogen 2.974 N/A LEU 168.A N ALA 164.A O no hydrogen 2.768 N/A GLU 169.A N LYS 165.A O no hydrogen 2.941 N/A SER 170.A N SER 166.A O no hydrogen 3.295 N/A VAL 171.A N ALA 167.A O no hydrogen 2.862 N/A ASN 172.A N LEU 168.A O no hydrogen 2.818 N/A ASN 172.A ND2 ASP 246.A O no hydrogen 3.123 N/A ARG 173.A N GLU 169.A O no hydrogen 3.332 N/A ARG 173.A N SER 170.A O no hydrogen 3.084 N/A PHE 174.A N SER 170.A O no hydrogen 3.341 N/A VAL 175.A N VAL 171.A O no hydrogen 2.743 N/A ALA 176.A N ASN 172.A O no hydrogen 2.871 N/A ARG 177.A N ARG 173.A O no hydrogen 3.313 N/A ARG 177.A NH2.B GLU 178.A OE2 no hydrogen 3.260 N/A GLU 178.A N PHE 174.A O no hydrogen 3.114 N/A ALA 179.A N VAL 175.A O no hydrogen 2.623 N/A GLY 180.A N ALA 176.A O no hydrogen 2.867 N/A LYS 181.A N GLU 178.A O no hydrogen 3.264 N/A LYS 181.A NZ GLU 178.A OE1 no hydrogen 2.562 N/A LYS 181.A NZ GLU 178.A OE2 no hydrogen 3.248 N/A VAL 182.A N ALA 179.A O no hydrogen 3.029 N/A GLY 183.A N GLY 180.A O no hydrogen 3.086 N/A VAL 184.A N ALA 179.A O no hydrogen 3.021 N/A ARG 185.A N GLY 142.A O no hydrogen 2.928 N/A ARG 185.A NH1 LEU 235.A O no hydrogen 2.880 N/A ARG 185.A NH2 GLY 141.A O no hydrogen 3.221 N/A ARG 185.A NH2 SER 237.A O no hydrogen 2.971 N/A SER 186.A N THR 244.A OG1 no hydrogen 2.946 N/A SER 186.A OG TYR 127.A OH no hydrogen 2.737 N/A SER 186.A OG ASN 172.A OD1 no hydrogen 2.702 N/A ASN 187.A N ILE 144.A O no hydrogen 2.937 N/A ASN 187.A ND2 THR 243.A O no hydrogen 2.925 N/A LEU 188.A N ASP 246.A O no hydrogen 2.897 N/A VAL 189.A N GLY 146.A O no hydrogen 2.904 N/A ALA 190.A N ILE 248.A O no hydrogen 2.817 N/A ALA 191.A N ASP 148.A O no hydrogen 3.182 N/A GLY 192.A N ALA 250.A O no hydrogen 2.985 N/A ARG 195.A N MET 222.A O no hydrogen 2.858 N/A GLU 200.A N ASP 199.A OD1 no hydrogen 2.815 N/A GLN 203.A N ASP 199.A O no hydrogen 3.057 N/A GLN 204.A N GLU 200.A O no hydrogen 2.904 N/A GLN 204.A NE2 GLU 200.A OE2 no hydrogen 3.350 N/A MET 205.A N ALA 201.A O no hydrogen 2.901 N/A GLN 206.A N GLY 202.A O no hydrogen 2.866 N/A LEU 207.A N GLN 203.A O no hydrogen 3.104 N/A LEU 208.A N GLN 204.A O no hydrogen 3.080 N/A GLU 209.A N MET 205.A O no hydrogen 2.780 N/A GLU 210.A N GLN 206.A O no hydrogen 2.952 N/A GLY 211.A N LEU 208.A O no hydrogen 3.173 N/A TRP 212.A N GLU 209.A O no hydrogen 3.174 N/A ARG 215.A N GLY 211.A O no hydrogen 3.086 N/A ARG 215.A NE ALA 254.A O no hydrogen 3.180 N/A ALA 216.A N TRP 212.A O no hydrogen 2.861 N/A GLY 219.A N ALA 216.A O no hydrogen 2.890 N/A TRP 220.A N ASP 213.A OD1 no hydrogen 2.859 N/A TRP 220.A NE1 PRO 193.A O no hydrogen 2.729 N/A LYS 223.A N ASP 221.A OD1 no hydrogen 2.912 N/A ASP 224.A N ASP 221.A O no hydrogen 3.076 N/A THR 226.A N ASP 224.A OD1 no hydrogen 3.035 N/A THR 226.A OG1 ASP 224.A OD1 no hydrogen 3.267 N/A ALA 229.A N PRO 225.A O no hydrogen 3.076 N/A LYS 230.A N THR 226.A O no hydrogen 2.885 N/A THR 231.A N PRO 227.A O no hydrogen 3.147 N/A THR 231.A OG1 PRO 227.A O no hydrogen 2.813 N/A VAL 232.A N VAL 228.A O no hydrogen 3.027 N/A CYS 233.A N ALA 229.A O no hydrogen 3.009 N/A CYS 233.A SG ILE 25.A O no hydrogen 3.983 N/A CYS 233.A SG ALA 229.A O no hydrogen 3.551 N/A ALA 234.A N LYS 230.A O no hydrogen 2.743 N/A LEU 235.A N THR 231.A O no hydrogen 3.114 N/A LEU 236.A N VAL 232.A O no hydrogen 2.929 N/A SER 237.A N CYS 233.A O no hydrogen 2.986 N/A SER 237.A N ALA 234.A O no hydrogen 3.272 N/A SER 237.A OG ALA 234.A O no hydrogen 2.677 N/A TRP 239.A N SER 237.A OG no hydrogen 3.034 N/A THR 244.A OG1 SER 186.A O no hydrogen 3.418 N/A GLY 245.A N SER 186.A O no hydrogen 2.774 N/A ASP 246.A N ASN 187.A OD1 no hydrogen 2.972 N/A ILE 247.A N ASP 246.A OD1 no hydrogen 2.978 N/A ILE 248.A N LEU 188.A O no hydrogen 2.868 N/A ALA 250.A N ALA 190.A O no hydrogen 2.914 N/A GLY 253.A N ASP 251.A OD1 no hydrogen 2.938 N/A ALA 254.A N ASP 251.A O no hydrogen 3.144 N/A HIS 255.A N ASP 251.A OD2 no hydrogen 2.887 N/A THR 256.A N GLY 253.A O no hydrogen 3.002 N/A THR 256.A OG1 GLY 253.A O no hydrogen 2.694 N/A GLN 257.A N ALA 254.A O no hydrogen 3.312 N/A GLN 257.A NE2 THR 256.A OG1 no hydrogen 2.944 N/A