Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4a78_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ASP 60.A O no hydrogen 3.173 N/A ALA 7.A N THR 274.A O no hydrogen 2.846 N/A SER 8.A N GLY 128.A O no hydrogen 2.832 N/A GLU 10.A N GLU 10.A OE1 no hydrogen 2.717 N/A ARG 13.A N GLU 10.A O no hydrogen 3.029 N/A ARG 13.A NH1 ASP 17.A OD1 no hydrogen 3.016 N/A SER 14.A N ASP 17.A OD2 no hydrogen 2.735 N/A SER 14.A OG ASP 17.A OD2 no hydrogen 3.509 N/A TYR 15.A OH ILE 284.A O no hydrogen 2.826 N/A ASP 17.A N SER 14.A O no hydrogen 2.919 N/A PHE 18.A N SER 14.A O no hydrogen 3.410 N/A GLN 19.A N TYR 15.A O no hydrogen 2.903 N/A LYS 20.A N GLU 16.A O no hydrogen 3.358 N/A VAL 21.A N ASP 17.A O no hydrogen 3.304 N/A TYR 22.A N PHE 18.A O no hydrogen 2.861 N/A TYR 22.A OH GLU 117.A OE2 no hydrogen 2.636 N/A ASN 23.A N GLN 19.A O no hydrogen 2.736 N/A ASN 23.A ND2 GLN 19.A OE1 no hydrogen 3.214 N/A ASN 23.A ND2 GLN 291.A OE1 no hydrogen 2.894 N/A ALA 24.A N LYS 20.A O no hydrogen 2.843 N/A ILE 25.A N VAL 21.A O no hydrogen 2.961 N/A ALA 26.A N TYR 22.A O no hydrogen 2.941 N/A LEU 27.A N ASN 23.A O no hydrogen 2.745 N/A LYS 28.A N ALA 24.A O no hydrogen 3.049 N/A LYS 28.A NZ ASP 32.A OD2 no hydrogen 2.812 N/A LEU 29.A N ILE 25.A O no hydrogen 2.854 N/A ARG 30.A N ALA 26.A O no hydrogen 3.057 N/A ARG 30.A NH1 LEU 293.A O no hydrogen 3.411 N/A ARG 30.A NH1 LEU 293.A OXT no hydrogen 2.642 N/A ARG 30.A NH2 LEU 293.A O no hydrogen 3.028 N/A GLU 31.A N LEU 27.A O no hydrogen 2.970 N/A ASP 32.A N LYS 28.A O no hydrogen 2.792 N/A ALA 38.A N GLU 34.A O no hydrogen 3.029 N/A ILE 39.A N ASP 36.A O no hydrogen 3.162 N/A GLY 40.A N TYR 35.A O no hydrogen 2.884 N/A LEU 45.A N TYR 41.A O no hydrogen 3.058 N/A VAL 46.A N GLY 42.A O no hydrogen 3.121 N/A ARG 47.A N PRO 43.A O no hydrogen 2.906 N/A ARG 47.A NH1 SER 80.A O no hydrogen 3.431 N/A LEU 48.A N VAL 44.A O no hydrogen 2.802 N/A ALA 49.A N LEU 45.A O no hydrogen 2.971 N/A TRP 50.A N VAL 46.A O no hydrogen 3.090 N/A HIS 51.A N ARG 47.A O no hydrogen 2.857 N/A HIS 51.A ND1 ASN 81.A OD1 no hydrogen 2.898 N/A THR 52.A N LEU 48.A O no hydrogen 2.954 N/A THR 52.A OG1 LEU 48.A O no hydrogen 2.734 N/A THR 52.A OG1 ALA 49.A O no hydrogen 3.258 N/A SER 53.A N ALA 49.A O no hydrogen 3.195 N/A SER 53.A OG ALA 49.A O no hydrogen 2.666 N/A GLY 54.A N TRP 50.A O no hydrogen 2.653 N/A TRP 56.A N SER 53.A O no hydrogen 3.200 N/A TRP 56.A NE1 ASN 61.A OD1 no hydrogen 2.701 N/A ASP 57.A N THR 62.A O no hydrogen 2.987 N/A LYS 58.A N ARG 159.A O no hydrogen 3.137 N/A LYS 58.A NZ GLN 158.A O no hydrogen 2.873 N/A HIS 59.A N ASP 57.A OD1 no hydrogen 2.997 N/A ASN 61.A ND2 LEU 3.A O no hydrogen 2.814 N/A ASN 61.A ND2 GLY 272.A O no hydrogen 2.959 N/A THR 62.A N ASP 60.A OD1 no hydrogen 3.215 N/A THR 62.A OG1 ASP 60.A OD1 no hydrogen 2.816 N/A GLY 64.A N THR 55.A OG1 no hydrogen 3.002 N/A SER 65.A OG LEU 269.A O no hydrogen 2.709 N/A TYR 66.A OH VAL 6.A O no hydrogen 2.580 N/A THR 69.A OG1 GLU 75.A OE1 no hydrogen 2.509 N/A ARG 71.A N GLY 68.A O no hydrogen 3.412 N/A ARG 71.A NH1 GLY 67.A O no hydrogen 2.719 N/A ARG 71.A NH1 GLY 68.A O no hydrogen 3.037 N/A ARG 71.A NH1 THR 132.A O no hydrogen 3.347 N/A ARG 71.A NH2 THR 132.A O no hydrogen 2.870 N/A PHE 72.A N THR 69.A O no hydrogen 2.944 N/A LYS 74.A NZ THR 137.A O no hydrogen 2.735 N/A LYS 74.A NZ ASP 139.A OD1 no hydrogen 2.847 N/A GLU 75.A N PHE 72.A O no hydrogen 2.993 N/A PHE 76.A N PHE 72.A O no hydrogen 3.048 N/A ASN 77.A N LYS 73.A O no hydrogen 2.860 N/A ASP 78.A N GLU 75.A O no hydrogen 3.149 N/A SER 80.A N ASP 78.A OD1 no hydrogen 2.950 N/A ASN 81.A N ASP 78.A O no hydrogen 2.876 N/A ASN 81.A ND2 GLU 75.A O no hydrogen 2.699 N/A ALA 82.A N PRO 79.A O no hydrogen 3.226 N/A LEU 84.A N ASN 81.A O no hydrogen 2.931 N/A ASN 86.A N GLY 83.A O no hydrogen 3.263 N/A ASN 86.A ND2 GLY 83.A O no hydrogen 2.983 N/A PHE 88.A N LEU 84.A O no hydrogen 3.067 N/A LYS 89.A N GLN 85.A O no hydrogen 2.809 N/A LYS 89.A NZ GLU 92.A OE1 no hydrogen 3.113 N/A PHE 90.A N ASN 86.A O no hydrogen 2.922 N/A LEU 91.A N GLY 87.A O no hydrogen 3.134 N/A LEU 91.A N PHE 88.A O no hydrogen 3.091 N/A GLU 92.A N LYS 89.A O no hydrogen 3.306 N/A HIS 95.A N LEU 91.A O no hydrogen 2.907 N/A LYS 96.A N GLU 92.A O no hydrogen 2.906 N/A GLU 97.A N PRO 93.A O no hydrogen 2.899 N/A PHE 98.A N ILE 94.A O no hydrogen 2.828 N/A ILE 101.A N PHE 98.A O no hydrogen 3.212 N/A SER 102.A N GLU 10.A OE2 no hydrogen 3.139 N/A SER 102.A OG GLU 10.A OE2 no hydrogen 3.477 N/A SER 102.A OG ARG 129.A O no hydrogen 2.488 N/A SER 103.A N ASP 131.A OD1 no hydrogen 2.985 N/A SER 103.A OG ASP 131.A OD2 no hydrogen 3.547 N/A ASP 105.A N SER 102.A OG no hydrogen 3.197 N/A LEU 106.A N SER 102.A O no hydrogen 2.914 N/A PHE 107.A N SER 103.A O no hydrogen 2.771 N/A SER 108.A N GLY 104.A O no hydrogen 3.111 N/A SER 108.A OG GLY 104.A O no hydrogen 2.768 N/A SER 108.A OG ASP 105.A O no hydrogen 3.151 N/A LEU 109.A N ASP 105.A O no hydrogen 2.949 N/A GLY 110.A N LEU 106.A O no hydrogen 2.990 N/A VAL 112.A N SER 108.A O no hydrogen 3.207 N/A THR 113.A N LEU 109.A O no hydrogen 2.867 N/A THR 113.A OG1 LEU 109.A O no hydrogen 2.860 N/A ALA 114.A N GLY 110.A O no hydrogen 3.000 N/A VAL 115.A N GLY 111.A O no hydrogen 3.072 N/A GLN 116.A N VAL 112.A O no hydrogen 3.100 N/A GLN 116.A NE2 TYR 22.A OH no hydrogen 3.322 N/A GLN 116.A NE2 PHE 285.A O no hydrogen 2.948 N/A GLU 117.A N THR 113.A O no hydrogen 2.785 N/A TRP 118.A N ALA 114.A O no hydrogen 2.926 N/A GLN 119.A N GLN 116.A O no hydrogen 3.049 N/A GLN 119.A NE2 GLU 117.A O no hydrogen 3.472 N/A GLY 120.A N VAL 115.A O no hydrogen 2.915 N/A LYS 122.A NZ PHE 285.A O no hydrogen 2.823 N/A LYS 122.A NZ GLU 290.A OE1 no hydrogen 2.762 N/A LYS 122.A NZ GLU 290.A OE2 no hydrogen 3.449 N/A ILE 123.A N GLN 116.A OE1 no hydrogen 2.914 N/A TRP 125.A N PHE 283.A O no hydrogen 2.927 N/A TRP 125.A NE1 SER 108.A OG no hydrogen 3.021 N/A ARG 126.A NH2 PRO 280.A O no hydrogen 3.004 N/A GLY 128.A N ASP 105.A OD2 no hydrogen 2.898 N/A ARG 129.A N ASP 105.A OD1 no hydrogen 3.105 N/A ARG 129.A NE SER 65.A OG no hydrogen 2.980 N/A ARG 129.A NE LEU 269.A O no hydrogen 3.430 N/A ARG 129.A NH1 ASP 105.A OD1 no hydrogen 2.947 N/A ARG 129.A NH1 ARG 126.A O no hydrogen 2.633 N/A ARG 129.A NH2 LEU 269.A O no hydrogen 2.903 N/A THR 132.A N GLY 67.A O no hydrogen 3.135 N/A THR 132.A OG1 THR 136.A OG1 no hydrogen 2.774 N/A THR 136.A N PRO 133.A O no hydrogen 3.085 N/A THR 136.A OG1 THR 132.A OG1 no hydrogen 2.774 N/A THR 136.A OG1 PRO 133.A O no hydrogen 2.656 N/A THR 137.A N GLU 134.A O no hydrogen 3.239 N/A THR 137.A OG1 GLU 134.A O no hydrogen 2.779 N/A ARG 142.A NH1 THR 55.A O no hydrogen 2.943 N/A ARG 142.A NH1 THR 62.A OG1 no hydrogen 2.893 N/A ARG 142.A NH2 THR 62.A OG1 no hydrogen 3.012 N/A ASP 145.A N TYR 152.A OH no hydrogen 2.826 N/A LYS 148.A NZ ASP 145.A OD2 no hydrogen 2.752 N/A LYS 148.A NZ ASP 147.A OD1 no hydrogen 2.939 N/A TYR 152.A N ASP 149.A OD1 no hydrogen 3.158 N/A VAL 153.A N ASP 149.A O no hydrogen 3.110 N/A ARG 154.A N ALA 150.A O no hydrogen 2.868 N/A ARG 154.A NE ASP 164.A OD1 no hydrogen 2.866 N/A ARG 154.A NH1 ASP 240.A OD2 no hydrogen 2.889 N/A ARG 154.A NH2 ASP 164.A OD2 no hydrogen 3.237 N/A ARG 154.A NH2 ASP 240.A OD1 no hydrogen 2.952 N/A ARG 154.A NH2 ASP 240.A OD2 no hydrogen 3.425 N/A THR 155.A N ASP 151.A O no hydrogen 3.014 N/A THR 155.A OG1 ASP 151.A O no hydrogen 3.001 N/A PHE 156.A N TYR 152.A O no hydrogen 2.698 N/A PHE 157.A N VAL 153.A O no hydrogen 3.047 N/A GLN 158.A N ARG 154.A O no hydrogen 3.317 N/A GLN 158.A N THR 155.A O no hydrogen 3.215 N/A ARG 159.A N PHE 156.A O no hydrogen 3.195 N/A ARG 159.A NE TRP 56.A O no hydrogen 2.767 N/A ARG 159.A NH1 ARG 142.A O no hydrogen 3.017 N/A ARG 159.A NH2 TRP 56.A O no hydrogen 2.862 N/A ARG 159.A NH2 ARG 142.A O no hydrogen 3.151 N/A LEU 160.A N PHE 157.A O no hydrogen 2.900 N/A ASN 161.A N GLN 158.A O no hydrogen 3.129 N/A MET 162.A N PHE 157.A O no hydrogen 3.137 N/A ASN 163.A N GLU 166.A OE1 no hydrogen 2.672 N/A ARG 165.A NH1 GLU 249.A OE1 no hydrogen 2.862 N/A ARG 165.A NH2 GLU 249.A OE1 no hydrogen 3.326 N/A ARG 165.A NH2 GLU 249.A OE2 no hydrogen 2.817 N/A ARG 165.A NH2 ASP 260.A OD2 no hydrogen 2.915 N/A GLU 166.A N ASN 163.A OD1 no hydrogen 3.020 N/A VAL 167.A N ASN 163.A O no hydrogen 2.923 N/A VAL 168.A N ASP 164.A O no hydrogen 2.905 N/A ALA 169.A N ARG 165.A O no hydrogen 2.839 N/A LEU 170.A N GLU 166.A O no hydrogen 2.855 N/A MET 171.A N VAL 167.A O no hydrogen 3.052 N/A GLY 172.A N ALA 169.A O no hydrogen 3.195 N/A ALA 173.A N LEU 170.A O no hydrogen 2.997 N/A HIS 174.A N MET 171.A O no hydrogen 2.936 N/A HIS 174.A ND1 ASP 234.A OD1 no hydrogen 2.826 N/A ALA 175.A N GLY 172.A O no hydrogen 3.286 N/A LEU 176.A N ALA 173.A O no hydrogen 2.979 N/A LYS 178.A NZ THR 179.A O no hydrogen 2.848 N/A LYS 178.A NZ GLU 187.A OE2 no hydrogen 2.816 N/A THR 179.A N GLY 188.A O no hydrogen 2.951 N/A THR 179.A OG1 GLY 188.A O no hydrogen 3.033 N/A HIS 180.A NE2 ASP 36.A OD2 no hydrogen 2.562 N/A LEU 181.A N GLU 187.A OE1 no hydrogen 2.813 N/A ASN 183.A N HIS 180.A O no hydrogen 2.852 N/A SER 184.A N HIS 180.A O no hydrogen 3.175 N/A GLY 185.A N LEU 181.A O no hydrogen 2.919 N/A GLY 188.A N THR 179.A O no hydrogen 3.199 N/A TRP 190.A NE1 ASP 234.A OD2 no hydrogen 2.531 N/A ASN 195.A ND2 ILE 39.A O no hydrogen 3.273 N/A ASN 195.A ND2 ASN 194.A O no hydrogen 3.560 N/A PHE 197.A N TRP 118.A O no hydrogen 2.762 N/A GLU 200.A N THR 198.A OG1 no hydrogen 2.989 N/A TYR 202.A N ASN 199.A O no hydrogen 3.196 N/A TYR 202.A OH VAL 168.A O no hydrogen 2.466 N/A LEU 203.A N ASN 199.A O no hydrogen 3.487 N/A ASN 204.A N GLU 200.A O no hydrogen 2.684 N/A ASN 204.A ND2 TRP 190.A O no hydrogen 3.151 N/A LEU 205.A N PHE 201.A O no hydrogen 3.064 N/A LEU 206.A N TYR 202.A O no hydrogen 3.291 N/A ASN 207.A N LEU 203.A O no hydrogen 2.864 N/A GLU 208.A N ASN 204.A O no hydrogen 2.910 N/A TRP 210.A NE1 LEU 205.A O no hydrogen 3.133 N/A LYS 211.A N ASP 223.A O no hydrogen 2.723 N/A GLU 213.A N GLN 221.A O no hydrogen 2.974 N/A ASN 215.A N ASN 219.A O no hydrogen 2.872 N/A ASN 215.A ND2 GLY 185.A O no hydrogen 2.774 N/A ALA 217.A N ASN 215.A OD1 no hydrogen 2.723 N/A ASN 218.A N ASN 215.A O no hydrogen 2.946 N/A ASN 219.A N ASN 215.A OD1 no hydrogen 3.273 N/A ASN 219.A ND2 GLY 185.A O no hydrogen 2.913 N/A GLN 221.A N GLU 213.A O no hydrogen 3.034 N/A TRP 222.A N MET 230.A O no hydrogen 2.916 N/A ASP 223.A N LYS 211.A O no hydrogen 2.781 N/A SER 224.A N TYR 228.A O no hydrogen 2.899 N/A SER 224.A OG GLU 208.A OE1 no hydrogen 2.957 N/A SER 226.A OG GLU 208.A OE1 no hydrogen 2.669 N/A GLY 227.A N SER 224.A O no hydrogen 2.994 N/A MET 229.A N PRO 189.A O no hydrogen 2.756 N/A MET 230.A N TRP 222.A O no hydrogen 2.754 N/A LEU 231.A N ASP 234.A OD2 no hydrogen 2.941 N/A THR 233.A N ALA 146.A O no hydrogen 3.249 N/A TYR 235.A N LEU 231.A O no hydrogen 2.859 N/A SER 236.A N PRO 232.A O no hydrogen 2.809 N/A SER 236.A OG THR 233.A O no hydrogen 2.678 N/A LEU 237.A N ASP 234.A O no hydrogen 2.994 N/A ILE 238.A N TYR 235.A O no hydrogen 3.052 N/A GLN 239.A N SER 236.A O no hydrogen 3.246 N/A ASP 240.A N SER 236.A O no hydrogen 3.067 N/A LYS 242.A N ASP 240.A OD1 no hydrogen 2.832 N/A TYR 243.A N ASP 240.A OD1 no hydrogen 2.943 N/A LEU 244.A N ASP 240.A O no hydrogen 2.814 N/A SER 245.A N PRO 241.A O no hydrogen 3.317 N/A SER 245.A OG PRO 241.A O no hydrogen 3.217 N/A VAL 247.A N TYR 243.A O no hydrogen 2.899 N/A LYS 248.A N LEU 244.A O no hydrogen 3.055 N/A GLU 249.A N SER 245.A O no hydrogen 3.036 N/A TYR 250.A N ILE 246.A O no hydrogen 2.959 N/A TYR 250.A OH ARG 165.A O no hydrogen 3.396 N/A TYR 250.A OH ASP 260.A OD2 no hydrogen 2.657 N/A ALA 251.A N VAL 247.A O no hydrogen 2.969 N/A ASN 252.A N LYS 248.A O no hydrogen 3.158 N/A ASN 252.A N GLU 249.A O no hydrogen 3.293 N/A ASN 252.A ND2 LYS 248.A O no hydrogen 2.797 N/A ASP 253.A N TYR 250.A O no hydrogen 3.404 N/A LYS 256.A N ASP 253.A OD1 no hydrogen 2.947 N/A PHE 257.A N ASP 253.A O no hydrogen 3.056 N/A PHE 258.A N GLN 254.A O no hydrogen 2.952 N/A LYS 259.A N ASP 255.A O no hydrogen 2.985 N/A ASP 260.A N LYS 256.A O no hydrogen 2.909 N/A PHE 261.A N PHE 257.A O no hydrogen 2.739 N/A SER 262.A N PHE 258.A O no hydrogen 2.968 N/A SER 262.A OG LYS 122.A O no hydrogen 2.449 N/A LYS 263.A N LYS 259.A O no hydrogen 3.257 N/A ALA 264.A N ASP 260.A O no hydrogen 3.020 N/A PHE 265.A N PHE 261.A O no hydrogen 2.764 N/A GLU 266.A N SER 262.A O no hydrogen 2.961 N/A LYS 267.A N LYS 263.A O no hydrogen 2.991 N/A LYS 267.A NZ ASN 161.A O no hydrogen 2.760 N/A LYS 267.A NZ GLU 166.A OE1 no hydrogen 3.266 N/A LYS 267.A NZ GLU 166.A OE2 no hydrogen 2.768 N/A LEU 268.A N ALA 264.A O no hydrogen 2.844 N/A LEU 269.A N PHE 265.A O no hydrogen 3.008 N/A GLU 270.A N LYS 267.A O no hydrogen 2.958 N/A ASN 271.A N LYS 267.A O no hydrogen 2.811 N/A ASN 271.A ND2 LEU 160.A O no hydrogen 2.945 N/A ILE 273.A N GLU 270.A O no hydrogen 3.173 N/A THR 274.A N HIS 5.A O no hydrogen 2.874 N/A ALA 279.A N PRO 276.A O no hydrogen 2.922 N/A PHE 283.A N TRP 125.A O no hydrogen 2.762 N/A THR 287.A N GLU 290.A OE1 no hydrogen 3.040 N/A LEU 288.A N GLU 117.A OE2 no hydrogen 3.110 N/A GLU 290.A N THR 287.A OG1 no hydrogen 3.081 N/A GLN 291.A N THR 287.A O no hydrogen 3.110 N/A GLN 291.A N LEU 288.A O no hydrogen 3.125 N/A GLN 291.A NE2 ASN 23.A OD1 no hydrogen 2.852 N/A GLY 292.A N GLU 289.A O no hydrogen 3.269 N/A LEU 293.A N LEU 288.A O no hydrogen 2.680 N/A