Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5r9u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NH2 PRO 88.A O no hydrogen 2.941 N/A TYR 5.A N VAL 16.A O no hydrogen 3.002 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.663 N/A GLN 7.A N TRP 14.A O no hydrogen 3.026 N/A LEU 9.A N THR 12.A O no hydrogen 2.712 N/A THR 12.A OG1 ASN 10.A O no hydrogen 2.318 N/A TRP 14.A N GLN 7.A O no hydrogen 2.815 N/A GLU 15.A N TYR 99.A OH no hydrogen 3.003 N/A VAL 16.A N TYR 5.A O no hydrogen 3.049 N/A GLU 18.A N THR 3.A O no hydrogen 3.029 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.917 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.551 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 2.810 N/A TYR 20.A N PRO 17.A O no hydrogen 3.050 N/A TYR 20.A OH ASP 84.A OD2 no hydrogen 2.746 N/A GLN 21.A N PHE 38.A O no hydrogen 2.973 N/A GLN 21.A NE2 GLU 18.A O no hydrogen 2.858 N/A SER 24.A N ALA 36.A O no hydrogen 3.066 N/A VAL 26.A N VAL 34.A O no hydrogen 3.095 N/A ALA 30.A N GLY 27.A O no hydrogen 3.042 N/A GLY 32.A N GLY 29.A O no hydrogen 3.264 N/A CYS 35.A N VAL 48.A O no hydrogen 2.931 N/A ALA 36.A N SER 24.A O no hydrogen 3.063 N/A ALA 37.A N VAL 46.A O no hydrogen 2.940 N/A PHE 38.A N GLN 21.A O no hydrogen 2.920 N/A ASP 39.A N HIS 44.A O no hydrogen 2.962 N/A THR 40.A N ARG 19.A O no hydrogen 2.938 N/A THR 40.A OG1 ARG 19.A O no hydrogen 2.947 N/A LYS 41.A N ASP 39.A OD1 no hydrogen 3.053 N/A THR 42.A OG1 ASP 39.A OD2 no hydrogen 2.821 N/A GLY 43.A N ASP 39.A O no hydrogen 2.783 N/A HIS 44.A N THR 42.A OG1 no hydrogen 3.264 N/A VAL 46.A N ALA 37.A O no hydrogen 2.832 N/A ALA 47.A N THR 102.A O no hydrogen 2.857 N/A VAL 48.A N CYS 35.A O no hydrogen 2.744 N/A LYS 49.A N LEU 100.A O no hydrogen 2.769 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 2.915 N/A LYS 50.A N SER 33.A O no hydrogen 3.010 N/A LYS 50.A NZ ILE 13.A O no hydrogen 2.744 N/A LEU 51.A N VAL 98.A O no hydrogen 2.954 N/A SER 57.A OG HIS 60.A ND1 no hydrogen 2.635 N/A HIS 60.A N SER 57.A OG no hydrogen 2.923 N/A HIS 60.A ND1 SER 57.A OG no hydrogen 2.635 N/A ALA 61.A N SER 57.A O no hydrogen 2.926 N/A LYS 62.A N ILE 58.A O no hydrogen 2.983 N/A LYS 62.A NZ GLU 321.A O no hydrogen 2.735 N/A ARG 63.A N ILE 59.A O no hydrogen 3.091 N/A THR 64.A N HIS 60.A O no hydrogen 2.976 N/A THR 64.A OG1 PRO 54.A O no hydrogen 2.790 N/A THR 64.A OG1 HIS 60.A O no hydrogen 3.125 N/A TYR 65.A N ALA 61.A O no hydrogen 3.083 N/A ARG 66.A N LYS 62.A O no hydrogen 2.901 N/A ARG 66.A NE GLU 321.A OE2 no hydrogen 2.841 N/A ARG 66.A NH2 GLU 321.A OE1 no hydrogen 2.944 N/A GLU 67.A N ARG 63.A O no hydrogen 2.977 N/A LEU 68.A N THR 64.A O no hydrogen 3.088 N/A ARG 69.A N TYR 65.A O no hydrogen 2.885 N/A ARG 69.A NH1 TYR 65.A OH no hydrogen 3.019 N/A ARG 69.A NH2 ASP 317.A O no hydrogen 2.803 N/A LEU 70.A N ARG 66.A O no hydrogen 3.047 N/A LEU 71.A N GLU 67.A O no hydrogen 3.017 N/A LYS 72.A N LEU 68.A O no hydrogen 2.929 N/A LYS 72.A NZ GLU 337.A O no hydrogen 2.926 N/A LYS 72.A NZ GLU 337.A OE1 no hydrogen 2.714 N/A HIS 73.A N ARG 69.A O no hydrogen 3.199 N/A HIS 73.A N LEU 70.A O no hydrogen 3.143 N/A HIS 73.A NE2 PRO 315.A O no hydrogen 3.066 N/A MET 74.A N.A LEU 70.A O no hydrogen 3.315 N/A MET 74.A N.B LEU 70.A O no hydrogen 3.298 N/A LYS 75.A N TYR 136.A OH no hydrogen 2.958 N/A ASN 78.A ND2 LEU 160.A O no hydrogen 3.115 N/A VAL 79.A N HIS 76.A O no hydrogen 3.137 N/A ILE 80.A N ILE 162.A O no hydrogen 3.180 N/A LEU 83.A N VAL 101.A O no hydrogen 2.840 N/A ASP 84.A N VAL 101.A O no hydrogen 3.323 N/A PHE 86.A N TYR 99.A O no hydrogen 3.106 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.834 N/A ALA 89.A N THR 87.A OG1 no hydrogen 3.239 N/A ARG 90.A N GLU 94.A OE2 no hydrogen 2.804 N/A GLU 94.A N SER 91.A O no hydrogen 3.177 N/A GLU 94.A N SER 91.A OG no hydrogen 3.335 N/A PHE 95.A N LEU 92.A O no hydrogen 3.178 N/A ASN 96.A ND2 GLU 94.A O no hydrogen 3.458 N/A TYR 99.A N PHE 86.A O no hydrogen 2.990 N/A LEU 100.A N LYS 49.A O no hydrogen 2.886 N/A VAL 101.A N ASP 84.A O no hydrogen 2.911 N/A THR 102.A N ALA 47.A O no hydrogen 2.991 N/A THR 102.A OG1 HIS 103.A O no hydrogen 2.859 N/A LEU 109.A N LEU 152.A O no hydrogen 2.845 N/A ASN 111.A N ASP 108.A O no hydrogen 3.218 N/A ASN 111.A N ASP 108.A OD1 no hydrogen 3.104 N/A VAL 113.A N LEU 109.A O no hydrogen 2.769 N/A LYS 114.A N ASN 110.A O no hydrogen 2.981 N/A CYS 115.A N ASN 111.A O no hydrogen 3.107 N/A CYS 115.A SG ASN 111.A O no hydrogen 3.048 N/A THR 119.A N HIS 122.A ND1 no hydrogen 3.242 N/A THR 119.A OG1 HIS 122.A ND1 no hydrogen 3.226 N/A HIS 122.A N THR 119.A OG1 no hydrogen 3.174 N/A VAL 123.A N THR 119.A O no hydrogen 3.120 N/A GLN 124.A N ASP 120.A O no hydrogen 2.876 N/A GLN 124.A NE2 GLN 303.A OE1 no hydrogen 2.991 N/A PHE 125.A N ASP 121.A O.A no hydrogen 3.185 N/A PHE 125.A N ASP 121.A O.B no hydrogen 3.139 N/A LEU 126.A N HIS 122.A O no hydrogen 2.989 N/A ILE 127.A N VAL 123.A O no hydrogen 2.971 N/A TYR 128.A N GLN 124.A O no hydrogen 2.928 N/A TYR 128.A OH GLU 310.A OE2 no hydrogen 2.704 N/A GLN 129.A N PHE 125.A O no hydrogen 3.112 N/A GLN 129.A NE2 PHE 125.A O no hydrogen 3.181 N/A GLN 129.A NE2 CYS 158.A O no hydrogen 2.923 N/A ILE 130.A N LEU 126.A O no hydrogen 3.126 N/A LEU 131.A N ILE 127.A O no hydrogen 2.971 N/A ARG 132.A N TYR 128.A O no hydrogen 2.937 N/A ARG 132.A NE ASP 309.A O no hydrogen 2.849 N/A ARG 132.A NH1 GLU 77.A OE1 no hydrogen 2.911 N/A ARG 132.A NH1 ASN 78.A OD1 no hydrogen 2.996 N/A ARG 132.A NH2 GLU 77.A OE1 no hydrogen 3.359 N/A ARG 132.A NH2 ASP 309.A O no hydrogen 3.039 N/A ARG 132.A NH2 ASP 309.A OD1 no hydrogen 3.226 N/A GLY 133.A N GLN 129.A O no hydrogen 3.061 N/A LEU 134.A N ILE 130.A O no hydrogen 2.896 N/A LYS 135.A N LEU 131.A O no hydrogen 2.855 N/A LYS 135.A NZ GLU 310.A O no hydrogen 2.874 N/A TYR 136.A N ARG 132.A O no hydrogen 3.361 N/A TYR 136.A OH HIS 73.A O no hydrogen 3.263 N/A ILE 137.A N GLY 133.A O no hydrogen 3.007 N/A HIS 138.A N LEU 134.A O no hydrogen 2.822 N/A HIS 138.A NE2 ASP 198.A OD2 no hydrogen 2.870 N/A SER 139.A N LYS 135.A O no hydrogen 3.076 N/A SER 139.A N TYR 136.A O no hydrogen 3.214 N/A SER 139.A OG TYR 136.A O no hydrogen 2.627 N/A ALA 140.A N ILE 137.A O no hydrogen 3.180 N/A ASP 141.A N HIS 138.A O no hydrogen 2.937 N/A ILE 142.A N ILE 137.A O no hydrogen 3.343 N/A HIS 144.A N ASP 198.A OD2 no hydrogen 2.925 N/A HIS 144.A NE2 LEU 163.A O no hydrogen 2.635 N/A ARG 145.A N.A ASP 198.A OD1 no hydrogen 2.949 N/A ARG 145.A N.B ASP 198.A OD1 no hydrogen 2.913 N/A ARG 145.A NE.A ILE 143.A O no hydrogen 2.893 N/A ASP 146.A N HIS 144.A ND1 no hydrogen 3.108 N/A ASN 151.A N LYS 148.A O no hydrogen 2.993 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 2.888 N/A ASN 151.A ND2 ASP 146.A OD2 no hydrogen 3.286 N/A LEU 152.A N PRO 149.A O no hydrogen 3.179 N/A ALA 153.A N LYS 161.A O no hydrogen 2.921 N/A VAL 154.A N ALA 107.A O no hydrogen 2.888 N/A ASN 155.A N GLU 159.A O no hydrogen 3.118 N/A ASN 155.A ND2 GLU 159.A OE2 no hydrogen 3.394 N/A CYS 158.A N ASN 155.A O no hydrogen 2.664 N/A LEU 160.A N GLN 129.A OE1 no hydrogen 2.940 N/A LYS 161.A N ALA 153.A O no hydrogen 2.942 N/A LYS 161.A NZ GLU 77.A O no hydrogen 3.376 N/A ILE 162.A N ASN 78.A O no hydrogen 3.068 N/A LEU 163.A N ASN 151.A O no hydrogen 2.860 N/A THR 168.A N GLU 171.A OE1 no hydrogen 2.707 N/A GLU 171.A N THR 168.A O no hydrogen 3.042 N/A MET 172.A N ASP 169.A O no hydrogen 3.071 N/A THR 173.A N ASP 170.A O no hydrogen 3.297 N/A THR 173.A OG1 ASP 169.A O no hydrogen 2.841 N/A VAL 176.A N GLY 174.A O no hydrogen 3.073 N/A THR 178.A OG1 GLU 171.A O no hydrogen 2.629 N/A ARG 179.A N VAL 176.A O no hydrogen 3.111 N/A ARG 179.A NE GLN 224.A OE1 no hydrogen 2.917 N/A ARG 179.A NH1 MET 172.A O no hydrogen 2.909 N/A ARG 179.A NH1 GLY 174.A O no hydrogen 2.808 N/A ARG 179.A NH2 GLY 174.A O no hydrogen 3.079 N/A ARG 179.A NH2 GLY 218.A O no hydrogen 3.095 N/A ARG 179.A NH2 GLN 224.A OE1 no hydrogen 3.043 N/A TRP 180.A NE1 GLY 218.A O no hydrogen 3.130 N/A TYR 181.A OH GLU 208.A OE1 no hydrogen 2.622 N/A TYR 181.A OH GLU 208.A OE2 no hydrogen 3.429 N/A ARG 182.A N ARG 179.A O no hydrogen 3.101 N/A ARG 182.A NH1 ASP 146.A OD1 no hydrogen 2.968 N/A ARG 182.A NH1 THR 178.A O no hydrogen 3.143 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.855 N/A ILE 186.A N ALA 183.A O no hydrogen 3.163 N/A MET 187.A N ALA 183.A O no hydrogen 3.027 N/A LEU 188.A N PRO 184.A O no hydrogen 3.034 N/A ASN 189.A N ILE 186.A O no hydrogen 3.334 N/A TRP 190.A N GLU 185.A O no hydrogen 2.918 N/A VAL 197.A N ASN 194.A O no hydrogen 3.108 N/A ASP 198.A N GLN 195.A O no hydrogen 3.099 N/A ILE 199.A N THR 196.A O no hydrogen 3.142 N/A TRP 200.A N THR 196.A O no hydrogen 3.475 N/A SER 201.A N VAL 197.A O no hydrogen 3.445 N/A SER 201.A OG TYR 181.A O no hydrogen 2.812 N/A SER 201.A OG VAL 197.A O no hydrogen 3.450 N/A VAL 202.A N ASP 198.A O no hydrogen 3.086 N/A GLY 203.A N ILE 199.A O no hydrogen 3.035 N/A CYS 204.A N TRP 200.A O no hydrogen 3.076 N/A CYS 204.A SG TRP 200.A O no hydrogen 3.598 N/A ILE 205.A N SER 201.A O no hydrogen 2.994 N/A MET 206.A N VAL 202.A O no hydrogen 2.838 N/A ALA 207.A N GLY 203.A O no hydrogen 3.001 N/A GLU 208.A N CYS 204.A O no hydrogen 3.274 N/A LEU 209.A N ILE 205.A O no hydrogen 3.011 N/A LEU 210.A N MET 206.A O no hydrogen 3.015 N/A THR 211.A N ALA 207.A O no hydrogen 2.969 N/A THR 211.A OG1 ALA 207.A O no hydrogen 3.162 N/A GLY 212.A N GLU 208.A O no hydrogen 2.805 N/A ARG 213.A N THR 211.A OG1 no hydrogen 3.101 N/A GLY 218.A N PHE 216.A O no hydrogen 2.814 N/A THR 219.A N ASP 223.A OD2 no hydrogen 2.917 N/A ASP 223.A N ASP 220.A OD1 no hydrogen 2.952 N/A GLN 224.A N ASP 220.A O no hydrogen 2.953 N/A GLN 224.A NE2 ARG 179.A O no hydrogen 3.005 N/A LEU 225.A N HIS 221.A O no hydrogen 3.006 N/A LYS 226.A N ILE 222.A O no hydrogen 3.023 N/A LEU 227.A N ASP 223.A O no hydrogen 3.019 N/A ILE 228.A N GLN 224.A O no hydrogen 2.924 N/A LEU 229.A N LEU 225.A O no hydrogen 2.834 N/A ARG 230.A N LYS 226.A O no hydrogen 3.074 N/A VAL 232.A N ILE 228.A O no hydrogen 3.021 N/A GLY 233.A N LEU 229.A O no hydrogen 2.872 N/A THR 234.A N MET 258.A O no hydrogen 3.089 N/A THR 234.A OG1 MET 258.A O no hydrogen 3.314 N/A LEU 240.A N GLY 236.A O no hydrogen 3.072 N/A LYS 241.A N ALA 237.A O no hydrogen 3.028 N/A LYS 242.A N LEU 239.A O no hydrogen 2.874 N/A LYS 242.A NZ ASP 285.A OD1 no hydrogen 3.423 N/A LYS 242.A NZ ASP 285.A OD2 no hydrogen 2.818 N/A LYS 242.A NZ ASP 287.A OD2 no hydrogen 2.804 N/A ILE 243.A N LEU 240.A O no hydrogen 3.257 N/A SER 244.A N TRP 190.A O no hydrogen 3.231 N/A SER 244.A OG TRP 190.A O no hydrogen 3.541 N/A ALA 248.A N SER 245.A OG no hydrogen 3.235 N/A ARG 249.A N SER 245.A O no hydrogen 3.042 N/A ARG 249.A NH1 ILE 243.A O no hydrogen 2.890 N/A ASN 250.A N GLU 246.A O no hydrogen 2.943 N/A TYR 251.A N SER 247.A O no hydrogen 3.010 N/A ILE 252.A N ALA 248.A O no hydrogen 3.069 N/A GLN 253.A N ARG 249.A O no hydrogen 3.157 N/A SER 254.A N TYR 251.A O no hydrogen 2.962 N/A SER 254.A OG TYR 251.A O no hydrogen 2.718 N/A LEU 255.A N ILE 252.A O no hydrogen 3.151 N/A MET 258.A N THR 234.A OG1 no hydrogen 2.999 N/A LYS 260.A NZ MET 261.A O no hydrogen 2.732 N/A LYS 260.A NZ GLU 279.A OE2 no hydrogen 3.231 N/A MET 261.A N LEU 231.A O no hydrogen 2.909 N/A ASN 265.A N ASN 262.A O no hydrogen 3.123 N/A VAL 266.A N PHE 263.A O no hydrogen 3.170 N/A PHE 267.A N PHE 263.A O no hydrogen 2.908 N/A ALA 270.A N PHE 267.A O no hydrogen 3.166 N/A ASN 271.A ND2 ASP 120.A OD2 no hydrogen 2.910 N/A LEU 273.A N ASN 271.A OD1 no hydrogen 2.902 N/A VAL 275.A N ASN 271.A O no hydrogen 3.154 N/A ASP 276.A N PRO 272.A O no hydrogen 3.058 N/A LEU 277.A N LEU 273.A O no hydrogen 3.067 N/A LEU 278.A N ALA 274.A O no hydrogen 2.911 N/A GLU 279.A N VAL 275.A O no hydrogen 3.052 N/A LYS 280.A N ASP 276.A O no hydrogen 3.269 N/A LYS 280.A N LEU 277.A O no hydrogen 2.999 N/A LYS 280.A NZ ASP 276.A OD2 no hydrogen 3.004 N/A MET 281.A N.A LEU 277.A O no hydrogen 3.044 N/A MET 281.A N.A LEU 278.A O no hydrogen 3.240 N/A MET 281.A N.B LEU 277.A O no hydrogen 3.044 N/A MET 281.A N.B LEU 278.A O no hydrogen 3.223 N/A LEU 282.A N LEU 278.A O no hydrogen 2.940 N/A VAL 283.A N MET 281.A O.A no hydrogen 2.999 N/A ASP 287.A N ASP 285.A OD1 no hydrogen 3.119 N/A LYS 288.A N ASP 285.A O no hydrogen 3.015 N/A LYS 288.A NZ GLU 238.A OE1 no hydrogen 3.471 N/A LYS 288.A NZ GLU 238.A OE2 no hydrogen 2.813 N/A ARG 289.A N SER 286.A O no hydrogen 3.396 N/A ARG 289.A NE VAL 283.A O no hydrogen 2.844 N/A ARG 289.A NH1 GLU 185.A OE2 no hydrogen 2.938 N/A ARG 289.A NH1 THR 196.A O no hydrogen 3.167 N/A ARG 289.A NH2 GLU 185.A OE1 no hydrogen 3.003 N/A ARG 289.A NH2 GLU 185.A OE2 no hydrogen 3.476 N/A ARG 289.A NH2 VAL 283.A O no hydrogen 3.301 N/A ARG 289.A NH2 LEU 284.A O no hydrogen 3.062 N/A ILE 290.A N LYS 280.A O no hydrogen 3.095 N/A THR 291.A N GLN 294.A OE1 no hydrogen 3.023 N/A GLN 294.A N THR 291.A OG1 no hydrogen 3.128 N/A ALA 295.A N THR 291.A O no hydrogen 2.866 N/A LEU 296.A N ALA 292.A O no hydrogen 3.093 N/A ALA 297.A N GLN 294.A O no hydrogen 3.170 N/A HIS 298.A N ALA 295.A O no hydrogen 3.046 N/A HIS 298.A NE2 ASP 276.A OD2 no hydrogen 2.797 N/A TYR 300.A N HIS 298.A ND1 no hydrogen 3.058 N/A TYR 300.A OH ASP 120.A OD1 no hydrogen 2.680 N/A PHE 301.A N HIS 298.A O no hydrogen 3.038 N/A ALA 302.A N ALA 299.A O no hydrogen 3.148 N/A TYR 304.A N PHE 301.A O no hydrogen 2.854 N/A TYR 304.A OH ASP 121.A OD1.B no hydrogen 3.093 N/A HIS 305.A N PHE 301.A O no hydrogen 2.954 N/A ASP 306.A N GLU 310.A OE2 no hydrogen 3.129 N/A ASP 308.A N ASP 306.A OD1 no hydrogen 3.017 N/A ASP 309.A N ASP 306.A O no hydrogen 2.932 N/A ALA 313.A N SER 139.A OG no hydrogen 2.863 N/A GLN 318.A NE2 ASP 141.A O no hydrogen 2.772 N/A SER 319.A N ASP 317.A OD1 no hydrogen 2.942 N/A SER 319.A OG ASP 317.A OD1 no hydrogen 2.761 N/A GLU 321.A N GLN 318.A O no hydrogen 2.986 N/A SER 322.A N SER 319.A O no hydrogen 3.251 N/A SER 322.A OG SER 319.A O no hydrogen 3.304 N/A ARG 323.A N PHE 320.A O no hydrogen 3.055 N/A LEU 326.A N GLU 329.A OE1 no hydrogen 2.957 N/A GLU 329.A N LEU 326.A O no hydrogen 2.950 N/A TRP 330.A N LEU 326.A O no hydrogen 3.153 N/A LYS 331.A N ILE 327.A O no hydrogen 2.889 N/A LYS 331.A NZ PHE 95.A O no hydrogen 2.765 N/A SER 332.A N ASP 328.A O no hydrogen 3.016 N/A LEU 333.A N GLU 329.A O no hydrogen 3.036 N/A THR 334.A N TRP 330.A O no hydrogen 2.956 N/A THR 334.A OG1 TRP 330.A O no hydrogen 2.992 N/A TYR 335.A N LYS 331.A O no hydrogen 2.947 N/A ASP 336.A N SER 332.A O no hydrogen 3.099 N/A GLU 337.A N LEU 333.A O no hydrogen 3.282 N/A VAL 338.A N THR 334.A O no hydrogen 2.977 N/A ILE 339.A N TYR 335.A O no hydrogen 3.016 N/A SER 340.A N ASP 336.A O no hydrogen 3.165 N/A SER 340.A OG ASP 336.A O no hydrogen 2.911 N/A SER 340.A OG GLU 337.A O no hydrogen 3.440 N/A PHE 341.A N VAL 338.A O no hydrogen 3.384 N/A