Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vla_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLU 179.A OE1 no hydrogen 2.805 N/A MET 1.A N GLU 179.A OE2 no hydrogen 3.504 N/A TYR 3.A OH TYR 163.A O no hydrogen 2.626 N/A ASN 4.A N GLN 169.A OE1 no hydrogen 2.855 N/A GLU 6.A N ASN 4.A OD1 no hydrogen 2.953 N/A GLU 7.A N ASN 4.A O no hydrogen 3.452 N/A GLN 8.A NE2 PRO 5.A O no hydrogen 2.770 N/A GLN 8.A NE2 TYR 162.A O no hydrogen 2.959 N/A PHE 9.A N ASN 166.A O no hydrogen 2.873 N/A ARG 10.A NE TYR 205.A O no hydrogen 2.885 N/A ARG 10.A NH2 TYR 205.A O no hydrogen 3.062 N/A GLY 16.A N GLU 212.A OE1 no hydrogen 2.915 N/A LYS 17.A NZ GLU 71.A OE2 no hydrogen 2.908 N/A LEU 22.A N LYS 19.A O no hydrogen 3.287 N/A ASN 24.A N MET 21.A O no hydrogen 2.988 N/A LEU 25.A N MET 21.A O no hydrogen 2.839 N/A LEU 26.A N LEU 22.A O no hydrogen 2.894 N/A ALA 28.A N ASN 24.A O no hydrogen 3.202 N/A TYR 29.A N LEU 25.A O no hydrogen 2.798 N/A TYR 29.A OH HIS 68.A ND1 no hydrogen 2.750 N/A ALA 30.A N LEU 26.A O no hydrogen 3.053 N/A ASN 31.A N PRO 27.A O no hydrogen 2.882 N/A ILE 32.A N ALA 28.A O no hydrogen 2.859 N/A ILE 33.A N TYR 29.A O no hydrogen 3.034 N/A ASP 34.A N ALA 30.A O no hydrogen 2.862 N/A ASP 35.A N ASN 31.A O no hydrogen 2.953 N/A ILE 36.A N ILE 32.A O no hydrogen 3.024 N/A CYS 37.A N ILE 33.A O no hydrogen 2.984 N/A CYS 39.A N ILE 87.A O no hydrogen 3.192 N/A CYS 39.A SG ILE 36.A O no hydrogen 3.252 N/A CYS 39.A SG ASP 40.A O no hydrogen 3.574 N/A SER 43.A N ASP 40.A OD2 no hydrogen 2.699 N/A SER 43.A OG ASP 40.A OD1 no hydrogen 2.332 N/A SER 43.A OG ASP 40.A OD2 no hydrogen 2.630 N/A PHE 44.A N ASP 40.A O no hydrogen 2.903 N/A VAL 45.A N LYS 41.A O no hydrogen 3.088 N/A LYS 46.A N ALA 42.A O no hydrogen 3.469 N/A ASP 47.A N SER 43.A O no hydrogen 2.931 N/A PHE 48.A N PHE 44.A O no hydrogen 2.848 N/A ASN 49.A N VAL 45.A O no hydrogen 3.151 N/A ASN 49.A ND2 ASP 66.A OD1 no hydrogen 2.946 N/A ASN 50.A N LYS 46.A O no hydrogen 2.960 N/A ARG 51.A N ASP 47.A O no hydrogen 3.201 N/A ARG 51.A NH1 ASP 35.A OD2 no hydrogen 3.006 N/A ARG 51.A NH2 ASP 35.A OD2 no hydrogen 3.144 N/A LEU 52.A N PHE 48.A O no hydrogen 2.915 N/A ILE 53.A N ASN 49.A O no hydrogen 3.063 N/A GLU 54.A N ARG 51.A O no hydrogen 3.190 N/A ILE 55.A N LEU 52.A O no hydrogen 2.831 N/A LEU 56.A N LEU 52.A O no hydrogen 3.072 N/A GLY 57.A N ILE 53.A O no hydrogen 2.887 N/A GLU 59.A N.A GLU 59.A OE1.A no hydrogen 2.190 N/A THR 60.A N GLY 57.A O no hydrogen 3.077 N/A THR 60.A OG1 GLY 57.A O no hydrogen 2.760 N/A THR 61.A OG1 THR 64.A OG1 no hydrogen 3.121 N/A LYS 62.A NZ ASP 66.A OD2 no hydrogen 2.834 N/A THR 64.A N THR 61.A OG1 no hydrogen 3.218 N/A THR 64.A OG1 THR 61.A OG1 no hydrogen 3.121 N/A LEU 65.A N THR 61.A O no hydrogen 3.096 N/A ASP 66.A N LYS 62.A O no hydrogen 2.816 N/A ASN 67.A N LYS 63.A O no hydrogen 2.860 N/A HIS 68.A N THR 64.A O no hydrogen 2.909 N/A HIS 68.A ND1 TYR 29.A OH no hydrogen 2.750 N/A ARG 69.A N LEU 65.A O no hydrogen 3.027 N/A ARG 69.A NH1 ASN 49.A OD1 no hydrogen 2.945 N/A ARG 69.A NH1 ASP 66.A OD1 no hydrogen 2.837 N/A THR 70.A N ASP 66.A O no hydrogen 2.863 N/A THR 70.A OG1 ASP 66.A O no hydrogen 3.435 N/A GLU 71.A N ASN 67.A O no hydrogen 2.781 N/A ILE 72.A N HIS 68.A O no hydrogen 3.123 N/A ALA 73.A N HIS 68.A O no hydrogen 2.979 N/A GLY 74.A N ARG 69.A O no hydrogen 2.904 N/A LYS 75.A N THR 70.A O no hydrogen 2.958 N/A LYS 75.A NZ GLY 118.A O no hydrogen 2.819 N/A LEU 76.A N GLU 71.A O no hydrogen 2.846 N/A PHE 77.A N ILE 72.A O no hydrogen 2.832 N/A MET 79.A N ALA 73.A O no hydrogen 2.808 N/A TYR 81.A N PHE 88.A O no hydrogen 3.022 N/A ASP 83.A N VAL 86.A O no hydrogen 2.943 N/A VAL 86.A N ASP 83.A O no hydrogen 3.009 N/A ILE 87.A N CYS 39.A O no hydrogen 2.788 N/A PHE 88.A N TYR 81.A O no hydrogen 2.853 N/A SER 90.A N MET 79.A O no hydrogen 3.039 N/A SER 90.A OG GLY 78.A O no hydrogen 2.682 N/A SER 90.A OG THR 93.A OG1 no hydrogen 3.389 N/A GLY 91.A N ASN 279.A OD1 no hydrogen 2.836 N/A ARG 92.A N SER 278.A O.A no hydrogen 3.018 N/A ARG 92.A N SER 278.A O.B no hydrogen 3.045 N/A ARG 92.A NE ASP 108.A OD2 no hydrogen 2.821 N/A ARG 92.A NH1 PHE 77.A O no hydrogen 2.910 N/A ARG 92.A NH2 ASP 108.A OD2 no hydrogen 2.971 N/A THR 93.A N SER 90.A OG no hydrogen 3.185 N/A THR 93.A OG1 MET 79.A O no hydrogen 2.731 N/A THR 93.A OG1 SER 90.A OG no hydrogen 3.389 N/A ASN 94.A N SER 90.A O no hydrogen 2.877 N/A LYS 95.A N GLY 91.A O no hydrogen 2.968 N/A LYS 95.A NZ ASP 99.A OD2 no hydrogen 2.842 N/A TYR 96.A N ARG 92.A O no hydrogen 3.163 N/A ILE 97.A N THR 93.A O no hydrogen 2.888 N/A GLU 98.A N ASN 94.A O no hydrogen 3.231 N/A ASP 99.A N LYS 95.A O no hydrogen 2.854 N/A SER 100.A N TYR 96.A O no hydrogen 2.780 N/A ASP 101.A N ASP 99.A OD1 no hydrogen 2.952 N/A ALA 104.A N ASP 101.A OD1 no hydrogen 2.941 N/A PHE 105.A N ASP 101.A O no hydrogen 3.071 N/A PHE 106.A N GLN 102.A O no hydrogen 3.155 N/A LYS 107.A N.A PRO 103.A O no hydrogen 2.778 N/A LYS 107.A N.B PRO 103.A O no hydrogen 2.799 N/A LYS 107.A NZ.A ALA 220.A O no hydrogen 2.793 N/A LYS 107.A NZ.B ASN 239.A OD1 no hydrogen 3.208 N/A ASP 108.A N ALA 104.A O no hydrogen 3.039 N/A ILE 109.A N PHE 105.A O no hydrogen 3.186 N/A CYS 110.A N PHE 106.A O no hydrogen 2.942 N/A CYS 110.A SG PHE 106.A O no hydrogen 3.389 N/A PHE 111.A N LYS 107.A O.A no hydrogen 2.833 N/A PHE 111.A N LYS 107.A O.B no hydrogen 2.934 N/A LYS 112.A N ASP 108.A O no hydrogen 3.024 N/A LYS 112.A NZ TYR 276.A O no hydrogen 3.101 N/A LYS 112.A NZ ASN 279.A O no hydrogen 3.103 N/A PHE 113.A N ILE 109.A O no hydrogen 2.946 N/A GLN 114.A NE2 PRO 116.A O no hydrogen 2.890 N/A GLN 114.A NE2 PHE 253.A O no hydrogen 2.906 N/A PHE 115.A N ILE 135.A O.A no hydrogen 3.011 N/A PHE 115.A N ILE 135.A O.B no hydrogen 3.011 N/A ASN 117.A ND2 GLN 114.A O no hydrogen 2.910 N/A MET 119.A N ASN 117.A OD1 no hydrogen 2.823 N/A VAL 125.A N LYS 121.A O no hydrogen 2.989 N/A ILE 126.A N LEU 122.A O no hydrogen 2.941 N/A GLU 127.A N.A ASP 123.A O no hydrogen 3.042 N/A GLU 127.A N.B ASP 123.A O no hydrogen 3.051 N/A LYS 128.A N LYS 124.A O no hydrogen 3.013 N/A LYS 128.A NZ THR 12.A O no hydrogen 3.018 N/A LYS 128.A NZ ASP 120.A OD2 no hydrogen 2.571 N/A VAL 129.A N VAL 125.A O no hydrogen 2.861 N/A GLY 130.A N ILE 126.A O no hydrogen 2.807 N/A ALA 131.A N GLU 127.A O.A no hydrogen 2.991 N/A ALA 131.A N GLU 127.A O.B no hydrogen 3.012 N/A ALA 131.A N LYS 128.A O no hydrogen 3.202 N/A LYS 132.A N VAL 129.A O no hydrogen 2.966 N/A ILE 133.A N.A LYS 128.A O no hydrogen 3.159 N/A ILE 133.A N.B LYS 128.A O no hydrogen 3.129 N/A GLN 134.A N LEU 171.A O no hydrogen 2.846 N/A ILE 135.A N.A PHE 115.A O no hydrogen 3.018 N/A ILE 135.A N.B PHE 115.A O no hydrogen 3.017 N/A ARG 136.A NE LYS 250.A O no hydrogen 2.902 N/A ARG 136.A NH2 LYS 250.A O no hydrogen 2.934 N/A ARG 136.A NH2 GLU 252.A OE1 no hydrogen 3.147 N/A GLN 137.A N GLN 137.A OE1 no hydrogen 2.845 N/A GLN 137.A NE2 GLN 213.A OE1 no hydrogen 2.959 N/A TYR 140.A N ARG 136.A O no hydrogen 3.225 N/A TYR 140.A OH ILE 175.A O no hydrogen 2.712 N/A ILE 141.A N GLN 137.A O no hydrogen 2.828 N/A LEU 142.A N PHE 138.A O no hydrogen 2.979 N/A GLN 143.A N PRO 139.A O no hydrogen 2.972 N/A VAL 144.A N TYR 140.A O no hydrogen 2.887 N/A LEU 145.A N ILE 141.A O no hydrogen 2.898 N/A LEU 146.A N LEU 142.A O no hydrogen 2.908 N/A THR 147.A N GLN 143.A O no hydrogen 2.880 N/A THR 147.A OG1 GLN 143.A O no hydrogen 2.843 N/A ALA 148.A N VAL 144.A O no hydrogen 2.818 N/A ASP 149.A N LEU 145.A O no hydrogen 3.036 N/A ASN 150.A N LEU 146.A O no hydrogen 2.914 N/A ASN 151.A N THR 147.A O no hydrogen 3.057 N/A ASN 151.A N ALA 148.A O no hydrogen 3.014 N/A ASN 151.A ND2 THR 147.A O no hydrogen 2.902 N/A ASN 152.A N ASP 149.A O no hydrogen 3.013 N/A ILE 153.A N ALA 148.A O no hydrogen 3.052 N/A SER 156.A N ASP 159.A OD2 no hydrogen 3.028 N/A LYS 157.A NZ.B ASN 228.A O no hydrogen 2.688 N/A ASP 159.A N SER 156.A OG no hydrogen 3.009 N/A ILE 160.A N.A SER 156.A O no hydrogen 3.122 N/A ILE 160.A N.B SER 156.A O no hydrogen 3.118 N/A ALA 161.A N LYS 157.A O.A no hydrogen 2.901 N/A ALA 161.A N LYS 157.A O.B no hydrogen 2.911 N/A TYR 162.A N ASP 158.A O no hydrogen 2.940 N/A TYR 163.A N ASP 159.A O no hydrogen 2.926 N/A TYR 163.A OH ASP 187.A OD2 no hydrogen 2.572 N/A VAL 164.A N ILE 160.A O.A no hydrogen 3.215 N/A VAL 164.A N ILE 160.A O.B no hydrogen 2.990 N/A LEU 165.A N ILE 160.A O.A no hydrogen 2.830 N/A LEU 165.A N ILE 160.A O.B no hydrogen 2.916 N/A ASN 166.A N ALA 161.A O no hydrogen 2.836 N/A ASN 166.A ND2 GLN 8.A OE1 no hydrogen 2.850 N/A SER 167.A N VAL 164.A O no hydrogen 3.230 N/A LEU 168.A N GLU 7.A O no hydrogen 2.931 N/A GLN 169.A NE2 GLU 7.A OE1 no hydrogen 3.249 N/A VAL 170.A N SER 167.A OG no hydrogen 3.219 N/A LEU 171.A N SER 167.A O no hydrogen 2.962 N/A GLN 172.A N LEU 168.A O no hydrogen 2.849 N/A GLN 172.A NE2 ALA 131.A O no hydrogen 2.781 N/A GLY 173.A N VAL 170.A O no hydrogen 2.911 N/A LYS 174.A N GLN 169.A O no hydrogen 3.112 N/A LYS 174.A NZ GLN 172.A OE1 no hydrogen 2.926 N/A LYS 176.A N.A GLU 179.A OE2 no hydrogen 2.845 N/A LYS 176.A N.B GLU 179.A OE2 no hydrogen 2.923 N/A VAL 180.A N LYS 176.A O.A no hydrogen 3.352 N/A ILE 181.A N PRO 177.A O no hydrogen 3.052 N/A GLU 182.A N ILE 178.A O no hydrogen 2.876 N/A LYS 183.A N GLU 179.A O no hydrogen 3.099 N/A LYS 183.A NZ ASP 187.A OD1 no hydrogen 2.851 N/A ILE 184.A N VAL 180.A O no hydrogen 2.951 N/A ILE 185.A N ILE 181.A O no hydrogen 2.983 N/A GLU 186.A N.A GLU 182.A O no hydrogen 2.973 N/A GLU 186.A N.B GLU 182.A O no hydrogen 2.943 N/A ASP 187.A N LYS 183.A O no hydrogen 2.847 N/A ARG 188.A N ILE 184.A O no hydrogen 2.918 N/A ARG 188.A NH1 GLN 154.A O no hydrogen 3.309 N/A ARG 188.A NH2 GLN 154.A O no hydrogen 2.829 N/A ARG 188.A NH2 ASP 159.A OD2 no hydrogen 2.789 N/A SER 189.A N ILE 185.A O no hydrogen 3.048 N/A SER 189.A OG GLU 186.A O.A no hydrogen 2.625 N/A SER 189.A OG GLU 186.A O.B no hydrogen 2.572 N/A ASN 190.A N GLU 186.A O.A no hydrogen 3.194 N/A ASN 190.A N GLU 186.A O.B no hydrogen 3.204 N/A ASN 190.A N ASP 187.A O no hydrogen 2.979 N/A ASP 191.A N ARG 188.A O no hydrogen 2.952 N/A ILE 192.A N ASP 187.A O no hydrogen 2.841 N/A ARG 197.A NH1 VAL 196.A O no hydrogen 2.791 N/A HIS 198.A ND1 SER 206.A OG no hydrogen 2.679 N/A LYS 201.A N HIS 198.A O no hydrogen 3.106 N/A TYR 205.A N GLU 202.A O no hydrogen 3.077 N/A SER 206.A OG HIS 198.A ND1 no hydrogen 2.679 N/A MET 207.A N THR 203.A O no hydrogen 2.808 N/A GLN 208.A N SER 204.A O no hydrogen 2.970 N/A GLN 208.A NE2 GLU 212.A OE2 no hydrogen 2.864 N/A ILE 210.A N MET 207.A O no hydrogen 2.979 N/A ARG 211.A N.A MET 207.A O no hydrogen 2.837 N/A ARG 211.A N.B MET 207.A O no hydrogen 2.847 N/A ARG 211.A NE.A ASN 215.A OD1 no hydrogen 2.784 N/A GLU 212.A N GLN 208.A O no hydrogen 2.895 N/A GLN 213.A N HIS 209.A O no hydrogen 3.198 N/A GLN 213.A NE2 HIS 209.A O no hydrogen 3.021 N/A LEU 214.A N ILE 210.A O no hydrogen 3.206 N/A ASN 215.A N ARG 211.A O.A no hydrogen 2.815 N/A ASN 215.A N ARG 211.A O.B no hydrogen 2.802 N/A TYR 216.A N GLU 212.A O no hydrogen 3.112 N/A TYR 216.A N GLN 213.A O no hydrogen 3.088 N/A LEU 217.A N.A GLN 213.A O no hydrogen 3.291 N/A LEU 217.A N.A LEU 214.A O no hydrogen 3.093 N/A LEU 217.A N.B GLN 213.A O no hydrogen 3.292 N/A GLU 218.A N LEU 214.A O no hydrogen 2.939 N/A LEU 219.A N ASN 215.A O no hydrogen 2.810 N/A ALA 220.A N TYR 216.A O no hydrogen 3.047 N/A ASN 221.A N.A GLU 218.A O no hydrogen 2.874 N/A ASN 221.A N.B GLU 218.A O no hydrogen 2.867 N/A ASN 221.A ND2.B GLU 236.A OE2 no hydrogen 3.196 N/A LEU 222.A N LEU 217.A O.A no hydrogen 3.099 N/A LEU 222.A N LEU 217.A O.B no hydrogen 3.162 N/A ARG 224.A N.A LYS 231.A O no hydrogen 2.784 N/A ARG 224.A N.B LYS 231.A O no hydrogen 2.786 N/A ARG 224.A NE.B GLU 218.A OE2 no hydrogen 3.394 N/A ILE 225.A N GLU 218.A OE2 no hydrogen 2.880 N/A ASP 226.A N LEU 229.A O no hydrogen 2.975 N/A ASN 228.A N ASP 226.A OD1 no hydrogen 2.642 N/A LEU 229.A N ASP 226.A OD1 no hydrogen 2.750 N/A VAL 230.A N LEU 155.A O no hydrogen 2.850 N/A LYS 231.A N ARG 224.A O.A no hydrogen 2.998 N/A LYS 231.A N ARG 224.A O.B no hydrogen 2.998 N/A ASN 233.A N LEU 222.A O no hydrogen 2.952 N/A ASN 233.A ND2 ASN 221.A O.A no hydrogen 3.073 N/A ASN 233.A ND2 ASN 221.A O.B no hydrogen 2.897 N/A TYR 234.A OH ASP 149.A OD2 no hydrogen 2.529 N/A ARG 235.A N ASN 233.A OD1 no hydrogen 3.248 N/A GLU 236.A N ASN 233.A O no hydrogen 2.832 N/A ALA 237.A N TYR 234.A O no hydrogen 3.035 N/A ASN 239.A ND2 GLU 236.A OE1 no hydrogen 2.825 N/A ILE 240.A N GLU 236.A O no hydrogen 2.882 N/A ASN 241.A N ALA 237.A O no hydrogen 2.961 N/A ASN 241.A ND2 ALA 237.A O no hydrogen 3.211 N/A TYR 242.A N GLU 238.A O no hydrogen 3.138 N/A ILE 243.A N ASN 239.A O no hydrogen 3.102 N/A ALA 244.A N ILE 240.A O no hydrogen 2.865 N/A GLN 245.A N.A ASN 241.A O no hydrogen 3.160 N/A GLN 245.A N.B ASN 241.A O no hydrogen 3.157 N/A GLN 245.A NE2.B ASN 241.A O no hydrogen 3.236 N/A PHE 246.A N ILE 243.A O no hydrogen 3.134 N/A TRP 247.A N ALA 244.A O no hydrogen 2.982 N/A ASN 249.A N PHE 246.A O no hydrogen 3.053 N/A PHE 253.A N GLN 114.A OE1 no hydrogen 3.027 N/A TYR 256.A N ASN 254.A OD1 no hydrogen 2.900 N/A TYR 256.A OH ILE 133.A O.A no hydrogen 2.609 N/A TYR 256.A OH ILE 133.A O.B no hydrogen 2.601 N/A TYR 258.A OH ASP 272.A OD2 no hydrogen 2.593 N/A ASP 259.A N ASP 265.A OD2 no hydrogen 2.766 N/A THR 261.A N ASP 259.A OD1 no hydrogen 3.057 N/A THR 261.A OG1 ASP 259.A OD1 no hydrogen 2.782 N/A THR 261.A OG1 ASP 259.A OD2 no hydrogen 3.523 N/A SER 262.A N ASP 259.A O no hydrogen 2.931 N/A ASP 265.A N SER 262.A OG no hydrogen 3.209 N/A LYS 266.A N SER 262.A O no hydrogen 2.908 N/A LYS 266.A NZ GLU 263.A OE2 no hydrogen 2.972 N/A LYS 267.A N GLU 263.A O no hydrogen 3.424 N/A SER 268.A N ASP 264.A O no hydrogen 3.002 N/A SER 268.A OG ASP 264.A O no hydrogen 3.243 N/A PHE 269.A N ASP 265.A O no hydrogen 2.831 N/A LYS 271.A N LYS 267.A O no hydrogen 3.280 N/A ASP 272.A N SER 268.A O no hydrogen 2.763 N/A TRP 273.A N PHE 269.A O no hydrogen 2.905 N/A GLN 274.A N PHE 270.A O no hydrogen 3.139 N/A GLN 274.A NE2 GLY 74.A O no hydrogen 2.950 N/A GLN 274.A NE2 PHE 80.A O no hydrogen 2.868 N/A GLN 275.A N.A LYS 271.A O no hydrogen 3.137 N/A GLN 275.A N.B LYS 271.A O no hydrogen 3.136 N/A TYR 276.A N ASP 272.A O no hydrogen 3.010 N/A TYR 276.A OH LYS 112.A O no hydrogen 2.714 N/A TYR 277.A N TRP 273.A O no hydrogen 2.881 N/A TYR 277.A OH LEU 76.A O no hydrogen 2.695 N/A SER 278.A N.A GLN 274.A O no hydrogen 2.934 N/A SER 278.A N.B GLN 274.A O no hydrogen 2.949 N/A SER 278.A OG.A GLN 274.A O no hydrogen 2.676 N/A SER 278.A OG.B GLN 274.A O no hydrogen 2.957 N/A ASN 279.A N GLN 275.A O.B no hydrogen 3.333 N/A ASN 279.A ND2 GLN 275.A OE1.A no hydrogen 2.878 N/A ASN 279.A ND2 GLN 275.A OE1.B no hydrogen 2.656 N/A