Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uve_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A N GLU 5.A OE1 no hydrogen 3.521 N/A GLY 2.A N GLU 5.A OE1 no hydrogen 3.053 N/A ARG 3.A N GLU 29.A OE1 no hydrogen 2.855 N/A VAL 4.A N GLU 29.A O no hydrogen 2.931 N/A GLU 5.A N GLY 2.A O no hydrogen 3.188 N/A GLY 6.A N GLY 30.A O no hydrogen 3.293 N/A LYS 7.A N VAL 4.A O no hydrogen 3.150 N/A VAL 8.A N ASP 101.A OD2 no hydrogen 2.927 N/A ALA 9.A N ASP 32.A O no hydrogen 2.898 N/A PHE 10.A N ILE 102.A O no hydrogen 2.830 N/A VAL 11.A N ILE 34.A O no hydrogen 2.878 N/A THR 12.A N VAL 104.A O no hydrogen 3.080 N/A ALA 14.A N VAL 36.A O no hydrogen 3.092 N/A ALA 15.A N ASP 37.A OD1 no hydrogen 2.995 N/A ARG 16.A NH1 PRO 52.A O no hydrogen 2.920 N/A ARG 16.A NH2 PRO 52.A O no hydrogen 2.818 N/A ARG 20.A N ARG 16.A O no hydrogen 3.090 N/A ARG 20.A NE THR 62.A OG1 no hydrogen 3.000 N/A ARG 20.A NH2 ALA 15.A O no hydrogen 2.990 N/A ARG 20.A NH2 ASP 58.A O no hydrogen 2.950 N/A ARG 20.A NH2 GLU 61.A OE1 no hydrogen 3.277 N/A SER 21.A N GLY 17.A O no hydrogen 3.068 N/A SER 21.A OG SER 253.A OG no hydrogen 2.694 N/A HIS 22.A N GLN 18.A O no hydrogen 2.797 N/A HIS 22.A ND1 SER 253.A OG no hydrogen 2.750 N/A ALA 23.A N GLY 19.A O no hydrogen 2.999 N/A VAL 24.A N ARG 20.A O no hydrogen 2.970 N/A ARG 25.A N SER 21.A O no hydrogen 2.842 N/A ARG 25.A NE ASN 254.A OD1 no hydrogen 2.819 N/A ARG 25.A NH1 GLN 28.A OE1 no hydrogen 2.872 N/A ARG 25.A NH1 GLU 29.A OE2 no hydrogen 2.960 N/A ARG 25.A NH2 ASN 254.A OD1 no hydrogen 3.184 N/A LEU 26.A N HIS 22.A O no hydrogen 2.906 N/A ALA 27.A N ALA 23.A O no hydrogen 2.983 N/A GLN 28.A N VAL 24.A O no hydrogen 2.842 N/A GLU 29.A N ARG 25.A O no hydrogen 3.120 N/A GLU 29.A N LEU 26.A O no hydrogen 3.163 N/A GLY 30.A N ALA 27.A O no hydrogen 2.929 N/A ALA 31.A N LEU 26.A O no hydrogen 2.963 N/A ASP 32.A N LYS 7.A O no hydrogen 2.976 N/A ILE 33.A N ARG 72.A O no hydrogen 3.015 N/A ILE 34.A N ALA 9.A O no hydrogen 2.756 N/A ALA 35.A N VAL 74.A O no hydrogen 2.841 N/A VAL 36.A N VAL 11.A O no hydrogen 3.038 N/A ASP 37.A N ALA 76.A O no hydrogen 3.166 N/A CYS 39.A N ASP 37.A OD2 no hydrogen 3.042 N/A CYS 39.A SG ASP 37.A O no hydrogen 3.642 N/A CYS 39.A SG THR 55.A O no hydrogen 3.554 N/A ARG 43.A NE GLU 126.A OE2 no hydrogen 2.862 N/A ARG 43.A NH2 ASP 123.A OD1 no hydrogen 2.757 N/A ARG 43.A NH2 GLU 126.A OE1 no hydrogen 2.942 N/A ARG 43.A NH2 GLU 126.A OE2 no hydrogen 3.523 N/A VAL 46.A N ARG 43.A O no hydrogen 2.986 N/A THR 49.A N VAL 47.A O no hydrogen 2.922 N/A THR 49.A OG1 ILE 51.A O no hydrogen 2.799 N/A SER 54.A OG.B ASP 37.A OD2 no hydrogen 2.693 N/A THR 55.A N ASP 58.A OD2 no hydrogen 3.070 N/A ASP 58.A N THR 55.A OG1 no hydrogen 2.938 N/A LEU 59.A N THR 55.A O no hydrogen 3.335 N/A ALA 60.A N PRO 56.A O no hydrogen 2.966 N/A GLU 61.A N GLU 57.A O no hydrogen 2.910 N/A THR 62.A N ASP 58.A O no hydrogen 3.039 N/A THR 62.A OG1 ALA 14.A O no hydrogen 2.767 N/A THR 62.A OG1 ALA 15.A O no hydrogen 3.246 N/A THR 62.A OG1 ASP 58.A O no hydrogen 3.458 N/A ALA 63.A N LEU 59.A O no hydrogen 2.990 N/A ASP 64.A N ALA 60.A O no hydrogen 2.955 N/A LEU 65.A N GLU 61.A O no hydrogen 3.062 N/A VAL 66.A N THR 62.A O no hydrogen 2.946 N/A LYS 67.A N ALA 63.A O no hydrogen 2.875 N/A GLY 68.A N ASP 64.A O no hydrogen 2.961 N/A HIS 69.A N VAL 66.A O no hydrogen 2.960 N/A ASN 70.A N LYS 67.A O no hydrogen 2.869 N/A ARG 71.A NE ASP 32.A OD1 no hydrogen 2.980 N/A ARG 71.A NH1 ASP 32.A OD1 no hydrogen 3.445 N/A ARG 72.A N ASP 32.A OD1 no hydrogen 2.858 N/A VAL 74.A N ILE 33.A O no hydrogen 2.875 N/A ALA 76.A N ALA 35.A O no hydrogen 2.998 N/A VAL 78.A N ASP 37.A O no hydrogen 2.978 N/A ARG 81.A N ASP 79.A OD1 no hydrogen 2.935 N/A ARG 81.A NE ASP 79.A OD1 no hydrogen 2.995 N/A ARG 81.A NE ASP 79.A OD2 no hydrogen 3.160 N/A ARG 81.A NH2 ILE 42.A O no hydrogen 2.984 N/A ARG 81.A NH2 ASP 79.A OD2 no hydrogen 2.856 N/A ASP 82.A N ASP 79.A O no hydrogen 2.902 N/A ALA 85.A N ASP 82.A OD1.A no hydrogen 3.116 N/A LEU 86.A N ASP 82.A O no hydrogen 2.873 N/A LYS 87.A N TYR 83.A O no hydrogen 2.803 N/A LYS 87.A NZ ASP 91.A OD1 no hydrogen 2.886 N/A LYS 87.A NZ ASP 91.A OD2 no hydrogen 3.319 N/A ALA 88.A N ASP 84.A O no hydrogen 2.971 N/A ALA 89.A N ALA 85.A O no hydrogen 3.022 N/A VAL 90.A N LEU 86.A O no hydrogen 2.928 N/A ASP 91.A N LYS 87.A O no hydrogen 2.824 N/A SER 92.A N ALA 88.A O no hydrogen 3.015 N/A SER 92.A OG GLN 96.A OE1 no hydrogen 3.101 N/A GLY 93.A N ALA 89.A O no hydrogen 2.937 N/A VAL 94.A N VAL 90.A O no hydrogen 2.864 N/A GLU 95.A N ASP 91.A O no hydrogen 3.049 N/A GLN 96.A N SER 92.A O no hydrogen 3.002 N/A LEU 97.A N GLY 93.A O no hydrogen 2.923 N/A GLY 98.A N VAL 94.A O no hydrogen 2.810 N/A ARG 99.A NE ASP 101.A OD1 no hydrogen 3.378 N/A ARG 99.A NE ASP 101.A OD2 no hydrogen 2.787 N/A ARG 99.A NH2 ASP 101.A OD1 no hydrogen 2.933 N/A ASP 101.A N VAL 8.A O no hydrogen 2.886 N/A ILE 102.A N VAL 8.A O no hydrogen 3.117 N/A ILE 103.A N SER 154.A O no hydrogen 3.009 N/A VAL 104.A N PHE 10.A O no hydrogen 2.764 N/A ALA 105.A N ILE 156.A O no hydrogen 2.956 N/A ASN 106.A N THR 12.A OG1 no hydrogen 3.009 N/A ASN 106.A ND2 THR 12.A O no hydrogen 2.939 N/A ALA 107.A N THR 12.A OG1 no hydrogen 3.019 N/A ILE 109.A N ASN 131.A OD1 no hydrogen 2.855 N/A ASN 111.A ND2 ASP 123.A O no hydrogen 3.015 N/A ASN 111.A ND2 GLU 126.A OE1 no hydrogen 2.801 N/A THR 115.A OG1 ASP 117.A OD1 no hydrogen 2.678 N/A LYS 118.A N THR 115.A O no hydrogen 2.910 N/A THR 119.A N LEU 116.A O no hydrogen 3.441 N/A THR 119.A OG1 THR 115.A O no hydrogen 2.873 N/A GLU 122.A N GLU 122.A OE1.A no hydrogen 2.839 N/A ASP 123.A N SER 120.A OG no hydrogen 3.038 N/A TRP 124.A N SER 120.A O no hydrogen 2.949 N/A THR 125.A N GLU 121.A O no hydrogen 2.834 N/A THR 125.A OG1 GLU 121.A O no hydrogen 2.709 N/A GLU 126.A N GLU 122.A O no hydrogen 3.119 N/A MET 127.A N ASP 123.A O no hydrogen 3.061 N/A ILE 128.A N TRP 124.A O no hydrogen 2.933 N/A ASP 129.A N THR 125.A O no hydrogen 2.781 N/A ILE 130.A N GLU 126.A O no hydrogen 3.020 N/A ASN 131.A N MET 127.A O no hydrogen 2.858 N/A ASN 131.A ND2 ILE 109.A O no hydrogen 3.032 N/A LEU 132.A N ILE 128.A O no hydrogen 3.067 N/A ALA 133.A N ILE 128.A O no hydrogen 2.844 N/A VAL 135.A N LEU 132.A O no hydrogen 3.111 N/A TRP 136.A N LEU 132.A O no hydrogen 3.111 N/A LYS 137.A N ALA 133.A O no hydrogen 2.825 N/A LYS 137.A NZ ARG 81.A O no hydrogen 2.781 N/A THR 138.A N GLY 134.A O no hydrogen 3.017 N/A THR 138.A OG1 GLY 134.A O no hydrogen 2.728 N/A VAL 139.A N VAL 135.A O no hydrogen 3.106 N/A LYS 140.A N TRP 136.A O no hydrogen 2.888 N/A ALA 141.A N LYS 137.A O no hydrogen 2.868 N/A GLY 142.A N THR 138.A O no hydrogen 3.156 N/A VAL 143.A N VAL 139.A O no hydrogen 2.839 N/A HIS 145.A N GLY 142.A O no hydrogen 3.087 N/A HIS 145.A NE2 ASP 91.A OD1 no hydrogen 2.800 N/A ILE 147.A N VAL 143.A O no hydrogen 2.910 N/A ALA 148.A N PRO 144.A O no hydrogen 2.922 N/A GLY 149.A N HIS 145.A O no hydrogen 3.221 N/A GLY 150.A N ILE 147.A O no hydrogen 3.080 N/A GLY 153.A N MET 195.A O no hydrogen 3.194 N/A SER 154.A N ASP 101.A O no hydrogen 2.918 N/A SER 154.A OG PHE 259.A O no hydrogen 2.708 N/A ILE 155.A N ARG 197.A O no hydrogen 2.803 N/A ILE 156.A N ILE 103.A O no hydrogen 2.763 N/A LEU 157.A N ASN 199.A O no hydrogen 2.901 N/A THR 158.A N ALA 105.A O no hydrogen 2.970 N/A THR 158.A OG1 ALA 105.A O no hydrogen 3.494 N/A SER 159.A N VAL 201.A O no hydrogen 2.823 N/A SER 159.A OG LYS 177.A O no hydrogen 2.898 N/A VAL 161.A N PRO 203.A O no hydrogen 2.986 N/A GLY 162.A N SER 160.A OG no hydrogen 2.908 N/A GLY 163.A N SER 160.A O no hydrogen 2.816 N/A LEU 164.A N VAL 161.A O no hydrogen 2.876 N/A LYS 165.A N VAL 161.A O no hydrogen 2.939 N/A LYS 165.A NZ SER 278.A O no hydrogen 2.794 N/A HIS 169.A ND1 GLY 113.A O no hydrogen 2.796 N/A THR 170.A N TYR 167.A O no hydrogen 3.263 N/A THR 170.A OG1 TYR 167.A O no hydrogen 2.676 N/A HIS 172.A NE2 ASN 111.A O no hydrogen 3.037 N/A HIS 172.A NE2 ASN 111.A OD1 no hydrogen 2.641 N/A VAL 174.A N THR 170.A O no hydrogen 2.865 N/A ALA 175.A N GLY 171.A O no hydrogen 2.927 N/A ALA 176.A N HIS 172.A O no hydrogen 3.064 N/A LYS 177.A N TYR 173.A O no hydrogen 2.816 N/A LYS 177.A NZ THR 158.A O no hydrogen 3.077 N/A LYS 177.A NZ SER 159.A O no hydrogen 3.287 N/A HIS 178.A N VAL 174.A O no hydrogen 2.875 N/A HIS 178.A ND1 VAL 174.A O no hydrogen 2.869 N/A GLY 179.A N ALA 175.A O no hydrogen 2.934 N/A VAL 180.A N ALA 176.A O no hydrogen 2.975 N/A GLY 182.A N HIS 178.A O no hydrogen 3.339 N/A LEU 183.A N GLY 179.A O no hydrogen 2.909 N/A MET 184.A N VAL 180.A O no hydrogen 2.898 N/A ARG 185.A N VAL 181.A O no hydrogen 2.985 N/A ALA 186.A N GLY 182.A O no hydrogen 2.861 N/A PHE 187.A N LEU 183.A O no hydrogen 2.848 N/A GLY 188.A N MET 184.A O no hydrogen 2.867 N/A VAL 189.A N ARG 185.A O no hydrogen 2.940 N/A GLU 190.A N ALA 186.A O no hydrogen 3.221 N/A LEU 191.A N PHE 187.A O no hydrogen 2.823 N/A GLY 192.A N GLY 188.A O no hydrogen 3.234 N/A HIS 194.A N LEU 191.A O no hydrogen 2.965 N/A MET 195.A N GLY 192.A O no hydrogen 2.844 N/A ILE 196.A N LEU 191.A O no hydrogen 3.311 N/A ARG 197.A N GLY 153.A O no hydrogen 2.958 N/A ARG 197.A NH2 PHE 259.A O no hydrogen 3.043 N/A VAL 198.A N THR 268.A OG1 no hydrogen 2.939 N/A ASN 199.A N ILE 155.A O no hydrogen 2.943 N/A ASN 199.A ND2 ILE 267.A O no hydrogen 3.023 N/A SER 200.A N VAL 270.A O no hydrogen 2.890 N/A SER 200.A OG HIS 202.A NE2 no hydrogen 2.763 N/A SER 200.A OG VAL 270.A O no hydrogen 3.567 N/A VAL 201.A N LEU 157.A O no hydrogen 2.977 N/A HIS 202.A N LEU 272.A O no hydrogen 2.882 N/A HIS 202.A ND1 SER 160.A O no hydrogen 2.799 N/A HIS 202.A NE2 SER 200.A OG no hydrogen 2.763 N/A THR 204.A N ILE 274.A O no hydrogen 3.102 N/A THR 204.A OG1 HIS 240.A NE2 no hydrogen 2.725 N/A THR 204.A OG1 SER 278.A OG.B no hydrogen 3.177 N/A HIS 205.A N THR 204.A OG1 no hydrogen 2.766 N/A LYS 207.A N VAL 247.A O no hydrogen 2.957 N/A MET 210.A N THR 208.A OG1 no hydrogen 3.149 N/A LEU 211.A N THR 208.A O no hydrogen 2.983 N/A HIS 212.A N THR 208.A O no hydrogen 2.846 N/A ASN 213.A N LEU 211.A O no hydrogen 3.233 N/A ASN 213.A ND2 PRO 209.A O no hydrogen 2.927 N/A ASN 213.A ND2 MET 210.A O no hydrogen 3.162 N/A THR 216.A N ASN 213.A OD1 no hydrogen 2.932 N/A THR 216.A OG1 ASN 213.A OD1 no hydrogen 2.766 N/A PHE 217.A N ASN 213.A O no hydrogen 2.958 N/A LYS 218.A N GLU 214.A O no hydrogen 3.000 N/A MET 219.A N GLY 215.A O no hydrogen 3.067 N/A PHE 220.A N THR 216.A O no hydrogen 2.968 N/A ARG 221.A N PHE 217.A O no hydrogen 3.001 N/A ARG 221.A NE ASP 223.A OD1 no hydrogen 2.885 N/A ARG 221.A NH1 ASP 231.A O no hydrogen 2.832 N/A ARG 221.A NH2 ASP 223.A OD2 no hydrogen 2.934 N/A LEU 224.A N ARG 221.A O no hydrogen 3.163 N/A GLY 228.A N ASP 231.A OD2 no hydrogen 2.909 N/A ASP 231.A N GLY 228.A O no hydrogen 3.051 N/A MET 232.A N GLY 228.A O no hydrogen 3.231 N/A ALA 233.A N PRO 229.A O no hydrogen 2.907 N/A ILE 235.A N MET 232.A O no hydrogen 2.987 N/A CYS 236.A N MET 232.A O no hydrogen 3.079 N/A CYS 236.A SG MET 232.A O no hydrogen 3.844 N/A GLN 237.A N ALA 233.A O no hydrogen 2.911 N/A MET 238.A N ILE 235.A O no hydrogen 3.242 N/A PHE 239.A N CYS 236.A O no hydrogen 3.114 N/A HIS 240.A N GLN 237.A O no hydrogen 3.045 N/A HIS 240.A ND1 ILE 244.A O no hydrogen 2.739 N/A HIS 240.A NE2 THR 204.A OG1 no hydrogen 2.725 N/A THR 241.A N ALA 276.A O no hydrogen 2.839 N/A THR 241.A OG1.A GLY 277.A O no hydrogen 3.044 N/A THR 241.A OG1.B ALA 276.A O no hydrogen 3.238 N/A LEU 242.A N ALA 276.A O no hydrogen 3.035 N/A ILE 244.A N LEU 242.A O no hydrogen 2.775 N/A VAL 247.A N HIS 205.A O no hydrogen 2.909 N/A GLU 248.A N ASP 251.A OD2 no hydrogen 2.906 N/A ASP 251.A N GLU 248.A O no hydrogen 2.916 N/A SER 253.A N PRO 249.A O no hydrogen 2.921 N/A SER 253.A OG SER 21.A OG no hydrogen 2.694 N/A SER 253.A OG HIS 22.A ND1 no hydrogen 2.750 N/A SER 253.A OG PRO 249.A O no hydrogen 3.222 N/A ASN 254.A N ILE 250.A O no hydrogen 2.861 N/A ALA 255.A N ASP 251.A O no hydrogen 3.432 N/A VAL 256.A N ILE 252.A O no hydrogen 2.918 N/A LEU 257.A N SER 253.A O no hydrogen 2.824 N/A PHE 258.A N ASN 254.A O no hydrogen 3.043 N/A PHE 259.A N ALA 255.A O no hydrogen 3.022 N/A ALA 260.A N VAL 256.A O no hydrogen 2.818 N/A SER 261.A N LEU 257.A O no hydrogen 2.943 N/A SER 261.A N PHE 258.A O no hydrogen 3.160 N/A SER 261.A OG LEU 257.A O no hydrogen 3.484 N/A SER 261.A OG PHE 258.A O no hydrogen 2.793 N/A GLU 263.A N SER 261.A OG no hydrogen 3.235 N/A ALA 264.A N SER 261.A O no hydrogen 3.015 N/A ARG 265.A N ASP 262.A O no hydrogen 3.136 N/A ILE 267.A N ALA 264.A O no hydrogen 3.030 N/A THR 268.A OG1 VAL 198.A O no hydrogen 3.427 N/A GLY 269.A N VAL 198.A O no hydrogen 2.758 N/A VAL 270.A N ASN 199.A OD1 no hydrogen 2.902 N/A LEU 272.A N SER 200.A O no hydrogen 2.833 N/A ILE 274.A N HIS 202.A O no hydrogen 3.094 N/A GLY 277.A N ASP 275.A OD1 no hydrogen 2.793 N/A SER 278.A N ASP 275.A O no hydrogen 2.958 N/A SER 278.A OG.A PHE 239.A O no hydrogen 3.567 N/A SER 278.A OG.B THR 204.A OG1 no hydrogen 3.177 N/A SER 278.A OG.B PHE 239.A O no hydrogen 3.442 N/A SER 278.A OG.B ASP 275.A O no hydrogen 2.836 N/A CYS 279.A N ASP 275.A OD2 no hydrogen 2.908 N/A CYS 279.A SG ASP 275.A OD2 no hydrogen 3.318 N/A LEU 280.A N GLY 277.A O no hydrogen 3.036 N/A LYS 281.A N SER 278.A O no hydrogen 3.082 N/A