Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ker_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 10.A OG no hydrogen 2.482 N/A ILE 3.A N ILE 11.A O no hydrogen 2.866 N/A VAL 6.A N LEU 90.A O no hydrogen 2.907 N/A LYS 8.A NZ GLY 87.A O no hydrogen 2.652 N/A LYS 8.A NZ ILE 88.A O no hydrogen 3.334 N/A LYS 8.A NZ ASN 89.A OD1 no hydrogen 3.006 N/A SER 10.A OG ILE 3.A O no hydrogen 3.057 N/A ILE 11.A N ILE 3.A O no hydrogen 2.903 N/A LYS 14.A NZ ASP 15.A OD1 no hydrogen 2.826 N/A LYS 14.A NZ ASP 15.A OD2 no hydrogen 3.362 N/A ASP 15.A N GLU 12.A O no hydrogen 2.721 N/A ILE 16.A N SER 13.A O no hydrogen 2.922 N/A THR 19.A N PHE 304.A O no hydrogen 2.922 N/A THR 19.A OG1 GLY 17.A O no hydrogen 2.798 N/A LEU 20.A N THR 63.A O no hydrogen 3.025 N/A HIS 22.A N SER 253.A OG no hydrogen 3.148 N/A HIS 22.A NE2 HIS 24.A NE2 no hydrogen 2.943 N/A GLU 23.A N VAL 65.A O no hydrogen 3.034 N/A HIS 24.A N TYR 256.A O no hydrogen 2.993 N/A HIS 24.A ND1 THR 68.A OG1 no hydrogen 2.926 N/A HIS 24.A NE2 HIS 22.A NE2 no hydrogen 2.943 N/A LEU 25.A N ASP 66.A OD2 no hydrogen 2.955 N/A ARG 26.A NH2 GLU 42.A OE1 no hydrogen 3.227 N/A ARG 26.A NH2 GLU 45.A OE1 no hydrogen 2.668 N/A VAL 27.A N THR 259.A O no hydrogen 2.802 N/A PHE 28.A N LEU 72.A O no hydrogen 2.913 N/A SER 29.A N ASP 261.A OD2 no hydrogen 2.949 N/A SER 29.A OG ASP 261.A OD2 no hydrogen 3.551 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.555 N/A ARG 33.A N SER 29.A O no hydrogen 3.153 N/A ARG 33.A NH1 GLU 45.A OE1 no hydrogen 3.349 N/A ARG 33.A NH1 GLU 45.A OE2 no hydrogen 2.988 N/A ARG 33.A NH2 GLU 45.A OE1 no hydrogen 3.067 N/A GLN 34.A N GLU 30.A O no hydrogen 3.020 N/A GLN 35.A N ALA 31.A O no hydrogen 2.881 N/A TRP 36.A N VAL 32.A O no hydrogen 2.571 N/A LEU 39.A N TRP 36.A O no hydrogen 3.063 N/A TYR 40.A N PRO 37.A O no hydrogen 3.283 N/A TYR 40.A OH ASP 261.A OD2 no hydrogen 2.709 N/A GLU 44.A N ASN 41.A OD1 no hydrogen 3.176 N/A GLU 45.A N ASN 41.A O no hydrogen 3.046 N/A PHE 46.A N GLU 42.A O no hydrogen 3.091 N/A ARG 47.A N ASP 43.A O no hydrogen 3.088 N/A ASN 48.A N GLU 44.A O no hydrogen 2.991 N/A ALA 49.A N GLU 45.A O no hydrogen 3.062 N/A VAL 50.A N PHE 46.A O no hydrogen 2.883 N/A ASN 51.A N ARG 47.A O no hydrogen 2.854 N/A GLU 52.A N ASN 48.A O no hydrogen 3.024 N/A VAL 53.A N ALA 49.A O no hydrogen 3.103 N/A LYS 54.A N VAL 50.A O no hydrogen 3.067 N/A ARG 55.A N ASN 51.A O no hydrogen 3.039 N/A ARG 55.A NH1 GLU 52.A OE2 no hydrogen 3.077 N/A ARG 55.A NH2 GLU 52.A OE1 no hydrogen 2.570 N/A ARG 55.A NH2 GLU 52.A OE2 no hydrogen 3.214 N/A ALA 56.A N GLU 52.A O no hydrogen 2.945 N/A MET 57.A N VAL 53.A O no hydrogen 2.944 N/A GLN 58.A N LYS 54.A O no hydrogen 3.004 N/A PHE 59.A N ALA 56.A O no hydrogen 3.150 N/A GLY 60.A N MET 57.A O no hydrogen 2.955 N/A VAL 61.A N ALA 56.A O no hydrogen 3.028 N/A LYS 62.A N PHE 18.A O no hydrogen 2.827 N/A LYS 62.A NZ ASP 15.A O no hydrogen 2.742 N/A THR 63.A N PHE 18.A O no hydrogen 3.161 N/A THR 63.A OG1 ILE 16.A O no hydrogen 2.646 N/A ILE 64.A N ASN 89.A O no hydrogen 2.657 N/A VAL 65.A N LEU 20.A O no hydrogen 2.974 N/A ASP 66.A N VAL 91.A O no hydrogen 3.060 N/A THR 68.A N ASP 66.A OD1 no hydrogen 2.949 N/A THR 68.A OG1 HIS 24.A ND1 no hydrogen 2.926 N/A THR 68.A OG1 ASP 66.A OD1 no hydrogen 2.478 N/A GLY 71.A N GLU 30.A OE2 no hydrogen 2.741 N/A LEU 72.A N VAL 69.A O no hydrogen 2.649 N/A GLY 73.A N GLU 30.A OE2 no hydrogen 2.905 N/A ARG 74.A NH1 GLY 93.A O no hydrogen 2.786 N/A ARG 74.A NH1 ASP 121.A OD2 no hydrogen 2.992 N/A ARG 74.A NH2 ASP 121.A OD2 no hydrogen 2.927 N/A ARG 77.A NH1 GLN 127.A O no hydrogen 2.799 N/A ARG 77.A NH2 GLN 127.A O no hydrogen 3.568 N/A PHE 78.A N ASP 75.A OD2 no hydrogen 3.173 N/A MET 79.A N ASP 75.A O no hydrogen 3.007 N/A GLU 80.A N ILE 76.A O no hydrogen 2.627 N/A LYS 81.A N ARG 77.A O no hydrogen 3.067 N/A VAL 82.A N PHE 78.A O no hydrogen 3.256 N/A VAL 83.A N MET 79.A O no hydrogen 3.114 N/A LYS 84.A N GLU 80.A O no hydrogen 3.111 N/A LYS 84.A NZ GLU 80.A O no hydrogen 3.398 N/A ALA 85.A N LYS 81.A O no hydrogen 3.047 N/A ALA 85.A N VAL 82.A O no hydrogen 3.235 N/A THR 86.A N VAL 83.A O no hydrogen 3.043 N/A THR 86.A OG1 VAL 82.A O no hydrogen 2.948 N/A GLY 87.A N VAL 83.A O no hydrogen 2.646 N/A ILE 88.A N THR 86.A OG1 no hydrogen 3.352 N/A ASN 89.A N LYS 62.A O no hydrogen 3.321 N/A ASN 89.A ND2 THR 63.A OG1 no hydrogen 3.142 N/A VAL 91.A N ILE 64.A O no hydrogen 3.115 N/A THR 94.A N PHE 135.A O no hydrogen 3.019 N/A THR 94.A OG1 ASP 121.A OD2 no hydrogen 2.554 N/A TYR 97.A N MET 70.A O no hydrogen 2.914 N/A TYR 97.A OH TYR 99.A OH no hydrogen 2.528 N/A TYR 99.A OH TYR 97.A OH no hydrogen 2.528 N/A TYR 99.A OH HIS 169.A NE2 no hydrogen 3.066 N/A LEU 102.A N ASP 147.A OD1 no hydrogen 2.654 N/A PHE 106.A N PRO 103.A O no hydrogen 3.081 N/A LEU 107.A N PHE 104.A O.A no hydrogen 3.059 N/A LEU 107.A N PHE 104.A O.B no hydrogen 3.381 N/A ARG 109.A N PHE 106.A O no hydrogen 2.927 N/A ARG 109.A NE TYR 105.A O no hydrogen 3.076 N/A ARG 109.A NH2 GLU 113.A OE2 no hydrogen 2.962 N/A GLU 113.A N SER 110.A OG no hydrogen 3.157 N/A ILE 114.A N SER 110.A O no hydrogen 3.405 N/A ALA 115.A N ILE 111.A O no hydrogen 2.963 N/A ASP 116.A N ASP 112.A O no hydrogen 2.814 N/A LEU 117.A N ILE 114.A O no hydrogen 3.004 N/A PHE 118.A N ILE 114.A O no hydrogen 3.409 N/A ILE 119.A N ALA 115.A O no hydrogen 2.847 N/A HIS 120.A N ASP 116.A O no hydrogen 2.922 N/A ASP 121.A N LEU 117.A O no hydrogen 3.165 N/A ILE 122.A N PHE 118.A O no hydrogen 3.006 N/A LYS 123.A N ILE 119.A O no hydrogen 2.702 N/A GLU 124.A N HIS 120.A O no hydrogen 2.736 N/A GLY 125.A N HIS 120.A O no hydrogen 3.092 N/A ILE 126.A N ASN 131.A O no hydrogen 2.709 N/A THR 129.A N ILE 126.A O no hydrogen 2.638 N/A THR 129.A OG1 ILE 126.A O no hydrogen 2.738 N/A THR 129.A OG1 ASN 131.A OD1 no hydrogen 3.235 N/A ASN 131.A N THR 129.A OG1 no hydrogen 3.161 N/A LYS 132.A NZ LEU 130.A O no hydrogen 3.277 N/A ALA 133.A N ASP 121.A O no hydrogen 3.054 N/A GLY 134.A N ALA 92.A O no hydrogen 2.840 N/A VAL 136.A N PRO 165.A O no hydrogen 3.094 N/A ALA 139.A N HIS 169.A O no hydrogen 2.982 N/A GLU 141.A N ASP 140.A OD1 no hydrogen 2.654 N/A GLY 143.A N ASP 140.A O no hydrogen 2.817 N/A THR 145.A OG1 ILE 100.A O no hydrogen 2.720 N/A VAL 148.A N THR 145.A OG1 no hydrogen 3.229 N/A GLU 149.A N THR 145.A O no hydrogen 2.920 N/A LYS 150.A N LYS 146.A O no hydrogen 3.073 N/A VAL 151.A N ASP 147.A O no hydrogen 2.960 N/A ILE 152.A N VAL 148.A O no hydrogen 3.082 N/A ARG 153.A N GLU 149.A O no hydrogen 2.860 N/A ARG 153.A NE GLU 149.A OE1 no hydrogen 3.030 N/A ARG 153.A NH1 GLU 149.A OE1 no hydrogen 3.039 N/A ALA 154.A N LYS 150.A O no hydrogen 2.923 N/A ALA 155.A N VAL 151.A O no hydrogen 2.919 N/A ALA 156.A N ILE 152.A O no hydrogen 3.192 N/A ILE 157.A N ARG 153.A O no hydrogen 3.023 N/A ALA 158.A N ALA 154.A O no hydrogen 3.022 N/A ASN 159.A N ALA 155.A O no hydrogen 2.858 N/A ASN 159.A ND2 VAL 164.A O no hydrogen 2.751 N/A LYS 160.A N ALA 156.A O no hydrogen 3.023 N/A LYS 160.A NZ GLU 187.A O no hydrogen 2.933 N/A GLU 161.A N ILE 157.A O no hydrogen 3.150 N/A GLU 161.A N ALA 158.A O no hydrogen 3.161 N/A THR 162.A N ALA 158.A O no hydrogen 2.822 N/A THR 162.A OG1 ALA 158.A O no hydrogen 2.719 N/A LYS 163.A N ASN 159.A O no hydrogen 2.560 N/A ILE 166.A N LYS 193.A O no hydrogen 2.684 N/A ILE 167.A N VAL 136.A O no hydrogen 3.035 N/A THR 168.A N LEU 195.A O no hydrogen 2.960 N/A THR 168.A OG1 GLN 180.A OE1 no hydrogen 2.736 N/A THR 168.A OG1 LEU 195.A O no hydrogen 3.552 N/A HIS 169.A N ILE 137.A O no hydrogen 2.848 N/A HIS 169.A NE2 ASP 140.A OD2 no hydrogen 2.800 N/A SER 170.A OG GLY 197.A O no hydrogen 2.862 N/A ASN 171.A N THR 176.A OG1 no hydrogen 3.035 N/A ASN 171.A ND2 ASP 140.A OD1 no hydrogen 2.889 N/A HIS 173.A N ASN 171.A OD1 no hydrogen 2.949 N/A ASN 174.A N ASN 171.A O no hydrogen 3.450 N/A ASN 174.A ND2 ASP 140.A O no hydrogen 2.874 N/A ASN 174.A ND2 GLU 141.A O no hydrogen 3.369 N/A THR 176.A N ASN 174.A OD1 no hydrogen 3.125 N/A THR 176.A OG1 ASN 171.A O no hydrogen 3.213 N/A THR 176.A OG1 ASN 174.A OD1 no hydrogen 2.751 N/A LEU 178.A N TYR 207.A OH no hydrogen 3.278 N/A GLU 179.A N ASN 175.A O no hydrogen 2.937 N/A GLN 180.A N THR 176.A O no hydrogen 2.797 N/A GLN 180.A NE2 HIS 169.A O no hydrogen 2.931 N/A GLN 181.A N GLY 177.A O no hydrogen 3.012 N/A GLN 181.A NE2 ILE 211.A O no hydrogen 2.924 N/A GLN 181.A NE2 SER 216.A OG no hydrogen 2.874 N/A ARG 182.A N LEU 178.A O no hydrogen 2.931 N/A ARG 182.A NE GLU 179.A OE1 no hydrogen 2.999 N/A ARG 182.A NE GLU 179.A OE2 no hydrogen 3.561 N/A ARG 182.A NH1 GLU 179.A OE1 no hydrogen 2.734 N/A ARG 182.A NH2 GLU 186.A OE1 no hydrogen 3.438 N/A ILE 183.A N GLU 179.A O no hydrogen 2.989 N/A LEU 184.A N GLN 180.A O no hydrogen 2.989 N/A THR 185.A N GLN 181.A O no hydrogen 2.986 N/A THR 185.A OG1 GLN 181.A O no hydrogen 2.635 N/A THR 185.A OG1 ARG 182.A O no hydrogen 3.183 N/A GLU 186.A N ARG 182.A O no hydrogen 3.072 N/A GLU 187.A N ILE 183.A O no hydrogen 3.145 N/A GLY 188.A N THR 185.A O no hydrogen 3.316 N/A VAL 189.A N LEU 184.A O no hydrogen 3.119 N/A GLY 192.A N ASP 190.A OD1 no hydrogen 2.877 N/A LYS 193.A N ASP 190.A O no hydrogen 2.683 N/A LYS 193.A NZ LYS 163.A O no hydrogen 3.189 N/A LYS 193.A NZ PHE 311.A O no hydrogen 3.305 N/A LYS 193.A NZ SER 313.A O no hydrogen 2.614 N/A ILE 194.A N PRO 191.A O no hydrogen 3.149 N/A LEU 195.A N ILE 166.A O no hydrogen 2.724 N/A ILE 196.A N PHE 217.A O no hydrogen 3.012 N/A GLY 197.A N THR 168.A OG1 no hydrogen 3.217 N/A HIS 198.A N ASP 221.A OD1 no hydrogen 2.957 N/A HIS 198.A ND1 ASP 221.A OD2 no hydrogen 2.792 N/A HIS 198.A NE2 HIS 169.A ND1 no hydrogen 2.748 N/A GLY 200.A N GLY 219.A O no hydrogen 3.077 N/A ASP 201.A N HIS 198.A O no hydrogen 3.320 N/A THR 202.A N LEU 199.A O no hydrogen 3.427 N/A ASN 204.A N THR 202.A OG1 no hydrogen 3.063 N/A TYR 207.A N ASN 204.A OD1 no hydrogen 3.232 N/A ILE 208.A N ASN 204.A O no hydrogen 3.371 N/A LYS 209.A N ILE 205.A O no hydrogen 2.906 N/A LYS 209.A NZ ASP 244.A OD1 no hydrogen 2.641 N/A LYS 210.A N ASP 206.A O no hydrogen 2.826 N/A ILE 211.A N TYR 207.A O no hydrogen 3.260 N/A ALA 212.A N ILE 208.A O no hydrogen 3.119 N/A ASP 213.A N LYS 209.A O no hydrogen 2.754 N/A GLY 215.A N ALA 212.A O no hydrogen 2.783 N/A SER 216.A OG PRO 191.A O no hydrogen 2.850 N/A PHE 217.A N ILE 194.A O no hydrogen 3.101 N/A ILE 218.A N LYS 249.A O no hydrogen 2.768 N/A GLY 219.A N ILE 196.A O no hydrogen 2.826 N/A LEU 220.A N MET 251.A O no hydrogen 2.951 N/A ARG 222.A NE ASP 255.A OD2 no hydrogen 2.980 N/A ARG 222.A NH1 ASP 201.A OD2 no hydrogen 3.044 N/A ARG 222.A NH2 ASP 255.A OD2 no hydrogen 3.557 N/A TYR 223.A N SER 253.A O no hydrogen 3.321 N/A TYR 223.A OH ASN 235.A OD1 no hydrogen 3.017 N/A TYR 223.A OH THR 238.A OG1 no hydrogen 2.478 N/A LEU 225.A N ARG 222.A O no hydrogen 3.042 N/A LEU 227.A N LEU 273.A O no hydrogen 2.921 N/A PHE 228.A N LEU 225.A O no hydrogen 3.253 N/A LEU 229.A N LEU 225.A O no hydrogen 3.374 N/A ARG 234.A N PRO 230.A O no hydrogen 3.156 N/A ARG 234.A NE LEU 229.A O no hydrogen 2.850 N/A ARG 234.A NH1 ASP 201.A OD1 no hydrogen 2.846 N/A ARG 234.A NH2 ASP 201.A OD1 no hydrogen 3.348 N/A ASN 235.A N VAL 231.A O no hydrogen 2.826 N/A ASN 235.A ND2 ASP 285.A OD1 no hydrogen 3.113 N/A GLU 236.A N ASP 232.A O no hydrogen 2.861 N/A THR 237.A N LYS 233.A O no hydrogen 3.112 N/A THR 237.A OG1 LYS 233.A O no hydrogen 2.870 N/A THR 238.A N ARG 234.A O no hydrogen 2.755 N/A THR 238.A OG1 TYR 223.A OH no hydrogen 2.478 N/A THR 238.A OG1 ARG 234.A O no hydrogen 2.615 N/A LEU 239.A N ASN 235.A O no hydrogen 2.839 N/A ARG 240.A N GLU 236.A O no hydrogen 2.943 N/A ARG 240.A NE ASP 244.A OD2 no hydrogen 3.150 N/A LEU 241.A N THR 237.A O no hydrogen 2.934 N/A ILE 242.A N THR 238.A O no hydrogen 2.985 N/A LYS 243.A N LEU 239.A O no hydrogen 2.806 N/A ASP 244.A N ARG 240.A O no hydrogen 2.853 N/A GLY 245.A N ILE 242.A O no hydrogen 2.843 N/A TYR 246.A N LEU 241.A O no hydrogen 2.959 N/A TYR 246.A OH ASP 213.A OD1 no hydrogen 2.870 N/A LYS 249.A N TYR 246.A O no hydrogen 3.070 N/A ILE 250.A N SER 247.A O no hydrogen 3.356 N/A MET 251.A N ILE 218.A O no hydrogen 3.113 N/A SER 253.A N LEU 220.A O no hydrogen 3.355 N/A SER 253.A OG HIS 22.A O no hydrogen 2.990 N/A SER 253.A OG GLU 23.A OE1 no hydrogen 2.463 N/A HIS 254.A N GLU 23.A OE1 no hydrogen 2.741 N/A HIS 254.A ND1 GLU 23.A OE1 no hydrogen 2.912 N/A ASP 255.A N HIS 22.A O no hydrogen 2.859 N/A TYR 256.A N GLU 23.A OE2 no hydrogen 3.012 N/A CYS 257.A SG ASP 255.A O no hydrogen 3.915 N/A CYS 258.A N HIS 24.A O no hydrogen 3.322 N/A CYS 258.A SG HIS 24.A O no hydrogen 3.519 N/A THR 259.A OG1 CYS 258.A O no hydrogen 2.688 N/A ASP 261.A N VAL 27.A O no hydrogen 3.194 N/A ALA 265.A N VAL 262.A O no hydrogen 2.905 N/A GLU 268.A N GLU 268.A OE1 no hydrogen 2.613 N/A TYR 269.A N LYS 266.A O no hydrogen 2.927 N/A LYS 270.A N PRO 267.A O no hydrogen 2.841 N/A LYS 270.A NZ ALA 274.A O no hydrogen 3.084 N/A LYS 270.A NZ PRO 275.A O no hydrogen 2.892 N/A LYS 270.A NZ TRP 277.A O no hydrogen 3.173 N/A ARG 276.A NH2 ASP 285.A OD2 no hydrogen 2.835 N/A TRP 277.A N ALA 274.A O no hydrogen 3.339 N/A TRP 277.A NE1 HIS 254.A O no hydrogen 3.204 N/A ILE 279.A N GLU 52.A OE2 no hydrogen 3.454 N/A THR 280.A N SER 278.A OG no hydrogen 3.304 N/A THR 280.A OG1 GLU 284.A OE2 no hydrogen 2.707 N/A ILE 282.A N HIS 254.A NE2 no hydrogen 2.892 N/A PHE 283.A N THR 280.A O no hydrogen 2.922 N/A GLU 284.A N THR 280.A O no hydrogen 3.124 N/A ASP 285.A N LEU 281.A O no hydrogen 2.820 N/A THR 286.A OG1 ASN 235.A OD1 no hydrogen 3.361 N/A ILE 287.A N ILE 282.A O no hydrogen 2.931 N/A PHE 289.A N ASP 285.A O no hydrogen 2.921 N/A LEU 290.A N THR 286.A O no hydrogen 2.900 N/A LYS 291.A N ILE 287.A O no hydrogen 2.781 N/A ARG 292.A N PRO 288.A O no hydrogen 2.982 N/A ASN 293.A N LEU 290.A O no hydrogen 3.104 N/A GLY 294.A N LYS 291.A O no hydrogen 3.284 N/A GLU 298.A N ASN 296.A OD1 no hydrogen 3.364 N/A VAL 299.A N ASN 296.A O no hydrogen 3.304 N/A ALA 301.A N GLU 297.A O no hydrogen 2.977 N/A THR 302.A N GLU 298.A O no hydrogen 3.077 N/A THR 302.A OG1 GLU 298.A O no hydrogen 2.958 N/A ILE 303.A N VAL 299.A O no hydrogen 3.099 N/A PHE 304.A N ILE 300.A O no hydrogen 3.003 N/A LYS 305.A N ALA 301.A O no hydrogen 2.741 N/A GLU 306.A N ALA 301.A O no hydrogen 3.105 N/A ASN 307.A N THR 302.A O no hydrogen 2.771 N/A ASN 307.A ND2 SER 247.A O no hydrogen 2.795 N/A ASN 307.A ND2 ILE 250.A O no hydrogen 2.460 N/A LYS 309.A N LYS 305.A O no hydrogen 3.012 N/A LYS 310.A N GLU 306.A O no hydrogen 2.821 N/A LYS 310.A NZ ASP 248.A O no hydrogen 3.175 N/A LYS 310.A NZ ASN 307.A OD1 no hydrogen 3.220 N/A PHE 311.A N ASN 307.A O no hydrogen 2.840 N/A PHE 312.A N PRO 308.A O no hydrogen 3.072 N/A PHE 312.A N LYS 309.A O no hydrogen 3.240 N/A SER 313.A N LYS 310.A O no hydrogen 3.199 N/A SER 313.A OG LYS 309.A O no hydrogen 2.779 N/A SER 313.A OG LYS 310.A O no hydrogen 3.351 N/A