Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dbp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N TYR 252.A OH no hydrogen 2.875 N/A GLY 6.A N GLN 26.A OE1 no hydrogen 2.921 N/A ALA 7.A N SER 4.A OG no hydrogen 3.039 N/A ARG 8.A N SER 4.A O no hydrogen 2.898 N/A ARG 8.A NE PRO 188.A O no hydrogen 2.939 N/A ARG 8.A NH1 PRO 188.A O no hydrogen 3.211 N/A ARG 8.A NH1 ASP 223.A OD2 no hydrogen 2.971 N/A ARG 8.A NH2 ASP 223.A OD1 no hydrogen 2.801 N/A ALA 9.A N PHE 5.A O no hydrogen 2.949 N/A GLU 10.A N ALA 7.A O no hydrogen 3.019 N/A LEU 11.A N ARG 8.A O no hydrogen 3.094 N/A ILE 14.A N LEU 11.A O no hydrogen 3.144 N/A VAL 17.A N HIS 15.A ND1 no hydrogen 3.025 N/A SER 19.A N HIS 15.A O no hydrogen 2.860 N/A SER 19.A OG ALA 9.A O no hydrogen 2.712 N/A LYS 20.A N PRO 16.A O no hydrogen 2.950 N/A LEU 21.A N VAL 17.A O no hydrogen 3.031 N/A LEU 22.A N ALA 18.A O no hydrogen 2.800 N/A ARG 23.A N.A SER 19.A O no hydrogen 2.933 N/A ARG 23.A N.B SER 19.A O no hydrogen 2.901 N/A LEU 24.A N LYS 20.A O no hydrogen 3.188 N/A MET 25.A N LEU 21.A O no hydrogen 2.873 N/A GLN 26.A N LEU 22.A O no hydrogen 3.055 N/A GLN 26.A NE2 GLN 26.A O no hydrogen 3.660 N/A LYS 27.A N ARG 23.A O.A no hydrogen 2.841 N/A LYS 27.A N ARG 23.A O.B no hydrogen 2.909 N/A LYS 27.A NZ GLU 84.A OE1 no hydrogen 3.526 N/A LYS 27.A NZ GLU 84.A OE2 no hydrogen 2.701 N/A LYS 28.A N LEU 24.A O no hydrogen 2.906 N/A LYS 28.A NZ GLY 52.A O no hydrogen 2.843 N/A LYS 28.A NZ ILE 55.A O no hydrogen 2.781 N/A LYS 28.A NZ HIS 83.A O no hydrogen 2.829 N/A LYS 28.A NZ GLU 84.A O no hydrogen 2.842 N/A GLU 29.A N GLN 26.A O no hydrogen 3.433 N/A THR 30.A N MET 25.A O no hydrogen 3.114 N/A THR 30.A OG1 SER 54.A O no hydrogen 2.751 N/A ASN 31.A ND2 ASP 223.A O no hydrogen 2.876 N/A ASN 31.A ND2 ALA 248.A O no hydrogen 3.153 N/A LEU 32.A N THR 30.A OG1 no hydrogen 3.098 N/A CYS 33.A N ILE 225.A O no hydrogen 2.801 N/A CYS 33.A SG LEU 34.A O no hydrogen 3.871 N/A CYS 33.A SG MET 57.A O no hydrogen 3.787 N/A LEU 34.A N MET 57.A O no hydrogen 3.030 N/A SER 35.A N VAL 227.A O no hydrogen 2.846 N/A SER 35.A OG ASP 37.A OD1 no hydrogen 3.355 N/A SER 35.A OG ASP 37.A OD2 no hydrogen 2.773 N/A ALA 36.A N LYS 59.A O no hydrogen 2.897 N/A ASP 37.A N SER 35.A O no hydrogen 2.840 N/A VAL 38.A N ALA 36.A O no hydrogen 3.049 N/A LEU 40.A N GLU 43.A OE1.A no hydrogen 3.226 N/A ALA 41.A N ASP 67.A OD1 no hydrogen 2.773 N/A LEU 44.A N LEU 40.A O no hydrogen 3.056 N/A LEU 45.A N ALA 41.A O no hydrogen 2.915 N/A GLN 46.A N.A ARG 42.A O.A no hydrogen 2.734 N/A GLN 46.A N.A ARG 42.A O.B no hydrogen 3.013 N/A GLN 46.A N.B ARG 42.A O.A no hydrogen 2.738 N/A GLN 46.A N.B ARG 42.A O.B no hydrogen 3.018 N/A LEU 47.A N GLU 43.A O.A no hydrogen 2.930 N/A LEU 47.A N GLU 43.A O.B no hydrogen 2.983 N/A ALA 48.A N LEU 44.A O no hydrogen 2.966 N/A ASP 49.A N LEU 45.A O no hydrogen 2.957 N/A ALA 50.A N GLN 46.A O.A no hydrogen 2.996 N/A ALA 50.A N GLN 46.A O.B no hydrogen 2.937 N/A LEU 51.A N LEU 47.A O no hydrogen 2.816 N/A SER 54.A N LEU 51.A O no hydrogen 2.812 N/A SER 54.A OG GLU 242.A OE2 no hydrogen 2.607 N/A ILE 55.A N GLY 52.A O no hydrogen 3.328 N/A CYS 56.A N LEU 32.A O no hydrogen 2.853 N/A CYS 56.A SG LEU 32.A O no hydrogen 3.549 N/A LEU 58.A N LEU 86.A O no hydrogen 2.846 N/A LYS 59.A N LEU 34.A O no hydrogen 2.708 N/A LYS 59.A NZ SER 35.A OG no hydrogen 3.005 N/A LYS 59.A NZ ASP 90.A OD2 no hydrogen 2.704 N/A THR 60.A N PHE 88.A O no hydrogen 2.812 N/A THR 60.A OG1 PHE 88.A O no hydrogen 3.540 N/A THR 60.A OG1 GLU 89.A OE1 no hydrogen 2.718 N/A VAL 62.A N GLU 89.A OE1 no hydrogen 2.838 N/A ILE 64.A N.A HIS 61.A O no hydrogen 3.025 N/A ILE 64.A N.B HIS 61.A O no hydrogen 3.048 N/A LEU 65.A N VAL 62.A O no hydrogen 3.170 N/A ASN 66.A N SER 39.A O.A no hydrogen 2.728 N/A ASN 66.A N SER 39.A O.B no hydrogen 2.714 N/A VAL 72.A N THR 69.A O no hydrogen 3.124 N/A VAL 72.A N THR 69.A OG1 no hydrogen 3.213 N/A MET 73.A N.A THR 69.A O no hydrogen 3.431 N/A LYS 74.A N LEU 70.A O no hydrogen 2.891 N/A GLU 75.A N.A ASP 71.A O.A no hydrogen 3.101 N/A GLU 75.A N.A ASP 71.A O.B no hydrogen 2.973 N/A GLU 75.A N.B ASP 71.A O.A no hydrogen 3.099 N/A GLU 75.A N.B ASP 71.A O.B no hydrogen 2.968 N/A LEU 76.A N VAL 72.A O no hydrogen 2.912 N/A ILE 77.A N MET 73.A O.A no hydrogen 2.841 N/A ILE 77.A N MET 73.A O.B no hydrogen 2.961 N/A THR 78.A N LYS 74.A O no hydrogen 3.111 N/A THR 78.A OG1 LYS 74.A O no hydrogen 3.234 N/A LEU 79.A N GLU 75.A O.A no hydrogen 3.020 N/A LEU 79.A N GLU 75.A O.B no hydrogen 3.376 N/A ALA 80.A N LEU 76.A O no hydrogen 2.863 N/A LYS 81.A N ILE 77.A O no hydrogen 2.867 N/A CYS 82.A N THR 78.A O no hydrogen 2.940 N/A HIS 83.A N LEU 79.A O no hydrogen 2.860 N/A HIS 83.A NE2 ASP 49.A OD1 no hydrogen 2.692 N/A PHE 85.A N ALA 80.A O no hydrogen 3.043 N/A LEU 86.A N CYS 56.A O no hydrogen 3.079 N/A ILE 87.A N ASP 116.A OD2 no hydrogen 2.773 N/A PHE 88.A N LEU 58.A O no hydrogen 2.931 N/A GLU 89.A N LEU 117.A O no hydrogen 2.874 N/A ASP 90.A N THR 60.A O no hydrogen 2.876 N/A ARG 91.A NH2 ARG 91.A O no hydrogen 2.791 N/A LYS 92.A N.A ASN 119.A OD1 no hydrogen 2.834 N/A LYS 92.A N.B ASN 119.A OD1 no hydrogen 2.816 N/A LYS 92.A NZ.A ASP 90.A OD1 no hydrogen 2.691 N/A LYS 92.A NZ.B ASP 90.A OD1 no hydrogen 3.489 N/A PHE 93.A N ASN 119.A O no hydrogen 3.063 N/A ILE 96.A N ASP 95.A OD1 no hydrogen 2.817 N/A THR 99.A N ILE 96.A O no hydrogen 2.985 N/A VAL 100.A N ILE 96.A O no hydrogen 3.045 N/A LYS 101.A N GLY 97.A O no hydrogen 3.204 N/A LYS 101.A NZ GLU 134.A OE1.A no hydrogen 2.392 N/A LYS 102.A N.A THR 99.A O no hydrogen 3.051 N/A GLN 103.A N THR 99.A O no hydrogen 3.020 N/A TYR 104.A N VAL 100.A O no hydrogen 2.827 N/A GLU 105.A N.A LYS 101.A O no hydrogen 3.092 N/A GLU 105.A N.B LYS 101.A O no hydrogen 3.120 N/A GLY 106.A N LYS 102.A O.A no hydrogen 2.818 N/A GLY 106.A N LYS 102.A O.B no hydrogen 2.892 N/A LYS 110.A N GLY 106.A O no hydrogen 3.145 N/A LYS 110.A NZ GLU 105.A O.A no hydrogen 2.918 N/A LYS 110.A NZ GLU 105.A O.B no hydrogen 2.911 N/A ALA 112.A N TYR 104.A O no hydrogen 2.924 N/A SER 113.A N.A LYS 110.A O no hydrogen 2.889 N/A SER 113.A N.B LYS 110.A O no hydrogen 2.870 N/A SER 113.A OG.A LYS 110.A O no hydrogen 2.641 N/A TRP 114.A N ILE 111.A O no hydrogen 3.139 N/A TRP 114.A NE1 PHE 109.A O no hydrogen 2.767 N/A ALA 115.A N ILE 111.A O no hydrogen 2.932 N/A LEU 117.A N ILE 87.A O no hydrogen 3.040 N/A VAL 118.A N GLY 142.A O no hydrogen 3.183 N/A ASN 119.A ND2 ASP 90.A OD1 no hydrogen 2.781 N/A ALA 120.A N LEU 144.A O no hydrogen 2.986 N/A HIS 121.A N PHE 93.A O no hydrogen 2.815 N/A GLY 125.A N VAL 122.A O no hydrogen 2.932 N/A VAL 128.A N GLY 125.A O no hydrogen 3.083 N/A LYS 130.A N.A SER 126.A O no hydrogen 3.013 N/A LYS 130.A N.B SER 126.A O no hydrogen 3.023 N/A LYS 130.A N.C SER 126.A O no hydrogen 3.016 N/A LYS 130.A NZ.A HIS 171.A NE2 no hydrogen 2.992 N/A GLY 131.A N GLY 127.A O no hydrogen 2.895 N/A LEU 132.A N VAL 128.A O no hydrogen 3.248 N/A GLN 133.A N VAL 129.A O no hydrogen 2.819 N/A GLU 134.A N.A LYS 130.A O.A no hydrogen 3.315 N/A GLU 134.A N.A LYS 130.A O.B no hydrogen 3.326 N/A GLU 134.A N.A LYS 130.A O.C no hydrogen 3.287 N/A GLU 134.A N.B LYS 130.A O.A no hydrogen 3.309 N/A GLU 134.A N.B LYS 130.A O.B no hydrogen 3.320 N/A GLU 134.A N.B LYS 130.A O.C no hydrogen 3.281 N/A VAL 135.A N LEU 132.A O no hydrogen 3.078 N/A GLY 136.A N LEU 132.A O no hydrogen 2.732 N/A LEU 137.A N GLN 133.A O no hydrogen 2.852 N/A HIS 140.A N LEU 137.A O no hydrogen 2.913 N/A ARG 141.A N GLY 136.A O no hydrogen 2.921 N/A ARG 141.A NE ALA 112.A O no hydrogen 2.909 N/A ARG 141.A NH1 ALA 112.A O no hydrogen 2.917 N/A GLY 142.A N ASP 116.A O no hydrogen 3.026 N/A CYS 143.A N PHE 174.A O no hydrogen 2.879 N/A CYS 143.A SG VAL 118.A O no hydrogen 3.868 N/A CYS 143.A SG LEU 144.A O no hydrogen 3.786 N/A LEU 144.A N VAL 118.A O no hydrogen 2.812 N/A LEU 145.A N GLY 177.A O no hydrogen 2.921 N/A ILE 146.A N ALA 120.A O no hydrogen 2.988 N/A ALA 147.A N ILE 179.A O no hydrogen 2.832 N/A GLU 148.A N ILE 179.A O no hydrogen 3.330 N/A SER 150.A OG GLN 208.A OE1 no hydrogen 2.614 N/A THR 152.A N GLY 207.A O no hydrogen 2.766 N/A THR 152.A OG1 GLY 207.A O no hydrogen 3.374 N/A SER 154.A N SER 151.A O no hydrogen 3.179 N/A ALA 156.A N SER 154.A OG no hydrogen 3.128 N/A TYR 160.A N THR 157.A O no hydrogen 2.989 N/A THR 161.A OG1 ALA 147.A O no hydrogen 2.803 N/A ARG 162.A N GLY 158.A O no hydrogen 3.124 N/A ARG 162.A NE ASP 159.A OD1 no hydrogen 3.135 N/A ARG 162.A NH1 ASP 159.A OD1 no hydrogen 2.770 N/A ALA 163.A N ASP 159.A O no hydrogen 2.858 N/A ALA 164.A N TYR 160.A O no hydrogen 3.022 N/A VAL 165.A N THR 161.A O no hydrogen 3.077 N/A ARG 166.A N ARG 162.A O no hydrogen 3.017 N/A MET 167.A N.A ALA 163.A O no hydrogen 3.013 N/A MET 167.A N.B ALA 163.A O no hydrogen 3.003 N/A ALA 168.A N ALA 164.A O no hydrogen 2.977 N/A GLU 169.A N.A VAL 165.A O no hydrogen 2.953 N/A GLU 169.A N.B VAL 165.A O no hydrogen 2.956 N/A GLU 170.A N ARG 166.A O no hydrogen 3.022 N/A HIS 171.A N ALA 168.A O no hydrogen 3.069 N/A HIS 171.A ND1 MET 167.A O.A no hydrogen 2.848 N/A HIS 171.A ND1 MET 167.A O.B no hydrogen 2.857 N/A PHE 174.A N HIS 171.A O no hydrogen 3.000 N/A VAL 175.A N HIS 171.A O no hydrogen 2.839 N/A VAL 176.A N CYS 143.A O no hydrogen 2.836 N/A PHE 178.A N LEU 191.A O no hydrogen 2.792 N/A ILE 179.A N LEU 145.A O no hydrogen 2.901 N/A SER 180.A N LEU 193.A O no hydrogen 3.021 N/A SER 180.A OG SER 182.A O.A no hydrogen 2.594 N/A SER 180.A OG SER 182.A O.B no hydrogen 2.793 N/A GLY 181.A N GLU 148.A OE1 no hydrogen 2.766 N/A SER 182.A OG.B GLU 148.A OE1 no hydrogen 3.304 N/A SER 182.A OG.B ARG 183.A O no hydrogen 3.485 N/A ARG 183.A N ARG 220.A O no hydrogen 2.884 N/A ARG 183.A NE GLY 221.A O no hydrogen 3.032 N/A ARG 183.A NH1 GLU 2.A OE1 no hydrogen 2.874 N/A ARG 183.A NH1 GLY 221.A O no hydrogen 3.290 N/A ARG 183.A NH2 GLU 2.A OE1 no hydrogen 3.309 N/A VAL 184.A N HIS 192.A NE2 no hydrogen 3.020 N/A SER 185.A N HIS 192.A NE2 no hydrogen 3.222 N/A SER 185.A OG GLU 169.A OE1.B no hydrogen 2.860 N/A LYS 187.A N SER 185.A OG no hydrogen 3.026 N/A PHE 190.A N LYS 187.A O no hydrogen 3.169 N/A LEU 191.A N VAL 176.A O no hydrogen 2.877 N/A HIS 192.A N ASP 223.A OD2 no hydrogen 2.928 N/A LEU 193.A N PHE 178.A O no hydrogen 2.923 N/A THR 194.A N ILE 224.A O no hydrogen 2.815 N/A THR 194.A OG1 SER 180.A O no hydrogen 2.664 N/A THR 194.A OG1 SER 222.A OG.A no hydrogen 2.674 N/A THR 194.A OG1 SER 222.A OG.B no hydrogen 2.633 N/A GLN 198.A N.A ASN 211.A O no hydrogen 3.160 N/A GLN 198.A N.B ASN 211.A O no hydrogen 3.183 N/A GLN 198.A NE2.B GLU 200.A O no hydrogen 2.857 N/A GLN 198.A NE2.B ALA 201.A O no hydrogen 3.385 N/A LEU 199.A N TYR 244.A OH no hydrogen 2.967 N/A ASP 204.A N GLN 208.A O no hydrogen 3.153 N/A LEU 206.A N ASP 204.A OD1 no hydrogen 2.785 N/A GLN 208.A N ASP 204.A OD1 no hydrogen 2.907 N/A GLN 209.A N GLN 208.A OE1 no hydrogen 3.080 N/A GLN 209.A NE2 SER 150.A O no hydrogen 2.985 N/A TYR 210.A N GLY 202.A O no hydrogen 2.975 N/A ASN 211.A N GLY 196.A O no hydrogen 2.862 N/A GLU 215.A N SER 212.A OG no hydrogen 3.088 N/A VAL 216.A N SER 212.A O no hydrogen 2.938 N/A ILE 217.A N PRO 213.A O no hydrogen 2.892 N/A GLY 218.A N GLN 214.A O no hydrogen 2.833 N/A LYS 219.A N GLN 214.A O no hydrogen 3.237 N/A ARG 220.A N GLU 215.A O no hydrogen 2.882 N/A ARG 220.A NE GLU 215.A OE2 no hydrogen 2.686 N/A SER 222.A N.A VAL 216.A O no hydrogen 3.019 N/A SER 222.A N.B VAL 216.A O no hydrogen 3.018 N/A SER 222.A OG.A HIS 192.A O no hydrogen 3.062 N/A SER 222.A OG.A THR 194.A OG1 no hydrogen 2.674 N/A SER 222.A OG.B THR 194.A OG1 no hydrogen 2.633 N/A ASP 223.A N HIS 192.A O no hydrogen 2.972 N/A ILE 224.A N HIS 192.A O no hydrogen 3.051 N/A ILE 225.A N ASN 31.A O no hydrogen 3.088 N/A ILE 226.A N THR 194.A O no hydrogen 2.887 N/A VAL 227.A N CYS 33.A O no hydrogen 3.024 N/A ARG 229.A NH1 ASP 204.A OD2 no hydrogen 3.038 N/A ARG 229.A NH2 ASP 204.A OD2 no hydrogen 2.919 N/A ILE 231.A N GLY 228.A O no hydrogen 2.928 N/A ILE 232.A N.A GLY 228.A O no hydrogen 2.868 N/A ILE 232.A N.B GLY 228.A O no hydrogen 2.857 N/A SER 233.A N ARG 229.A O no hydrogen 3.002 N/A ALA 234.A N ILE 231.A O no hydrogen 3.039 N/A ARG 237.A NH1 ILE 232.A O.A no hydrogen 2.857 N/A ARG 237.A NH1 ILE 232.A O.B no hydrogen 2.849 N/A GLU 239.A N ASP 236.A OD1 no hydrogen 2.980 N/A ALA 240.A N ASP 236.A O no hydrogen 2.920 N/A ALA 241.A N ARG 237.A O no hydrogen 2.894 N/A GLU 242.A N LEU 238.A O no hydrogen 2.978 N/A MET 243.A N.A GLU 239.A O no hydrogen 2.879 N/A MET 243.A N.B GLU 239.A O no hydrogen 2.864 N/A TYR 244.A N ALA 240.A O no hydrogen 2.951 N/A ARG 245.A N ALA 241.A O no hydrogen 2.805 N/A ARG 245.A NE GLU 242.A OE1 no hydrogen 3.297 N/A ARG 245.A NE GLU 242.A OE2 no hydrogen 2.955 N/A ARG 245.A NH1 GLU 242.A OE1 no hydrogen 2.891 N/A ARG 245.A NH2 GLU 29.A O no hydrogen 2.939 N/A LYS 246.A N GLU 242.A O no hydrogen 2.832 N/A ALA 247.A N MET 243.A O.A no hydrogen 2.947 N/A ALA 247.A N MET 243.A O.B no hydrogen 2.997 N/A ALA 248.A N TYR 244.A O no hydrogen 2.931 N/A TRP 249.A N ARG 245.A O no hydrogen 2.832 N/A GLU 250.A N.A LYS 246.A O no hydrogen 2.969 N/A GLU 250.A N.B LYS 246.A O no hydrogen 2.938 N/A ALA 251.A N ALA 247.A O no hydrogen 3.094 N/A TYR 252.A N ALA 248.A O no hydrogen 3.042 N/A LEU 253.A N TRP 249.A O no hydrogen 2.924 N/A SER 254.A N.A GLU 250.A O.A no hydrogen 3.033 N/A SER 254.A N.A GLU 250.A O.B no hydrogen 2.906 N/A SER 254.A N.B GLU 250.A O.A no hydrogen 3.041 N/A SER 254.A N.B GLU 250.A O.B no hydrogen 2.912 N/A SER 254.A OG.A GLU 250.A O.A no hydrogen 3.478 N/A SER 254.A OG.A ALA 251.A O no hydrogen 2.744 N/A SER 254.A OG.B GLU 250.A O.A no hydrogen 2.854 N/A SER 254.A OG.B GLU 250.A O.B no hydrogen 3.059 N/A ARG 255.A N ALA 251.A O no hydrogen 3.142 N/A ARG 255.A NE GLU 2.A OE2 no hydrogen 3.212 N/A ARG 255.A NH1 ILE 217.A O no hydrogen 2.954 N/A ARG 255.A NH1 SER 222.A O.A no hydrogen 2.676 N/A ARG 255.A NH1 SER 222.A O.B no hydrogen 2.673 N/A ARG 255.A NH2 GLU 2.A OE2 no hydrogen 3.012 N/A ARG 255.A NH2 ASP 223.A OD1 no hydrogen 3.332 N/A LEU 256.A N TYR 252.A O no hydrogen 2.998 N/A GLY 257.A N LEU 253.A O no hydrogen 3.087 N/A GLY 257.A N SER 254.A O.A no hydrogen 2.907 N/A GLY 257.A N SER 254.A O.B no hydrogen 3.330 N/A