Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kpq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 11.A OG ASN 320.A OD1 no hydrogen 3.295 N/A SER 11.A OG VAL 321.A O no hydrogen 2.586 N/A THR 12.A N ASN 320.A OD1 no hydrogen 3.269 N/A THR 12.A OG1 SER 14.A OG no hydrogen 3.214 N/A SER 14.A OG THR 12.A OG1 no hydrogen 3.214 N/A SER 14.A OG GLU 16.A OE2 no hydrogen 3.265 N/A VAL 18.A N VAL 26.A O no hydrogen 3.008 N/A THR 20.A N GLU 23.A O no hydrogen 2.717 N/A THR 20.A OG1 GLU 23.A O no hydrogen 3.377 N/A LEU 22.A N THR 20.A OG1 no hydrogen 3.211 N/A GLU 23.A N THR 20.A OG1 no hydrogen 2.958 N/A GLY 25.A N ASP 19.A OD1 no hydrogen 2.755 N/A VAL 26.A N VAL 18.A O no hydrogen 2.710 N/A VAL 28.A N GLU 16.A O no hydrogen 3.175 N/A THR 29.A N LEU 318.A O no hydrogen 3.024 N/A SER 30.A OG THR 316.A OG1 no hydrogen 2.878 N/A SER 31.A OG GLU 16.A OE1 no hydrogen 3.464 N/A ILE 32.A N LEU 314.A O no hydrogen 2.944 N/A LEU 34.A N LEU 312.A O no hydrogen 3.028 N/A ILE 35.A N GLN 311.A OE1 no hydrogen 3.108 N/A GLU 36.A N PHE 292.A O no hydrogen 2.722 N/A THR 37.A N GLU 36.A OE2 no hydrogen 3.107 N/A ASN 38.A N GLU 36.A OE2 no hydrogen 2.851 N/A THR 40.A N GLY 285.A O no hydrogen 2.857 N/A THR 40.A OG1 THR 42.A OG1 no hydrogen 2.831 N/A THR 42.A N THR 40.A OG1 no hydrogen 3.044 N/A THR 42.A OG1 THR 40.A OG1 no hydrogen 2.831 N/A TYR 43.A N ARG 271.A O no hydrogen 2.769 N/A TYR 43.A OH SER 268.A O no hydrogen 2.698 N/A CYS 44.A N GLN 280.A OE1 no hydrogen 2.969 N/A CYS 44.A SG THR 40.A OG1 no hydrogen 3.306 N/A CYS 44.A SG THR 42.A O no hydrogen 3.619 N/A CYS 44.A SG THR 42.A OG1 no hydrogen 3.453 N/A CYS 44.A SG GLN 280.A OE1 no hydrogen 3.958 N/A SER 45.A N CYS 275.A O no hydrogen 3.148 N/A LEU 46.A N VAL 49.A O no hydrogen 2.849 N/A ASN 47.A N THR 277.A O no hydrogen 2.914 N/A ASN 47.A ND2 LYS 278.A O no hydrogen 3.568 N/A GLY 48.A N ASN 276.A OD1 no hydrogen 2.849 N/A VAL 49.A N LEU 46.A O no hydrogen 3.150 N/A SER 50.A OG PRO 51.A O no hydrogen 3.436 N/A VAL 52.A N TYR 80.A O no hydrogen 3.103 N/A LEU 54.A N ILE 82.A O no hydrogen 2.886 N/A GLY 55.A N HIS 53.A ND1 no hydrogen 2.907 N/A CYS 57.A N LEU 54.A O no hydrogen 2.983 N/A SER 58.A N HIS 89.A O no hydrogen 2.745 N/A SER 58.A OG HIS 89.A O no hydrogen 3.454 N/A PHE 59.A N GLU 83.A OE2 no hydrogen 2.879 N/A GLU 60.A N GLU 60.A OE2 no hydrogen 2.739 N/A TRP 62.A N SER 58.A O no hydrogen 3.105 N/A ILE 63.A N PHE 59.A O no hydrogen 2.889 N/A VAL 64.A N GLU 60.A O no hydrogen 3.299 N/A GLY 65.A N GLY 61.A O no hydrogen 3.143 N/A ASN 66.A N GLY 61.A O no hydrogen 2.790 N/A ASN 66.A ND2 GLY 90.A O no hydrogen 2.531 N/A ALA 68.A N ASN 66.A OD1 no hydrogen 3.155 N/A CYS 69.A N ASN 66.A O no hydrogen 2.699 N/A THR 70.A OG1 SER 71.A O no hydrogen 3.485 N/A ASN 72.A ND2 TYR 255.A OH no hydrogen 3.022 N/A PHE 73.A N SER 71.A OG no hydrogen 3.188 N/A ILE 75.A N ASN 72.A O no hydrogen 3.372 N/A TRP 78.A N ILE 110.A O no hydrogen 2.955 N/A TRP 78.A NE1 PHE 107.A O no hydrogen 2.969 N/A SER 79.A OG VAL 49.A O no hydrogen 2.823 N/A TYR 80.A OH CYS 44.A O no hydrogen 2.679 N/A LEU 81.A N ARG 264.A O no hydrogen 2.868 N/A ILE 82.A N VAL 52.A O no hydrogen 2.962 N/A GLU 83.A N PHE 266.A O no hydrogen 2.885 N/A ALA 87.A N ASP 84.A O no hydrogen 3.071 N/A HIS 89.A N ASP 56.A O no hydrogen 2.993 N/A CYS 92.A SG ASN 66.A OD1 no hydrogen 3.881 N/A TYR 93.A N TYR 145.A OH no hydrogen 3.139 N/A TYR 93.A OH SER 225.A OG no hydrogen 2.789 N/A GLY 95.A N TYR 220.A OH no hydrogen 3.389 N/A GLU 96.A N MET 227.A O no hydrogen 3.001 N/A ASN 98.A N ILE 229.A O no hydrogen 2.749 N/A ASN 100.A ND2 GLU 60.A OE1 no hydrogen 2.956 N/A LEU 103.A N ASN 99.A O no hydrogen 3.412 N/A ARG 104.A N ASN 100.A O no hydrogen 2.843 N/A ARG 104.A NE GLU 60.A OE1 no hydrogen 2.938 N/A ARG 104.A NH1 GLU 83.A OE1 no hydrogen 3.234 N/A ARG 104.A NH2 GLU 60.A OE1 no hydrogen 3.566 N/A ARG 104.A NH2 GLU 60.A OE2 no hydrogen 3.278 N/A ARG 104.A NH2 GLU 83.A OE1 no hydrogen 3.383 N/A ARG 104.A NH2 GLU 83.A OE2 no hydrogen 2.891 N/A HIS 105.A N GLY 101.A O no hydrogen 3.140 N/A LEU 106.A N GLU 102.A O no hydrogen 2.929 N/A PHE 107.A N LEU 103.A O no hydrogen 2.956 N/A SER 108.A N HIS 105.A O no hydrogen 3.492 N/A SER 108.A OG HIS 105.A O no hydrogen 3.144 N/A ILE 110.A N TRP 78.A O no hydrogen 2.997 N/A ARG 111.A N GLU 259.A O no hydrogen 3.071 N/A SER 112.A N GLU 258.A O no hydrogen 3.161 N/A PHE 113.A N ARG 76.A O no hydrogen 2.852 N/A SER 114.A N ILE 256.A O no hydrogen 3.287 N/A THR 116.A N GLY 254.A O no hydrogen 2.988 N/A LEU 118.A N ARG 252.A O no hydrogen 2.790 N/A SER 123.A N PRO 120.A O no hydrogen 3.076 N/A VAL 127.A N GLY 125.A O no hydrogen 3.157 N/A LEU 128.A N ILE 152.A O no hydrogen 3.169 N/A GLY 130.A N TRP 150.A O no hydrogen 2.734 N/A THR 132.A N SER 143.A O no hydrogen 2.977 N/A ALA 134.A N THR 132.A OG1 no hydrogen 3.148 N/A CYS 135.A N THR 132.A O no hydrogen 3.229 N/A ASP 137.A N THR 141.A O no hydrogen 3.043 N/A THR 139.A N ASP 137.A OD1 no hydrogen 3.073 N/A GLY 140.A N ASP 137.A OD1 no hydrogen 3.007 N/A THR 141.A N ASP 137.A OD1 no hydrogen 2.991 N/A SER 143.A OG PHE 144.A O no hydrogen 3.317 N/A PHE 144.A N SER 143.A OG no hydrogen 2.526 N/A TYR 145.A OH TYR 93.A O no hydrogen 3.349 N/A ARG 146.A N GLY 65.A O no hydrogen 2.865 N/A ARG 146.A NH1 CYS 69.A O no hydrogen 3.205 N/A ARG 146.A NH2 CYS 69.A O no hydrogen 2.676 N/A ASN 147.A N VAL 64.A O no hydrogen 3.255 N/A ASN 147.A ND2 TYR 255.A OH no hydrogen 2.582 N/A VAL 149.A N ALA 250.A O no hydrogen 2.873 N/A TRP 150.A NE1 TYR 192.A OH no hydrogen 2.914 N/A ILE 152.A N LEU 128.A O no hydrogen 2.995 N/A LYS 153.A N LEU 191.A O no hydrogen 2.992 N/A LYS 153.A NZ THR 190.A O no hydrogen 2.708 N/A LYS 154.A N ARG 157.A O no hydrogen 3.209 N/A LYS 154.A NZ GLU 126.A OE2 no hydrogen 2.584 N/A ARG 157.A N LYS 154.A O no hydrogen 3.244 N/A ILE 161.A N SER 244.A O no hydrogen 2.947 N/A SER 162.A OG PHE 242.A O no hydrogen 3.546 N/A LYS 163.A N PHE 242.A O no hydrogen 3.125 N/A TYR 165.A N ILE 240.A O no hydrogen 2.910 N/A ASN 167.A N GLU 238.A O no hydrogen 3.010 N/A ASN 167.A ND2 ARG 171.A O no hydrogen 2.963 N/A THR 169.A N ASN 167.A OD1 no hydrogen 3.383 N/A THR 169.A OG1 ASN 167.A OD1 no hydrogen 2.983 N/A ARG 171.A N THR 169.A OG1 no hydrogen 3.115 N/A ARG 171.A NE THR 169.A O no hydrogen 3.391 N/A ARG 171.A NH2 THR 169.A O no hydrogen 3.332 N/A VAL 173.A N ILE 234.A O no hydrogen 2.939 N/A LEU 174.A N TYR 255.A O no hydrogen 2.726 N/A VAL 175.A N SER 232.A O no hydrogen 2.976 N/A TRP 177.A N TYR 230.A O no hydrogen 3.113 N/A GLY 178.A N LEU 249.A O no hydrogen 2.884 N/A ILE 179.A N LYS 228.A O no hydrogen 2.807 N/A HIS 180.A N GLY 247.A O no hydrogen 3.122 N/A HIS 180.A ND1 TYR 192.A OH no hydrogen 2.737 N/A HIS 180.A NE2 SER 225.A OG no hydrogen 3.000 N/A HIS 181.A N TRP 226.A O no hydrogen 2.552 N/A SER 184.A OG GLU 187.A OE2 no hydrogen 2.928 N/A GLU 187.A N SER 184.A O no hydrogen 2.978 N/A THR 188.A N SER 184.A O no hydrogen 3.304 N/A LYS 189.A N VAL 185.A O no hydrogen 3.204 N/A THR 190.A N ASP 186.A O no hydrogen 2.908 N/A THR 190.A OG1 ASP 186.A O no hydrogen 2.879 N/A LEU 191.A N GLU 187.A O no hydrogen 2.811 N/A TYR 192.A N THR 188.A O no hydrogen 2.762 N/A TYR 192.A OH HIS 180.A ND1 no hydrogen 2.737 N/A VAL 193.A N LYS 189.A O no hydrogen 2.857 N/A ASN 194.A N TYR 192.A O no hydrogen 2.432 N/A ASN 194.A ND2 TYR 158.A O no hydrogen 3.299 N/A TYR 198.A N ASN 245.A OD1 no hydrogen 2.765 N/A TYR 198.A OH GLU 243.A OE2 no hydrogen 2.242 N/A THR 199.A N TYR 210.A O no hydrogen 2.885 N/A THR 199.A OG1 SER 244.A OG no hydrogen 2.955 N/A LEU 200.A N GLU 243.A O no hydrogen 2.672 N/A VAL 201.A N GLU 208.A O no hydrogen 2.886 N/A SER 202.A N THR 241.A O no hydrogen 3.092 N/A SER 202.A OG SER 207.A OG no hydrogen 2.512 N/A THR 203.A N TRP 206.A O no hydrogen 2.806 N/A THR 203.A OG1 TRP 206.A O no hydrogen 3.464 N/A SER 205.A N THR 203.A OG1 no hydrogen 3.114 N/A TRP 206.A N THR 203.A OG1 no hydrogen 3.097 N/A SER 207.A OG SER 202.A OG no hydrogen 2.512 N/A GLU 208.A N VAL 201.A O no hydrogen 2.737 N/A TYR 210.A N THR 199.A O no hydrogen 2.722 N/A GLU 213.A N HIS 181.A ND1 no hydrogen 2.897 N/A GLY 215.A N PRO 182.A O no hydrogen 3.176 N/A ARG 217.A N ARG 224.A O no hydrogen 2.876 N/A ARG 217.A NH1 GLU 213.A O no hydrogen 2.974 N/A ARG 217.A NH1 GLY 215.A O no hydrogen 3.080 N/A ARG 217.A NH2 GLU 213.A O no hydrogen 2.899 N/A GLY 219.A N ARG 217.A O no hydrogen 2.751 N/A TYR 220.A OH LEU 91.A O no hydrogen 2.742 N/A TYR 220.A OH TYR 93.A O no hydrogen 3.411 N/A ASN 221.A ND2 ALA 134.A O no hydrogen 3.206 N/A SER 225.A OG HIS 180.A NE2 no hydrogen 3.000 N/A TRP 226.A N HIS 181.A O no hydrogen 2.874 N/A TRP 226.A NE1 GLU 96.A OE1 no hydrogen 3.199 N/A MET 227.A N PRO 94.A O no hydrogen 3.056 N/A LYS 228.A N ILE 179.A O no hydrogen 2.808 N/A LYS 228.A NZ GLU 213.A OE1 no hydrogen 3.502 N/A ILE 229.A N GLU 96.A O no hydrogen 2.957 N/A TYR 230.A N TRP 177.A O no hydrogen 2.801 N/A TRP 231.A NE1 ASN 99.A O no hydrogen 3.224 N/A SER 232.A N VAL 175.A O no hydrogen 3.068 N/A ILE 234.A N VAL 173.A O no hydrogen 2.729 N/A HIS 235.A N GLU 238.A OE1 no hydrogen 3.280 N/A HIS 235.A ND1 ASP 172.A OD1 no hydrogen 3.090 N/A GLY 237.A N ASN 167.A O no hydrogen 3.053 N/A GLU 238.A N HIS 235.A O no hydrogen 2.918 N/A ILE 240.A N TYR 165.A O no hydrogen 3.131 N/A THR 241.A N SER 202.A O no hydrogen 2.795 N/A PHE 242.A N LYS 163.A O no hydrogen 2.877 N/A GLU 243.A N LEU 200.A O no hydrogen 2.943 N/A SER 244.A N ILE 161.A O no hydrogen 2.969 N/A SER 244.A OG TYR 198.A O no hydrogen 3.012 N/A SER 244.A OG THR 199.A OG1 no hydrogen 2.955 N/A ASN 245.A N TYR 198.A O no hydrogen 3.275 N/A GLY 246.A N SER 244.A OG no hydrogen 3.126 N/A LEU 249.A N GLY 178.A O no hydrogen 2.689 N/A ALA 250.A N VAL 149.A O no hydrogen 2.989 N/A ARG 252.A N ASN 147.A O no hydrogen 2.824 N/A ARG 252.A NE GLU 117.A OE2 no hydrogen 3.348 N/A TYR 253.A N ASN 147.A O no hydrogen 3.319 N/A GLY 254.A N THR 116.A O no hydrogen 2.753 N/A TYR 255.A N LEU 174.A O no hydrogen 3.028 N/A TYR 255.A OH ILE 63.A O no hydrogen 2.662 N/A ILE 256.A N SER 114.A O no hydrogen 2.850 N/A ILE 257.A N ASP 172.A O no hydrogen 2.825 N/A GLU 258.A N SER 112.A O no hydrogen 3.051 N/A TYR 260.A OH ASP 172.A OD2 no hydrogen 2.503 N/A LYS 262.A N GLY 109.A O no hydrogen 3.061 N/A GLY 263.A N SER 108.A OG no hydrogen 3.082 N/A ARG 264.A N SER 108.A O no hydrogen 3.127 N/A ARG 264.A NE GLY 263.A O no hydrogen 3.363 N/A ARG 264.A NH1 ASN 298.A OD1 no hydrogen 2.929 N/A ARG 264.A NH1 ALA 299.A O no hydrogen 3.184 N/A ARG 264.A NH2 ALA 299.A O no hydrogen 3.383 N/A PHE 266.A N LEU 81.A O no hydrogen 2.883 N/A SER 268.A OG SER 282.A O no hydrogen 2.643 N/A SER 273.A N TYR 43.A O no hydrogen 2.784 N/A CYS 275.A N SER 273.A OG no hydrogen 3.163 N/A CYS 275.A SG THR 42.A OG1 no hydrogen 3.677 N/A THR 277.A N SER 45.A O no hydrogen 3.044 N/A THR 277.A OG1 CYS 279.A O no hydrogen 3.029 N/A LYS 278.A NZ THR 288.A O no hydrogen 2.996 N/A CYS 279.A SG LEU 300.A O no hydrogen 4.012 N/A GLN 280.A N LEU 300.A O no hydrogen 3.072 N/A GLN 280.A NE2 THR 42.A O no hydrogen 3.148 N/A GLN 280.A NE2 THR 281.A O no hydrogen 2.765 N/A THR 281.A N GLY 284.A O no hydrogen 2.850 N/A THR 281.A OG1 GLY 284.A O no hydrogen 2.504 N/A SER 282.A N ASN 298.A O no hydrogen 3.273 N/A SER 282.A OG ASP 296.A OD2 no hydrogen 2.483 N/A VAL 283.A N THR 281.A OG1 no hydrogen 3.234 N/A GLY 284.A N THR 281.A O no hydrogen 3.343 N/A GLY 284.A N THR 281.A OG1 no hydrogen 2.909 N/A GLY 285.A N THR 40.A OG1 no hydrogen 2.964 N/A ILE 286.A N CYS 279.A O no hydrogen 2.649 N/A THR 288.A OG1 GLU 36.A OE1 no hydrogen 2.783 N/A ARG 290.A N THR 288.A OG1 no hydrogen 2.989 N/A ARG 290.A NH1 ILE 35.A O no hydrogen 3.353 N/A GLN 293.A N LYS 305.A O no hydrogen 3.030 N/A GLN 293.A NE2 PRO 304.A O no hydrogen 3.308 N/A ASN 294.A ND2 SER 309.A O no hydrogen 2.785 N/A ILE 295.A N GLN 293.A OE1 no hydrogen 3.140 N/A ASP 296.A N GLN 293.A OE1 no hydrogen 2.787 N/A ASN 298.A N ASP 296.A OD1 no hydrogen 3.225 N/A LEU 300.A N GLN 280.A O no hydrogen 2.894 N/A LYS 305.A N THR 291.A O no hydrogen 2.897 N/A LYS 305.A NZ TYR 306.A O no hydrogen 2.584 N/A ILE 307.A N GLN 293.A O no hydrogen 3.108 N/A SER 309.A OG GLY 310.A O no hydrogen 2.603 N/A GLN 311.A NE2 ILE 35.A O no hydrogen 3.010 N/A LEU 312.A N GLN 311.A OE1 no hydrogen 2.974 N/A LYS 313.A NZ ASP 33.A OD1 no hydrogen 3.432 N/A LEU 314.A N ILE 32.A O no hydrogen 2.861 N/A THR 316.A N SER 30.A O no hydrogen 2.983 N/A THR 316.A OG1 SER 30.A OG no hydrogen 2.878 N/A GLY 317.A N SER 30.A O no hydrogen 2.975 N/A LEU 318.A N THR 29.A OG1 no hydrogen 3.328 N/A ARG 319.A NH1 GLU 23.A OE2 no hydrogen 3.354 N/A ARG 319.A NH2 GLU 23.A OE2 no hydrogen 3.374 N/A ASN 320.A N PRO 27.A O no hydrogen 2.766 N/A ASN 320.A ND2 THR 12.A O no hydrogen 3.286 N/A VAL 321.A N ARG 319.A O no hydrogen 3.068 N/A