Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ihm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A OH GLU 289.A OE1 no hydrogen 3.308 N/A ALA 6.A N GLU 281.A OE1 no hydrogen 3.086 N/A CYS 7.A SG GLU 281.A O no hydrogen 3.607 N/A GLN 8.A N TYR 5.A O no hydrogen 2.893 N/A ARG 9.A NH1 ALA 4.A O no hydrogen 3.168 N/A SER 11.A N GLN 329.A O no hydrogen 2.592 N/A HIS 15.A NE2 SER 21.A OG no hydrogen 3.297 N/A ASN 17.A ND2 LEU 50.A O no hydrogen 3.410 N/A ASN 17.A ND2 CYS 55.A O no hydrogen 3.344 N/A SER 21.A N ASN 17.A O no hydrogen 2.887 N/A SER 21.A OG HIS 15.A NE2 no hydrogen 3.297 N/A SER 21.A OG ASN 17.A O no hydrogen 3.341 N/A SER 21.A OG THR 18.A O no hydrogen 3.233 N/A GLU 22.A N THR 18.A O no hydrogen 2.915 N/A ALA 23.A N LEU 19.A O no hydrogen 3.250 N/A LEU 24.A N LEU 20.A O no hydrogen 3.242 N/A GLU 25.A N SER 21.A O no hydrogen 2.877 N/A THR 26.A N GLU 22.A O no hydrogen 2.948 N/A THR 26.A N ALA 23.A O no hydrogen 3.202 N/A THR 26.A OG1 GLU 22.A O no hydrogen 2.956 N/A LEU 27.A N ALA 23.A O no hydrogen 3.303 N/A ALA 28.A N LEU 24.A O no hydrogen 2.892 N/A GLU 29.A N GLU 25.A O no hydrogen 2.878 N/A ALA 30.A N THR 26.A O no hydrogen 2.776 N/A ALA 31.A N LEU 27.A O no hydrogen 2.704 N/A GLY 32.A N ALA 28.A O no hydrogen 3.004 N/A PHE 33.A N GLU 29.A O no hydrogen 2.908 N/A GLU 34.A N ALA 30.A O no hydrogen 2.992 N/A GLU 34.A N ALA 31.A O no hydrogen 2.820 N/A ALA 35.A N GLY 32.A O no hydrogen 2.783 N/A ASN 36.A N.A ALA 31.A O no hydrogen 2.899 N/A ASN 36.A N.B ALA 31.A O no hydrogen 2.915 N/A ARG 39.A N ASN 36.A OD1.B no hydrogen 3.069 N/A LEU 40.A N ASN 36.A O.A no hydrogen 2.958 N/A LEU 40.A N ASN 36.A O.B no hydrogen 2.986 N/A LEU 41.A N GLU 37.A O no hydrogen 3.049 N/A SER 42.A N GLY 38.A O no hydrogen 3.065 N/A PHE 43.A N ARG 39.A O no hydrogen 2.984 N/A SER 44.A N LEU 40.A O no hydrogen 2.873 N/A SER 44.A OG LEU 40.A O no hydrogen 2.737 N/A ARG 45.A N LEU 41.A O no hydrogen 2.983 N/A ALA 46.A N SER 42.A O no hydrogen 3.241 N/A ALA 47.A N PHE 43.A O no hydrogen 2.914 N/A SER 48.A N SER 44.A O no hydrogen 2.920 N/A VAL 49.A N ARG 45.A O no hydrogen 2.973 N/A LEU 50.A N ALA 46.A O no hydrogen 3.090 N/A LYS 51.A N ALA 47.A O no hydrogen 3.082 N/A LYS 51.A NZ GLU 25.A OE2 no hydrogen 2.944 N/A LYS 51.A NZ ALA 332.A OXT no hydrogen 3.052 N/A SER 52.A N SER 48.A O no hydrogen 3.313 N/A SER 52.A N VAL 49.A O no hydrogen 3.002 N/A SER 52.A OG PRO 10.A O no hydrogen 3.107 N/A SER 52.A OG SER 48.A O no hydrogen 3.462 N/A LEU 53.A N VAL 49.A O no hydrogen 3.257 N/A LEU 53.A N LEU 50.A O no hydrogen 3.187 N/A VAL 57.A N ASN 17.A OD1 no hydrogen 2.859 N/A ALA 58.A N GLN 62.A OE1 no hydrogen 2.445 N/A SER 59.A N GLN 62.A OE1 no hydrogen 3.023 N/A GLN 62.A N SER 59.A O no hydrogen 2.984 N/A HIS 64.A N SER 61.A O no hydrogen 3.027 N/A LEU 66.A N LEU 63.A O no hydrogen 2.746 N/A HIS 72.A NE2 GLU 88.A OE1 no hydrogen 2.500 N/A THR 74.A N GLY 70.A O no hydrogen 3.280 N/A THR 74.A OG1 PHE 69.A O no hydrogen 3.472 N/A THR 74.A OG1 GLY 70.A O no hydrogen 2.337 N/A ARG 75.A N GLU 71.A O no hydrogen 2.885 N/A VAL 76.A N HIS 72.A O no hydrogen 3.205 N/A ILE 77.A N SER 73.A O no hydrogen 3.143 N/A GLN 78.A N THR 74.A O no hydrogen 3.033 N/A GLU 79.A N ARG 75.A O no hydrogen 2.940 N/A LEU 80.A N VAL 76.A O no hydrogen 3.105 N/A LEU 81.A N ILE 77.A O no hydrogen 2.857 N/A GLU 82.A N GLN 78.A O no hydrogen 3.098 N/A HIS 83.A N GLU 79.A O no hydrogen 3.108 N/A THR 85.A OG1 GLY 84.A O no hydrogen 2.625 N/A CYS 86.A SG GLU 79.A OE1 no hydrogen 3.755 N/A GLU 87.A N GLU 79.A OE2 no hydrogen 2.694 N/A LYS 90.A N CYS 86.A O no hydrogen 2.921 N/A LYS 90.A NZ GLU 87.A OE2 no hydrogen 2.773 N/A GLN 91.A N GLU 87.A O no hydrogen 2.922 N/A VAL 92.A N GLU 88.A O no hydrogen 3.096 N/A ARG 93.A N VAL 89.A O no hydrogen 3.039 N/A ARG 93.A NE THR 26.A OG1 no hydrogen 3.317 N/A ARG 93.A NH2 THR 26.A OG1 no hydrogen 2.835 N/A CYS 94.A N LYS 90.A O no hydrogen 2.942 N/A CYS 94.A SG LYS 90.A O no hydrogen 3.228 N/A SER 95.A N GLN 91.A O no hydrogen 2.990 N/A SER 95.A N VAL 92.A O no hydrogen 3.217 N/A SER 95.A OG VAL 92.A O no hydrogen 2.794 N/A ARG 97.A NH2 PHE 33.A O no hydrogen 3.351 N/A ARG 97.A NH2 ASN 116.A OD1 no hydrogen 2.614 N/A TYR 98.A N SER 95.A OG no hydrogen 3.404 N/A TYR 98.A OH GLU 29.A OE2 no hydrogen 2.550 N/A GLN 99.A N SER 95.A O no hydrogen 3.289 N/A GLN 99.A NE2 ARG 93.A O no hydrogen 2.978 N/A THR 100.A N GLU 96.A O no hydrogen 3.072 N/A THR 100.A OG1 GLU 96.A O no hydrogen 2.854 N/A MET 101.A N ARG 97.A O no hydrogen 2.892 N/A LYS 102.A N TYR 98.A O no hydrogen 3.008 N/A LYS 102.A NZ GLU 29.A OE1 no hydrogen 2.906 N/A LEU 103.A N GLN 99.A O no hydrogen 3.231 N/A PHE 104.A N THR 100.A O no hydrogen 2.818 N/A THR 105.A N MET 101.A O no hydrogen 2.860 N/A THR 105.A OG1 MET 101.A O no hydrogen 2.693 N/A THR 105.A OG1 LYS 102.A O no hydrogen 3.073 N/A GLN 106.A N LYS 102.A O no hydrogen 3.162 N/A GLN 106.A NE2 TYR 147.A OH no hydrogen 3.022 N/A VAL 107.A N PHE 104.A O no hydrogen 3.074 N/A VAL 110.A N VAL 107.A O no hydrogen 2.980 N/A ALA 115.A N GLY 111.A O no hydrogen 3.131 N/A ASN 116.A N VAL 112.A O no hydrogen 2.912 N/A ARG 117.A N LYS 113.A O no hydrogen 2.956 N/A TRP 118.A N THR 114.A O no hydrogen 3.036 N/A TYR 119.A N ALA 115.A O no hydrogen 2.941 N/A GLN 120.A N ASN 116.A O no hydrogen 2.804 N/A GLU 121.A N ARG 117.A O no hydrogen 3.141 N/A GLY 122.A N TYR 119.A O no hydrogen 2.661 N/A LEU 123.A N TRP 118.A O no hydrogen 3.039 N/A ARG 124.A N GLU 128.A OE1 no hydrogen 2.564 N/A ARG 124.A NE GLU 96.A OE2 no hydrogen 2.866 N/A ARG 124.A NH1 TYR 119.A O no hydrogen 3.157 N/A ARG 124.A NH1 LEU 123.A O no hydrogen 2.829 N/A THR 125.A N GLU 128.A OE1 no hydrogen 2.661 N/A THR 125.A OG1 GLU 128.A OE1 no hydrogen 3.150 N/A GLU 128.A N THR 125.A O no hydrogen 3.220 N/A GLU 128.A N THR 125.A OG1 no hydrogen 3.201 N/A LEU 129.A N LEU 126.A O no hydrogen 2.762 N/A ARG 130.A N LEU 126.A O no hydrogen 3.070 N/A ARG 130.A NH2 LEU 144.A O no hydrogen 2.885 N/A GLN 132.A N LEU 129.A O no hydrogen 3.364 N/A ARG 135.A N PRO 133.A O no hydrogen 2.658 N/A ARG 135.A NH1 GLU 121.A OE1 no hydrogen 3.039 N/A ARG 135.A NH1 GLN 132.A OE1 no hydrogen 2.651 N/A ARG 135.A NH2 GLU 121.A OE1 no hydrogen 3.023 N/A ARG 135.A NH2 GLU 121.A OE2 no hydrogen 2.676 N/A LEU 136.A N PRO 133.A O no hydrogen 3.144 N/A GLN 140.A N THR 137.A OG1 no hydrogen 3.135 N/A GLN 140.A NE2 GLY 109.A O no hydrogen 3.083 N/A LYS 141.A N THR 137.A O no hydrogen 2.935 N/A ALA 142.A N GLN 138.A O no hydrogen 3.109 N/A GLY 143.A N GLN 139.A O no hydrogen 3.029 N/A LEU 144.A N GLN 140.A O no hydrogen 2.921 N/A GLN 145.A N LYS 141.A O no hydrogen 2.919 N/A TYR 146.A N ALA 142.A O no hydrogen 2.922 N/A TYR 147.A N LEU 144.A O no hydrogen 3.328 N/A LEU 150.A N TYR 146.A O no hydrogen 2.988 N/A SER 151.A OG TYR 147.A O no hydrogen 2.661 N/A THR 152.A N ASP 149.A O no hydrogen 3.079 N/A THR 152.A OG1 GLN 148.A O no hydrogen 2.770 N/A VAL 154.A N GLY 192.A O no hydrogen 2.722 N/A ARG 155.A N ASP 158.A OD2 no hydrogen 2.929 N/A ARG 155.A NE ASP 158.A OD2 no hydrogen 2.879 N/A ARG 155.A NH2 ASP 158.A OD1 no hydrogen 2.958 N/A ARG 155.A NH2 ASP 158.A OD2 no hydrogen 3.530 N/A ARG 156.A NH1 PHE 185.A O no hydrogen 3.247 N/A ARG 156.A NH1 LYS 189.A O no hydrogen 3.015 N/A ASP 158.A N ARG 155.A O no hydrogen 2.719 N/A ALA 159.A N ARG 155.A O no hydrogen 2.990 N/A GLU 160.A N ARG 156.A O no hydrogen 2.827 N/A ALA 161.A N ALA 157.A O no hydrogen 3.125 N/A LEU 162.A N ASP 158.A O no hydrogen 3.057 N/A GLN 163.A N ALA 159.A O no hydrogen 2.903 N/A GLN 163.A NE2 GLU 167.A OE2 no hydrogen 3.321 N/A GLN 164.A N GLU 160.A O no hydrogen 2.953 N/A GLN 164.A N ALA 161.A O no hydrogen 3.026 N/A LEU 165.A N ALA 161.A O no hydrogen 3.097 N/A ILE 166.A N LEU 162.A O no hydrogen 2.872 N/A GLU 167.A N GLN 163.A O no hydrogen 2.978 N/A ALA 168.A N GLN 164.A O no hydrogen 3.061 N/A ALA 169.A N LEU 165.A O no hydrogen 3.070 N/A VAL 170.A N ILE 166.A O no hydrogen 2.845 N/A ARG 171.A N GLU 167.A O no hydrogen 2.803 N/A GLN 172.A N ALA 169.A O no hydrogen 2.885 N/A GLN 172.A NE2 ALA 168.A O no hydrogen 2.983 N/A THR 173.A N VAL 170.A O no hydrogen 3.056 N/A LEU 174.A N VAL 170.A O no hydrogen 2.835 N/A ALA 177.A N LEU 174.A O no hydrogen 3.301 N/A THR 178.A N THR 200.A O no hydrogen 2.894 N/A THR 180.A N LEU 198.A O no hydrogen 2.765 N/A THR 182.A N ASP 196.A O no hydrogen 2.816 N/A GLY 183.A N TRP 272.A O no hydrogen 2.794 N/A ARG 186.A N GLY 183.A O no hydrogen 3.001 N/A ARG 186.A NH1 THR 273.A OG1 no hydrogen 3.046 N/A ARG 186.A NH1 GLU 313.A OE2 no hydrogen 2.904 N/A ARG 186.A NH2 GLU 313.A OE2 no hydrogen 2.701 N/A ARG 187.A NE ASN 331.A OD1 no hydrogen 2.795 N/A ARG 187.A NH2 THR 273.A O no hydrogen 2.954 N/A GLY 188.A N PHE 185.A O no hydrogen 2.722 N/A LYS 189.A N GLY 184.A O no hydrogen 3.121 N/A GLY 192.A N VAL 154.A O no hydrogen 3.309 N/A VAL 195.A N ARG 254.A O no hydrogen 3.044 N/A PHE 197.A N ASP 256.A O no hydrogen 3.041 N/A LEU 198.A N THR 180.A O no hydrogen 2.746 N/A ILE 199.A N VAL 258.A O no hydrogen 2.749 N/A THR 200.A N THR 178.A O no hydrogen 3.107 N/A THR 200.A OG1 THR 260.A O no hydrogen 2.941 N/A HIS 201.A NE2 PRO 175.A O no hydrogen 3.037 N/A GLU 203.A N HIS 201.A ND1 no hydrogen 3.145 N/A GLN 206.A N GLU 203.A O no hydrogen 2.926 N/A GLU 207.A N GLU 207.A OE1 no hydrogen 2.650 N/A VAL 208.A N GLY 205.A O no hydrogen 3.195 N/A VAL 214.A N LEU 210.A O no hydrogen 3.110 N/A MET 215.A N LEU 211.A O no hydrogen 2.733 N/A SER 216.A N PRO 212.A O no hydrogen 2.814 N/A CYS 217.A N LYS 213.A O no hydrogen 2.983 N/A LEU 218.A N VAL 214.A O no hydrogen 2.989 N/A GLN 219.A N MET 215.A O no hydrogen 2.674 N/A SER 220.A N SER 216.A O no hydrogen 2.998 N/A SER 220.A OG CYS 217.A O no hydrogen 2.697 N/A GLN 221.A N CYS 217.A O no hydrogen 3.159 N/A GLN 221.A NE2 CYS 217.A O no hydrogen 3.519 N/A GLY 222.A N GLN 219.A O no hydrogen 2.725 N/A LEU 223.A N LEU 218.A O no hydrogen 3.268 N/A LEU 225.A N ILE 242.A O no hydrogen 2.916 N/A HIS 230.A N ARG 238.A O no hydrogen 2.714 N/A HIS 230.A NE2 GLN 228.A OE1 no hydrogen 2.982 N/A SER 232.A OG GLU 237.A OE2 no hydrogen 2.651 N/A GLU 237.A N HIS 230.A O no hydrogen 2.768 N/A ARG 238.A N HIS 230.A O no hydrogen 3.203 N/A ARG 238.A NH2 HIS 230.A ND1 no hydrogen 2.973 N/A SER 239.A N LEU 257.A O no hydrogen 2.794 N/A PHE 240.A N GLN 228.A O no hydrogen 2.984 N/A CYS 241.A N VAL 255.A O no hydrogen 2.960 N/A CYS 241.A SG SER 239.A OG no hydrogen 3.334 N/A CYS 241.A SG VAL 255.A O no hydrogen 3.785 N/A ILE 242.A N TYR 226.A O no hydrogen 3.136 N/A LEU 243.A N VAL 253.A O no hydrogen 2.781 N/A GLY 244.A N LEU 223.A O no hydrogen 2.829 N/A LEU 245.A N LYS 251.A O no hydrogen 2.799 N/A GLN 247.A N THR 249.A O no hydrogen 2.948 N/A LYS 251.A N LEU 245.A O no hydrogen 2.991 N/A LYS 251.A NZ ASP 158.A OD2 no hydrogen 2.663 N/A ALA 252.A N ASP 149.A OD2 no hydrogen 2.586 N/A VAL 253.A N LEU 243.A O no hydrogen 3.007 N/A ARG 254.A NH1 CYS 241.A O no hydrogen 2.960 N/A ARG 254.A NH1 ASP 256.A OD1 no hydrogen 3.009 N/A ARG 254.A NH2 ASP 256.A OD1 no hydrogen 3.208 N/A ARG 254.A NH2 ASP 256.A OD2 no hydrogen 3.427 N/A VAL 255.A N CYS 241.A O no hydrogen 2.820 N/A ASP 256.A N VAL 195.A O no hydrogen 2.995 N/A LEU 257.A N SER 239.A O no hydrogen 2.833 N/A VAL 258.A N PHE 197.A O no hydrogen 3.035 N/A VAL 259.A N GLU 237.A O no hydrogen 3.004 N/A THR 260.A N ILE 199.A O no hydrogen 3.033 N/A THR 260.A OG1 PRO 261.A O no hydrogen 3.403 N/A SER 262.A OG HIS 201.A O no hydrogen 2.629 N/A SER 262.A OG PRO 202.A O no hydrogen 3.204 N/A SER 262.A OG GLU 204.A OE2 no hydrogen 3.121 N/A SER 263.A OG GLU 204.A OE1 no hydrogen 2.901 N/A GLN 264.A N PRO 261.A O no hydrogen 2.918 N/A GLN 264.A NE2 HIS 297.A O no hydrogen 3.155 N/A PHE 267.A N GLN 264.A O no hydrogen 3.150 N/A ALA 268.A N GLN 264.A O no hydrogen 3.129 N/A LEU 269.A N PHE 265.A O no hydrogen 2.822 N/A LEU 270.A N PRO 266.A O no hydrogen 3.246 N/A GLY 271.A N PHE 267.A O no hydrogen 3.015 N/A TRP 272.A N ALA 268.A O no hydrogen 2.903 N/A THR 273.A OG1 LEU 269.A O no hydrogen 2.728 N/A GLY 274.A N GLU 279.A OE1 no hydrogen 3.294 N/A SER 275.A N ARG 330.A O no hydrogen 3.091 N/A SER 275.A OG ARG 330.A O no hydrogen 3.220 N/A SER 275.A OG ALA 332.A O no hydrogen 2.614 N/A PHE 278.A N SER 275.A OG no hydrogen 3.123 N/A GLU 279.A N SER 275.A O no hydrogen 2.933 N/A ARG 280.A N GLN 276.A O no hydrogen 3.289 N/A GLU 281.A N PHE 277.A O no hydrogen 3.153 N/A LEU 282.A N PHE 278.A O no hydrogen 2.883 N/A ARG 283.A N GLU 279.A O no hydrogen 2.763 N/A ARG 284.A N ARG 280.A O no hydrogen 2.803 N/A ARG 284.A NH2 TYR 68.A OH no hydrogen 2.720 N/A PHE 285.A N GLU 281.A O no hydrogen 2.827 N/A SER 286.A N LEU 282.A O no hydrogen 2.869 N/A SER 286.A OG LEU 292.A O no hydrogen 3.082 N/A ARG 287.A N ARG 283.A O no hydrogen 3.094 N/A GLN 288.A N ARG 284.A O no hydrogen 2.806 N/A GLN 288.A NE2 TYR 5.A OH no hydrogen 3.440 N/A GLU 289.A N PHE 285.A O no hydrogen 3.100 N/A LYS 290.A N ARG 287.A O no hydrogen 3.053 N/A GLY 291.A N ARG 287.A O no hydrogen 2.874 N/A LEU 292.A N SER 286.A O no hydrogen 3.299 N/A TRP 293.A N PHE 300.A O no hydrogen 3.082 N/A ASN 295.A N GLY 298.A O no hydrogen 3.136 N/A ASN 295.A ND2 HIS 297.A ND1 no hydrogen 2.889 N/A HIS 297.A N ASN 295.A OD1 no hydrogen 2.807 N/A GLY 298.A N ASN 295.A OD1 no hydrogen 2.661 N/A PHE 300.A N TRP 293.A O no hydrogen 2.955 N/A GLU 303.A N ASP 301.A OD1 no hydrogen 3.151 N/A GLN 304.A NE2 PRO 302.A O no hydrogen 3.677 N/A LYS 305.A N GLU 303.A O no hydrogen 2.409 N/A THR 311.A N ASP 315.A OD2 no hydrogen 2.668 N/A THR 311.A OG1 ASP 315.A OD2 no hydrogen 3.219 N/A SER 312.A N ASP 315.A OD2 no hydrogen 3.315 N/A SER 312.A OG GLU 314.A OE1 no hydrogen 3.316 N/A GLU 314.A N GLU 314.A OE1 no hydrogen 2.741 N/A ASP 315.A N SER 312.A OG no hydrogen 3.210 N/A VAL 316.A N SER 312.A O no hydrogen 3.346 N/A PHE 317.A N GLU 313.A O no hydrogen 2.970 N/A ARG 318.A N GLU 314.A O no hydrogen 3.003 N/A ARG 318.A N ASP 315.A O no hydrogen 2.794 N/A LEU 319.A N ASP 315.A O no hydrogen 3.022 N/A GLY 321.A N ARG 318.A O no hydrogen 2.565 N/A LEU 322.A N PHE 317.A O no hydrogen 2.799 N/A GLN 329.A N PRO 326.A O no hydrogen 2.761 N/A ARG 330.A N PRO 327.A O no hydrogen 3.065 N/A ARG 330.A NE LEU 325.A O no hydrogen 2.911 N/A ARG 330.A NH1 GLU 313.A OE1 no hydrogen 2.687 N/A ARG 330.A NH2 GLU 313.A OE2 no hydrogen 3.511 N/A ARG 330.A NH2 LEU 325.A O no hydrogen 2.825 N/A ASN 331.A N SER 11.A O no hydrogen 2.800 N/A ASN 331.A ND2 SER 11.A O no hydrogen 3.353 N/A ALA 332.A N ARG 330.A O no hydrogen 2.824 N/A