Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f0j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N GLY 198.A O no hydrogen 3.021 N/A GLY 7.A N GLU 11.A O no hydrogen 3.026 N/A ARG 9.A N GLU 11.A OE1 no hydrogen 2.907 N/A ARG 9.A NE LYS 83.A O no hydrogen 2.920 N/A ARG 9.A NH2 SER 32.A OG no hydrogen 2.897 N/A ARG 9.A NH2 LYS 83.A O no hydrogen 2.994 N/A LEU 10.A N GLY 7.A O no hydrogen 2.916 N/A GLU 11.A N GLU 11.A OE1 no hydrogen 2.899 N/A PHE 13.A N LEU 10.A O no hydrogen 3.220 N/A TYR 15.A OH ASP 77.A OD1 no hydrogen 3.359 N/A TYR 15.A OH ASP 77.A OD2 no hydrogen 2.553 N/A HIS 20.A N TYR 34.A O no hydrogen 2.847 N/A PHE 24.A N LEU 31.A O no hydrogen 2.946 N/A SER 26.A N GLN 29.A O no hydrogen 3.045 N/A SER 26.A OG TYR 90.A OH no hydrogen 2.735 N/A GLN 27.A NE2 GLN 91.A O no hydrogen 2.972 N/A GLN 27.A NE2 GLN 96.A OE1 no hydrogen 3.029 N/A GLN 29.A N SER 26.A O no hydrogen 3.013 N/A GLN 29.A NE2.B GLN 27.A O no hydrogen 3.616 N/A GLN 29.A NE2.B HIS 89.A O no hydrogen 2.464 N/A LEU 31.A N PHE 24.A O no hydrogen 2.862 N/A SER 32.A N SER 85.A OG no hydrogen 2.851 N/A SER 32.A OG ASP 23.A OD1 no hydrogen 3.531 N/A TYR 34.A N HIS 20.A O no hydrogen 2.814 N/A LEU 35.A N ALA 75.A O no hydrogen 2.818 N/A VAL 37.A N VAL 73.A O no hydrogen 2.885 N/A ASN 43.A N GLY 70.A O no hydrogen 2.797 N/A ASN 43.A ND2 ALA 69.A O no hydrogen 3.118 N/A ARG 45.A N ASN 43.A OD1 no hydrogen 2.918 N/A ARG 45.A NE GLU 135.A OE2 no hydrogen 2.949 N/A ARG 45.A NH1 LEU 302.A O no hydrogen 2.840 N/A ARG 45.A NH2 SER 114.A OG no hydrogen 2.928 N/A ARG 45.A NH2 LEU 302.A O no hydrogen 3.030 N/A ILE 47.A N ARG 72.A O no hydrogen 2.832 N/A LEU 48.A N SER 114.A O no hydrogen 2.914 N/A LEU 49.A N ILE 74.A O no hydrogen 2.853 N/A HIS 50.A ND1 GLY 51.A O no hydrogen 2.717 N/A LYS 52.A NZ SER 211.A O no hydrogen 3.095 N/A LYS 52.A NZ THR 214.A OG1 no hydrogen 3.335 N/A ASN 53.A ND2 TYR 181.A OH.A no hydrogen 3.491 N/A PHE 54.A N GLY 51.A O no hydrogen 3.316 N/A CYS 55.A N THR 58.A OG1 no hydrogen 3.232 N/A ALA 56.A N ASP 77.A OD1 no hydrogen 2.784 N/A THR 58.A N CYS 55.A O no hydrogen 3.013 N/A THR 58.A OG1 CYS 55.A O no hydrogen 3.431 N/A TRP 59.A N ALA 56.A O no hydrogen 3.101 N/A GLU 60.A N GLY 57.A O no hydrogen 3.117 N/A THR 62.A OG1 HIS 295.A NE2 no hydrogen 2.705 N/A ILE 63.A N TRP 59.A O no hydrogen 2.877 N/A ASP 64.A N GLU 60.A O no hydrogen 3.022 N/A VAL 65.A N ARG 61.A O no hydrogen 2.929 N/A LEU 66.A N THR 62.A O no hydrogen 2.876 N/A ALA 67.A N ILE 63.A O no hydrogen 2.946 N/A ASP 68.A N ASP 64.A O no hydrogen 3.034 N/A ALA 69.A N VAL 65.A O no hydrogen 3.071 N/A GLY 70.A N ALA 67.A O no hydrogen 3.055 N/A TYR 71.A N LEU 66.A O no hydrogen 3.069 N/A ARG 72.A N ARG 45.A O no hydrogen 3.183 N/A ARG 72.A NE ASP 36.A OD1 no hydrogen 2.810 N/A ARG 72.A NH1 LEU 108.A O no hydrogen 2.969 N/A ARG 72.A NH2 ASP 36.A OD1 no hydrogen 3.463 N/A ARG 72.A NH2 ASP 36.A OD2 no hydrogen 2.725 N/A ARG 72.A NH2 LEU 108.A O no hydrogen 3.348 N/A VAL 73.A N VAL 37.A O no hydrogen 2.903 N/A ILE 74.A N ILE 47.A O no hydrogen 2.837 N/A ALA 75.A N LEU 35.A O no hydrogen 2.940 N/A VAL 76.A N LEU 49.A O no hydrogen 3.481 N/A ASP 77.A N ALA 33.A O no hydrogen 2.950 N/A GLN 78.A N HIS 50.A NE2 no hydrogen 3.051 N/A GLN 78.A NE2 THR 101.A OG1 no hydrogen 2.973 N/A GLY 80.A N SER 85.A O no hydrogen 2.884 N/A PHE 81.A N GLN 78.A O no hydrogen 3.009 N/A CYS 82.A SG PHE 54.A O no hydrogen 3.173 N/A LYS 83.A N ASP 77.A OD2 no hydrogen 3.000 N/A LYS 83.A NZ LEU 10.A O no hydrogen 3.127 N/A LYS 83.A NZ PHE 13.A O no hydrogen 2.762 N/A SER 84.A N PHE 81.A O no hydrogen 3.021 N/A SER 84.A OG ASP 77.A O no hydrogen 2.579 N/A SER 85.A N SER 32.A O no hydrogen 2.958 N/A SER 85.A OG SER 32.A O no hydrogen 3.445 N/A LYS 86.A NZ.A GLU 8.A O no hydrogen 3.217 N/A LYS 86.A NZ.A CYS 82.A O no hydrogen 2.710 N/A LYS 86.A NZ.A SER 84.A O no hydrogen 2.551 N/A LYS 86.A NZ.B GLU 8.A O no hydrogen 2.515 N/A LYS 86.A NZ.B CYS 82.A O no hydrogen 2.723 N/A TYR 90.A OH SER 26.A OG no hydrogen 2.735 N/A GLN 91.A N GLN 27.A OE1 no hydrogen 2.830 N/A TYR 92.A OH ASN 210.A OD1 no hydrogen 2.648 N/A GLN 95.A N GLN 95.A OE1 no hydrogen 2.781 N/A GLN 96.A N SER 93.A OG no hydrogen 3.086 N/A GLN 96.A NE2 GLN 96.A O no hydrogen 3.312 N/A GLN 96.A NE2 ASN 100.A OD1 no hydrogen 3.071 N/A LEU 97.A N SER 93.A O no hydrogen 3.123 N/A ALA 98.A N PHE 94.A O no hydrogen 2.866 N/A ALA 99.A N GLN 95.A O no hydrogen 2.840 N/A ASN 100.A N GLN 96.A O no hydrogen 2.962 N/A ASN 100.A ND2 TYR 90.A OH no hydrogen 3.111 N/A THR 101.A N LEU 97.A O no hydrogen 3.020 N/A THR 101.A OG1 LEU 97.A O no hydrogen 2.978 N/A HIS 102.A N ALA 98.A O no hydrogen 2.823 N/A HIS 102.A NE2 GLN 133.A OE1 no hydrogen 2.670 N/A ALA 103.A N ALA 99.A O no hydrogen 2.920 N/A LEU 104.A N ASN 100.A O no hydrogen 3.158 N/A LEU 105.A N THR 101.A O no hydrogen 2.918 N/A GLU 106.A N HIS 102.A O no hydrogen 2.940 N/A ARG 107.A N ALA 103.A O no hydrogen 3.157 N/A LEU 108.A N LEU 104.A O no hydrogen 3.013 N/A LEU 108.A N LEU 105.A O no hydrogen 3.171 N/A GLY 109.A N GLU 106.A O no hydrogen 3.069 N/A VAL 110.A N LEU 105.A O no hydrogen 2.974 N/A ARG 112.A NE ARG 132.A O no hydrogen 2.964 N/A ARG 112.A NH2 ARG 132.A O no hydrogen 3.120 N/A ALA 113.A N GLN 133.A O no hydrogen 3.052 N/A SER 114.A N THR 46.A O no hydrogen 2.887 N/A SER 114.A OG GLU 135.A OE2 no hydrogen 2.728 N/A VAL 115.A N ARG 136.A O no hydrogen 2.956 N/A ILE 116.A N LEU 48.A O no hydrogen 2.835 N/A GLY 117.A N VAL 138.A O no hydrogen 2.947 N/A HIS 118.A NE2 HIS 284.A O no hydrogen 2.887 N/A SER 119.A N VAL 140.A O no hydrogen 3.075 N/A SER 119.A OG HIS 284.A NE2 no hydrogen 2.952 N/A GLY 121.A N SER 119.A O no hydrogen 2.911 N/A ALA 123.A N GLY 120.A O no hydrogen 2.798 N/A THR 124.A N GLY 121.A O no hydrogen 2.953 N/A THR 124.A OG1 GLY 121.A O no hydrogen 2.866 N/A ARG 125.A NH1 GLU 225.A OE1 no hydrogen 2.913 N/A ARG 125.A NH1 GLU 225.A OE2 no hydrogen 3.490 N/A ARG 125.A NH2 PRO 221.A O no hydrogen 3.407 N/A ARG 125.A NH2 GLU 225.A OE2 no hydrogen 2.836 N/A TYR 126.A N LEU 122.A O no hydrogen 2.841 N/A ALA 127.A N ALA 123.A O no hydrogen 2.848 N/A LEU 128.A N THR 124.A O no hydrogen 2.964 N/A LEU 129.A N ARG 125.A O no hydrogen 2.910 N/A TYR 130.A N TYR 126.A O no hydrogen 2.918 N/A GLN 133.A N TYR 130.A O no hydrogen 2.957 N/A GLN 133.A NE2 ALA 111.A O no hydrogen 2.980 N/A VAL 134.A N PRO 131.A O no hydrogen 3.293 N/A GLU 135.A N ALA 113.A O no hydrogen 2.928 N/A ARG 136.A NH1 GLY 301.A O no hydrogen 2.871 N/A ARG 136.A NH2 GLY 301.A O no hydrogen 3.525 N/A LEU 137.A N PRO 231.A O no hydrogen 2.962 N/A VAL 138.A N VAL 115.A O no hydrogen 2.877 N/A LEU 139.A N LEU 233.A O no hydrogen 2.906 N/A VAL 140.A N GLY 117.A O no hydrogen 2.967 N/A ASN 141.A N LEU 235.A O no hydrogen 2.907 N/A ASN 141.A ND2 GLY 237.A O no hydrogen 3.043 N/A ASN 141.A ND2 ASP 240.A OD2 no hydrogen 2.846 N/A ILE 143.A N SER 119.A O no hydrogen 3.175 N/A LYS 149.A NZ ASP 147.A OD1 no hydrogen 3.446 N/A LYS 149.A NZ ASP 147.A OD2 no hydrogen 2.733 N/A ALA 150.A N ASP 147.A O no hydrogen 2.940 N/A LEU 151.A N ASP 147.A O no hydrogen 3.261 N/A LEU 151.A N TRP 148.A O no hydrogen 3.011 N/A GLY 152.A N LYS 149.A O no hydrogen 3.157 N/A VAL 153.A N TRP 148.A O no hydrogen 3.069 N/A ASP 160.A N SER 157.A OG no hydrogen 3.025 N/A TRP 161.A N SER 157.A O no hydrogen 2.827 N/A TYR 162.A N VAL 158.A O no hydrogen 2.884 N/A ARG 163.A N ASP 159.A O no hydrogen 3.066 N/A ARG 164.A N ASP 160.A O no hydrogen 3.065 N/A ASP 165.A N TRP 161.A O no hydrogen 2.898 N/A LEU 166.A N TYR 162.A O no hydrogen 3.197 N/A GLN 167.A N ARG 164.A O no hydrogen 3.164 N/A GLN 167.A NE2 ARG 163.A O no hydrogen 3.354 N/A GLN 167.A NE2 ARG 164.A O no hydrogen 3.658 N/A THR 168.A N ASP 165.A O no hydrogen 3.070 N/A THR 168.A OG1 ASP 165.A O no hydrogen 2.730 N/A GLY 172.A N SER 169.A OG no hydrogen 3.007 N/A ILE 173.A N SER 169.A O no hydrogen 2.848 N/A ARG 174.A N ALA 170.A O no hydrogen 2.862 N/A ARG 174.A NE GLN 178.A OE1 no hydrogen 2.995 N/A ARG 174.A NH2 GLN 178.A OE1 no hydrogen 2.864 N/A GLN 175.A N GLU 171.A O no hydrogen 3.073 N/A TYR 176.A N GLY 172.A O no hydrogen 3.083 N/A GLN 177.A N ILE 173.A O no hydrogen 2.805 N/A GLN 178.A N ARG 174.A O no hydrogen 2.866 N/A GLN 178.A NE2 GLY 184.A O no hydrogen 2.958 N/A THR 180.A N TYR 176.A O no hydrogen 2.901 N/A THR 180.A OG1 ASN 241.A OD1 no hydrogen 2.797 N/A TYR 181.A N GLN 177.A O no hydrogen 2.821 N/A TYR 182.A N GLN 177.A O no hydrogen 3.185 N/A GLY 184.A N GLN 178.A O no hydrogen 2.714 N/A GLU 185.A N TYR 182.A O no hydrogen 2.975 N/A TRP 186.A NE1 ASP 191.A OD1 no hydrogen 2.724 N/A ARG 187.A NE GLU 189.A OE2 no hydrogen 2.880 N/A ARG 187.A NH1 GLN 289.A O no hydrogen 3.005 N/A ARG 187.A NH2 ILE 288.A O no hydrogen 2.974 N/A ARG 187.A NH2 GLN 289.A O no hydrogen 3.176 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.903 N/A PHE 190.A N ARG 187.A O no hydrogen 2.913 N/A ASP 191.A N PRO 188.A O no hydrogen 3.039 N/A ARG 192.A NH2 ASP 14.A O no hydrogen 2.941 N/A TRP 193.A N PHE 190.A O no hydrogen 3.272 N/A VAL 194.A N PHE 190.A O no hydrogen 3.447 N/A GLN 195.A N ASP 191.A O no hydrogen 3.004 N/A ALA 197.A N VAL 194.A O no hydrogen 2.813 N/A GLY 198.A N GLN 195.A O no hydrogen 2.814 N/A TYR 199.A OH ASP 165.A OD2 no hydrogen 2.452 N/A ARG 200.A N GLY 198.A O no hydrogen 3.245 N/A ARG 200.A NH1 PRO 4.A O no hydrogen 2.807 N/A ARG 200.A NH1 GLN 195.A OE1 no hydrogen 2.833 N/A ARG 200.A NH2 GLN 195.A OE1 no hydrogen 2.989 N/A GLY 201.A N GLY 198.A O no hydrogen 3.407 N/A ARG 204.A N GLY 201.A O no hydrogen 3.179 N/A ARG 204.A NE TYR 199.A O no hydrogen 2.744 N/A ARG 204.A NH2 LEU 166.A O no hydrogen 2.933 N/A SER 206.A OG.B GLU 8.A OE2 no hydrogen 2.962 N/A SER 206.A OG.B LYS 86.A O no hydrogen 3.404 N/A VAL 207.A N GLY 203.A O no hydrogen 2.946 N/A ALA 208.A N ARG 204.A O no hydrogen 2.972 N/A TRP 209.A N GLU 205.A O no hydrogen 2.808 N/A ASN 210.A N SER 206.A O no hydrogen 3.065 N/A ASN 210.A ND2 PRO 87.A O no hydrogen 3.090 N/A ASN 210.A ND2 SER 206.A O no hydrogen 2.902 N/A SER 211.A N VAL 207.A O no hydrogen 2.867 N/A SER 211.A OG ASP 165.A OD1 no hydrogen 3.299 N/A SER 211.A OG ASP 165.A OD2 no hydrogen 3.051 N/A ALA 212.A N ALA 208.A O no hydrogen 2.900 N/A LEU 213.A N TRP 209.A O no hydrogen 2.955 N/A THR 214.A N ASN 210.A O no hydrogen 3.021 N/A THR 214.A OG1 ASN 210.A O no hydrogen 3.008 N/A THR 214.A OG1 SER 211.A O no hydrogen 3.106 N/A TYR 215.A N SER 211.A O no hydrogen 2.936 N/A ASP 216.A N ALA 212.A O no hydrogen 2.997 N/A PHE 218.A N TYR 215.A O no hydrogen 3.028 N/A THR 219.A N ASP 216.A O no hydrogen 2.993 N/A THR 219.A OG1 ASP 216.A O no hydrogen 2.920 N/A GLN 220.A NE2 TYR 92.A O no hydrogen 3.078 N/A TYR 224.A OH ASP 147.A OD2 no hydrogen 2.744 N/A GLU 225.A N VAL 222.A O no hydrogen 2.912 N/A LEU 226.A N VAL 223.A O no hydrogen 3.459 N/A ARG 228.A N GLU 225.A O no hydrogen 2.876 N/A ARG 228.A NH1 GLU 225.A OE1 no hydrogen 2.875 N/A LEU 229.A N LEU 226.A O no hydrogen 3.316 N/A THR 232.A N GLN 273.A O no hydrogen 2.943 N/A LEU 233.A N LEU 137.A O no hydrogen 2.910 N/A LEU 234.A N THR 275.A O no hydrogen 2.867 N/A LEU 235.A N LEU 139.A O no hydrogen 2.895 N/A ILE 236.A N VAL 277.A O no hydrogen 3.040 N/A GLY 237.A N ASN 141.A OD1 no hydrogen 2.852 N/A GLU 238.A N PHE 279.A O no hydrogen 3.000 N/A LYS 239.A N LEU 282.A O no hydrogen 2.810 N/A ASP 240.A N GLY 237.A O no hydrogen 3.350 N/A THR 242.A N ASP 240.A OD1 no hydrogen 2.957 N/A THR 242.A OG1 ASP 240.A OD1 no hydrogen 2.703 N/A THR 242.A OG1 HIS 284.A ND1 no hydrogen 3.214 N/A LYS 246.A N ALA 243.A O no hydrogen 3.307 N/A LYS 246.A NZ ASN 241.A OD1 no hydrogen 3.258 N/A ALA 248.A N GLY 245.A O no hydrogen 2.939 N/A ALA 249.A N GLY 245.A O no hydrogen 3.087 N/A ALA 249.A N LYS 246.A O no hydrogen 3.320 N/A LEU 253.A N PRO 250.A O no hydrogen 2.950 N/A LYS 254.A N PRO 250.A O no hydrogen 2.912 N/A ALA 255.A N ALA 251.A O no hydrogen 3.196 N/A ARG 256.A N LEU 253.A O no hydrogen 2.899 N/A ARG 256.A NE GLU 252.A O no hydrogen 3.301 N/A ARG 256.A NE GLU 252.A OE1 no hydrogen 3.330 N/A ARG 256.A NH2 GLU 252.A OE1 no hydrogen 3.058 N/A ARG 256.A NH2 GLU 252.A OE2 no hydrogen 3.427 N/A LEU 257.A N LEU 253.A O no hydrogen 3.166 N/A LEU 257.A N LYS 254.A O no hydrogen 3.175 N/A GLY 258.A N GLU 146.A OE2 no hydrogen 2.803 N/A TYR 260.A OH PRO 142.A O no hydrogen 2.703 N/A GLN 262.A N ASN 259.A O no hydrogen 2.919 N/A GLN 262.A NE2 ASP 266.A OD1 no hydrogen 2.598 N/A LEU 263.A N ASN 259.A O no hydrogen 2.914 N/A GLY 264.A N TYR 260.A O no hydrogen 3.242 N/A LYS 265.A NZ ALA 261.A O no hydrogen 2.692 N/A LYS 265.A NZ GLU 278.A OE2 no hydrogen 2.750 N/A ASP 266.A N GLN 262.A O no hydrogen 2.911 N/A ALA 267.A N LEU 263.A O no hydrogen 2.974 N/A ALA 268.A N GLY 264.A O no hydrogen 2.919 N/A ARG 269.A N LYS 265.A O no hydrogen 3.081 N/A ARG 270.A N ALA 267.A O no hydrogen 3.026 N/A ARG 270.A NH1 VAL 223.A O no hydrogen 2.872 N/A ARG 270.A NH2 VAL 223.A O no hydrogen 2.755 N/A ILE 271.A N ALA 267.A O no hydrogen 2.951 N/A THR 275.A N THR 232.A O no hydrogen 2.905 N/A VAL 277.A N LEU 234.A O no hydrogen 2.773 N/A PHE 279.A N ILE 236.A O no hydrogen 2.867 N/A LEU 282.A N PHE 279.A O no hydrogen 3.323 N/A GLY 283.A N GLN 289.A OE1 no hydrogen 2.948 N/A HIS 284.A N THR 180.A O no hydrogen 3.093 N/A HIS 284.A ND1 ASP 240.A OD2 no hydrogen 2.648 N/A HIS 284.A NE2 SER 119.A OG no hydrogen 2.952 N/A THR 285.A N TYR 181.A O no hydrogen 3.176 N/A GLN 287.A N GLN 287.A OE1 no hydrogen 2.729 N/A ILE 288.A N THR 285.A O no hydrogen 3.079 N/A GLN 289.A N THR 285.A O no hydrogen 2.995 N/A GLN 289.A NE2 GLU 185.A OE2 no hydrogen 3.201 N/A GLN 289.A NE2 ASP 281.A O no hydrogen 3.551 N/A ALA 290.A N PRO 286.A O no hydrogen 2.898 N/A ARG 293.A NH1 ASP 281.A OD1 no hydrogen 3.514 N/A ARG 293.A NH1 ASP 281.A OD2 no hydrogen 2.840 N/A ARG 293.A NH2 ASP 281.A OD1 no hydrogen 2.829 N/A PHE 294.A N ALA 290.A O no hydrogen 3.004 N/A HIS 295.A N PRO 291.A O no hydrogen 2.840 N/A HIS 295.A NE2 THR 62.A OG1 no hydrogen 2.705 N/A GLN 296.A N GLU 292.A O no hydrogen 3.006 N/A ALA 297.A N ARG 293.A O no hydrogen 3.219 N/A LEU 298.A N PHE 294.A O no hydrogen 2.953 N/A LEU 299.A N HIS 295.A O no hydrogen 2.930 N/A GLU 300.A N GLN 296.A O no hydrogen 3.151 N/A GLY 301.A N ALA 297.A O no hydrogen 2.817 N/A LEU 302.A N LEU 298.A O no hydrogen 2.923 N/A GLN 303.A N GLU 300.A O no hydrogen 3.205 N/A