Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3t44_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N THR 1.A O no hydrogen 3.101 N/A SER 5.A OG THR 1.A O no hydrogen 3.486 N/A SER 5.A OG VAL 2.A O no hydrogen 2.651 N/A ILE 6.A N VAL 2.A O no hydrogen 2.963 N/A LEU 7.A N LEU 3.A O no hydrogen 2.895 N/A GLU 8.A N ASP 4.A O no hydrogen 3.048 N/A GLY 9.A N SER 5.A O no hydrogen 3.231 N/A VAL 10.A N ILE 6.A O no hydrogen 2.896 N/A ARG 11.A N LEU 7.A O no hydrogen 2.924 N/A ALA 12.A N GLU 8.A O no hydrogen 3.341 N/A ASP 13.A N GLY 9.A O no hydrogen 2.894 N/A VAL 14.A N VAL 10.A O no hydrogen 2.806 N/A ALA 15.A N ARG 11.A O no hydrogen 3.062 N/A ALA 16.A N ALA 12.A O no hydrogen 3.000 N/A ARG 17.A N ASP 13.A O no hydrogen 3.008 N/A ARG 17.A NE GLU 126.A OE2 no hydrogen 2.725 N/A ARG 17.A NH2 GLU 126.A OE1 no hydrogen 2.983 N/A ARG 17.A NH2 GLU 126.A OE2 no hydrogen 3.539 N/A GLU 18.A N VAL 14.A O no hydrogen 2.835 N/A ALA 19.A N ALA 15.A O no hydrogen 3.008 N/A SER 20.A N ARG 17.A O no hydrogen 3.009 N/A VAL 21.A N ARG 17.A O no hydrogen 2.850 N/A SER 22.A N GLU 25.A OE1 no hydrogen 2.839 N/A GLU 25.A N SER 22.A OG no hydrogen 3.000 N/A ILE 26.A N SER 22.A O no hydrogen 2.938 N/A LYS 27.A N LEU 23.A O no hydrogen 2.862 N/A ALA 28.A N SER 24.A O no hydrogen 2.953 N/A ALA 29.A N GLU 25.A O no hydrogen 2.906 N/A ALA 30.A N ILE 26.A O no hydrogen 2.903 N/A ALA 31.A N LYS 27.A O no hydrogen 2.969 N/A ALA 32.A N ALA 28.A O no hydrogen 2.990 N/A ALA 32.A N ALA 29.A O no hydrogen 3.261 N/A ALA 33.A N ALA 30.A O no hydrogen 3.296 N/A LEU 37.A N ASP 133.A OD1 no hydrogen 2.873 N/A ALA 41.A N ASP 38.A OD1 no hydrogen 3.110 N/A ALA 42.A N ASP 38.A O no hydrogen 3.199 N/A LEU 43.A N VAL 39.A O no hydrogen 2.859 N/A ARG 44.A N MET 40.A O no hydrogen 3.077 N/A ARG 44.A N ALA 41.A O no hydrogen 3.194 N/A GLU 45.A N ALA 42.A O no hydrogen 3.230 N/A GLY 49.A N ASP 233.A O no hydrogen 3.170 N/A ILE 51.A N VAL 235.A O no hydrogen 2.812 N/A ALA 52.A N ILE 84.A O no hydrogen 3.066 N/A GLU 53.A N VAL 237.A O no hydrogen 2.885 N/A VAL 54.A N SER 86.A O no hydrogen 2.736 N/A ARG 56.A NE THR 66.A O no hydrogen 2.837 N/A ARG 56.A NE ILE 67.A O no hydrogen 3.250 N/A ARG 56.A NH1 GLN 95.A O no hydrogen 2.903 N/A ARG 56.A NH1 ASP 100.A OD1 no hydrogen 3.478 N/A ARG 56.A NH1 ASP 100.A OD2 no hydrogen 2.739 N/A ARG 56.A NH2 ILE 67.A O no hydrogen 2.852 N/A ARG 56.A NH2 ASP 100.A OD1 no hydrogen 2.971 N/A SER 58.A N GLY 62.A O no hydrogen 2.936 N/A ALA 61.A N SER 58.A OG no hydrogen 2.998 N/A GLY 62.A N SER 58.A O no hydrogen 2.755 N/A LEU 64.A N ARG 56.A O no hydrogen 2.759 N/A ALA 65.A N ARG 56.A O no hydrogen 3.094 N/A LYS 72.A N ASP 69.A OD1 no hydrogen 3.142 N/A LEU 73.A N ASP 69.A O no hydrogen 3.140 N/A ALA 74.A N PRO 70.A O no hydrogen 2.903 N/A GLN 75.A N ALA 71.A O no hydrogen 2.866 N/A ALA 76.A N LYS 72.A O no hydrogen 3.053 N/A TYR 77.A N LEU 73.A O no hydrogen 2.960 N/A TYR 77.A OH GLU 53.A O no hydrogen 2.760 N/A GLN 78.A N ALA 74.A O no hydrogen 2.883 N/A ASP 79.A N GLN 75.A O no hydrogen 2.841 N/A GLY 80.A N ALA 76.A O no hydrogen 2.895 N/A GLY 81.A N GLN 78.A O no hydrogen 2.982 N/A ALA 82.A N TYR 77.A O no hydrogen 3.020 N/A ARG 83.A N VAL 50.A O no hydrogen 2.817 N/A ARG 83.A NH1 ALA 42.A O no hydrogen 2.970 N/A ARG 83.A NH1 GLU 45.A O no hydrogen 3.322 N/A ARG 83.A NH2 GLY 47.A O no hydrogen 3.215 N/A VAL 85.A N PRO 111.A O no hydrogen 3.029 N/A SER 86.A N ALA 52.A O no hydrogen 2.893 N/A SER 86.A OG GLU 53.A OE2 no hydrogen 2.702 N/A VAL 87.A N LEU 113.A O no hydrogen 2.854 N/A VAL 88.A N VAL 54.A O no hydrogen 3.017 N/A THR 89.A N LYS 115.A O no hydrogen 3.003 N/A THR 89.A OG1 ASP 116.A OD2 no hydrogen 2.558 N/A ARG 92.A N GLU 90.A OE1 no hydrogen 2.982 N/A ARG 92.A NE ASP 13.A OD1 no hydrogen 3.391 N/A ARG 92.A NE ASP 13.A OD2 no hydrogen 2.999 N/A ARG 92.A NH2 ASP 13.A OD1 no hydrogen 2.959 N/A ARG 93.A N GLU 90.A OE2 no hydrogen 2.746 N/A PHE 94.A N GLU 90.A OE2 no hydrogen 3.240 N/A GLN 95.A N GLN 91.A O no hydrogen 3.127 N/A GLY 96.A N GLU 90.A O no hydrogen 2.856 N/A SER 97.A N ASP 100.A OD2 no hydrogen 3.097 N/A ASP 100.A N SER 97.A O no hydrogen 2.930 N/A ASP 102.A N LEU 98.A O no hydrogen 3.051 N/A ALA 103.A N ASP 99.A O no hydrogen 3.026 N/A VAL 104.A N ASP 100.A O no hydrogen 2.959 N/A ARG 105.A N LEU 101.A O no hydrogen 2.869 N/A ARG 105.A NE ARG 105.A O no hydrogen 2.904 N/A ARG 105.A NH1 GLY 131.A O no hydrogen 3.146 N/A ARG 105.A NH1 ASP 133.A OD2 no hydrogen 2.728 N/A ARG 105.A NH2 VAL 108.A O no hydrogen 3.135 N/A ARG 105.A NH2 ILE 110.A O no hydrogen 2.896 N/A ALA 106.A N ASP 102.A O no hydrogen 3.046 N/A SER 107.A N VAL 104.A O no hydrogen 2.988 N/A SER 107.A OG.A ALA 71.A O no hydrogen 3.311 N/A SER 107.A OG.A ALA 103.A O no hydrogen 3.421 N/A SER 107.A OG.A VAL 104.A O no hydrogen 2.986 N/A SER 107.A OG.B ALA 103.A O no hydrogen 3.295 N/A VAL 108.A N VAL 104.A O no hydrogen 3.169 N/A SER 109.A N GLN 78.A OE1 no hydrogen 2.822 N/A ILE 110.A N GLN 78.A OE1 no hydrogen 3.216 N/A VAL 112.A N ASP 133.A OD2 no hydrogen 2.799 N/A LEU 113.A N VAL 85.A O no hydrogen 2.813 N/A ARG 114.A N MET 134.A O no hydrogen 2.940 N/A ARG 114.A NE THR 89.A OG1 no hydrogen 2.868 N/A ARG 114.A NH1 GLU 126.A OE1 no hydrogen 2.872 N/A ARG 114.A NH2 ASP 116.A OD2 no hydrogen 3.457 N/A ARG 114.A NH2 GLU 126.A OE1 no hydrogen 3.013 N/A LYS 115.A N VAL 87.A O no hydrogen 2.873 N/A LYS 115.A NZ GLU 53.A OE2 no hydrogen 2.695 N/A LYS 115.A NZ GLU 215.A OE1 no hydrogen 2.901 N/A PHE 117.A N ASP 116.A OD1 no hydrogen 2.659 N/A VAL 119.A N GLN 123.A OE1 no hydrogen 2.819 N/A GLN 120.A N GLN 123.A OE1 no hydrogen 3.139 N/A TYR 122.A OH VAL 21.A O no hydrogen 2.662 N/A GLN 123.A N GLN 120.A O no hydrogen 3.051 N/A GLN 123.A NE2 PHE 117.A O no hydrogen 2.915 N/A ILE 124.A N PRO 121.A O no hydrogen 2.840 N/A HIS 125.A N PRO 121.A O no hydrogen 3.256 N/A GLU 126.A N TYR 122.A O no hydrogen 2.918 N/A ALA 127.A N GLN 123.A O no hydrogen 2.939 N/A ARG 128.A N ILE 124.A O no hydrogen 3.113 N/A ARG 128.A NE ALA 132.A O no hydrogen 3.000 N/A ARG 128.A NH1 ALA 132.A O no hydrogen 2.809 N/A ARG 128.A NH2 PRO 34.A O no hydrogen 2.825 N/A ALA 129.A N HIS 125.A O no hydrogen 2.846 N/A HIS 130.A N GLU 126.A O no hydrogen 3.075 N/A HIS 130.A N ALA 127.A O no hydrogen 3.222 N/A HIS 130.A ND1 ASP 102.A OD1 no hydrogen 2.578 N/A GLY 131.A N ARG 128.A O no hydrogen 3.082 N/A ALA 132.A N ALA 127.A O no hydrogen 2.981 N/A ASP 133.A N VAL 112.A O no hydrogen 2.846 N/A MET 134.A N VAL 112.A O no hydrogen 3.062 N/A LEU 135.A N THR 160.A O no hydrogen 2.906 N/A LEU 136.A N ARG 114.A O no hydrogen 3.198 N/A LEU 137.A N LEU 162.A O no hydrogen 2.936 N/A VAL 139.A N GLU 164.A O no hydrogen 2.966 N/A ALA 141.A N ILE 138.A O no hydrogen 2.942 N/A LEU 142.A N VAL 139.A O no hydrogen 3.193 N/A GLN 144.A NE2 ARG 173.A O no hydrogen 2.985 N/A SER 145.A N GLU 143.A OE2 no hydrogen 2.913 N/A VAL 146.A N GLU 143.A OE1 no hydrogen 3.218 N/A LEU 147.A N GLU 143.A O no hydrogen 2.866 N/A VAL 148.A N GLN 144.A O no hydrogen 3.021 N/A SER 149.A N SER 145.A O no hydrogen 3.164 N/A MET 150.A N VAL 146.A O no hydrogen 2.856 N/A LEU 151.A N.A LEU 147.A O no hydrogen 2.865 N/A LEU 151.A N.B LEU 147.A O no hydrogen 2.863 N/A ASP 152.A N VAL 148.A O no hydrogen 2.888 N/A ARG 153.A N SER 149.A O no hydrogen 2.947 N/A ARG 153.A NH1 HIS 125.A NE2 no hydrogen 2.952 N/A THR 154.A N MET 150.A O no hydrogen 2.929 N/A THR 154.A OG1 MET 150.A O no hydrogen 2.755 N/A GLU 155.A N LEU 151.A O.A no hydrogen 3.042 N/A GLU 155.A N LEU 151.A O.B no hydrogen 3.055 N/A SER 156.A N ASP 152.A O no hydrogen 2.903 N/A SER 156.A OG ARG 153.A O no hydrogen 2.576 N/A LEU 157.A N ARG 153.A O no hydrogen 3.280 N/A LEU 157.A N THR 154.A O no hydrogen 3.268 N/A GLY 158.A N GLU 155.A O no hydrogen 2.876 N/A MET 159.A N THR 154.A O no hydrogen 3.160 N/A THR 160.A N ASP 133.A O no hydrogen 3.099 N/A LEU 162.A N LEU 135.A O no hydrogen 2.903 N/A VAL 163.A N VAL 181.A O no hydrogen 3.064 N/A GLU 164.A N LEU 137.A O no hydrogen 2.755 N/A VAL 165.A N GLY 183.A O no hydrogen 2.779 N/A HIS 166.A N GLU 170.A OE1 no hydrogen 2.760 N/A HIS 166.A ND1 ASN 185.A O no hydrogen 2.776 N/A THR 167.A OG1 GLN 169.A OE1.A no hydrogen 3.095 N/A GLU 170.A N THR 167.A OG1 no hydrogen 2.946 N/A ALA 171.A N THR 167.A O no hydrogen 2.948 N/A ASP 172.A N GLU 168.A O no hydrogen 2.859 N/A ARG 173.A N GLN 169.A O.A no hydrogen 3.050 N/A ARG 173.A N GLN 169.A O.B no hydrogen 3.036 N/A ARG 173.A NE GLN 144.A OE1 no hydrogen 2.946 N/A ARG 173.A NH1 VAL 139.A O no hydrogen 3.383 N/A ARG 173.A NH2 LEU 142.A O no hydrogen 2.748 N/A ARG 173.A NH2 GLN 144.A OE1 no hydrogen 3.065 N/A ALA 174.A N GLU 170.A O no hydrogen 2.914 N/A LEU 175.A N ALA 171.A O no hydrogen 2.998 N/A LYS 176.A N ASP 172.A O no hydrogen 3.068 N/A ALA 177.A N ARG 173.A O no hydrogen 2.967 N/A GLY 178.A N LEU 175.A O no hydrogen 2.981 N/A ALA 179.A N ALA 174.A O no hydrogen 3.005 N/A LYS 180.A NZ GLU 155.A OE1 no hydrogen 3.389 N/A LYS 180.A NZ GLU 155.A OE2 no hydrogen 2.924 N/A LYS 180.A NZ GLY 178.A O no hydrogen 2.828 N/A ILE 182.A N ILE 211.A O no hydrogen 2.939 N/A GLY 183.A N VAL 163.A O no hydrogen 2.880 N/A VAL 184.A N ILE 213.A O no hydrogen 2.822 N/A ASN 185.A N VAL 165.A O no hydrogen 2.918 N/A ASN 185.A ND2 GLU 164.A OE2 no hydrogen 2.980 N/A ALA 186.A N GLU 215.A O no hydrogen 3.059 N/A ARG 187.A N ASN 185.A OD1 no hydrogen 2.932 N/A ARG 187.A NH1 LEU 192.A O no hydrogen 2.906 N/A ASP 188.A N ASP 193.A O no hydrogen 2.814 N/A MET 190.A N ASP 188.A OD1 no hydrogen 2.777 N/A THR 191.A N ASP 188.A OD1 no hydrogen 3.369 N/A LEU 192.A N ASP 188.A O no hydrogen 2.605 N/A ASP 193.A N THR 191.A OG1 no hydrogen 3.319 N/A ASP 195.A N ALA 186.A O no hydrogen 2.856 N/A ARG 196.A NE GLY 217.A O no hydrogen 2.985 N/A ARG 196.A NH2 GLY 217.A O no hydrogen 2.900 N/A ASP 197.A N ASP 195.A OD1 no hydrogen 2.963 N/A CYS 198.A N ASP 195.A O no hydrogen 3.302 N/A CYS 198.A SG.A HIS 166.A O no hydrogen 3.821 N/A CYS 198.A SG.A ASP 195.A O no hydrogen 3.373 N/A CYS 198.A SG.B HIS 166.A O no hydrogen 2.794 N/A ARG 201.A N ASP 197.A O no hydrogen 2.982 N/A ARG 201.A NE ASP 197.A O no hydrogen 3.551 N/A ILE 202.A N CYS 198.A O no hydrogen 2.984 N/A ALA 203.A N PHE 199.A O no hydrogen 2.711 N/A GLY 205.A N ILE 202.A O no hydrogen 3.091 N/A LEU 206.A N ALA 203.A O no hydrogen 3.106 N/A VAL 210.A N PRO 207.A O no hydrogen 2.978 N/A ILE 211.A N LYS 180.A O no hydrogen 3.033 N/A ARG 212.A N ASP 233.A OD2 no hydrogen 2.853 N/A ARG 212.A NH1 PRO 207.A O no hydrogen 2.889 N/A ARG 212.A NH1 VAL 210.A O no hydrogen 2.947 N/A ARG 212.A NH2 LEU 206.A O no hydrogen 2.859 N/A ILE 213.A N ILE 182.A O no hydrogen 2.916 N/A ALA 214.A N ALA 234.A O no hydrogen 2.994 N/A GLU 215.A N VAL 184.A O no hydrogen 2.931 N/A SER 216.A N LEU 236.A O no hydrogen 3.326 N/A SER 216.A OG ASN 185.A OD1 no hydrogen 2.686 N/A ARG 219.A N ASP 223.A OD2 no hydrogen 2.787 N/A ARG 219.A NE ASP 223.A OD2 no hydrogen 2.920 N/A ARG 219.A NH2 ASP 223.A OD1 no hydrogen 3.042 N/A LEU 224.A N GLY 220.A O no hydrogen 3.394 N/A LEU 225.A N THR 221.A O no hydrogen 2.874 N/A ALA 226.A N ALA 222.A O no hydrogen 2.957 N/A TYR 227.A N ASP 223.A O no hydrogen 3.150 N/A TYR 227.A OH SER 216.A O no hydrogen 2.691 N/A ALA 228.A N LEU 224.A O no hydrogen 2.902 N/A GLY 229.A N LEU 225.A O no hydrogen 2.834 N/A ALA 230.A N ALA 226.A O no hydrogen 3.225 N/A ALA 230.A N TYR 227.A O no hydrogen 3.087 N/A GLY 231.A N ALA 228.A O no hydrogen 3.034 N/A ALA 232.A N TYR 227.A O no hydrogen 3.029 N/A ASP 233.A N ARG 212.A O no hydrogen 2.780 N/A ALA 234.A N ARG 212.A O no hydrogen 3.373 N/A VAL 235.A N GLY 49.A O no hydrogen 2.829 N/A LEU 236.A N ALA 214.A O no hydrogen 2.867 N/A VAL 237.A N ILE 51.A O no hydrogen 2.857 N/A LEU 241.A N GLY 238.A O no hydrogen 2.907 N/A VAL 242.A N GLY 238.A O no hydrogen 2.950 N/A THR 243.A N GLU 239.A O no hydrogen 3.181 N/A THR 243.A OG1 GLU 239.A O no hydrogen 2.657 N/A SER 244.A N LEU 241.A O no hydrogen 3.100 N/A ASP 246.A N SER 244.A OG no hydrogen 2.896 N/A ALA 249.A N ASP 246.A OD1 no hydrogen 3.387 N/A ALA 250.A N ASP 246.A O no hydrogen 2.949 N/A VAL 251.A N PRO 247.A O no hydrogen 2.884 N/A ALA 252.A N ARG 248.A O no hydrogen 2.938 N/A ASP 253.A N ALA 249.A O no hydrogen 2.951 N/A LEU 254.A N ALA 250.A O no hydrogen 3.280 N/A VAL 255.A N VAL 251.A O no hydrogen 2.767 N/A THR 256.A N ALA 252.A O no hydrogen 2.967 N/A THR 256.A OG1 ALA 252.A O no hydrogen 2.829 N/A THR 256.A OG1 ASP 253.A O no hydrogen 3.430 N/A ALA 257.A N LEU 254.A O no hydrogen 3.085 N/A THR 259.A N THR 256.A O no hydrogen 2.958 N/A THR 259.A OG1 THR 256.A O no hydrogen 2.569 N/A