Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3akj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N THR 58.A O no hydrogen 2.793 N/A THR 6.A N ASP 4.A OD2 no hydrogen 2.970 N/A THR 6.A OG1 ASP 4.A OD1 no hydrogen 3.096 N/A THR 6.A OG1 ASP 4.A OD2 no hydrogen 2.853 N/A CYS 8.A N PHE 5.A O no hydrogen 2.912 N/A CYS 8.A SG PHE 18.A O no hydrogen 3.635 N/A ASN 11.A N SER 16.A O no hydrogen 2.558 N/A ASN 11.A ND2 SER 16.A OG no hydrogen 3.075 N/A ILE 15.A N VAL 26.A O no hydrogen 3.008 N/A LEU 17.A N TYR 24.A O no hydrogen 2.894 N/A PHE 18.A N GLU 9.A O no hydrogen 2.887 N/A TYR 19.A N GLU 22.A O no hydrogen 2.736 N/A GLU 22.A N TYR 19.A O no hydrogen 2.908 N/A TYR 24.A N LEU 17.A O no hydrogen 2.762 N/A MET 25.A N CYS 67.A O no hydrogen 2.834 N/A VAL 26.A N ILE 15.A O no hydrogen 2.760 N/A LYS 27.A N VAL 65.A O no hydrogen 2.921 N/A LYS 27.A NZ GLU 37.A OE1 no hydrogen 2.833 N/A LYS 27.A NZ ASP 159.A OD1 no hydrogen 3.235 N/A PHE 28.A N ASN 13.A O no hydrogen 3.022 N/A ASN 32.A N PRO 166.A O no hydrogen 2.954 N/A CYS 34.A SG LYS 27.A O no hydrogen 3.445 N/A CYS 34.A SG ILE 63.A O no hydrogen 3.863 N/A SER 36.A N ASN 32.A O no hydrogen 2.729 N/A SER 36.A OG ASN 32.A O no hydrogen 3.203 N/A SER 36.A OG CYS 163.A O no hydrogen 2.837 N/A GLU 37.A N GLY 33.A O no hydrogen 2.906 N/A TYR 38.A N CYS 34.A O no hydrogen 3.091 N/A VAL 39.A N PHE 35.A O no hydrogen 2.902 N/A ALA 40.A N SER 36.A O no hydrogen 2.833 N/A CYS 41.A N GLU 37.A O no hydrogen 2.947 N/A CYS 41.A SG GLU 37.A O no hydrogen 3.326 N/A CYS 41.A SG GLU 37.A OE2 no hydrogen 3.331 N/A HIS 42.A N TYR 38.A O no hydrogen 3.016 N/A HIS 42.A NE2 THR 54.A O no hydrogen 3.123 N/A ILE 43.A N VAL 39.A O no hydrogen 2.879 N/A VAL 44.A N ALA 40.A O no hydrogen 2.866 N/A ASN 45.A N CYS 41.A O no hydrogen 2.877 N/A SER 46.A N HIS 42.A O no hydrogen 3.006 N/A SER 46.A OG ILE 43.A O no hydrogen 2.699 N/A LEU 47.A N ILE 43.A O no hydrogen 3.052 N/A LEU 47.A N VAL 44.A O no hydrogen 2.913 N/A GLY 48.A N ASN 45.A O no hydrogen 2.906 N/A LEU 49.A N VAL 44.A O no hydrogen 3.413 N/A LYS 50.A NZ ILE 154.A O no hydrogen 2.819 N/A GLN 52.A N ILE 157.A O no hydrogen 2.886 N/A LEU 55.A N ALA 66.A O no hydrogen 2.893 N/A GLY 57.A N VAL 64.A O no hydrogen 2.987 N/A THR 58.A N ILE 3.A O no hydrogen 2.954 N/A THR 58.A OG1 ASP 4.A OD1 no hydrogen 3.562 N/A THR 58.A OG1 LYS 62.A O no hydrogen 3.261 N/A TYR 59.A N LYS 62.A O no hydrogen 2.790 N/A LYS 60.A N THR 6.A OG1 no hydrogen 2.572 N/A LYS 62.A N TYR 59.A O no hydrogen 3.176 N/A VAL 64.A N GLY 57.A O no hydrogen 2.894 N/A VAL 65.A N LYS 27.A O no hydrogen 3.303 N/A ALA 66.A N LEU 55.A O no hydrogen 2.697 N/A CYS 67.A N MET 25.A O no hydrogen 2.846 N/A LYS 68.A N GLU 53.A O no hydrogen 2.973 N/A LYS 68.A NZ GLU 22.A OE1 no hydrogen 2.836 N/A LYS 68.A NZ GLU 53.A OE1 no hydrogen 2.852 N/A ASP 69.A N LEU 23.A O no hydrogen 2.884 N/A THR 71.A N ASP 69.A OD1 no hydrogen 2.861 N/A THR 71.A OG1 ASP 69.A OD1 no hydrogen 2.260 N/A GLU 76.A N ARG 145.A O no hydrogen 2.850 N/A VAL 78.A N PHE 143.A O no hydrogen 2.871 N/A PHE 80.A N TRP 141.A O no hydrogen 2.894 N/A LEU 81.A N ASN 138.A O no hydrogen 2.884 N/A SER 82.A N ASP 79.A O no hydrogen 3.072 N/A SER 82.A N ASP 79.A OD1 no hydrogen 2.932 N/A SER 82.A OG ASP 79.A O no hydrogen 2.952 N/A LEU 83.A N ASP 79.A O no hydrogen 3.361 N/A LYS 84.A N PHE 80.A O no hydrogen 2.750 N/A LYS 84.A NZ SER 93.A O no hydrogen 3.106 N/A LYS 84.A NZ ASP 96.A O no hydrogen 3.063 N/A ASN 85.A N LEU 81.A O no hydrogen 2.851 N/A THR 86.A N LEU 83.A O no hydrogen 3.015 N/A THR 86.A OG1 LEU 83.A O no hydrogen 2.727 N/A MET 87.A N LYS 84.A O no hydrogen 3.092 N/A LEU 90.A N MET 87.A O no hydrogen 3.102 N/A ASP 96.A N SER 93.A O no hydrogen 2.978 N/A THR 97.A OG1 ILE 194.A O no hydrogen 2.748 N/A ASN 98.A N ASP 96.A OD1 no hydrogen 3.070 N/A ASN 98.A ND2 ASP 198.A OD1 no hydrogen 3.011 N/A LEU 99.A N LYS 196.A O no hydrogen 2.823 N/A ASP 101.A N ASN 98.A OD1 no hydrogen 3.033 N/A VAL 102.A N ASN 98.A O no hydrogen 3.074 N/A LEU 103.A N LEU 99.A O no hydrogen 2.831 N/A TYR 104.A N ASN 100.A O no hydrogen 2.943 N/A TYR 104.A OH GLU 89.A OE1 no hydrogen 2.607 N/A ALA 105.A N ASP 101.A O no hydrogen 2.923 N/A ILE 106.A N VAL 102.A O no hydrogen 2.998 N/A ASP 107.A N LEU 103.A O no hydrogen 3.039 N/A ASN 108.A N TYR 104.A O no hydrogen 2.934 N/A ASN 108.A N ALA 105.A O no hydrogen 3.164 N/A GLN 109.A NE2 ILE 106.A O no hydrogen 2.909 N/A GLN 109.A NE2 ILE 112.A O no hydrogen 2.757 N/A ILE 112.A N GLN 109.A OE1 no hydrogen 2.843 N/A VAL 116.A N GLU 113.A O no hydrogen 2.811 N/A LEU 117.A N GLU 113.A O no hydrogen 2.992 N/A LYS 118.A N PRO 114.A O no hydrogen 2.886 N/A LYS 118.A NZ ASP 216.A OD1 no hydrogen 3.371 N/A CYS 119.A N LYS 115.A O no hydrogen 3.153 N/A CYS 119.A SG LYS 115.A O no hydrogen 3.532 N/A PHE 120.A N VAL 116.A O no hydrogen 3.094 N/A PHE 121.A N LEU 117.A O no hydrogen 2.898 N/A TRP 122.A N LYS 118.A O no hydrogen 3.010 N/A ASP 123.A N CYS 119.A O no hydrogen 3.004 N/A MET 124.A N PHE 120.A O no hydrogen 2.879 N/A PHE 125.A N PHE 121.A O no hydrogen 2.882 N/A VAL 126.A N TRP 122.A O no hydrogen 3.033 N/A ALA 127.A N ASP 123.A O no hydrogen 3.145 N/A ASP 128.A N MET 124.A O no hydrogen 2.801 N/A THR 129.A N PHE 125.A O no hydrogen 2.829 N/A THR 129.A OG1 PHE 125.A O no hydrogen 2.831 N/A LEU 130.A N VAL 126.A O no hydrogen 3.025 N/A LEU 131.A N ALA 127.A O no hydrogen 2.849 N/A GLY 132.A N THR 129.A O no hydrogen 3.374 N/A ASN 133.A N ASP 128.A O no hydrogen 2.928 N/A ASN 133.A ND2 ASP 128.A OD1 no hydrogen 2.935 N/A PHE 134.A N SER 162.A O no hydrogen 3.223 N/A ASP 135.A N ASN 133.A OD1 no hydrogen 2.820 N/A ARG 136.A NE ASP 128.A OD2 no hydrogen 2.753 N/A ARG 136.A NH1 ASN 140.A O no hydrogen 3.033 N/A ARG 136.A NH1 PHE 158.A O no hydrogen 2.830 N/A ARG 136.A NH2 ASP 128.A OD1 no hydrogen 2.915 N/A ASN 138.A ND2 GLY 94.A O no hydrogen 2.746 N/A ASN 138.A ND2 ASP 96.A O no hydrogen 2.879 N/A ASN 140.A N HIS 137.A O no hydrogen 2.842 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.853 N/A PHE 143.A N VAL 78.A O no hydrogen 2.868 N/A LEU 144.A N GLN 153.A O no hydrogen 2.615 N/A ARG 145.A N GLU 76.A O no hydrogen 2.852 N/A ARG 145.A NH1 ALA 146.A O no hydrogen 2.907 N/A ALA 146.A N GLU 151.A O no hydrogen 2.954 N/A SER 147.A N GLN 74.A O no hydrogen 2.809 N/A SER 149.A OG GLU 151.A OE2 no hydrogen 3.476 N/A GLN 153.A N LEU 144.A O no hydrogen 2.749 N/A ALA 155.A N GLY 142.A O no hydrogen 2.804 N/A ILE 157.A N LYS 50.A O no hydrogen 2.870 N/A CYS 160.A N GLU 37.A OE2 no hydrogen 2.719 N/A CYS 160.A SG PHE 158.A O no hydrogen 4.031 N/A CYS 163.A N CYS 160.A O no hydrogen 3.157 N/A LEU 164.A N LEU 131.A O no hydrogen 2.833 N/A TYR 165.A OH ARG 186.A O no hydrogen 2.572 N/A GLN 167.A N GLN 167.A OE1 no hydrogen 2.903 N/A ALA 168.A N TYR 165.A O no hydrogen 3.108 N/A VAL 172.A N ASP 169.A OD1 no hydrogen 2.701 N/A CYS 173.A N ASP 169.A O no hydrogen 2.862 N/A CYS 173.A SG ALA 168.A O no hydrogen 3.656 N/A CYS 173.A SG ASP 169.A O no hydrogen 3.417 N/A GLN 174.A N ASP 170.A O no hydrogen 2.977 N/A LYS 175.A N VAL 171.A O no hydrogen 2.914 N/A VAL 176.A N VAL 172.A O no hydrogen 2.887 N/A LEU 177.A N CYS 173.A O no hydrogen 3.047 N/A SER 178.A N GLN 174.A O no hydrogen 2.912 N/A SER 178.A N LYS 175.A O no hydrogen 3.324 N/A SER 178.A OG GLN 174.A O no hydrogen 3.172 N/A ASN 179.A N VAL 176.A O no hydrogen 3.382 N/A GLU 182.A N ASN 179.A OD1 no hydrogen 3.172 N/A LEU 183.A N ASN 179.A O no hydrogen 3.100 N/A ASN 184.A N ILE 180.A O no hydrogen 2.699 N/A ALA 185.A N ASP 181.A O no hydrogen 3.063 N/A ARG 186.A N LEU 183.A O no hydrogen 2.904 N/A ARG 186.A NH1 GLU 182.A O no hydrogen 3.051 N/A ILE 187.A N ASN 184.A O no hydrogen 3.032 N/A TYR 188.A N ASN 184.A O no hydrogen 2.900 N/A ASN 189.A N ALA 185.A O no hydrogen 2.968 N/A PHE 190.A N ALA 185.A O no hydrogen 3.093 N/A SER 193.A N ILE 203.A O no hydrogen 2.785 N/A LEU 195.A N SER 193.A OG no hydrogen 3.002 N/A LYS 196.A N THR 97.A O no hydrogen 2.941 N/A LYS 196.A NZ ASP 96.A OD2 no hydrogen 2.681 N/A LYS 196.A NZ ASP 200.A OD1 no hydrogen 2.824 N/A ASP 197.A N LYS 201.A O no hydrogen 2.787 N/A ASN 199.A N ASP 197.A OD2 no hydrogen 2.871 N/A ASP 200.A N ASP 197.A O no hydrogen 2.877 N/A LYS 201.A N ASP 197.A OD2 no hydrogen 2.924 N/A ILE 203.A N LEU 195.A O no hydrogen 2.884 N/A ASN 204.A ND2 TYR 188.A O no hydrogen 2.881 N/A TYR 205.A OH ASN 133.A O no hydrogen 2.580 N/A ASP 207.A N ASN 204.A OD1 no hydrogen 3.065 N/A PHE 208.A N ASN 204.A O no hydrogen 2.882 N/A LEU 209.A N TYR 205.A O no hydrogen 2.944 N/A THR 210.A N TYR 206.A O no hydrogen 3.102 N/A THR 210.A OG1 TYR 206.A O no hydrogen 2.757 N/A THR 210.A OG1 ASP 207.A O no hydrogen 3.482 N/A GLN 211.A N PHE 208.A O no hydrogen 3.203 N/A THR 212.A N PHE 208.A O no hydrogen 2.747 N/A ASN 214.A N THR 212.A OG1 no hydrogen 2.764 N/A LYS 215.A NZ ASP 219.A OD1 no hydrogen 3.085 N/A LYS 215.A NZ ASP 219.A OD2 no hydrogen 3.072 N/A CYS 217.A N ASN 214.A OD1 no hydrogen 2.944 N/A LEU 218.A N ASN 214.A O no hydrogen 3.157 N/A ASP 219.A N LYS 215.A O no hydrogen 2.879 N/A ALA 220.A N ASP 216.A O no hydrogen 3.058 N/A LEU 221.A N CYS 217.A O no hydrogen 2.956 N/A LEU 222.A N LEU 218.A O no hydrogen 2.914 N/A ARG 223.A N ASP 219.A O no hydrogen 2.855 N/A ARG 223.A NE ASP 123.A OD1 no hydrogen 2.941 N/A ARG 223.A NH2 ASP 123.A OD1 no hydrogen 2.688 N/A ILE 224.A N ALA 220.A O no hydrogen 2.897 N/A TYR 225.A N LEU 221.A O no hydrogen 2.906 N/A TYR 225.A OH ASP 264.A OD1 no hydrogen 3.176 N/A ARG 227.A N ILE 224.A O no hydrogen 2.852 N/A ARG 227.A NE LEU 47.A O no hydrogen 2.798 N/A ARG 227.A NH2 LEU 47.A O no hydrogen 3.034 N/A ILE 228.A N TYR 225.A O no hydrogen 2.875 N/A LYS 232.A N ASP 229.A OD1 no hydrogen 3.162 N/A ILE 233.A N ASP 229.A O no hydrogen 2.877 N/A HIS 234.A N MET 230.A O no hydrogen 2.775 N/A HIS 234.A NE2 HIS 252.A O no hydrogen 3.315 N/A SER 235.A N ASN 231.A O no hydrogen 2.910 N/A ILE 236.A N LYS 232.A O no hydrogen 2.969 N/A ILE 237.A N ILE 233.A O no hydrogen 3.147 N/A ASP 238.A N HIS 234.A O no hydrogen 2.815 N/A ASN 239.A N SER 235.A O no hydrogen 2.826 N/A ASN 239.A ND2 SER 235.A O no hydrogen 2.895 N/A THR 240.A N ILE 237.A O no hydrogen 3.265 N/A THR 240.A OG1 ILE 236.A O no hydrogen 2.721 N/A THR 240.A OG1 ILE 237.A O no hydrogen 3.393 N/A HIS 247.A N SER 244.A OG no hydrogen 3.171 N/A LYS 248.A N SER 244.A O no hydrogen 2.991 N/A LYS 248.A NZ ASP 238.A O no hydrogen 2.844 N/A GLU 249.A N GLU 245.A O no hydrogen 2.929 N/A PHE 250.A N ILE 246.A O no hydrogen 3.079 N/A LEU 251.A N HIS 247.A O no hydrogen 3.006 N/A HIS 252.A N LYS 248.A O no hydrogen 2.835 N/A HIS 252.A NE2 HIS 234.A O no hydrogen 3.288 N/A THR 253.A N GLU 249.A O no hydrogen 3.036 N/A THR 253.A OG1 GLU 249.A O no hydrogen 3.140 N/A MET 254.A N PHE 250.A O no hydrogen 2.858 N/A LEU 255.A N LEU 251.A O no hydrogen 2.913 N/A ASP 256.A N HIS 252.A O no hydrogen 3.190 N/A GLU 257.A N THR 253.A O no hydrogen 2.945 N/A ARG 258.A N MET 254.A O no hydrogen 2.800 N/A ARG 258.A NE THR 129.A O no hydrogen 3.030 N/A ARG 258.A NE LEU 130.A O no hydrogen 3.171 N/A ARG 258.A NH1 TYR 165.A OH no hydrogen 2.928 N/A ARG 258.A NH2 THR 129.A O no hydrogen 2.810 N/A LYS 259.A N LEU 255.A O no hydrogen 2.894 N/A LYS 259.A NZ ASP 264.A OD1 no hydrogen 2.841 N/A LYS 259.A NZ ASP 264.A OD2 no hydrogen 3.565 N/A SER 260.A N ASP 256.A O no hydrogen 2.840 N/A SER 260.A OG ASP 256.A O no hydrogen 3.170 N/A LYS 261.A N GLU 257.A O no hydrogen 2.759 N/A LYS 261.A NZ GLU 257.A OE1 no hydrogen 2.738 N/A ILE 262.A N ARG 258.A O no hydrogen 3.071 N/A ILE 263.A N ARG 258.A O no hydrogen 3.211 N/A ASP 264.A N LYS 259.A O no hydrogen 2.811 N/A ALA 266.A N ILE 262.A O no hydrogen 2.948 N/A HIS 267.A N ILE 263.A O no hydrogen 2.787 N/A THR 268.A N ASP 264.A O no hydrogen 2.949 N/A THR 268.A OG1 ASP 264.A O no hydrogen 3.125 N/A ARG 269.A N VAL 265.A O no hydrogen 3.368 N/A ARG 269.A NH1 THR 212.A O no hydrogen 2.941 N/A ARG 269.A NH2 THR 212.A O no hydrogen 3.121 N/A ALA 270.A N ALA 266.A O no hydrogen 2.910 N/A ILE 271.A N HIS 267.A O no hydrogen 2.815 N/A GLU 272.A N THR 268.A O no hydrogen 3.029 N/A LEU 273.A N ARG 269.A O no hydrogen 2.864 N/A SER 274.A N ALA 270.A O no hydrogen 2.902 N/A LEU 275.A N ILE 271.A O no hydrogen 3.326 N/A