Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5n3f_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N LYS 2.A O no hydrogen 2.877 N/A GLU 6.A N GLY 3.A O no hydrogen 3.083 N/A VAL 8.A N GLU 4.A O no hydrogen 3.004 N/A LYS 9.A N GLN 5.A O no hydrogen 3.037 N/A GLU 10.A N GLU 6.A O no hydrogen 2.977 N/A PHE 11.A N SER 7.A O no hydrogen 2.972 N/A LEU 12.A N VAL 8.A O no hydrogen 2.907 N/A ALA 13.A N LYS 9.A O no hydrogen 2.990 N/A LYS 14.A N GLU 10.A O no hydrogen 3.146 N/A LYS 14.A NZ GLU 10.A OE2 no hydrogen 2.818 N/A ALA 15.A N PHE 11.A O no hydrogen 2.845 N/A LYS 16.A N LEU 12.A O no hydrogen 2.920 N/A GLU 17.A N ALA 13.A O no hydrogen 3.147 N/A GLU 18.A N LYS 14.A O no hydrogen 3.117 N/A PHE 19.A N ALA 15.A O no hydrogen 2.888 N/A LEU 20.A N LYS 16.A O no hydrogen 2.914 N/A LYS 21.A N GLU 17.A O no hydrogen 3.280 N/A LYS 22.A N GLU 18.A O no hydrogen 3.500 N/A TRP 23.A N PHE 19.A O no hydrogen 2.834 N/A GLU 24.A N LEU 20.A O no hydrogen 3.149 N/A SER 25.A N LYS 21.A O no hydrogen 3.381 N/A GLN 29.A N HIS 32.A ND1 no hydrogen 3.379 N/A GLN 29.A NE2 ASP 31.A OD1 no hydrogen 2.564 N/A HIS 32.A N GLN 29.A O no hydrogen 2.932 N/A PHE 33.A N LEU 30.A O no hydrogen 3.194 N/A ASP 34.A N LYS 49.A O no hydrogen 2.828 N/A ILE 36.A N LEU 47.A O no hydrogen 2.859 N/A LYS 37.A N LEU 47.A O no hydrogen 3.429 N/A LYS 37.A NZ ASP 314.A OD1 no hydrogen 2.685 N/A THR 38.A N GLU 317.A OE2 no hydrogen 2.939 N/A THR 38.A OG1 GLU 317.A OE1 no hydrogen 2.614 N/A LEU 39.A N VAL 45.A O no hydrogen 2.679 N/A ARG 44.A N ILE 61.A O no hydrogen 3.374 N/A ARG 44.A NH2 GLU 316.A O no hydrogen 2.667 N/A VAL 45.A N GLY 40.A O no hydrogen 2.892 N/A MET 46.A N MET 59.A O no hydrogen 2.855 N/A LEU 47.A N LYS 37.A O no hydrogen 2.726 N/A VAL 48.A N TYR 57.A O no hydrogen 2.907 N/A LYS 49.A N ASP 34.A O no hydrogen 2.860 N/A HIS 50.A N ASN 55.A O no hydrogen 2.742 N/A LYS 51.A N HIS 32.A O no hydrogen 2.789 N/A LYS 51.A NZ ASP 31.A O no hydrogen 3.007 N/A THR 53.A OG1 HIS 50.A ND1 no hydrogen 3.152 N/A GLY 54.A N HIS 50.A O no hydrogen 2.745 N/A ASN 55.A N THR 53.A OG1 no hydrogen 3.165 N/A TYR 57.A N VAL 48.A O no hydrogen 2.983 N/A ALA 58.A N MET 107.A O no hydrogen 2.888 N/A MET 59.A N MET 46.A O no hydrogen 2.706 N/A LYS 60.A N MET 105.A O no hydrogen 2.785 N/A LYS 60.A NZ GLU 78.A OE1 no hydrogen 2.995 N/A LYS 60.A NZ GLU 78.A OE2 no hydrogen 2.750 N/A LYS 60.A NZ ASP 170.A OD2 no hydrogen 3.066 N/A ILE 61.A N ARG 44.A O no hydrogen 2.899 N/A LEU 62.A N LEU 103.A O no hydrogen 2.841 N/A LYS 64.A N SER 101.A O no hydrogen 2.976 N/A GLN 65.A N ASP 63.A OD2 no hydrogen 2.499 N/A LYS 66.A N ASP 63.A O no hydrogen 2.912 N/A VAL 67.A N ASP 63.A O no hydrogen 2.955 N/A VAL 68.A N LYS 66.A O no hydrogen 2.440 N/A ILE 72.A N LYS 69.A O no hydrogen 3.369 N/A ILE 72.A N LEU 70.A O no hydrogen 2.941 N/A THR 75.A N GLN 71.A O no hydrogen 3.051 N/A THR 75.A OG1 GLN 71.A O no hydrogen 2.973 N/A LEU 76.A N ILE 72.A O no hydrogen 3.220 N/A ASN 77.A N GLU 73.A O no hydrogen 2.890 N/A GLU 78.A N HIS 74.A O no hydrogen 3.021 N/A LYS 79.A N THR 75.A O no hydrogen 3.227 N/A ARG 80.A N LEU 76.A O no hydrogen 3.105 N/A ARG 80.A NE TRP 23.A O no hydrogen 2.930 N/A ARG 80.A NH2 TRP 23.A O no hydrogen 2.802 N/A ILE 81.A N ASN 77.A O no hydrogen 2.890 N/A LEU 82.A N GLU 78.A O no hydrogen 2.977 N/A GLN 83.A N LYS 79.A O no hydrogen 3.019 N/A GLN 83.A NE2 LYS 22.A O no hydrogen 3.070 N/A GLN 83.A NE2 ARG 80.A O no hydrogen 2.823 N/A ALA 84.A N ILE 81.A O no hydrogen 2.997 N/A VAL 85.A N ILE 81.A O no hydrogen 3.123 N/A ASN 86.A N TYR 142.A OH no hydrogen 2.929 N/A LEU 90.A N PHE 87.A O no hydrogen 3.237 N/A VAL 91.A N VAL 168.A O no hydrogen 3.070 N/A GLU 94.A N VAL 106.A O no hydrogen 2.696 N/A PHE 95.A N VAL 106.A O no hydrogen 3.102 N/A PHE 97.A N TYR 104.A O no hydrogen 3.043 N/A ASP 99.A N ASN 102.A O no hydrogen 2.917 N/A SER 101.A N ASP 99.A OD1 no hydrogen 2.820 N/A ASN 102.A N ASP 99.A OD1 no hydrogen 2.706 N/A ASN 102.A ND2 TYR 104.A OH no hydrogen 2.936 N/A LEU 103.A N LEU 62.A O no hydrogen 2.847 N/A TYR 104.A N PHE 97.A O no hydrogen 2.853 N/A TYR 104.A OH ASP 99.A OD2 no hydrogen 2.621 N/A MET 105.A N LYS 60.A O no hydrogen 3.009 N/A VAL 106.A N PHE 95.A O no hydrogen 2.761 N/A MET 107.A N ALA 58.A O no hydrogen 2.897 N/A GLU 108.A N LYS 92.A O no hydrogen 2.964 N/A TYR 109.A OH ASP 308.A O no hydrogen 2.646 N/A MET 115.A N LEU 158.A O no hydrogen 2.720 N/A PHE 116.A N PRO 155.A O no hydrogen 3.179 N/A SER 117.A N.A GLU 114.A O no hydrogen 3.147 N/A SER 117.A OG.A GLU 114.A O no hydrogen 3.088 N/A HIS 118.A N GLU 114.A O no hydrogen 3.502 N/A HIS 118.A NE2 GLY 112.A O no hydrogen 2.731 N/A LEU 119.A N MET 115.A O no hydrogen 2.793 N/A ARG 120.A N PHE 116.A O no hydrogen 2.903 N/A ARG 120.A NH1 GLU 215.A OE2 no hydrogen 3.015 N/A ARG 120.A NH2 GLU 215.A OE2 no hydrogen 2.858 N/A ARG 121.A N SER 117.A O.A no hydrogen 2.928 N/A ARG 121.A N SER 117.A O.B no hydrogen 2.925 N/A ILE 122.A N HIS 118.A O no hydrogen 3.040 N/A GLY 123.A N LEU 119.A O no hydrogen 2.786 N/A PHE 125.A N MET 216.A O no hydrogen 2.869 N/A HIS 128.A NE2 TYR 132.A OH no hydrogen 2.905 N/A ARG 130.A N.A GLU 126.A O no hydrogen 2.782 N/A ARG 130.A N.B GLU 126.A O no hydrogen 2.788 N/A ARG 130.A NE.A TRP 281.A O no hydrogen 2.655 N/A ARG 130.A NH1.B TRP 281.A O no hydrogen 2.851 N/A PHE 131.A N PRO 127.A O no hydrogen 3.100 N/A TYR 132.A N HIS 128.A O no hydrogen 3.362 N/A TYR 132.A OH HIS 128.A NE2 no hydrogen 2.905 N/A ALA 133.A N ALA 129.A O no hydrogen 2.842 N/A ALA 134.A N ARG 130.A O.A no hydrogen 2.933 N/A ALA 134.A N ARG 130.A O.B no hydrogen 2.803 N/A GLN 135.A NE2 PHE 131.A O no hydrogen 3.024 N/A ILE 136.A N TYR 132.A O no hydrogen 3.235 N/A VAL 137.A N ALA 133.A O no hydrogen 2.860 N/A LEU 138.A N ALA 134.A O no hydrogen 3.045 N/A THR 139.A N GLN 135.A O no hydrogen 2.933 N/A THR 139.A OG1 GLN 135.A O no hydrogen 2.711 N/A PHE 140.A N ILE 136.A O no hydrogen 2.834 N/A GLU 141.A N VAL 137.A O no hydrogen 2.853 N/A TYR 142.A N LEU 138.A O no hydrogen 2.950 N/A LEU 143.A N THR 139.A O no hydrogen 2.799 N/A HIS 144.A N PHE 140.A O no hydrogen 2.775 N/A HIS 144.A NE2 ASP 205.A OD2 no hydrogen 2.800 N/A SER 145.A N GLU 141.A O no hydrogen 3.165 N/A SER 145.A N TYR 142.A O no hydrogen 3.226 N/A SER 145.A OG TYR 142.A O no hydrogen 2.767 N/A LEU 146.A N LEU 143.A O no hydrogen 2.990 N/A ASP 147.A N HIS 144.A O no hydrogen 2.911 N/A LEU 148.A N LEU 143.A O no hydrogen 2.969 N/A ILE 149.A N LYS 175.A O no hydrogen 2.881 N/A TYR 150.A N ASP 205.A OD2 no hydrogen 2.815 N/A TYR 150.A OH THR 169.A O.A no hydrogen 2.703 N/A TYR 150.A OH THR 169.A O.B no hydrogen 2.557 N/A TYR 150.A OH ASP 170.A O no hydrogen 3.241 N/A ARG 151.A N ASP 205.A OD1 no hydrogen 2.924 N/A ARG 151.A NE PHE 173.A O no hydrogen 2.709 N/A ARG 151.A NH1 TYR 200.A OH no hydrogen 2.816 N/A ARG 151.A NH2 PHE 173.A O no hydrogen 2.977 N/A LYS 154.A NZ THR 186.A OG1 no hydrogen 2.773 N/A GLU 156.A N GLU 156.A OE1 no hydrogen 2.750 N/A ASN 157.A N LYS 154.A O no hydrogen 3.044 N/A ASN 157.A ND2 TYR 150.A OH no hydrogen 3.435 N/A ASN 157.A ND2 ASP 152.A O no hydrogen 2.839 N/A ASN 157.A ND2 ASP 152.A OD1 no hydrogen 3.079 N/A LEU 158.A N PRO 155.A O no hydrogen 3.269 N/A LEU 159.A N GLN 167.A O no hydrogen 2.873 N/A ILE 160.A N GLY 113.A O no hydrogen 2.874 N/A ASP 161.A N TYR 165.A O no hydrogen 2.711 N/A GLN 163.A N.A ASP 161.A OD1 no hydrogen 2.837 N/A GLN 163.A N.B ASP 161.A OD1 no hydrogen 2.833 N/A GLY 164.A N ASP 161.A O no hydrogen 2.957 N/A TYR 165.A N ASP 161.A OD1 no hydrogen 2.977 N/A TYR 165.A OH VAL 295.A O no hydrogen 2.588 N/A ILE 166.A N.A GLN 135.A OE1 no hydrogen 2.782 N/A ILE 166.A N.B GLN 135.A OE1 no hydrogen 2.805 N/A GLN 167.A N LEU 159.A O no hydrogen 2.726 N/A VAL 168.A N PHE 89.A O no hydrogen 2.711 N/A THR 169.A N.A ASN 157.A O no hydrogen 3.006 N/A THR 169.A N.B ASN 157.A O no hydrogen 3.003 N/A THR 169.A OG1.B ASN 157.A O no hydrogen 3.094 N/A ASP 170.A N THR 169.A OG1.A no hydrogen 2.808 N/A PHE 171.A N GLU 78.A OE2 no hydrogen 3.272 N/A GLY 172.A N ASP 170.A OD2 no hydrogen 3.107 N/A ALA 174.A N PHE 171.A O no hydrogen 3.019 N/A LYS 175.A N ILE 149.A O no hydrogen 2.979 N/A LYS 175.A NZ THR 181.A OG1 no hydrogen 2.802 N/A ARG 176.A NE LEU 146.A O no hydrogen 2.800 N/A ARG 176.A NH2 LEU 146.A O no hydrogen 3.444 N/A VAL 177.A N ASP 147.A O no hydrogen 2.779 N/A THR 181.A N TYR 200.A O no hydrogen 2.850 N/A THR 186.A OG1 ASP 152.A OD2 no hydrogen 2.760 N/A GLU 188.A N GLU 188.A OE1 no hydrogen 2.692 N/A TYR 189.A N THR 186.A O no hydrogen 2.838 N/A TYR 189.A OH GLU 215.A OE1 no hydrogen 2.661 N/A LEU 190.A N PRO 187.A O no hydrogen 3.184 N/A GLU 193.A N GLU 193.A OE1 no hydrogen 2.837 N/A ILE 194.A N ALA 191.A O no hydrogen 2.994 N/A ILE 195.A N ALA 191.A O no hydrogen 3.398 N/A LEU 196.A N PRO 192.A O no hydrogen 2.873 N/A SER 197.A N ILE 194.A O no hydrogen 2.970 N/A LYS 198.A N GLU 193.A O no hydrogen 3.064 N/A TYR 200.A N THR 181.A O no hydrogen 2.951 N/A ASN 201.A ND2 ASN 268.A OD1 no hydrogen 3.526 N/A ALA 203.A N ASN 201.A OD1 no hydrogen 2.902 N/A VAL 204.A N ASN 201.A O no hydrogen 3.083 N/A ASP 205.A N LYS 202.A O no hydrogen 2.910 N/A TRP 207.A N ALA 203.A O no hydrogen 3.071 N/A ALA 208.A N VAL 204.A O no hydrogen 3.000 N/A LEU 209.A N ASP 205.A O no hydrogen 2.875 N/A GLY 210.A N TRP 206.A O no hydrogen 3.169 N/A VAL 211.A N TRP 207.A O no hydrogen 3.079 N/A LEU 212.A N ALA 208.A O no hydrogen 2.894 N/A ILE 213.A N LEU 209.A O no hydrogen 2.857 N/A TYR 214.A N GLY 210.A O no hydrogen 2.982 N/A TYR 214.A OH ARG 241.A O no hydrogen 2.660 N/A GLU 215.A N VAL 211.A O no hydrogen 2.839 N/A MET 216.A N LEU 212.A O no hydrogen 2.781 N/A ALA 217.A N ILE 213.A O no hydrogen 2.937 N/A ALA 218.A N TYR 214.A O no hydrogen 2.726 N/A GLY 219.A N GLU 215.A O no hydrogen 2.759 N/A GLN 227.A N GLN 230.A OE1 no hydrogen 3.223 N/A ILE 231.A N GLN 227.A O no hydrogen 3.210 N/A TYR 232.A N PRO 228.A O no hydrogen 2.955 N/A GLU 233.A N ILE 229.A O no hydrogen 3.158 N/A LYS 234.A N GLN 230.A O no hydrogen 3.179 N/A LYS 234.A NZ PHE 224.A O no hydrogen 3.263 N/A ILE 235.A N ILE 231.A O no hydrogen 2.917 N/A VAL 236.A N TYR 232.A O no hydrogen 3.034 N/A SER 237.A N GLU 233.A O no hydrogen 3.312 N/A SER 237.A N LYS 234.A O no hydrogen 3.366 N/A SER 237.A OG LYS 234.A O no hydrogen 2.773 N/A LYS 239.A N SER 237.A OG no hydrogen 3.217 N/A PHE 246.A N PRO 243.A O no hydrogen 3.112 N/A SER 247.A N GLU 126.A OE2 no hydrogen 2.815 N/A SER 247.A OG GLU 126.A OE1 no hydrogen 2.646 N/A SER 247.A OG GLU 126.A OE2 no hydrogen 3.516 N/A LEU 250.A N SER 247.A OG no hydrogen 3.055 N/A LYS 251.A N SER 247.A O no hydrogen 3.031 N/A ASP 252.A N SER 248.A O no hydrogen 2.902 N/A LEU 253.A N ASP 249.A O no hydrogen 3.058 N/A LEU 254.A N LEU 250.A O no hydrogen 2.906 N/A ARG 255.A N LYS 251.A O no hydrogen 2.850 N/A ASN 256.A N ASP 252.A O no hydrogen 3.212 N/A ASN 256.A N LEU 253.A O no hydrogen 3.059 N/A ASN 256.A ND2 ASP 252.A O no hydrogen 2.852 N/A LEU 257.A N LEU 253.A O no hydrogen 2.962 N/A LEU 257.A N LEU 254.A O no hydrogen 3.230 N/A LEU 258.A N LEU 254.A O no hydrogen 2.807 N/A ASP 261.A N GLN 259.A OE1 no hydrogen 2.921 N/A THR 263.A N ASP 261.A OD1 no hydrogen 2.928 N/A THR 263.A OG1 ASP 261.A OD1 no hydrogen 2.609 N/A LYS 264.A N ASP 261.A O no hydrogen 2.894 N/A ARG 265.A NE GLN 259.A O no hydrogen 2.873 N/A ARG 265.A NH1 GLU 193.A OE2 no hydrogen 2.830 N/A ARG 265.A NH1 ALA 203.A O no hydrogen 2.972 N/A ARG 265.A NH2 GLU 193.A OE1 no hydrogen 2.878 N/A ARG 265.A NH2 GLU 193.A OE2 no hydrogen 3.490 N/A ARG 265.A NH2 GLN 259.A O no hydrogen 3.076 N/A PHE 266.A N ASN 256.A O no hydrogen 2.909 N/A ASN 268.A N ARG 265.A O no hydrogen 2.942 N/A ASN 268.A ND2 LEU 262.A O no hydrogen 2.832 N/A GLY 272.A N LEU 269.A O no hydrogen 2.842 N/A ASN 274.A N ASN 271.A O no hydrogen 3.073 N/A ASP 275.A N GLY 272.A O no hydrogen 3.282 N/A ILE 276.A N VAL 273.A O no hydrogen 2.929 N/A LYS 277.A N VAL 273.A O no hydrogen 2.950 N/A LYS 277.A NZ GLU 141.A OE1 no hydrogen 2.829 N/A LYS 277.A NZ GLU 141.A OE2 no hydrogen 3.507 N/A ASN 278.A N ASN 274.A O no hydrogen 2.939 N/A HIS 279.A N ILE 276.A O no hydrogen 3.084 N/A HIS 279.A NE2 ASP 252.A OD2 no hydrogen 2.763 N/A TRP 281.A N HIS 279.A ND1 no hydrogen 2.867 N/A TRP 281.A NE1 GLU 126.A OE1 no hydrogen 2.857 N/A PHE 282.A N HIS 279.A O no hydrogen 2.892 N/A ALA 283.A N LYS 280.A O no hydrogen 2.953 N/A THR 285.A N PHE 282.A O no hydrogen 2.865 N/A ALA 289.A N ASP 286.A OD1 no hydrogen 2.953 N/A ILE 290.A N ASP 286.A O no hydrogen 2.944 N/A TYR 291.A N TRP 287.A O no hydrogen 3.054 N/A GLN 292.A N ILE 288.A O no hydrogen 2.830 N/A ARG 293.A N ILE 290.A O no hydrogen 2.885 N/A ARG 293.A NE GLN 163.A OE1.A no hydrogen 2.752 N/A ARG 293.A NH1 ASP 161.A OD1 no hydrogen 3.459 N/A ARG 293.A NH1 ASP 161.A OD2 no hydrogen 2.731 N/A ARG 293.A NH1 GLN 163.A OE1.A no hydrogen 2.778 N/A ARG 293.A NH2 ASP 161.A OD2 no hydrogen 3.372 N/A LYS 294.A N ALA 289.A O no hydrogen 2.843 N/A LYS 294.A NZ GLN 292.A OE1 no hydrogen 2.849 N/A LYS 304.A N ASP 308.A OD2 no hydrogen 2.506 N/A ASP 308.A N GLY 305.A O no hydrogen 3.244 N/A SER 310.A N ASP 308.A OD1 no hydrogen 2.870 N/A SER 310.A OG ASP 308.A OD1 no hydrogen 3.161 N/A ASN 311.A ND2 PRO 111.A O no hydrogen 3.260 N/A ASN 311.A ND2 LYS 302.A O no hydrogen 2.908 N/A PHE 312.A N THR 309.A O no hydrogen 3.110 N/A