Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5q0a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N PHE 177.A O no hydrogen 3.053 N/A ARG 7.A N THR 4.A OG1 no hydrogen 3.097 N/A PHE 8.A N THR 4.A O no hydrogen 2.884 N/A VAL 9.A N LEU 5.A O no hydrogen 2.881 N/A MET 10.A N THR 6.A O no hydrogen 3.162 N/A GLU 11.A N ARG 7.A O no hydrogen 2.819 N/A GLU 12.A N PHE 8.A O no hydrogen 3.003 N/A GLY 13.A N VAL 9.A O no hydrogen 3.189 N/A ARG 14.A N MET 10.A O no hydrogen 2.982 N/A LYS 15.A N GLU 11.A O no hydrogen 3.086 N/A ALA 16.A N GLU 12.A O no hydrogen 3.240 N/A ARG 17.A N GLY 13.A O no hydrogen 2.823 N/A GLN 24.A N GLY 20.A O no hydrogen 3.106 N/A LEU 25.A N GLU 21.A O no hydrogen 2.844 N/A LEU 26.A N LEU 22.A O no hydrogen 2.982 N/A ASN 27.A N THR 23.A O no hydrogen 2.988 N/A ASN 27.A ND2 GLN 24.A OE1 no hydrogen 3.305 N/A SER 28.A N GLN 24.A O no hydrogen 2.841 N/A SER 28.A OG GLN 24.A O no hydrogen 3.020 N/A SER 28.A OG MET 68.A O no hydrogen 3.491 N/A LEU 29.A N LEU 25.A O no hydrogen 2.943 N/A CYS 30.A N LEU 26.A O no hydrogen 2.789 N/A THR 31.A N ASN 27.A O no hydrogen 3.118 N/A THR 31.A OG1 ASN 27.A O no hydrogen 3.323 N/A ALA 32.A N SER 28.A O no hydrogen 3.073 N/A VAL 33.A N LEU 29.A O no hydrogen 2.960 N/A LYS 34.A N CYS 30.A O no hydrogen 3.008 N/A LYS 34.A NZ GLY 175.A O no hydrogen 3.042 N/A ALA 35.A N THR 31.A O no hydrogen 3.167 N/A ILE 36.A N ALA 32.A O no hydrogen 2.892 N/A SER 37.A N VAL 33.A O no hydrogen 2.967 N/A SER 37.A OG THR 155.A OG1 no hydrogen 3.017 N/A SER 38.A N LYS 34.A O no hydrogen 3.181 N/A ALA 39.A N ALA 35.A O no hydrogen 3.266 N/A VAL 40.A N ILE 36.A O no hydrogen 2.619 N/A ARG 41.A N SER 37.A O no hydrogen 2.856 N/A ARG 41.A NH1 GLY 152.A O no hydrogen 2.933 N/A ARG 41.A NH2 GLY 152.A O no hydrogen 2.917 N/A ARG 41.A NH2 THR 155.A OG1 no hydrogen 3.008 N/A LYS 42.A N ALA 39.A O no hydrogen 3.023 N/A ALA 43.A N SER 38.A O no hydrogen 3.164 N/A ILE 45.A N LYS 42.A O no hydrogen 2.902 N/A HIS 47.A N GLY 44.A O no hydrogen 2.950 N/A TYR 49.A N ALA 46.A O no hydrogen 3.223 N/A GLY 50.A N HIS 47.A O no hydrogen 3.134 N/A ILE 51.A N ALA 46.A O no hydrogen 3.258 N/A GLY 53.A N GLY 50.A O no hydrogen 3.028 N/A LEU 60.A N LYS 56.A O no hydrogen 2.991 N/A SER 61.A N LEU 57.A O no hydrogen 2.848 N/A SER 61.A OG LEU 57.A O no hydrogen 2.834 N/A ASN 62.A N ASP 58.A O no hydrogen 3.167 N/A ASP 63.A N VAL 59.A O no hydrogen 3.051 N/A LEU 64.A N LEU 60.A O no hydrogen 2.866 N/A VAL 65.A N SER 61.A O no hydrogen 2.973 N/A MET 66.A N ASN 62.A O no hydrogen 2.911 N/A ASN 67.A N ASP 63.A O no hydrogen 3.088 N/A MET 68.A N LEU 64.A O no hydrogen 2.971 N/A LEU 69.A N VAL 65.A O no hydrogen 2.885 N/A LYS 70.A N MET 66.A O no hydrogen 3.019 N/A SER 71.A N ASN 67.A O no hydrogen 3.065 N/A SER 71.A OG ASN 67.A O no hydrogen 3.087 N/A SER 71.A OG MET 68.A O no hydrogen 2.938 N/A SER 72.A N LEU 69.A O no hydrogen 3.269 N/A SER 72.A OG LEU 69.A O no hydrogen 2.534 N/A PHE 73.A N LYS 70.A O no hydrogen 3.288 N/A ALA 74.A N SER 72.A OG no hydrogen 3.192 N/A THR 75.A OG1 LEU 69.A O no hydrogen 3.552 N/A CYS 76.A N TYR 97.A O no hydrogen 2.858 N/A CYS 76.A SG TYR 97.A O no hydrogen 3.755 N/A LEU 78.A N ILE 87.A O no hydrogen 2.862 N/A VAL 79.A N VAL 99.A O no hydrogen 2.816 N/A SER 80.A OG ASN 62.A OD1 no hydrogen 2.788 N/A GLU 81.A N PHE 101.A O no hydrogen 3.216 N/A GLU 82.A N SER 80.A OG no hydrogen 2.930 N/A ASP 83.A N SER 80.A O no hydrogen 3.368 N/A ALA 86.A N GLU 133.A OE1 no hydrogen 3.181 N/A ILE 87.A N LEU 78.A O no hydrogen 2.927 N/A VAL 89.A N CYS 76.A O no hydrogen 2.965 N/A GLU 92.A N GLU 92.A OE1 no hydrogen 2.542 N/A LYS 93.A N GLU 90.A O no hydrogen 3.103 N/A ARG 94.A N PRO 91.A O no hydrogen 3.231 N/A ARG 94.A NE VAL 89.A O no hydrogen 2.921 N/A ARG 94.A NH2 VAL 89.A O no hydrogen 3.322 N/A GLY 95.A N THR 75.A O no hydrogen 2.866 N/A LYS 96.A N GLU 21.A OE1 no hydrogen 2.981 N/A TYR 97.A N ALA 74.A O no hydrogen 3.005 N/A VAL 98.A N TYR 123.A O no hydrogen 2.653 N/A VAL 99.A N VAL 77.A O no hydrogen 3.035 N/A CYS 100.A N GLY 121.A O no hydrogen 3.029 N/A PHE 101.A N VAL 79.A O no hydrogen 2.796 N/A ASP 102.A N ILE 119.A O no hydrogen 2.921 N/A ASP 105.A N GLY 117.A O no hydrogen 2.618 N/A SER 107.A N LEU 104.A O no hydrogen 3.348 N/A SER 107.A OG LEU 104.A O no hydrogen 3.068 N/A ASN 109.A N GLY 106.A O no hydrogen 3.257 N/A ILE 110.A N SER 107.A O no hydrogen 3.207 N/A CYS 112.A N ASN 109.A O no hydrogen 3.226 N/A CYS 112.A SG ASN 109.A O no hydrogen 3.168 N/A LEU 113.A N ILE 110.A O no hydrogen 2.888 N/A GLY 117.A N ASP 105.A O no hydrogen 3.200 N/A THR 118.A N ALA 149.A O no hydrogen 2.852 N/A THR 118.A OG1 PRO 103.A O no hydrogen 2.788 N/A THR 118.A OG1 TYR 151.A OH no hydrogen 2.731 N/A ILE 119.A N ASP 102.A O no hydrogen 3.189 N/A PHE 120.A N GLY 147.A O no hydrogen 2.984 N/A GLY 121.A N CYS 100.A O no hydrogen 2.911 N/A ILE 122.A N ALA 145.A O no hydrogen 2.781 N/A TYR 123.A N VAL 98.A O no hydrogen 2.752 N/A ARG 124.A NH2 TYR 97.A OH no hydrogen 3.188 N/A LYS 125.A N LYS 96.A O no hydrogen 2.924 N/A LYS 125.A NZ SER 127.A O no hydrogen 3.182 N/A LYS 125.A NZ ASP 129.A O no hydrogen 3.256 N/A LYS 125.A NZ ASP 135.A OD1 no hydrogen 3.030 N/A LYS 125.A NZ ASP 135.A OD2 no hydrogen 3.504 N/A LYS 126.A NZ GLN 138.A OE1 no hydrogen 2.616 N/A SER 127.A OG ASP 135.A OD1 no hydrogen 3.195 N/A SER 132.A N ASP 135.A OD2 no hydrogen 2.649 N/A LYS 134.A N SER 132.A OG no hydrogen 3.091 N/A ASP 135.A N SER 132.A O no hydrogen 2.976 N/A ALA 136.A N GLU 133.A O no hydrogen 3.157 N/A LEU 137.A N LYS 134.A O no hydrogen 3.100 N/A GLN 138.A NE2 ARG 124.A O no hydrogen 3.231 N/A GLN 138.A NE2 ASP 135.A O no hydrogen 2.851 N/A ARG 141.A N LEU 287.A O no hydrogen 2.956 N/A ARG 141.A NE ASP 288.A OD1 no hydrogen 2.810 N/A ARG 141.A NH1 GLU 273.A OE1 no hydrogen 3.242 N/A ARG 141.A NH2 ASP 288.A OD2 no hydrogen 3.545 N/A ASN 142.A N PRO 139.A O no hydrogen 2.945 N/A ASN 142.A ND2 GLN 138.A OE1 no hydrogen 3.388 N/A LEU 143.A N GLY 140.A O no hydrogen 2.949 N/A VAL 144.A N ILE 122.A O no hydrogen 2.888 N/A ALA 146.A N ALA 160.A O no hydrogen 3.115 N/A GLY 147.A N PHE 120.A O no hydrogen 2.963 N/A TYR 148.A N VAL 158.A O no hydrogen 2.907 N/A TYR 148.A OH HIS 237.A ND1 no hydrogen 2.591 N/A ALA 149.A N THR 118.A O no hydrogen 2.799 N/A LEU 150.A N MET 156.A O no hydrogen 2.809 N/A TYR 151.A N VAL 116.A O no hydrogen 2.946 N/A TYR 151.A OH THR 118.A OG1 no hydrogen 2.731 N/A GLY 152.A N ALA 154.A O no hydrogen 3.065 N/A THR 155.A OG1 SER 37.A OG no hydrogen 3.017 N/A MET 156.A N LEU 150.A O no hydrogen 3.022 N/A LEU 157.A N PHE 168.A O no hydrogen 2.711 N/A VAL 158.A N TYR 148.A O no hydrogen 2.715 N/A LEU 159.A N ASN 166.A O no hydrogen 2.938 N/A ALA 160.A N ALA 146.A O no hydrogen 2.825 N/A MET 161.A N GLY 164.A O no hydrogen 2.993 N/A GLY 164.A N MET 161.A O no hydrogen 2.881 N/A ASN 166.A N LEU 159.A O no hydrogen 2.938 N/A CYS 167.A N ASP 181.A O no hydrogen 2.953 N/A PHE 168.A N LEU 157.A O no hydrogen 2.732 N/A MET 169.A N ILE 178.A O no hydrogen 2.811 N/A LEU 170.A N THR 155.A O no hydrogen 2.931 N/A ASP 171.A N GLU 176.A O no hydrogen 2.644 N/A ALA 173.A N ASP 171.A OD1 no hydrogen 3.007 N/A ILE 174.A N ASP 171.A O no hydrogen 3.232 N/A GLU 176.A N ASP 171.A O no hydrogen 3.390 N/A ILE 178.A N MET 169.A O no hydrogen 2.633 N/A LEU 179.A N ASN 3.A O no hydrogen 2.834 N/A VAL 180.A N CYS 167.A O no hydrogen 2.976 N/A ASP 181.A N CYS 167.A O no hydrogen 3.423 N/A ASP 183.A N ASN 166.A OD1 no hydrogen 2.871 N/A VAL 184.A N VAL 165.A O no hydrogen 2.860 N/A LYS 185.A NZ LYS 274.A O no hydrogen 3.098 N/A ILE 186.A N ALA 275.A O no hydrogen 2.749 N/A LYS 187.A NZ TYR 242.A O no hydrogen 3.108 N/A LYS 188.A NZ ASP 306.A OD2 no hydrogen 2.795 N/A LYS 189.A NZ TYR 224.A OH no hydrogen 2.957 N/A GLY 190.A N ASP 307.A OD2 no hydrogen 3.073 N/A TYR 193.A N GLY 225.A O no hydrogen 2.950 N/A TYR 193.A OH GLU 197.A OE2 no hydrogen 2.474 N/A SER 194.A N ILE 245.A O no hydrogen 2.980 N/A SER 194.A OG ARG 227.A O no hydrogen 2.610 N/A SER 194.A OG ASP 235.A OD1 no hydrogen 3.542 N/A GLY 198.A N ASN 196.A OD1 no hydrogen 3.007 N/A ALA 200.A N GLU 197.A O no hydrogen 3.140 N/A ASP 202.A N TYR 199.A O no hydrogen 3.188 N/A PHE 203.A N ALA 200.A O no hydrogen 3.271 N/A ALA 206.A N ASP 204.A OD2 no hydrogen 3.069 N/A THR 208.A N ASP 204.A O no hydrogen 3.102 N/A THR 208.A OG1 ASP 204.A O no hydrogen 3.304 N/A GLU 209.A N PRO 205.A O no hydrogen 2.941 N/A TYR 210.A N ALA 206.A O no hydrogen 3.017 N/A TYR 210.A OH ASP 307.A O no hydrogen 3.305 N/A ILE 211.A N VAL 207.A O no hydrogen 2.907 N/A GLN 212.A N THR 208.A O no hydrogen 3.139 N/A ARG 213.A N GLU 209.A O no hydrogen 2.943 N/A ARG 213.A NH2 GLU 209.A OE2 no hydrogen 2.487 N/A LYS 214.A N TYR 210.A O no hydrogen 3.038 N/A LYS 214.A NZ GLU 310.A OE1 no hydrogen 3.255 N/A LYS 214.A NZ GLU 310.A OE2 no hydrogen 3.512 N/A LYS 215.A N ILE 211.A O no hydrogen 3.126 N/A LYS 215.A NZ GLU 197.A OE1 no hydrogen 2.745 N/A PHE 216.A N GLN 212.A O no hydrogen 2.669 N/A SER 221.A OG ASP 219.A OD1 no hydrogen 2.631 N/A TYR 224.A N LYS 214.A O no hydrogen 3.033 N/A TYR 224.A OH ASP 307.A OD1 no hydrogen 2.586 N/A GLY 225.A N LYS 191.A O no hydrogen 3.060 N/A ARG 227.A N TYR 193.A O no hydrogen 3.257 N/A ARG 227.A NH1 ALA 226.A O no hydrogen 2.911 N/A VAL 229.A N ASP 235.A OD1 no hydrogen 2.983 N/A VAL 229.A N ASP 235.A OD2 no hydrogen 3.177 N/A GLY 230.A N ASP 235.A OD2 no hydrogen 3.049 N/A SER 231.A OG SER 115.A O no hydrogen 3.006 N/A ASP 235.A N SER 231.A O no hydrogen 3.050 N/A VAL 236.A N MET 232.A O no hydrogen 2.858 N/A HIS 237.A N VAL 233.A O no hydrogen 2.953 N/A HIS 237.A ND1 TYR 148.A OH no hydrogen 2.591 N/A ARG 238.A N ALA 234.A O no hydrogen 3.039 N/A ARG 238.A NH1 ASP 235.A OD1 no hydrogen 2.830 N/A ARG 238.A NH2 SER 194.A OG no hydrogen 3.077 N/A ARG 238.A NH2 ASP 235.A OD1 no hydrogen 3.163 N/A THR 239.A N ASP 235.A O no hydrogen 3.067 N/A THR 239.A OG1 ASP 235.A O no hydrogen 2.703 N/A LEU 240.A N VAL 236.A O no hydrogen 2.813 N/A VAL 241.A N HIS 237.A O no hydrogen 2.826 N/A TYR 242.A N ARG 238.A O no hydrogen 2.838 N/A GLY 243.A N THR 239.A O no hydrogen 2.855 N/A GLY 244.A N SER 304.A OG no hydrogen 2.912 N/A ILE 245.A N ILE 192.A O no hydrogen 3.096 N/A PHE 246.A N LEU 302.A O no hydrogen 2.731 N/A LEU 247.A N SER 194.A O no hydrogen 2.893 N/A TYR 248.A N VAL 300.A O no hydrogen 2.793 N/A ASN 251.A N SER 254.A O no hydrogen 3.267 N/A LYS 253.A NZ ASP 202.A OD2 no hydrogen 3.062 N/A SER 254.A N ASN 251.A O no hydrogen 3.341 N/A GLY 257.A N SER 254.A O no hydrogen 3.114 N/A LYS 258.A NZ TYR 248.A OH no hydrogen 2.973 N/A ARG 260.A N GLU 264.A OE1 no hydrogen 2.657 N/A ARG 260.A NH1 HIS 295.A O no hydrogen 2.782 N/A LEU 261.A N GLN 296.A O no hydrogen 2.982 N/A TYR 263.A OH HIS 295.A ND1 no hydrogen 2.720 N/A GLU 264.A N ARG 260.A O no hydrogen 3.211 N/A CYS 265.A N ARG 260.A O no hydrogen 2.976 N/A CYS 265.A SG ARG 260.A O no hydrogen 3.415 N/A CYS 265.A SG ALA 298.A O no hydrogen 3.882 N/A ASN 266.A N LEU 261.A O no hydrogen 2.929 N/A MET 268.A N GLU 264.A O no hydrogen 3.304 N/A ALA 269.A N CYS 265.A O no hydrogen 2.692 N/A TYR 270.A N ASN 266.A O no hydrogen 2.776 N/A VAL 271.A N PRO 267.A O no hydrogen 3.048 N/A MET 272.A N MET 268.A O no hydrogen 3.022 N/A GLU 273.A N ALA 269.A O no hydrogen 2.993 N/A LYS 274.A N TYR 270.A O no hydrogen 3.004 N/A LYS 274.A NZ ASP 162.A O no hydrogen 3.537 N/A LYS 274.A NZ ASP 162.A OD2 no hydrogen 3.278 N/A ALA 275.A N VAL 271.A O no hydrogen 2.977 N/A ALA 275.A N MET 272.A O no hydrogen 3.047 N/A GLY 276.A N GLU 273.A O no hydrogen 3.073 N/A GLY 277.A N MET 272.A O no hydrogen 2.704 N/A MET 278.A N GLY 303.A O no hydrogen 3.135 N/A THR 280.A N ILE 301.A O no hydrogen 2.967 N/A THR 280.A OG1 GLU 284.A O no hydrogen 2.780 N/A THR 281.A N GLU 284.A O no hydrogen 2.767 N/A THR 281.A OG1 GLU 284.A O no hydrogen 3.479 N/A GLY 282.A N THR 280.A OG1 no hydrogen 2.972 N/A LYS 283.A N THR 281.A OG1 no hydrogen 3.230 N/A GLU 284.A N THR 281.A OG1 no hydrogen 3.304 N/A VAL 286.A N ALA 279.A O no hydrogen 3.008 N/A ASP 288.A N ALA 285.A O no hydrogen 3.026 N/A VAL 289.A N VAL 286.A O no hydrogen 3.263 N/A THR 292.A N GLN 296.A OE1 no hydrogen 2.573 N/A THR 292.A OG1 GLN 296.A OE1 no hydrogen 3.385 N/A ASP 293.A N GLN 296.A OE1 no hydrogen 3.175 N/A HIS 295.A N ASP 293.A OD1 no hydrogen 2.788 N/A HIS 295.A ND1 TYR 263.A OH no hydrogen 2.720 N/A HIS 295.A NE2 ASP 83.A O no hydrogen 2.752 N/A HIS 295.A NE2 LYS 84.A O no hydrogen 3.114 N/A GLN 296.A N ASP 293.A O no hydrogen 2.961 N/A ARG 297.A NH1 LYS 258.A O no hydrogen 2.781 N/A ALA 298.A N LEU 259.A O no hydrogen 3.043 N/A VAL 300.A N TYR 248.A O no hydrogen 3.173 N/A ILE 301.A N THR 280.A O no hydrogen 2.867 N/A LEU 302.A N PHE 246.A O no hydrogen 2.920 N/A GLY 303.A N MET 278.A O no hydrogen 3.106 N/A SER 304.A N GLY 244.A O no hydrogen 2.699 N/A SER 304.A OG LYS 187.A O no hydrogen 2.970 N/A ASP 306.A N LYS 188.A O no hydrogen 3.156 N/A VAL 308.A N SER 304.A O no hydrogen 3.021 N/A LEU 309.A N PRO 305.A O no hydrogen 2.822 N/A GLU 310.A N ASP 306.A O no hydrogen 3.033 N/A PHE 311.A N ASP 307.A O no hydrogen 3.043 N/A LEU 312.A N VAL 308.A O no hydrogen 2.951 N/A LYS 313.A N LEU 309.A O no hydrogen 3.093 N/A VAL 314.A N GLU 310.A O no hydrogen 3.421 N/A TYR 315.A N PHE 311.A O no hydrogen 2.985 N/A GLU 316.A N LEU 312.A O no hydrogen 2.766 N/A LYS 317.A N LYS 313.A O no hydrogen 2.866 N/A LYS 317.A NZ GLU 209.A OE1 no hydrogen 2.363 N/A LYS 317.A NZ GLU 209.A OE2 no hydrogen 2.923 N/A HIS 318.A N VAL 314.A O no hydrogen 3.122 N/A HIS 318.A N TYR 315.A O no hydrogen 3.295 N/A HIS 318.A NE2 GLU 209.A OE1 no hydrogen 2.967 N/A