Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1hqf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ GLY 86.A O no hydrogen 2.490 N/A ILE 3.A N ASN 41.A O no hydrogen 2.473 N/A GLU 4.A N ILE 88.A O no hydrogen 3.060 N/A ILE 5.A N ARG 43.A O no hydrogen 2.779 N/A ILE 6.A N VAL 90.A O no hydrogen 3.148 N/A GLY 7.A N GLY 46.A O no hydrogen 2.989 N/A ALA 8.A N LEU 92.A O no hydrogen 2.926 N/A SER 11.A OG GLU 20.A OE1 no hydrogen 3.280 N/A LYS 12.A NZ ASP 52.A OD2 no hydrogen 2.962 N/A GLN 14.A N SER 11.A O no hydrogen 3.056 N/A GLN 14.A NE2 ARG 16.A O no hydrogen 2.738 N/A GLY 18.A N GLU 20.A OE1 no hydrogen 3.370 N/A GLU 20.A N GLU 20.A OE1 no hydrogen 2.843 N/A LYS 21.A N GLY 18.A O no hydrogen 2.481 N/A GLY 22.A N VAL 19.A O no hydrogen 2.981 N/A ALA 25.A N LYS 21.A O no hydrogen 2.979 N/A ALA 25.A N GLY 22.A O no hydrogen 2.966 N/A LEU 26.A N GLY 22.A O no hydrogen 3.037 N/A ARG 27.A N PRO 23.A O no hydrogen 3.124 N/A ARG 27.A NE ASP 44.A OD1 no hydrogen 3.055 N/A ARG 27.A NE ASP 44.A OD2 no hydrogen 2.656 N/A ARG 27.A NH1 PRO 23.A O no hydrogen 3.361 N/A ARG 27.A NH1 ASP 47.A OD2 no hydrogen 3.450 N/A ARG 27.A NH2 ASP 44.A OD1 no hydrogen 3.060 N/A ALA 29.A N ALA 25.A O no hydrogen 2.792 N/A ALA 29.A N LEU 26.A O no hydrogen 3.133 N/A GLY 30.A N ARG 27.A O no hydrogen 2.628 N/A LEU 31.A N LEU 26.A O no hydrogen 3.170 N/A LYS 34.A N GLY 30.A O no hydrogen 3.301 N/A LEU 35.A N LEU 31.A O no hydrogen 3.172 N/A LYS 36.A N VAL 32.A O no hydrogen 3.065 N/A GLU 37.A N GLU 33.A O no hydrogen 3.073 N/A GLU 37.A N LYS 34.A O no hydrogen 2.880 N/A THR 38.A N LEU 35.A O no hydrogen 2.983 N/A THR 38.A OG1 LEU 35.A O no hydrogen 2.557 N/A TYR 40.A N THR 38.A OG1 no hydrogen 3.268 N/A ASN 41.A N LYS 1.A O no hydrogen 2.918 N/A ARG 43.A N ILE 3.A O no hydrogen 2.587 N/A ARG 43.A NE GLU 4.A OE1 no hydrogen 3.118 N/A ARG 43.A NH2 GLU 4.A OE1 no hydrogen 3.433 N/A HIS 45.A N ILE 5.A O no hydrogen 2.816 N/A GLY 46.A N ASP 44.A OD1 no hydrogen 2.807 N/A LEU 48.A N GLY 7.A O no hydrogen 3.114 N/A LYS 63.A N GLY 133.A O no hydrogen 3.046 N/A LYS 63.A NZ ILE 61.A O no hydrogen 2.902 N/A ARG 66.A N ASP 56.A OD1 no hydrogen 3.119 N/A ARG 66.A NH1 ASP 56.A OD1 no hydrogen 3.452 N/A ARG 66.A NH1 SER 57.A O no hydrogen 3.351 N/A SER 67.A N ASP 56.A OD2 no hydrogen 2.519 N/A SER 67.A OG ASP 56.A OD2 no hydrogen 2.700 N/A VAL 68.A N ASN 64.A O no hydrogen 3.239 N/A GLY 69.A N PRO 65.A O no hydrogen 2.817 N/A GLY 69.A N ARG 66.A O no hydrogen 3.165 N/A LYS 70.A N ARG 66.A O no hydrogen 2.923 N/A LYS 70.A NZ GLU 73.A OE1 no hydrogen 3.136 N/A ALA 71.A N SER 67.A O no hydrogen 2.823 N/A ASN 72.A N VAL 68.A O no hydrogen 3.383 N/A ASN 72.A ND2 VAL 68.A O no hydrogen 2.811 N/A ASN 72.A ND2 SER 97.A O no hydrogen 2.813 N/A GLN 74.A N LYS 70.A O no hydrogen 2.978 N/A GLN 74.A NE2 ALA 49.A O no hydrogen 3.434 N/A LEU 75.A N ALA 71.A O no hydrogen 3.296 N/A ALA 76.A N ASN 72.A O no hydrogen 3.168 N/A ALA 77.A N GLU 73.A O no hydrogen 3.459 N/A VAL 78.A N GLN 74.A O no hydrogen 3.458 N/A VAL 79.A N LEU 75.A O no hydrogen 2.972 N/A ALA 80.A N ALA 76.A O no hydrogen 2.859 N/A GLU 81.A N ALA 77.A O no hydrogen 2.815 N/A THR 82.A N VAL 78.A O no hydrogen 2.923 N/A THR 82.A OG1 GLU 4.A OE2 no hydrogen 2.795 N/A THR 82.A OG1 VAL 78.A O no hydrogen 2.934 N/A GLN 83.A N VAL 79.A O no hydrogen 2.795 N/A GLN 83.A NE2 SER 89.A OG no hydrogen 3.070 N/A GLN 83.A NE2 SER 266.A O no hydrogen 2.984 N/A LYS 84.A N ALA 80.A O no hydrogen 3.050 N/A ASN 85.A ND2 THR 82.A O no hydrogen 3.544 N/A GLY 86.A N THR 82.A O no hydrogen 3.177 N/A GLY 86.A N GLN 83.A O no hydrogen 3.239 N/A ILE 88.A N PRO 2.A O no hydrogen 2.881 N/A SER 89.A N SER 266.A O no hydrogen 3.115 N/A SER 89.A OG SER 266.A O no hydrogen 3.496 N/A VAL 90.A N GLU 4.A O no hydrogen 3.202 N/A VAL 91.A N LEU 268.A O no hydrogen 2.821 N/A LEU 92.A N ILE 6.A O no hydrogen 2.882 N/A GLY 93.A N ILE 270.A O no hydrogen 3.028 N/A HIS 96.A N GLU 272.A OE2 no hydrogen 2.732 N/A HIS 96.A ND1 ASP 119.A OD2 no hydrogen 2.791 N/A HIS 96.A NE2 SER 225.A OG no hydrogen 3.140 N/A SER 97.A N ASP 95.A OD1 no hydrogen 2.340 N/A SER 97.A OG ASP 95.A OD1 no hydrogen 2.457 N/A SER 97.A OG ASP 95.A OD2 no hydrogen 3.050 N/A MET 98.A N ASP 95.A O no hydrogen 3.471 N/A ALA 99.A N HIS 96.A O no hydrogen 3.344 N/A GLY 101.A N ASN 72.A OD1 no hydrogen 2.797 N/A SER 102.A N MET 98.A O no hydrogen 3.072 N/A SER 102.A OG ASP 269.A OD1 no hydrogen 2.987 N/A SER 102.A OG ASP 269.A OD2 no hydrogen 3.225 N/A ILE 103.A N ALA 99.A O no hydrogen 2.683 N/A SER 104.A N ILE 100.A O no hydrogen 2.685 N/A SER 104.A OG ILE 100.A O no hydrogen 3.198 N/A GLY 105.A N GLY 101.A O no hydrogen 2.894 N/A HIS 106.A N SER 102.A O no hydrogen 2.903 N/A HIS 106.A ND1 HIS 223.A ND1 no hydrogen 3.099 N/A ALA 107.A N ILE 103.A O no hydrogen 2.934 N/A ARG 108.A N SER 104.A O no hydrogen 3.199 N/A VAL 109.A N HIS 106.A O no hydrogen 3.105 N/A HIS 110.A N HIS 106.A O no hydrogen 3.031 N/A LEU 113.A N HIS 110.A O no hydrogen 3.319 N/A CYS 114.A N PRO 221.A O no hydrogen 3.192 N/A CYS 114.A SG PRO 221.A O no hydrogen 3.300 N/A VAL 115.A N ASP 168.A O no hydrogen 2.768 N/A ILE 116.A N HIS 223.A O no hydrogen 3.120 N/A TRP 117.A N VAL 170.A O no hydrogen 2.497 N/A VAL 118.A N SER 225.A O no hydrogen 3.238 N/A ASP 119.A N ILE 172.A O no hydrogen 3.266 N/A ALA 120.A N ASP 229.A OD1 no hydrogen 3.012 N/A HIS 121.A N ASP 119.A OD1 no hydrogen 2.618 N/A HIS 121.A ND1 ASP 119.A OD1 no hydrogen 2.896 N/A THR 122.A OG1 GLU 181.A OE2 no hydrogen 2.610 N/A ILE 124.A N GLU 181.A OE2 no hydrogen 2.899 N/A ASN 125.A N GLY 137.A O no hydrogen 3.261 N/A ASN 125.A ND2 ASP 178.A OD2 no hydrogen 3.380 N/A THR 126.A N THR 129.A OG1 no hydrogen 2.418 N/A THR 126.A OG1 THR 129.A OG1 no hydrogen 3.323 N/A THR 129.A N THR 126.A OG1 no hydrogen 3.253 N/A THR 129.A OG1 ASN 125.A OD1 no hydrogen 3.010 N/A THR 129.A OG1 THR 126.A O no hydrogen 2.737 N/A THR 129.A OG1 THR 126.A OG1 no hydrogen 3.323 N/A THR 130.A N THR 126.A O no hydrogen 2.916 N/A THR 130.A OG1 THR 126.A O no hydrogen 2.817 N/A HIS 136.A N GLY 13.A O no hydrogen 3.149 N/A GLY 137.A N ASN 134.A O no hydrogen 2.915 N/A GLN 138.A N LEU 135.A O no hydrogen 3.140 N/A ALA 141.A N GLN 138.A O no hydrogen 2.548 N/A LEU 143.A N VAL 140.A O no hydrogen 3.033 N/A LEU 144.A N VAL 140.A O no hydrogen 2.727 N/A LYS 145.A N ILE 164.A O no hydrogen 3.348 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.603 N/A LYS 148.A N LYS 145.A O no hydrogen 2.702 N/A LYS 150.A N LEU 147.A O no hydrogen 3.032 N/A PHE 157.A N VAL 154.A O no hydrogen 3.086 N/A TRP 159.A NE1 GLY 156.A O no hydrogen 2.542 N/A VAL 160.A N PHE 157.A O no hydrogen 2.970 N/A THR 161.A OG1 TRP 159.A O no hydrogen 3.537 N/A CYS 163.A SG LEU 143.A O no hydrogen 3.955 N/A ILE 164.A N LEU 143.A O no hydrogen 3.069 N/A SER 165.A OG ASP 168.A OD2 no hydrogen 3.392 N/A ALA 166.A N GLU 146.A OE2 no hydrogen 2.575 N/A LYS 167.A NZ GLY 189.A O no hydrogen 3.281 N/A ASP 168.A N SER 165.A O no hydrogen 3.219 N/A VAL 170.A N VAL 115.A O no hydrogen 2.643 N/A TYR 171.A N LYS 191.A O no hydrogen 3.434 N/A TYR 171.A OH THR 122.A O no hydrogen 2.399 N/A ILE 172.A N TRP 117.A O no hydrogen 2.788 N/A GLY 173.A N PHE 193.A O no hydrogen 3.370 N/A ARG 175.A N ALA 120.A O no hydrogen 2.769 N/A ARG 175.A NH1 LEU 231.A O no hydrogen 3.447 N/A ARG 175.A NH1 VAL 243.A O no hydrogen 2.278 N/A ARG 175.A NH2 LEU 231.A O no hydrogen 3.546 N/A ASP 176.A N ALA 120.A O no hydrogen 3.322 N/A ASP 178.A N GLU 181.A OE1 no hydrogen 3.376 N/A HIS 182.A N ASP 178.A O no hydrogen 2.882 N/A TYR 183.A N PRO 179.A O no hydrogen 3.030 N/A ILE 184.A N GLY 180.A O no hydrogen 3.016 N/A ILE 185.A N GLU 181.A O no hydrogen 2.955 N/A LYS 186.A N HIS 182.A O no hydrogen 3.038 N/A LYS 186.A NZ TYR 192.A OH no hydrogen 2.924 N/A THR 187.A N TYR 183.A O no hydrogen 2.796 N/A THR 187.A OG1 TYR 183.A O no hydrogen 3.177 N/A LEU 188.A N ILE 184.A O no hydrogen 2.807 N/A GLY 189.A N LYS 186.A O no hydrogen 2.936 N/A ILE 190.A N ILE 185.A O no hydrogen 2.845 N/A LYS 191.A NZ GLU 209.A OE1 no hydrogen 3.461 N/A SER 194.A OG GLU 197.A OE1 no hydrogen 2.684 N/A MET 195.A N LEU 174.A O no hydrogen 2.998 N/A THR 196.A OG1 GLU 197.A OE2 no hydrogen 3.276 N/A GLU 197.A N SER 194.A O no hydrogen 2.407 N/A VAL 198.A N SER 194.A O no hydrogen 2.915 N/A ASP 199.A N MET 195.A O no hydrogen 2.648 N/A LYS 200.A N THR 196.A O no hydrogen 2.857 N/A LEU 201.A N GLU 197.A O no hydrogen 2.892 N/A GLY 202.A N VAL 198.A O no hydrogen 2.753 N/A VAL 206.A N GLY 202.A O no hydrogen 3.113 N/A MET 207.A N ILE 203.A O no hydrogen 2.892 N/A GLU 208.A N GLY 204.A O no hydrogen 2.912 N/A GLU 209.A N LYS 205.A O no hydrogen 2.751 N/A THR 210.A N VAL 206.A O no hydrogen 3.208 N/A THR 210.A OG1 VAL 206.A O no hydrogen 2.810 N/A THR 210.A OG1 MET 207.A O no hydrogen 2.645 N/A PHE 211.A N MET 207.A O no hydrogen 3.049 N/A SER 212.A N GLU 208.A O no hydrogen 3.487 N/A SER 212.A OG GLU 209.A O no hydrogen 2.984 N/A TYR 213.A N GLU 209.A O no hydrogen 3.136 N/A LEU 214.A N THR 210.A O no hydrogen 3.227 N/A LEU 214.A N PHE 211.A O no hydrogen 2.639 N/A LEU 215.A N PHE 211.A O no hydrogen 2.578 N/A LYS 219.A NZ LEU 215.A O no hydrogen 3.337 N/A LYS 219.A NZ GLY 216.A O no hydrogen 3.181 N/A LYS 219.A NZ ARG 217.A O no hydrogen 3.462 N/A ARG 220.A NE LEU 214.A O no hydrogen 2.527 N/A ARG 220.A NH2 ASP 168.A OD1 no hydrogen 2.893 N/A ILE 222.A N LEU 264.A O no hydrogen 2.621 N/A HIS 223.A NE2 ASP 269.A OD2 no hydrogen 2.677 N/A LEU 224.A N GLY 267.A O no hydrogen 2.810 N/A SER 225.A N ILE 116.A O no hydrogen 2.968 N/A SER 225.A OG HIS 96.A NE2 no hydrogen 3.140 N/A SER 225.A OG ASP 269.A OD2 no hydrogen 3.020 N/A PHE 226.A N ASP 269.A O no hydrogen 2.536 N/A ASP 227.A N VAL 118.A O no hydrogen 2.638 N/A VAL 228.A N MET 271.A O no hydrogen 3.090 N/A ASP 229.A N ASP 227.A OD1 no hydrogen 2.907 N/A GLY 230.A N ASP 227.A O no hydrogen 2.523 N/A ASP 232.A N LEU 247.A O no hydrogen 2.629 N/A VAL 234.A N ASP 232.A OD1 no hydrogen 2.858 N/A PHE 235.A N ASP 232.A O no hydrogen 2.883 N/A THR 236.A N ASP 232.A O no hydrogen 3.239 N/A THR 236.A OG1 VAL 228.A O no hydrogen 2.722 N/A ALA 238.A N THR 287.A OG1 no hydrogen 2.797 N/A THR 239.A N PRO 237.A O no hydrogen 2.779 N/A THR 239.A OG1 THR 236.A O no hydrogen 2.874 N/A GLY 245.A N ASP 232.A OD2 no hydrogen 2.940 N/A GLY 246.A N ASP 232.A OD2 no hydrogen 3.377 N/A LEU 247.A N GLY 230.A O no hydrogen 3.181 N/A SER 248.A N GLU 251.A OE1 no hydrogen 3.025 N/A GLU 251.A N SER 248.A OG no hydrogen 3.018 N/A GLY 252.A N SER 248.A O no hydrogen 2.664 N/A LEU 253.A N TYR 249.A O no hydrogen 2.683 N/A TYR 254.A N ARG 250.A O no hydrogen 2.637 N/A ILE 255.A N GLU 251.A O no hydrogen 3.058 N/A THR 256.A N GLY 252.A O no hydrogen 3.357 N/A THR 256.A OG1 GLY 252.A O no hydrogen 3.494 N/A THR 256.A OG1 LEU 253.A O no hydrogen 3.216 N/A THR 256.A OG1 SER 297.A OG no hydrogen 2.563 N/A GLU 257.A N LEU 253.A O no hydrogen 3.104 N/A GLU 258.A N TYR 254.A O no hydrogen 2.923 N/A ILE 259.A N ILE 255.A O no hydrogen 2.873 N/A TYR 260.A N THR 256.A O no hydrogen 2.921 N/A LYS 261.A N GLU 257.A O no hydrogen 3.062 N/A LYS 261.A NZ GLU 258.A OE1 no hydrogen 3.254 N/A LYS 261.A NZ GLU 258.A OE2 no hydrogen 3.062 N/A THR 262.A N ILE 259.A O no hydrogen 3.131 N/A THR 262.A OG1 ILE 259.A O no hydrogen 2.551 N/A GLY 263.A N TYR 260.A O no hydrogen 2.785 N/A SER 266.A N ILE 222.A O no hydrogen 2.846 N/A SER 266.A OG GLN 83.A OE1 no hydrogen 3.374 N/A SER 266.A OG HIS 106.A NE2 no hydrogen 3.139 N/A GLY 267.A N ILE 222.A O no hydrogen 3.098 N/A LEU 268.A N SER 89.A O no hydrogen 2.772 N/A ASP 269.A N LEU 224.A O no hydrogen 2.763 N/A ILE 270.A N VAL 91.A O no hydrogen 3.199 N/A MET 271.A N PHE 226.A O no hydrogen 3.000 N/A GLU 272.A N GLY 94.A O no hydrogen 3.314 N/A ASN 274.A N ALA 238.A O no hydrogen 2.970 N/A THR 276.A OG1 GLY 17.A O no hydrogen 3.068 N/A THR 276.A OG1 ASN 274.A OD1 no hydrogen 2.601 N/A LEU 277.A N ASN 274.A O no hydrogen 2.585 N/A GLY 278.A N THR 276.A O no hydrogen 2.780 N/A LYS 279.A N GLU 283.A OE1 no hydrogen 3.171 N/A VAL 284.A N THR 280.A O no hydrogen 3.477 N/A THR 285.A N PRO 281.A O no hydrogen 3.054 N/A THR 285.A OG1 PRO 281.A O no hydrogen 3.319 N/A ARG 286.A N GLU 282.A O no hydrogen 2.548 N/A ARG 286.A NE GLU 282.A OE1 no hydrogen 2.982 N/A ARG 286.A NH1 VAL 234.A O no hydrogen 3.152 N/A THR 287.A N GLU 283.A O no hydrogen 2.899 N/A THR 287.A OG1 GLU 283.A O no hydrogen 2.543 N/A VAL 288.A N VAL 284.A O no hydrogen 2.721 N/A ASN 289.A N THR 285.A O no hydrogen 2.885 N/A THR 290.A N ARG 286.A O no hydrogen 3.053 N/A ALA 291.A N THR 287.A O no hydrogen 3.173 N/A VAL 292.A N VAL 288.A O no hydrogen 2.878 N/A ALA 293.A N ASN 289.A O no hydrogen 2.445 N/A LEU 294.A N THR 290.A O no hydrogen 2.828 N/A THR 295.A N ALA 291.A O no hydrogen 3.134 N/A THR 295.A N VAL 292.A O no hydrogen 2.927 N/A THR 295.A OG1 ALA 291.A O no hydrogen 3.322 N/A THR 295.A OG1 VAL 292.A O no hydrogen 3.338 N/A LEU 296.A N VAL 292.A O no hydrogen 3.257 N/A SER 297.A OG THR 256.A OG1 no hydrogen 2.563 N/A CYS 298.A N LEU 294.A O no hydrogen 3.497 N/A CYS 298.A SG LEU 294.A O no hydrogen 3.162 N/A GLY 300.A N SER 297.A O no hydrogen 3.218 N/A THR 301.A OG1 LEU 296.A O no hydrogen 2.761 N/A ARG 303.A N GLU 257.A OE2 no hydrogen 2.947 N/A ARG 303.A NE GLU 257.A OE2 no hydrogen 3.474 N/A ARG 303.A NH2 GLU 257.A OE1 no hydrogen 2.940 N/A GLY 305.A N LYS 302.A O no hydrogen 3.402 N/A LYS 308.A N TYR 313.A OH no hydrogen 3.184 N/A THR 311.A OG1 PRO 309.A O no hydrogen 3.521 N/A