Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f5n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N GLN 1.A O no hydrogen 2.790 N/A ASN 5.A ND2 HIS 44.A O no hydrogen 2.790 N/A GLY 6.A N GLU 2.A O no hydrogen 2.662 N/A THR 9.A N ASN 5.A O no hydrogen 2.977 N/A THR 9.A OG1 ASN 5.A O no hydrogen 3.439 N/A THR 9.A OG1 GLY 6.A O no hydrogen 3.170 N/A ASP 10.A N GLY 6.A O no hydrogen 2.862 N/A MET 11.A N GLY 7.A O no hydrogen 3.038 N/A LEU 12.A N ILE 8.A O no hydrogen 2.903 N/A THR 13.A N THR 9.A O no hydrogen 2.919 N/A THR 13.A OG1 THR 9.A O no hydrogen 2.983 N/A GLU 14.A N ASP 10.A O no hydrogen 2.930 N/A LEU 15.A N MET 11.A O no hydrogen 3.016 N/A ALA 16.A N LEU 12.A O no hydrogen 2.837 N/A ASN 17.A N THR 13.A O no hydrogen 2.955 N/A PHE 18.A N GLU 14.A O no hydrogen 3.087 N/A GLU 19.A N LEU 15.A O no hydrogen 3.030 N/A LYS 20.A N ALA 16.A O no hydrogen 2.995 N/A ASN 21.A N ASN 17.A O no hydrogen 2.835 N/A ASN 21.A ND2 ASN 91.A OD1 no hydrogen 2.770 N/A VAL 22.A N PHE 18.A O no hydrogen 2.877 N/A SER 23.A N PHE 18.A O no hydrogen 3.069 N/A SER 23.A OG GLU 19.A OE1 no hydrogen 3.533 N/A ALA 25.A N GLU 19.A O no hydrogen 2.850 N/A LYS 28.A N ALA 25.A O no hydrogen 3.085 N/A TYR 29.A N ALA 25.A O no hydrogen 3.040 N/A ASN 30.A N ILE 26.A O no hydrogen 3.028 N/A ALA 31.A N HIS 27.A O no hydrogen 2.987 N/A TYR 32.A N LYS 28.A O no hydrogen 2.932 N/A ARG 33.A N TYR 29.A O no hydrogen 2.975 N/A ARG 33.A NH1 ASN 30.A OD1 no hydrogen 2.964 N/A LYS 34.A N ASN 30.A O no hydrogen 2.887 N/A ALA 35.A N ALA 31.A O no hydrogen 3.016 N/A ALA 36.A N TYR 32.A O no hydrogen 2.895 N/A SER 37.A N ARG 33.A O no hydrogen 2.854 N/A VAL 38.A N LYS 34.A O no hydrogen 3.003 N/A ILE 39.A N ALA 35.A O no hydrogen 3.033 N/A ALA 40.A N ALA 36.A O no hydrogen 2.848 N/A LYS 41.A N SER 37.A O no hydrogen 3.243 N/A LYS 41.A N VAL 38.A O no hydrogen 3.263 N/A TYR 42.A N ILE 39.A O no hydrogen 3.055 N/A TYR 42.A OH GLU 51.A OE2 no hydrogen 2.595 N/A ILE 46.A N ASN 5.A OD1 no hydrogen 2.786 N/A LYS 47.A N GLU 51.A OE1 no hydrogen 2.960 N/A GLY 49.A N ASP 67.A OD1 no hydrogen 2.695 N/A GLU 51.A N SER 48.A OG no hydrogen 3.182 N/A ALA 52.A N SER 48.A O no hydrogen 3.291 N/A LYS 53.A N GLY 49.A O no hydrogen 2.895 N/A LYS 54.A N GLU 51.A O no hydrogen 3.425 N/A LEU 55.A N ALA 52.A O no hydrogen 2.930 N/A VAL 58.A N LEU 55.A O no hydrogen 3.198 N/A ALA 63.A N GLY 59.A O no hydrogen 3.036 N/A GLU 64.A N THR 60.A O no hydrogen 3.080 N/A LYS 65.A N LYS 61.A O no hydrogen 2.942 N/A ILE 66.A N ILE 62.A O no hydrogen 2.859 N/A ASP 67.A N ALA 63.A O no hydrogen 2.991 N/A GLU 68.A N GLU 64.A O no hydrogen 3.044 N/A PHE 69.A N LYS 65.A O no hydrogen 2.889 N/A LEU 70.A N ILE 66.A O no hydrogen 2.822 N/A ALA 71.A N ASP 67.A O no hydrogen 2.991 N/A THR 72.A N GLU 68.A O no hydrogen 2.947 N/A THR 72.A OG1 GLU 68.A O no hydrogen 2.793 N/A GLY 73.A N PHE 69.A O no hydrogen 2.675 N/A LYS 74.A N THR 72.A OG1 no hydrogen 3.301 N/A ARG 76.A N GLU 68.A OE2 no hydrogen 2.896 N/A GLU 79.A N LEU 75.A O no hydrogen 2.937 N/A LYS 80.A N ARG 76.A O no hydrogen 2.994 N/A LYS 80.A NZ GLN 83.A OE1 no hydrogen 3.144 N/A ILE 81.A N LYS 77.A O no hydrogen 3.105 N/A ARG 82.A N LEU 78.A O no hydrogen 2.949 N/A ARG 82.A NE GLU 14.A OE1 no hydrogen 3.143 N/A ARG 82.A NE GLU 14.A OE2 no hydrogen 2.569 N/A ARG 82.A NH2 GLU 14.A OE1 no hydrogen 2.711 N/A GLN 83.A N GLU 79.A O no hydrogen 3.324 N/A GLN 83.A N LYS 80.A O no hydrogen 3.146 N/A GLN 83.A NE2 GLU 79.A O no hydrogen 3.305 N/A ASP 84.A N ILE 81.A O no hydrogen 2.985 N/A SER 87.A N ASP 84.A OD2 no hydrogen 2.878 N/A SER 87.A OG ASP 84.A OD2 no hydrogen 3.358 N/A SER 88.A N ASP 84.A O no hydrogen 2.830 N/A SER 88.A OG ASP 84.A O no hydrogen 2.718 N/A SER 88.A OG ASP 85.A O no hydrogen 3.218 N/A SER 89.A N ASP 85.A O no hydrogen 3.011 N/A SER 89.A OG ASP 85.A O no hydrogen 2.710 N/A ILE 90.A N THR 86.A O no hydrogen 2.960 N/A ASN 91.A N SER 87.A O no hydrogen 2.945 N/A PHE 92.A N SER 88.A O no hydrogen 2.975 N/A LEU 93.A N SER 89.A O no hydrogen 2.977 N/A THR 94.A N ILE 90.A O no hydrogen 3.411 N/A THR 94.A OG1 ASN 91.A O no hydrogen 2.737 N/A ARG 95.A N PHE 92.A O no hydrogen 2.864 N/A ARG 95.A NE GLU 140.A OE2 no hydrogen 2.855 N/A ARG 95.A NH2 GLU 140.A OE1 no hydrogen 2.927 N/A ARG 95.A NH2 GLU 140.A OE2 no hydrogen 3.450 N/A VAL 96.A N LEU 93.A O no hydrogen 3.002 N/A SER 97.A OG HIS 128.A NE2 no hydrogen 2.772 N/A ILE 99.A N VAL 96.A O no hydrogen 3.050 N/A ALA 104.A N GLY 100.A O no hydrogen 2.915 N/A ARG 105.A N PRO 101.A O no hydrogen 3.103 N/A LYS 106.A N SER 102.A O no hydrogen 3.033 N/A PHE 107.A N ALA 103.A O no hydrogen 2.850 N/A VAL 108.A N ALA 104.A O no hydrogen 2.967 N/A ASP 109.A N ARG 105.A O no hydrogen 2.927 N/A GLU 110.A N LYS 106.A O no hydrogen 3.309 N/A GLU 110.A N PHE 107.A O no hydrogen 3.087 N/A GLY 111.A N VAL 108.A O no hydrogen 3.102 N/A ILE 112.A N PHE 107.A O no hydrogen 2.890 N/A LYS 113.A N ASP 117.A OD2 no hydrogen 2.835 N/A LYS 113.A NZ ASP 85.A OD1 no hydrogen 2.916 N/A LYS 113.A NZ ASP 85.A OD2 no hydrogen 2.950 N/A THR 114.A N ASP 117.A OD2 no hydrogen 3.216 N/A THR 114.A OG1 GLU 116.A OE1 no hydrogen 3.061 N/A ASP 117.A N THR 114.A OG1 no hydrogen 3.207 N/A LEU 118.A N THR 114.A O no hydrogen 3.019 N/A ARG 119.A N LEU 115.A O no hydrogen 2.779 N/A ARG 119.A NH2 GLU 116.A OE2 no hydrogen 2.822 N/A LYS 120.A N GLU 116.A O no hydrogen 3.005 N/A ASN 121.A N LEU 118.A O no hydrogen 2.883 N/A ASN 121.A ND2 ASP 117.A O no hydrogen 2.726 N/A LYS 124.A N ASN 121.A O no hydrogen 2.793 N/A LYS 124.A NZ GLU 110.A OE1 no hydrogen 2.666 N/A LEU 125.A N GLU 122.A O no hydrogen 2.985 N/A ASN 126.A N GLN 129.A OE1 no hydrogen 2.881 N/A HIS 127.A NE2 THR 217.A O no hydrogen 2.798 N/A HIS 128.A NE2 SER 97.A OG no hydrogen 2.772 N/A GLN 129.A N ASN 126.A OD1 no hydrogen 2.847 N/A GLN 129.A NE2 GLY 98.A O no hydrogen 3.027 N/A ARG 130.A N ASN 126.A O no hydrogen 2.945 N/A ARG 130.A NE GLU 122.A O no hydrogen 3.236 N/A ARG 130.A NH2 GLU 122.A O no hydrogen 2.991 N/A ILE 131.A N HIS 127.A O no hydrogen 3.166 N/A GLY 132.A N HIS 128.A O no hydrogen 2.833 N/A LEU 133.A N GLN 129.A O no hydrogen 2.948 N/A LYS 134.A N ARG 130.A O no hydrogen 2.922 N/A LYS 134.A NZ TYR 135.A OH no hydrogen 3.353 N/A TYR 135.A N ILE 131.A O no hydrogen 3.037 N/A TYR 135.A OH ASP 216.A OD2 no hydrogen 2.609 N/A PHE 136.A N LEU 133.A O no hydrogen 3.180 N/A PHE 139.A N TYR 135.A O no hydrogen 2.891 N/A GLU 140.A N GLY 137.A O no hydrogen 3.069 N/A LYS 141.A N ASP 138.A O no hydrogen 3.036 N/A ARG 142.A NE SER 180.A OG no hydrogen 2.766 N/A ARG 142.A NH2 SER 180.A O no hydrogen 2.847 N/A ARG 142.A NH2 SER 180.A OG no hydrogen 3.098 N/A ILE 143.A N SER 181.A O no hydrogen 2.723 N/A ARG 145.A N GLU 179.A O no hydrogen 2.996 N/A ARG 145.A NH1 PHE 174.A O no hydrogen 2.789 N/A ARG 145.A NH1 ALA 178.A O no hydrogen 2.961 N/A ARG 145.A NH2 PHE 174.A O no hydrogen 3.361 N/A GLU 147.A N PRO 144.A O no hydrogen 2.939 N/A MET 148.A N PRO 144.A O no hydrogen 3.078 N/A LEU 149.A N ARG 145.A O no hydrogen 2.872 N/A GLN 150.A N GLU 146.A O no hydrogen 3.216 N/A GLN 150.A NE2 GLU 146.A OE2 no hydrogen 3.316 N/A MET 151.A N GLU 147.A O no hydrogen 2.796 N/A GLN 152.A N MET 148.A O no hydrogen 2.746 N/A ASP 153.A N LEU 149.A O no hydrogen 2.823 N/A ILE 154.A N GLN 150.A O no hydrogen 3.204 N/A VAL 155.A N MET 151.A O no hydrogen 2.994 N/A LEU 156.A N GLN 152.A O no hydrogen 2.923 N/A ASN 157.A N ASP 153.A O no hydrogen 3.073 N/A ASN 157.A ND2 GLU 158.A OE2 no hydrogen 3.292 N/A GLU 158.A N ILE 154.A O no hydrogen 2.924 N/A VAL 159.A N VAL 155.A O no hydrogen 2.922 N/A LYS 160.A N LEU 156.A O no hydrogen 3.139 N/A LYS 161.A N ASN 157.A O no hydrogen 3.041 N/A LYS 161.A NZ GLU 158.A OE1 no hydrogen 2.981 N/A LYS 161.A NZ GLU 158.A OE2 no hydrogen 3.309 N/A VAL 162.A N GLU 158.A O no hydrogen 3.131 N/A ASP 163.A N VAL 159.A O no hydrogen 3.214 N/A GLU 165.A N ASP 163.A OD1 no hydrogen 2.992 N/A TYR 166.A N ASP 163.A O no hydrogen 3.070 N/A TYR 166.A OH LEU 200.A O no hydrogen 2.644 N/A ILE 167.A N THR 189.A O no hydrogen 2.913 N/A THR 169.A N LEU 187.A O no hydrogen 2.934 N/A THR 169.A OG1 TYR 253.A OH no hydrogen 2.666 N/A CYS 171.A N ASP 185.A O no hydrogen 2.866 N/A CYS 171.A SG THR 169.A O no hydrogen 3.682 N/A GLY 172.A N PHE 260.A O no hydrogen 2.870 N/A SER 173.A OG SER 180.A O no hydrogen 3.535 N/A SER 173.A OG SER 181.A OG no hydrogen 2.746 N/A ARG 175.A N GLY 172.A O no hydrogen 3.064 N/A ARG 175.A NH1 THR 261.A OG1 no hydrogen 2.876 N/A ARG 175.A NH1 GLU 304.A OE1 no hydrogen 3.075 N/A ARG 175.A NH1 GLU 304.A OE2 no hydrogen 3.393 N/A ARG 175.A NH2 GLU 304.A OE2 no hydrogen 2.693 N/A ARG 176.A N GLY 172.A O no hydrogen 3.412 N/A ARG 176.A NH1 THR 261.A O no hydrogen 2.910 N/A GLY 177.A N PHE 174.A O no hydrogen 3.028 N/A ALA 178.A N SER 173.A O no hydrogen 3.037 N/A SER 181.A N ILE 143.A O no hydrogen 2.945 N/A SER 181.A OG SER 173.A OG no hydrogen 2.746 N/A MET 184.A N ARG 242.A O no hydrogen 2.959 N/A VAL 186.A N ASP 244.A O no hydrogen 2.821 N/A LEU 187.A N THR 169.A O no hydrogen 2.869 N/A LEU 188.A N ARG 246.A O no hydrogen 2.704 N/A THR 189.A N ILE 167.A O no hydrogen 2.888 N/A THR 189.A OG1 ILE 248.A O no hydrogen 2.760 N/A HIS 190.A NE2 ASP 163.A OD2 no hydrogen 2.869 N/A SER 192.A N HIS 190.A ND1 no hydrogen 3.026 N/A SER 192.A OG HIS 190.A ND1 no hydrogen 2.628 N/A PHE 193.A N HIS 190.A O no hydrogen 2.960 N/A THR 194.A N SER 197.A OG no hydrogen 2.950 N/A SER 195.A N ASP 251.A OD1 no hydrogen 2.815 N/A SER 195.A OG ASP 251.A OD1 no hydrogen 3.046 N/A SER 195.A OG ASP 251.A OD2 no hydrogen 2.565 N/A GLU 196.A N THR 194.A OG1 no hydrogen 3.356 N/A SER 197.A N THR 194.A O no hydrogen 3.168 N/A SER 197.A OG THR 194.A O no hydrogen 3.019 N/A GLN 203.A N LYS 199.A O no hydrogen 2.954 N/A VAL 205.A N LEU 201.A O no hydrogen 3.051 N/A GLU 206.A N HIS 202.A O no hydrogen 2.795 N/A GLN 207.A N GLN 203.A O no hydrogen 3.110 N/A GLN 207.A NE2 GLU 158.A OE1 no hydrogen 2.901 N/A LEU 208.A N VAL 204.A O no hydrogen 3.025 N/A GLN 209.A N VAL 205.A O no hydrogen 2.901 N/A LYS 210.A N GLU 206.A O no hydrogen 2.859 N/A VAL 211.A N GLN 207.A O no hydrogen 3.187 N/A HIS 212.A N GLN 209.A O no hydrogen 2.834 N/A PHE 213.A N LEU 208.A O no hydrogen 2.944 N/A ILE 214.A N LEU 208.A O no hydrogen 3.140 N/A THR 215.A N VAL 228.A O no hydrogen 2.788 N/A THR 215.A OG1 ASP 216.A OD2 no hydrogen 2.683 N/A THR 215.A OG1 VAL 228.A O no hydrogen 3.427 N/A LEU 218.A N MET 226.A O no hydrogen 2.752 N/A SER 219.A N MET 226.A O no hydrogen 2.996 N/A GLY 221.A N LYS 224.A O no hydrogen 2.999 N/A PHE 225.A N ILE 245.A O no hydrogen 2.847 N/A MET 226.A N SER 219.A O no hydrogen 2.924 N/A GLY 227.A N ILE 243.A O no hydrogen 2.938 N/A VAL 228.A N ASP 216.A O no hydrogen 3.019 N/A CYS 229.A N ARG 241.A O no hydrogen 2.854 N/A CYS 229.A SG ARG 241.A O no hydrogen 3.880 N/A GLN 230.A N PHE 213.A O no hydrogen 2.899 N/A GLN 230.A NE2 TYR 238.A O no hydrogen 2.869 N/A SER 233.A OG GLU 235.A O no hydrogen 2.989 N/A SER 233.A OG LYS 236.A O no hydrogen 3.260 N/A HIS 240.A N ASP 138.A OD2 no hydrogen 2.973 N/A ARG 241.A N CYS 229.A O no hydrogen 2.763 N/A ARG 241.A NH1 ARG 142.A O no hydrogen 3.136 N/A ARG 241.A NH2 GLU 147.A OE1 no hydrogen 2.816 N/A ARG 242.A NH1 GLY 227.A O no hydrogen 2.946 N/A ARG 242.A NH1 ILE 243.A O no hydrogen 3.143 N/A ARG 242.A NH1 ASP 244.A OD1 no hydrogen 2.823 N/A ARG 242.A NH2 ASP 244.A OD1 no hydrogen 2.741 N/A ARG 242.A NH2 ASP 244.A OD2 no hydrogen 3.504 N/A ILE 243.A N GLY 227.A O no hydrogen 3.079 N/A ASP 244.A N MET 184.A O no hydrogen 2.815 N/A ILE 245.A N PHE 225.A O no hydrogen 2.872 N/A ARG 246.A N VAL 186.A O no hydrogen 2.818 N/A ARG 246.A NE ASP 185.A OD1 no hydrogen 3.377 N/A ARG 246.A NE ASP 185.A OD2 no hydrogen 3.560 N/A LEU 247.A N THR 223.A O no hydrogen 2.778 N/A ILE 248.A N LEU 188.A O no hydrogen 2.844 N/A LYS 250.A N PHE 193.A O no hydrogen 2.813 N/A GLN 252.A N PRO 249.A O no hydrogen 2.928 N/A TYR 253.A N LYS 250.A O no hydrogen 3.160 N/A TYR 253.A OH THR 169.A OG1 no hydrogen 2.666 N/A TYR 253.A OH LEU 187.A O no hydrogen 2.873 N/A GLY 256.A N GLN 252.A O no hydrogen 3.119 N/A VAL 257.A N TYR 253.A O no hydrogen 2.824 N/A LEU 258.A N TYR 254.A O no hydrogen 2.902 N/A TYR 259.A N CYS 255.A O no hydrogen 2.942 N/A PHE 260.A N GLY 256.A O no hydrogen 2.826 N/A THR 261.A N LEU 258.A O no hydrogen 3.241 N/A THR 261.A OG1 VAL 257.A O no hydrogen 2.652 N/A GLY 262.A N LEU 258.A O no hydrogen 3.323 N/A SER 263.A N ARG 321.A O no hydrogen 3.091 N/A SER 263.A OG ARG 321.A O no hydrogen 3.166 N/A SER 263.A OG SER 322.A O no hydrogen 2.955 N/A PHE 266.A N SER 263.A OG no hydrogen 3.407 N/A ASN 267.A N SER 263.A O no hydrogen 2.781 N/A ASN 267.A ND2 TYR 259.A O no hydrogen 3.132 N/A LYS 268.A N ASP 264.A O no hydrogen 2.812 N/A ASN 269.A N ILE 265.A O no hydrogen 2.835 N/A ASN 269.A ND2 GLU 323.A O no hydrogen 2.608 N/A MET 270.A N PHE 266.A O no hydrogen 2.730 N/A LYS 271.A N ASN 267.A O no hydrogen 2.924 N/A ALA 272.A N LYS 268.A O no hydrogen 2.973 N/A HIS 273.A N ASN 269.A O no hydrogen 2.994 N/A HIS 273.A NE2 ILE 311.A O no hydrogen 2.749 N/A ALA 274.A N MET 270.A O no hydrogen 2.949 N/A LEU 275.A N LYS 271.A O no hydrogen 2.995 N/A GLU 276.A N ALA 272.A O no hydrogen 3.181 N/A LYS 277.A N HIS 273.A O no hydrogen 3.128 N/A LYS 277.A N ALA 274.A O no hydrogen 3.130 N/A LYS 277.A NZ GLN 312.A OE1 no hydrogen 2.461 N/A GLY 278.A N LEU 275.A O no hydrogen 2.653 N/A PHE 279.A N ALA 274.A O no hydrogen 2.752 N/A THR 280.A N ARG 287.A O no hydrogen 2.842 N/A ASN 282.A N THR 285.A O no hydrogen 3.030 N/A TYR 284.A N ASN 282.A OD1 no hydrogen 2.853 N/A THR 285.A N ASN 282.A OD1 no hydrogen 2.868 N/A THR 285.A OG1 ASN 282.A OD1 no hydrogen 3.521 N/A ARG 287.A N THR 280.A O no hydrogen 2.870 N/A LEU 289.A N GLY 278.A O no hydrogen 2.956 N/A GLY 290.A N VAL 294.A O no hydrogen 2.729 N/A GLY 293.A N GLY 290.A O no hydrogen 3.033 N/A GLY 296.A N PRO 288.A O no hydrogen 2.664 N/A LEU 299.A N ILE 286.A O no hydrogen 2.912 N/A ASP 302.A N ASP 306.A OD1 no hydrogen 2.815 N/A LYS 305.A NZ ASP 309.A OD1 no hydrogen 2.914 N/A LYS 305.A NZ ASP 309.A OD2 no hydrogen 3.005 N/A ASP 306.A N SER 303.A OG no hydrogen 3.104 N/A PHE 308.A N GLU 304.A O no hydrogen 3.441 N/A ASP 309.A N LYS 305.A O no hydrogen 2.846 N/A TYR 310.A N ASP 306.A O no hydrogen 2.999 N/A TYR 310.A OH PRO 300.A O no hydrogen 2.684 N/A ILE 311.A N ILE 307.A O no hydrogen 3.419 N/A GLN 312.A N ASP 309.A O no hydrogen 3.025 N/A TRP 313.A N PHE 308.A O no hydrogen 2.919 N/A TYR 315.A OH GLU 304.A OE2 no hydrogen 3.028 N/A ARG 316.A NE ASP 320.A O no hydrogen 2.922 N/A ASP 320.A N GLU 317.A O no hydrogen 2.614 N/A ARG 321.A N PRO 318.A O no hydrogen 3.274 N/A ARG 321.A NE ARG 316.A O no hydrogen 2.847 N/A ARG 321.A NH1 GLU 304.A OE1 no hydrogen 2.876 N/A ARG 321.A NH1 GLU 304.A OE2 no hydrogen 3.551 N/A ARG 321.A NH2 GLU 304.A OE2 no hydrogen 2.843 N/A ARG 321.A NH2 ARG 316.A O no hydrogen 2.889 N/A