Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1fq4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N PHE 171.A O no hydrogen 3.159 N/A VAL 5.A N ALA 169.A O no hydrogen 2.961 N/A LEU 7.A N GLY 167.A O no hydrogen 2.949 N/A THR 8.A N TYR 16.A O no hydrogen 2.811 N/A ASN 9.A ND2 ASN 12.A OD1 no hydrogen 3.037 N/A ASN 9.A ND2 GLY 157.A O no hydrogen 3.241 N/A TYR 10.A N GLN 14.A O no hydrogen 2.848 N/A ASN 12.A N ASN 9.A OD1 no hydrogen 2.670 N/A ASN 12.A ND2 ASP 158.A OD1 no hydrogen 2.872 N/A ALA 13.A N TYR 10.A O no hydrogen 3.205 N/A TYR 15.A OH GLY 157.A O no hydrogen 2.653 N/A TYR 16.A N THR 8.A O no hydrogen 3.105 N/A THR 17.A N VAL 30.A O no hydrogen 2.847 N/A ILE 19.A N PHE 28.A O no hydrogen 2.906 N/A THR 20.A N SER 91.A O no hydrogen 2.911 N/A LEU 21.A N GLN 26.A O no hydrogen 2.931 N/A GLY 22.A N THR 89.A O no hydrogen 2.816 N/A THR 23.A N SER 62.A OG no hydrogen 2.663 N/A THR 23.A OG1 SER 64.A OG no hydrogen 2.667 N/A GLN 26.A N LEU 21.A O no hydrogen 2.695 N/A GLN 26.A NE2 ASP 58.A O no hydrogen 2.664 N/A ASN 27.A ND2 PHE 28.A O no hydrogen 3.377 N/A PHE 28.A N ILE 19.A O no hydrogen 3.238 N/A LYS 29.A N ASP 119.A OD1 no hydrogen 2.633 N/A LYS 29.A NZ ASP 18.A OD2 no hydrogen 2.993 N/A VAL 30.A N THR 17.A O no hydrogen 2.860 N/A ILE 31.A N GLY 120.A O no hydrogen 3.030 N/A ASP 33.A N LEU 122.A O no hydrogen 3.008 N/A THR 34.A N THR 219.A OG1 no hydrogen 3.203 N/A THR 34.A OG1 ILE 217.A O no hydrogen 2.792 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.812 N/A SER 36.A OG TYR 76.A OH no hydrogen 3.428 N/A SER 37.A OG TYR 126.A O no hydrogen 2.668 N/A ASN 38.A ND2 VAL 131.A O no hydrogen 3.338 N/A TRP 40.A N ILE 121.A O no hydrogen 2.981 N/A TRP 40.A NE1 TYR 76.A OH no hydrogen 3.038 N/A VAL 41.A N ALA 103.A O no hydrogen 3.307 N/A SER 43.A N ALA 105.A O no hydrogen 2.758 N/A SER 43.A OG GLU 104.A OE1 no hydrogen 2.720 N/A ASN 44.A N TYR 57.A O no hydrogen 3.357 N/A GLU 45.A N SER 43.A OG no hydrogen 3.386 N/A CYS 46.A N SER 43.A O no hydrogen 2.926 N/A CYS 46.A SG SER 48.A OG no hydrogen 2.822 N/A CYS 46.A SG THR 106.A O no hydrogen 3.289 N/A CYS 51.A N SER 48.A O no hydrogen 3.211 N/A CYS 51.A SG SER 48.A OG no hydrogen 3.507 N/A PHE 52.A N SER 48.A O no hydrogen 3.187 N/A PHE 52.A N LEU 49.A O no hydrogen 2.923 N/A LEU 53.A N LEU 49.A O no hydrogen 3.001 N/A HIS 54.A N ALA 50.A O no hydrogen 3.311 N/A HIS 54.A ND1 ALA 50.A O no hydrogen 2.699 N/A HIS 54.A NE2 GLY 116.A O no hydrogen 2.720 N/A SER 55.A N ASP 119.A OD2 no hydrogen 3.132 N/A LYS 56.A NZ HIS 54.A O no hydrogen 3.468 N/A TYR 57.A N PRO 42.A O no hydrogen 2.832 N/A TYR 57.A OH ASP 88.A OD2 no hydrogen 2.648 N/A ASP 58.A N GLN 26.A OE1 no hydrogen 2.829 N/A SER 62.A N HIS 59.A O no hydrogen 2.833 N/A SER 62.A OG ASP 88.A OD1 no hydrogen 3.340 N/A SER 62.A OG ASP 88.A OD2 no hydrogen 3.343 N/A SER 63.A N THR 23.A O no hydrogen 2.651 N/A SER 63.A OG THR 23.A O no hydrogen 3.032 N/A SER 64.A OG THR 23.A OG1 no hydrogen 2.667 N/A LYS 66.A N GLN 87.A O no hydrogen 3.349 N/A GLY 69.A N ILE 85.A O no hydrogen 3.037 N/A THR 70.A N ASN 68.A OD1 no hydrogen 2.923 N/A THR 70.A OG1 ASN 68.A OD1 no hydrogen 2.608 N/A PHE 72.A N GLY 83.A O no hydrogen 2.949 N/A ILE 74.A N LEU 81.A O no hydrogen 3.331 N/A TYR 76.A N GLY 79.A O no hydrogen 2.730 N/A TYR 76.A OH SER 36.A OG no hydrogen 3.428 N/A THR 78.A OG1 THR 78.A O no hydrogen 2.544 N/A LEU 81.A N ILE 74.A O no hydrogen 3.013 N/A GLU 82.A N SER 107.A O no hydrogen 2.990 N/A GLY 83.A N PHE 72.A O no hydrogen 2.861 N/A TYR 84.A N GLU 104.A O no hydrogen 3.208 N/A ILE 85.A N THR 70.A O no hydrogen 2.913 N/A SER 86.A N PHE 102.A O no hydrogen 2.941 N/A SER 86.A OG ILE 85.A O no hydrogen 3.013 N/A SER 86.A OG GLU 104.A OE2 no hydrogen 2.839 N/A THR 89.A N ASP 88.A OD1 no hydrogen 2.718 N/A LEU 90.A N ILE 97.A O no hydrogen 3.037 N/A SER 91.A N THR 20.A O no hydrogen 2.897 N/A SER 91.A OG THR 96.A OG1 no hydrogen 3.428 N/A ILE 92.A N LEU 95.A O no hydrogen 2.962 N/A LEU 95.A N ILE 92.A O no hydrogen 3.041 N/A THR 96.A OG1 SER 91.A OG no hydrogen 3.428 N/A ILE 97.A N LEU 90.A O no hydrogen 2.836 N/A GLN 100.A N ASP 88.A O no hydrogen 3.024 N/A GLN 100.A NE2 ASP 101.A O no hydrogen 2.702 N/A GLN 100.A NE2 VAL 135.A O no hydrogen 3.032 N/A PHE 102.A N SER 86.A O no hydrogen 3.291 N/A GLU 104.A N TYR 84.A O no hydrogen 3.021 N/A ALA 105.A N VAL 41.A O no hydrogen 2.714 N/A THR 106.A N GLU 82.A O no hydrogen 2.651 N/A THR 106.A OG1 GLU 82.A O no hydrogen 2.895 N/A SER 107.A N GLU 82.A O no hydrogen 3.032 N/A GLU 108.A N SER 48.A OG no hydrogen 3.240 N/A ALA 114.A N LEU 111.A O no hydrogen 2.670 N/A PHE 115.A N LEU 111.A O no hydrogen 3.231 N/A LYS 117.A N GLN 14.A OE1 no hydrogen 3.377 N/A ASP 119.A N LYS 29.A O no hydrogen 2.697 N/A GLY 120.A N LYS 29.A O no hydrogen 3.190 N/A ILE 121.A N TRP 40.A O no hydrogen 3.194 N/A LEU 122.A N ILE 31.A O no hydrogen 2.848 N/A GLY 123.A N ASN 38.A O no hydrogen 2.936 N/A LEU 124.A N ASP 33.A O no hydrogen 2.873 N/A GLY 125.A N SER 36.A O no hydrogen 2.961 N/A TYR 126.A N ALA 192.A O no hydrogen 3.124 N/A TYR 126.A OH ASN 321.A OD1 no hydrogen 2.827 N/A ASP 127.A N TYR 139.A OH no hydrogen 3.095 N/A THR 128.A OG1 ASP 127.A OD1 no hydrogen 3.488 N/A THR 128.A OG1 LYS 191.A O no hydrogen 3.116 N/A ILE 129.A N TYR 126.A O no hydrogen 3.516 N/A SER 130.A N ASP 127.A O no hydrogen 2.816 N/A SER 130.A OG VAL 131.A O no hydrogen 3.393 N/A SER 130.A OG VAL 134.A O no hydrogen 2.750 N/A VAL 131.A N ASN 38.A OD1 no hydrogen 2.851 N/A LYS 133.A N SER 130.A O no hydrogen 2.968 N/A VAL 134.A N VAL 131.A O no hydrogen 3.167 N/A TYR 139.A N PRO 136.A O no hydrogen 2.710 N/A ASN 140.A N PRO 136.A O no hydrogen 3.185 N/A ASN 140.A ND2 LYS 99.A O no hydrogen 3.214 N/A ALA 141.A N PRO 137.A O no hydrogen 3.302 N/A GLN 143.A N TYR 139.A O no hydrogen 2.887 N/A GLN 144.A N ALA 141.A O no hydrogen 3.363 N/A ASP 145.A N ILE 142.A O no hydrogen 3.076 N/A LEU 146.A N ALA 141.A O no hydrogen 2.988 N/A PHE 152.A N TYR 316.A O no hydrogen 3.065 N/A ALA 153.A N THR 170.A O no hydrogen 2.986 N/A PHE 154.A N SER 314.A O no hydrogen 2.756 N/A TYR 155.A N GLU 168.A O no hydrogen 2.930 N/A TYR 155.A OH ILE 329.A OXT no hydrogen 2.844 N/A TYR 155.A OH ASP 162B.A OD2 no hydrogen 3.310 N/A GLY 157.A N GLY 166.A O no hydrogen 3.054 N/A ASP 158.A N ASP 162B.A OD1 no hydrogen 2.973 N/A THR 159.A N ASN 12.A OD1 no hydrogen 3.149 N/A THR 159.A OG1 ASP 158.A OD1 no hydrogen 3.540 N/A SER 160.A N ASP 158.A OD1 no hydrogen 3.412 N/A SER 160.A OG ASP 158.A OD1 no hydrogen 2.906 N/A GLU 168.A N TYR 155.A O no hydrogen 2.903 N/A ALA 169.A N VAL 5.A O no hydrogen 2.982 N/A THR 170.A N ALA 153.A O no hydrogen 2.955 N/A THR 170.A OG1 ASP 4.A OD1 no hydrogen 2.722 N/A THR 170.A OG1 GLU 168.A OE1 no hydrogen 3.564 N/A PHE 171.A N HIS 3.A O no hydrogen 2.942 N/A GLY 172.A N ARG 151.A O no hydrogen 2.654 N/A ASP 175.A N TYR 313.A OH no hydrogen 3.073 N/A SER 177.A N ASP 175.A OD1 no hydrogen 3.111 N/A SER 177.A OG ASP 175.A OD1 no hydrogen 2.806 N/A SER 177.A OG ASP 175.A OD2 no hydrogen 3.446 N/A LYS 178.A N ASP 175.A O no hydrogen 3.470 N/A LYS 178.A NZ ASN 165.A OD1 no hydrogen 2.661 N/A LYS 180.A N LYS 327.A O no hydrogen 2.821 N/A THR 184.A N LEU 325.A O no hydrogen 2.713 N/A LEU 186.A N VAL 323.A O no hydrogen 2.659 N/A VAL 188.A N ASN 321.A O no hydrogen 2.847 N/A ARG 189.A N GLU 195.A O no hydrogen 2.981 N/A ARG 189.A NE GLU 195.A OE2 no hydrogen 2.843 N/A ARG 190.A NH2 VAL 298.A O no hydrogen 3.346 N/A ALA 192.A N ARG 190.A O no hydrogen 3.017 N/A TRP 194.A NE1 LEU 124.A O no hydrogen 2.973 N/A VAL 196.A N ALA 215.A O no hydrogen 2.733 N/A PHE 198.A N HIS 213.A O no hydrogen 2.980 N/A GLU 199.A N ASN 264.A O no hydrogen 3.017 N/A ILE 201.A N ALA 208.A O no hydrogen 3.301 N/A GLY 202.A N ILE 262.A O no hydrogen 3.073 N/A LEU 203.A N GLU 206.A O no hydrogen 3.277 N/A ALA 208.A N ILE 201.A O no hydrogen 2.835 N/A LEU 210.A N GLU 199.A O no hydrogen 2.704 N/A HIS 213.A ND1 GLU 211.A O no hydrogen 2.711 N/A GLY 214.A N PRO 300.A O no hydrogen 3.258 N/A ALA 215.A N VAL 196.A O no hydrogen 3.012 N/A ALA 216.A N ALA 302.A O no hydrogen 2.913 N/A ILE 217.A N TRP 194.A O no hydrogen 3.023 N/A ASP 218.A N VAL 304.A O no hydrogen 3.219 N/A THR 219.A N THR 34.A OG1 no hydrogen 2.999 N/A THR 219.A OG1 LEU 32.A O no hydrogen 2.715 N/A GLY 220.A N ASP 218.A OD1 no hydrogen 2.685 N/A THR 221.A OG1 ASP 218.A OD2 no hydrogen 2.810 N/A SER 222.A OG ALA 13.A O no hydrogen 3.189 N/A ILE 224.A N ALA 288.A O no hydrogen 2.905 N/A THR 225.A N ILE 303.A O no hydrogen 2.848 N/A LEU 226.A N THR 290.A O no hydrogen 2.696 N/A SER 228.A N ASP 293.A OD1 no hydrogen 3.401 N/A SER 228.A OG ASP 293.A OD2 no hydrogen 2.877 N/A LEU 230.A N PRO 227.A O no hydrogen 3.069 N/A ALA 231.A N PRO 227.A O no hydrogen 3.310 N/A ALA 231.A N SER 228.A O no hydrogen 3.251 N/A GLU 232.A N SER 228.A O no hydrogen 3.039 N/A MET 233.A N GLY 229.A O no hydrogen 3.350 N/A ILE 234.A N LEU 230.A O no hydrogen 3.318 N/A ASN 235.A N ALA 231.A O no hydrogen 3.134 N/A ASN 235.A ND2 SER 287.A OG no hydrogen 2.619 N/A ALA 236.A N GLU 232.A O no hydrogen 2.940 N/A GLU 237.A N MET 233.A O no hydrogen 2.915 N/A ILE 238.A N ILE 234.A O no hydrogen 2.940 N/A ILE 238.A N ASN 235.A O no hydrogen 3.086 N/A GLY 239.A N ALA 236.A O no hydrogen 3.259 N/A ALA 240.A N ASN 235.A O no hydrogen 2.961 N/A LYS 241.A N THR 249.A O no hydrogen 2.946 N/A LYS 242.A NZ TYR 248.A OH no hydrogen 3.519 N/A GLY 246.A N GLY 243.A O no hydrogen 3.110 N/A THR 249.A N LYS 241.A O no hydrogen 3.061 N/A LEU 250.A N CYS 285.A O no hydrogen 2.959 N/A ASN 253.A N ASP 251.A OD1 no hydrogen 3.156 N/A THR 254.A N ASP 251.A O no hydrogen 2.869 N/A THR 254.A OG1 ASP 251.A O no hydrogen 2.684 N/A ARG 255.A N CYS 252.A O no hydrogen 3.417 N/A ARG 255.A NE CYS 252.A O no hydrogen 3.265 N/A ARG 255.A NH2 GLU 280.A OE1 no hydrogen 3.203 N/A ASN 257.A N THR 254.A O no hydrogen 3.119 N/A LEU 258.A N ARG 255.A O no hydrogen 3.149 N/A LEU 261.A N ILE 272.A O no hydrogen 2.683 N/A ILE 262.A N GLY 202.A O no hydrogen 3.122 N/A PHE 263.A N PHE 270.A O no hydrogen 2.790 N/A ASN 264.A N GLY 200.A O no hydrogen 2.694 N/A PHE 265.A N TYR 268.A O no hydrogen 2.675 N/A ASN 266.A N LYS 197.A O no hydrogen 2.724 N/A TYR 268.A N PHE 265.A O no hydrogen 2.929 N/A PHE 270.A N PHE 263.A O no hydrogen 2.989 N/A THR 271.A N TYR 312.A OH no hydrogen 3.186 N/A ILE 272.A N LEU 261.A O no hydrogen 2.873 N/A GLY 273.A N ASP 276.A OD2 no hydrogen 3.071 N/A TYR 275.A OH ASP 256.A OD1 no hydrogen 2.961 N/A ASP 276.A N GLY 273.A O no hydrogen 3.048 N/A TYR 277.A N GLY 273.A O no hydrogen 2.821 N/A TYR 277.A OH PRO 259.A O no hydrogen 2.676 N/A THR 278.A N PRO 274.A O no hydrogen 3.229 N/A THR 278.A OG1 PRO 274.A O no hydrogen 2.675 N/A LEU 279.A N ILE 286.A O no hydrogen 2.665 N/A VAL 281.A N SER 284.A O no hydrogen 2.788 N/A SER 284.A N VAL 281.A O no hydrogen 3.482 N/A SER 284.A OG VAL 281.A O no hydrogen 3.142 N/A ILE 286.A N LEU 279.A O no hydrogen 2.705 N/A SER 287.A N TYR 248.A O no hydrogen 2.881 N/A ALA 288.A N TYR 277.A O no hydrogen 2.828 N/A ILE 289.A N SER 287.A OG no hydrogen 3.256 N/A THR 290.A N ILE 224.A O no hydrogen 2.756 N/A MET 292.A N LEU 226.A O no hydrogen 2.925 N/A VAL 298.A N PRO 295.A O no hydrogen 3.128 N/A GLY 299.A N PRO 295.A O no hydrogen 2.923 N/A ALA 302.A N GLY 214.A O no hydrogen 2.772 N/A ILE 303.A N THR 225.A O no hydrogen 2.890 N/A VAL 304.A N ALA 216.A O no hydrogen 3.113 N/A GLY 305.A N LEU 223.A O no hydrogen 2.889 N/A ASP 306.A N THR 221.A O no hydrogen 2.773 N/A ALA 307.A N SER 222.A O no hydrogen 3.184 N/A PHE 308.A N GLY 305.A O no hydrogen 3.005 N/A LEU 309.A N GLY 305.A O no hydrogen 3.194 N/A ARG 310.A N ASP 306.A O no hydrogen 3.071 N/A ARG 310.A NH1 ASN 12.A O no hydrogen 3.023 N/A ARG 310.A NH1 TYR 15.A OH no hydrogen 2.876 N/A LYS 311.A N PHE 308.A O no hydrogen 3.130 N/A LYS 311.A NZ ASP 276.A OD2 no hydrogen 3.162 N/A TYR 312.A N LEU 309.A O no hydrogen 3.020 N/A TYR 312.A OH THR 271.A O no hydrogen 3.207 N/A TYR 313.A N ALA 326.A O no hydrogen 2.762 N/A SER 314.A N PHE 154.A O no hydrogen 3.025 N/A SER 314.A OG TYR 316.A OH no hydrogen 2.635 N/A ILE 315.A N GLY 324.A O no hydrogen 3.089 N/A TYR 316.A N PHE 152.A O no hydrogen 2.868 N/A TYR 316.A OH SER 314.A OG no hydrogen 2.635 N/A ASP 317.A N ALA 322.A O no hydrogen 2.796 N/A ILE 318.A N LYS 150.A O no hydrogen 2.884 N/A GLY 319.A N LYS 150.A O no hydrogen 3.290 N/A ASN 320.A N ASP 317.A OD1 no hydrogen 3.064 N/A ALA 322.A N ASP 317.A O no hydrogen 3.128 N/A VAL 323.A N LEU 186.A O no hydrogen 2.696 N/A GLY 324.A N ILE 315.A O no hydrogen 2.917 N/A LEU 325.A N THR 184.A O no hydrogen 2.753 N/A ALA 326.A N TYR 313.A O no hydrogen 3.275 N/A LYS 327.A NZ TYR 312.A OH no hydrogen 3.519 N/A ALA 328.A N LYS 311.A O no hydrogen 3.310 N/A ILE 329.A N LYS 178.A O no hydrogen 3.098 N/A LYS 161A.A NZ ILE 329.A O no hydrogen 3.365 N/A LYS 161A.A NZ ILE 329.A OXT no hydrogen 3.237 N/A