Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2jd4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 10.A N CYS 281.A O no hydrogen 3.103 N/A VAL 18.A N CYS 193.A O no hydrogen 2.926 N/A HIS 22.A N ILE 169.A O no hydrogen 3.008 N/A GLN 23.A N ASP 191.A O no hydrogen 2.854 N/A PHE 24.A N ALA 167.A O no hydrogen 2.787 N/A GLY 25.A N SER 164.A OG no hydrogen 2.836 N/A SER 27.A N SER 30.A OG no hydrogen 2.933 N/A SER 27.A OG SER 30.A OG no hydrogen 3.322 N/A ASN 29.A N SER 27.A OG no hydrogen 2.998 N/A SER 30.A N SER 27.A O no hydrogen 3.433 N/A SER 30.A OG SER 27.A O no hydrogen 3.280 N/A SER 30.A OG SER 27.A OG no hydrogen 3.322 N/A SER 30.A OG ALA 189.A O no hydrogen 2.890 N/A HIS 31.A N SER 188.A O no hydrogen 3.063 N/A HIS 31.A ND1 ASN 29.A O no hydrogen 2.842 N/A LEU 32.A N LEU 146.A O no hydrogen 3.108 N/A VAL 33.A N SER 186.A O no hydrogen 3.000 N/A LEU 34.A N LEU 144.A O no hydrogen 2.921 N/A LEU 36.A N ARG 142.A O no hydrogen 3.151 N/A ARG 42.A N ASP 40.A OD1 no hydrogen 3.339 N/A ARG 42.A NE ASP 40.A OD1 no hydrogen 2.851 N/A ARG 42.A NH2 ASP 40.A OD2 no hydrogen 2.594 N/A LEU 45.A N TYR 112.A O no hydrogen 2.824 N/A GLN 46.A N ASN 175.A OD1 no hydrogen 2.891 N/A VAL 47.A N THR 110.A O no hydrogen 2.965 N/A GLN 48.A N MET 173.A O no hydrogen 2.988 N/A LEU 49.A N VAL 108.A O no hydrogen 2.960 N/A ILE 51.A N HIS 106.A O no hydrogen 2.840 N/A ARG 52.A N CYS 168.A O no hydrogen 3.152 N/A ARG 52.A NH1 TYR 194.A O no hydrogen 3.046 N/A ARG 52.A NH2 TYR 194.A O no hydrogen 2.901 N/A THR 53.A OG1 PRO 166.A O no hydrogen 2.827 N/A ALA 55.A N THR 53.A OG1 no hydrogen 2.896 N/A SER 57.A OG HIS 163.A NE2 no hydrogen 3.072 N/A GLY 58.A N LEU 76.A O no hydrogen 3.063 N/A LEU 59.A N HIS 163.A O no hydrogen 3.016 N/A ILE 60.A N LEU 74.A O no hydrogen 2.864 N/A TYR 61.A N LEU 74.A O no hydrogen 3.406 N/A TYR 61.A OH THR 110.A OG1 no hydrogen 2.668 N/A TYR 62.A N TYR 145.A O no hydrogen 2.949 N/A TYR 62.A OH TYR 153.A OH no hydrogen 3.090 N/A VAL 63.A N ALA 72.A O no hydrogen 3.031 N/A HIS 65.A N ASP 70.A O no hydrogen 2.921 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 2.873 N/A GLN 68.A N HIS 65.A O no hydrogen 2.901 N/A GLN 68.A NE2 ARG 154.A O no hydrogen 2.937 N/A MET 69.A N ASN 67.A OD1 no hydrogen 2.653 N/A TYR 71.A N ASP 86.A O no hydrogen 3.183 N/A ALA 72.A N VAL 63.A O no hydrogen 2.984 N/A THR 73.A N MET 84.A O no hydrogen 2.874 N/A THR 73.A OG1 TYR 61.A O no hydrogen 2.986 N/A LEU 74.A N TYR 61.A O no hydrogen 3.131 N/A GLN 75.A N HIS 82.A O no hydrogen 3.015 N/A GLN 75.A NE2 ILE 158.A O no hydrogen 2.937 N/A GLN 75.A NE2 ILE 161.A O no hydrogen 2.787 N/A LEU 76.A N GLY 58.A O no hydrogen 2.760 N/A GLN 77.A N ARG 80.A O no hydrogen 2.790 N/A GLY 79.A N SER 56.A O no hydrogen 2.832 N/A ARG 80.A N GLN 77.A O no hydrogen 2.907 N/A ARG 80.A NE PRO 97.A O no hydrogen 2.679 N/A HIS 82.A N GLN 75.A O no hydrogen 2.970 N/A HIS 82.A ND1 SER 95.A OG no hydrogen 2.963 N/A PHE 83.A N VAL 94.A O no hydrogen 2.847 N/A MET 84.A N THR 73.A O no hydrogen 3.094 N/A PHE 85.A N THR 92.A O no hydrogen 3.134 N/A ASP 86.A N TYR 71.A O no hydrogen 2.975 N/A GLY 88.A N ASP 86.A OD1 no hydrogen 2.847 N/A GLY 90.A N ASP 86.A OD1 no hydrogen 2.955 N/A ARG 91.A NH1 TYR 71.A OH no hydrogen 3.096 N/A THR 92.A N PHE 85.A O no hydrogen 2.914 N/A VAL 94.A N PHE 83.A O no hydrogen 2.767 N/A SER 95.A OG HIS 82.A ND1 no hydrogen 2.963 N/A HIS 96.A N LEU 81.A O no hydrogen 3.274 N/A LEU 100.A N GLY 79.A O no hydrogen 3.208 N/A ASP 102.A N LEU 100.A O no hydrogen 2.858 N/A GLY 103.A N THR 53.A O no hydrogen 2.962 N/A LYS 104.A N ASP 102.A OD1 no hydrogen 2.958 N/A HIS 106.A N ILE 51.A O no hydrogen 2.846 N/A HIS 106.A ND1 ASP 122.A OD2 no hydrogen 2.789 N/A HIS 106.A NE2 ASP 102.A OD1 no hydrogen 2.792 N/A THR 107.A N ASP 122.A OD1 no hydrogen 3.041 N/A VAL 108.A N LEU 49.A O no hydrogen 2.786 N/A LYS 109.A N THR 120.A O no hydrogen 2.870 N/A THR 110.A N VAL 47.A O no hydrogen 2.929 N/A THR 110.A OG1 TYR 61.A OH no hydrogen 2.668 N/A GLU 111.A N PHE 118.A O no hydrogen 2.912 N/A TYR 112.A N LEU 45.A O no hydrogen 2.946 N/A TYR 112.A OH ARG 42.A O no hydrogen 3.049 N/A ILE 113.A N LYS 116.A O no hydrogen 3.028 N/A LYS 114.A N LYS 43.A O no hydrogen 3.349 N/A ARG 115.A NH1 GLY 133.A O no hydrogen 3.302 N/A ARG 115.A NH2 ALA 135.A O no hydrogen 2.773 N/A LYS 116.A N ILE 113.A O no hydrogen 3.129 N/A ALA 117.A N VAL 129.A O no hydrogen 3.036 N/A PHE 118.A N GLU 111.A O no hydrogen 2.881 N/A MET 119.A N SER 126.A OG no hydrogen 3.186 N/A THR 120.A N LYS 109.A O no hydrogen 2.889 N/A VAL 121.A N GLN 124.A O no hydrogen 3.192 N/A ASP 122.A N THR 107.A O no hydrogen 2.916 N/A GLN 124.A N VAL 121.A O no hydrogen 3.006 N/A GLN 124.A NE2 VAL 121.A O no hydrogen 3.095 N/A SER 126.A N MET 119.A O no hydrogen 2.884 N/A SER 126.A OG MET 119.A O no hydrogen 3.246 N/A SER 126.A OG PRO 127.A O no hydrogen 3.357 N/A VAL 129.A N ALA 117.A O no hydrogen 2.926 N/A VAL 131.A N ARG 115.A O no hydrogen 2.862 N/A VAL 132.A N THR 92.A OG1 no hydrogen 2.828 N/A LYS 134.A NZ LYS 89.A O no hydrogen 3.273 N/A THR 137.A OG1 ASP 139.A OD1 no hydrogen 3.042 N/A THR 137.A OG1 ASP 139.A OD2 no hydrogen 2.702 N/A LEU 138.A N ARG 42.A O no hydrogen 2.916 N/A ASP 139.A N ASP 70.A OD2 no hydrogen 2.999 N/A GLU 141.A N ALA 64.A O no hydrogen 2.952 N/A ARG 142.A NH1 SER 39.A O no hydrogen 2.673 N/A ARG 142.A NH2 SER 39.A O no hydrogen 2.437 N/A LYS 143.A N GLU 141.A O no hydrogen 2.702 N/A LEU 144.A N LEU 34.A O no hydrogen 2.870 N/A TYR 145.A N TYR 62.A O no hydrogen 2.901 N/A LEU 146.A N LEU 32.A O no hydrogen 2.907 N/A GLY 147.A N ILE 60.A O no hydrogen 2.682 N/A TYR 153.A N PRO 150.A O no hydrogen 3.209 N/A TYR 153.A OH TYR 62.A OH no hydrogen 3.090 N/A ARG 156.A N GLN 68.A OE1 no hydrogen 2.641 N/A THR 162.A N THR 160.A O no hydrogen 2.882 N/A HIS 163.A NE2 SER 57.A OG no hydrogen 3.072 N/A SER 164.A N GLN 28.A O no hydrogen 2.957 N/A SER 164.A OG SER 30.A O no hydrogen 3.059 N/A SER 164.A OG GLY 147.A O no hydrogen 2.740 N/A ILE 165.A N GLY 147.A O no hydrogen 3.134 N/A CYS 168.A N ARG 52.A O no hydrogen 3.037 N/A CYS 168.A SG HIS 22.A O no hydrogen 3.774 N/A ILE 169.A N HIS 22.A O no hydrogen 2.785 N/A GLY 170.A N SER 50.A O no hydrogen 3.189 N/A MET 173.A N GLN 48.A O no hydrogen 2.790 N/A VAL 174.A N GLN 177.A O no hydrogen 2.851 N/A ASN 175.A N GLN 46.A O no hydrogen 2.826 N/A ASN 175.A ND2 ARG 44.A O no hydrogen 3.101 N/A GLN 177.A N VAL 174.A O no hydrogen 2.999 N/A LEU 179.A N ILE 172.A O no hydrogen 2.956 N/A LYS 181.A NZ GLY 170.A O no hydrogen 2.687 N/A ASP 182.A N ASP 180.A OD1 no hydrogen 3.099 N/A ARG 183.A N ASP 180.A O no hydrogen 3.162 N/A LEU 185.A N VAL 33.A O no hydrogen 2.740 N/A SER 188.A N HIS 31.A O no hydrogen 3.187 N/A ASP 191.A N GLN 23.A O no hydrogen 3.346 N/A ARG 192.A N ASP 191.A OD2 no hydrogen 2.840 N/A VAL 195.A N GLY 16.A O no hydrogen 3.021 N/A GLN 198.A N CYS 371.A O no hydrogen 3.017 N/A GLN 198.A NE2 PRO 372.A O no hydrogen 3.162 N/A THR 201.A N VAL 344.A O no hydrogen 3.030 N/A PHE 202.A N SER 370.A O no hydrogen 3.032 N/A PHE 203.A N GLY 342.A O no hydrogen 2.826 N/A GLU 204.A N GLY 365.A O no hydrogen 3.196 N/A SER 206.A OG GLU 204.A OE1 no hydrogen 2.639 N/A TYR 208.A N GLN 364.A O no hydrogen 2.868 N/A TYR 208.A OH ASP 362.A OD2 no hydrogen 2.741 N/A ALA 209.A N VAL 322.A O no hydrogen 2.970 N/A ALA 210.A N ASP 362.A O no hydrogen 2.871 N/A LEU 211.A N ILE 320.A O no hydrogen 2.870 N/A GLU 214.A N GLU 214.A OE2 no hydrogen 2.567 N/A GLY 215.A N VAL 212.A O no hydrogen 3.049 N/A TYR 216.A N ASP 318.A O no hydrogen 2.804 N/A VAL 218.A N THR 316.A OG1 no hydrogen 3.002 N/A ARG 219.A N ALA 314.A O no hydrogen 2.919 N/A LEU 222.A N LYS 292.A O no hydrogen 2.922 N/A GLN 223.A NE2 THR 225.A OG1 no hydrogen 3.215 N/A ILE 224.A N ALA 290.A O no hydrogen 2.866 N/A THR 225.A N ARG 348.A O no hydrogen 3.028 N/A LEU 226.A N LEU 288.A O no hydrogen 3.053 N/A GLU 227.A N ARG 345.A O no hydrogen 2.998 N/A PHE 228.A N HIS 286.A O no hydrogen 3.060 N/A ARG 229.A N CYS 343.A O no hydrogen 3.005 N/A ARG 229.A NE GLY 283.A O no hydrogen 3.158 N/A ARG 229.A NH1 ASP 12.A OD2 no hydrogen 3.444 N/A ARG 229.A NH2 ASP 12.A OD1 no hydrogen 3.067 N/A ARG 229.A NH2 ASP 12.A OD2 no hydrogen 3.419 N/A ARG 229.A NH2 GLY 283.A O no hydrogen 3.479 N/A THR 230.A OG1 ARG 341.A O no hydrogen 2.649 N/A SER 232.A N THR 230.A OG1 no hydrogen 3.094 N/A SER 232.A OG ASN 234.A O no hydrogen 3.410 N/A LYS 233.A NZ ALA 277.A O no hydrogen 3.320 N/A GLY 235.A N ILE 252.A O no hydrogen 2.835 N/A VAL 236.A N ALA 338.A O no hydrogen 2.892 N/A LEU 237.A N LEU 250.A O no hydrogen 2.990 N/A LEU 238.A N LEU 250.A O no hydrogen 3.005 N/A GLY 239.A N TYR 321.A O no hydrogen 2.976 N/A ILE 240.A N ILE 248.A O no hydrogen 3.137 N/A SER 241.A OG SER 242.A O no hydrogen 2.817 N/A SER 241.A OG LYS 330.A O no hydrogen 3.494 N/A SER 242.A N ASP 246.A O no hydrogen 3.126 N/A SER 242.A OG ASP 246.A O no hydrogen 2.956 N/A LYS 244.A N SER 242.A OG no hydrogen 3.228 N/A ALA 247.A N ASN 262.A O no hydrogen 3.185 N/A ILE 248.A N ILE 240.A O no hydrogen 3.047 N/A GLY 249.A N HIS 260.A O no hydrogen 2.941 N/A LEU 250.A N LEU 238.A O no hydrogen 2.759 N/A GLU 251.A N LEU 258.A O no hydrogen 3.057 N/A ILE 252.A N GLY 235.A O no hydrogen 2.852 N/A VAL 253.A N LYS 256.A O no hydrogen 2.884 N/A GLY 255.A N LYS 233.A O no hydrogen 3.110 N/A LYS 256.A N VAL 253.A O no hydrogen 3.167 N/A VAL 257.A N TYR 272.A O no hydrogen 3.076 N/A LEU 258.A N GLU 251.A O no hydrogen 2.853 N/A PHE 259.A N ALA 270.A O no hydrogen 3.042 N/A HIS 260.A N GLY 249.A O no hydrogen 2.898 N/A HIS 260.A ND1 THR 269.A OG1 no hydrogen 2.636 N/A HIS 260.A NE2 GLU 251.A OE2 no hydrogen 2.950 N/A VAL 261.A N ILE 268.A O no hydrogen 2.843 N/A ASN 262.A N ALA 247.A O no hydrogen 2.872 N/A ASN 263.A ND2 SER 311.A O no hydrogen 3.488 N/A GLY 264.A N ASN 262.A OD1 no hydrogen 2.673 N/A GLY 266.A N ASN 262.A OD1 no hydrogen 3.437 N/A ARG 267.A NH2 ASN 332.A O no hydrogen 2.921 N/A ILE 268.A N VAL 261.A O no hydrogen 2.711 N/A THR 269.A OG1 HIS 260.A ND1 no hydrogen 2.636 N/A ALA 270.A N PHE 259.A O no hydrogen 3.039 N/A TYR 272.A N VAL 257.A O no hydrogen 2.908 N/A ALA 279.A N ALA 276.A O no hydrogen 3.206 N/A CYS 281.A N ARG 278.A O no hydrogen 3.164 N/A CYS 281.A SG ARG 278.A O no hydrogen 3.492 N/A GLY 283.A N THR 230.A O no hydrogen 3.256 N/A LYS 284.A N ASP 282.A OD1 no hydrogen 3.165 N/A TRP 285.A NE1 GLN 198.A OE1 no hydrogen 2.800 N/A HIS 286.A N PHE 228.A O no hydrogen 2.989 N/A HIS 286.A ND1 ASP 302.A OD2 no hydrogen 2.900 N/A HIS 286.A NE2 ASP 282.A OD1 no hydrogen 2.795 N/A THR 287.A N ASP 302.A OD1 no hydrogen 3.096 N/A LEU 288.A N LEU 226.A O no hydrogen 2.850 N/A GLN 289.A N THR 300.A O no hydrogen 2.718 N/A ALA 290.A N ILE 224.A O no hydrogen 2.836 N/A HIS 291.A N VAL 298.A O no hydrogen 2.704 N/A HIS 291.A NE2 ASP 221.A OD1 no hydrogen 3.248 N/A HIS 291.A NE2 ASP 221.A OD2 no hydrogen 3.129 N/A LYS 292.A N LEU 222.A O no hydrogen 2.877 N/A LYS 292.A NZ ARG 219.A O no hydrogen 3.094 N/A LYS 292.A NZ LEU 220.A O no hydrogen 3.109 N/A LYS 292.A NZ ASN 263.A OD1 no hydrogen 3.302 N/A LYS 292.A NZ THR 312.A O no hydrogen 2.745 N/A SER 293.A N ARG 296.A O no hydrogen 2.870 N/A SER 293.A OG ARG 296.A O no hydrogen 3.346 N/A ARG 296.A N SER 293.A O no hydrogen 3.166 N/A ILE 297.A N ALA 308.A O no hydrogen 3.115 N/A VAL 298.A N HIS 291.A O no hydrogen 2.891 N/A LEU 299.A N VAL 306.A O no hydrogen 2.876 N/A THR 300.A N GLN 289.A O no hydrogen 2.621 N/A THR 300.A OG1 SER 305.A OG no hydrogen 2.764 N/A VAL 301.A N ASN 304.A O no hydrogen 2.825 N/A ASP 302.A N THR 287.A O no hydrogen 3.071 N/A ASN 304.A N VAL 301.A O no hydrogen 2.842 N/A ASN 304.A ND2 VAL 301.A O no hydrogen 2.933 N/A SER 305.A OG THR 300.A OG1 no hydrogen 2.764 N/A VAL 306.A N LEU 299.A O no hydrogen 2.810 N/A ALA 308.A N ILE 297.A O no hydrogen 3.010 N/A SER 313.A OG ASP 315.A OD1 no hydrogen 2.695 N/A ALA 314.A N ARG 219.A O no hydrogen 2.933 N/A ASP 315.A N ASP 246.A OD2 no hydrogen 2.766 N/A THR 316.A N ALA 314.A O no hydrogen 2.837 N/A THR 316.A OG1 TYR 216.A O no hydrogen 2.695 N/A ASN 317.A N ASP 318.A OD2 no hydrogen 2.889 N/A ASP 318.A N TYR 216.A O no hydrogen 3.340 N/A ILE 320.A N LEU 211.A O no hydrogen 2.775 N/A TYR 321.A N GLY 239.A O no hydrogen 2.929 N/A VAL 322.A N ALA 209.A O no hydrogen 2.703 N/A GLY 323.A N LEU 237.A O no hydrogen 2.831 N/A TYR 325.A OH SER 336.A O no hydrogen 2.726 N/A ILE 329.A N PRO 326.A O no hydrogen 3.060 N/A LYS 330.A NZ LYS 244.A O no hydrogen 2.781 N/A ASN 332.A N SER 241.A OG no hydrogen 3.119 N/A ASN 332.A ND2 VAL 245.A O no hydrogen 2.770 N/A SER 333.A OG ALA 247.A O no hydrogen 2.835 N/A LEU 334.A N GLN 331.A O no hydrogen 3.364 N/A SER 335.A N GLU 251.A OE2 no hydrogen 3.151 N/A SER 335.A OG GLU 251.A OE2 no hydrogen 2.674 N/A SER 336.A N GLU 251.A OE1 no hydrogen 2.848 N/A ALA 338.A N SER 336.A OG no hydrogen 3.030 N/A SER 339.A OG GLY 207.A O no hydrogen 2.746 N/A PHE 340.A N GLY 323.A O no hydrogen 2.864 N/A ARG 341.A NH1 GLU 204.A O no hydrogen 2.750 N/A GLY 342.A N PHE 203.A O no hydrogen 3.000 N/A CYS 343.A N ARG 229.A O no hydrogen 3.022 N/A VAL 344.A N THR 201.A O no hydrogen 3.165 N/A ARG 345.A N GLU 227.A O no hydrogen 2.938 N/A ARG 345.A NE GLU 199.A O no hydrogen 3.258 N/A ARG 345.A NH1 GLU 375.A OE2 no hydrogen 3.284 N/A ARG 345.A NH2 GLU 199.A O no hydrogen 3.007 N/A ARG 345.A NH2 GLU 375.A OE1 no hydrogen 2.623 N/A ASN 346.A ND2 GLU 227.A OE2 no hydrogen 2.712 N/A ARG 348.A N THR 225.A O no hydrogen 2.923 N/A LEU 349.A N GLN 353.A O no hydrogen 2.566 N/A SER 350.A N GLN 223.A O no hydrogen 2.616 N/A LEU 355.A N LEU 347.A O no hydrogen 2.789 N/A SER 358.A N ASP 356.A OD1 no hydrogen 3.056 N/A SER 358.A OG ASP 356.A OD1 no hydrogen 2.684 N/A SER 358.A OG ASP 356.A OD2 no hydrogen 2.850 N/A ARG 359.A N ASP 356.A O no hydrogen 2.993 N/A ALA 360.A N LEU 357.A O no hydrogen 3.226 N/A PHE 361.A N ALA 210.A O no hydrogen 3.006 N/A GLN 364.A N TYR 208.A O no hydrogen 2.903 N/A GLN 364.A NE2 ASP 362.A OD1 no hydrogen 3.152 N/A PHE 367.A N PHE 202.A O no hydrogen 2.883 N/A HIS 369.A N THR 201.A OG1 no hydrogen 2.794 N/A HIS 369.A NE2 ASP 356.A OD1 no hydrogen 2.840 N/A SER 370.A N PHE 367.A O no hydrogen 3.096 N/A CYS 371.A SG PRO 372.A O no hydrogen 3.815 N/A GLY 373.A N VAL 196.A O no hydrogen 2.910 N/A