Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ija_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 6.A OE1.B no hydrogen 2.768 N/A SER 1.A N GLU 6.A OE2.B no hydrogen 3.466 N/A SER 1.A OG SER 3.A OG no hydrogen 3.120 N/A GLY 2.A N GLU 6.A OE2.B no hydrogen 2.878 N/A SER 3.A N SER 1.A OG no hydrogen 3.064 N/A SER 3.A OG SER 1.A OG no hydrogen 3.120 N/A GLU 6.A N SER 3.A OG no hydrogen 3.182 N/A ALA 7.A N SER 3.A O no hydrogen 2.973 N/A TYR 8.A N ASP 4.A O no hydrogen 2.933 N/A TYR 8.A OH GLN 33.A OE1 no hydrogen 2.641 N/A LEU 9.A N ILE 5.A O no hydrogen 2.926 N/A GLU 10.A N GLU 6.A O no hydrogen 2.903 N/A ARG 11.A N ALA 7.A O no hydrogen 2.954 N/A ARG 11.A NE VAL 60.A O no hydrogen 2.716 N/A ARG 11.A NH1 ARG 11.A O no hydrogen 3.250 N/A ARG 11.A NH1 ALA 36.A O no hydrogen 3.043 N/A ARG 11.A NH2 ALA 36.A O no hydrogen 3.182 N/A ARG 11.A NH2 ARG 65.A O no hydrogen 3.001 N/A ILE 12.A N TYR 8.A O no hydrogen 3.115 N/A GLY 13.A N GLU 10.A O no hydrogen 3.084 N/A TYR 14.A N LEU 9.A O no hydrogen 2.853 N/A TYR 14.A OH SER 17.A O no hydrogen 2.534 N/A LYS 16.A NZ ASP 28.A OD2 no hydrogen 2.845 N/A SER 17.A OG ASN 19.A OD1 no hydrogen 2.410 N/A ARG 18.A NE GLU 6.A OE2.A no hydrogen 3.329 N/A ARG 18.A NH2 GLU 6.A OE2.A no hydrogen 3.527 N/A ASN 19.A N SER 17.A OG no hydrogen 3.349 N/A THR 25.A N ASP 22.A OD1 no hydrogen 2.830 N/A THR 25.A OG1 LYS 20.A O no hydrogen 2.959 N/A THR 25.A OG1 ASP 22.A OD1 no hydrogen 2.770 N/A LEU 26.A N ASP 22.A O no hydrogen 2.934 N/A THR 27.A N LEU 23.A O no hydrogen 2.821 N/A THR 27.A OG1 LEU 23.A O no hydrogen 2.685 N/A ASP 28.A N GLU 24.A O no hydrogen 2.905 N/A ILE 29.A N THR 25.A O no hydrogen 2.961 N/A LEU 30.A N LEU 26.A O no hydrogen 3.025 N/A GLN 31.A N THR 27.A O no hydrogen 2.860 N/A GLN 31.A NE2 TRP 130.A O no hydrogen 2.880 N/A HIS 32.A N ASP 28.A O no hydrogen 2.911 N/A HIS 32.A ND1 ASP 28.A O no hydrogen 2.765 N/A GLN 33.A N ILE 29.A O no hydrogen 2.855 N/A GLN 33.A NE2 VAL 72.A O no hydrogen 3.139 N/A ILE 34.A N LEU 30.A O no hydrogen 2.944 N/A ARG 35.A N GLN 31.A O no hydrogen 3.108 N/A ALA 36.A N GLN 33.A O no hydrogen 3.092 N/A VAL 37.A N GLN 33.A O no hydrogen 2.792 N/A PHE 39.A N SER 221.A O no hydrogen 2.957 N/A GLU 40.A N GLY 67.A O no hydrogen 2.981 N/A ASN 41.A N PHE 219.A O no hydrogen 3.204 N/A ASN 41.A ND2 PHE 214.A O no hydrogen 2.836 N/A ASN 41.A ND2 LYS 217.A O no hydrogen 2.822 N/A LEU 42.A N GLU 40.A OE2 no hydrogen 3.158 N/A ASN 43.A ND2 ALA 49.A O no hydrogen 3.557 N/A ASN 43.A ND2 GLN 59.A OE1.A no hydrogen 2.839 N/A ILE 44.A N ASN 41.A O no hydrogen 3.059 N/A HIS 45.A N LEU 42.A O no hydrogen 3.037 N/A HIS 45.A NE2 PHE 214.A O no hydrogen 2.891 N/A CYS 46.A N ASN 43.A O no hydrogen 3.100 N/A CYS 46.A SG LEU 42.A O no hydrogen 3.352 N/A CYS 46.A SG ARG 274.A O no hydrogen 3.805 N/A GLY 47.A N ILE 44.A O no hydrogen 3.428 N/A ASP 48.A N ASN 43.A O no hydrogen 2.861 N/A ILE 56.A N GLY 52.A O no hydrogen 2.970 N/A PHE 57.A N LEU 53.A O no hydrogen 2.795 N/A ASP 58.A N GLU 54.A O no hydrogen 3.054 N/A GLN 59.A N ALA 55.A O no hydrogen 2.983 N/A GLN 59.A NE2.B ASP 50.A OD2 no hydrogen 2.717 N/A VAL 60.A N ILE 56.A O no hydrogen 2.825 N/A VAL 61.A N PHE 57.A O no hydrogen 2.718 N/A ARG 62.A N ASP 58.A O no hydrogen 2.945 N/A ARG 62.A NH2.A ASP 58.A OD1 no hydrogen 2.883 N/A ARG 63.A N ASP 58.A O no hydrogen 2.981 N/A ARG 63.A NE ASP 58.A OD2 no hydrogen 2.809 N/A ARG 63.A NH1 ASP 58.A OD1 no hydrogen 2.873 N/A ARG 63.A NH1 ASP 58.A OD2 no hydrogen 3.526 N/A ARG 65.A N GLN 59.A O no hydrogen 3.036 N/A ARG 65.A NE GLU 40.A OE1 no hydrogen 2.920 N/A ARG 65.A NH1 ASN 43.A OD1 no hydrogen 3.104 N/A ARG 65.A NH2 GLU 40.A OE1 no hydrogen 3.464 N/A ARG 65.A NH2 GLU 40.A OE2 no hydrogen 2.883 N/A ARG 65.A NH2 ASN 43.A OD1 no hydrogen 3.044 N/A GLY 66.A N GLU 40.A OE1 no hydrogen 2.872 N/A GLY 67.A N PRO 38.A O no hydrogen 3.034 N/A TRP 68.A N GLN 71.A OE1 no hydrogen 3.270 N/A CYS 69.A SG ILE 105.A O no hydrogen 3.618 N/A CYS 69.A SG HIS 106.A ND1 no hydrogen 3.619 N/A GLN 71.A N TRP 68.A O no hydrogen 2.944 N/A GLN 71.A NE2 ASP 50.A O no hydrogen 2.943 N/A VAL 72.A N TRP 68.A O no hydrogen 2.911 N/A ASN 73.A N CYS 69.A O no hydrogen 3.026 N/A ASN 73.A ND2 LEU 107.A O no hydrogen 2.725 N/A ASN 73.A ND2 ASP 121.A OD1 no hydrogen 2.852 N/A HIS 74.A ND1 LEU 51.A O no hydrogen 3.009 N/A LEU 75.A N GLN 71.A O no hydrogen 2.974 N/A LEU 76.A N VAL 72.A O no hydrogen 2.923 N/A TYR 77.A N ASN 73.A O no hydrogen 2.825 N/A TRP 78.A N HIS 74.A O no hydrogen 2.979 N/A ALA 79.A N LEU 75.A O no hydrogen 2.877 N/A LEU 80.A N LEU 76.A O no hydrogen 2.873 N/A THR 81.A N TYR 77.A O no hydrogen 3.015 N/A THR 81.A OG1 TYR 77.A O no hydrogen 2.695 N/A THR 81.A OG1 THR 87.A OG1 no hydrogen 2.618 N/A THR 82.A N TRP 78.A O no hydrogen 2.925 N/A THR 82.A OG1 TRP 78.A O no hydrogen 2.834 N/A ILE 83.A N ALA 79.A O no hydrogen 2.945 N/A GLY 84.A N LEU 80.A O no hydrogen 3.059 N/A PHE 85.A N LEU 80.A O no hydrogen 2.979 N/A THR 87.A OG1 THR 81.A OG1 no hydrogen 2.618 N/A THR 88.A N GLN 110.A O no hydrogen 2.856 N/A GLY 91.A N HIS 106.A O no hydrogen 2.736 N/A TYR 92.A N SER 189.A O no hydrogen 2.770 N/A VAL 93.A N SER 102.A OG no hydrogen 2.938 N/A TYR 94.A N ILE 187.A O no hydrogen 2.986 N/A SER 95.A N LYS 100.A O no hydrogen 2.940 N/A ALA 98.A N SER 95.A OG no hydrogen 3.296 N/A LYS 99.A N THR 96.A O no hydrogen 3.123 N/A LYS 100.A NZ TYR 101.A O no hydrogen 2.791 N/A LYS 100.A NZ THR 103.A OG1 no hydrogen 3.214 N/A SER 102.A N VAL 93.A O no hydrogen 2.822 N/A SER 102.A OG GLY 104.A O no hydrogen 2.799 N/A ILE 105.A N GLY 91.A O no hydrogen 3.058 N/A HIS 106.A N GLY 91.A O no hydrogen 2.987 N/A HIS 106.A NE2 ASP 121.A OD2 no hydrogen 3.227 N/A LEU 108.A N LEU 89.A O no hydrogen 2.955 N/A LEU 109.A N VAL 120.A O no hydrogen 2.917 N/A GLN 110.A N THR 88.A O no hydrogen 2.838 N/A GLN 110.A NE2 ASN 117.A OD1 no hydrogen 3.566 N/A VAL 111.A N TYR 118.A O no hydrogen 2.965 N/A THR 112.A N GLU 86.A O no hydrogen 3.022 N/A THR 112.A OG1 ASN 117.A OD1 no hydrogen 2.852 N/A ILE 113.A N ARG 116.A O no hydrogen 2.835 N/A ARG 116.A N ILE 113.A O no hydrogen 2.889 N/A ARG 116.A NH1 GLU 134.A OE2 no hydrogen 2.745 N/A TYR 118.A N VAL 111.A O no hydrogen 2.826 N/A ILE 119.A N LEU 133.A O no hydrogen 2.833 N/A VAL 120.A N LEU 109.A O no hydrogen 2.855 N/A ALA 122.A N ASN 73.A OD1 no hydrogen 2.811 N/A GLY 123.A N ASP 121.A OD1 no hydrogen 2.843 N/A SER 124.A N GLN 129.A OE1 no hydrogen 2.985 N/A SER 124.A OG ASP 121.A OD2 no hydrogen 2.683 N/A GLY 125.A N GLN 129.A OE1 no hydrogen 2.964 N/A ARG 126.A N SER 221.A OG no hydrogen 2.861 N/A ARG 126.A NE THR 286.A O no hydrogen 2.809 N/A ARG 126.A NH1 THR 286.A O no hydrogen 2.999 N/A ARG 126.A NH2 SER 124.A O no hydrogen 2.876 N/A SER 127.A N ILE 287.A OXT no hydrogen 3.066 N/A SER 127.A OG ILE 287.A O no hydrogen 3.103 N/A SER 127.A OG ILE 287.A OXT no hydrogen 2.593 N/A TYR 128.A N GLY 125.A O no hydrogen 3.048 N/A TYR 128.A OH ILE 287.A O no hydrogen 2.702 N/A GLN 129.A NE2 ASP 121.A O no hydrogen 2.675 N/A TRP 130.A N GLN 143.A OE1 no hydrogen 2.800 N/A TRP 130.A NE1 GLN 223.A OE1 no hydrogen 2.892 N/A GLN 131.A N GLN 143.A OE1 no hydrogen 3.175 N/A LEU 133.A N ILE 119.A O no hydrogen 3.062 N/A GLU 134.A N GLN 141.A OE1 no hydrogen 2.903 N/A LEU 135.A N ASN 117.A O no hydrogen 2.905 N/A ILE 136.A N GLU 134.A O no hydrogen 2.831 N/A GLY 138.A N LEU 150.A O no hydrogen 2.732 N/A LYS 139.A N ILE 136.A O no hydrogen 3.471 N/A GLN 141.A N PHE 148.A O no hydrogen 2.858 N/A GLN 141.A NE2 GLU 134.A O no hydrogen 2.823 N/A GLN 143.A N CYS 146.A O no hydrogen 2.872 N/A GLN 143.A NE2 GLN 131.A O no hydrogen 2.953 N/A CYS 146.A N GLN 143.A O no hydrogen 3.304 N/A VAL 147.A N ILE 162.A O no hydrogen 3.286 N/A PHE 148.A N GLN 141.A O no hydrogen 3.098 N/A ARG 149.A N ASP 160.A O no hydrogen 2.929 N/A ARG 149.A NE ASP 140.A OD1 no hydrogen 2.854 N/A ARG 149.A NH2 ASP 140.A OD1 no hydrogen 2.857 N/A THR 151.A N TYR 158.A O no hydrogen 2.943 N/A GLU 152.A N SER 137.A OG no hydrogen 2.955 N/A GLU 153.A N PHE 156.A O no hydrogen 2.846 N/A GLY 155.A N GLU 152.A OE2 no hydrogen 2.944 N/A PHE 156.A N GLU 153.A O no hydrogen 3.085 N/A TRP 157.A N PHE 190.A O no hydrogen 2.748 N/A TYR 158.A N THR 151.A O no hydrogen 2.805 N/A LEU 159.A N TYR 188.A O no hydrogen 2.779 N/A ASP 160.A N ARG 149.A O no hydrogen 2.869 N/A GLN 161.A N ARG 185.A O no hydrogen 2.894 N/A GLN 161.A NE2 SER 127.A O no hydrogen 3.007 N/A ILE 162.A N VAL 147.A O no hydrogen 2.835 N/A ARG 163.A N LYS 183.A O no hydrogen 2.564 N/A ARG 163.A NH1 SER 127.A OG no hydrogen 2.970 N/A ARG 163.A NH1 GLN 161.A OE1 no hydrogen 2.810 N/A ARG 163.A NH2 SER 127.A OG no hydrogen 3.055 N/A ARG 163.A NH2 GLN 166.A OE1 no hydrogen 2.956 N/A ARG 164.A NH1 VAL 144.A O no hydrogen 2.699 N/A ARG 164.A NH2 VAL 144.A O no hydrogen 3.082 N/A ARG 164.A NH2 ASP 248.A OD1 no hydrogen 2.930 N/A GLU 165.A N ASN 246.A O no hydrogen 3.283 N/A GLN 166.A NE2 GLU 180.A O no hydrogen 2.914 N/A TYR 167.A N ASP 248.A O no hydrogen 2.781 N/A ASN 170.A ND2 PHE 252.A O no hydrogen 3.615 N/A GLU 172.A N ASN 170.A OD1 no hydrogen 3.090 N/A PHE 173.A N ASN 170.A O no hydrogen 3.158 N/A LEU 174.A N GLU 171.A O no hydrogen 3.045 N/A SER 176.A N PHE 173.A O no hydrogen 2.998 N/A LEU 178.A N SER 176.A OG no hydrogen 3.021 N/A LEU 179.A N SER 176.A O no hydrogen 3.265 N/A SER 182.A N GLU 180.A OE2 no hydrogen 2.924 N/A SER 182.A OG TYR 184.A O no hydrogen 3.175 N/A LYS 183.A NZ GLU 165.A OE2 no hydrogen 3.196 N/A TYR 184.A N SER 182.A OG no hydrogen 3.192 N/A TYR 184.A OH.B ASP 160.A OD2 no hydrogen 2.371 N/A ARG 185.A N GLN 161.A O no hydrogen 3.033 N/A ARG 185.A NE LYS 186.A O no hydrogen 3.008 N/A ARG 185.A NH2 GLU 180.A OE1 no hydrogen 2.708 N/A ARG 185.A NH2 THR 286.A OG1 no hydrogen 2.998 N/A ILE 187.A N LEU 159.A O no hydrogen 2.866 N/A TYR 188.A N LEU 159.A O no hydrogen 3.388 N/A TYR 188.A OH ASP 121.A OD2 no hydrogen 2.846 N/A SER 189.A N TYR 92.A O no hydrogen 2.917 N/A PHE 190.A N TRP 157.A O no hydrogen 2.808 N/A LYS 193.A N THR 191.A OG1 no hydrogen 3.351 N/A THR 196.A N ASP 199.A OD2 no hydrogen 3.064 N/A THR 196.A OG1 GLU 198.A OE1 no hydrogen 3.352 N/A GLU 198.A N GLU 198.A OE1 no hydrogen 2.874 N/A ASP 199.A N THR 196.A O no hydrogen 3.052 N/A PHE 200.A N ILE 197.A O no hydrogen 2.983 N/A GLU 201.A N GLU 198.A O no hydrogen 3.263 N/A THR 204.A N GLU 201.A O no hydrogen 3.082 N/A THR 204.A OG1 GLU 201.A O no hydrogen 3.357 N/A TYR 205.A N SER 202.A O no hydrogen 3.020 N/A GLN 207.A N THR 204.A O no hydrogen 3.111 N/A GLN 207.A NE2 ASN 203.A O no hydrogen 2.817 N/A THR 208.A N TYR 205.A O no hydrogen 3.188 N/A THR 208.A OG1 THR 204.A O no hydrogen 3.395 N/A THR 208.A OG1 TYR 205.A O no hydrogen 3.547 N/A SER 209.A N TYR 205.A O no hydrogen 2.829 N/A SER 211.A N SER 209.A OG no hydrogen 3.026 N/A SER 212.A N SER 209.A O no hydrogen 3.064 N/A SER 212.A OG LEU 206.A O no hydrogen 2.738 N/A PHE 214.A N SER 212.A OG no hydrogen 3.089 N/A THR 215.A N SER 212.A O no hydrogen 3.057 N/A THR 215.A OG1 SER 209.A O no hydrogen 2.744 N/A THR 215.A OG1 SER 212.A O no hydrogen 3.084 N/A SER 216.A N SER 212.A O no hydrogen 3.316 N/A SER 216.A N VAL 213.A O no hydrogen 3.056 N/A LYS 217.A N VAL 213.A O no hydrogen 3.088 N/A LYS 217.A NZ.A ASP 177.A OD2 no hydrogen 2.833 N/A LYS 217.A NZ.A GLY 281.A O no hydrogen 2.808 N/A LYS 217.A NZ.A ARG 283.A O no hydrogen 2.713 N/A LYS 217.A NZ.B ASP 177.A OD1 no hydrogen 3.235 N/A LYS 217.A NZ.B ASP 177.A OD2 no hydrogen 3.290 N/A LYS 217.A NZ.B PHE 285.A O no hydrogen 3.288 N/A SER 218.A N LYS 279.A O no hydrogen 2.956 N/A SER 218.A OG LYS 279.A O no hydrogen 3.351 N/A PHE 219.A N ASN 41.A OD1 no hydrogen 2.808 N/A CYS 220.A N LEU 231.A O no hydrogen 2.963 N/A SER 221.A N PHE 39.A O no hydrogen 2.771 N/A LEU 222.A N HIS 229.A O no hydrogen 2.912 N/A GLN 223.A N ILE 34.A O no hydrogen 3.148 N/A GLN 223.A NE2 ARG 126.A O no hydrogen 3.012 N/A THR 224.A N GLY 227.A O no hydrogen 2.862 N/A THR 224.A OG1 ASP 226.A OD1 no hydrogen 3.492 N/A ASP 226.A N THR 224.A OG1 no hydrogen 3.182 N/A VAL 228.A N ARG 239.A O no hydrogen 2.944 N/A HIS 229.A N LEU 222.A O no hydrogen 2.952 N/A CYS 230.A N THR 237.A O no hydrogen 2.927 N/A CYS 230.A SG.A CYS 220.A O no hydrogen 3.745 N/A CYS 230.A SG.A LEU 231.A O no hydrogen 4.012 N/A CYS 230.A SG.B SER 221.A OG no hydrogen 3.643 N/A LEU 231.A N CYS 220.A O no hydrogen 2.883 N/A VAL 232.A N THR 235.A O no hydrogen 2.895 N/A GLY 233.A N SER 218.A O no hydrogen 2.864 N/A THR 235.A N VAL 232.A O no hydrogen 2.786 N/A LEU 236.A N LYS 253.A O no hydrogen 2.815 N/A THR 237.A N CYS 230.A O no hydrogen 2.745 N/A THR 237.A OG1 CYS 230.A O no hydrogen 2.820 N/A HIS 238.A N GLU 251.A O no hydrogen 3.039 N/A ARG 239.A N VAL 228.A O no hydrogen 2.825 N/A ARG 239.A NH1 GLN 166.A OE1 no hydrogen 3.250 N/A ARG 239.A NH1 ASP 248.A OD2 no hydrogen 2.955 N/A ARG 239.A NH2 GLN 166.A OE1 no hydrogen 2.907 N/A ARG 240.A N LEU 249.A O no hydrogen 2.799 N/A PHE 241.A N ASP 226.A O no hydrogen 2.952 N/A ASN 242.A N ASP 248.A OD1 no hydrogen 2.905 N/A TYR 243.A N THR 247.A O no hydrogen 2.901 N/A THR 247.A OG1.A LYS 244.A O no hydrogen 2.474 N/A THR 247.A OG1.B LYS 244.A O no hydrogen 2.971 N/A THR 247.A OG1.B ASP 245.A O no hydrogen 2.794 N/A ASP 248.A N GLU 165.A O no hydrogen 2.797 N/A LEU 249.A N ARG 240.A O no hydrogen 3.057 N/A ILE 250.A N TYR 167.A O no hydrogen 2.878 N/A GLU 251.A N HIS 238.A O no hydrogen 2.850 N/A LYS 253.A N LEU 236.A O no hydrogen 2.836 N/A LEU 255.A N PHE 234.A O no hydrogen 2.764 N/A SER 256.A N GLU 259.A OE1 no hydrogen 2.911 N/A GLU 259.A N SER 256.A O no hydrogen 3.072 N/A GLU 259.A N SER 256.A OG no hydrogen 3.063 N/A ILE 260.A N GLU 257.A O no hydrogen 3.349 N/A VAL 263.A N GLU 259.A O no hydrogen 3.218 N/A LEU 264.A N ILE 260.A O no hydrogen 2.860 N/A LYS 265.A N GLU 261.A O no hydrogen 3.135 N/A LYS 265.A NZ ASN 269.A OD1 no hydrogen 3.273 N/A ASN 266.A N LYS 262.A O no hydrogen 2.868 N/A ILE 267.A N VAL 263.A O no hydrogen 2.826 N/A PHE 268.A N LEU 264.A O no hydrogen 3.156 N/A ASN 269.A N LYS 265.A O no hydrogen 2.992 N/A ILE 270.A N LEU 264.A O no hydrogen 2.940 N/A VAL 277.A N HIS 45.A O no hydrogen 2.826 N/A LYS 279.A N SER 218.A OG no hydrogen 2.900 N/A LYS 279.A NZ THR 215.A O no hydrogen 2.920 N/A HIS 280.A NE2 ASP 177.A OD1 no hydrogen 2.847 N/A GLY 281.A N SER 216.A O no hydrogen 2.770 N/A ARG 283.A N SER 216.A OG no hydrogen 3.161 N/A ARG 283.A NE SER 211.A O no hydrogen 3.163 N/A THR 286.A OG1 TYR 128.A OH no hydrogen 2.714 N/A ILE 287.A N LEU 178.A O no hydrogen 2.893 N/A