Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4j6f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG ARG 3.A O no hydrogen 2.664 N/A THR 10.A N GLU 136.A OE1 no hydrogen 2.990 N/A ALA 11.A N SER 26.A O no hydrogen 3.012 N/A VAL 12.A N TYR 134.A O no hydrogen 3.017 N/A LEU 13.A N VAL 24.A O no hydrogen 2.792 N/A LEU 14.A N ARG 82.A O no hydrogen 2.828 N/A THR 15.A N LYS 22.A O no hydrogen 3.039 N/A THR 15.A OG1 LYS 22.A O no hydrogen 3.031 N/A HIS 17.A ND1 ARG 55.A O no hydrogen 3.107 N/A GLY 18.A N ARG 55.A O no hydrogen 3.026 N/A GLU 21.A N GLU 21.A OE2 no hydrogen 2.987 N/A LYS 22.A N GLY 19.A O no hydrogen 2.778 N/A LEU 23.A N LEU 20.A O no hydrogen 2.728 N/A VAL 24.A N LEU 13.A O no hydrogen 2.802 N/A SER 26.A N ALA 11.A O no hydrogen 2.792 N/A SER 26.A OG VAL 24.A O no hydrogen 3.488 N/A VAL 31.A N LYS 8.A O no hydrogen 3.163 N/A ALA 35.A N GLU 38.A OE2 no hydrogen 2.617 N/A GLU 38.A N ALA 35.A O no hydrogen 3.053 N/A VAL 39.A N LEU 139.A O no hydrogen 2.887 N/A LEU 40.A N ALA 94.A O no hydrogen 2.844 N/A LYS 42.A N HIS 91.A O no hydrogen 2.712 N/A VAL 43.A N GLU 136.A O no hydrogen 2.858 N/A THR 44.A N VAL 89.A O no hydrogen 2.887 N/A THR 44.A OG1 VAL 89.A O no hydrogen 3.171 N/A THR 44.A OG1 ASP 153.A OD2 no hydrogen 2.997 N/A ALA 45.A N VAL 89.A O no hydrogen 3.342 N/A CYS 46.A N VAL 346.A O no hydrogen 2.806 N/A CYS 46.A SG THR 88.A OG1 no hydrogen 3.519 N/A GLY 47.A N ASP 87.A O no hydrogen 2.994 N/A ASN 48.A N ASP 51.A OD2 no hydrogen 3.180 N/A ASN 48.A ND2 ASP 87.A OD2 no hydrogen 2.900 N/A THR 50.A OG1 TYR 59.A OH no hydrogen 3.001 N/A THR 50.A OG1 TYR 126.A OH no hydrogen 2.660 N/A ASP 51.A N ASN 48.A O no hydrogen 2.985 N/A VAL 52.A N ASN 49.A O no hydrogen 2.910 N/A TRP 53.A N ASN 49.A O no hydrogen 2.963 N/A VAL 54.A N THR 50.A O no hydrogen 2.906 N/A ARG 55.A N ASP 51.A O no hydrogen 3.295 N/A ARG 55.A NE GLY 18.A O no hydrogen 3.124 N/A GLU 56.A N VAL 52.A O no hydrogen 2.868 N/A GLY 57.A N VAL 54.A O no hydrogen 3.179 N/A ALA 58.A N TRP 53.A O no hydrogen 2.945 N/A TYR 59.A N SER 69.A O no hydrogen 3.253 N/A TYR 59.A OH THR 50.A OG1 no hydrogen 3.001 N/A THR 61.A N ASP 64.A O no hydrogen 2.856 N/A THR 61.A OG1 ASP 64.A O no hydrogen 3.045 N/A ASP 64.A N THR 61.A OG1 no hydrogen 2.972 N/A SER 66.A N ASP 64.A OD1 no hydrogen 3.182 N/A SER 66.A OG ASP 64.A OD1 no hydrogen 2.908 N/A ALA 67.A N ASP 64.A O no hydrogen 3.278 N/A SER 69.A N GLY 57.A O no hydrogen 2.789 N/A SER 69.A OG THR 70.A O no hydrogen 3.304 N/A THR 70.A OG1 ASN 76.A OD1 no hydrogen 3.515 N/A ARG 72.A NE ILE 124.A O no hydrogen 2.981 N/A ARG 72.A NH1 ASP 123.A O no hydrogen 2.648 N/A ARG 72.A NH1 ILE 124.A O no hydrogen 3.292 N/A ARG 72.A NH2 GLY 75.A O no hydrogen 2.933 N/A ARG 73.A N TRP 71.A O no hydrogen 2.748 N/A ARG 73.A NE GLY 60.A O no hydrogen 2.859 N/A ARG 73.A NH2 TYR 59.A O no hydrogen 3.025 N/A HIS 74.A NE2 GLU 62.A OE1 no hydrogen 2.880 N/A GLY 75.A N ARG 72.A O no hydrogen 3.473 N/A THR 77.A OG1 ASP 125.A OD2 no hydrogen 2.541 N/A LEU 78.A N ASN 76.A OD1 no hydrogen 3.083 N/A ARG 82.A N LEU 14.A O no hydrogen 2.843 N/A ARG 82.A NE HIS 128.A O no hydrogen 2.789 N/A ARG 82.A NH1 THR 77.A O no hydrogen 3.299 N/A ARG 82.A NH1 HIS 128.A O no hydrogen 3.159 N/A ARG 82.A NH2 ASP 131.A OD1 no hydrogen 2.977 N/A ILE 83.A N ASP 131.A OD1 no hydrogen 2.770 N/A GLN 84.A NE2 ASP 51.A O no hydrogen 2.870 N/A THR 86.A OG1 ASP 87.A OD1 no hydrogen 3.512 N/A THR 88.A N THR 86.A O no hydrogen 3.127 N/A VAL 89.A N ALA 45.A O no hydrogen 2.887 N/A GLY 90.A N VAL 108.A O no hydrogen 2.988 N/A HIS 91.A N LYS 42.A O no hydrogen 3.093 N/A HIS 91.A NE2 ASP 153.A OD2 no hydrogen 3.018 N/A ILE 92.A N GLU 106.A O no hydrogen 3.059 N/A VAL 93.A N LEU 40.A O no hydrogen 2.769 N/A ALA 94.A N LEU 40.A O no hydrogen 3.382 N/A GLY 96.A N GLU 38.A O no hydrogen 2.904 N/A VAL 99.A N GLY 96.A O no hydrogen 3.136 N/A ALA 102.A N ASP 100.A OD1 no hydrogen 3.515 N/A ARG 103.A N ASP 100.A O no hydrogen 3.195 N/A ARG 103.A NH1 GLU 106.A OE1 no hydrogen 2.800 N/A ARG 103.A NH1 ALA 144.A O no hydrogen 3.235 N/A ARG 103.A NH2 ALA 144.A O no hydrogen 3.321 N/A ILE 104.A N ARG 101.A O no hydrogen 3.452 N/A GLY 105.A N ILE 92.A O no hydrogen 2.825 N/A GLU 106.A N ARG 103.A O no hydrogen 3.167 N/A ARG 107.A NH1 THR 149.A O no hydrogen 3.108 N/A ARG 107.A NH1 LEU 151.A O no hydrogen 3.542 N/A ARG 107.A NH2 LEU 151.A O no hydrogen 2.700 N/A ARG 107.A NH2 ASP 153.A OD1 no hydrogen 3.071 N/A VAL 108.A N GLY 90.A O no hydrogen 2.782 N/A ASP 110.A N ASN 143.A O no hydrogen 2.839 N/A SER 112.A N ASP 110.A OD1 no hydrogen 2.855 N/A SER 112.A OG ASP 110.A OD1 no hydrogen 2.880 N/A ILE 113.A N ASP 125.A O no hydrogen 2.874 N/A TYR 114.A OH ASP 110.A OD2 no hydrogen 3.030 N/A ASN 115.A ND2 ASP 123.A O no hydrogen 2.961 N/A ARG 116.A NE ASP 118.A OD1 no hydrogen 2.880 N/A ARG 116.A NE ASP 118.A OD2 no hydrogen 3.522 N/A ARG 116.A NH1 ASP 118.A OD2 no hydrogen 3.218 N/A ARG 116.A NH2 ASP 123.A OD2 no hydrogen 2.881 N/A SER 120.A N ASP 118.A OD1 no hydrogen 3.132 N/A ALA 122.A N SER 120.A OG no hydrogen 3.280 N/A ASP 125.A N ILE 113.A O no hydrogen 2.802 N/A TYR 126.A N ASP 125.A OD1 no hydrogen 2.821 N/A TYR 126.A OH THR 50.A OG1 no hydrogen 2.660 N/A HIS 128.A N TYR 126.A O no hydrogen 2.908 N/A HIS 128.A ND1 ASP 125.A OD1 no hydrogen 2.944 N/A GLY 129.A N TYR 126.A O no hydrogen 2.913 N/A ARG 130.A NH1 GLU 38.A OE1 no hydrogen 2.316 N/A GLY 132.A N ILE 83.A O no hydrogen 2.701 N/A GLY 133.A N GLY 85.A O no hydrogen 3.069 N/A TYR 134.A N GLN 84.A O no hydrogen 2.922 N/A TYR 134.A OH ASP 51.A OD2 no hydrogen 2.672 N/A GLU 136.A N THR 10.A O no hydrogen 3.207 N/A LEU 139.A N VAL 39.A O no hydrogen 3.173 N/A ALA 141.A N GLY 37.A O no hydrogen 2.783 N/A ASN 143.A N PRO 140.A O no hydrogen 2.877 N/A ASN 143.A ND2 ASP 110.A O no hydrogen 2.667 N/A ASN 143.A ND2 SER 112.A O no hydrogen 3.072 N/A ALA 144.A N ALA 141.A O no hydrogen 2.952 N/A ALA 148.A N GLU 312.A OE1 no hydrogen 2.839 N/A LEU 151.A N THR 149.A OG1 no hydrogen 3.257 N/A THR 152.A N GLU 155.A OE2 no hydrogen 3.102 N/A THR 152.A OG1 GLU 155.A OE2 no hydrogen 3.030 N/A LEU 156.A N THR 152.A O no hydrogen 2.891 N/A ALA 157.A N ASP 153.A O no hydrogen 3.054 N/A ALA 157.A N ILE 154.A O no hydrogen 3.143 N/A THR 158.A N GLU 155.A O no hydrogen 3.329 N/A THR 158.A OG1 GLU 155.A O no hydrogen 2.961 N/A CYS 160.A SG VAL 109.A O no hydrogen 3.550 N/A CYS 161.A N ASP 87.A OD1 no hydrogen 2.705 N/A TYR 163.A N PHE 159.A O no hydrogen 2.971 N/A LEU 164.A N CYS 160.A O no hydrogen 3.242 N/A THR 165.A N CYS 161.A O no hydrogen 3.057 N/A THR 165.A OG1 CYS 161.A O no hydrogen 2.952 N/A GLY 166.A N ALA 162.A O no hydrogen 2.698 N/A GLU 167.A N TYR 163.A O no hydrogen 2.872 N/A ARG 168.A N LEU 164.A O no hydrogen 3.047 N/A ARG 168.A NE ASP 303.A OD2 no hydrogen 3.068 N/A GLU 170.A N GLU 167.A O no hydrogen 2.856 N/A ARG 171.A N ARG 168.A O no hydrogen 2.715 N/A ARG 171.A NH1 GLY 295.A O no hydrogen 2.768 N/A ARG 171.A NH2 HIS 294.A ND1 no hydrogen 3.064 N/A ARG 171.A NH2 GLY 295.A O no hydrogen 3.426 N/A ARG 173.A N GLU 170.A O no hydrogen 3.122 N/A ARG 173.A NH1 GLU 292.A OE1 no hydrogen 2.839 N/A LEU 174.A N LEU 169.A O no hydrogen 3.098 N/A ALA 175.A N GLU 178.A OE1 no hydrogen 2.847 N/A GLY 177.A N GLY 201.A O no hydrogen 2.827 N/A GLU 178.A N ALA 175.A O no hydrogen 3.104 N/A THR 179.A N ASP 245.A OD2 no hydrogen 2.766 N/A VAL 180.A N VAL 203.A O no hydrogen 2.832 N/A LEU 181.A N VAL 246.A O no hydrogen 2.733 N/A VAL 182.A N ILE 205.A O no hydrogen 3.112 N/A THR 183.A N ALA 248.A O no hydrogen 2.923 N/A THR 183.A OG1 ALA 248.A O no hydrogen 3.539 N/A THR 183.A OG1 ASP 249.A OD1 no hydrogen 2.723 N/A ALA 185.A N VAL 207.A O no hydrogen 3.374 N/A GLY 187.A N GLY 184.A O no hydrogen 3.080 N/A SER 191.A N GLY 187.A O no hydrogen 2.862 N/A SER 191.A OG ALA 185.A O no hydrogen 3.059 N/A SER 191.A OG GLY 187.A O no hydrogen 3.084 N/A ALA 192.A N GLY 188.A O no hydrogen 3.175 N/A ILE 193.A N VAL 189.A O no hydrogen 2.830 N/A ILE 194.A N GLY 190.A O no hydrogen 3.109 N/A GLN 195.A N SER 191.A O no hydrogen 3.143 N/A GLN 195.A NE2 ARG 317.A O no hydrogen 2.846 N/A LEU 196.A N ALA 192.A O no hydrogen 2.664 N/A ALA 197.A N ILE 193.A O no hydrogen 2.690 N/A ARG 198.A N ILE 194.A O no hydrogen 3.285 N/A ARG 198.A NE GLY 219.A O no hydrogen 2.696 N/A ARG 198.A NH2 GLY 219.A O no hydrogen 3.108 N/A ARG 198.A NH2 GLN 221.A OE1 no hydrogen 3.161 N/A ALA 199.A N GLN 195.A O no hydrogen 2.913 N/A ARG 200.A N ALA 197.A O no hydrogen 3.321 N/A ARG 200.A NH1 LEU 174.A O no hydrogen 2.815 N/A ARG 200.A NH2 GLU 167.A OE1 no hydrogen 3.281 N/A ARG 200.A NH2 GLU 170.A OE2 no hydrogen 3.029 N/A GLY 201.A N ARG 198.A O no hydrogen 2.998 N/A ALA 202.A N ALA 197.A O no hydrogen 2.826 N/A VAL 203.A N GLU 178.A O no hydrogen 2.808 N/A ILE 205.A N VAL 180.A O no hydrogen 2.923 N/A ALA 206.A N ALA 222.A O no hydrogen 3.057 N/A VAL 207.A N VAL 182.A O no hydrogen 2.930 N/A ALA 208.A N VAL 224.A O no hydrogen 2.858 N/A LYS 212.A N GLY 209.A O no hydrogen 3.208 N/A LYS 212.A NZ SER 186.A OG no hydrogen 3.051 N/A LYS 212.A NZ LYS 338.A O no hydrogen 3.008 N/A LYS 212.A NZ PHE 340.A O no hydrogen 3.456 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.802 N/A ASP 217.A N ALA 214.A O no hydrogen 3.030 N/A ILE 218.A N ALA 215.A O no hydrogen 3.291 N/A GLY 219.A N LEU 216.A O no hydrogen 3.180 N/A GLN 221.A N PRO 204.A O no hydrogen 2.767 N/A VAL 224.A N ALA 206.A O no hydrogen 2.908 N/A THR 225.A OG1 GLU 213.A OE2 no hydrogen 2.680 N/A ARG 226.A N ALA 208.A O no hydrogen 2.982 N/A ALA 232.A N ASP 230.A OD1 no hydrogen 3.021 N/A ALA 234.A N ASP 230.A O no hydrogen 3.063 N/A VAL 235.A N LEU 231.A O no hydrogen 2.763 N/A GLU 236.A N ALA 232.A O no hydrogen 2.984 N/A ALA 237.A N GLU 233.A O no hydrogen 2.930 N/A ALA 238.A N ALA 234.A O no hydrogen 2.972 N/A SER 239.A N VAL 235.A O no hydrogen 2.812 N/A SER 239.A OG ARG 242.A O no hydrogen 2.663 N/A GLY 240.A N ALA 237.A O no hydrogen 3.160 N/A ASP 245.A N THR 179.A O no hydrogen 3.105 N/A VAL 246.A N THR 179.A O no hydrogen 3.064 N/A VAL 247.A N ARG 268.A O no hydrogen 3.020 N/A ALA 248.A N LEU 181.A O no hydrogen 2.684 N/A ASP 249.A N THR 270.A O no hydrogen 2.915 N/A LEU 250.A N THR 183.A OG1 no hydrogen 2.788 N/A VAL 251.A N ASP 249.A OD1 no hydrogen 3.025 N/A GLY 252.A N ASP 249.A OD1 no hydrogen 2.934 N/A GLY 253.A N GLY 277.A O no hydrogen 2.843 N/A LEU 255.A N GLY 252.A O no hydrogen 3.236 N/A PHE 256.A N GLY 253.A O no hydrogen 3.290 N/A LEU 259.A N LEU 255.A O no hydrogen 3.121 N/A LEU 260.A N PHE 256.A O no hydrogen 3.264 N/A LYS 261.A N ASN 257.A O no hydrogen 3.084 N/A ILE 262.A N ASP 258.A O no hydrogen 2.967 N/A LEU 263.A N LEU 259.A O no hydrogen 2.947 N/A ARG 264.A N ILE 244.A O no hydrogen 3.152 N/A ARG 264.A NH2 ASP 245.A OD1 no hydrogen 2.865 N/A GLU 266.A N LYS 289.A O no hydrogen 2.726 N/A GLY 267.A N ARG 264.A O no hydrogen 2.846 N/A ARG 268.A N ASP 245.A O no hydrogen 3.121 N/A ARG 268.A NE ALA 172.A O no hydrogen 2.881 N/A ARG 268.A NH1 GLU 178.A OE2 no hydrogen 3.260 N/A ARG 268.A NH2 ALA 172.A O no hydrogen 2.989 N/A ARG 268.A NH2 GLU 178.A OE1 no hydrogen 2.953 N/A ARG 268.A NH2 GLU 178.A OE2 no hydrogen 3.512 N/A TYR 269.A N GLU 292.A O no hydrogen 2.726 N/A TYR 269.A OH ASP 249.A OD2 no hydrogen 2.548 N/A THR 270.A N VAL 247.A O no hydrogen 2.838 N/A THR 270.A OG1 HIS 294.A O no hydrogen 3.564 N/A THR 271.A N HIS 294.A O no hydrogen 2.943 N/A THR 271.A OG1 ASP 249.A O no hydrogen 2.983 N/A GLY 273.A N THR 271.A OG1 no hydrogen 3.324 N/A ILE 275.A N LEU 250.A O no hydrogen 3.119 N/A ALA 276.A N VAL 251.A O no hydrogen 2.976 N/A ARG 285.A N ASP 283.A OD1 no hydrogen 2.927 N/A ARG 285.A NE ASP 283.A OD1 no hydrogen 2.836 N/A ARG 285.A NH1 ASP 283.A OD1 no hydrogen 3.479 N/A ARG 285.A NH1 ASP 283.A OD2 no hydrogen 2.902 N/A THR 286.A N ASP 283.A O no hydrogen 2.823 N/A LEU 288.A N ARG 285.A O no hydrogen 2.660 N/A LYS 289.A N THR 286.A O no hydrogen 3.244 N/A LYS 289.A NZ LEU 260.A O no hydrogen 2.894 N/A LYS 289.A NZ LYS 261.A O no hydrogen 2.785 N/A LYS 289.A NZ LEU 263.A O no hydrogen 2.642 N/A GLN 290.A N TYR 287.A O no hydrogen 3.434 N/A GLU 292.A N GLY 267.A O no hydrogen 3.180 N/A HIS 294.A N TYR 269.A O no hydrogen 2.769 N/A HIS 294.A NE2 GLU 292.A OE1 no hydrogen 2.868 N/A SER 296.A N THR 271.A O no hydrogen 3.079 N/A GLN 298.A NE2 ASP 125.A O no hydrogen 3.492 N/A SER 300.A N ASP 303.A OD2 no hydrogen 2.948 N/A SER 300.A OG ASP 303.A OD2 no hydrogen 2.873 N/A ASP 303.A N SER 300.A OG no hydrogen 3.190 N/A PHE 304.A N SER 300.A O no hydrogen 2.944 N/A ARG 305.A N ARG 301.A O no hydrogen 2.941 N/A ARG 306.A N ALA 302.A O no hydrogen 3.028 N/A ARG 306.A NE GLU 167.A OE1 no hydrogen 2.857 N/A ARG 306.A NH2 GLU 167.A OE1 no hydrogen 2.856 N/A LEU 307.A N ASP 303.A O no hydrogen 2.989 N/A VAL 308.A N PHE 304.A O no hydrogen 2.909 N/A ARG 309.A N ARG 305.A O no hydrogen 2.806 N/A TYR 310.A N ARG 306.A O no hydrogen 2.797 N/A ILE 311.A N LEU 307.A O no hydrogen 2.944 N/A GLU 312.A N VAL 308.A O no hydrogen 2.937 N/A GLU 313.A N ARG 309.A O no hydrogen 2.885 N/A LYS 314.A N ILE 311.A O no hydrogen 3.166 N/A LYS 314.A NZ ASP 150.A OD1 no hydrogen 3.112 N/A LYS 314.A NZ ASP 150.A OD2 no hydrogen 3.343 N/A LYS 315.A N TYR 310.A O no hydrogen 2.906 N/A ARG 317.A N GLN 195.A OE1 no hydrogen 2.763 N/A ARG 317.A NH2 ASP 217.A O no hydrogen 3.125 N/A GLY 321.A N LYS 343.A O no hydrogen 2.732 N/A TYR 324.A N VAL 345.A O no hydrogen 2.829 N/A TYR 324.A OH ASP 335.A OD2 no hydrogen 2.651 N/A LEU 326.A N VAL 347.A O no hydrogen 2.600 N/A SER 327.A N ASP 349.A O no hydrogen 3.378 N/A SER 327.A OG ASP 349.A O no hydrogen 2.841 N/A GLU 328.A N PRO 325.A O no hydrogen 2.817 N/A PHE 329.A N LEU 326.A O no hydrogen 3.309 N/A HIS 330.A NE2 LEU 23.A O no hydrogen 2.871 N/A ALA 332.A N GLU 328.A O no hydrogen 2.977 N/A GLN 333.A N PHE 329.A O no hydrogen 2.848 N/A THR 334.A N HIS 330.A O no hydrogen 3.055 N/A THR 334.A OG1 HIS 330.A O no hydrogen 2.622 N/A ASP 335.A N ARG 331.A O no hydrogen 3.013 N/A PHE 336.A N ALA 332.A O no hydrogen 2.799 N/A LYS 338.A N ASP 335.A O no hydrogen 3.356 N/A LYS 338.A NZ ASN 49.A OD1 no hydrogen 2.677 N/A LYS 338.A NZ PHE 336.A O no hydrogen 3.466 N/A LYS 343.A N LEU 319.A O no hydrogen 2.963 N/A LYS 343.A NZ ASN 48.A OD1 no hydrogen 3.432 N/A LYS 343.A NZ ASP 87.A OD2 no hydrogen 2.930 N/A LYS 343.A NZ THR 158.A O no hydrogen 3.362 N/A VAL 345.A N GLY 322.A O no hydrogen 2.987 N/A VAL 346.A N CYS 46.A O no hydrogen 2.661 N/A VAL 347.A N TYR 324.A O no hydrogen 2.761 N/A