Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6iqv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG GLU 32.A OE2 no hydrogen 2.626 N/A VAL 3.A N ASP 30.A O no hydrogen 3.292 N/A LYS 4.A N ASP 96.A OD2 no hydrogen 2.905 N/A LYS 4.A NZ SER 2.A O no hydrogen 3.158 N/A LYS 4.A NZ SER 2.A OG no hydrogen 3.279 N/A ILE 5.A N GLU 32.A O no hydrogen 2.880 N/A GLY 6.A N PHE 97.A O no hydrogen 2.978 N/A ILE 7.A N ALA 35.A O no hydrogen 2.929 N/A ASN 8.A N LEU 99.A O no hydrogen 2.852 N/A ASN 8.A ND2 GLU 100.A OE1 no hydrogen 2.756 N/A GLY 9.A N ASN 37.A O no hydrogen 2.881 N/A PHE 10.A N ASP 38.A OD2 no hydrogen 2.814 N/A ARG 12.A NE GLU 323.A OE2 no hydrogen 3.012 N/A ARG 12.A NH1 ASP 52.A OD2 no hydrogen 2.892 N/A ARG 12.A NH2 ASP 52.A OD1 no hydrogen 3.063 N/A ARG 12.A NH2 ASP 52.A OD2 no hydrogen 3.047 N/A ARG 12.A NH2 GLU 323.A OE1 no hydrogen 3.130 N/A ARG 15.A N GLY 11.A O no hydrogen 2.843 N/A ARG 15.A NH1 PHE 10.A O no hydrogen 3.127 N/A LEU 16.A N ARG 12.A O no hydrogen 3.243 N/A ALA 17.A N ILE 13.A O no hydrogen 2.902 N/A PHE 18.A N GLY 14.A O no hydrogen 2.971 N/A ARG 19.A N ARG 15.A O no hydrogen 2.960 N/A ARG 19.A NE LEU 49.A O no hydrogen 3.217 N/A ARG 19.A NH1 HIS 55.A O no hydrogen 3.377 N/A ARG 19.A NH1 GLY 56.A O no hydrogen 3.209 N/A ARG 19.A NH2 LEU 49.A O no hydrogen 2.896 N/A ARG 19.A NH2 GLY 56.A O no hydrogen 2.941 N/A ARG 20.A N LEU 16.A O no hydrogen 2.870 N/A ARG 20.A NH1 GLU 23.A OE2 no hydrogen 3.270 N/A ILE 21.A N ALA 17.A O no hydrogen 2.942 N/A LEU 22.A N PHE 18.A O no hydrogen 2.907 N/A GLU 23.A N ARG 19.A O no hydrogen 2.997 N/A LEU 24.A N ARG 20.A O no hydrogen 2.924 N/A GLY 25.A N ILE 21.A O no hydrogen 2.957 N/A GLU 26.A N GLU 23.A O no hydrogen 3.118 N/A LYS 27.A N LEU 24.A O no hydrogen 3.343 N/A SER 28.A OG ASP 30.A OD1 no hydrogen 2.368 N/A SER 29.A N LEU 24.A O no hydrogen 3.271 N/A ASP 30.A N SER 28.A OG no hydrogen 2.849 N/A GLU 32.A N VAL 3.A O no hydrogen 2.867 N/A VAL 34.A N ILE 5.A O no hydrogen 3.032 N/A ILE 36.A N ARG 77.A O no hydrogen 2.993 N/A ASN 37.A N ILE 7.A O no hydrogen 2.935 N/A ASN 37.A ND2 ASN 8.A OD1 no hydrogen 2.592 N/A ASN 37.A ND2 GLU 81.A O no hydrogen 3.284 N/A ASP 38.A N TYR 79.A O no hydrogen 2.922 N/A THR 40.A N ASP 38.A OD1 no hydrogen 2.982 N/A THR 40.A OG1 ASP 38.A OD1 no hydrogen 3.182 N/A LEU 44.A N SER 41.A O no hydrogen 3.119 N/A LEU 45.A N SER 41.A O no hydrogen 3.112 N/A ALA 46.A N PRO 42.A O no hydrogen 2.870 N/A HIS 47.A N ALA 43.A O no hydrogen 3.202 N/A LEU 48.A N LEU 44.A O no hydrogen 2.913 N/A LEU 49.A N LEU 45.A O no hydrogen 2.860 N/A LYS 50.A N ALA 46.A O no hydrogen 3.186 N/A LYS 50.A NZ LEU 58.A O no hydrogen 2.969 N/A LYS 50.A NZ ALA 60.A O no hydrogen 3.050 N/A TYR 51.A N HIS 47.A O no hydrogen 3.150 N/A THR 54.A N ASP 52.A OD1 no hydrogen 2.866 N/A HIS 55.A N ASP 52.A OD1 no hydrogen 2.912 N/A HIS 55.A NE2 GLU 323.A OE1 no hydrogen 2.866 N/A GLY 56.A N ASP 52.A O no hydrogen 2.934 N/A LEU 58.A N LYS 50.A O no hydrogen 2.867 N/A ALA 60.A N LEU 58.A O no hydrogen 2.939 N/A ASP 61.A N ASN 72.A OD1 no hydrogen 2.911 N/A SER 63.A N VAL 70.A O no hydrogen 2.973 N/A THR 65.A N SER 68.A O no hydrogen 3.019 N/A THR 65.A OG1 ASP 67.A OD1 no hydrogen 3.478 N/A THR 65.A OG1 SER 68.A OG no hydrogen 2.659 N/A ASP 67.A N THR 65.A OG1 no hydrogen 3.172 N/A SER 68.A OG THR 65.A OG1 no hydrogen 2.659 N/A SER 68.A OG ASN 75.A OD1 no hydrogen 2.785 N/A ILE 69.A N TYR 76.A O no hydrogen 2.975 N/A VAL 70.A N SER 63.A O no hydrogen 2.652 N/A VAL 71.A N LYS 74.A O no hydrogen 3.085 N/A ASN 72.A N ASP 61.A O no hydrogen 2.859 N/A LYS 74.A N VAL 71.A O no hydrogen 2.916 N/A LYS 74.A NZ ASN 75.A O no hydrogen 2.975 N/A TYR 76.A N ILE 69.A O no hydrogen 2.964 N/A ARG 77.A NH1 ASP 67.A O no hydrogen 3.207 N/A VAL 78.A N ASP 67.A O no hydrogen 2.919 N/A TYR 79.A N ILE 36.A O no hydrogen 2.879 N/A TYR 79.A OH ASP 93.A OD2 no hydrogen 2.575 N/A GLU 81.A N ASN 37.A OD1 no hydrogen 3.035 N/A ALA 84.A N TYR 105.A OH no hydrogen 2.937 N/A GLN 85.A N GLN 85.A OE1 no hydrogen 2.861 N/A ASN 86.A N GLN 83.A O no hydrogen 3.036 N/A ILE 87.A N ALA 84.A O no hydrogen 3.254 N/A ASN 92.A N PRO 88.A O no hydrogen 2.964 N/A ASN 92.A ND2 TYR 79.A OH no hydrogen 2.958 N/A ASP 93.A N TRP 89.A O no hydrogen 2.940 N/A GLY 94.A N VAL 90.A O no hydrogen 2.960 N/A VAL 95.A N TRP 89.A O no hydrogen 3.233 N/A ASP 96.A N LYS 4.A O no hydrogen 2.723 N/A PHE 97.A N LYS 4.A O no hydrogen 3.197 N/A VAL 98.A N ARG 121.A O no hydrogen 2.988 N/A LEU 99.A N GLY 6.A O no hydrogen 2.816 N/A GLU 100.A N LEU 123.A O no hydrogen 3.011 N/A CYS 101.A N ASN 8.A O no hydrogen 3.153 N/A CYS 101.A SG SER 125.A OG no hydrogen 2.913 N/A THR 102.A N GLU 100.A OE2 no hydrogen 3.050 N/A THR 102.A OG1 GLU 100.A OE2 no hydrogen 2.677 N/A PHE 104.A N THR 102.A OG1 no hydrogen 2.955 N/A TYR 105.A OH PRO 82.A O no hydrogen 3.334 N/A SER 107.A N TYR 105.A O no hydrogen 2.947 N/A LYS 110.A N SER 107.A OG no hydrogen 2.929 N/A SER 111.A N SER 107.A O no hydrogen 3.041 N/A SER 111.A OG TYR 105.A O no hydrogen 2.889 N/A GLN 112.A NE2 ASP 116.A OD1 no hydrogen 3.141 N/A ALA 113.A N LYS 110.A O no hydrogen 3.330 N/A HIS 114.A N SER 111.A O no hydrogen 3.046 N/A HIS 114.A NE2 GLU 100.A OE1 no hydrogen 2.767 N/A ASP 116.A N GLN 112.A O no hydrogen 2.920 N/A ALA 117.A N ALA 113.A O no hydrogen 3.074 N/A GLY 118.A N LEU 115.A O no hydrogen 2.669 N/A ALA 119.A N HIS 114.A O no hydrogen 3.016 N/A LYS 120.A N ASP 96.A O no hydrogen 2.887 N/A LYS 120.A NZ ASP 96.A OD1 no hydrogen 3.361 N/A ARG 121.A NH1 ALA 146.A O no hydrogen 3.090 N/A ARG 121.A NH1 ASP 148.A O no hydrogen 3.007 N/A VAL 122.A N ARG 149.A O no hydrogen 2.635 N/A LEU 123.A N VAL 98.A O no hydrogen 3.069 N/A ILE 124.A N VAL 151.A O no hydrogen 2.748 N/A SER 125.A N GLU 100.A O no hydrogen 3.108 N/A SER 125.A OG GLU 100.A O no hydrogen 3.295 N/A LYS 133.A NZ ILE 143.A O no hydrogen 2.677 N/A LYS 133.A NZ ASP 148.A OD2 no hydrogen 2.873 N/A ILE 135.A N SER 152.A O no hydrogen 2.813 N/A VAL 136.A N ASN 140.A OD1 no hydrogen 2.877 N/A ASN 138.A N ASP 141.A OD1 no hydrogen 2.851 N/A ASN 138.A ND2 GLU 275.A OE1 no hydrogen 3.180 N/A VAL 139.A N VAL 136.A O no hydrogen 3.024 N/A ASN 140.A N VAL 136.A O no hydrogen 3.253 N/A ASN 140.A ND2 THR 134.A O no hydrogen 2.914 N/A ILE 143.A N ASN 140.A O no hydrogen 3.114 N/A LEU 144.A N ASP 141.A O no hydrogen 3.152 N/A THR 145.A N ASP 148.A OD2 no hydrogen 2.900 N/A THR 145.A OG1 ASP 148.A OD2 no hydrogen 3.338 N/A ASP 147.A N THR 145.A OG1 no hydrogen 3.409 N/A ASP 148.A N THR 145.A O no hydrogen 3.379 N/A ARG 149.A NE LYS 120.A O no hydrogen 2.882 N/A VAL 151.A N VAL 122.A O no hydrogen 2.834 N/A SER 152.A N LYS 133.A O no hydrogen 2.971 N/A SER 152.A OG ALA 126.A O no hydrogen 2.610 N/A ALA 153.A N ILE 124.A O no hydrogen 2.998 N/A GLY 154.A N SER 152.A OG no hydrogen 3.052 N/A SER 155.A OG THR 158.A OG1 no hydrogen 3.313 N/A CYS 156.A SG HIS 183.A NE2 no hydrogen 3.802 N/A THR 157.A OG1 TYR 320.A OH no hydrogen 3.348 N/A THR 158.A N SER 155.A OG no hydrogen 3.380 N/A THR 158.A OG1 SER 155.A OG no hydrogen 3.313 N/A ASN 159.A N SER 155.A O no hydrogen 3.220 N/A ASN 159.A ND2 ALA 153.A O no hydrogen 2.896 N/A ASN 159.A ND2 SER 155.A O no hydrogen 3.168 N/A CYS 160.A N CYS 156.A O no hydrogen 3.319 N/A CYS 160.A N THR 157.A O no hydrogen 3.084 N/A CYS 160.A SG THR 248.A OG1 no hydrogen 3.689 N/A CYS 160.A SG ALA 318.A O no hydrogen 3.733 N/A LEU 161.A N THR 157.A O no hydrogen 2.914 N/A ALA 162.A N THR 158.A O no hydrogen 2.963 N/A ALA 165.A N LEU 161.A O no hydrogen 2.954 N/A PHE 166.A N ALA 162.A O no hydrogen 2.760 N/A PHE 167.A N PRO 163.A O no hydrogen 2.922 N/A GLU 168.A N LEU 164.A O no hydrogen 2.961 N/A ASN 169.A N ALA 165.A O no hydrogen 2.923 N/A LYS 170.A N PHE 166.A O no hydrogen 2.985 N/A GLU 171.A N PHE 167.A O no hydrogen 3.079 N/A PHE 172.A N GLU 168.A O no hydrogen 3.024 N/A GLY 173.A N ASN 169.A O no hydrogen 2.750 N/A ILE 174.A N ASN 169.A OD1 no hydrogen 2.740 N/A LYS 175.A N ILE 253.A O no hydrogen 2.931 N/A GLY 177.A N LYS 232.A O no hydrogen 3.032 N/A THR 178.A N VAL 251.A O no hydrogen 2.946 N/A THR 178.A OG1 GLN 234.A O no hydrogen 3.471 N/A MET 179.A N GLN 234.A O no hydrogen 3.076 N/A THR 180.A N GLU 249.A O no hydrogen 3.012 N/A THR 181.A N HIS 236.A O no hydrogen 3.056 N/A THR 181.A OG1 LEU 247.A O no hydrogen 3.125 N/A THR 181.A OG1 TYR 320.A OH no hydrogen 3.296 N/A ILE 182.A N LEU 247.A O no hydrogen 2.845 N/A HIS 183.A N GLN 238.A O no hydrogen 2.835 N/A HIS 183.A ND1 ALA 184.A O no hydrogen 2.610 N/A ALA 184.A N SER 246.A OG no hydrogen 3.110 N/A TYR 185.A N VAL 242.A O no hydrogen 3.139 N/A THR 186.A N GLN 189.A OE1 no hydrogen 3.086 N/A THR 186.A OG1 THR 188.A OG1 no hydrogen 3.166 N/A THR 188.A OG1 THR 186.A OG1 no hydrogen 3.166 N/A GLN 189.A N THR 186.A O no hydrogen 3.072 N/A GLY 194.A N ALA 204.A O no hydrogen 2.940 N/A GLY 199.A N VAL 196.A O no hydrogen 2.891 N/A ARG 202.A N ASN 200.A OD1 no hydrogen 2.870 N/A ALA 203.A N ASN 200.A OD1 no hydrogen 2.889 N/A ALA 204.A N ASN 200.A O no hydrogen 3.293 N/A ARG 205.A N ARG 202.A O no hydrogen 3.062 N/A ARG 205.A NE ASP 193.A OD1 no hydrogen 3.005 N/A ALA 206.A N ASP 193.A OD1 no hydrogen 2.920 N/A ALA 207.A N MET 190.A O no hydrogen 3.000 N/A ASN 210.A ND2 ALA 206.A O no hydrogen 2.875 N/A ILE 212.A N ARG 239.A O no hydrogen 2.982 N/A HIS 214.A N ALA 237.A O no hydrogen 2.802 N/A ALA 221.A N GLY 217.A O no hydrogen 3.213 N/A LEU 222.A N ALA 219.A O no hydrogen 3.277 N/A LEU 224.A N ALA 221.A O no hydrogen 3.054 N/A VAL 225.A N LEU 222.A O no hydrogen 2.924 N/A ILE 226.A N LEU 222.A O no hydrogen 2.861 N/A LEU 229.A N ILE 226.A O no hydrogen 2.991 N/A ASN 230.A N PRO 227.A O no hydrogen 3.148 N/A LYS 232.A N LEU 229.A O no hydrogen 2.910 N/A LYS 232.A NZ GLU 228.A O no hydrogen 3.224 N/A GLN 234.A N GLY 177.A O no hydrogen 3.163 N/A HIS 236.A N MET 179.A O no hydrogen 3.175 N/A ALA 237.A N HIS 214.A O no hydrogen 2.882 N/A GLN 238.A N THR 181.A O no hydrogen 2.859 N/A ARG 239.A N ILE 212.A O no hydrogen 2.877 N/A ARG 239.A NH1 GLN 189.A OE1 no hydrogen 2.981 N/A VAL 240.A N HIS 183.A O no hydrogen 2.790 N/A VAL 242.A N VAL 240.A O no hydrogen 2.987 N/A GLY 245.A N ASN 322.A OD1 no hydrogen 3.174 N/A SER 246.A N TYR 320.A O no hydrogen 2.996 N/A SER 246.A OG ASN 322.A OD1 no hydrogen 2.780 N/A LEU 247.A N ILE 182.A O no hydrogen 3.126 N/A THR 248.A N ALA 318.A O no hydrogen 2.916 N/A GLU 249.A N THR 180.A O no hydrogen 2.885 N/A LEU 250.A N THR 316.A O no hydrogen 2.807 N/A VAL 251.A N THR 178.A O no hydrogen 2.883 N/A ALA 252.A N VAL 314.A O no hydrogen 2.973 N/A ILE 253.A N VAL 176.A O no hydrogen 3.027 N/A ASP 255.A N PHE 172.A O no hydrogen 3.159 N/A ASP 255.A N GLY 173.A O no hydrogen 3.009 N/A THR 259.A N GLU 262.A OE2 no hydrogen 3.137 N/A GLU 262.A N THR 259.A OG1 no hydrogen 3.331 N/A VAL 263.A N THR 259.A O no hydrogen 3.061 N/A ASN 264.A N ALA 260.A O no hydrogen 2.915 N/A ASN 264.A ND2 PRO 300.A O no hydrogen 3.252 N/A ALA 265.A N ASP 261.A O no hydrogen 2.873 N/A ALA 266.A N GLU 262.A O no hydrogen 3.073 N/A ILE 267.A N VAL 263.A O no hydrogen 3.042 N/A LYS 268.A N ASN 264.A O no hydrogen 2.892 N/A LYS 269.A N ALA 265.A O no hydrogen 3.307 N/A HIS 270.A N ILE 267.A O no hydrogen 2.953 N/A HIS 270.A NE2 GLU 171.A OE2 no hydrogen 2.809 N/A THR 271.A N LYS 268.A O no hydrogen 3.001 N/A THR 271.A OG1 LYS 268.A O no hydrogen 2.828 N/A ASN 274.A N THR 271.A O no hydrogen 2.883 N/A ASN 274.A ND2 HIS 270.A O no hydrogen 3.036 N/A GLU 275.A N GLU 275.A OE1 no hydrogen 3.021 N/A SER 276.A N ASN 274.A OD1 no hydrogen 2.813 N/A SER 276.A OG TYR 137.A O no hydrogen 3.420 N/A SER 276.A OG GLN 329.A OE1 no hydrogen 2.487 N/A PHE 277.A N ASN 274.A OD1 no hydrogen 2.825 N/A GLY 278.A N SER 296.A O no hydrogen 2.721 N/A ASN 280.A N PHE 298.A O no hydrogen 3.168 N/A ASP 282.A N ASN 280.A OD1 no hydrogen 2.603 N/A VAL 285.A N ASP 288.A OD2 no hydrogen 2.948 N/A ASP 288.A N VAL 285.A O no hydrogen 3.063 N/A VAL 289.A N SER 286.A O no hydrogen 3.303 N/A ILE 290.A N SER 287.A O no hydrogen 3.145 N/A GLY 291.A N ASP 321.A OD2 no hydrogen 2.747 N/A THR 292.A N VAL 289.A O no hydrogen 3.172 N/A THR 292.A OG1 VAL 289.A O no hydrogen 2.832 N/A GLY 295.A N SER 276.A O no hydrogen 2.790 N/A SER 296.A N SER 276.A O no hydrogen 3.237 N/A SER 296.A OG CYS 160.A O no hydrogen 3.118 N/A ILE 297.A N TRP 319.A O no hydrogen 2.557 N/A PHE 298.A N GLY 278.A O no hydrogen 2.867 N/A ASP 299.A N VAL 317.A O no hydrogen 3.061 N/A THR 301.A N ASP 299.A OD1 no hydrogen 3.198 N/A THR 301.A OG1 ASP 299.A OD1 no hydrogen 2.977 N/A THR 301.A OG1 ASP 299.A OD2 no hydrogen 3.450 N/A GLN 302.A N ASP 299.A O no hydrogen 3.331 N/A GLN 302.A NE2 ASP 299.A OD2 no hydrogen 2.863 N/A THR 303.A N PRO 300.A O no hydrogen 3.307 N/A THR 303.A OG1 ASN 264.A OD1 no hydrogen 2.541 N/A THR 303.A OG1 PRO 300.A O no hydrogen 3.354 N/A GLU 304.A N LYS 315.A O no hydrogen 2.908 N/A THR 306.A N LEU 313.A O no hydrogen 2.912 N/A ASP 308.A N ASN 311.A O no hydrogen 3.245 N/A ASN 311.A N ASP 308.A O no hydrogen 3.493 N/A LEU 313.A N THR 306.A O no hydrogen 2.957 N/A VAL 314.A N ALA 252.A O no hydrogen 2.946 N/A LYS 315.A N GLU 304.A O no hydrogen 2.816 N/A THR 316.A N LEU 250.A O no hydrogen 3.057 N/A THR 316.A OG1 GLU 168.A OE1 no hydrogen 2.999 N/A ALA 318.A N THR 248.A O no hydrogen 3.123 N/A TRP 319.A N ILE 297.A O no hydrogen 2.778 N/A TRP 319.A NE1 ASP 299.A OD2 no hydrogen 2.971 N/A TYR 320.A N SER 246.A O no hydrogen 2.936 N/A TYR 320.A OH THR 157.A OG1 no hydrogen 3.348 N/A TYR 320.A OH THR 181.A OG1 no hydrogen 3.296 N/A GLU 323.A N ASP 321.A OD1 no hydrogen 2.994 N/A TYR 324.A N ASP 321.A OD1 no hydrogen 2.866 N/A GLY 325.A N ASP 321.A O no hydrogen 2.966 N/A THR 327.A N GLU 323.A O no hydrogen 3.128 N/A THR 327.A OG1 GLU 323.A O no hydrogen 3.031 N/A CYS 328.A N TYR 324.A O no hydrogen 3.046 N/A CYS 328.A SG TYR 324.A O no hydrogen 3.317 N/A GLN 329.A N GLY 325.A O no hydrogen 3.088 N/A GLN 329.A NE2 TYR 137.A O no hydrogen 2.897 N/A GLN 329.A NE2 ASN 159.A OD1 no hydrogen 3.254 N/A MET 330.A N PHE 326.A O no hydrogen 3.263 N/A VAL 331.A N THR 327.A O no hydrogen 3.040 N/A ARG 332.A N CYS 328.A O no hydrogen 3.099 N/A ARG 332.A NH1 THR 293.A O no hydrogen 3.090 N/A ARG 332.A NH1 GLN 329.A OE1 no hydrogen 3.149 N/A ARG 332.A NH2 THR 293.A O no hydrogen 3.092 N/A THR 333.A N GLN 329.A O no hydrogen 3.154 N/A LEU 334.A N MET 330.A O no hydrogen 3.048 N/A LEU 335.A N VAL 331.A O no hydrogen 3.115 N/A LYS 336.A N ARG 332.A O no hydrogen 3.140 N/A PHE 337.A N THR 333.A O no hydrogen 3.021 N/A PHE 337.A N LEU 334.A O no hydrogen 3.079 N/A ALA 338.A N LEU 335.A O no hydrogen 3.069 N/A THR 339.A N LYS 336.A O no hydrogen 3.078 N/A THR 339.A OG1 LYS 336.A O no hydrogen 2.959 N/A LEU 340.A N PHE 337.A O no hydrogen 3.203 N/A