Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kqx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N ILE 176.A O no hydrogen 2.822 N/A TYR 3.A N ASP 6.A OD2 no hydrogen 2.754 N/A GLN 5.A N GLN 5.A OE1 no hydrogen 2.746 N/A ASP 6.A N TYR 3.A O no hydrogen 2.891 N/A VAL 7.A N GLU 4.A O no hydrogen 3.412 N/A LYS 10.A N ASP 8.A OD1 no hydrogen 3.117 N/A VAL 11.A N ASP 8.A O no hydrogen 3.152 N/A ILE 12.A N PRO 9.A O no hydrogen 3.121 N/A ILE 12.A N SER 164.A OG no hydrogen 2.809 N/A GLN 13.A N PRO 9.A O no hydrogen 3.042 N/A GLN 13.A NE2 SER 36.A O no hydrogen 3.146 N/A GLY 14.A N LYS 10.A O no hydrogen 2.953 N/A GLY 14.A N VAL 11.A O no hydrogen 3.281 N/A LEU 15.A N ILE 12.A O no hydrogen 3.093 N/A LYS 16.A N ASP 72.A OD2 no hydrogen 2.439 N/A LYS 16.A NZ ASP 39.A OD2 no hydrogen 3.404 N/A VAL 17.A N ASP 39.A O no hydrogen 2.841 N/A GLY 18.A N VAL 73.A O no hydrogen 2.700 N/A ILE 19.A N ARG 41.A O no hydrogen 2.844 N/A ILE 20.A N MET 75.A O no hydrogen 2.859 N/A GLY 21.A N GLY 43.A O no hydrogen 3.211 N/A GLN 25.A NE2 GLY 129.A O no hydrogen 3.081 N/A HIS 27.A N GLY 23.A O no hydrogen 3.198 N/A HIS 27.A ND1 GLY 23.A O no hydrogen 2.871 N/A HIS 29.A N GLN 25.A O no hydrogen 2.769 N/A HIS 29.A ND1 TYR 165.A OH no hydrogen 2.755 N/A HIS 29.A NE2 GLN 25.A OE1 no hydrogen 2.798 N/A ALA 30.A N GLY 26.A O no hydrogen 2.753 N/A LEU 31.A N HIS 27.A O no hydrogen 2.900 N/A ASN 32.A N ALA 28.A O no hydrogen 2.831 N/A ASN 32.A ND2 VAL 134.A O no hydrogen 3.255 N/A ASN 32.A ND2 VAL 169.A O no hydrogen 3.231 N/A LEU 33.A N HIS 29.A O no hydrogen 2.723 N/A MET 34.A N ALA 30.A O no hydrogen 2.881 N/A ASP 35.A N LEU 31.A O no hydrogen 2.819 N/A SER 36.A N ASN 32.A O no hydrogen 2.977 N/A SER 36.A N LEU 33.A O no hydrogen 3.098 N/A SER 36.A OG ASN 32.A O no hydrogen 2.956 N/A SER 36.A OG GLY 168.A O no hydrogen 2.801 N/A GLY 37.A N MET 34.A O no hydrogen 3.069 N/A VAL 38.A N LEU 33.A O no hydrogen 2.990 N/A ARG 41.A N VAL 17.A O no hydrogen 2.997 N/A ARG 41.A NE GLU 70.A OE1 no hydrogen 2.857 N/A ARG 41.A NH1 ASP 39.A OD2 no hydrogen 3.217 N/A ARG 41.A NH1 GLU 70.A OE1 no hydrogen 3.461 N/A ARG 41.A NH2 VAL 17.A O no hydrogen 2.951 N/A ARG 41.A NH2 ASP 39.A O no hydrogen 3.101 N/A VAL 42.A N LYS 60.A O no hydrogen 3.016 N/A GLY 43.A N ILE 19.A O no hydrogen 2.862 N/A LEU 44.A N THR 62.A O no hydrogen 2.957 N/A ASP 50.A N ASP 48.A OD1 no hydrogen 2.752 N/A TRP 51.A N ASP 48.A O no hydrogen 3.066 N/A ALA 54.A N ASP 50.A O no hydrogen 2.850 N/A GLU 55.A N TRP 51.A O no hydrogen 3.014 N/A GLU 56.A N LYS 52.A O no hydrogen 2.704 N/A ALA 57.A N THR 53.A O no hydrogen 2.836 N/A GLY 58.A N GLU 55.A O no hydrogen 2.923 N/A THR 62.A N VAL 42.A O no hydrogen 2.935 N/A THR 62.A OG1 ASP 63.A OD1 no hydrogen 2.988 N/A THR 66.A N ASP 63.A OD2 no hydrogen 3.212 N/A THR 66.A OG1 ASP 63.A OD1 no hydrogen 2.583 N/A THR 66.A OG1 ASP 63.A OD2 no hydrogen 3.302 N/A ALA 67.A N ASP 63.A O no hydrogen 2.993 N/A ALA 68.A N MET 64.A O no hydrogen 2.809 N/A GLU 69.A N ASP 65.A O no hydrogen 3.024 N/A GLU 70.A N THR 66.A O no hydrogen 2.839 N/A ALA 71.A N ALA 68.A O no hydrogen 3.382 N/A VAL 73.A N LYS 16.A O no hydrogen 2.928 N/A ILE 74.A N THR 100.A O no hydrogen 2.936 N/A MET 75.A N GLY 18.A O no hydrogen 2.959 N/A VAL 76.A N ALA 102.A O no hydrogen 2.951 N/A LEU 77.A N ILE 20.A O no hydrogen 2.796 N/A GLU 81.A N GLU 81.A OE1 no hydrogen 2.737 N/A VAL 82.A N PRO 79.A O no hydrogen 2.878 N/A GLN 83.A N PRO 79.A O no hydrogen 3.249 N/A GLN 83.A N ASP 80.A O no hydrogen 3.215 N/A GLN 83.A NE2 VAL 78.A O no hydrogen 2.683 N/A GLN 83.A NE2 ASP 80.A OD1 no hydrogen 3.297 N/A LYS 85.A NZ GLU 89.A OE2 no hydrogen 3.148 N/A VAL 86.A N VAL 82.A O no hydrogen 2.997 N/A TYR 87.A N GLN 83.A O no hydrogen 2.825 N/A GLN 88.A N PRO 84.A O no hydrogen 3.260 N/A GLU 89.A N LYS 85.A O no hydrogen 3.014 N/A HIS 90.A N VAL 86.A O no hydrogen 3.000 N/A HIS 90.A ND1 ASP 65.A OD1 no hydrogen 2.486 N/A ILE 91.A N TYR 87.A O no hydrogen 2.822 N/A ALA 92.A N TYR 87.A O no hydrogen 2.762 N/A HIS 94.A N ILE 91.A O no hydrogen 2.848 N/A HIS 94.A ND1 GLU 69.A OE1 no hydrogen 2.555 N/A HIS 94.A NE2 ASP 65.A OD2 no hydrogen 2.738 N/A LEU 95.A N ALA 92.A O no hydrogen 3.110 N/A LYS 96.A N ASN 99.A OD1 no hydrogen 2.953 N/A LYS 96.A NZ GLU 69.A OE1 no hydrogen 3.438 N/A LYS 96.A NZ GLU 69.A OE2 no hydrogen 2.707 N/A GLY 98.A N ASP 119.A O no hydrogen 3.223 N/A ASN 99.A N LYS 96.A O no hydrogen 3.080 N/A THR 100.A N ASP 72.A O no hydrogen 2.876 N/A LEU 101.A N ASN 121.A O no hydrogen 2.972 N/A ALA 102.A N ILE 74.A O no hydrogen 2.812 N/A PHE 103.A N ILE 123.A O no hydrogen 2.965 N/A HIS 105.A ND1 GLU 184.A OE1 no hydrogen 3.063 N/A GLY 106.A N GLU 184.A OE1 no hydrogen 3.067 N/A ASN 108.A ND2 ASP 80.A O no hydrogen 3.053 N/A ASN 108.A ND2 GLN 83.A OE1 no hydrogen 2.540 N/A HIS 110.A N GLY 106.A O no hydrogen 2.854 N/A TYR 111.A N PHE 107.A O no hydrogen 2.997 N/A TYR 111.A OH ILE 279.A O no hydrogen 2.800 N/A ILE 114.A N ASN 108.A O no hydrogen 3.228 N/A ASN 121.A N ASN 99.A O no hydrogen 3.088 N/A ASN 121.A ND2 THR 100.A OG1 no hydrogen 3.139 N/A ASN 121.A ND2 THR 155.A OG1 no hydrogen 3.111 N/A VAL 122.A N GLN 152.A O no hydrogen 2.965 N/A ILE 123.A N LEU 101.A O no hydrogen 3.139 N/A MET 124.A N CYS 149.A O no hydrogen 2.901 N/A CYS 125.A N PHE 103.A O no hydrogen 2.988 N/A ALA 126.A N LEU 147.A O no hydrogen 2.923 N/A LYS 128.A N PRO 145.A O no hydrogen 2.489 N/A LYS 128.A NZ GLU 184.A OE2 no hydrogen 2.738 N/A LYS 128.A NZ GLU 187.A OE1 no hydrogen 2.586 N/A LYS 128.A NZ ASP 188.A OD1 no hydrogen 2.893 N/A ILE 133.A N PRO 130.A O no hydrogen 3.035 N/A VAL 134.A N PRO 130.A O no hydrogen 2.909 N/A ARG 135.A N GLY 131.A O no hydrogen 2.820 N/A ARG 135.A NH1 ASN 32.A OD1 no hydrogen 2.873 N/A ARG 135.A NH1 ASP 35.A OD2 no hydrogen 2.894 N/A ARG 135.A NH2 ASP 35.A OD2 no hydrogen 2.820 N/A ARG 136.A N HIS 132.A O no hydrogen 2.803 N/A GLN 137.A N ILE 133.A O no hydrogen 2.647 N/A GLN 137.A NE2 TYR 237.A OH no hydrogen 3.004 N/A PHE 138.A N VAL 134.A O no hydrogen 3.353 N/A THR 139.A N ARG 135.A O no hydrogen 2.965 N/A THR 139.A OG1 ARG 135.A O no hydrogen 3.529 N/A THR 139.A OG1 ARG 136.A O no hydrogen 2.698 N/A GLU 140.A N ARG 136.A O no hydrogen 2.800 N/A GLY 141.A N PHE 138.A O no hydrogen 3.105 N/A SER 142.A N GLN 137.A O no hydrogen 2.866 N/A GLY 143.A N SER 142.A OG no hydrogen 2.751 N/A ASP 146.A N GLY 175.A O no hydrogen 3.250 N/A LEU 147.A N ALA 126.A O no hydrogen 3.033 N/A ALA 148.A N ILE 177.A O no hydrogen 2.967 N/A CYS 149.A N MET 124.A O no hydrogen 2.956 N/A CYS 149.A SG ALA 179.A O no hydrogen 3.311 N/A CYS 149.A SG THR 180.A O no hydrogen 3.738 N/A GLN 151.A N VAL 122.A O no hydrogen 2.766 N/A GLN 152.A N VAL 122.A O no hydrogen 3.286 N/A GLN 152.A NE2 PRO 117.A O no hydrogen 2.695 N/A GLN 152.A NE2 VAL 120.A O no hydrogen 2.591 N/A THR 155.A N ASN 121.A OD1 no hydrogen 2.824 N/A THR 155.A OG1 ASN 121.A OD1 no hydrogen 3.472 N/A THR 155.A OG1 ASN 157.A OD1 no hydrogen 2.418 N/A ASN 157.A N THR 155.A OG1 no hydrogen 3.137 N/A ALA 158.A N ASP 153.A OD1 no hydrogen 3.181 N/A ILE 161.A N ASN 157.A O no hydrogen 3.127 N/A ILE 161.A N ALA 158.A O no hydrogen 3.051 N/A VAL 162.A N ALA 158.A O no hydrogen 2.867 N/A LEU 163.A N TRP 159.A O no hydrogen 3.095 N/A SER 164.A N ASP 160.A O no hydrogen 3.109 N/A SER 164.A OG ASP 8.A O no hydrogen 2.460 N/A TYR 165.A N ILE 161.A O no hydrogen 3.114 N/A TYR 165.A OH HIS 29.A ND1 no hydrogen 2.755 N/A CYS 166.A N VAL 162.A O no hydrogen 3.164 N/A CYS 166.A SG VAL 162.A O no hydrogen 3.328 N/A TRP 167.A N LEU 163.A O no hydrogen 3.125 N/A GLY 168.A N SER 164.A O no hydrogen 2.891 N/A VAL 169.A N CYS 166.A O no hydrogen 3.100 N/A GLY 170.A N TRP 167.A O no hydrogen 3.049 N/A GLY 171.A N CYS 166.A O no hydrogen 3.003 N/A ARG 173.A N GLY 170.A O no hydrogen 3.122 N/A ARG 173.A NH1 PHE 138.A O no hydrogen 3.189 N/A ARG 173.A NH1 SER 142.A O no hydrogen 2.784 N/A SER 174.A N GLY 171.A O no hydrogen 3.279 N/A SER 174.A OG GLY 143.A O no hydrogen 2.946 N/A GLY 175.A N GLY 171.A O no hydrogen 2.752 N/A ILE 176.A N LEU 2.A O no hydrogen 2.912 N/A ILE 177.A N ASP 146.A O no hydrogen 2.982 N/A ALA 179.A N ALA 148.A O no hydrogen 2.886 N/A THR 180.A N GLU 183.A OE1 no hydrogen 3.263 N/A GLU 183.A N THR 180.A OG1 no hydrogen 3.106 N/A GLU 184.A N THR 180.A O no hydrogen 3.051 N/A THR 185.A N PHE 181.A O no hydrogen 2.996 N/A THR 185.A OG1 PHE 181.A O no hydrogen 2.770 N/A GLU 186.A N ALA 182.A O no hydrogen 2.983 N/A GLU 187.A N GLU 183.A O no hydrogen 2.953 N/A ASP 188.A N GLU 184.A O no hydrogen 2.909 N/A LEU 189.A N THR 185.A O no hydrogen 3.080 N/A PHE 190.A N GLU 186.A O no hydrogen 3.149 N/A GLY 191.A N GLU 187.A O no hydrogen 3.024 N/A GLU 192.A N ASP 188.A O no hydrogen 3.152 N/A GLN 193.A N LEU 189.A O no hydrogen 3.137 N/A ALA 194.A N PHE 190.A O no hydrogen 2.825 N/A VAL 195.A N GLY 191.A O no hydrogen 3.084 N/A LEU 196.A N GLY 191.A O no hydrogen 2.711 N/A GLY 198.A N GLU 192.A O no hydrogen 3.014 N/A GLY 199.A N GLN 193.A O no hydrogen 3.273 N/A LEU 200.A N VAL 195.A O no hydrogen 2.961 N/A VAL 201.A N CYS 197.A O no hydrogen 3.015 N/A GLU 202.A N GLY 198.A O no hydrogen 2.992 N/A LEU 203.A N GLY 199.A O no hydrogen 2.868 N/A VAL 204.A N LEU 200.A O no hydrogen 3.062 N/A LYS 205.A N VAL 201.A O no hydrogen 2.929 N/A LYS 205.A NZ GLU 202.A OE1 no hydrogen 2.907 N/A ALA 206.A N GLU 202.A O no hydrogen 2.822 N/A GLY 207.A N LEU 203.A O no hydrogen 3.062 N/A PHE 208.A N VAL 204.A O no hydrogen 2.963 N/A GLU 209.A N LYS 205.A O no hydrogen 2.833 N/A THR 210.A N ALA 206.A O no hydrogen 2.886 N/A THR 210.A OG1 ALA 206.A O no hydrogen 2.854 N/A LEU 211.A N GLY 207.A O no hydrogen 3.124 N/A THR 212.A N PHE 208.A O no hydrogen 2.950 N/A THR 212.A OG1 PHE 208.A O no hydrogen 3.200 N/A THR 212.A OG1 GLU 209.A O no hydrogen 3.562 N/A GLU 213.A N GLU 209.A O no hydrogen 2.871 N/A ALA 214.A N THR 210.A O no hydrogen 3.143 N/A ALA 214.A N LEU 211.A O no hydrogen 2.961 N/A GLY 215.A N THR 212.A O no hydrogen 3.003 N/A TYR 216.A N LEU 211.A O no hydrogen 3.046 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.728 N/A ALA 221.A N PRO 217.A O no hydrogen 2.990 N/A TYR 222.A N PRO 218.A O no hydrogen 2.936 N/A PHE 223.A N GLU 219.A O no hydrogen 3.246 N/A GLU 224.A N LEU 220.A O no hydrogen 3.059 N/A CYS 225.A N ALA 221.A O no hydrogen 2.774 N/A CYS 225.A SG ALA 221.A O no hydrogen 3.606 N/A TYR 226.A N TYR 222.A O no hydrogen 2.951 N/A HIS 227.A N TYR 222.A O no hydrogen 2.945 N/A GLU 228.A N PHE 223.A O no hydrogen 3.089 N/A MET 229.A N TYR 226.A O no hydrogen 3.011 N/A LYS 230.A NZ ASP 234.A OD1 no hydrogen 3.145 N/A LYS 230.A NZ ASP 234.A OD2 no hydrogen 2.725 N/A MET 231.A N GLU 228.A O no hydrogen 3.021 N/A ILE 232.A N GLU 228.A O no hydrogen 3.413 N/A VAL 233.A N MET 229.A O no hydrogen 3.040 N/A ASP 234.A N LYS 230.A O no hydrogen 2.854 N/A LEU 235.A N MET 231.A O no hydrogen 3.278 N/A MET 236.A N ILE 232.A O no hydrogen 3.248 N/A TYR 237.A N VAL 233.A O no hydrogen 2.909 N/A GLU 238.A N ASP 234.A O no hydrogen 3.120 N/A SER 239.A N LEU 235.A O no hydrogen 2.880 N/A GLY 240.A N MET 236.A O no hydrogen 3.035 N/A PHE 243.A N GLY 240.A O no hydrogen 3.145 N/A MET 244.A N GLY 240.A O no hydrogen 3.058 N/A ASN 245.A N ILE 241.A O no hydrogen 2.817 N/A ASN 245.A ND2 GLU 256.A OE2 no hydrogen 2.915 N/A TYR 246.A N HIS 242.A O no hydrogen 3.216 N/A SER 247.A N PHE 243.A O no hydrogen 2.900 N/A ILE 248.A N MET 244.A O no hydrogen 3.018 N/A ALA 252.A N SER 249.A OG no hydrogen 2.923 N/A GLU 253.A N SER 249.A O no hydrogen 2.655 N/A TYR 254.A N ASN 250.A O no hydrogen 2.820 N/A GLY 255.A N THR 251.A O no hydrogen 2.975 N/A GLU 256.A N ALA 252.A O no hydrogen 2.730 N/A TYR 257.A N GLU 253.A O no hydrogen 3.348 N/A TYR 257.A OH GLU 253.A OE2 no hydrogen 2.703 N/A TYR 258.A N TYR 254.A O no hydrogen 3.072 N/A ALA 259.A N GLY 255.A O no hydrogen 2.701 N/A GLY 260.A N GLU 256.A O no hydrogen 2.710 N/A LYS 262.A N ALA 259.A O no hydrogen 2.985 N/A LYS 262.A NZ TYR 258.A O no hydrogen 3.205 N/A VAL 263.A N ALA 259.A O no hydrogen 3.199 N/A ILE 264.A N GLY 260.A O no hydrogen 2.798 N/A ASN 265.A N SER 268.A OG no hydrogen 3.029 N/A ASN 265.A ND2 LYS 262.A O no hydrogen 3.245 N/A SER 268.A N ASN 265.A OD1 no hydrogen 3.110 N/A ARG 269.A N ASN 265.A O no hydrogen 2.987 N/A GLU 270.A N GLU 266.A O no hydrogen 2.977 N/A ALA 271.A N GLN 267.A O no hydrogen 2.879 N/A MET 272.A N SER 268.A O no hydrogen 2.865 N/A LYS 273.A N ARG 269.A O no hydrogen 3.156 N/A LYS 273.A NZ GLU 270.A OE2 no hydrogen 2.781 N/A GLU 274.A N GLU 270.A O no hydrogen 2.978 N/A ILE 275.A N ALA 271.A O no hydrogen 2.908 N/A LEU 276.A N MET 272.A O no hydrogen 3.009 N/A LYS 277.A N LYS 273.A O no hydrogen 2.820 N/A ARG 278.A N GLU 274.A O no hydrogen 2.930 N/A ARG 278.A NH1 GLU 287.A OE1 no hydrogen 3.014 N/A ARG 278.A NH2 GLU 287.A OE1 no hydrogen 2.959 N/A ILE 279.A N ILE 275.A O no hydrogen 3.044 N/A GLN 280.A N LEU 276.A O no hydrogen 2.800 N/A ASP 281.A N LYS 277.A O no hydrogen 2.957 N/A GLY 282.A N ILE 279.A O no hydrogen 3.241 N/A SER 283.A N ASP 281.A OD1 no hydrogen 2.994 N/A SER 283.A OG ASP 281.A OD1 no hydrogen 3.191 N/A PHE 284.A N ARG 278.A O no hydrogen 3.029 N/A GLN 286.A N GLY 282.A O no hydrogen 3.121 N/A GLU 287.A N SER 283.A O no hydrogen 2.992 N/A PHE 288.A N PHE 284.A O no hydrogen 2.942 N/A VAL 289.A N ALA 285.A O no hydrogen 3.036 N/A ASP 290.A N GLN 286.A O no hydrogen 2.853 N/A ASP 291.A N GLU 287.A O no hydrogen 2.901 N/A CYS 292.A N PHE 288.A O no hydrogen 2.822 N/A CYS 292.A SG PHE 288.A O no hydrogen 3.340 N/A ASN 293.A N VAL 289.A O no hydrogen 2.898 N/A ASN 294.A N ASP 291.A O no hydrogen 2.861 N/A GLY 295.A N CYS 292.A O no hydrogen 3.150 N/A ARG 298.A N ASP 291.A OD1 no hydrogen 2.722 N/A LEU 299.A N ASP 291.A OD2 no hydrogen 3.221 N/A LEU 300.A N HIS 296.A O no hydrogen 2.971 N/A GLU 301.A N LYS 297.A O no hydrogen 3.268 N/A GLN 302.A N ARG 298.A O no hydrogen 3.173 N/A ARG 303.A N LEU 299.A O no hydrogen 2.986 N/A GLU 304.A N LEU 300.A O no hydrogen 2.946 N/A ALA 305.A N GLU 301.A O no hydrogen 3.097 N/A ILE 306.A N GLN 302.A O no hydrogen 3.122 N/A ASN 307.A N ARG 303.A O no hydrogen 2.847 N/A THR 308.A N GLU 304.A O no hydrogen 2.934 N/A THR 308.A OG1 GLU 304.A O no hydrogen 2.754 N/A THR 308.A OG1 ALA 305.A O no hydrogen 3.523 N/A HIS 309.A N ILE 306.A O no hydrogen 3.095 N/A HIS 309.A NE2 GLU 209.A OE2 no hydrogen 2.473 N/A ILE 311.A N HIS 309.A ND1 no hydrogen 3.042 N/A GLU 312.A N HIS 309.A O no hydrogen 2.686 N/A THR 313.A N HIS 309.A O no hydrogen 3.174 N/A THR 313.A OG1 HIS 309.A O no hydrogen 3.562 N/A THR 313.A OG1 PRO 310.A O no hydrogen 3.449 N/A THR 314.A N PRO 310.A O no hydrogen 2.774 N/A THR 314.A OG1 PRO 310.A O no hydrogen 2.882 N/A GLY 315.A N ILE 311.A O no hydrogen 3.098 N/A ALA 316.A N GLU 312.A O no hydrogen 2.869 N/A GLN 317.A N THR 313.A O no hydrogen 3.223 N/A ILE 318.A N THR 314.A O no hydrogen 3.091 N/A ARG 319.A N GLY 315.A O no hydrogen 3.029 N/A ARG 319.A NH1 TYR 222.A OH no hydrogen 2.998 N/A SER 320.A N ALA 316.A O no hydrogen 3.101 N/A SER 320.A N GLN 317.A O no hydrogen 3.142 N/A SER 320.A OG GLN 317.A O no hydrogen 2.571 N/A MET 321.A N ILE 318.A O no hydrogen 3.133 N/A PHE 322.A N ARG 319.A O no hydrogen 3.233 N/A