Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7k4k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N ALA 1.A O no hydrogen 2.946 N/A ARG 4.A NE PHE 302.A O no hydrogen 3.161 N/A THR 5.A N LYS 2.A O no hydrogen 3.192 N/A THR 5.A OG1 ALA 1.A O no hydrogen 2.733 N/A ILE 6.A N ASP 44.A O no hydrogen 2.835 N/A GLY 7.A N ILE 91.A O no hydrogen 2.883 N/A ILE 8.A N LYS 46.A O no hydrogen 2.868 N/A ILE 9.A N LEU 93.A O no hydrogen 2.822 N/A GLY 10.A N GLY 49.A O no hydrogen 2.884 N/A ALA 11.A N LEU 95.A O no hydrogen 2.774 N/A PHE 13.A N ALA 11.A O no hydrogen 2.766 N/A SER 14.A OG GLU 23.A OE1 no hydrogen 3.336 N/A GLY 16.A N ASP 98.A OD2 no hydrogen 2.996 N/A GLN 17.A N SER 14.A O no hydrogen 3.133 N/A GLN 17.A NE2 SER 14.A O no hydrogen 2.792 N/A GLN 17.A NE2 ARG 19.A O no hydrogen 2.777 N/A ARG 19.A N GLN 17.A OE1 no hydrogen 3.030 N/A ARG 19.A NH1 GLY 243.A O no hydrogen 2.787 N/A GLY 21.A N GLU 23.A OE1 no hydrogen 2.972 N/A GLU 23.A N GLU 23.A OE1 no hydrogen 2.940 N/A GLU 24.A N GLY 21.A O no hydrogen 2.859 N/A GLY 25.A N VAL 22.A O no hydrogen 3.134 N/A VAL 28.A N GLU 24.A O no hydrogen 3.011 N/A LEU 29.A N GLY 25.A O no hydrogen 3.142 N/A ARG 30.A N PRO 26.A O no hydrogen 3.103 N/A ARG 30.A NE ASP 50.A OD1 no hydrogen 2.944 N/A ARG 30.A NH1 ASP 47.A OD1 no hydrogen 3.309 N/A ARG 30.A NH1 ASP 47.A OD2 no hydrogen 2.764 N/A ARG 30.A NH2 ASP 47.A OD1 no hydrogen 2.926 N/A ARG 30.A NH2 ASP 50.A OD1 no hydrogen 2.812 N/A LYS 31.A N THR 27.A O no hydrogen 2.835 N/A ALA 32.A N VAL 28.A O no hydrogen 3.054 N/A GLY 33.A N ARG 30.A O no hydrogen 2.886 N/A GLU 36.A N GLU 36.A OE1 no hydrogen 2.767 N/A LYS 37.A N GLY 33.A O no hydrogen 3.054 N/A LEU 38.A N LEU 34.A O no hydrogen 2.921 N/A LYS 39.A N LEU 35.A O no hydrogen 2.938 N/A GLU 40.A N GLU 36.A O no hydrogen 3.083 N/A GLN 41.A N LEU 38.A O no hydrogen 3.126 N/A GLN 41.A NE2 LEU 299.A O no hydrogen 3.013 N/A GLN 41.A NE2 PHE 302.A O no hydrogen 3.228 N/A CYS 43.A N LEU 38.A O no hydrogen 3.235 N/A CYS 43.A SG GLN 41.A O no hydrogen 3.875 N/A CYS 43.A SG PHE 302.A O no hydrogen 3.851 N/A ASP 44.A N ARG 4.A O no hydrogen 2.770 N/A LYS 46.A N ILE 6.A O no hydrogen 2.942 N/A LYS 46.A NZ ASN 88.A OD1 no hydrogen 3.467 N/A TYR 48.A N ILE 8.A O no hydrogen 2.805 N/A GLY 49.A N ASP 47.A OD1 no hydrogen 3.176 N/A LEU 51.A N GLY 10.A O no hydrogen 2.790 N/A PHE 62.A N VAL 65.A O no hydrogen 2.896 N/A VAL 65.A N PHE 62.A O no hydrogen 2.761 N/A LYS 66.A N GLY 136.A O no hydrogen 2.908 N/A LYS 66.A NZ SER 135.A O no hydrogen 2.817 N/A LYS 66.A NZ ASN 137.A OD1 no hydrogen 3.196 N/A ASN 67.A ND2 LYS 15.A O no hydrogen 3.029 N/A ARG 69.A N ASP 59.A OD1 no hydrogen 3.093 N/A SER 70.A N ASP 59.A OD2 no hydrogen 2.838 N/A SER 70.A OG ASP 59.A OD2 no hydrogen 2.704 N/A VAL 71.A N ASN 67.A O no hydrogen 3.203 N/A GLY 72.A N PRO 68.A O no hydrogen 2.845 N/A LYS 73.A N ARG 69.A O no hydrogen 2.846 N/A LYS 73.A NZ GLU 76.A OE1 no hydrogen 3.359 N/A ALA 74.A N SER 70.A O no hydrogen 2.953 N/A SER 75.A N VAL 71.A O no hydrogen 3.144 N/A SER 75.A OG SER 100.A O no hydrogen 3.159 N/A GLU 76.A N GLY 72.A O no hydrogen 3.081 N/A GLN 77.A N LYS 73.A O no hydrogen 2.873 N/A GLN 77.A NE2 PRO 52.A O no hydrogen 2.764 N/A LEU 78.A N ALA 74.A O no hydrogen 3.020 N/A ALA 79.A N SER 75.A O no hydrogen 2.796 N/A GLY 80.A N GLU 76.A O no hydrogen 3.415 N/A LYS 81.A N GLN 77.A O no hydrogen 3.197 N/A LYS 81.A NZ GLU 84.A OE1 no hydrogen 2.828 N/A VAL 82.A N LEU 78.A O no hydrogen 2.848 N/A ALA 83.A N ALA 79.A O no hydrogen 3.023 N/A GLU 84.A N GLY 80.A O no hydrogen 3.179 N/A VAL 85.A N LYS 81.A O no hydrogen 3.170 N/A LYS 86.A N VAL 82.A O no hydrogen 2.969 N/A LYS 86.A NZ ARG 90.A O no hydrogen 2.806 N/A LYS 86.A NZ SER 269.A O no hydrogen 2.802 N/A LYS 87.A N ALA 83.A O no hydrogen 2.978 N/A ASN 88.A N VAL 85.A O no hydrogen 3.058 N/A GLY 89.A N LYS 86.A O no hydrogen 3.025 N/A ARG 90.A N VAL 85.A O no hydrogen 3.419 N/A ARG 90.A NH1 ILE 6.A O no hydrogen 3.212 N/A ARG 90.A NH1 ASP 44.A OD1 no hydrogen 2.927 N/A ARG 90.A NH2 ASP 44.A OD1 no hydrogen 3.128 N/A ILE 91.A N THR 5.A O no hydrogen 2.819 N/A SER 92.A N SER 269.A O no hydrogen 3.374 N/A LEU 93.A N GLY 7.A O no hydrogen 2.958 N/A VAL 94.A N LEU 271.A O no hydrogen 2.839 N/A LEU 95.A N ILE 9.A O no hydrogen 2.913 N/A GLY 96.A N ILE 273.A O no hydrogen 2.858 N/A GLY 97.A N VAL 22.A O no hydrogen 2.933 N/A ASP 98.A N PHE 13.A O no hydrogen 3.141 N/A HIS 99.A N GLU 275.A OE2 no hydrogen 2.928 N/A HIS 99.A NE2 SER 228.A OG no hydrogen 2.799 N/A SER 100.A N ASP 98.A OD1 no hydrogen 3.109 N/A SER 100.A OG ASP 98.A OD1 no hydrogen 2.554 N/A LEU 101.A N ASP 98.A O no hydrogen 3.423 N/A ALA 102.A N HIS 99.A O no hydrogen 3.024 N/A ILE 103.A N SER 100.A O no hydrogen 3.082 N/A GLY 104.A N SER 75.A OG no hydrogen 3.305 N/A SER 105.A N LEU 101.A O no hydrogen 2.887 N/A SER 105.A OG ASP 272.A OD1 no hydrogen 2.648 N/A ILE 106.A N ALA 102.A O no hydrogen 3.071 N/A SER 107.A N ILE 103.A O no hydrogen 3.104 N/A SER 107.A OG ILE 103.A O no hydrogen 2.871 N/A GLY 108.A N GLY 104.A O no hydrogen 2.948 N/A HIS 109.A N SER 105.A O no hydrogen 3.198 N/A HIS 109.A ND1 HIS 226.A ND1 no hydrogen 2.868 N/A HIS 109.A NE2 SER 269.A OG no hydrogen 2.803 N/A ALA 110.A N ILE 106.A O no hydrogen 2.835 N/A ARG 111.A N SER 107.A O no hydrogen 3.188 N/A VAL 112.A N HIS 109.A O no hydrogen 3.184 N/A HIS 113.A N HIS 109.A O no hydrogen 2.891 N/A LEU 116.A N HIS 113.A O no hydrogen 3.135 N/A GLY 117.A N PRO 224.A O no hydrogen 2.893 N/A VAL 118.A N ASP 171.A O no hydrogen 2.865 N/A ILE 119.A N HIS 226.A O no hydrogen 2.815 N/A TRP 120.A N VAL 173.A O no hydrogen 2.795 N/A TRP 120.A NE1 ASP 122.A OD2 no hydrogen 2.944 N/A VAL 121.A N SER 228.A O no hydrogen 2.864 N/A ASP 122.A N ILE 175.A O no hydrogen 3.010 N/A ALA 123.A N ASP 232.A OD1 no hydrogen 3.356 N/A HIS 124.A N ASP 122.A OD1 no hydrogen 3.012 N/A HIS 124.A ND1 ASP 122.A OD1 no hydrogen 2.995 N/A THR 125.A OG1 GLU 184.A OE2 no hydrogen 2.657 N/A ILE 127.A N GLU 184.A OE2 no hydrogen 3.142 N/A ASN 128.A N GLY 140.A O no hydrogen 3.199 N/A ASN 128.A ND2 ASP 181.A OD2 no hydrogen 2.776 N/A THR 129.A N THR 132.A OG1 no hydrogen 2.843 N/A LEU 131.A N THR 129.A OG1 no hydrogen 3.085 N/A THR 132.A N THR 129.A O no hydrogen 3.068 N/A THR 132.A N THR 129.A OG1 no hydrogen 3.196 N/A THR 132.A OG1 ASN 128.A OD1 no hydrogen 2.704 N/A THR 133.A N THR 129.A O no hydrogen 3.090 N/A GLY 136.A N THR 133.A OG1 no hydrogen 2.895 N/A ASN 137.A N SER 135.A OG no hydrogen 3.197 N/A HIS 139.A N GLY 16.A O no hydrogen 2.826 N/A HIS 139.A ND1 GLU 275.A OE2 no hydrogen 2.862 N/A GLY 140.A N ASN 137.A O no hydrogen 3.203 N/A GLN 141.A N LEU 138.A O no hydrogen 2.983 N/A GLN 141.A NE2 ASN 137.A O no hydrogen 3.212 N/A VAL 143.A N ASP 126.A O no hydrogen 3.083 N/A SER 144.A OG ASN 128.A O no hydrogen 3.011 N/A SER 144.A OG GLN 141.A O no hydrogen 2.697 N/A PHE 145.A N PRO 142.A O no hydrogen 3.001 N/A LEU 146.A N VAL 143.A O no hydrogen 2.989 N/A LEU 147.A N VAL 143.A O no hydrogen 2.949 N/A LYS 148.A N ILE 167.A O no hydrogen 2.878 N/A LYS 148.A NZ CYS 166.A O no hydrogen 3.004 N/A GLU 149.A N GLU 149.A OE1 no hydrogen 2.806 N/A LEU 150.A N LEU 147.A O no hydrogen 3.067 N/A LYS 151.A N LYS 148.A O no hydrogen 3.099 N/A LYS 153.A N LEU 150.A O no hydrogen 3.000 N/A PHE 160.A N VAL 157.A O no hydrogen 3.201 N/A VAL 163.A N PHE 160.A O no hydrogen 3.081 N/A CYS 166.A N LEU 146.A O no hydrogen 2.930 N/A ILE 167.A N LEU 146.A O no hydrogen 3.044 N/A SER 168.A N ASP 171.A OD2 no hydrogen 3.281 N/A SER 168.A OG ASP 171.A OD2 no hydrogen 3.449 N/A ALA 169.A N GLU 149.A OE1 no hydrogen 2.787 N/A ALA 169.A N GLU 149.A OE2 no hydrogen 3.279 N/A LYS 170.A NZ SER 168.A OG no hydrogen 3.290 N/A ASP 171.A N SER 168.A O no hydrogen 2.898 N/A VAL 173.A N VAL 118.A O no hydrogen 2.843 N/A TYR 174.A N LYS 194.A O no hydrogen 3.302 N/A TYR 174.A OH THR 125.A O no hydrogen 2.733 N/A ILE 175.A N TRP 120.A O no hydrogen 2.814 N/A GLY 176.A N PHE 196.A O no hydrogen 2.988 N/A ARG 178.A N ALA 123.A O no hydrogen 2.859 N/A ARG 178.A NE VAL 246.A O no hydrogen 2.912 N/A ARG 178.A NH1 GLY 176.A O no hydrogen 2.902 N/A ARG 178.A NH1 GLY 233.A O no hydrogen 2.943 N/A ARG 178.A NH2 ASP 232.A O no hydrogen 2.660 N/A ARG 178.A NH2 GLY 233.A O no hydrogen 3.557 N/A ARG 178.A NH2 LEU 234.A O no hydrogen 3.270 N/A ARG 178.A NH2 VAL 246.A O no hydrogen 2.931 N/A ASP 179.A N ALA 123.A O no hydrogen 3.064 N/A ASP 181.A N GLU 184.A OE1 no hydrogen 2.946 N/A HIS 185.A N ASP 181.A O no hydrogen 2.879 N/A TYR 186.A N PRO 182.A O no hydrogen 2.823 N/A ILE 187.A N GLY 183.A O no hydrogen 2.989 N/A LEU 188.A N GLU 184.A O no hydrogen 2.927 N/A LYS 189.A N HIS 185.A O no hydrogen 3.222 N/A LYS 189.A NZ TYR 195.A OH no hydrogen 2.937 N/A THR 190.A N TYR 186.A O no hydrogen 3.064 N/A THR 190.A OG1 TYR 186.A O no hydrogen 2.923 N/A THR 190.A OG1 ILE 187.A O no hydrogen 3.553 N/A LEU 191.A N ILE 187.A O no hydrogen 3.030 N/A ILE 193.A N LEU 188.A O no hydrogen 3.107 N/A LYS 194.A NZ GLU 212.A OE1 no hydrogen 3.224 N/A PHE 196.A N TYR 174.A O no hydrogen 2.783 N/A SER 197.A N GLU 200.A OE1 no hydrogen 2.911 N/A SER 197.A OG GLU 200.A OE1 no hydrogen 2.715 N/A MET 198.A N LEU 177.A O no hydrogen 2.787 N/A THR 199.A N SER 197.A OG no hydrogen 3.297 N/A GLU 200.A N SER 197.A O no hydrogen 2.916 N/A VAL 201.A N SER 197.A O no hydrogen 3.189 N/A ASP 202.A N MET 198.A O no hydrogen 2.855 N/A ARG 203.A N THR 199.A O no hydrogen 2.987 N/A ARG 203.A NH2 GLU 200.A OE2 no hydrogen 3.310 N/A LEU 204.A N GLU 200.A O no hydrogen 2.837 N/A GLY 205.A N VAL 201.A O no hydrogen 2.858 N/A VAL 209.A N GLY 205.A O no hydrogen 3.180 N/A MET 210.A N ILE 206.A O no hydrogen 3.183 N/A GLU 211.A N GLY 207.A O no hydrogen 3.048 N/A GLU 212.A N LYS 208.A O no hydrogen 2.929 N/A THR 213.A N VAL 209.A O no hydrogen 2.762 N/A THR 213.A OG1 VAL 209.A O no hydrogen 2.797 N/A LEU 214.A N MET 210.A O no hydrogen 3.083 N/A SER 215.A N GLU 211.A O no hydrogen 3.012 N/A SER 215.A OG GLU 211.A O no hydrogen 3.510 N/A SER 215.A OG GLU 212.A O no hydrogen 3.504 N/A TYR 216.A N GLU 212.A O no hydrogen 3.048 N/A TYR 216.A OH LYS 170.A O no hydrogen 3.202 N/A LEU 217.A N THR 213.A O no hydrogen 3.312 N/A LEU 218.A N LEU 214.A O no hydrogen 2.867 N/A GLY 219.A N SER 215.A O no hydrogen 2.883 N/A ARG 223.A NE ASP 115.A O no hydrogen 2.860 N/A ARG 223.A NH1 LEU 217.A O no hydrogen 2.809 N/A ARG 223.A NH2 ASP 115.A O no hydrogen 3.372 N/A ARG 223.A NH2 LEU 116.A O no hydrogen 3.269 N/A ARG 223.A NH2 ASP 171.A OD1 no hydrogen 2.857 N/A ILE 225.A N LEU 267.A O no hydrogen 2.903 N/A HIS 226.A N GLY 117.A O no hydrogen 2.826 N/A HIS 226.A ND1 HIS 109.A ND1 no hydrogen 2.868 N/A HIS 226.A NE2 ASP 272.A OD2 no hydrogen 2.801 N/A LEU 227.A N GLY 270.A O no hydrogen 2.864 N/A SER 228.A N ILE 119.A O no hydrogen 2.758 N/A SER 228.A OG HIS 99.A NE2 no hydrogen 2.799 N/A SER 228.A OG ASP 272.A OD2 no hydrogen 2.703 N/A PHE 229.A N ASP 272.A O no hydrogen 2.997 N/A ASP 230.A N VAL 121.A O no hydrogen 2.800 N/A VAL 231.A N MET 274.A O no hydrogen 3.042 N/A ASP 232.A N ASP 230.A OD1 no hydrogen 3.024 N/A GLY 233.A N ASP 230.A O no hydrogen 2.933 N/A LEU 234.A N VAL 231.A O no hydrogen 3.191 N/A ASP 235.A N LEU 250.A O no hydrogen 2.817 N/A SER 237.A N ASP 235.A OD2 no hydrogen 3.061 N/A SER 237.A OG ASP 235.A OD2 no hydrogen 2.692 N/A PHE 238.A N ASP 235.A O no hydrogen 2.833 N/A THR 239.A N ASP 235.A O no hydrogen 3.177 N/A THR 239.A OG1 VAL 231.A O no hydrogen 2.730 N/A ALA 241.A N THR 290.A OG1 no hydrogen 2.840 N/A THR 242.A N PRO 240.A O no hydrogen 2.854 N/A THR 242.A OG1 GLU 275.A O no hydrogen 2.834 N/A THR 244.A OG1 ASP 232.A OD2 no hydrogen 3.047 N/A GLY 249.A N ASP 235.A OD1 no hydrogen 2.783 N/A LEU 250.A N GLY 233.A O no hydrogen 3.203 N/A THR 251.A N GLU 254.A OE1 no hydrogen 2.755 N/A THR 251.A OG1 GLU 254.A OE1 no hydrogen 3.307 N/A GLU 254.A N THR 251.A OG1 no hydrogen 3.219 N/A GLY 255.A N THR 251.A O no hydrogen 3.148 N/A LEU 256.A N TYR 252.A O no hydrogen 3.214 N/A TYR 257.A N ARG 253.A O no hydrogen 2.795 N/A ILE 258.A N GLU 254.A O no hydrogen 2.943 N/A THR 259.A N GLY 255.A O no hydrogen 3.177 N/A THR 259.A OG1 GLY 255.A O no hydrogen 3.087 N/A THR 259.A OG1 LEU 256.A O no hydrogen 3.252 N/A GLU 260.A N LEU 256.A O no hydrogen 2.732 N/A GLU 261.A N TYR 257.A O no hydrogen 2.938 N/A ILE 262.A N ILE 258.A O no hydrogen 3.051 N/A TYR 263.A N THR 259.A O no hydrogen 2.999 N/A LYS 264.A N GLU 260.A O no hydrogen 3.190 N/A LYS 264.A NZ GLU 261.A OE2 no hydrogen 3.296 N/A THR 265.A OG1 ILE 262.A O no hydrogen 2.650 N/A GLY 266.A N TYR 263.A O no hydrogen 2.889 N/A LEU 267.A N THR 265.A OG1 no hydrogen 3.224 N/A SER 269.A N ILE 225.A O no hydrogen 2.786 N/A SER 269.A OG HIS 109.A NE2 no hydrogen 2.803 N/A GLY 270.A N ILE 225.A O no hydrogen 3.213 N/A LEU 271.A N SER 92.A O no hydrogen 2.826 N/A ASP 272.A N LEU 227.A O no hydrogen 3.092 N/A ILE 273.A N VAL 94.A O no hydrogen 2.888 N/A MET 274.A N PHE 229.A O no hydrogen 2.920 N/A GLU 275.A N GLY 97.A O no hydrogen 3.081 N/A ASN 277.A N ALA 241.A O no hydrogen 2.789 N/A ASN 277.A ND2 ARG 19.A O no hydrogen 3.616 N/A ASN 277.A ND2 GLY 20.A O no hydrogen 3.139 N/A SER 279.A N ASN 277.A OD1 no hydrogen 2.996 N/A SER 279.A OG ASN 277.A OD1 no hydrogen 3.040 N/A LEU 280.A N ASN 277.A O no hydrogen 3.160 N/A LYS 282.A N GLU 286.A OE1 no hydrogen 2.993 N/A GLU 286.A N THR 283.A O no hydrogen 2.880 N/A GLU 286.A N THR 283.A OG1 no hydrogen 3.168 N/A THR 288.A N PRO 284.A O no hydrogen 3.071 N/A THR 288.A OG1 GLU 285.A O no hydrogen 3.095 N/A ARG 289.A N GLU 285.A O no hydrogen 2.820 N/A ARG 289.A NE GLU 285.A OE2 no hydrogen 3.122 N/A ARG 289.A NH1 SER 237.A O no hydrogen 2.812 N/A ARG 289.A NH2 GLU 285.A OE1 no hydrogen 2.754 N/A THR 290.A N GLU 286.A O no hydrogen 3.001 N/A THR 290.A OG1 GLU 286.A O no hydrogen 2.926 N/A VAL 291.A N VAL 287.A O no hydrogen 2.986 N/A ASN 292.A N THR 288.A O no hydrogen 2.929 N/A THR 293.A N ARG 289.A O no hydrogen 3.155 N/A THR 293.A OG1 PHE 238.A O no hydrogen 3.162 N/A THR 293.A OG1 ARG 289.A O no hydrogen 2.676 N/A ALA 294.A N THR 290.A O no hydrogen 2.921 N/A VAL 295.A N VAL 291.A O no hydrogen 2.837 N/A ALA 296.A N ASN 292.A O no hydrogen 3.005 N/A ILE 297.A N THR 293.A O no hydrogen 3.089 N/A THR 298.A N ALA 294.A O no hydrogen 3.254 N/A THR 298.A OG1 ALA 294.A O no hydrogen 2.763 N/A LEU 299.A N VAL 295.A O no hydrogen 2.875 N/A ALA 300.A N ALA 296.A O no hydrogen 3.147 N/A CYS 301.A N ILE 297.A O no hydrogen 3.260 N/A CYS 301.A N THR 298.A O no hydrogen 3.166 N/A CYS 301.A SG ILE 297.A O no hydrogen 3.343 N/A PHE 302.A N LEU 299.A O no hydrogen 3.145 N/A LEU 304.A N LEU 299.A O no hydrogen 3.065 N/A ALA 305.A N ASN 309.A OD1 no hydrogen 2.872 N/A ARG 306.A N GLU 260.A OE2 no hydrogen 3.228 N/A ARG 306.A NE GLU 260.A OE2 no hydrogen 3.055 N/A ARG 306.A NH2 GLU 260.A OE1 no hydrogen 2.855 N/A GLY 308.A N ALA 305.A O no hydrogen 2.916 N/A ASN 309.A ND2 GLY 303.A O no hydrogen 2.803 N/A LYS 311.A N TYR 315.A OH no hydrogen 2.839 N/A LYS 311.A NZ GLU 42.A OE1 no hydrogen 2.884 N/A ILE 313.A N LYS 311.A O no hydrogen 2.732 N/A