Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ckb_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N MET 1.A O no hydrogen 3.275 N/A LYS 6.A N ASP 2.A O no hydrogen 3.231 N/A ASN 7.A N GLU 3.A O no hydrogen 3.180 N/A ILE 8.A N ILE 4.A O no hydrogen 2.989 N/A ARG 9.A N VAL 5.A O no hydrogen 2.818 N/A ARG 9.A NE LEU 282.A O no hydrogen 3.469 N/A ARG 9.A NH2 LEU 282.A O no hydrogen 3.144 N/A ARG 9.A NH2 LEU 284.A OXT no hydrogen 2.935 N/A GLU 10.A N LYS 6.A O no hydrogen 2.665 N/A GLY 11.A N ASN 7.A O no hydrogen 2.772 N/A THR 12.A N LYS 180.A O no hydrogen 3.120 N/A VAL 14.A N LEU 178.A O no hydrogen 2.692 N/A LEU 16.A N VAL 176.A O no hydrogen 2.981 N/A TYR 19.A N CYS 170.A O no hydrogen 2.921 N/A TYR 19.A OH GLU 237.A OE2 no hydrogen 3.019 N/A ASN 26.A N ILE 229.A O no hydrogen 2.616 N/A LEU 27.A N HIS 209.A NE2 no hydrogen 3.431 N/A SER 28.A N SER 228.A O no hydrogen 3.194 N/A SER 28.A OG SER 228.A OG no hydrogen 3.197 N/A GLY 30.A N GLN 226.A O no hydrogen 2.798 N/A TYR 39.A N SER 36.A OG no hydrogen 3.175 N/A TYR 39.A OH ASP 164.A OD1 no hydrogen 2.498 N/A GLY 40.A N LEU 37.A O no hydrogen 2.985 N/A ALA 41.A N SER 36.A O no hydrogen 3.063 N/A ASN 42.A N GLN 46.A OE1 no hydrogen 3.122 N/A LEU 45.A N ASN 42.A OD1 no hydrogen 2.962 N/A GLN 46.A N ASN 42.A O no hydrogen 2.844 N/A GLN 46.A NE2 GLY 40.A O no hydrogen 3.094 N/A ILE 47.A N TYR 43.A O no hydrogen 2.948 N/A SER 48.A N TYR 43.A O no hydrogen 2.697 N/A SER 48.A OG PHE 44.A O no hydrogen 2.795 N/A ASN 51.A N ILE 47.A O no hydrogen 2.789 N/A ASP 52.A N SER 48.A O no hydrogen 3.145 N/A LEU 53.A N ARG 49.A O no hydrogen 3.114 N/A ASN 54.A N VAL 50.A O no hydrogen 2.784 N/A ASN 54.A ND2 GLU 122.A O no hydrogen 2.902 N/A ARG 55.A N ASP 52.A O no hydrogen 3.339 N/A ARG 55.A NH2 ASN 51.A OD1 no hydrogen 3.492 N/A MET 56.A N LEU 53.A O no hydrogen 3.185 N/A THR 58.A N ARG 114.A O no hydrogen 2.857 N/A THR 58.A OG1 ARG 114.A O no hydrogen 2.885 N/A MET 60.A N PRO 57.A O no hydrogen 3.033 N/A LEU 61.A N PRO 57.A O no hydrogen 3.162 N/A LYS 62.A N THR 58.A O no hydrogen 2.834 N/A LEU 63.A N ASP 59.A O no hydrogen 3.438 N/A PHE 64.A N MET 60.A O no hydrogen 2.899 N/A THR 65.A N LEU 61.A O no hydrogen 2.765 N/A THR 65.A N LYS 62.A O no hydrogen 3.336 N/A THR 65.A OG1 LEU 61.A O no hydrogen 2.714 N/A THR 65.A OG1 LYS 62.A O no hydrogen 3.464 N/A HIS 66.A N LYS 62.A O no hydrogen 2.682 N/A ILE 68.A N THR 65.A O no hydrogen 2.861 N/A GLU 72.A N ASN 107.A OD1 no hydrogen 2.838 N/A SER 73.A N SER 183.A O no hydrogen 2.910 N/A ASP 74.A N ASP 74.A OD1 no hydrogen 2.671 N/A VAL 78.A N ASP 74.A O no hydrogen 2.955 N/A TYR 79.A N LEU 75.A O no hydrogen 3.034 N/A GLU 80.A N ASP 76.A O no hydrogen 3.063 N/A ILE 81.A N LYS 77.A O no hydrogen 2.922 N/A LEU 82.A N VAL 78.A O no hydrogen 2.857 N/A LYS 83.A N GLU 80.A O no hydrogen 3.097 N/A ILE 84.A N TYR 79.A O no hydrogen 2.893 N/A ASN 85.A N ASP 97.A OD2 no hydrogen 2.775 N/A LYS 88.A N ALA 98.A O no hydrogen 3.190 N/A LYS 88.A NZ GLY 91.A O no hydrogen 2.832 N/A LYS 88.A NZ THR 94.A O no hydrogen 2.979 N/A LYS 88.A NZ ASP 143.A O no hydrogen 2.962 N/A LYS 88.A NZ GLU 147.A OE2 no hydrogen 3.500 N/A ARG 92.A NH1 PHE 142.A O no hydrogen 2.983 N/A ALA 96.A N GLU 147.A OE2 no hydrogen 3.496 N/A ASP 97.A N SER 86.A O no hydrogen 2.822 N/A VAL 99.A N TYR 149.A O no hydrogen 2.892 N/A VAL 100.A N LYS 88.A O no hydrogen 2.756 N/A ALA 101.A N ILE 151.A O no hydrogen 3.064 N/A LEU 103.A N LYS 153.A O no hydrogen 3.044 N/A SER 104.A N ASP 102.A OD1 no hydrogen 3.190 N/A SER 104.A OG ASP 102.A OD1 no hydrogen 2.782 N/A ASN 107.A N GLU 72.A OE2 no hydrogen 2.849 N/A LYS 108.A N ALA 105.A O no hydrogen 3.123 N/A LYS 111.A N ASN 124.A O no hydrogen 2.591 N/A LYS 111.A NZ ASN 123.A O no hydrogen 2.730 N/A LYS 111.A NZ LEU 125.A O no hydrogen 2.994 N/A LYS 111.A NZ ASP 129.A OD2 no hydrogen 2.693 N/A ARG 112.A N ASN 124.A OD1 no hydrogen 2.896 N/A ARG 114.A N THR 58.A OG1 no hydrogen 3.109 N/A ARG 114.A NH1 GLU 122.A O no hydrogen 3.125 N/A ARG 114.A NH2 ASN 54.A O no hydrogen 2.646 N/A ILE 117.A N ARG 55.A O no hydrogen 3.065 N/A ASN 123.A ND2 ILE 127.A O no hydrogen 2.804 N/A ASN 124.A N ASN 54.A OD1 no hydrogen 2.928 N/A ASN 124.A ND2 ARG 112.A O no hydrogen 2.769 N/A LEU 125.A N ASN 123.A OD1 no hydrogen 3.153 N/A TYR 126.A N LEU 109.A O no hydrogen 2.992 N/A SER 128.A N ASP 189.A OD1 no hydrogen 3.145 N/A SER 128.A N ASP 189.A OD2 no hydrogen 3.165 N/A SER 128.A OG GLN 46.A O no hydrogen 2.644 N/A LYS 131.A N ASP 129.A OD1 no hydrogen 3.040 N/A MET 132.A N ASP 129.A O no hydrogen 3.058 N/A LEU 133.A N TYR 130.A O no hydrogen 3.396 N/A THR 134.A N MET 132.A O no hydrogen 2.939 N/A THR 134.A OG1 ASP 136.A OD1 no hydrogen 3.046 N/A PHE 135.A N VAL 225.A O no hydrogen 2.796 N/A VAL 137.A N THR 134.A O no hydrogen 3.358 N/A PHE 138.A N PHE 135.A O no hydrogen 3.197 N/A ARG 139.A N ASP 136.A O no hydrogen 2.674 N/A LEU 141.A N PHE 138.A O no hydrogen 3.121 N/A PHE 142.A N ARG 139.A O no hydrogen 2.995 N/A ASP 143.A N PRO 140.A O no hydrogen 3.054 N/A PHE 144.A N LEU 141.A O no hydrogen 3.361 N/A VAL 145.A N GLU 147.A OE1 no hydrogen 2.818 N/A LYS 148.A N ASP 97.A O no hydrogen 2.869 N/A TYR 149.A N ASP 97.A O no hydrogen 3.338 N/A CYS 150.A N ALA 195.A O no hydrogen 2.864 N/A ILE 151.A N VAL 99.A O no hydrogen 2.874 N/A ILE 152.A N MET 193.A O no hydrogen 3.040 N/A LYS 153.A N ALA 101.A O no hydrogen 2.792 N/A LYS 153.A NZ ASP 74.A OD1 no hydrogen 2.759 N/A LYS 153.A NZ ASP 74.A OD2 no hydrogen 2.825 N/A LYS 153.A NZ ASP 184.A OD1 no hydrogen 2.585 N/A LEU 154.A N ALA 191.A O no hydrogen 2.663 N/A THR 156.A OG1 ASP 189.A OD2 no hydrogen 2.449 N/A LEU 157.A N ASP 189.A OD2 no hydrogen 3.281 N/A PHE 158.A N THR 156.A OG1 no hydrogen 3.058 N/A ARG 160.A NE ASP 164.A OD2 no hydrogen 3.121 N/A ARG 160.A NH2 ASP 164.A OD2 no hydrogen 3.441 N/A ASP 164.A N ARG 160.A O no hydrogen 3.027 N/A THR 165.A N GLY 161.A O no hydrogen 2.938 N/A THR 165.A OG1 GLY 161.A O no hydrogen 2.945 N/A MET 166.A N VAL 162.A O no hydrogen 2.822 N/A ARG 167.A N ILE 163.A O no hydrogen 2.775 N/A ARG 167.A NH1 THR 21.A O no hydrogen 3.209 N/A ILE 168.A N ASP 164.A O no hydrogen 3.106 N/A TYR 169.A N THR 165.A O no hydrogen 3.023 N/A TYR 169.A OH VAL 137.A O no hydrogen 2.429 N/A CYS 170.A N MET 166.A O no hydrogen 2.960 N/A CYS 170.A SG PRO 17.A O no hydrogen 3.420 N/A CYS 170.A SG MET 166.A O no hydrogen 3.323 N/A SER 171.A N ILE 168.A O no hydrogen 2.869 N/A SER 171.A OG TYR 19.A O no hydrogen 2.701 N/A SER 171.A OG THR 21.A O no hydrogen 3.395 N/A LEU 172.A N ILE 168.A O no hydrogen 3.106 N/A PHE 173.A N TYR 169.A O no hydrogen 3.097 N/A LYS 174.A N ASP 197.A O no hydrogen 2.762 N/A ARG 177.A N VAL 194.A O no hydrogen 3.083 N/A ARG 177.A NE ASN 175.A OD1 no hydrogen 2.987 N/A ARG 177.A NH2 ASN 175.A OD1 no hydrogen 2.856 N/A LEU 178.A N VAL 14.A O no hydrogen 2.848 N/A LEU 179.A N ILE 192.A O no hydrogen 2.930 N/A LYS 180.A N THR 12.A O no hydrogen 2.924 N/A LYS 180.A NZ ASP 184.A OD2 no hydrogen 3.076 N/A LYS 180.A NZ SER 185.A O no hydrogen 2.881 N/A LYS 180.A NZ LYS 188.A O no hydrogen 2.841 N/A LYS 180.A NZ SER 190.A O no hydrogen 2.716 N/A ASP 184.A N CYS 181.A O no hydrogen 2.964 N/A SER 185.A N ASP 184.A OD1 no hydrogen 2.676 N/A TRP 186.A NE1 CYS 181.A O no hydrogen 3.033 N/A LEU 187.A N SER 185.A OG no hydrogen 3.333 N/A LYS 188.A N SER 185.A O no hydrogen 3.494 N/A LYS 188.A NZ GLU 72.A OE1 no hydrogen 3.502 N/A LYS 188.A NZ GLU 72.A OE2 no hydrogen 2.637 N/A LYS 188.A NZ ALA 105.A O no hydrogen 3.176 N/A LYS 188.A NZ LYS 108.A O no hydrogen 3.088 N/A SER 190.A OG ASP 184.A OD1 no hydrogen 3.092 N/A SER 190.A OG ASP 184.A OD2 no hydrogen 2.729 N/A ALA 191.A N LEU 154.A O no hydrogen 3.236 N/A ILE 192.A N LEU 179.A O no hydrogen 2.836 N/A MET 193.A N ILE 152.A O no hydrogen 2.833 N/A VAL 194.A N ARG 177.A O no hydrogen 2.927 N/A ALA 195.A N CYS 150.A O no hydrogen 2.741 N/A SER 196.A N ASN 175.A O no hydrogen 2.846 N/A CYS 199.A N LEU 172.A O no hydrogen 2.781 N/A CYS 199.A SG GLU 20.A OE1 no hydrogen 3.900 N/A LYS 201.A NZ GLU 20.A OE2 no hydrogen 3.246 N/A ASN 202.A ND2 GLU 20.A O no hydrogen 2.634 N/A ASN 202.A ND2 SER 171.A O no hydrogen 2.926 N/A LEU 203.A N CYS 199.A O no hydrogen 2.986 N/A ASP 204.A N LYS 200.A O no hydrogen 2.737 N/A LEU 205.A N LYS 201.A O no hydrogen 2.981 N/A PHE 206.A N ASN 202.A O no hydrogen 2.913 N/A MET 207.A N LEU 203.A O no hydrogen 2.914 N/A SER 208.A N ASP 204.A O no hydrogen 3.029 N/A SER 208.A OG ASP 204.A O no hydrogen 2.727 N/A SER 208.A OG LEU 205.A O no hydrogen 3.159 N/A HIS 209.A N LEU 205.A O no hydrogen 3.147 N/A VAL 210.A N PHE 206.A O no hydrogen 2.808 N/A LYS 211.A N MET 207.A O no hydrogen 2.666 N/A SER 212.A N SER 208.A O no hydrogen 3.344 N/A VAL 213.A N HIS 209.A O no hydrogen 3.084 N/A THR 214.A N VAL 210.A O no hydrogen 2.873 N/A THR 214.A OG1 VAL 210.A O no hydrogen 2.996 N/A THR 214.A OG1 LYS 211.A O no hydrogen 3.421 N/A THR 214.A OG1 SER 216.A O no hydrogen 3.346 N/A LYS 215.A N SER 212.A O no hydrogen 3.260 N/A SER 216.A N LYS 211.A O no hydrogen 3.271 N/A SER 216.A OG SER 218.A O no hydrogen 3.134 N/A SER 218.A OG TRP 219.A O no hydrogen 3.524 N/A TRP 219.A NE1 ASP 221.A OD1 no hydrogen 3.152 N/A ASN 223.A N LYS 220.A O no hydrogen 3.127 N/A SER 224.A N ASP 221.A O no hydrogen 2.958 N/A SER 224.A OG ASP 136.A OD1 no hydrogen 2.935 N/A SER 224.A OG ASP 221.A O no hydrogen 3.299 N/A VAL 225.A N ASN 223.A O no hydrogen 2.674 N/A GLN 226.A NE2 SER 32.A OG no hydrogen 2.881 N/A SER 228.A N SER 28.A O no hydrogen 2.940 N/A SER 228.A OG ASN 26.A O no hydrogen 3.565 N/A SER 228.A OG SER 28.A OG no hydrogen 3.197 N/A ASN 231.A N GLU 24.A O no hydrogen 3.400 N/A ASN 232.A ND2 GLU 24.A OE2 no hydrogen 3.122 N/A VAL 234.A N TYR 39.A OH no hydrogen 2.964 N/A ILE 239.A N ASP 235.A O no hydrogen 3.169 N/A ASN 240.A N THR 236.A O no hydrogen 2.874 N/A LYS 241.A N GLU 237.A O no hydrogen 3.023 N/A LYS 241.A N PHE 238.A O no hydrogen 3.110 N/A PHE 242.A N PHE 238.A O no hydrogen 3.021 N/A LEU 243.A N ILE 239.A O no hydrogen 2.840 N/A GLU 244.A N ASN 240.A O no hydrogen 3.109 N/A PHE 245.A N PHE 242.A O no hydrogen 3.197 N/A SER 246.A N PHE 242.A O no hydrogen 2.975 N/A SER 246.A OG PHE 242.A O no hydrogen 3.293 N/A SER 246.A OG LEU 243.A O no hydrogen 3.543 N/A ASN 247.A N LEU 243.A O no hydrogen 2.717 N/A ARG 248.A NH1 HIS 13.A O no hydrogen 3.136 N/A VAL 249.A N PHE 245.A O no hydrogen 3.305 N/A TYR 250.A N SER 246.A O no hydrogen 2.830 N/A TYR 250.A OH ASP 189.A OD2 no hydrogen 2.532 N/A GLU 251.A N ASN 247.A O no hydrogen 2.921 N/A ALA 252.A N ARG 248.A O no hydrogen 3.123 N/A LEU 253.A N VAL 249.A O no hydrogen 2.854 N/A TYR 254.A N TYR 250.A O no hydrogen 2.842 N/A TYR 255.A N GLU 251.A O no hydrogen 3.131 N/A VAL 256.A N ALA 252.A O no hydrogen 3.004 N/A HIS 257.A N LEU 253.A O no hydrogen 2.667 N/A HIS 257.A NE2 LEU 187.A O no hydrogen 2.778 N/A SER 258.A N TYR 254.A O no hydrogen 2.775 N/A SER 258.A OG TYR 254.A O no hydrogen 2.762 N/A LEU 259.A N TYR 255.A O no hydrogen 3.113 N/A LEU 260.A N VAL 256.A O no hydrogen 3.028 N/A TYR 261.A N HIS 257.A O no hydrogen 2.808 N/A SER 262.A N SER 258.A O no hydrogen 2.676 N/A SER 263.A N LEU 259.A O no hydrogen 2.776 N/A SER 263.A OG GLN 276.A OE1 no hydrogen 2.632 N/A MET 264.A N LEU 260.A O no hydrogen 2.968 N/A THR 265.A N TYR 261.A O no hydrogen 3.037 N/A THR 265.A OG1 TYR 261.A O no hydrogen 2.827 N/A SER 266.A N SER 262.A O no hydrogen 2.908 N/A SER 266.A N SER 263.A O no hydrogen 3.048 N/A SER 266.A OG SER 268.A OG no hydrogen 2.560 N/A SER 268.A N SER 266.A OG no hydrogen 3.157 N/A SER 268.A OG SER 266.A OG no hydrogen 2.560 N/A LYS 269.A N SER 266.A O no hydrogen 2.734 N/A SER 270.A N SER 268.A OG no hydrogen 3.311 N/A GLU 272.A N SER 270.A OG no hydrogen 2.851 N/A ASN 273.A N ILE 271.A O no hydrogen 2.881 N/A ASN 273.A ND2 SER 263.A OG no hydrogen 2.724 N/A ASN 273.A ND2 SER 270.A O no hydrogen 2.836 N/A HIS 275.A N ASN 273.A OD1 no hydrogen 3.029 N/A GLN 276.A N ASN 273.A OD1 no hydrogen 3.245 N/A GLN 276.A NE2 PHE 64.A O no hydrogen 2.921 N/A ARG 277.A N ASN 273.A O no hydrogen 3.159 N/A ARG 278.A N LYS 274.A O no hydrogen 3.275 N/A LEU 279.A N HIS 275.A O no hydrogen 3.032 N/A VAL 280.A N GLN 276.A O no hydrogen 2.991 N/A LYS 281.A N ARG 277.A O no hydrogen 3.005 N/A LEU 282.A N ARG 278.A O no hydrogen 2.865 N/A LEU 283.A N LEU 279.A O no hydrogen 2.961 N/A LEU 283.A N VAL 280.A O no hydrogen 3.268 N/A LEU 284.A N VAL 280.A O no hydrogen 2.865 N/A