Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4hkp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N TYR 251.A OH no hydrogen 2.864 N/A GLY 5.A N GLN 25.A OE1 no hydrogen 2.847 N/A ALA 6.A N SER 3.A OG no hydrogen 3.024 N/A ARG 7.A N SER 3.A O no hydrogen 2.921 N/A ARG 7.A NE PRO 187.A O no hydrogen 2.876 N/A ARG 7.A NH1 PRO 187.A O no hydrogen 3.233 N/A ARG 7.A NH1 ASP 222.A OD2 no hydrogen 3.001 N/A ARG 7.A NH2 ASP 222.A OD1 no hydrogen 2.801 N/A ALA 8.A N PHE 4.A O no hydrogen 2.959 N/A GLU 9.A N ALA 6.A O no hydrogen 2.892 N/A LEU 10.A N ARG 7.A O no hydrogen 3.095 N/A ILE 13.A N LEU 10.A O no hydrogen 3.101 N/A VAL 16.A N HIS 14.A ND1 no hydrogen 3.043 N/A SER 18.A N HIS 14.A O no hydrogen 2.767 N/A SER 18.A OG ALA 8.A O no hydrogen 2.766 N/A LYS 19.A N PRO 15.A O no hydrogen 2.993 N/A LEU 20.A N VAL 16.A O no hydrogen 3.019 N/A LEU 21.A N ALA 17.A O no hydrogen 2.882 N/A ARG 22.A N SER 18.A O no hydrogen 2.970 N/A ARG 22.A NH1 SER 18.A OG no hydrogen 3.414 N/A ARG 22.A NH2 SER 18.A OG no hydrogen 3.250 N/A LEU 23.A N LYS 19.A O no hydrogen 3.200 N/A MET 24.A N LEU 20.A O no hydrogen 2.907 N/A GLN 25.A N LEU 21.A O no hydrogen 3.022 N/A LYS 26.A N ARG 22.A O no hydrogen 2.957 N/A LYS 26.A NZ GLU 83.A OE2 no hydrogen 2.683 N/A LYS 27.A N LEU 23.A O no hydrogen 2.883 N/A LYS 27.A NZ GLY 51.A O no hydrogen 2.768 N/A LYS 27.A NZ ILE 54.A O no hydrogen 2.697 N/A LYS 27.A NZ HIS 82.A O no hydrogen 2.811 N/A LYS 27.A NZ GLU 83.A O no hydrogen 2.819 N/A THR 29.A N MET 24.A O no hydrogen 3.235 N/A THR 29.A OG1 SER 53.A O no hydrogen 2.683 N/A ASN 30.A ND2 ASP 222.A O no hydrogen 2.941 N/A ASN 30.A ND2 ALA 247.A O no hydrogen 3.162 N/A LEU 31.A N THR 29.A OG1 no hydrogen 3.160 N/A CYS 32.A N ILE 224.A O no hydrogen 2.772 N/A CYS 32.A SG LEU 33.A O no hydrogen 3.909 N/A LEU 33.A N MET 56.A O no hydrogen 2.999 N/A SER 34.A N VAL 226.A O no hydrogen 2.813 N/A SER 34.A OG ASP 36.A OD1 no hydrogen 3.424 N/A SER 34.A OG ASP 36.A OD2 no hydrogen 2.817 N/A ALA 35.A N LYS 58.A O no hydrogen 2.952 N/A ASP 36.A N SER 34.A O no hydrogen 2.882 N/A VAL 37.A N ALA 35.A O no hydrogen 2.994 N/A ALA 40.A N ASP 66.A OD1 no hydrogen 2.799 N/A LEU 43.A N LEU 39.A O no hydrogen 2.947 N/A LEU 44.A N ALA 40.A O no hydrogen 2.900 N/A GLN 45.A N ARG 41.A O no hydrogen 2.938 N/A LEU 46.A N GLU 42.A O no hydrogen 2.899 N/A ALA 47.A N LEU 43.A O no hydrogen 2.948 N/A ASP 48.A N LEU 44.A O no hydrogen 2.992 N/A ALA 49.A N GLN 45.A O no hydrogen 3.063 N/A LEU 50.A N LEU 46.A O no hydrogen 2.868 N/A SER 53.A N LEU 50.A O no hydrogen 2.777 N/A SER 53.A OG GLU 241.A OE2 no hydrogen 2.608 N/A ILE 54.A N GLY 51.A O no hydrogen 3.312 N/A CYS 55.A N LEU 31.A O no hydrogen 2.913 N/A CYS 55.A SG LEU 31.A O no hydrogen 3.544 N/A LEU 57.A N LEU 85.A O no hydrogen 2.837 N/A LYS 58.A N LEU 33.A O no hydrogen 2.735 N/A LYS 58.A NZ SER 34.A OG no hydrogen 3.100 N/A LYS 58.A NZ ASP 89.A OD2 no hydrogen 2.755 N/A THR 59.A N PHE 87.A O no hydrogen 2.799 N/A THR 59.A OG1 PHE 87.A O no hydrogen 3.556 N/A THR 59.A OG1 GLU 88.A OE1 no hydrogen 2.741 N/A VAL 61.A N GLU 88.A OE1 no hydrogen 2.868 N/A ILE 63.A N.A HIS 60.A O no hydrogen 3.000 N/A ILE 63.A N.B HIS 60.A O no hydrogen 3.034 N/A LEU 64.A N VAL 61.A O no hydrogen 3.230 N/A ASN 65.A N SER 38.A O no hydrogen 2.806 N/A PHE 67.A N LEU 64.A O no hydrogen 3.436 N/A VAL 71.A N THR 68.A OG1 no hydrogen 3.103 N/A MET 72.A N THR 68.A O no hydrogen 3.378 N/A LYS 73.A N LEU 69.A O no hydrogen 2.892 N/A GLU 74.A N ASP 70.A O no hydrogen 3.063 N/A LEU 75.A N VAL 71.A O no hydrogen 2.947 N/A ILE 76.A N MET 72.A O no hydrogen 2.841 N/A THR 77.A N LYS 73.A O no hydrogen 3.018 N/A THR 77.A OG1 LYS 73.A O no hydrogen 3.240 N/A LEU 78.A N GLU 74.A O no hydrogen 3.107 N/A ALA 79.A N LEU 75.A O no hydrogen 2.812 N/A LYS 80.A N ILE 76.A O no hydrogen 2.844 N/A CYS 81.A N THR 77.A O no hydrogen 2.898 N/A HIS 82.A N LEU 78.A O no hydrogen 2.854 N/A HIS 82.A NE2 ASP 48.A OD1 no hydrogen 2.768 N/A PHE 84.A N ALA 79.A O no hydrogen 3.036 N/A LEU 85.A N CYS 55.A O no hydrogen 3.094 N/A ILE 86.A N ASP 115.A OD2 no hydrogen 2.867 N/A PHE 87.A N LEU 57.A O no hydrogen 2.907 N/A GLU 88.A N LEU 116.A O no hydrogen 2.960 N/A ASP 89.A N THR 59.A O no hydrogen 2.934 N/A ARG 90.A NH2 ARG 90.A O no hydrogen 2.819 N/A LYS 91.A N ASN 118.A OD1 no hydrogen 2.852 N/A LYS 91.A NZ ASP 89.A OD1 no hydrogen 2.767 N/A PHE 92.A N ASN 118.A O no hydrogen 3.155 N/A ILE 95.A N ASP 94.A OD1 no hydrogen 2.713 N/A THR 98.A N ILE 95.A O no hydrogen 3.067 N/A VAL 99.A N ILE 95.A O no hydrogen 3.045 N/A LYS 100.A N GLY 96.A O no hydrogen 3.185 N/A LYS 100.A NZ ASN 97.A O no hydrogen 2.937 N/A LYS 100.A NZ ASN 97.A OD1 no hydrogen 3.013 N/A LYS 101.A N THR 98.A O no hydrogen 2.987 N/A GLN 102.A N THR 98.A O no hydrogen 3.094 N/A TYR 103.A N VAL 99.A O no hydrogen 2.944 N/A GLU 104.A N LYS 100.A O no hydrogen 3.115 N/A GLY 105.A N LYS 101.A O no hydrogen 2.830 N/A LYS 109.A N GLY 105.A O no hydrogen 3.153 N/A ALA 111.A N TYR 103.A O no hydrogen 2.902 N/A SER 112.A N LYS 109.A O no hydrogen 2.899 N/A SER 112.A OG LYS 109.A O no hydrogen 2.723 N/A TRP 113.A N ILE 110.A O no hydrogen 3.125 N/A TRP 113.A NE1 PHE 108.A O no hydrogen 2.760 N/A ALA 114.A N ILE 110.A O no hydrogen 2.957 N/A LEU 116.A N ILE 86.A O no hydrogen 3.079 N/A VAL 117.A N GLY 141.A O no hydrogen 3.194 N/A ASN 118.A ND2 ASP 89.A OD1 no hydrogen 2.741 N/A ALA 119.A N LEU 143.A O no hydrogen 2.944 N/A HIS 120.A N PHE 92.A O no hydrogen 2.768 N/A GLY 124.A N VAL 121.A O no hydrogen 2.947 N/A VAL 127.A N GLY 124.A O no hydrogen 3.128 N/A LYS 129.A N SER 125.A O no hydrogen 2.964 N/A LYS 129.A NZ HIS 170.A NE2 no hydrogen 3.014 N/A GLY 130.A N GLY 126.A O no hydrogen 2.894 N/A LEU 131.A N VAL 127.A O no hydrogen 3.315 N/A GLN 132.A N VAL 128.A O no hydrogen 2.837 N/A GLU 133.A N LYS 129.A O no hydrogen 3.207 N/A VAL 134.A N LEU 131.A O no hydrogen 3.035 N/A GLY 135.A N LEU 131.A O no hydrogen 2.807 N/A LEU 136.A N GLN 132.A O no hydrogen 2.968 N/A HIS 139.A N LEU 136.A O no hydrogen 3.047 N/A ARG 140.A N GLY 135.A O no hydrogen 2.943 N/A ARG 140.A NE ALA 111.A O no hydrogen 2.965 N/A ARG 140.A NH1 ALA 111.A O no hydrogen 2.976 N/A GLY 141.A N ASP 115.A O no hydrogen 3.080 N/A CYS 142.A N PHE 173.A O no hydrogen 3.047 N/A CYS 142.A SG VAL 117.A O no hydrogen 3.861 N/A CYS 142.A SG LEU 143.A O no hydrogen 3.845 N/A LEU 143.A N VAL 117.A O no hydrogen 2.851 N/A LEU 144.A N GLY 176.A O no hydrogen 2.950 N/A ILE 145.A N ALA 119.A O no hydrogen 2.921 N/A ALA 146.A N ILE 178.A O no hydrogen 2.819 N/A GLU 147.A N ILE 178.A O no hydrogen 3.323 N/A SER 149.A OG GLN 207.A OE1 no hydrogen 2.637 N/A THR 151.A N GLY 206.A O no hydrogen 2.803 N/A THR 151.A OG1 GLY 206.A O no hydrogen 3.446 N/A SER 153.A N SER 150.A O no hydrogen 3.155 N/A ALA 155.A N SER 153.A OG no hydrogen 3.022 N/A TYR 159.A N THR 156.A O no hydrogen 2.968 N/A THR 160.A N THR 156.A O no hydrogen 3.396 N/A THR 160.A OG1 ALA 146.A O no hydrogen 2.835 N/A ARG 161.A N GLY 157.A O no hydrogen 3.014 N/A ARG 161.A NE ASP 158.A OD1 no hydrogen 3.233 N/A ARG 161.A NH1 ASP 158.A OD1 no hydrogen 2.754 N/A ALA 162.A N ASP 158.A O no hydrogen 2.845 N/A ALA 163.A N TYR 159.A O no hydrogen 3.017 N/A VAL 164.A N THR 160.A O no hydrogen 3.104 N/A ARG 165.A N ARG 161.A O no hydrogen 3.040 N/A ARG 165.A NH2.A GLU 169.A OE2 no hydrogen 3.315 N/A MET 166.A N ALA 162.A O no hydrogen 2.931 N/A ALA 167.A N ALA 163.A O no hydrogen 3.008 N/A GLU 168.A N VAL 164.A O no hydrogen 2.979 N/A GLU 169.A N ARG 165.A O no hydrogen 3.006 N/A HIS 170.A N ALA 167.A O no hydrogen 3.104 N/A HIS 170.A ND1 MET 166.A O no hydrogen 3.082 N/A PHE 173.A N HIS 170.A O no hydrogen 3.044 N/A VAL 174.A N HIS 170.A O no hydrogen 2.896 N/A VAL 175.A N CYS 142.A O no hydrogen 2.842 N/A PHE 177.A N LEU 190.A O no hydrogen 2.841 N/A ILE 178.A N LEU 144.A O no hydrogen 2.887 N/A SER 179.A N LEU 192.A O no hydrogen 3.047 N/A SER 179.A OG SER 181.A O no hydrogen 2.687 N/A GLY 180.A N GLU 147.A OE1 no hydrogen 2.762 N/A ARG 182.A N ARG 219.A O no hydrogen 2.837 N/A ARG 182.A NH1 GLU 1.A OE1 no hydrogen 3.107 N/A VAL 183.A N HIS 191.A NE2 no hydrogen 3.048 N/A SER 184.A N HIS 191.A NE2 no hydrogen 3.359 N/A LYS 186.A N SER 184.A OG no hydrogen 3.090 N/A PHE 189.A N LYS 186.A O no hydrogen 3.232 N/A LEU 190.A N VAL 175.A O no hydrogen 2.883 N/A HIS 191.A N ASP 222.A OD2 no hydrogen 2.813 N/A LEU 192.A N PHE 177.A O no hydrogen 2.926 N/A THR 193.A N ILE 223.A O no hydrogen 2.863 N/A THR 193.A OG1 SER 179.A O no hydrogen 2.767 N/A THR 193.A OG1 SER 221.A OG no hydrogen 2.541 N/A GLN 197.A N ASN 210.A O no hydrogen 3.080 N/A LEU 198.A N TYR 243.A OH no hydrogen 2.986 N/A ASP 203.A N GLN 207.A O no hydrogen 3.065 N/A LEU 205.A N ASP 203.A OD1 no hydrogen 2.809 N/A GLN 207.A N ASP 203.A OD1 no hydrogen 2.824 N/A GLN 208.A N GLN 207.A OE1 no hydrogen 3.021 N/A GLN 208.A NE2 SER 149.A O no hydrogen 2.881 N/A TYR 209.A N GLY 201.A O no hydrogen 3.017 N/A ASN 210.A N GLY 195.A O no hydrogen 2.954 N/A GLU 214.A N SER 211.A OG no hydrogen 3.044 N/A VAL 215.A N SER 211.A O no hydrogen 2.888 N/A ILE 216.A N PRO 212.A O no hydrogen 2.790 N/A GLY 217.A N GLN 213.A O no hydrogen 2.757 N/A LYS 218.A N GLU 214.A O no hydrogen 3.102 N/A ARG 219.A N GLU 214.A O no hydrogen 2.890 N/A ARG 219.A NE GLU 214.A OE2 no hydrogen 2.847 N/A SER 221.A N VAL 215.A O no hydrogen 3.103 N/A SER 221.A OG HIS 191.A O no hydrogen 3.036 N/A SER 221.A OG THR 193.A OG1 no hydrogen 2.541 N/A ASP 222.A N HIS 191.A O no hydrogen 2.911 N/A ILE 223.A N HIS 191.A O no hydrogen 3.086 N/A ILE 224.A N ASN 30.A O no hydrogen 3.082 N/A ILE 225.A N THR 193.A O no hydrogen 2.823 N/A VAL 226.A N CYS 32.A O no hydrogen 3.053 N/A ARG 228.A NH1 ASP 203.A OD2 no hydrogen 2.938 N/A ARG 228.A NH2 ASP 203.A OD2 no hydrogen 2.966 N/A ILE 230.A N GLY 227.A O no hydrogen 2.887 N/A ILE 231.A N GLY 227.A O no hydrogen 2.874 N/A SER 232.A N ARG 228.A O no hydrogen 3.069 N/A SER 232.A OG ARG 228.A O no hydrogen 3.367 N/A ALA 233.A N ILE 230.A O no hydrogen 3.019 N/A ARG 236.A NH1 GLU 42.A OE2 no hydrogen 3.061 N/A ARG 236.A NH1 ILE 231.A O no hydrogen 2.934 N/A ARG 236.A NH2 GLU 42.A OE2 no hydrogen 2.860 N/A LEU 237.A N ASP 235.A OD1 no hydrogen 2.978 N/A GLU 238.A N ASP 235.A OD1 no hydrogen 3.020 N/A ALA 239.A N ASP 235.A O no hydrogen 3.148 N/A ALA 240.A N ARG 236.A O no hydrogen 2.940 N/A GLU 241.A N LEU 237.A O no hydrogen 2.992 N/A MET 242.A N GLU 238.A O no hydrogen 3.031 N/A TYR 243.A N ALA 239.A O no hydrogen 3.050 N/A ARG 244.A N ALA 240.A O no hydrogen 2.761 N/A ARG 244.A NE GLU 241.A OE1 no hydrogen 3.367 N/A ARG 244.A NE GLU 241.A OE2 no hydrogen 3.075 N/A ARG 244.A NH1 GLU 241.A OE1 no hydrogen 2.900 N/A ARG 244.A NH2 GLU 28.A O no hydrogen 2.895 N/A LYS 245.A N GLU 241.A O no hydrogen 2.970 N/A ALA 246.A N MET 242.A O no hydrogen 3.047 N/A ALA 247.A N TYR 243.A O no hydrogen 2.949 N/A TRP 248.A N ARG 244.A O no hydrogen 2.836 N/A GLU 249.A N LYS 245.A O no hydrogen 2.898 N/A ALA 250.A N ALA 246.A O no hydrogen 3.085 N/A TYR 251.A N ALA 247.A O no hydrogen 3.092 N/A LEU 252.A N TRP 248.A O no hydrogen 2.977 N/A SER 253.A N GLU 249.A O no hydrogen 2.932 N/A SER 253.A OG ALA 250.A O no hydrogen 2.497 N/A ARG 254.A N ALA 250.A O no hydrogen 3.149 N/A ARG 254.A NE GLU 1.A OE1 no hydrogen 3.052 N/A ARG 254.A NE GLU 1.A OE2 no hydrogen 3.321 N/A ARG 254.A NH1 ILE 216.A O no hydrogen 2.767 N/A ARG 254.A NH1 SER 221.A O no hydrogen 2.658 N/A ARG 254.A NH2 GLU 1.A OE2 no hydrogen 2.707 N/A ARG 254.A NH2 ASP 222.A OD1 no hydrogen 3.550 N/A LEU 255.A N TYR 251.A O no hydrogen 3.125 N/A GLY 256.A N LEU 252.A O no hydrogen 3.264 N/A