Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5n1k_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 8.A N LYS 5.A O no hydrogen 2.940 N/A GLU 9.A N GLY 6.A O no hydrogen 3.303 N/A VAL 11.A N GLU 7.A O no hydrogen 3.001 N/A LYS 12.A N GLN 8.A O no hydrogen 3.166 N/A GLU 13.A N GLU 9.A O no hydrogen 2.985 N/A PHE 14.A N SER 10.A O no hydrogen 2.934 N/A LEU 15.A N VAL 11.A O no hydrogen 2.922 N/A ALA 16.A N LYS 12.A O no hydrogen 3.007 N/A LYS 17.A N GLU 13.A O no hydrogen 3.196 N/A ALA 18.A N PHE 14.A O no hydrogen 2.800 N/A LYS 19.A N LEU 15.A O no hydrogen 2.917 N/A GLU 20.A N ALA 16.A O no hydrogen 3.251 N/A GLU 21.A N LYS 17.A O no hydrogen 3.209 N/A PHE 22.A N ALA 18.A O no hydrogen 2.985 N/A LEU 23.A N LYS 19.A O no hydrogen 2.885 N/A LYS 24.A N GLU 20.A O no hydrogen 3.279 N/A LYS 25.A N GLU 21.A O no hydrogen 3.446 N/A TRP 26.A N PHE 22.A O no hydrogen 2.753 N/A GLU 27.A N LEU 23.A O no hydrogen 3.087 N/A THR 31.A N SER 102.A O no hydrogen 2.882 N/A THR 31.A OG1 SER 102.A O no hydrogen 3.272 N/A HIS 36.A N GLN 33.A O no hydrogen 3.066 N/A PHE 37.A N LEU 34.A O no hydrogen 3.078 N/A ASP 38.A N LYS 55.A O no hydrogen 2.833 N/A ILE 40.A N LEU 53.A O no hydrogen 2.890 N/A LYS 41.A N LEU 53.A O no hydrogen 3.443 N/A LYS 41.A NZ ASP 321.A OD1 no hydrogen 2.452 N/A THR 42.A N GLU 324.A OE2 no hydrogen 2.902 N/A THR 42.A OG1 GLU 324.A OE1 no hydrogen 2.499 N/A LEU 43.A N VAL 51.A O no hydrogen 2.770 N/A GLY 46.A N GLY 49.A O no hydrogen 3.133 N/A ARG 50.A N ILE 66.A O no hydrogen 3.279 N/A VAL 51.A N GLY 44.A O no hydrogen 3.014 N/A MET 52.A N MET 64.A O no hydrogen 2.736 N/A LEU 53.A N LYS 41.A O no hydrogen 2.755 N/A VAL 54.A N TYR 62.A O no hydrogen 2.982 N/A LYS 55.A N ASP 38.A O no hydrogen 2.814 N/A HIS 56.A N ASN 60.A O no hydrogen 2.872 N/A LYS 57.A N HIS 36.A O no hydrogen 2.920 N/A GLY 59.A N HIS 56.A O no hydrogen 2.618 N/A TYR 62.A N VAL 54.A O no hydrogen 2.979 N/A ALA 63.A N MET 113.A O no hydrogen 2.752 N/A MET 64.A N MET 52.A O no hydrogen 2.707 N/A LYS 65.A N MET 111.A O no hydrogen 2.831 N/A LYS 65.A NZ GLU 84.A OE2 no hydrogen 2.913 N/A LYS 65.A NZ ASP 177.A OD1 no hydrogen 3.230 N/A ILE 66.A N ARG 50.A O no hydrogen 2.880 N/A LEU 67.A N LEU 109.A O no hydrogen 2.938 N/A ASP 68.A N PHE 48.A O no hydrogen 2.967 N/A LYS 69.A N SER 107.A O no hydrogen 2.998 N/A LYS 69.A NZ ASP 105.A O no hydrogen 2.834 N/A LYS 69.A NZ ASN 106.A O no hydrogen 3.158 N/A LYS 69.A NZ LYS 333.A O no hydrogen 2.725 N/A GLN 70.A N ASP 68.A OD1 no hydrogen 2.786 N/A LYS 71.A N ASP 68.A O no hydrogen 2.805 N/A VAL 72.A N ASP 68.A O no hydrogen 3.167 N/A VAL 72.A N LYS 69.A O no hydrogen 3.317 N/A VAL 73.A N GLN 77.A OE1 no hydrogen 3.193 N/A LYS 74.A N GLN 77.A OE1 no hydrogen 2.847 N/A LYS 76.A NZ GLU 79.A OE1 no hydrogen 2.744 N/A ILE 78.A N LYS 74.A O no hydrogen 3.042 N/A GLU 79.A N LEU 75.A O no hydrogen 3.031 N/A HIS 80.A N LYS 76.A O no hydrogen 3.003 N/A THR 81.A N GLN 77.A O no hydrogen 3.393 N/A THR 81.A OG1 GLN 77.A O no hydrogen 3.014 N/A LEU 82.A N ILE 78.A O no hydrogen 3.336 N/A ASN 83.A N GLU 79.A O no hydrogen 3.012 N/A GLU 84.A N HIS 80.A O no hydrogen 3.024 N/A LYS 85.A N THR 81.A O no hydrogen 3.304 N/A ARG 86.A N LEU 82.A O no hydrogen 3.112 N/A ARG 86.A NE TRP 26.A O no hydrogen 3.143 N/A ARG 86.A NH2 TRP 26.A O no hydrogen 2.872 N/A ILE 87.A N ASN 83.A O no hydrogen 2.903 N/A LEU 88.A N GLU 84.A O no hydrogen 2.935 N/A GLN 89.A N.A LYS 85.A O no hydrogen 3.007 N/A GLN 89.A N.B LYS 85.A O no hydrogen 2.996 N/A GLN 89.A NE2.A LYS 25.A O no hydrogen 3.113 N/A GLN 89.A NE2.A ARG 86.A O no hydrogen 2.809 N/A ALA 90.A N ILE 87.A O no hydrogen 2.995 N/A VAL 91.A N ILE 87.A O no hydrogen 3.177 N/A ASN 92.A N TYR 149.A OH no hydrogen 2.900 N/A LEU 96.A N PHE 93.A O no hydrogen 3.279 N/A VAL 97.A N.A VAL 175.A O no hydrogen 3.010 N/A VAL 97.A N.B VAL 175.A O no hydrogen 3.023 N/A GLU 100.A N VAL 112.A O no hydrogen 2.729 N/A PHE 101.A N VAL 112.A O no hydrogen 3.116 N/A SER 102.A N THR 31.A OG1 no hydrogen 3.025 N/A PHE 103.A N TYR 110.A O no hydrogen 3.133 N/A LYS 104.A NZ PHE 338.A O no hydrogen 2.877 N/A LYS 104.A NZ PHE 341.A O no hydrogen 2.707 N/A ASP 105.A N ASN 108.A O no hydrogen 2.912 N/A SER 107.A N ASP 105.A OD1 no hydrogen 2.879 N/A SER 107.A OG ARG 328.A O no hydrogen 3.424 N/A ASN 108.A N ASP 105.A OD1 no hydrogen 2.862 N/A ASN 108.A ND2 TYR 110.A OH no hydrogen 3.077 N/A LEU 109.A N LEU 67.A O no hydrogen 3.007 N/A TYR 110.A N PHE 103.A O no hydrogen 2.843 N/A TYR 110.A OH ASP 105.A OD2 no hydrogen 2.487 N/A MET 111.A N LYS 65.A O no hydrogen 3.046 N/A VAL 112.A N PHE 101.A O no hydrogen 2.712 N/A MET 113.A N ALA 63.A O no hydrogen 2.765 N/A GLU 114.A N LYS 98.A O no hydrogen 2.918 N/A TYR 115.A OH ASP 315.A O no hydrogen 2.647 N/A MET 121.A N LEU 165.A O no hydrogen 2.676 N/A PHE 122.A N PRO 162.A O no hydrogen 3.176 N/A SER 123.A N.B GLU 120.A O no hydrogen 3.191 N/A SER 123.A OG.B GLU 120.A O no hydrogen 3.224 N/A HIS 124.A NE2 GLY 118.A O no hydrogen 2.748 N/A LEU 125.A N MET 121.A O no hydrogen 2.833 N/A ARG 126.A N PHE 122.A O no hydrogen 2.939 N/A ARG 126.A NH1 GLU 222.A OE2 no hydrogen 3.006 N/A ARG 126.A NH2 GLU 222.A OE2 no hydrogen 2.813 N/A ARG 127.A N SER 123.A O.A no hydrogen 2.854 N/A ARG 127.A N SER 123.A O.B no hydrogen 2.985 N/A ILE 128.A N HIS 124.A O no hydrogen 2.992 N/A GLY 129.A N LEU 125.A O no hydrogen 2.786 N/A PHE 131.A N MET 223.A O no hydrogen 2.881 N/A HIS 135.A N.A SER 132.A OG no hydrogen 3.176 N/A HIS 135.A N.B SER 132.A O no hydrogen 3.150 N/A HIS 135.A N.B SER 132.A OG no hydrogen 3.229 N/A HIS 135.A NE2.A TYR 139.A OH no hydrogen 2.807 N/A ALA 136.A N SER 132.A O no hydrogen 2.878 N/A ARG 137.A N GLU 133.A O no hydrogen 2.809 N/A ARG 137.A NH2 TRP 288.A O no hydrogen 3.023 N/A PHE 138.A N PRO 134.A O no hydrogen 3.071 N/A TYR 139.A N HIS 135.A O.A no hydrogen 3.333 N/A TYR 139.A N HIS 135.A O.B no hydrogen 3.258 N/A TYR 139.A OH HIS 135.A NE2.A no hydrogen 2.807 N/A ALA 140.A N ALA 136.A O no hydrogen 2.757 N/A ALA 141.A N ARG 137.A O no hydrogen 2.833 N/A GLN 142.A NE2 PHE 138.A O no hydrogen 3.051 N/A ILE 143.A N TYR 139.A O no hydrogen 3.224 N/A VAL 144.A N ALA 140.A O no hydrogen 2.881 N/A LEU 145.A N ALA 141.A O no hydrogen 3.026 N/A THR 146.A N GLN 142.A O no hydrogen 2.905 N/A THR 146.A OG1 GLN 142.A O no hydrogen 2.720 N/A PHE 147.A N ILE 143.A O no hydrogen 2.825 N/A GLU 148.A N VAL 144.A O no hydrogen 2.891 N/A TYR 149.A N LEU 145.A O no hydrogen 3.034 N/A LEU 150.A N THR 146.A O no hydrogen 2.869 N/A HIS 151.A N PHE 147.A O no hydrogen 2.749 N/A HIS 151.A NE2 ASP 212.A OD2 no hydrogen 2.835 N/A SER 152.A N GLU 148.A O no hydrogen 3.097 N/A SER 152.A OG TYR 149.A O no hydrogen 2.795 N/A LEU 153.A N TYR 149.A O no hydrogen 3.371 N/A LEU 153.A N LEU 150.A O no hydrogen 3.001 N/A ASP 154.A N HIS 151.A O no hydrogen 2.922 N/A LEU 155.A N LEU 150.A O no hydrogen 2.890 N/A ILE 156.A N LYS 182.A O no hydrogen 2.836 N/A TYR 157.A N ASP 212.A OD2 no hydrogen 2.842 N/A TYR 157.A OH THR 176.A O.A no hydrogen 2.561 N/A TYR 157.A OH THR 176.A O.B no hydrogen 2.595 N/A TYR 157.A OH ASP 177.A O no hydrogen 3.136 N/A ARG 158.A N ASP 212.A OD1 no hydrogen 2.833 N/A ARG 158.A NE PHE 180.A O no hydrogen 2.644 N/A ARG 158.A NH1 TYR 207.A OH no hydrogen 2.963 N/A ARG 158.A NH2 PHE 180.A O no hydrogen 3.029 N/A LYS 161.A NZ THR 193.A OG1 no hydrogen 2.932 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 2.698 N/A ASN 164.A N LYS 161.A O no hydrogen 3.050 N/A ASN 164.A ND2 TYR 157.A OH no hydrogen 3.274 N/A ASN 164.A ND2 ASP 159.A O no hydrogen 2.856 N/A ASN 164.A ND2 ASP 159.A OD1 no hydrogen 2.937 N/A LEU 165.A N PRO 162.A O no hydrogen 3.284 N/A LEU 166.A N GLN 174.A O no hydrogen 2.879 N/A ILE 167.A N GLY 119.A O no hydrogen 2.900 N/A ASP 168.A N TYR 172.A O no hydrogen 2.701 N/A GLN 169.A N GLN 169.A OE1 no hydrogen 2.818 N/A GLN 170.A N ASP 168.A OD1 no hydrogen 2.794 N/A GLY 171.A N ASP 168.A O no hydrogen 2.988 N/A TYR 172.A N ASP 168.A OD1 no hydrogen 2.946 N/A TYR 172.A OH VAL 302.A O no hydrogen 2.592 N/A ILE 173.A N GLN 142.A OE1 no hydrogen 2.864 N/A GLN 174.A N LEU 166.A O no hydrogen 2.755 N/A GLN 174.A NE2 PRO 94.A O no hydrogen 2.711 N/A GLN 174.A NE2 ILE 173.A O no hydrogen 3.519 N/A VAL 175.A N PHE 95.A O no hydrogen 2.740 N/A THR 176.A N.A ASN 164.A O no hydrogen 2.993 N/A THR 176.A N.B ASN 164.A O no hydrogen 3.001 N/A THR 176.A OG1.A ASN 164.A O no hydrogen 3.176 N/A ALA 181.A N PHE 178.A O no hydrogen 3.088 N/A LYS 182.A N ILE 156.A O no hydrogen 2.927 N/A LYS 182.A NZ THR 188.A OG1 no hydrogen 2.772 N/A VAL 184.A N ASP 154.A O no hydrogen 2.849 N/A THR 188.A N TYR 207.A O no hydrogen 2.797 N/A THR 193.A OG1 ASP 159.A OD2 no hydrogen 2.728 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.765 N/A TYR 196.A N THR 193.A O no hydrogen 2.905 N/A TYR 196.A OH GLU 222.A OE1 no hydrogen 2.682 N/A LEU 197.A N PRO 194.A O no hydrogen 3.203 N/A GLU 200.A N GLU 200.A OE1 no hydrogen 2.806 N/A ILE 201.A N ALA 198.A O no hydrogen 3.067 N/A ILE 202.A N ALA 198.A O no hydrogen 3.419 N/A LEU 203.A N PRO 199.A O no hydrogen 2.945 N/A SER 204.A N ILE 201.A O no hydrogen 3.046 N/A LYS 205.A N GLU 200.A O no hydrogen 3.031 N/A TYR 207.A N THR 188.A O no hydrogen 2.933 N/A ALA 210.A N ASN 208.A OD1 no hydrogen 2.879 N/A VAL 211.A N ASN 208.A O no hydrogen 3.060 N/A ASP 212.A N LYS 209.A O no hydrogen 2.955 N/A TRP 214.A N ALA 210.A O no hydrogen 3.089 N/A ALA 215.A N VAL 211.A O no hydrogen 2.981 N/A LEU 216.A N ASP 212.A O no hydrogen 2.858 N/A GLY 217.A N TRP 213.A O no hydrogen 3.103 N/A VAL 218.A N TRP 214.A O no hydrogen 3.063 N/A LEU 219.A N ALA 215.A O no hydrogen 2.860 N/A ILE 220.A N LEU 216.A O no hydrogen 2.831 N/A TYR 221.A N GLY 217.A O no hydrogen 3.053 N/A TYR 221.A OH ARG 248.A O no hydrogen 2.721 N/A GLU 222.A N VAL 218.A O no hydrogen 2.842 N/A MET 223.A N LEU 219.A O no hydrogen 2.810 N/A ALA 224.A N ILE 220.A O no hydrogen 2.920 N/A ALA 225.A N TYR 221.A O no hydrogen 2.744 N/A GLY 226.A N GLU 222.A O no hydrogen 2.713 N/A GLN 234.A N GLN 237.A OE1 no hydrogen 3.080 N/A ILE 238.A N GLN 234.A O no hydrogen 3.122 N/A TYR 239.A N PRO 235.A O no hydrogen 2.897 N/A GLU 240.A N ILE 236.A O no hydrogen 3.170 N/A LYS 241.A N GLN 237.A O no hydrogen 3.214 N/A LYS 241.A NZ PHE 231.A O no hydrogen 3.267 N/A ILE 242.A N ILE 238.A O no hydrogen 2.975 N/A VAL 243.A N TYR 239.A O no hydrogen 3.090 N/A SER 244.A N GLU 240.A O no hydrogen 3.231 N/A SER 244.A OG LYS 241.A O no hydrogen 2.915 N/A GLY 245.A N LYS 241.A O no hydrogen 3.043 N/A LYS 246.A N SER 244.A OG no hydrogen 3.260 N/A PHE 253.A N PRO 250.A O no hydrogen 3.128 N/A SER 254.A N GLU 133.A OE2 no hydrogen 2.833 N/A SER 254.A OG GLU 133.A OE1 no hydrogen 2.638 N/A SER 254.A OG GLU 133.A OE2 no hydrogen 3.536 N/A LEU 257.A N SER 254.A OG no hydrogen 3.064 N/A LYS 258.A N SER 254.A O no hydrogen 3.004 N/A ASP 259.A N SER 255.A O no hydrogen 2.948 N/A LEU 260.A N ASP 256.A O no hydrogen 3.088 N/A LEU 261.A N LEU 257.A O no hydrogen 2.887 N/A ARG 262.A N.A LYS 258.A O no hydrogen 2.865 N/A ARG 262.A N.B LYS 258.A O no hydrogen 2.862 N/A ASN 263.A N ASP 259.A O no hydrogen 3.268 N/A ASN 263.A N LEU 260.A O no hydrogen 3.073 N/A ASN 263.A ND2 ASP 259.A O no hydrogen 2.784 N/A LEU 264.A N LEU 260.A O no hydrogen 2.992 N/A LEU 265.A N LEU 261.A O no hydrogen 2.773 N/A ASP 268.A N GLN 266.A OE1 no hydrogen 3.033 N/A THR 270.A N ASP 268.A OD1 no hydrogen 2.847 N/A THR 270.A OG1 ASP 268.A OD1 no hydrogen 2.683 N/A THR 270.A OG1 ASP 268.A OD2 no hydrogen 3.382 N/A LYS 271.A N ASP 268.A O no hydrogen 2.869 N/A ARG 272.A NE GLN 266.A O no hydrogen 2.873 N/A ARG 272.A NH1 GLU 200.A OE2 no hydrogen 2.754 N/A ARG 272.A NH1 ALA 210.A O no hydrogen 2.982 N/A ARG 272.A NH2 GLU 200.A OE1 no hydrogen 2.874 N/A ARG 272.A NH2 GLU 200.A OE2 no hydrogen 3.478 N/A ARG 272.A NH2 GLN 266.A O no hydrogen 3.070 N/A PHE 273.A N ASN 263.A O no hydrogen 2.897 N/A ASN 275.A N ARG 272.A O no hydrogen 3.059 N/A ASN 275.A ND2 LEU 269.A O no hydrogen 3.042 N/A GLY 279.A N LEU 276.A O no hydrogen 2.886 N/A ASN 281.A N ASN 278.A O no hydrogen 3.031 N/A ASP 282.A N GLY 279.A O no hydrogen 3.274 N/A ILE 283.A N VAL 280.A O.A no hydrogen 2.873 N/A ILE 283.A N VAL 280.A O.B no hydrogen 2.951 N/A LYS 284.A N VAL 280.A O.A no hydrogen 2.924 N/A LYS 284.A N VAL 280.A O.B no hydrogen 2.937 N/A LYS 284.A NZ GLU 148.A OE1 no hydrogen 2.854 N/A LYS 284.A NZ GLU 148.A OE2 no hydrogen 3.510 N/A ASN 285.A N ASN 281.A O no hydrogen 2.937 N/A HIS 286.A N ILE 283.A O no hydrogen 3.089 N/A HIS 286.A NE2 ASP 259.A OD2 no hydrogen 2.774 N/A LYS 287.A NZ ASP 256.A OD1 no hydrogen 3.344 N/A LYS 287.A NZ ASP 256.A OD2 no hydrogen 3.166 N/A TRP 288.A N HIS 286.A ND1 no hydrogen 2.873 N/A TRP 288.A NE1 GLU 133.A OE1 no hydrogen 2.868 N/A PHE 289.A N HIS 286.A O no hydrogen 2.781 N/A ALA 290.A N LYS 287.A O no hydrogen 2.955 N/A THR 292.A N PHE 289.A O no hydrogen 2.880 N/A ALA 296.A N ASP 293.A OD1 no hydrogen 3.020 N/A ILE 297.A N ASP 293.A O no hydrogen 2.951 N/A TYR 298.A N TRP 294.A O no hydrogen 3.044 N/A GLN 299.A N ILE 295.A O no hydrogen 2.860 N/A ARG 300.A N ILE 297.A O no hydrogen 2.916 N/A ARG 300.A NE GLN 170.A OE1 no hydrogen 3.008 N/A ARG 300.A NH1 ASP 168.A OD1 no hydrogen 3.525 N/A ARG 300.A NH1 ASP 168.A OD2 no hydrogen 2.690 N/A ARG 300.A NH2 ASP 168.A OD2 no hydrogen 3.276 N/A LYS 301.A N ALA 296.A O no hydrogen 2.824 N/A LYS 301.A NZ GLN 299.A OE1 no hydrogen 2.863 N/A VAL 302.A N TYR 172.A OH no hydrogen 2.974 N/A LYS 311.A N ASP 315.A OD1 no hydrogen 2.815 N/A ASP 315.A N GLY 312.A O no hydrogen 3.151 N/A SER 317.A N ASP 315.A OD2 no hydrogen 2.811 N/A SER 317.A OG ASP 315.A OD1 no hydrogen 3.149 N/A SER 317.A OG ASP 315.A OD2 no hydrogen 3.055 N/A ASN 318.A ND2 PRO 117.A O no hydrogen 3.380 N/A ASN 318.A ND2 LYS 309.A O no hydrogen 2.909 N/A PHE 319.A N THR 316.A O no hydrogen 3.082 N/A LYS 333.A N ASN 106.A O no hydrogen 2.723 N/A CYS 334.A SG LYS 69.A O no hydrogen 3.823 N/A THR 339.A N LYS 336.A O no hydrogen 3.404 N/A PHE 341.A N PHE 338.A O no hydrogen 3.210 N/A