Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pqm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 9.A NH1 TYR 13.A OH no hydrogen 2.877 N/A HIS 14.A N GLU 18.A OE1 no hydrogen 2.662 N/A LEU 17.A N ASN 15.A OD1 no hydrogen 2.920 N/A GLU 18.A N ASN 15.A O no hydrogen 3.114 N/A THR 19.A N ILE 16.A O no hydrogen 3.029 N/A THR 19.A OG1 ILE 16.A O no hydrogen 2.600 N/A ILE 20.A N LEU 17.A O no hydrogen 3.168 N/A GLY 22.A N GLU 174.A OE2 no hydrogen 2.921 N/A THR 23.A N GLU 174.A OE1 no hydrogen 3.173 N/A THR 23.A OG1 GLU 48.A OE2 no hydrogen 2.597 N/A THR 23.A OG1 GLU 174.A OE1 no hydrogen 3.559 N/A VAL 26.A N VAL 45.A O no hydrogen 2.835 N/A LEU 28.A N ILE 43.A O no hydrogen 2.836 N/A HIS 29.A N ASP 272.A OD1 no hydrogen 2.778 N/A HIS 29.A NE2 GLU 27.A OE1 no hydrogen 2.769 N/A GLY 30.A N ASP 272.A OD1 no hydrogen 3.001 N/A VAL 31.A N ASP 272.A OD2 no hydrogen 2.837 N/A THR 32.A N HIS 29.A O no hydrogen 3.112 N/A THR 32.A OG1 HIS 29.A O no hydrogen 2.811 N/A GLU 33.A N GLY 30.A O no hydrogen 3.472 N/A HIS 34.A N THR 32.A O no hydrogen 3.032 N/A HIS 34.A NE2 ASP 331.A OD1 no hydrogen 2.779 N/A ARG 36.A N HIS 34.A ND1 no hydrogen 3.050 N/A ARG 36.A NH1 GLU 292.A OE1 no hydrogen 3.000 N/A ILE 37.A N HIS 34.A O no hydrogen 3.050 N/A THR 41.A N LYS 38.A O no hydrogen 3.248 N/A ARG 42.A N LYS 299.A O no hydrogen 2.910 N/A ARG 42.A NE THR 300.A OG1 no hydrogen 2.934 N/A ARG 42.A NH2 THR 300.A OG1 no hydrogen 2.751 N/A LEU 44.A N ILE 301.A O no hydrogen 2.847 N/A VAL 45.A N VAL 26.A O no hydrogen 2.721 N/A LYS 46.A N ILE 303.A O no hydrogen 2.842 N/A LYS 46.A NZ THR 23.A O no hydrogen 2.942 N/A LYS 46.A NZ THR 23.A OG1 no hydrogen 2.843 N/A LYS 46.A NZ GLU 174.A OE1 no hydrogen 2.745 N/A LEU 47.A N PRO 24.A O no hydrogen 2.957 N/A GLU 48.A N VAL 305.A O no hydrogen 2.858 N/A PHE 50.A N LEU 47.A O no hydrogen 3.143 N/A ASN 51.A N GLU 48.A O no hydrogen 3.266 N/A MET 53.A N ASP 58.A OD2 no hydrogen 2.598 N/A SER 54.A N ASN 51.A O no hydrogen 2.909 N/A SER 54.A OG TYR 49.A O no hydrogen 3.555 N/A VAL 56.A N PRO 306.A O no hydrogen 3.029 N/A LYS 57.A N SER 55.A OG no hydrogen 3.091 N/A ASP 58.A N SER 55.A O no hydrogen 3.179 N/A ARG 59.A N VAL 56.A O no hydrogen 3.163 N/A ARG 59.A NE GLU 48.A OE1 no hydrogen 2.687 N/A ARG 59.A NH1 GLU 174.A OE2 no hydrogen 3.023 N/A ARG 59.A NH2 THR 23.A OG1 no hydrogen 3.221 N/A ARG 59.A NH2 GLU 48.A OE1 no hydrogen 3.441 N/A ARG 59.A NH2 GLU 48.A OE2 no hydrogen 2.953 N/A ARG 59.A NH2 GLU 174.A OE1 no hydrogen 2.800 N/A ARG 59.A NH2 GLU 174.A OE2 no hydrogen 3.435 N/A GLY 61.A N LYS 57.A O no hydrogen 2.781 N/A PHE 62.A N ASP 58.A O no hydrogen 3.053 N/A ASN 63.A N ARG 59.A O no hydrogen 2.949 N/A ASN 63.A ND2 ASP 163.A O no hydrogen 2.789 N/A ILE 64.A N VAL 60.A O no hydrogen 2.892 N/A VAL 65.A N GLY 61.A O no hydrogen 3.192 N/A TYR 66.A N PHE 62.A O no hydrogen 2.824 N/A GLN 67.A N ASN 63.A O no hydrogen 2.871 N/A GLN 67.A NE2 ASN 63.A OD1 no hydrogen 2.947 N/A ALA 68.A N ILE 64.A O no hydrogen 3.144 N/A ILE 69.A N VAL 65.A O no hydrogen 2.896 N/A LYS 70.A N TYR 66.A O no hydrogen 2.925 N/A ASP 71.A N GLN 67.A O no hydrogen 2.913 N/A GLY 72.A N ILE 69.A O no hydrogen 3.363 N/A ARG 73.A NE ASP 71.A OD2 no hydrogen 3.263 N/A ARG 73.A NH2 ASP 71.A OD2 no hydrogen 2.707 N/A ARG 73.A NH2 ASP 163.A OD2 no hydrogen 3.002 N/A LEU 74.A N ALA 68.A O no hydrogen 3.044 N/A LYS 75.A NZ GLY 72.A O no hydrogen 2.604 N/A MET 78.A N LYS 75.A O no hydrogen 3.009 N/A GLU 79.A N LYS 152.A O no hydrogen 2.952 N/A ILE 80.A N ARG 102.A O no hydrogen 2.840 N/A ILE 81.A N PHE 154.A O no hydrogen 2.872 N/A GLU 82.A N ASN 104.A O no hydrogen 3.105 N/A THR 84.A N ALA 106.A O no hydrogen 2.913 N/A GLY 86.A N THR 84.A OG1 no hydrogen 3.273 N/A THR 88.A OG1 GLN 158.A OE1 no hydrogen 2.605 N/A GLY 89.A N GLY 86.A O no hydrogen 3.198 N/A ALA 91.A N ASN 87.A O no hydrogen 2.988 N/A LEU 92.A N THR 88.A O no hydrogen 2.902 N/A CYS 93.A N GLY 89.A O no hydrogen 2.970 N/A CYS 93.A SG GLY 89.A O no hydrogen 3.349 N/A CYS 93.A SG MET 119.A O no hydrogen 4.032 N/A GLN 94.A N ILE 90.A O no hydrogen 2.965 N/A ALA 95.A N ALA 91.A O no hydrogen 3.094 N/A GLY 96.A N LEU 92.A O no hydrogen 2.755 N/A ALA 97.A N CYS 93.A O no hydrogen 2.930 N/A VAL 98.A N GLN 94.A O no hydrogen 3.246 N/A PHE 99.A N ALA 95.A O no hydrogen 2.889 N/A GLY 100.A N GLY 96.A O no hydrogen 2.827 N/A TYR 101.A N GLY 96.A O no hydrogen 2.896 N/A ASN 104.A N ILE 80.A O no hydrogen 2.737 N/A ASN 104.A ND2 GLU 79.A OE1 no hydrogen 2.859 N/A ASN 104.A ND2 ILE 80.A O no hydrogen 3.034 N/A ILE 105.A N GLU 125.A O no hydrogen 2.882 N/A ALA 106.A N GLU 82.A O no hydrogen 2.956 N/A MET 107.A N ILE 127.A O no hydrogen 3.065 N/A SER 109.A N THR 129.A O no hydrogen 2.820 N/A SER 109.A OG THR 129.A O no hydrogen 3.551 N/A MET 111.A N PRO 108.A O no hydrogen 2.844 N/A ARG 115.A NE SER 112.A OG no hydrogen 3.320 N/A ARG 115.A NH2 SER 112.A OG no hydrogen 3.205 N/A GLN 116.A N SER 112.A O no hydrogen 2.973 N/A GLN 116.A NE2 SER 109.A O no hydrogen 3.228 N/A GLN 116.A NE2 MET 111.A O no hydrogen 2.854 N/A MET 117.A N VAL 113.A O no hydrogen 3.044 N/A ILE 118.A N GLU 114.A O no hydrogen 3.034 N/A MET 119.A N ARG 115.A O no hydrogen 2.917 N/A LYS 120.A N GLN 116.A O no hydrogen 3.003 N/A LYS 120.A NZ ALA 124.A O no hydrogen 3.126 N/A ALA 121.A N MET 117.A O no hydrogen 2.980 N/A PHE 122.A N ILE 118.A O no hydrogen 3.345 N/A PHE 122.A N MET 119.A O no hydrogen 3.036 N/A GLY 123.A N LYS 120.A O no hydrogen 2.947 N/A ALA 124.A N MET 119.A O no hydrogen 3.182 N/A GLU 125.A N VAL 103.A O no hydrogen 2.841 N/A ILE 127.A N ILE 105.A O no hydrogen 2.790 N/A THR 129.A N MET 107.A O no hydrogen 2.966 N/A LYS 133.A N GLU 130.A O no hydrogen 3.026 N/A GLY 134.A N GLY 131.A O no hydrogen 3.095 N/A GLY 137.A N LYS 133.A O no hydrogen 3.428 N/A GLY 137.A N GLY 134.A O no hydrogen 3.172 N/A ALA 138.A N GLY 134.A O no hydrogen 3.464 N/A ILE 139.A N MET 135.A O no hydrogen 2.891 N/A GLU 140.A N PRO 136.A O no hydrogen 2.879 N/A GLU 141.A N GLY 137.A O no hydrogen 3.094 N/A VAL 142.A N ALA 138.A O no hydrogen 3.057 N/A ASN 143.A N ILE 139.A O no hydrogen 2.842 N/A LYS 144.A N GLU 140.A O no hydrogen 2.910 N/A MET 145.A N GLU 141.A O no hydrogen 2.865 N/A ILE 146.A N VAL 142.A O no hydrogen 2.988 N/A LYS 147.A N ASN 143.A O no hydrogen 3.081 N/A GLU 148.A N LYS 144.A O no hydrogen 2.985 N/A ASN 149.A N MET 145.A O no hydrogen 3.026 N/A ASN 149.A ND2 MET 145.A O no hydrogen 2.770 N/A LYS 152.A N ASN 149.A O no hydrogen 3.113 N/A PHE 154.A N GLU 79.A O no hydrogen 2.750 N/A ALA 156.A N ILE 81.A O no hydrogen 3.090 N/A ASN 157.A N GLU 82.A OE1 no hydrogen 2.726 N/A GLN 158.A N GLU 82.A OE2 no hydrogen 2.874 N/A GLY 160.A N ASN 157.A O no hydrogen 3.027 N/A ASN 161.A ND2 ALA 156.A O no hydrogen 2.985 N/A ASP 163.A N ASN 161.A OD1 no hydrogen 2.839 N/A ASN 164.A N ASN 161.A O no hydrogen 2.885 N/A ASN 164.A ND2 GLN 158.A O no hydrogen 2.881 N/A ASN 164.A ND2 THR 192.A OG1 no hydrogen 2.905 N/A ALA 166.A N PRO 162.A O no hydrogen 2.928 N/A ALA 167.A N ASP 163.A O no hydrogen 3.356 N/A ALA 167.A N ASN 164.A O no hydrogen 3.061 N/A HIS 168.A N THR 165.A O no hydrogen 2.961 N/A HIS 168.A ND1 THR 171.A OG1 no hydrogen 2.872 N/A HIS 169.A N ALA 166.A O no hydrogen 3.117 N/A HIS 169.A NE2 GLU 201.A OE1 no hydrogen 2.757 N/A TYR 170.A N ALA 167.A O no hydrogen 3.252 N/A THR 171.A OG1 HIS 168.A ND1 no hydrogen 2.872 N/A ALA 172.A N HIS 168.A O no hydrogen 2.863 N/A ASN 173.A N HIS 169.A O no hydrogen 2.877 N/A GLU 174.A N TYR 170.A O no hydrogen 2.895 N/A ILE 175.A N THR 171.A O no hydrogen 3.047 N/A TRP 176.A N ALA 172.A O no hydrogen 2.892 N/A GLU 177.A N ASN 173.A O no hydrogen 2.820 N/A ASP 178.A N GLU 174.A O no hydrogen 2.803 N/A THR 179.A N ILE 175.A O no hydrogen 3.048 N/A THR 179.A OG1 ILE 175.A O no hydrogen 2.889 N/A THR 179.A OG1 TRP 176.A O no hydrogen 3.513 N/A ASP 180.A N GLU 177.A O no hydrogen 3.171 N/A GLY 181.A N TRP 176.A O no hydrogen 2.878 N/A GLU 182.A N THR 179.A O no hydrogen 2.950 N/A VAL 183.A N THR 179.A OG1 no hydrogen 3.114 N/A ASP 184.A N THR 300.A O no hydrogen 2.843 N/A ILE 185.A N THR 300.A O no hydrogen 3.197 N/A VAL 186.A N LYS 211.A O no hydrogen 2.918 N/A VAL 187.A N VAL 302.A O no hydrogen 2.711 N/A SER 188.A N ILE 213.A O no hydrogen 2.857 N/A VAL 190.A N VAL 215.A O no hydrogen 2.913 N/A SER 193.A OG THR 192.A O no hydrogen 2.522 N/A GLY 194.A N THR 192.A OG1 no hydrogen 3.093 N/A ILE 197.A N SER 193.A O no hydrogen 3.126 N/A GLY 198.A N GLY 194.A O no hydrogen 2.876 N/A VAL 199.A N THR 195.A O no hydrogen 2.930 N/A ALA 200.A N VAL 196.A O no hydrogen 3.045 N/A GLU 201.A N ILE 197.A O no hydrogen 2.817 N/A LYS 202.A N GLY 198.A O no hydrogen 3.383 N/A LEU 203.A N VAL 199.A O no hydrogen 2.825 N/A LYS 204.A N ALA 200.A O no hydrogen 2.881 N/A LYS 204.A NZ ILE 210.A O no hydrogen 2.864 N/A LYS 204.A NZ ASP 251.A OD1 no hydrogen 3.536 N/A LYS 204.A NZ ASP 251.A OD2 no hydrogen 2.735 N/A GLU 205.A N LYS 202.A O no hydrogen 3.221 N/A LYS 206.A N LEU 203.A O no hydrogen 2.787 N/A LYS 207.A N LEU 203.A O no hydrogen 3.369 N/A LYS 207.A NZ GLY 181.A O no hydrogen 2.897 N/A LYS 207.A NZ VAL 183.A O no hydrogen 2.892 N/A LYS 207.A NZ ASP 184.A OD1 no hydrogen 3.514 N/A LYS 211.A N ASP 184.A O no hydrogen 2.944 N/A LYS 211.A NZ GLU 252.A OE1 no hydrogen 3.035 N/A LYS 211.A NZ GLU 290.A OE1 no hydrogen 3.007 N/A ILE 212.A N ASP 251.A OD2 no hydrogen 2.741 N/A ILE 213.A N VAL 186.A O no hydrogen 2.826 N/A ALA 214.A N GLU 252.A O no hydrogen 3.009 N/A VAL 215.A N SER 188.A O no hydrogen 2.932 N/A GLU 216.A N ILE 254.A O no hydrogen 3.100 N/A GLU 218.A N ILE 256.A O no hydrogen 2.937 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.906 N/A SER 220.A N PRO 217.A O no hydrogen 3.040 N/A SER 220.A OG GLY 229.A O no hydrogen 3.401 N/A VAL 222.A N SER 220.A O no hydrogen 2.916 N/A LEU 223.A N GLU 216.A OE1 no hydrogen 2.760 N/A GLU 224.A N GLU 216.A OE2 no hydrogen 3.080 N/A GLY 225.A N VAL 222.A O no hydrogen 3.109 N/A LYS 226.A N ALA 221.A O no hydrogen 2.849 N/A GLY 229.A N SER 220.A OG no hydrogen 3.096 N/A HIS 231.A NE2 GLY 237.A O no hydrogen 2.956 N/A GLY 232.A N THR 258.A OG1 no hydrogen 2.956 N/A ILE 233.A N HIS 231.A ND1 no hydrogen 2.993 N/A ILE 236.A N ILE 233.A O no hydrogen 3.273 N/A GLY 237.A N VAL 190.A O no hydrogen 3.425 N/A ILE 244.A N PHE 159.A O no hydrogen 3.257 N/A TYR 245.A N PRO 242.A O no hydrogen 3.032 N/A LYS 246.A NZ GLU 201.A OE2 no hydrogen 2.509 N/A PHE 249.A N LYS 246.A O no hydrogen 3.009 N/A VAL 250.A N LYS 247.A O no hydrogen 3.113 N/A ASP 251.A N ILE 212.A O no hydrogen 2.827 N/A GLU 252.A N ILE 212.A O no hydrogen 3.332 N/A ILE 254.A N ALA 214.A O no hydrogen 2.835 N/A ILE 256.A N GLU 216.A O no hydrogen 2.983 N/A THR 258.A N GLU 219.A OE2 no hydrogen 2.994 N/A THR 258.A OG1 GLU 219.A OE1 no hydrogen 3.210 N/A THR 258.A OG1 GLU 219.A OE2 no hydrogen 3.251 N/A GLN 259.A NE2 GLU 219.A OE2 no hydrogen 3.014 N/A ALA 261.A N LYS 257.A O no hydrogen 2.936 N/A TRP 262.A N THR 258.A O no hydrogen 3.049 N/A TRP 262.A NE1 GLY 232.A O no hydrogen 3.102 N/A LYS 263.A N GLN 259.A O no hydrogen 3.081 N/A MET 264.A N ASP 260.A O no hydrogen 2.900 N/A ALA 265.A N ALA 261.A O no hydrogen 3.105 N/A ARG 266.A N TRP 262.A O no hydrogen 2.939 N/A ARG 266.A NE ASP 322.A OD2 no hydrogen 2.732 N/A ARG 266.A NH1 LEU 317.A O no hydrogen 3.037 N/A ARG 266.A NH2 ASP 322.A OD1 no hydrogen 2.913 N/A ARG 266.A NH2 ASP 322.A OD2 no hydrogen 3.395 N/A ALA 267.A N LYS 263.A O no hydrogen 2.972 N/A VAL 268.A N MET 264.A O no hydrogen 2.871 N/A VAL 269.A N ALA 265.A O no hydrogen 3.205 N/A LYS 270.A N ARG 266.A O no hydrogen 3.170 N/A TYR 271.A N ALA 267.A O no hydrogen 2.858 N/A ASP 272.A N VAL 268.A O no hydrogen 2.912 N/A ILE 274.A N VAL 268.A O no hydrogen 3.439 N/A CYS 276.A N ILE 274.A O no hydrogen 3.020 N/A CYS 276.A SG GLY 277.A O no hydrogen 3.934 N/A GLY 277.A N SER 307.A O no hydrogen 2.895 N/A GLY 281.A N GLY 277.A O no hydrogen 3.123 N/A ALA 282.A N MET 278.A O no hydrogen 3.188 N/A ALA 283.A N SER 279.A O no hydrogen 2.946 N/A ILE 284.A N SER 280.A O no hydrogen 2.802 N/A LEU 285.A N GLY 281.A O no hydrogen 2.997 N/A ALA 286.A N ALA 282.A O no hydrogen 3.047 N/A GLY 287.A N ALA 283.A O no hydrogen 2.880 N/A LEU 288.A N ILE 284.A O no hydrogen 2.745 N/A LYS 289.A N LEU 285.A O no hydrogen 2.996 N/A GLU 290.A N ALA 286.A O no hydrogen 3.004 N/A ALA 291.A N GLY 287.A O no hydrogen 2.931 N/A GLU 292.A N LYS 289.A O no hydrogen 3.338 N/A LYS 293.A N GLU 290.A O no hydrogen 3.113 N/A LYS 293.A NZ GLU 290.A OE2 no hydrogen 2.558 N/A GLU 295.A N GLU 295.A OE2 no hydrogen 2.831 N/A ASN 296.A N LYS 293.A O no hydrogen 2.929 N/A ASN 296.A ND2 GLU 290.A O no hydrogen 2.894 N/A ASN 296.A ND2 GLU 290.A OE1 no hydrogen 2.991 N/A GLU 297.A N PRO 294.A O no hydrogen 3.174 N/A LYS 299.A N ASN 296.A O no hydrogen 3.021 N/A LYS 299.A NZ GLU 295.A O no hydrogen 3.425 N/A LYS 299.A NZ ASN 296.A OD1 no hydrogen 2.805 N/A THR 300.A N ASP 184.A OD2 no hydrogen 2.867 N/A ILE 301.A N ARG 42.A O no hydrogen 2.763 N/A VAL 302.A N ILE 185.A O no hydrogen 2.782 N/A ILE 303.A N LEU 44.A O no hydrogen 2.854 N/A ILE 304.A N VAL 187.A O no hydrogen 3.008 N/A VAL 305.A N LYS 46.A O no hydrogen 2.920 N/A SER 307.A OG TYR 312.A OH no hydrogen 2.616 N/A CYS 308.A SG MET 275.A O no hydrogen 3.041 N/A GLY 309.A N MET 275.A O no hydrogen 2.747 N/A ARG 311.A N CYS 308.A O no hydrogen 3.289 N/A ARG 311.A NH1 MET 53.A O no hydrogen 3.019 N/A ARG 311.A NH2 MET 53.A O no hydrogen 2.828 N/A TYR 312.A N GLY 309.A O no hydrogen 2.868 N/A TYR 312.A OH SER 307.A OG no hydrogen 2.616 N/A SER 314.A OG GLU 114.A OE2 no hydrogen 3.417 N/A THR 315.A N TYR 312.A O no hydrogen 2.940 N/A THR 315.A OG1 TYR 312.A O no hydrogen 2.543 N/A LEU 317.A N THR 315.A OG1 no hydrogen 3.136 N/A LYS 319.A N ASP 316.A O no hydrogen 3.203 N/A LYS 319.A NZ LEU 313.A O no hydrogen 3.431 N/A LYS 319.A NZ THR 315.A O no hydrogen 3.209 N/A LYS 321.A NZ TYR 318.A O no hydrogen 2.924 N/A THR 325.A N GLN 328.A OE1 no hydrogen 2.996 N/A LYS 326.A NZ GLY 30.A O no hydrogen 2.825 N/A LYS 326.A NZ GLU 33.A OE1 no hydrogen 2.436 N/A ILE 329.A N THR 325.A O no hydrogen 3.035 N/A LEU 330.A N LYS 326.A O no hydrogen 2.933 N/A ASP 331.A N ILE 327.A O no hydrogen 2.854 N/A SER 332.A N GLN 328.A O no hydrogen 2.905 N/A SER 332.A OG GLN 328.A O no hydrogen 3.342 N/A SER 332.A OG ILE 329.A O no hydrogen 2.748 N/A LEU 333.A N ILE 329.A O no hydrogen 3.056 N/A LEU 333.A N LEU 330.A O no hydrogen 3.095 N/A LEU 334.A N LEU 330.A O no hydrogen 3.114 N/A