Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hur_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 9.A N CYS 252.A O no hydrogen 2.983 N/A VAL 10.A N LYS 369.A O no hydrogen 3.023 N/A SER 11.A N SER 250.A O no hydrogen 2.718 N/A VAL 12.A N ILE 371.A O no hydrogen 2.830 N/A ASP 13.A N ILE 248.A O no hydrogen 2.937 N/A ALA 16.A N ASP 13.A OD1 no hydrogen 3.047 N/A ALA 17.A N ASP 13.A O no hydrogen 3.209 N/A ALA 18.A N LEU 14.A O no hydrogen 3.102 N/A HIS 19.A N ASP 15.A O no hydrogen 2.878 N/A ASN 20.A N ALA 16.A O no hydrogen 2.918 N/A ASN 20.A ND2 ILE 227.A O no hydrogen 2.869 N/A ASN 20.A ND2 GLU 246.A O no hydrogen 2.939 N/A LEU 21.A N ALA 17.A O no hydrogen 3.232 N/A GLN 22.A N ALA 18.A O no hydrogen 2.922 N/A GLU 23.A N HIS 19.A O no hydrogen 2.865 N/A ILE 24.A N ASN 20.A O no hydrogen 3.166 N/A ARG 25.A N LEU 21.A O no hydrogen 3.116 N/A ARG 25.A NH1 SER 58.A O no hydrogen 3.054 N/A ARG 25.A NH2 LYS 31.A O no hydrogen 3.171 N/A ARG 25.A NH2 ASP 60.A OD1 no hydrogen 3.478 N/A GLU 26.A N GLN 22.A O no hydrogen 3.264 N/A TRP 27.A N GLU 23.A O no hydrogen 2.904 N/A TRP 27.A NE1 ILE 208.A O no hydrogen 2.872 N/A THR 28.A N ARG 25.A O no hydrogen 3.375 N/A THR 28.A OG1 ILE 24.A O no hydrogen 2.957 N/A ALA 30.A N ARG 25.A O no hydrogen 3.050 N/A LYS 31.A N ALA 219.A O no hydrogen 3.200 N/A LYS 32.A N ALA 219.A O no hydrogen 2.976 N/A VAL 33.A N ASP 60.A OD2 no hydrogen 2.577 N/A TYR 34.A N ILE 221.A O no hydrogen 2.910 N/A ALA 35.A N ALA 61.A O no hydrogen 2.948 N/A VAL 36.A N PRO 223.A O no hydrogen 2.860 N/A LEU 37.A N ILE 63.A O no hydrogen 2.831 N/A TYR 42.A N LYS 38.A O no hydrogen 2.723 N/A GLY 43.A N ALA 39.A O no hydrogen 2.680 N/A LEU 44.A N GLY 41.A O no hydrogen 2.957 N/A GLY 45.A N ASP 40.A O no hydrogen 2.773 N/A ALA 46.A N ASP 40.A OD2 no hydrogen 2.848 N/A LEU 49.A N GLY 45.A O no hydrogen 3.240 N/A ALA 50.A N ALA 46.A O no hydrogen 2.720 N/A LYS 51.A N ILE 47.A O no hydrogen 2.805 N/A LYS 51.A NZ ALA 76.A O no hydrogen 2.969 N/A ALA 52.A N PRO 48.A O no hydrogen 2.944 N/A PHE 53.A N LEU 49.A O no hydrogen 2.920 N/A GLN 54.A N ALA 50.A O no hydrogen 2.931 N/A GLN 54.A NE2 ASP 77.A O no hydrogen 3.601 N/A GLU 55.A N LYS 51.A O no hydrogen 3.137 N/A THR 56.A N ALA 52.A O no hydrogen 3.371 N/A THR 56.A OG1 ALA 52.A O no hydrogen 2.775 N/A THR 56.A OG1 PHE 53.A O no hydrogen 3.458 N/A THR 56.A OG1 SER 58.A OG no hydrogen 3.002 N/A ALA 57.A N GLN 54.A O no hydrogen 3.395 N/A SER 58.A N PHE 53.A O no hydrogen 3.093 N/A SER 58.A OG THR 56.A OG1 no hydrogen 3.002 N/A ASP 60.A N VAL 33.A O no hydrogen 2.657 N/A ALA 61.A N VAL 33.A O no hydrogen 3.425 N/A LEU 62.A N PRO 81.A O no hydrogen 3.034 N/A ILE 63.A N ALA 35.A O no hydrogen 2.846 N/A VAL 64.A N TRP 83.A O no hydrogen 3.022 N/A ALA 70.A N ASN 66.A O no hydrogen 3.314 N/A LEU 71.A N LEU 67.A O no hydrogen 2.989 N/A GLU 72.A N ASP 68.A O no hydrogen 3.027 N/A LEU 73.A N GLU 69.A O no hydrogen 3.012 N/A ARG 74.A N ALA 70.A O no hydrogen 2.964 N/A ARG 74.A NE HIS 99.A O no hydrogen 2.621 N/A ARG 74.A NH1 LEU 78.A O no hydrogen 2.753 N/A ARG 74.A NH1 LEU 80.A O no hydrogen 2.786 N/A ARG 74.A NH2 LEU 80.A O no hydrogen 2.884 N/A ARG 74.A NH2 HIS 99.A O no hydrogen 3.165 N/A ARG 74.A NH2 ASP 100.A O no hydrogen 2.970 N/A GLN 75.A N LEU 71.A O no hydrogen 2.952 N/A ALA 76.A N GLU 72.A O no hydrogen 3.019 N/A ALA 76.A N LEU 73.A O no hydrogen 2.974 N/A ASP 77.A N ARG 74.A O no hydrogen 2.913 N/A LEU 78.A N LEU 73.A O no hydrogen 3.222 N/A THR 79.A N GLN 54.A OE1 no hydrogen 2.470 N/A THR 79.A OG1 GLN 54.A OE1 no hydrogen 2.854 N/A LEU 80.A N GLN 54.A OE1 no hydrogen 3.113 N/A TRP 83.A N LEU 62.A O no hydrogen 2.966 N/A VAL 84.A N VAL 102.A O no hydrogen 3.105 N/A LEU 85.A N VAL 64.A O no hydrogen 2.988 N/A TYR 90.A OH TRP 110.A O no hydrogen 2.586 N/A ASP 92.A N ASP 89.A O no hydrogen 2.849 N/A LEU 93.A N TYR 90.A O no hydrogen 3.380 N/A PHE 96.A N ASP 92.A O no hydrogen 2.940 N/A ILE 97.A N LEU 93.A O no hydrogen 3.031 N/A ASP 98.A N LYS 94.A O no hydrogen 2.961 N/A HIS 99.A N LEU 95.A O no hydrogen 3.088 N/A ASP 100.A N ILE 97.A O no hydrogen 3.234 N/A ILE 101.A N PHE 96.A O no hydrogen 2.905 N/A VAL 102.A N ILE 82.A O no hydrogen 2.643 N/A ILE 103.A N LYS 122.A O no hydrogen 3.018 N/A THR 104.A OG1 TYR 161.A OH no hydrogen 2.689 N/A ILE 105.A N SER 124.A O no hydrogen 2.688 N/A TRP 110.A N SER 107.A OG no hydrogen 3.080 N/A TRP 110.A NE1 TRP 88.A O no hydrogen 2.865 N/A LEU 111.A N SER 107.A O no hydrogen 3.451 N/A GLN 112.A N LEU 108.A O no hydrogen 3.013 N/A ASN 113.A N ALA 109.A O no hydrogen 2.940 N/A ASN 113.A ND2 ALA 109.A O no hydrogen 2.827 N/A LEU 114.A N LEU 111.A O no hydrogen 3.381 N/A LEU 121.A N GLN 154.A O no hydrogen 2.844 N/A VAL 123.A N ASP 156.A O no hydrogen 2.957 N/A SER 124.A N ILE 103.A O no hydrogen 2.783 N/A LEU 125.A N SER 159.A O no hydrogen 2.858 N/A ILE 127.A N TYR 161.A O no hydrogen 2.726 N/A ASP 128.A N PHE 136.A O no hydrogen 2.910 N/A THR 129.A OG1 THR 162.A OG1 no hydrogen 3.226 N/A GLY 130.A N ASP 128.A OD1 no hydrogen 2.750 N/A THR 132.A N GLY 130.A O no hydrogen 2.981 N/A ARG 133.A NH1 ASN 351.A OD1 no hydrogen 3.415 N/A ARG 133.A NH1 TYR 352.A O no hydrogen 2.779 N/A ARG 133.A NH2 TYR 352.A O no hydrogen 3.240 N/A ARG 133.A NH2 SER 353.A O no hydrogen 2.895 N/A ILE 134.A N THR 132.A OG1 no hydrogen 2.903 N/A GLY 135.A N PRO 106.A O no hydrogen 2.855 N/A PHE 136.A N ALA 126.A O no hydrogen 2.905 N/A ILE 142.A N LYS 138.A O no hydrogen 3.227 N/A SER 143.A N ALA 139.A O no hydrogen 3.321 N/A SER 143.A OG ASP 140.A O no hydrogen 3.161 N/A ALA 144.A N ASP 140.A O no hydrogen 2.827 N/A ALA 145.A N GLU 141.A O no hydrogen 2.843 N/A LYS 146.A N ILE 142.A O no hydrogen 2.786 N/A LYS 146.A NZ ASP 150.A OD2 no hydrogen 2.881 N/A LYS 147.A N SER 143.A O no hydrogen 3.107 N/A ILE 148.A N ALA 144.A O no hydrogen 3.224 N/A ILE 149.A N ALA 145.A O no hydrogen 3.022 N/A ASP 150.A N LYS 146.A O no hydrogen 2.880 N/A LYS 151.A N LYS 147.A O no hydrogen 2.965 N/A ASN 152.A N ILE 148.A O no hydrogen 3.207 N/A ASN 152.A N ILE 149.A O no hydrogen 3.004 N/A GLN 154.A N ASN 152.A OD1 no hydrogen 2.705 N/A GLN 154.A NE2 PHE 117.A O no hydrogen 2.565 N/A GLN 154.A NE2 GLY 119.A O no hydrogen 2.755 N/A LEU 155.A N ASN 152.A O no hydrogen 3.216 N/A ASP 156.A N LEU 121.A O no hydrogen 2.896 N/A PHE 158.A N VAL 123.A O no hydrogen 2.760 N/A SER 159.A OG LEU 198.A O no hydrogen 3.163 N/A VAL 160.A N LEU 198.A O no hydrogen 2.877 N/A TYR 161.A N LEU 125.A O no hydrogen 2.858 N/A TYR 161.A OH THR 104.A OG1 no hydrogen 2.689 N/A THR 162.A N SER 200.A O no hydrogen 3.131 N/A THR 162.A OG1 ILE 127.A O no hydrogen 2.915 N/A THR 162.A OG1 THR 129.A OG1 no hydrogen 3.226 N/A ALA 165.A N GLN 181.A OE1 no hydrogen 2.967 N/A THR 166.A OG1 SER 174.A O no hydrogen 3.119 N/A GLU 169.A N THR 166.A O no hydrogen 3.391 N/A ALA 170.A N GLU 236.A OE2 no hydrogen 3.024 N/A SER 174.A OG THR 166.A O no hydrogen 3.272 N/A SER 174.A OG GLU 169.A O no hydrogen 3.443 N/A ALA 176.A N GLU 172.A O no hydrogen 3.162 N/A TYR 177.A N LYS 173.A O no hydrogen 3.346 N/A PHE 178.A N SER 174.A O no hydrogen 3.014 N/A GLU 179.A N LYS 175.A O no hydrogen 3.105 N/A GLU 180.A N ALA 176.A O no hydrogen 2.904 N/A GLN 181.A N TYR 177.A O no hydrogen 2.877 N/A GLN 181.A NE2 THR 129.A O no hydrogen 3.460 N/A GLN 181.A NE2 HIS 163.A O no hydrogen 3.679 N/A LEU 182.A N PHE 178.A O no hydrogen 2.995 N/A ARG 183.A N GLU 179.A O no hydrogen 2.811 N/A ARG 184.A N GLU 180.A O no hydrogen 2.980 N/A TRP 185.A N GLN 181.A O no hydrogen 2.881 N/A GLN 186.A N LEU 182.A O no hydrogen 3.175 N/A GLU 187.A N ARG 183.A O no hydrogen 2.743 N/A LEU 188.A N ARG 184.A O no hydrogen 2.789 N/A THR 189.A N GLN 186.A O no hydrogen 3.135 N/A THR 189.A OG1 TRP 185.A O no hydrogen 2.728 N/A ILE 190.A N GLN 186.A O no hydrogen 2.957 N/A GLN 192.A N THR 189.A O no hydrogen 3.291 N/A GLN 192.A NE2 ALA 139.A O no hydrogen 2.931 N/A GLN 192.A NE2 LEU 188.A O no hydrogen 3.275 N/A SER 197.A N ASP 195.A OD1 no hydrogen 2.922 N/A SER 197.A OG ASP 195.A OD1 no hydrogen 2.542 N/A LEU 198.A N ASP 195.A O no hydrogen 3.084 N/A PHE 199.A N PRO 196.A O no hydrogen 3.266 N/A SER 200.A N VAL 160.A O no hydrogen 2.951 N/A SER 200.A OG ALA 220.A O no hydrogen 2.496 N/A ASN 203.A ND2 PHE 164.A O no hydrogen 3.238 N/A THR 206.A N ASN 203.A OD1 no hydrogen 2.843 N/A THR 206.A OG1 ASN 203.A OD1 no hydrogen 2.786 N/A CYS 207.A N ASN 203.A O no hydrogen 2.907 N/A CYS 207.A SG ALA 202.A O no hydrogen 3.770 N/A CYS 207.A SG ASN 203.A O no hydrogen 3.260 N/A ILE 208.A N SER 204.A O no hydrogen 2.923 N/A TRP 209.A N ALA 205.A O no hydrogen 2.976 N/A TRP 209.A NE1 LYS 238.A O no hydrogen 2.909 N/A HIS 210.A N THR 206.A O no hydrogen 3.154 N/A HIS 211.A ND1 TRP 27.A O no hydrogen 2.708 N/A ASP 213.A N HIS 210.A O no hydrogen 3.418 N/A ARG 215.A N ASP 213.A OD1 no hydrogen 3.061 N/A ARG 215.A NE ASP 213.A OD1 no hydrogen 3.125 N/A ARG 215.A NH1 GLU 179.A OE2 no hydrogen 2.609 N/A ARG 215.A NH2 GLU 179.A OE1 no hydrogen 3.127 N/A ARG 215.A NH2 ASP 213.A OD2 no hydrogen 3.030 N/A ILE 216.A N ASP 213.A O no hydrogen 3.100 N/A ALA 219.A N SER 217.A OG no hydrogen 3.107 N/A ILE 221.A N LYS 32.A O no hydrogen 3.276 N/A ARG 222.A N ALA 202.A O no hydrogen 2.991 N/A ARG 222.A NE SER 200.A OG no hydrogen 2.845 N/A ARG 222.A NH1 THR 162.A O no hydrogen 3.533 N/A ARG 222.A NH2 THR 162.A O no hydrogen 2.562 N/A ARG 222.A NH2 SER 200.A O no hydrogen 2.883 N/A ARG 222.A NH2 SER 200.A OG no hydrogen 3.219 N/A GLY 224.A N SER 204.A OG no hydrogen 3.145 N/A GLN 225.A NE2 GLN 343.A OE1 no hydrogen 3.566 N/A LEU 226.A N SER 204.A OG no hydrogen 3.262 N/A ILE 227.A N GLY 224.A O no hydrogen 2.793 N/A SER 228.A N GLN 225.A O no hydrogen 3.442 N/A SER 228.A OG GLN 225.A O no hydrogen 3.236 N/A GLY 229.A N LEU 226.A O no hydrogen 3.066 N/A ASN 231.A N GLY 341.A O no hydrogen 3.089 N/A SER 233.A OG LEU 237.A O no hydrogen 3.156 N/A ASN 234.A ND2 ASN 234.A O no hydrogen 2.451 N/A GLU 236.A N SER 233.A O no hydrogen 3.294 N/A LEU 237.A N SER 233.A OG no hydrogen 3.047 N/A LEU 243.A N PRO 240.A O no hydrogen 3.041 N/A GLU 246.A N ASN 20.A OD1 no hydrogen 2.802 N/A ARG 247.A NH1 PHE 249.A O no hydrogen 2.992 N/A ILE 248.A N SER 228.A O no hydrogen 3.038 N/A SER 250.A N SER 11.A O no hydrogen 2.913 N/A CYS 252.A N TRP 9.A O no hydrogen 2.801 N/A SER 253.A N VAL 333.A O no hydrogen 2.827 N/A SER 253.A OG PRO 7.A O no hydrogen 2.611 N/A GLU 254.A N SER 253.A OG no hydrogen 2.667 N/A ILE 255.A N THR 331.A O no hydrogen 3.062 N/A ALA 256.A N THR 283.A O no hydrogen 2.996 N/A ARG 259.A N VAL 281.A O no hydrogen 2.978 N/A VAL 261.A N GLY 279.A O no hydrogen 3.353 N/A LYS 262.A N GLN 265.A OE1 no hydrogen 2.876 N/A GLN 265.A N LYS 262.A O no hydrogen 2.874 N/A ALA 271.A N SER 268.A O no hydrogen 3.065 N/A MET 275.A N GLN 265.A O no hydrogen 3.253 N/A VAL 281.A N ARG 259.A O no hydrogen 2.895 N/A ALA 282.A N VAL 321.A O no hydrogen 2.794 N/A THR 283.A N ASP 257.A O no hydrogen 2.805 N/A LEU 284.A N THR 319.A O no hydrogen 2.665 N/A PHE 286.A N LEU 284.A O no hydrogen 2.869 N/A GLY 287.A N ASP 290.A OD2 no hydrogen 3.189 N/A TYR 288.A N THR 315.A O no hydrogen 2.943 N/A ASN 289.A N MET 316.A O no hydrogen 3.074 N/A ASP 290.A N GLY 287.A O no hydrogen 2.858 N/A LEU 293.A N ASP 290.A O no hydrogen 2.704 N/A ARG 294.A N GLY 291.A O no hydrogen 3.344 N/A ARG 295.A N TRP 292.A O no hydrogen 3.172 N/A ARG 295.A NH1 GLN 343.A O no hydrogen 3.071 N/A ARG 295.A NH2 GLN 343.A O no hydrogen 3.005 N/A ARG 295.A NH2 THR 363.A O no hydrogen 3.008 N/A MET 296.A N LEU 293.A O no hydrogen 2.891 N/A GLN 297.A N ILE 336.A O no hydrogen 2.938 N/A LYS 298.A NZ LEU 293.A O no hydrogen 3.128 N/A LYS 298.A NZ MET 296.A O no hydrogen 3.187 N/A SER 300.A OG SER 299.A O no hydrogen 2.986 N/A VAL 301.A N MET 308.A O no hydrogen 3.045 N/A ILE 302.A N THR 334.A O no hydrogen 2.899 N/A ILE 303.A N LYS 306.A O no hydrogen 2.706 N/A ASN 304.A ND2 ASN 304.A O no hydrogen 3.075 N/A LYS 306.A N ILE 303.A O no hydrogen 2.952 N/A MET 308.A N VAL 301.A O no hydrogen 3.017 N/A ILE 310.A N SER 299.A O no hydrogen 2.959 N/A ILE 311.A N MET 320.A O no hydrogen 3.114 N/A THR 315.A N GLN 318.A O no hydrogen 2.888 N/A THR 315.A OG1 GLN 318.A O no hydrogen 3.501 N/A THR 315.A OG1 GLN 318.A OE1 no hydrogen 3.144 N/A THR 319.A N LEU 284.A O no hydrogen 3.116 N/A THR 319.A OG1 PHE 286.A O no hydrogen 2.638 N/A VAL 321.A N ALA 282.A O no hydrogen 2.662 N/A LYS 322.A N PRO 309.A O no hydrogen 3.186 N/A LEU 323.A N TYR 280.A O no hydrogen 3.026 N/A ARG 325.A NE LYS 326.A O no hydrogen 3.365 N/A TYR 327.A OH ASP 324.A OD1 no hydrogen 2.911 N/A GLY 330.A N ILE 255.A O no hydrogen 2.878 N/A THR 331.A N PRO 328.A O no hydrogen 3.248 N/A THR 331.A OG1 PRO 328.A O no hydrogen 2.612 N/A VAL 333.A N SER 253.A O no hydrogen 2.709 N/A THR 334.A N ILE 302.A O no hydrogen 2.882 N/A LEU 335.A N VAL 251.A O no hydrogen 2.914 N/A LYS 338.A N ARG 295.A O no hydrogen 3.133 N/A LYS 338.A NZ ARG 294.A O no hydrogen 3.244 N/A GLY 341.A N ASP 339.A OD1 no hydrogen 3.334 N/A GLU 342.A N ASP 339.A O no hydrogen 2.878 N/A GLN 343.A NE2 ASN 231.A O no hydrogen 2.569 N/A VAL 346.A N GLN 361.A O no hydrogen 2.934 N/A GLU 348.A N GLU 359.A O no hydrogen 2.989 N/A ALA 350.A N VAL 357.A O no hydrogen 2.783 N/A TYR 352.A N THR 355.A O no hydrogen 2.958 N/A THR 355.A N TYR 352.A O no hydrogen 3.436 N/A VAL 357.A N ALA 350.A O no hydrogen 2.884 N/A GLU 359.A N GLU 348.A O no hydrogen 2.828 N/A GLN 361.A N VAL 346.A O no hydrogen 2.963 N/A THR 362.A OG1 ILE 344.A O no hydrogen 3.433 N/A THR 363.A N ILE 344.A O no hydrogen 2.842 N/A LEU 364.A N THR 362.A OG1 no hydrogen 3.051 N/A ILE 368.A N ALA 365.A O no hydrogen 3.242 N/A ARG 370.A NE GLY 43.A O no hydrogen 2.867 N/A ARG 370.A NH1 LEU 364.A O no hydrogen 3.414 N/A ARG 370.A NH1 ALA 365.A O no hydrogen 2.854 N/A ARG 370.A NH1 ILE 368.A O no hydrogen 3.073 N/A ARG 370.A NH2 GLY 43.A O no hydrogen 2.863 N/A ARG 370.A NH2 LEU 364.A O no hydrogen 2.798 N/A ILE 371.A N VAL 10.A O no hydrogen 2.825 N/A TYR 372.A OH LEU 44.A O no hydrogen 2.579 N/A THR 373.A N VAL 12.A O no hydrogen 3.142 N/A LEU 376.A N ASP 15.A OD1 no hydrogen 3.257 N/A GLU 378.A N GLY 374.A O no hydrogen 3.262 N/A VAL 379.A N ASP 375.A O no hydrogen 3.057 N/A ILE 380.A N LEU 376.A O no hydrogen 3.042 N/A GLY 381.A N GLU 378.A O no hydrogen 3.063 N/A ALA 382.A N ALA 377.A O no hydrogen 2.969 N/A