Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mi2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N TYR 251.A OH no hydrogen 2.938 N/A GLY 6.A N GLN 26.A OE1 no hydrogen 2.905 N/A ALA 7.A N SER 4.A OG no hydrogen 3.093 N/A ARG 8.A N SER 4.A O no hydrogen 2.873 N/A ARG 8.A NE PRO 187.A O no hydrogen 2.905 N/A ARG 8.A NH1 PRO 187.A O no hydrogen 3.206 N/A ARG 8.A NH1 ASP 222.A OD2 no hydrogen 2.974 N/A ARG 8.A NH2 ASP 222.A OD1 no hydrogen 2.794 N/A ALA 9.A N PHE 5.A O no hydrogen 2.996 N/A GLU 10.A N ALA 7.A O no hydrogen 2.968 N/A LEU 11.A N ARG 8.A O no hydrogen 3.085 N/A ILE 14.A N LEU 11.A O no hydrogen 3.125 N/A VAL 17.A N HIS 15.A ND1 no hydrogen 2.965 N/A SER 19.A N HIS 15.A O no hydrogen 2.865 N/A SER 19.A OG ALA 9.A O no hydrogen 2.744 N/A LYS 20.A N PRO 16.A O no hydrogen 3.019 N/A LEU 21.A N VAL 17.A O no hydrogen 3.027 N/A LEU 22.A N ALA 18.A O no hydrogen 2.825 N/A ARG 23.A N.A SER 19.A O no hydrogen 2.912 N/A ARG 23.A N.B SER 19.A O no hydrogen 2.949 N/A ARG 23.A NE.B SER 19.A OG no hydrogen 3.299 N/A ARG 23.A NH1.B SER 19.A OG no hydrogen 3.395 N/A LEU 24.A N LYS 20.A O no hydrogen 3.138 N/A MET 25.A N LEU 21.A O no hydrogen 2.919 N/A GLN 26.A N LEU 22.A O no hydrogen 3.034 N/A LYS 27.A N ARG 23.A O.A no hydrogen 2.912 N/A LYS 27.A N ARG 23.A O.B no hydrogen 2.989 N/A LYS 27.A NZ GLU 83.A OE2 no hydrogen 2.673 N/A LYS 28.A N LEU 24.A O no hydrogen 2.892 N/A LYS 28.A NZ GLY 52.A O no hydrogen 2.790 N/A LYS 28.A NZ ILE 55.A O no hydrogen 2.783 N/A LYS 28.A NZ HIS 82.A O no hydrogen 2.718 N/A LYS 28.A NZ GLU 83.A O no hydrogen 2.835 N/A THR 30.A N MET 25.A O no hydrogen 3.162 N/A THR 30.A OG1 SER 54.A O no hydrogen 2.723 N/A ASN 31.A ND2 ASP 222.A O no hydrogen 2.899 N/A ASN 31.A ND2 ALA 247.A O no hydrogen 3.223 N/A LEU 32.A N THR 30.A OG1 no hydrogen 3.096 N/A CYS 33.A N ILE 224.A O no hydrogen 2.762 N/A CYS 33.A SG LEU 34.A O no hydrogen 3.957 N/A LEU 34.A N MET 57.A O no hydrogen 2.988 N/A SER 35.A N VAL 226.A O no hydrogen 2.839 N/A SER 35.A OG ASP 37.A OD2 no hydrogen 2.754 N/A ALA 36.A N LYS 59.A O no hydrogen 2.941 N/A ASP 37.A N SER 35.A O no hydrogen 2.839 N/A VAL 38.A N ALA 36.A O no hydrogen 3.024 N/A ALA 41.A N ASP 67.A OD1 no hydrogen 2.865 N/A LEU 44.A N LEU 40.A O.A no hydrogen 2.992 N/A LEU 44.A N LEU 40.A O.B no hydrogen 2.986 N/A LEU 45.A N ALA 41.A O no hydrogen 2.911 N/A GLN 46.A N ARG 42.A O no hydrogen 2.905 N/A LEU 47.A N GLU 43.A O no hydrogen 2.890 N/A ALA 48.A N LEU 44.A O no hydrogen 2.904 N/A ASP 49.A N LEU 45.A O no hydrogen 2.967 N/A ALA 50.A N GLN 46.A O no hydrogen 3.045 N/A LEU 51.A N LEU 47.A O no hydrogen 2.828 N/A SER 54.A N LEU 51.A O no hydrogen 2.829 N/A SER 54.A OG GLU 241.A OE2 no hydrogen 2.689 N/A ILE 55.A N GLY 52.A O no hydrogen 3.406 N/A CYS 56.A N LEU 32.A O no hydrogen 2.867 N/A CYS 56.A SG LEU 32.A O no hydrogen 3.535 N/A LEU 58.A N LEU 85.A O no hydrogen 2.863 N/A LYS 59.A N LEU 34.A O no hydrogen 2.764 N/A LYS 59.A NZ SER 35.A OG no hydrogen 3.025 N/A LYS 59.A NZ ASP 89.A OD2 no hydrogen 2.734 N/A THR 60.A N PHE 87.A O no hydrogen 2.799 N/A THR 60.A OG1 PHE 87.A O no hydrogen 3.466 N/A THR 60.A OG1 GLU 88.A OE1 no hydrogen 2.748 N/A VAL 62.A N.A GLU 88.A OE1 no hydrogen 2.905 N/A VAL 62.A N.B GLU 88.A OE1 no hydrogen 2.846 N/A ILE 64.A N HIS 61.A O no hydrogen 3.006 N/A LEU 65.A N VAL 62.A O.A no hydrogen 3.084 N/A LEU 65.A N VAL 62.A O.B no hydrogen 3.330 N/A ASN 66.A N SER 39.A O no hydrogen 2.788 N/A VAL 72.A N THR 69.A OG1 no hydrogen 3.117 N/A LYS 74.A N LEU 70.A O no hydrogen 2.991 N/A GLU 75.A N.A ASP 71.A O.A no hydrogen 3.123 N/A GLU 75.A N.A ASP 71.A O.B no hydrogen 3.008 N/A GLU 75.A N.B ASP 71.A O.A no hydrogen 3.112 N/A GLU 75.A N.B ASP 71.A O.B no hydrogen 2.997 N/A LEU 76.A N VAL 72.A O no hydrogen 2.919 N/A ILE 77.A N MET 73.A O.A no hydrogen 2.928 N/A ILE 77.A N MET 73.A O.B no hydrogen 2.863 N/A THR 78.A N LYS 74.A O no hydrogen 3.046 N/A THR 78.A OG1 LYS 74.A O no hydrogen 3.249 N/A LEU 79.A N GLU 75.A O.A no hydrogen 3.174 N/A LEU 79.A N GLU 75.A O.B no hydrogen 3.188 N/A ALA 80.A N LEU 76.A O no hydrogen 2.884 N/A LYS 81.A N ILE 77.A O no hydrogen 2.906 N/A HIS 82.A NE2 ASP 49.A OD1 no hydrogen 2.849 N/A PHE 84.A N ALA 80.A O no hydrogen 3.001 N/A LEU 85.A N CYS 56.A O no hydrogen 3.077 N/A ILE 86.A N ASP 115.A OD2 no hydrogen 2.825 N/A PHE 87.A N LEU 58.A O no hydrogen 2.940 N/A GLU 88.A N LEU 116.A O no hydrogen 2.925 N/A ASP 89.A N THR 60.A O no hydrogen 2.896 N/A ARG 90.A NH2 ARG 90.A O no hydrogen 2.897 N/A LYS 91.A N ASN 118.A OD1 no hydrogen 2.831 N/A LYS 91.A NZ ASP 89.A OD1 no hydrogen 2.766 N/A PHE 92.A N ASN 118.A O no hydrogen 3.134 N/A ILE 95.A N ASP 94.A OD1 no hydrogen 2.783 N/A THR 98.A N ILE 95.A O no hydrogen 3.017 N/A VAL 99.A N ILE 95.A O no hydrogen 3.036 N/A LYS 100.A N GLY 96.A O no hydrogen 3.204 N/A LYS 100.A NZ ASN 97.A O no hydrogen 3.193 N/A LYS 100.A NZ ASN 97.A OD1 no hydrogen 3.563 N/A LYS 101.A N THR 98.A O no hydrogen 3.053 N/A GLN 102.A N THR 98.A O no hydrogen 3.108 N/A TYR 103.A N VAL 99.A O no hydrogen 2.889 N/A GLU 104.A N LYS 100.A O no hydrogen 3.183 N/A GLY 105.A N LYS 101.A O no hydrogen 2.856 N/A LYS 109.A N GLY 105.A O no hydrogen 3.132 N/A ALA 111.A N TYR 103.A O no hydrogen 2.929 N/A SER 112.A N LYS 109.A O no hydrogen 2.922 N/A SER 112.A OG LYS 109.A O no hydrogen 2.694 N/A TRP 113.A N ILE 110.A O no hydrogen 3.118 N/A TRP 113.A NE1 PHE 108.A O no hydrogen 2.828 N/A ALA 114.A N ILE 110.A O no hydrogen 2.936 N/A LEU 116.A N ILE 86.A O no hydrogen 3.077 N/A VAL 117.A N GLY 141.A O no hydrogen 3.208 N/A ASN 118.A ND2 ASP 89.A OD1 no hydrogen 2.717 N/A ALA 119.A N LEU 143.A O no hydrogen 2.950 N/A HIS 120.A N PHE 92.A O no hydrogen 2.825 N/A GLY 124.A N VAL 121.A O no hydrogen 2.932 N/A VAL 127.A N GLY 124.A O no hydrogen 3.105 N/A LYS 129.A N.A SER 125.A O no hydrogen 3.028 N/A LYS 129.A N.B SER 125.A O no hydrogen 3.024 N/A LYS 129.A NZ.A HIS 170.A NE2 no hydrogen 2.886 N/A GLY 130.A N GLY 126.A O no hydrogen 2.851 N/A LEU 131.A N VAL 127.A O no hydrogen 3.203 N/A GLN 132.A N VAL 128.A O no hydrogen 2.810 N/A GLU 133.A N.A LYS 129.A O.A no hydrogen 3.318 N/A GLU 133.A N.A LYS 129.A O.B no hydrogen 3.202 N/A GLU 133.A N.B LYS 129.A O.A no hydrogen 3.280 N/A GLU 133.A N.B LYS 129.A O.B no hydrogen 3.163 N/A VAL 134.A N LEU 131.A O no hydrogen 3.058 N/A GLY 135.A N LEU 131.A O no hydrogen 2.741 N/A LEU 136.A N GLN 132.A O no hydrogen 2.885 N/A LEU 138.A N VAL 134.A O no hydrogen 3.414 N/A HIS 139.A N.A LEU 136.A O no hydrogen 2.996 N/A HIS 139.A N.B LEU 136.A O no hydrogen 2.987 N/A ARG 140.A N GLY 135.A O no hydrogen 2.901 N/A ARG 140.A NE ALA 111.A O no hydrogen 2.986 N/A ARG 140.A NH1 ALA 111.A O no hydrogen 2.970 N/A GLY 141.A N ASP 115.A O no hydrogen 3.031 N/A CYS 142.A N PHE 173.A O no hydrogen 2.935 N/A CYS 142.A SG VAL 117.A O no hydrogen 3.913 N/A CYS 142.A SG LEU 143.A O no hydrogen 3.836 N/A LEU 143.A N VAL 117.A O no hydrogen 2.821 N/A LEU 144.A N GLY 176.A O no hydrogen 2.935 N/A ILE 145.A N ALA 119.A O no hydrogen 2.918 N/A ALA 146.A N ILE 178.A O no hydrogen 2.863 N/A GLU 147.A N ILE 178.A O no hydrogen 3.411 N/A SER 149.A OG GLN 207.A OE1 no hydrogen 2.646 N/A THR 151.A N GLY 206.A O no hydrogen 2.824 N/A THR 151.A OG1 GLY 206.A O no hydrogen 3.387 N/A SER 153.A N SER 150.A O no hydrogen 3.124 N/A ALA 155.A N SER 153.A OG no hydrogen 3.120 N/A TYR 159.A N THR 156.A O no hydrogen 3.022 N/A THR 160.A OG1 ALA 146.A O no hydrogen 2.829 N/A ARG 161.A N GLY 157.A O no hydrogen 3.171 N/A ARG 161.A NE ASP 158.A OD1 no hydrogen 3.209 N/A ARG 161.A NH1 ASP 158.A OD1 no hydrogen 2.570 N/A ALA 162.A N ASP 158.A O no hydrogen 2.921 N/A ALA 163.A N TYR 159.A O no hydrogen 3.034 N/A VAL 164.A N THR 160.A O no hydrogen 3.021 N/A ARG 165.A N ARG 161.A O no hydrogen 2.933 N/A MET 166.A N.A ALA 162.A O no hydrogen 2.907 N/A MET 166.A N.B ALA 162.A O no hydrogen 2.903 N/A ALA 167.A N ALA 163.A O no hydrogen 2.971 N/A GLU 168.A N.A VAL 164.A O no hydrogen 2.930 N/A GLU 168.A N.B VAL 164.A O no hydrogen 2.996 N/A GLU 169.A N ARG 165.A O no hydrogen 3.021 N/A HIS 170.A N ALA 167.A O no hydrogen 3.034 N/A HIS 170.A ND1 MET 166.A O.A no hydrogen 2.813 N/A HIS 170.A ND1 MET 166.A O.B no hydrogen 2.844 N/A GLU 172.A N GLU 172.A OE2 no hydrogen 2.730 N/A PHE 173.A N HIS 170.A O no hydrogen 3.062 N/A VAL 174.A N HIS 170.A O no hydrogen 2.824 N/A VAL 175.A N CYS 142.A O no hydrogen 2.851 N/A PHE 177.A N LEU 190.A O.A no hydrogen 2.818 N/A PHE 177.A N LEU 190.A O.B no hydrogen 2.805 N/A ILE 178.A N LEU 144.A O no hydrogen 2.901 N/A SER 179.A N LEU 192.A O no hydrogen 2.982 N/A SER 179.A OG SER 181.A O.A no hydrogen 2.833 N/A SER 179.A OG SER 181.A O.B no hydrogen 2.609 N/A GLY 180.A N GLU 147.A OE1 no hydrogen 2.787 N/A SER 181.A OG.B GLU 147.A OE1 no hydrogen 3.387 N/A SER 181.A OG.B ARG 182.A O.A no hydrogen 3.118 N/A ARG 182.A N.A ARG 219.A O no hydrogen 2.845 N/A ARG 182.A N.B ARG 219.A O no hydrogen 2.872 N/A ARG 182.A NE.A GLY 220.A O no hydrogen 3.092 N/A ARG 182.A NH1.A GLU 2.A OE1 no hydrogen 3.405 N/A ARG 182.A NH1.A GLU 2.A OE2 no hydrogen 2.866 N/A ARG 182.A NH1.A GLY 220.A O no hydrogen 3.208 N/A VAL 183.A N HIS 191.A NE2 no hydrogen 3.023 N/A SER 184.A N HIS 191.A NE2 no hydrogen 3.197 N/A SER 184.A OG GLU 168.A OE2.A no hydrogen 2.657 N/A LYS 186.A N SER 184.A OG no hydrogen 3.064 N/A LYS 186.A NZ GLU 168.A OE1.B no hydrogen 3.070 N/A GLU 188.A N.B GLU 188.A OE1.B no hydrogen 2.790 N/A PHE 189.A N LYS 186.A O no hydrogen 3.219 N/A LEU 190.A N.A VAL 175.A O no hydrogen 2.955 N/A LEU 190.A N.B VAL 175.A O no hydrogen 2.943 N/A HIS 191.A N ASP 222.A OD2 no hydrogen 2.873 N/A LEU 192.A N PHE 177.A O no hydrogen 2.885 N/A THR 193.A N ILE 223.A O no hydrogen 2.818 N/A THR 193.A OG1 SER 179.A O no hydrogen 2.718 N/A THR 193.A OG1 SER 221.A OG.A no hydrogen 2.681 N/A THR 193.A OG1 SER 221.A OG.B no hydrogen 2.753 N/A GLN 197.A N.A ASN 210.A O no hydrogen 3.088 N/A GLN 197.A N.B ASN 210.A O no hydrogen 3.053 N/A LEU 198.A N TYR 243.A OH no hydrogen 2.975 N/A ASP 203.A N GLN 207.A O no hydrogen 3.030 N/A LEU 205.A N ASP 203.A OD1 no hydrogen 2.822 N/A GLN 207.A N ASP 203.A OD1 no hydrogen 2.814 N/A GLN 208.A N GLN 207.A OE1 no hydrogen 3.199 N/A GLN 208.A NE2 SER 149.A O no hydrogen 3.045 N/A TYR 209.A N GLY 201.A O no hydrogen 2.980 N/A ASN 210.A N GLY 195.A O no hydrogen 2.884 N/A GLU 214.A N SER 211.A OG no hydrogen 3.087 N/A VAL 215.A N SER 211.A O no hydrogen 2.955 N/A ILE 216.A N PRO 212.A O no hydrogen 2.909 N/A GLY 217.A N GLN 213.A O no hydrogen 2.848 N/A LYS 218.A NZ.B GLU 214.A OE1 no hydrogen 3.339 N/A ARG 219.A N GLU 214.A O no hydrogen 2.914 N/A ARG 219.A NE GLU 214.A OE2 no hydrogen 2.746 N/A ARG 219.A NH1 GLU 214.A OE2 no hydrogen 3.472 N/A GLY 220.A N GLY 217.A O no hydrogen 3.344 N/A SER 221.A N.A VAL 215.A O no hydrogen 3.034 N/A SER 221.A N.B VAL 215.A O no hydrogen 3.026 N/A SER 221.A OG.A HIS 191.A O no hydrogen 3.014 N/A SER 221.A OG.A THR 193.A OG1 no hydrogen 2.681 N/A SER 221.A OG.B THR 193.A OG1 no hydrogen 2.753 N/A ASP 222.A N HIS 191.A O no hydrogen 2.964 N/A ILE 223.A N HIS 191.A O no hydrogen 3.061 N/A ILE 224.A N ASN 31.A O no hydrogen 3.077 N/A ILE 225.A N THR 193.A O no hydrogen 2.860 N/A VAL 226.A N CYS 33.A O no hydrogen 3.073 N/A ARG 228.A NH1 ASP 203.A OD2 no hydrogen 2.970 N/A ARG 228.A NH2 ASP 203.A OD2 no hydrogen 2.961 N/A ILE 230.A N GLY 227.A O no hydrogen 2.885 N/A ILE 231.A N GLY 227.A O no hydrogen 2.861 N/A SER 232.A N ARG 228.A O no hydrogen 3.005 N/A ALA 233.A N ILE 230.A O no hydrogen 3.045 N/A ARG 236.A NH1 GLU 43.A OE2 no hydrogen 2.823 N/A ARG 236.A NH2 GLU 43.A OE2 no hydrogen 3.032 N/A ARG 236.A NH2 ILE 231.A O no hydrogen 2.888 N/A GLU 238.A N ASP 235.A OD1 no hydrogen 3.064 N/A ALA 239.A N ASP 235.A O no hydrogen 3.070 N/A ALA 240.A N ARG 236.A O no hydrogen 2.936 N/A GLU 241.A N LEU 237.A O no hydrogen 2.947 N/A MET 242.A N.A GLU 238.A O no hydrogen 2.938 N/A MET 242.A N.B GLU 238.A O no hydrogen 2.950 N/A TYR 243.A N ALA 239.A O no hydrogen 3.010 N/A ARG 244.A N ALA 240.A O no hydrogen 2.781 N/A ARG 244.A NE GLU 241.A OE1 no hydrogen 3.400 N/A ARG 244.A NE GLU 241.A OE2 no hydrogen 2.974 N/A ARG 244.A NH1 GLU 241.A OE1 no hydrogen 2.981 N/A ARG 244.A NH2 GLU 29.A O no hydrogen 2.964 N/A LYS 245.A N GLU 241.A O no hydrogen 2.920 N/A ALA 246.A N MET 242.A O.A no hydrogen 3.083 N/A ALA 246.A N MET 242.A O.B no hydrogen 3.083 N/A ALA 247.A N TYR 243.A O no hydrogen 3.002 N/A TRP 248.A N ARG 244.A O no hydrogen 2.878 N/A GLU 249.A N.A LYS 245.A O no hydrogen 2.981 N/A GLU 249.A N.B LYS 245.A O no hydrogen 2.985 N/A ALA 250.A N ALA 246.A O no hydrogen 3.147 N/A TYR 251.A N ALA 247.A O no hydrogen 3.067 N/A LEU 252.A N TRP 248.A O no hydrogen 2.929 N/A SER 253.A N GLU 249.A O.A no hydrogen 2.925 N/A SER 253.A N GLU 249.A O.B no hydrogen 2.872 N/A SER 253.A OG GLU 249.A O.A no hydrogen 3.092 N/A SER 253.A OG GLU 249.A O.B no hydrogen 3.137 N/A ARG 254.A N ALA 250.A O no hydrogen 3.084 N/A ARG 254.A NE GLU 2.A OE1 no hydrogen 3.066 N/A ARG 254.A NH1 ILE 216.A O no hydrogen 2.613 N/A ARG 254.A NH1 SER 221.A O.A no hydrogen 2.689 N/A ARG 254.A NH1 SER 221.A O.B no hydrogen 2.685 N/A ARG 254.A NH2 GLU 2.A OE2 no hydrogen 3.187 N/A LEU 255.A N TYR 251.A O no hydrogen 2.925 N/A GLY 256.A N LEU 252.A O no hydrogen 3.065 N/A