Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nqk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG ASP 333.A OD1 no hydrogen 2.875 N/A LEU 3.A N ASP 333.A O no hydrogen 2.820 N/A ASN 4.A N ASP 308.A O no hydrogen 2.834 N/A ASN 4.A ND2 ASP 308.A OD1 no hydrogen 3.281 N/A PHE 6.A N PHE 310.A O no hydrogen 3.059 N/A TRP 7.A N GLY 46.A O no hydrogen 2.868 N/A TRP 7.A NE1 HIS 317.A O no hydrogen 2.815 N/A LEU 9.A N LEU 48.A O no hydrogen 3.040 N/A THR 11.A N LEU 9.A O no hydrogen 2.855 N/A HIS 12.A NE2 GLY 282.A O no hydrogen 2.950 N/A GLY 13.A N PRO 10.A O no hydrogen 3.040 N/A GLY 15.A N ASP 14.A OD1 no hydrogen 2.855 N/A HIS 16.A N GLY 23.A O no hydrogen 3.135 N/A HIS 16.A ND1 GLY 23.A O no hydrogen 3.130 N/A LEU 18.A N LEU 246.A O no hydrogen 3.009 N/A GLU 22.A N THR 20.A OG1 no hydrogen 2.975 N/A SER 24.A N GLU 21.A O no hydrogen 3.279 N/A SER 24.A OG GLU 21.A O no hydrogen 2.728 N/A SER 24.A OG GLU 21.A OE2 no hydrogen 2.624 N/A ARG 25.A N ASP 14.A O no hydrogen 2.772 N/A ARG 25.A NH1 TYR 31.A OH no hydrogen 2.797 N/A ARG 25.A NH1 GLU 319.A OE1 no hydrogen 2.755 N/A ARG 25.A NH2 GLU 319.A OE1 no hydrogen 3.471 N/A ARG 25.A NH2 GLU 319.A OE2 no hydrogen 2.780 N/A TYR 31.A N ASP 28.A OD1 no hydrogen 2.825 N/A TYR 31.A OH ASP 14.A OD2 no hydrogen 2.455 N/A LEU 32.A N ASP 28.A O no hydrogen 2.904 N/A GLN 33.A N HIS 29.A O no hydrogen 2.664 N/A GLN 33.A NE2 GLN 37.A OE1 no hydrogen 3.446 N/A GLN 34.A N GLY 30.A O no hydrogen 3.069 N/A ILE 35.A N TYR 31.A O no hydrogen 3.238 N/A ALA 36.A N LEU 32.A O no hydrogen 3.055 N/A GLN 37.A N GLN 33.A O no hydrogen 2.907 N/A GLN 37.A NE2 VAL 68.A O no hydrogen 2.787 N/A ALA 38.A N GLN 34.A O no hydrogen 2.998 N/A ALA 39.A N ILE 35.A O no hydrogen 2.901 N/A ASP 40.A N ALA 36.A O no hydrogen 2.893 N/A ARG 41.A N GLN 37.A O no hydrogen 3.025 N/A LEU 42.A N ALA 38.A O no hydrogen 2.949 N/A TYR 44.A N ALA 39.A O no hydrogen 3.058 N/A TYR 44.A OH ALA 321.A O no hydrogen 2.760 N/A THR 45.A N MET 5.A O no hydrogen 2.558 N/A VAL 47.A N LYS 73.A O no hydrogen 2.867 N/A LEU 48.A N TRP 7.A O no hydrogen 2.864 N/A ILE 49.A N LEU 75.A O no hydrogen 2.983 N/A CYS 55.A N GLY 52.A O no hydrogen 3.121 N/A CYS 55.A SG THR 51.A O no hydrogen 3.723 N/A GLU 56.A N THR 11.A O no hydrogen 3.355 N/A TRP 59.A NE1 ALA 77.A O no hydrogen 2.953 N/A LEU 60.A N ASP 57.A OD2 no hydrogen 3.285 N/A VAL 61.A N ASP 57.A O no hydrogen 3.178 N/A ALA 62.A N ALA 58.A O no hydrogen 2.832 N/A ALA 63.A N TRP 59.A O no hydrogen 2.974 N/A SER 64.A N LEU 60.A O no hydrogen 2.896 N/A SER 64.A OG LEU 60.A O no hydrogen 3.388 N/A SER 64.A OG VAL 61.A O no hydrogen 2.795 N/A MET 65.A N ALA 62.A O no hydrogen 3.016 N/A ILE 66.A N ALA 63.A O no hydrogen 3.089 N/A VAL 68.A N MET 65.A O no hydrogen 3.266 N/A THR 69.A N ILE 66.A O no hydrogen 3.436 N/A THR 69.A OG1 MET 65.A O no hydrogen 2.855 N/A GLN 70.A N ASP 40.A OD1 no hydrogen 3.394 N/A GLN 70.A N ASP 40.A OD2 no hydrogen 3.171 N/A ARG 71.A N ASP 40.A OD1 no hydrogen 3.029 N/A ARG 71.A NE ASP 40.A O no hydrogen 3.086 N/A ARG 71.A NH1 PRO 337.A O no hydrogen 2.976 N/A ARG 71.A NH2 ASP 40.A O no hydrogen 3.319 N/A ARG 71.A NH2 ARG 41.A O no hydrogen 3.343 N/A LEU 72.A N ASP 40.A OD1 no hydrogen 2.740 N/A LYS 73.A N THR 45.A O no hydrogen 2.989 N/A PHE 74.A N ARG 102.A O no hydrogen 2.877 N/A LEU 75.A N VAL 47.A O no hydrogen 2.980 N/A VAL 76.A N LEU 104.A O no hydrogen 3.004 N/A LEU 78.A N ASN 106.A O no hydrogen 2.837 N/A THR 83.A N PRO 80.A O no hydrogen 2.970 N/A ALA 88.A N SER 84.A O no hydrogen 3.035 N/A ALA 89.A N PRO 85.A O no hydrogen 2.982 N/A ARG 90.A N THR 86.A O no hydrogen 3.039 N/A GLN 91.A N VAL 87.A O no hydrogen 2.887 N/A ALA 92.A N ALA 88.A O no hydrogen 2.937 N/A ALA 93.A N ALA 89.A O no hydrogen 2.858 N/A THR 94.A N ARG 90.A O no hydrogen 3.157 N/A THR 94.A OG1 ARG 90.A O no hydrogen 3.210 N/A LEU 95.A N GLN 91.A O no hydrogen 2.849 N/A ASP 96.A N ALA 92.A O no hydrogen 2.980 N/A ARG 97.A N ALA 93.A O no hydrogen 2.870 N/A ARG 97.A NH1 PRO 165.A O no hydrogen 2.928 N/A LEU 98.A N THR 94.A O no hydrogen 2.925 N/A SER 99.A N LEU 95.A O no hydrogen 3.164 N/A SER 99.A OG LEU 95.A O no hydrogen 2.816 N/A SER 99.A OG ASP 96.A O no hydrogen 3.454 N/A ASN 100.A N ARG 97.A O no hydrogen 3.126 N/A ASN 100.A ND2 GLN 341.A O no hydrogen 3.257 N/A GLY 101.A N ASP 96.A O no hydrogen 2.641 N/A ARG 102.A N SER 99.A OG no hydrogen 3.086 N/A ARG 102.A NE SER 99.A O no hydrogen 2.776 N/A ARG 102.A NH1 THR 69.A OG1 no hydrogen 2.855 N/A ARG 102.A NH1 LEU 72.A O no hydrogen 2.945 N/A ARG 102.A NH2 ILE 66.A O no hydrogen 3.258 N/A LEU 104.A N PHE 74.A O no hydrogen 2.813 N/A PHE 105.A N PRO 173.A O no hydrogen 2.949 N/A ASN 106.A N VAL 76.A O no hydrogen 3.012 N/A LEU 107.A N TYR 175.A O no hydrogen 2.937 N/A VAL 108.A N LEU 78.A O no hydrogen 2.806 N/A THR 109.A OG1 SER 132.A OG no hydrogen 2.877 N/A GLN 114.A N ASP 112.A OD2 no hydrogen 3.351 N/A LEU 116.A N ASP 112.A O no hydrogen 2.885 N/A ALA 117.A N PRO 113.A O no hydrogen 2.659 N/A GLY 118.A N GLN 114.A O no hydrogen 3.105 N/A ASP 119.A N GLU 115.A O no hydrogen 3.146 N/A ASP 119.A N LEU 116.A O no hydrogen 2.909 N/A GLY 120.A N ALA 117.A O no hydrogen 3.348 N/A VAL 121.A N LEU 116.A O no hydrogen 2.777 N/A ASP 124.A N GLU 127.A OE1 no hydrogen 2.956 N/A SER 126.A N ASP 124.A OD1 no hydrogen 2.544 N/A GLU 127.A N ASP 124.A OD1 no hydrogen 2.606 N/A ARG 128.A N ASP 124.A O no hydrogen 3.059 N/A ARG 128.A NE GLY 110.A O no hydrogen 2.889 N/A ARG 128.A NH1 LEU 123.A O no hydrogen 2.838 N/A TYR 129.A N SER 126.A O no hydrogen 2.682 N/A GLU 130.A N SER 126.A O no hydrogen 3.015 N/A ALA 131.A N GLU 127.A O no hydrogen 2.835 N/A SER 132.A N ARG 128.A O no hydrogen 3.177 N/A SER 132.A OG THR 109.A OG1 no hydrogen 2.877 N/A SER 132.A OG ARG 128.A O no hydrogen 3.043 N/A ALA 133.A N TYR 129.A O no hydrogen 3.181 N/A GLU 134.A N GLU 130.A O no hydrogen 3.137 N/A PHE 135.A N ALA 131.A O no hydrogen 2.860 N/A THR 136.A N SER 132.A O no hydrogen 2.911 N/A THR 136.A OG1 SER 132.A O no hydrogen 2.646 N/A GLN 137.A N ALA 133.A O no hydrogen 2.951 N/A VAL 138.A N GLU 134.A O no hydrogen 3.156 N/A TRP 139.A N PHE 135.A O no hydrogen 2.874 N/A ARG 140.A N THR 136.A O no hydrogen 3.054 N/A ARG 140.A NE TYR 171.A OH no hydrogen 2.974 N/A ARG 140.A NH1 GLN 190.A OE1 no hydrogen 2.839 N/A ARG 141.A N GLN 137.A O no hydrogen 3.155 N/A LEU 142.A N VAL 138.A O no hydrogen 2.900 N/A LEU 143.A N TRP 139.A O no hydrogen 3.021 N/A GLN 144.A N ARG 141.A O no hydrogen 2.987 N/A ARG 145.A N LEU 142.A O no hydrogen 3.072 N/A GLU 146.A N ARG 141.A O no hydrogen 3.162 N/A VAL 148.A N ALA 160.A O no hydrogen 2.811 N/A PHE 150.A N VAL 157.A O no hydrogen 2.872 N/A GLY 152.A N ILE 155.A O no hydrogen 2.842 N/A LYS 153.A N GLU 134.A OE2 no hydrogen 3.144 N/A HIS 154.A N GLU 134.A OE1 no hydrogen 2.972 N/A ILE 155.A N GLU 134.A OE1 no hydrogen 2.859 N/A VAL 157.A N PHE 150.A O no hydrogen 2.872 N/A GLY 159.A N ASP 149.A OD1 no hydrogen 2.529 N/A ALA 160.A N VAL 148.A O no hydrogen 3.046 N/A ILE 167.A N ASP 96.A OD2 no hydrogen 2.584 N/A GLN 168.A N ASP 96.A OD2 no hydrogen 2.879 N/A LEU 174.A N ASP 192.A OD2 no hydrogen 2.922 N/A TYR 175.A N PHE 105.A O no hydrogen 2.557 N/A PHE 176.A N LEU 193.A O no hydrogen 3.108 N/A ALA 183.A N SER 180.A OG no hydrogen 3.081 N/A GLN 184.A N SER 180.A O no hydrogen 2.997 N/A GLN 184.A NE2 TYR 194.A OH no hydrogen 3.261 N/A GLU 185.A N ASP 181.A O no hydrogen 3.044 N/A LEU 186.A N VAL 182.A O no hydrogen 3.149 N/A ALA 187.A N ALA 183.A O no hydrogen 3.049 N/A ALA 188.A N GLN 184.A O no hydrogen 2.899 N/A GLU 189.A N LEU 186.A O no hydrogen 3.177 N/A GLN 190.A N LEU 186.A O no hydrogen 2.912 N/A GLN 190.A N ALA 187.A O no hydrogen 3.097 N/A GLN 190.A NE2 ALA 133.A O no hydrogen 3.285 N/A VAL 191.A N ALA 187.A O no hydrogen 3.153 N/A ASP 192.A N LEU 174.A O no hydrogen 2.750 N/A LEU 193.A N LEU 174.A O no hydrogen 3.353 N/A TYR 194.A N ARG 223.A O no hydrogen 2.866 N/A TYR 194.A OH GLY 178.A O no hydrogen 2.483 N/A LEU 195.A N PHE 176.A O no hydrogen 2.772 N/A THR 196.A N GLY 225.A O no hydrogen 2.767 N/A GLU 202.A N GLU 202.A OE2 no hydrogen 2.593 N/A LEU 203.A N PRO 200.A O no hydrogen 2.860 N/A VAL 204.A N PRO 200.A O no hydrogen 3.080 N/A LYS 205.A N PRO 201.A O no hydrogen 2.880 N/A GLU 206.A N GLU 202.A O no hydrogen 3.201 N/A LYS 207.A N LEU 203.A O no hydrogen 3.249 N/A LYS 207.A NZ SER 179.A OG no hydrogen 2.817 N/A LYS 207.A NZ GLU 199.A OE1 no hydrogen 2.641 N/A ILE 208.A N VAL 204.A O no hydrogen 3.037 N/A GLU 209.A N LYS 205.A O no hydrogen 2.971 N/A GLN 210.A N GLU 206.A O no hydrogen 3.045 N/A GLN 210.A NE2 GLN 184.A OE1 no hydrogen 2.776 N/A VAL 211.A N LYS 207.A O no hydrogen 3.078 N/A ARG 212.A N ILE 208.A O no hydrogen 2.651 N/A ALA 213.A N GLU 209.A O no hydrogen 2.988 N/A LYS 214.A N GLN 210.A O no hydrogen 2.926 N/A LYS 214.A NZ ASP 181.A OD1 no hydrogen 2.955 N/A LYS 214.A NZ ASP 181.A OD2 no hydrogen 3.178 N/A ALA 215.A N VAL 211.A O no hydrogen 2.646 N/A ALA 216.A N ARG 212.A O no hydrogen 2.928 N/A ALA 217.A N ALA 213.A O no hydrogen 3.011 N/A HIS 218.A N ALA 215.A O no hydrogen 2.931 N/A HIS 218.A ND1 LYS 214.A O no hydrogen 2.969 N/A GLY 219.A N ALA 216.A O no hydrogen 2.636 N/A ARG 220.A N ALA 215.A O no hydrogen 3.137 N/A ARG 220.A NH1 ALA 187.A O no hydrogen 3.425 N/A ARG 220.A NH1 ALA 188.A O no hydrogen 2.958 N/A ARG 220.A NH2 VAL 191.A O no hydrogen 2.714 N/A ARG 223.A N ASP 192.A O no hydrogen 2.826 N/A ARG 223.A NH1 ASP 308.A OD2 no hydrogen 3.236 N/A GLY 225.A N TYR 194.A O no hydrogen 2.991 N/A ILE 226.A N SER 309.A O no hydrogen 3.025 N/A ARG 227.A N THR 196.A O no hydrogen 2.943 N/A ARG 227.A NH1 VAL 311.A O no hydrogen 3.122 N/A ARG 227.A NH1 SER 313.A OG no hydrogen 2.831 N/A ARG 227.A NH2 SER 313.A OG no hydrogen 2.950 N/A LEU 228.A N VAL 311.A O no hydrogen 2.969 N/A HIS 229.A N THR 286.A O no hydrogen 3.084 N/A VAL 230.A N SER 313.A O no hydrogen 2.805 N/A ILE 231.A N LEU 288.A O no hydrogen 3.008 N/A ARG 233.A N GLY 290.A O no hydrogen 3.179 N/A ARG 233.A NH1 VAL 232.A O no hydrogen 2.743 N/A ARG 233.A NH1 GLU 320.A OE1 no hydrogen 3.139 N/A ARG 233.A NH2 GLU 320.A OE1 no hydrogen 3.567 N/A GLU 238.A N THR 235.A OG1 no hydrogen 3.316 N/A ALA 239.A N THR 235.A O no hydrogen 3.229 N/A TRP 240.A N ASN 236.A O no hydrogen 2.935 N/A GLN 241.A N ASP 237.A O no hydrogen 2.682 N/A ALA 242.A N GLU 238.A O no hydrogen 2.689 N/A ALA 243.A N ALA 239.A O no hydrogen 2.981 N/A GLU 244.A N TRP 240.A O no hydrogen 3.018 N/A ARG 245.A N GLN 241.A O no hydrogen 2.922 N/A ARG 245.A NE TYR 17.A OH no hydrogen 2.938 N/A LEU 246.A N ALA 242.A O no hydrogen 2.964 N/A SER 248.A N ARG 245.A O no hydrogen 3.175 N/A SER 248.A OG ARG 245.A O no hydrogen 2.580 N/A SER 248.A OG HIS 249.A ND1 no hydrogen 3.248 N/A HIS 249.A ND1 SER 248.A OG no hydrogen 3.248 N/A LEU 250.A N ILE 247.A O no hydrogen 3.279 N/A ILE 255.A N ASP 251.A O no hydrogen 3.089 N/A ALA 256.A N ASP 252.A O no hydrogen 3.027 N/A LYS 257.A N GLU 253.A O no hydrogen 2.692 N/A ALA 258.A N THR 254.A O no hydrogen 2.854 N/A GLN 259.A N ILE 255.A O no hydrogen 3.211 N/A ALA 260.A N ALA 256.A O no hydrogen 3.295 N/A ALA 261.A N LYS 257.A O no hydrogen 2.880 N/A PHE 262.A N ALA 258.A O no hydrogen 3.064 N/A PHE 262.A N GLN 259.A O no hydrogen 3.298 N/A GLU 268.A N ASP 265.A O no hydrogen 3.096 N/A ASN 272.A N GLU 268.A OE1 no hydrogen 2.801 N/A LEU 273.A N SER 270.A O no hydrogen 2.830 N/A TRP 274.A N ALA 287.A O no hydrogen 2.790 N/A ALA 275.A N LEU 267.A O no hydrogen 2.910 N/A GLY 278.A N ALA 275.A O no hydrogen 3.206 N/A LEU 279.A N GLY 276.A O no hydrogen 3.472 N/A THR 286.A OG1 GLY 198.A O no hydrogen 2.694 N/A ALA 287.A N TRP 274.A O no hydrogen 2.946 N/A LEU 288.A N HIS 229.A O no hydrogen 2.863 N/A VAL 289.A N ASN 272.A O no hydrogen 2.976 N/A GLY 290.A N ILE 231.A O no hydrogen 3.307 N/A ASP 291.A N ASN 236.A OD1 no hydrogen 3.457 N/A THR 294.A N ASP 291.A OD1 no hydrogen 2.989 N/A THR 294.A OG1 ASN 236.A OD1 no hydrogen 3.373 N/A THR 294.A OG1 ASP 291.A OD1 no hydrogen 2.837 N/A VAL 295.A N ASP 291.A O no hydrogen 2.876 N/A ALA 296.A N GLY 292.A O no hydrogen 2.760 N/A ALA 297.A N PRO 293.A O no hydrogen 2.727 N/A ARG 298.A N THR 294.A O no hydrogen 3.003 N/A ARG 298.A NE PRO 271.A O no hydrogen 2.702 N/A ILE 299.A N VAL 295.A O no hydrogen 2.884 N/A ASN 300.A N ALA 296.A O no hydrogen 2.944 N/A GLU 301.A N ALA 297.A O no hydrogen 2.807 N/A TYR 302.A N ARG 298.A O no hydrogen 3.235 N/A TYR 302.A OH GLU 199.A O no hydrogen 2.550 N/A ALA 303.A N ILE 299.A O no hydrogen 2.955 N/A ALA 304.A N ASN 300.A O no hydrogen 2.870 N/A LEU 305.A N TYR 302.A O no hydrogen 3.012 N/A GLY 306.A N ALA 303.A O no hydrogen 2.769 N/A ASP 308.A N PHE 224.A O no hydrogen 3.017 N/A SER 309.A OG ASP 308.A OD1 no hydrogen 2.750 N/A PHE 310.A N ASN 4.A O no hydrogen 3.108 N/A VAL 311.A N ILE 226.A O no hydrogen 2.946 N/A LEU 312.A N PHE 6.A O no hydrogen 2.923 N/A HIS 317.A N ASP 14.A OD1 no hydrogen 3.280 N/A HIS 317.A N ASP 14.A OD2 no hydrogen 2.811 N/A HIS 317.A ND1 ASP 14.A OD1 no hydrogen 2.883 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.820 N/A GLU 320.A N PRO 316.A O no hydrogen 3.047 N/A ARG 323.A N GLU 319.A O no hydrogen 2.974 N/A ARG 323.A NE GLU 320.A OE2 no hydrogen 3.022 N/A VAL 324.A N GLU 320.A O no hydrogen 2.935 N/A GLY 325.A N ALA 321.A O no hydrogen 3.009 N/A GLU 326.A N TYR 322.A O no hydrogen 2.877 N/A LEU 327.A N ARG 323.A O no hydrogen 2.832 N/A LEU 328.A N VAL 324.A O no hydrogen 2.824 N/A PHE 329.A N VAL 324.A O no hydrogen 3.172 N/A LEU 331.A N LEU 328.A O no hydrogen 2.824 N/A LEU 332.A N PHE 329.A O no hydrogen 3.099 N/A ALA 335.A N LEU 3.A O no hydrogen 2.811 N/A GLN 343.A NE2 ASN 100.A OD1 no hydrogen 3.341 N/A