Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ykd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N ASP 211.A OD2 no hydrogen 3.193 N/A HIS 1.A NE2 ASP 142.A OD2 no hydrogen 2.839 N/A HIS 3.A ND1 GLU 143.A OE2 no hydrogen 2.954 N/A HIS 4.A N GLU 143.A OE1 no hydrogen 3.386 N/A HIS 4.A NE2 GLU 215.A OE1 no hydrogen 3.010 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 2.684 N/A SER 8.A OG PRO 5.A O no hydrogen 2.620 N/A GLN 9.A NE2 PRO 5.A O no hydrogen 3.580 N/A GLN 11.A N ILE 28.A O no hydrogen 2.941 N/A GLY 13.A N SER 26.A O no hydrogen 2.652 N/A LEU 16.A N VAL 24.A O no hydrogen 2.698 N/A GLY 17.A N VAL 24.A O no hydrogen 3.388 N/A GLY 19.A N GLY 22.A O no hydrogen 2.884 N/A GLY 22.A N GLY 19.A O no hydrogen 2.805 N/A SER 23.A N HIS 40.A O no hydrogen 3.054 N/A VAL 24.A N GLY 17.A O no hydrogen 2.863 N/A TYR 25.A N ILE 38.A O no hydrogen 2.787 N/A SER 26.A N PRO 14.A O no hydrogen 2.863 N/A GLY 27.A N VAL 36.A O no hydrogen 2.914 N/A ILE 28.A N GLN 11.A O no hydrogen 3.001 N/A ARG 29.A N LEU 34.A O no hydrogen 2.978 N/A ARG 29.A NH1 ASP 32.A OD2 no hydrogen 2.925 N/A VAL 30.A N GLN 9.A O no hydrogen 3.045 N/A ASP 32.A N ARG 29.A O no hydrogen 3.382 N/A LEU 34.A N ASP 32.A OD1 no hydrogen 2.976 N/A VAL 36.A N GLY 27.A O no hydrogen 2.989 N/A ALA 37.A N LEU 92.A O no hydrogen 2.730 N/A ILE 38.A N TYR 25.A O no hydrogen 2.695 N/A LYS 39.A N LEU 90.A O no hydrogen 2.878 N/A LYS 39.A NZ GLU 61.A OE2 no hydrogen 2.681 N/A LYS 39.A NZ ASP 158.A OD1 no hydrogen 3.433 N/A HIS 40.A N SER 23.A O no hydrogen 2.911 N/A VAL 41.A N PHE 88.A O no hydrogen 2.870 N/A LYS 43.A N ASP 86.A O no hydrogen 2.796 N/A LYS 43.A NZ GLU 83.A OE2 no hydrogen 2.863 N/A LYS 43.A NZ ARG 84.A O no hydrogen 2.658 N/A LYS 43.A NZ PRO 85.A O no hydrogen 3.117 N/A ARG 45.A N GLU 42.A O no hydrogen 3.104 N/A ILE 46.A N LYS 43.A O no hydrogen 3.174 N/A TRP 49.A NE1 ILE 46.A O no hydrogen 2.981 N/A GLY 50.A N VAL 58.A O no hydrogen 2.893 N/A THR 56.A N ASN 54.A OD1 no hydrogen 3.260 N/A THR 56.A OG1 ASN 54.A OD1 no hydrogen 2.970 N/A VAL 58.A N GLY 50.A O no hydrogen 2.975 N/A MET 60.A N ASP 48.A O no hydrogen 3.003 N/A VAL 62.A N PRO 59.A O no hydrogen 2.839 N/A VAL 63.A N PRO 59.A O no hydrogen 3.300 N/A LEU 64.A N MET 60.A O no hydrogen 2.776 N/A LEU 65.A N GLU 61.A O no hydrogen 2.925 N/A LYS 66.A N VAL 62.A O no hydrogen 3.005 N/A LYS 67.A N VAL 63.A O no hydrogen 3.111 N/A LYS 67.A NZ CYS 133.A O no hydrogen 3.071 N/A VAL 68.A N LEU 64.A O no hydrogen 3.183 N/A VAL 68.A N LEU 65.A O no hydrogen 3.158 N/A SER 69.A N LYS 66.A O no hydrogen 3.417 N/A SER 69.A OG LEU 65.A O no hydrogen 2.582 N/A VAL 75.A N SER 73.A OG no hydrogen 3.387 N/A ILE 76.A N LEU 156.A O.A no hydrogen 3.053 N/A ILE 76.A N LEU 156.A O.B no hydrogen 2.978 N/A ARG 77.A N GLU 93.A OE1 no hydrogen 3.019 N/A LEU 78.A N SER 69.A OG no hydrogen 2.951 N/A LEU 79.A N ILE 91.A O no hydrogen 2.765 N/A ASP 80.A N ILE 91.A O no hydrogen 3.315 N/A TRP 81.A N ASP 80.A OD1 no hydrogen 2.974 N/A PHE 82.A N VAL 89.A O no hydrogen 2.755 N/A ARG 84.A N SER 87.A O no hydrogen 2.822 N/A PHE 88.A N VAL 41.A O no hydrogen 2.821 N/A VAL 89.A N PHE 82.A O no hydrogen 2.843 N/A LEU 90.A N LYS 39.A O no hydrogen 2.795 N/A ILE 91.A N ASP 80.A O no hydrogen 2.734 N/A LEU 92.A N ALA 37.A O no hydrogen 2.847 N/A GLU 93.A N ARG 77.A O no hydrogen 3.032 N/A ARG 94.A NE VAL 36.A O no hydrogen 2.791 N/A ARG 94.A NH1 GLY 27.A O no hydrogen 2.832 N/A ARG 94.A NH2 GLU 96.A OE1 no hydrogen 2.783 N/A GLN 99.A N ILE 147.A O no hydrogen 3.054 N/A LEU 101.A N ILE 145.A O no hydrogen 2.777 N/A ASP 103.A N ASP 100.A OD1 no hydrogen 2.668 N/A PHE 104.A N ASP 100.A O no hydrogen 3.051 N/A ILE 105.A N LEU 101.A O no hydrogen 2.952 N/A THR 106.A N PHE 102.A O no hydrogen 2.864 N/A THR 106.A OG1 PHE 102.A O no hydrogen 3.016 N/A GLU 107.A N ASP 103.A O no hydrogen 3.007 N/A ARG 108.A N PHE 104.A O no hydrogen 2.949 N/A ARG 108.A NH1 HIS 274.A O no hydrogen 3.136 N/A ARG 108.A NH2 HIS 274.A O no hydrogen 2.870 N/A GLY 109.A N ILE 105.A O no hydrogen 2.860 N/A LEU 111.A N MET 207.A O no hydrogen 2.852 N/A ALA 116.A N GLN 112.A O no hydrogen 2.875 N/A ARG 117.A N GLU 113.A O no hydrogen 2.749 N/A ARG 117.A NE TRP 260.A O no hydrogen 2.686 N/A ARG 117.A NH2 TRP 260.A O no hydrogen 3.211 N/A SER 118.A N GLU 114.A O no hydrogen 3.180 N/A SER 118.A OG THR 270.A OG1 no hydrogen 2.716 N/A PHE 119.A N LEU 115.A O no hydrogen 2.976 N/A PHE 120.A N ALA 116.A O no hydrogen 2.800 N/A TRP 121.A N ARG 117.A O no hydrogen 2.853 N/A GLN 122.A N SER 118.A O no hydrogen 3.180 N/A GLN 122.A NE2 GLY 152.A O no hydrogen 2.793 N/A VAL 123.A N PHE 119.A O no hydrogen 2.946 N/A LEU 124.A N PHE 120.A O no hydrogen 2.892 N/A GLU 125.A N TRP 121.A O no hydrogen 2.993 N/A ALA 126.A N GLN 122.A O no hydrogen 3.032 N/A VAL 127.A N VAL 123.A O no hydrogen 2.896 N/A ARG 128.A N LEU 124.A O no hydrogen 2.889 N/A ARG 128.A NH1 GLN 256.A OE1 no hydrogen 2.974 N/A HIS 129.A N GLU 125.A O no hydrogen 2.997 N/A HIS 129.A NE2 VAL 68.A O no hydrogen 2.892 N/A CYS 130.A N ALA 126.A O no hydrogen 3.044 N/A CYS 130.A SG ALA 126.A O no hydrogen 3.444 N/A HIS 131.A N VAL 127.A O no hydrogen 2.884 N/A ASN 132.A N ARG 128.A O no hydrogen 2.820 N/A CYS 133.A N HIS 129.A O no hydrogen 2.961 N/A CYS 133.A SG LYS 67.A O no hydrogen 3.389 N/A CYS 133.A SG HIS 129.A O no hydrogen 3.298 N/A GLY 134.A N HIS 131.A O no hydrogen 3.002 N/A VAL 135.A N CYS 130.A O no hydrogen 2.841 N/A LEU 136.A N ALA 163.A O no hydrogen 2.868 N/A HIS 137.A NE2 ILE 157.A O no hydrogen 2.872 N/A ARG 138.A NE SER 161.A O no hydrogen 2.837 N/A ARG 138.A NH1 ASP 172.A OD1 no hydrogen 3.479 N/A ARG 138.A NH1 ASP 172.A OD2 no hydrogen 3.082 N/A ARG 138.A NH1 TYR 190.A OH no hydrogen 2.937 N/A ARG 138.A NH2 SER 161.A O no hydrogen 3.204 N/A ARG 138.A NH2 GLY 162.A O no hydrogen 3.350 N/A ARG 138.A NH2 ASP 172.A OD2 no hydrogen 3.161 N/A ASP 139.A N HIS 137.A ND1 no hydrogen 2.960 N/A LYS 141.A NZ GLU 143.A OE1 no hydrogen 3.052 N/A LYS 141.A NZ THR 176.A OG1 no hydrogen 2.777 N/A ASN 144.A N LYS 141.A O no hydrogen 2.904 N/A ASN 144.A ND2 ASP 139.A O no hydrogen 2.788 N/A ASN 144.A ND2 ASP 139.A OD2 no hydrogen 2.937 N/A ILE 145.A N ASP 142.A O no hydrogen 3.271 N/A LEU 146.A N LYS 155.A O no hydrogen 2.833 N/A ILE 147.A N GLN 99.A O no hydrogen 2.804 N/A ASP 148.A N GLU 153.A O no hydrogen 2.817 N/A LEU 149.A N PRO 97.A O no hydrogen 3.189 N/A ASN 150.A N ASP 148.A OD1 no hydrogen 3.118 N/A ARG 151.A N ASP 148.A OD1 no hydrogen 2.962 N/A GLY 152.A N ASP 148.A O no hydrogen 2.775 N/A LEU 154.A N GLN 122.A OE1 no hydrogen 2.872 N/A LYS 155.A N LEU 146.A O no hydrogen 2.825 N/A LYS 155.A NZ SER 73.A O no hydrogen 2.713 N/A LEU 156.A N.A GLY 74.A O no hydrogen 2.817 N/A LEU 156.A N.B GLY 74.A O no hydrogen 2.817 N/A ILE 157.A N ASN 144.A O no hydrogen 2.903 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 3.076 N/A GLY 162.A N PHE 159.A O no hydrogen 2.989 N/A ALA 163.A N LEU 136.A O no hydrogen 2.890 N/A LEU 165.A N GLY 134.A O no hydrogen 2.883 N/A LYS 166.A N TYR 170.A OH no hydrogen 3.080 N/A LYS 166.A NZ VAL 169.A O no hydrogen 3.166 N/A TYR 170.A N TYR 190.A O no hydrogen 2.809 N/A TYR 170.A OH LEU 164.A O no hydrogen 2.649 N/A THR 176.A OG1 ASP 139.A OD1 no hydrogen 2.651 N/A ARG 177.A NE ASP 217.A OD1 no hydrogen 2.960 N/A ARG 177.A NE ASP 217.A OD2 no hydrogen 3.399 N/A ARG 177.A NH2 ASP 217.A OD2 no hydrogen 2.782 N/A TYR 179.A N THR 176.A O no hydrogen 3.025 N/A SER 180.A N ARG 177.A O no hydrogen 2.941 N/A SER 180.A OG ARG 177.A O no hydrogen 2.607 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.736 N/A TRP 184.A N PRO 181.A O no hydrogen 2.969 N/A ILE 185.A N PRO 181.A O no hydrogen 3.138 N/A ARG 186.A N PRO 182.A O no hydrogen 2.858 N/A ARG 186.A NE TYR 187.A OH no hydrogen 3.202 N/A ARG 186.A NH2 TYR 187.A OH no hydrogen 3.525 N/A TYR 187.A N GLU 183.A O no hydrogen 2.880 N/A HIS 188.A N TRP 184.A O no hydrogen 2.847 N/A TYR 190.A N TYR 170.A O no hydrogen 3.129 N/A TYR 190.A OH ASP 172.A O no hydrogen 2.669 N/A SER 194.A OG HIS 191.A O no hydrogen 3.567 N/A ALA 195.A N HIS 191.A O no hydrogen 3.147 N/A ALA 196.A N GLY 192.A O no hydrogen 2.941 N/A VAL 197.A N ARG 193.A O no hydrogen 2.922 N/A TRP 198.A N SER 194.A O no hydrogen 3.097 N/A SER 199.A N ALA 195.A O no hydrogen 3.086 N/A SER 199.A OG ALA 196.A O no hydrogen 2.650 N/A LEU 200.A N ALA 196.A O no hydrogen 2.950 N/A GLY 201.A N VAL 197.A O no hydrogen 2.959 N/A ILE 202.A N TRP 198.A O no hydrogen 3.088 N/A LEU 203.A N SER 199.A O no hydrogen 2.918 N/A LEU 204.A N LEU 200.A O no hydrogen 2.840 N/A TYR 205.A N GLY 201.A O no hydrogen 3.017 N/A TYR 205.A OH PHE 226.A O no hydrogen 2.594 N/A ASP 206.A N ILE 202.A O no hydrogen 2.904 N/A MET 207.A N LEU 203.A O no hydrogen 2.929 N/A VAL 208.A N LEU 204.A O no hydrogen 3.064 N/A CYS 209.A N TYR 205.A O no hydrogen 2.712 N/A GLY 210.A N ASP 206.A O no hydrogen 2.755 N/A ILE 212.A N ASP 211.A OD1 no hydrogen 2.877 N/A GLU 215.A N GLU 219.A OE2 no hydrogen 2.782 N/A HIS 216.A N GLU 219.A OE2 no hydrogen 2.956 N/A ILE 220.A N HIS 216.A O no hydrogen 3.130 N/A ILE 221.A N ASP 217.A O no hydrogen 3.023 N/A ARG 222.A N GLU 218.A O no hydrogen 3.069 N/A GLY 223.A N GLU 219.A O no hydrogen 2.934 N/A ARG 228.A NE TYR 205.A OH no hydrogen 3.209 N/A GLN 229.A NE2 ARG 228.A O no hydrogen 3.610 N/A SER 232.A N GLU 113.A OE2 no hydrogen 2.811 N/A SER 232.A OG GLU 113.A OE1 no hydrogen 2.657 N/A SER 232.A OG GLU 113.A OE2 no hydrogen 3.526 N/A CYS 234.A N SER 232.A OG no hydrogen 3.180 N/A GLN 235.A N SER 232.A O no hydrogen 2.929 N/A GLN 235.A NE2 VAL 231.A O no hydrogen 3.243 N/A HIS 236.A ND1 HIS 258.A NE2 no hydrogen 2.842 N/A LEU 237.A N GLU 233.A O no hydrogen 3.119 N/A ILE 238.A N CYS 234.A O no hydrogen 2.999 N/A ARG 239.A N GLN 235.A O no hydrogen 2.900 N/A ARG 239.A NH1 GLN 235.A OE1 no hydrogen 2.789 N/A ARG 239.A NH2 VAL 225.A O no hydrogen 2.980 N/A TRP 240.A N HIS 236.A O no hydrogen 2.877 N/A CYS 241.A N LEU 237.A O no hydrogen 2.934 N/A CYS 241.A SG LEU 237.A O no hydrogen 3.468 N/A LEU 242.A N ILE 238.A O no hydrogen 3.018 N/A ALA 243.A N TRP 240.A O no hydrogen 3.131 N/A ASP 248.A N ARG 245.A O no hydrogen 2.927 N/A ARG 249.A N PRO 246.A O no hydrogen 3.105 N/A ARG 249.A NE ALA 243.A O no hydrogen 2.850 N/A ARG 249.A NH1 GLU 183.A OE2 no hydrogen 2.757 N/A ARG 249.A NH1 SER 194.A O no hydrogen 3.006 N/A ARG 249.A NH2 GLU 183.A OE1 no hydrogen 2.804 N/A ARG 249.A NH2 GLU 183.A OE2 no hydrogen 3.560 N/A ARG 249.A NH2 ALA 243.A O no hydrogen 3.163 N/A THR 251.A N GLU 254.A OE1 no hydrogen 2.893 N/A THR 251.A OG1 GLU 254.A OE1 no hydrogen 3.407 N/A GLU 254.A N THR 251.A OG1 no hydrogen 3.029 N/A ILE 255.A N THR 251.A O no hydrogen 2.950 N/A GLN 256.A N PHE 252.A O no hydrogen 2.985 N/A GLN 256.A NE2 GLU 125.A OE2 no hydrogen 2.802 N/A ASN 257.A N GLU 253.A O no hydrogen 2.944 N/A HIS 258.A N ILE 255.A O no hydrogen 3.026 N/A HIS 258.A NE2 HIS 236.A ND1 no hydrogen 2.842 N/A TRP 260.A N HIS 258.A ND1 no hydrogen 2.922 N/A TRP 260.A NE1 GLU 113.A OE1 no hydrogen 2.853 N/A MET 261.A N HIS 258.A O no hydrogen 2.951 N/A GLN 262.A N PRO 259.A O no hydrogen 3.329 N/A GLN 262.A NE2 GLN 256.A O no hydrogen 2.984 N/A GLN 262.A NE2 HIS 258.A O no hydrogen 2.832 N/A LEU 266.A N GLU 269.A OE1 no hydrogen 3.003 N/A GLN 268.A NE2 GLU 272.A OE2 no hydrogen 3.486 N/A THR 270.A N LEU 266.A O no hydrogen 2.939 N/A THR 270.A OG1 SER 118.A OG no hydrogen 2.716 N/A THR 270.A OG1 LEU 266.A O no hydrogen 2.853 N/A ALA 271.A N PRO 267.A O no hydrogen 2.958 N/A GLU 272.A N GLN 268.A O no hydrogen 3.037 N/A ILE 273.A N GLU 269.A O no hydrogen 2.962 N/A HIS 274.A N THR 270.A O no hydrogen 2.870 N/A HIS 274.A NE2 GLU 114.A OE1 no hydrogen 2.803 N/A LEU 275.A N ALA 271.A O no hydrogen 2.906 N/A HIS 276.A N ALA 271.A O no hydrogen 2.906 N/A HIS 276.A NE2 ASN 150.A O no hydrogen 2.868 N/A