Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ekp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH1 HIS 71.A ND1 no hydrogen 3.544 N/A LYS 3.A NZ LEU 67.A O no hydrogen 3.253 N/A LYS 3.A NZ GLY 68.A O no hydrogen 3.198 N/A ALA 4.A N ARG 27.A O no hydrogen 2.888 N/A LEU 5.A N VAL 72.A O no hydrogen 2.873 N/A VAL 6.A N ALA 29.A O no hydrogen 2.915 N/A THR 7.A N VAL 74.A O no hydrogen 2.892 N/A THR 7.A OG1 HIS 75.A ND1 no hydrogen 2.773 N/A GLY 8.A N ALA 31.A O no hydrogen 2.734 N/A SER 10.A OG SER 32.A OG no hydrogen 3.307 N/A ARG 11.A NE GLU 179.A OE1 no hydrogen 2.895 N/A ARG 11.A NH2 GLU 179.A OE1 no hydrogen 3.306 N/A ARG 11.A NH2 GLU 179.A OE2 no hydrogen 2.773 N/A ARG 15.A N ARG 11.A O no hydrogen 3.022 N/A ARG 15.A NE GLU 19.A OE2 no hydrogen 2.847 N/A ARG 15.A NH1 SER 10.A O no hydrogen 3.328 N/A ALA 16.A N GLY 12.A O no hydrogen 3.008 N/A ILE 17.A N ILE 13.A O no hydrogen 2.837 N/A ALA 18.A N GLY 14.A O no hydrogen 2.921 N/A GLU 19.A N ARG 15.A O no hydrogen 2.891 N/A ALA 20.A N ALA 16.A O no hydrogen 2.919 N/A LEU 21.A N ILE 17.A O no hydrogen 2.892 N/A VAL 22.A N ALA 18.A O no hydrogen 2.950 N/A ALA 23.A N GLU 19.A O no hydrogen 3.046 N/A ARG 24.A N ALA 20.A O no hydrogen 3.164 N/A ARG 24.A N LEU 21.A O no hydrogen 2.977 N/A ARG 24.A NH1 GLU 220.A OE1 no hydrogen 2.916 N/A ARG 24.A NH2 GLU 220.A OE2 no hydrogen 2.537 N/A GLY 25.A N VAL 22.A O no hydrogen 2.929 N/A TYR 26.A N LEU 21.A O no hydrogen 3.073 N/A TYR 26.A OH CYS 217.A O no hydrogen 2.675 N/A ARG 27.A N ARG 2.A O no hydrogen 2.920 N/A ALA 29.A N ALA 4.A O no hydrogen 2.865 N/A ILE 30.A N VAL 45.A O no hydrogen 2.889 N/A ALA 31.A N VAL 6.A O no hydrogen 2.956 N/A SER 32.A OG SER 10.A OG no hydrogen 3.307 N/A ALA 39.A N PRO 35.A O no hydrogen 2.817 N/A GLN 40.A N GLU 36.A O no hydrogen 3.043 N/A SER 41.A N GLU 37.A O no hydrogen 3.054 N/A LEU 42.A N ALA 38.A O no hydrogen 2.743 N/A GLY 43.A N ALA 39.A O no hydrogen 2.738 N/A ALA 44.A N ALA 39.A O no hydrogen 2.907 N/A VAL 45.A N VAL 28.A O no hydrogen 2.809 N/A LEU 47.A N ILE 30.A O no hydrogen 2.936 N/A THR 49.A N SER 32.A O no hydrogen 2.918 N/A THR 49.A OG1 ASP 54.A OD2 no hydrogen 3.323 N/A ASP 50.A N ASP 54.A OD2 no hydrogen 2.883 N/A GLU 52.A N ASP 50.A OD1 no hydrogen 2.987 N/A LYS 53.A N ASP 50.A O no hydrogen 3.001 N/A ASP 54.A N ASP 50.A O no hydrogen 2.763 N/A LYS 57.A N ASP 55.A OD1 no hydrogen 3.159 N/A GLY 58.A N ASP 55.A O no hydrogen 2.947 N/A VAL 60.A N PRO 56.A O no hydrogen 3.160 N/A LYS 61.A N LYS 57.A O no hydrogen 3.072 N/A ARG 62.A N GLY 58.A O no hydrogen 2.990 N/A ARG 62.A NH1 PRO 48.A O no hydrogen 2.942 N/A ARG 62.A NH2 PRO 48.A O no hydrogen 2.881 N/A ALA 63.A N LEU 59.A O no hydrogen 2.862 N/A LEU 64.A N VAL 60.A O no hydrogen 2.925 N/A GLU 65.A N LYS 61.A O no hydrogen 3.141 N/A ALA 66.A N ARG 62.A O no hydrogen 2.887 N/A LEU 67.A N ALA 63.A O no hydrogen 2.857 N/A GLY 68.A N LEU 64.A O no hydrogen 2.831 N/A GLY 69.A N LEU 64.A O no hydrogen 3.183 N/A HIS 71.A N LYS 3.A O no hydrogen 2.813 N/A VAL 72.A N LYS 3.A O no hydrogen 2.954 N/A LEU 73.A N ARG 122.A O no hydrogen 2.924 N/A VAL 74.A N LEU 5.A O no hydrogen 2.900 N/A HIS 75.A N LEU 124.A O no hydrogen 3.241 N/A HIS 75.A ND1 THR 7.A OG1 no hydrogen 2.773 N/A HIS 75.A NE2 LEU 99.A O no hydrogen 2.788 N/A ALA 76.A N THR 7.A O no hydrogen 3.020 N/A ALA 77.A N THR 7.A OG1 no hydrogen 3.195 N/A VAL 81.A N ASN 80.A OD1 no hydrogen 2.725 N/A ARG 82.A NH2 PHE 180.A O no hydrogen 2.952 N/A LYS 83.A N VAL 81.A O no hydrogen 3.040 N/A LYS 83.A NZ GLU 92.A OE2 no hydrogen 2.790 N/A GLU 87.A N PRO 84.A O no hydrogen 2.968 N/A LEU 88.A N PRO 84.A O no hydrogen 2.919 N/A SER 89.A N GLU 92.A OE1 no hydrogen 2.921 N/A GLU 92.A N SER 89.A OG no hydrogen 3.091 N/A TRP 93.A N SER 89.A O no hydrogen 2.954 N/A ARG 94.A N TYR 90.A O no hydrogen 2.841 N/A ARG 94.A NH1 ASP 102.A OD2 no hydrogen 2.839 N/A ARG 94.A NH2 ASP 102.A OD2 no hydrogen 2.860 N/A ARG 95.A N GLU 91.A O no hydrogen 2.840 N/A ARG 95.A NE GLU 52.A OE1 no hydrogen 2.705 N/A ARG 95.A NH2 GLU 52.A OE2 no hydrogen 2.993 N/A VAL 96.A N GLU 92.A O no hydrogen 3.148 N/A LEU 97.A N TRP 93.A O no hydrogen 3.007 N/A TYR 98.A N ARG 94.A O no hydrogen 2.765 N/A LEU 99.A N ARG 95.A O no hydrogen 3.331 N/A HIS 100.A N VAL 96.A O no hydrogen 3.106 N/A LEU 101.A N LEU 97.A O no hydrogen 2.869 N/A ASP 102.A N LEU 97.A O no hydrogen 3.129 N/A VAL 103.A N TYR 98.A O no hydrogen 2.842 N/A PHE 105.A N LEU 101.A O no hydrogen 3.034 N/A LEU 106.A N ASP 102.A O no hydrogen 2.902 N/A LEU 107.A N VAL 103.A O no hydrogen 2.835 N/A ALA 108.A N ALA 104.A O no hydrogen 3.029 N/A GLN 109.A N PHE 105.A O no hydrogen 2.859 N/A ALA 110.A N LEU 106.A O no hydrogen 3.111 N/A ALA 111.A N LEU 107.A O no hydrogen 2.915 N/A ALA 112.A N ALA 108.A O no hydrogen 2.902 N/A HIS 114.A N ALA 111.A O no hydrogen 3.008 N/A MET 115.A N ALA 111.A O no hydrogen 3.280 N/A ALA 116.A N ALA 112.A O no hydrogen 2.828 N/A GLU 117.A N PRO 113.A O no hydrogen 3.016 N/A ALA 118.A N HIS 114.A O no hydrogen 3.301 N/A GLY 119.A N ALA 116.A O no hydrogen 2.905 N/A TRP 120.A N MET 115.A O no hydrogen 3.179 N/A GLY 121.A N GLY 165.A O no hydrogen 3.034 N/A ARG 122.A N HIS 71.A O no hydrogen 2.838 N/A ARG 122.A NE GLY 218.A O no hydrogen 2.928 N/A ARG 122.A NH1 GLY 121.A O no hydrogen 2.969 N/A ARG 122.A NH2 GLY 218.A O no hydrogen 3.016 N/A VAL 123.A N ARG 167.A O no hydrogen 2.832 N/A LEU 124.A N LEU 73.A O no hydrogen 2.793 N/A PHE 125.A N ASN 169.A O no hydrogen 3.004 N/A GLY 127.A N LEU 171.A O no hydrogen 2.671 N/A SER 128.A N THR 131.A OG1 no hydrogen 3.093 N/A SER 128.A OG THR 130.A OG1 no hydrogen 2.936 N/A THR 130.A N SER 128.A OG no hydrogen 2.884 N/A THR 130.A OG1 SER 128.A OG no hydrogen 2.936 N/A THR 131.A N SER 128.A O no hydrogen 2.969 N/A THR 131.A OG1 SER 128.A O no hydrogen 3.104 N/A THR 131.A OG1 LYS 147.A O no hydrogen 2.866 N/A PHE 132.A N VAL 129.A O no hydrogen 3.042 N/A THR 133.A OG1 VAL 129.A O no hydrogen 2.848 N/A VAL 138.A N GLY 135.A O no hydrogen 3.178 N/A THR 144.A N ILE 140.A O no hydrogen 2.918 N/A THR 144.A OG1 ILE 140.A O no hydrogen 2.890 N/A THR 145.A N PRO 141.A O no hydrogen 3.004 N/A THR 145.A OG1 PRO 141.A O no hydrogen 2.846 N/A ALA 146.A N ALA 142.A O no hydrogen 2.918 N/A LYS 147.A N TYR 143.A O no hydrogen 2.856 N/A LYS 147.A NZ ILE 126.A O no hydrogen 2.814 N/A THR 148.A N THR 144.A O no hydrogen 3.014 N/A THR 148.A OG1 THR 130.A O no hydrogen 2.959 N/A THR 148.A OG1 THR 131.A O no hydrogen 3.455 N/A THR 148.A OG1 THR 144.A O no hydrogen 2.791 N/A ALA 149.A N THR 145.A O no hydrogen 2.865 N/A LEU 150.A N ALA 146.A O no hydrogen 3.045 N/A LEU 151.A N THR 148.A O no hydrogen 2.987 N/A LEU 153.A N ALA 149.A O no hydrogen 3.055 N/A THR 154.A N LEU 150.A O no hydrogen 2.824 N/A THR 154.A OG1 LEU 150.A O no hydrogen 2.744 N/A ARG 155.A N LEU 151.A O no hydrogen 3.044 N/A ALA 156.A N GLY 152.A O no hydrogen 2.940 N/A LEU 157.A N LEU 153.A O no hydrogen 2.886 N/A ALA 158.A N THR 154.A O no hydrogen 2.955 N/A LYS 159.A N ARG 155.A O no hydrogen 2.965 N/A GLU 160.A N ALA 156.A O no hydrogen 3.192 N/A TRP 161.A N LEU 157.A O no hydrogen 2.909 N/A LEU 164.A N TRP 161.A O no hydrogen 2.931 N/A GLY 165.A N ALA 162.A O no hydrogen 3.054 N/A ILE 166.A N TRP 161.A O no hydrogen 3.406 N/A ARG 167.A N GLY 121.A O no hydrogen 2.960 N/A ARG 167.A NE GLU 222.A O no hydrogen 2.736 N/A ARG 167.A NH1 ALA 162.A O no hydrogen 2.993 N/A ARG 167.A NH1 ILE 166.A O no hydrogen 3.024 N/A ARG 167.A NH2 GLU 222.A OE2 no hydrogen 2.951 N/A VAL 168.A N THR 225.A OG1 no hydrogen 2.950 N/A ASN 169.A N VAL 123.A O no hydrogen 3.084 N/A ASN 169.A ND2 LEU 224.A O no hydrogen 2.968 N/A LEU 170.A N GLN 227.A O no hydrogen 2.833 N/A LEU 171.A N PHE 125.A O no hydrogen 2.934 N/A CYS 172.A N VAL 229.A O no hydrogen 2.815 N/A CYS 172.A SG SER 128.A O no hydrogen 3.927 N/A CYS 172.A SG LEU 170.A O no hydrogen 3.804 N/A GLY 174.A N VAL 231.A O no hydrogen 2.918 N/A GLU 177.A N ALA 204.A O no hydrogen 2.887 N/A PHE 180.A N THR 178.A OG1 no hydrogen 3.176 N/A THR 181.A N THR 178.A O no hydrogen 3.360 N/A THR 181.A OG1 VAL 176.A O no hydrogen 2.735 N/A THR 181.A OG1 THR 178.A O no hydrogen 3.375 N/A LEU 182.A N GLU 179.A O no hydrogen 3.150 N/A LEU 184.A N THR 181.A O no hydrogen 3.005 N/A ARG 185.A N THR 181.A O no hydrogen 3.235 N/A ARG 185.A NH1 THR 178.A O no hydrogen 2.928 N/A ARG 185.A NH2 THR 178.A O no hydrogen 2.873 N/A GLN 186.A N LEU 182.A O no hydrogen 2.948 N/A ASN 187.A N LEU 184.A O no hydrogen 3.467 N/A GLU 189.A N ASN 187.A OD1 no hydrogen 2.955 N/A LEU 190.A N ASN 187.A O no hydrogen 2.744 N/A TYR 191.A N ASN 187.A O no hydrogen 2.856 N/A GLU 192.A N PRO 188.A O no hydrogen 3.005 N/A ILE 194.A N LEU 190.A O no hydrogen 3.308 N/A THR 195.A N TYR 191.A O no hydrogen 2.888 N/A THR 195.A OG1 TYR 191.A O no hydrogen 2.755 N/A ALA 196.A N GLU 192.A O no hydrogen 2.999 N/A ARG 197.A N ILE 194.A O no hydrogen 2.919 N/A ILE 198.A N THR 195.A O no hydrogen 3.018 N/A MET 200.A N GLY 233.A O no hydrogen 3.196 N/A GLY 201.A N ILE 198.A O no hydrogen 2.742 N/A ARG 202.A NH1 TRP 203.A O no hydrogen 3.097 N/A ARG 202.A NH1 GLU 208.A OE1 no hydrogen 2.935 N/A ARG 202.A NH2 GLU 208.A OE2 no hydrogen 2.675 N/A TRP 203.A NE1 THR 195.A OG1 no hydrogen 2.985 N/A ALA 204.A N TYR 175.A O no hydrogen 2.875 N/A ARG 205.A N GLU 208.A OE1 no hydrogen 2.878 N/A ARG 205.A NH1 GLU 177.A OE1 no hydrogen 2.540 N/A GLU 208.A N ARG 205.A O no hydrogen 2.915 N/A ILE 209.A N PRO 206.A O no hydrogen 3.042 N/A ALA 210.A N PRO 206.A O no hydrogen 2.987 N/A ARG 211.A N GLU 207.A O no hydrogen 3.128 N/A ARG 211.A NE GLU 207.A OE1 no hydrogen 3.129 N/A ARG 211.A NE GLU 207.A OE2 no hydrogen 2.796 N/A ARG 211.A NH2 GLU 207.A OE1 no hydrogen 2.988 N/A VAL 212.A N ILE 209.A O no hydrogen 3.137 N/A ALA 213.A N ILE 209.A O no hydrogen 3.187 N/A ALA 214.A N ALA 210.A O no hydrogen 2.905 N/A LEU 216.A N VAL 212.A O no hydrogen 3.124 N/A CYS 217.A N ALA 214.A O no hydrogen 3.011 N/A CYS 217.A SG ALA 213.A O no hydrogen 3.393 N/A GLY 218.A N VAL 215.A O no hydrogen 3.090 N/A GLU 220.A N GLU 220.A OE1 no hydrogen 2.781 N/A ALA 221.A N GLY 218.A O no hydrogen 3.145 N/A GLU 222.A N ASP 219.A O no hydrogen 3.078 N/A LEU 224.A N ALA 221.A O no hydrogen 2.978 N/A THR 225.A OG1 VAL 168.A O no hydrogen 3.500 N/A GLY 226.A N VAL 168.A O no hydrogen 2.721 N/A GLN 227.A N ASN 169.A OD1 no hydrogen 3.064 N/A VAL 229.A N LEU 170.A O no hydrogen 2.889 N/A VAL 231.A N CYS 172.A O no hydrogen 2.949 N/A GLY 234.A N ASP 232.A OD1 no hydrogen 2.932 N/A PHE 235.A N ASP 232.A O no hydrogen 3.125 N/A LEU 236.A N ASP 232.A OD2 no hydrogen 2.812 N/A TYR 238.A N GLY 234.A O no hydrogen 2.981 N/A