Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xaa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ILE 16.A O no hydrogen 3.232 N/A MET 1.A N THR 18.A OG1 no hydrogen 2.697 N/A VAL 4.A N MET 113.A O no hydrogen 3.139 N/A GLY 10.A N TYR 6.A OH no hydrogen 3.050 N/A SER 11.A N GLU 8.A O no hydrogen 3.212 N/A SER 11.A OG GLU 8.A O no hydrogen 3.323 N/A VAL 14.A N GLN 5.A O no hydrogen 3.329 N/A ILE 24.A N VAL 119.A O no hydrogen 2.950 N/A LEU 26.A N MET 117.A O no hydrogen 2.894 N/A LYS 27.A N THR 62.A O no hydrogen 2.722 N/A VAL 28.A N GLU 115.A O no hydrogen 2.893 N/A THR 29.A N VAL 60.A O no hydrogen 3.110 N/A GLY 32.A N GLU 58.A O no hydrogen 3.080 N/A LEU 33.A N GLY 329.A O no hydrogen 3.001 N/A CYS 34.A N ASP 37.A OD2 no hydrogen 3.360 N/A CYS 34.A SG.A HIS 57.A NE2 no hydrogen 2.469 N/A CYS 34.A SG.A ASP 141.A OD2 no hydrogen 2.943 N/A CYS 34.A SG.B ASP 141.A OD2 no hydrogen 3.748 N/A ASP 37.A N CYS 34.A O no hydrogen 2.912 N/A PHE 39.A N HIS 35.A O no hydrogen 3.079 N/A VAL 40.A N SER 36.A O no hydrogen 2.795 N/A MET 41.A N ASP 37.A O no hydrogen 2.790 N/A TYR 48.A N PRO 44.A O no hydrogen 3.033 N/A TYR 48.A OH GLY 50.A O no hydrogen 2.745 N/A LEU 55.A N VAL 4.A O no hydrogen 3.298 N/A VAL 60.A N ALA 30.A O no hydrogen 3.363 N/A GLY 61.A N VAL 72.A O no hydrogen 2.842 N/A THR 62.A N LYS 27.A O no hydrogen 3.040 N/A THR 62.A OG1 GLY 69.A O no hydrogen 2.972 N/A THR 62.A OG1 ASP 70.A O no hydrogen 3.567 N/A VAL 63.A N ASP 70.A O no hydrogen 3.057 N/A ALA 64.A N LEU 25.A O no hydrogen 2.760 N/A GLY 67.A N ASP 70.A OD2 no hydrogen 2.940 N/A GLY 69.A N VAL 63.A O no hydrogen 3.194 N/A ASP 70.A N GLY 67.A O no hydrogen 2.942 N/A VAL 72.A N GLY 61.A O no hydrogen 2.788 N/A ALA 73.A N VAL 126.A O no hydrogen 2.924 N/A VAL 74.A N GLY 59.A O no hydrogen 2.941 N/A TYR 75.A N HIS 124.A O no hydrogen 3.056 N/A TYR 75.A OH GLY 284.A O no hydrogen 2.641 N/A TRP 78.A NE1 TYR 75.A O no hydrogen 2.686 N/A GLY 79.A N GLU 91.A OE1 no hydrogen 2.986 N/A ALA 87.A N CYS 83.A O no hydrogen 3.014 N/A ARG 88.A N ALA 85.A O no hydrogen 3.094 N/A ARG 88.A NE HIS 84.A O no hydrogen 3.292 N/A ARG 88.A NH2 HIS 84.A ND1 no hydrogen 3.038 N/A GLY 89.A N CYS 86.A O no hydrogen 2.896 N/A ARG 90.A N ALA 85.A O no hydrogen 2.799 N/A ASN 92.A ND2 TYR 282.A O no hydrogen 2.903 N/A TYR 93.A N ARG 90.A O no hydrogen 2.748 N/A TYR 93.A OH HIS 148.A NE2 no hydrogen 2.579 N/A CYS 94.A N GLU 91.A O no hydrogen 2.942 N/A ARG 96.A NH2 ASP 99.A OD2 no hydrogen 3.479 N/A LEU 100.A N ARG 96.A O no hydrogen 2.823 N/A GLY 101.A N ALA 98.A O no hydrogen 2.782 N/A ILE 102.A N ALA 97.A O no hydrogen 2.865 N/A GLY 106.A N SER 109.A O no hydrogen 2.860 N/A LEU 107.A N PRO 104.A O no hydrogen 2.839 N/A SER 109.A N PRO 104.A O no hydrogen 3.244 N/A SER 109.A OG THR 103.A O no hydrogen 3.469 N/A SER 112.A N GLY 56.A O no hydrogen 2.714 N/A SER 112.A OG GLU 58.A O no hydrogen 2.919 N/A MET 113.A N LEU 55.A O no hydrogen 2.789 N/A MET 117.A N LEU 26.A O no hydrogen 2.971 N/A VAL 119.A N ILE 24.A O no hydrogen 2.897 N/A ARG 123.A NE GLU 91.A OE2 no hydrogen 2.787 N/A ARG 123.A NH2 GLU 91.A OE1 no hydrogen 3.383 N/A HIS 124.A N SER 121.A O no hydrogen 3.093 N/A HIS 124.A ND1 ASP 120.A OD1 no hydrogen 2.990 N/A HIS 124.A NE2 GLU 91.A OE1 no hydrogen 3.026 N/A VAL 126.A N ALA 73.A O no hydrogen 3.014 N/A ILE 128.A N ALA 71.A O no hydrogen 3.005 N/A LEU 131.A N ILE 128.A O no hydrogen 3.236 N/A VAL 134.A N ASP 132.A OD1 no hydrogen 3.106 N/A ALA 136.A N ASP 132.A O no hydrogen 2.943 N/A ALA 137.A N PRO 133.A O no hydrogen 2.932 N/A THR 140.A N ALA 137.A O no hydrogen 3.198 N/A THR 140.A OG1 ALA 137.A O no hydrogen 2.628 N/A ASP 141.A N PRO 138.A O no hydrogen 2.876 N/A GLY 143.A N PRO 138.A O no hydrogen 3.127 N/A GLY 143.A N LEU 139.A O no hydrogen 3.167 N/A LEU 144.A N LEU 139.A O no hydrogen 2.699 N/A THR 145.A N ASP 141.A O no hydrogen 2.858 N/A THR 145.A OG1 ASP 141.A OD1 no hydrogen 3.042 N/A TYR 147.A N GLY 143.A O no hydrogen 2.976 N/A TYR 147.A OH GLU 291.A OE1 no hydrogen 2.717 N/A HIS 148.A N LEU 144.A O no hydrogen 2.817 N/A HIS 148.A ND1 GLU 288.A OE2 no hydrogen 3.272 N/A HIS 148.A NE2 TYR 93.A OH no hydrogen 2.579 N/A ALA 149.A N THR 145.A O no hydrogen 3.062 N/A ILE 150.A N PRO 146.A O no hydrogen 2.875 N/A SER 151.A N TYR 147.A O no hydrogen 2.718 N/A SER 151.A OG TYR 147.A O no hydrogen 3.017 N/A ARG 152.A N HIS 148.A O no hydrogen 3.113 N/A LEU 156.A N VAL 153.A O no hydrogen 2.917 N/A LEU 157.A N LEU 154.A O no hydrogen 2.952 N/A SER 161.A N GLY 158.A O no hydrogen 3.128 N/A SER 161.A OG GLY 158.A O no hydrogen 2.852 N/A THR 162.A N THR 229.A OG1 no hydrogen 2.885 N/A ALA 163.A N ARG 186.A O no hydrogen 2.716 N/A VAL 164.A N ALA 230.A O no hydrogen 2.795 N/A VAL 165.A N ILE 188.A O no hydrogen 2.637 N/A ILE 166.A N PHE 232.A O no hydrogen 3.022 N/A GLY 167.A N VAL 190.A O no hydrogen 3.028 N/A VAL 168.A N ASP 191.A OD1 no hydrogen 3.007 N/A HIS 173.A N GLY 169.A O no hydrogen 3.186 N/A HIS 173.A ND1 GLY 169.A O no hydrogen 3.047 N/A HIS 173.A ND1 GLY 170.A O no hydrogen 2.835 N/A VAL 174.A N LEU 171.A O no hydrogen 2.864 N/A GLY 175.A N LEU 171.A O no hydrogen 3.140 N/A ILE 176.A N GLY 172.A O no hydrogen 3.063 N/A GLN 177.A NE2 HIS 173.A O no hydrogen 3.062 N/A GLN 177.A NE2 ASP 302.A O no hydrogen 2.924 N/A ILE 178.A N VAL 174.A O no hydrogen 2.885 N/A LEU 179.A N GLY 175.A O no hydrogen 2.899 N/A ARG 180.A N ILE 176.A O no hydrogen 3.256 N/A ARG 180.A NE GLY 204.A O no hydrogen 3.071 N/A ALA 181.A N GLN 177.A O no hydrogen 2.956 N/A VAL 182.A N ILE 178.A O no hydrogen 3.046 N/A SER 183.A N LEU 179.A O no hydrogen 3.019 N/A SER 183.A OG LEU 179.A O no hydrogen 2.721 N/A ALA 185.A N SER 183.A OG no hydrogen 3.065 N/A ARG 186.A N SER 161.A O no hydrogen 3.015 N/A ARG 186.A NH1 LEU 222.A O no hydrogen 3.304 N/A ARG 186.A NH2 LEU 222.A O no hydrogen 2.816 N/A VAL 187.A N ASP 206.A OD2 no hydrogen 2.946 N/A ILE 188.A N ALA 163.A O no hydrogen 2.879 N/A ALA 189.A N ALA 207.A O no hydrogen 2.661 N/A VAL 190.A N VAL 165.A O no hydrogen 2.761 N/A ASP 191.A N VAL 209.A O no hydrogen 3.344 N/A ASP 193.A N ASP 191.A OD2 no hydrogen 2.873 N/A ASP 195.A N ASP 193.A OD1 no hydrogen 2.718 N/A ARG 196.A N ASP 193.A OD1 no hydrogen 2.637 N/A LEU 197.A N ASP 193.A O no hydrogen 3.221 N/A ALA 198.A N ASP 194.A O no hydrogen 3.456 N/A LEU 199.A N ASP 195.A O no hydrogen 2.925 N/A ALA 200.A N ARG 196.A O no hydrogen 2.930 N/A ARG 201.A N LEU 197.A O no hydrogen 3.202 N/A GLU 202.A N ALA 198.A O no hydrogen 3.089 N/A VAL 203.A N LEU 199.A O no hydrogen 3.253 N/A VAL 203.A N ALA 200.A O no hydrogen 3.127 N/A GLY 204.A N ARG 201.A O no hydrogen 2.814 N/A ALA 205.A N ALA 200.A O no hydrogen 3.225 N/A ASP 206.A N VAL 187.A O no hydrogen 2.760 N/A ALA 207.A N VAL 187.A O no hydrogen 3.331 N/A VAL 209.A N ALA 189.A O no hydrogen 2.684 N/A SER 211.A N ASP 191.A O no hydrogen 2.863 N/A ALA 218.A N GLY 214.A O no hydrogen 2.973 N/A ILE 219.A N ALA 215.A O no hydrogen 2.935 N/A ARG 220.A N ALA 216.A O no hydrogen 2.937 N/A ARG 220.A NE GLN 246.A O no hydrogen 2.705 N/A ARG 220.A NH1 GLY 225.A O no hydrogen 2.885 N/A ARG 220.A NH2 GLN 246.A O no hydrogen 2.971 N/A GLU 221.A N ASP 217.A O no hydrogen 2.931 N/A LEU 222.A N ILE 219.A O no hydrogen 2.900 N/A THR 223.A N ILE 219.A O no hydrogen 3.072 N/A THR 223.A OG1 ILE 219.A O no hydrogen 3.476 N/A THR 223.A OG1 ARG 220.A O no hydrogen 3.328 N/A THR 223.A OG1 GLY 224.A O no hydrogen 2.874 N/A GLN 226.A N GLN 226.A OE1 no hydrogen 2.796 N/A GLY 227.A N GLY 224.A O no hydrogen 3.205 N/A ALA 228.A N VAL 247.A O no hydrogen 2.746 N/A THR 229.A OG1 THR 162.A O no hydrogen 3.233 N/A ALA 230.A N THR 162.A O no hydrogen 3.201 N/A VAL 231.A N HIS 253.A O no hydrogen 2.953 N/A PHE 232.A N VAL 164.A O no hydrogen 2.937 N/A ASP 233.A N SER 255.A O no hydrogen 2.813 N/A PHE 234.A N ILE 166.A O no hydrogen 2.702 N/A VAL 235.A N ASP 233.A OD1 no hydrogen 2.740 N/A GLY 236.A N ASP 233.A OD1 no hydrogen 2.677 N/A GLN 238.A NE2 ASP 242.A OD1 no hydrogen 3.253 N/A GLN 238.A NE2 HIS 264.A O no hydrogen 2.794 N/A THR 240.A OG1 ASP 233.A OD1 no hydrogen 3.325 N/A THR 240.A OG1 ASP 233.A OD2 no hydrogen 2.637 N/A THR 240.A OG1 ALA 237.A O no hydrogen 2.770 N/A ILE 241.A N ALA 237.A O no hydrogen 2.855 N/A ASP 242.A N GLN 238.A O no hydrogen 2.876 N/A THR 243.A N SER 239.A O no hydrogen 3.091 N/A THR 243.A OG1 SER 239.A O no hydrogen 3.055 N/A ALA 244.A N THR 240.A O no hydrogen 2.886 N/A GLN 245.A N ILE 241.A O no hydrogen 2.918 N/A GLN 245.A NE2 LYS 266.A O no hydrogen 3.055 N/A GLN 246.A N ASP 242.A O no hydrogen 3.084 N/A GLN 246.A N THR 243.A O no hydrogen 2.811 N/A VAL 247.A N ALA 244.A O no hydrogen 3.023 N/A VAL 248.A N ALA 244.A O no hydrogen 3.013 N/A ALA 249.A N ALA 228.A O no hydrogen 2.918 N/A ASP 251.A N PHE 274.A O no hydrogen 2.989 N/A GLY 252.A N ALA 249.A O no hydrogen 3.030 N/A HIS 253.A N THR 229.A O no hydrogen 3.092 N/A HIS 253.A ND1 SER 277.A OG no hydrogen 2.772 N/A ILE 254.A N SER 277.A O no hydrogen 2.690 N/A SER 255.A N VAL 231.A O no hydrogen 2.964 N/A VAL 256.A N VAL 279.A O no hydrogen 2.944 N/A VAL 257.A N ASP 233.A O no hydrogen 2.854 N/A GLY 258.A N ASP 233.A O no hydrogen 3.016 N/A HIS 260.A ND1 VAL 235.A O no hydrogen 3.339 N/A ALA 263.A N HIS 260.A O no hydrogen 2.870 N/A HIS 264.A N GLN 238.A OE1 no hydrogen 2.967 N/A LYS 266.A N GLN 245.A OE1 no hydrogen 2.778 N/A MET 271.A N GLY 268.A O no hydrogen 3.110 N/A ALA 276.A N PRO 273.A O no hydrogen 3.164 N/A SER 277.A N GLY 252.A O no hydrogen 3.063 N/A SER 277.A OG HIS 253.A ND1 no hydrogen 2.772 N/A VAL 279.A N ILE 254.A O no hydrogen 3.013 N/A TYR 282.A N TYR 93.A OH no hydrogen 3.460 N/A TRP 283.A NE1 THR 140.A O no hydrogen 3.152 N/A THR 285.A N GLU 288.A OE1 no hydrogen 2.860 N/A ARG 286.A N GLY 89.A O no hydrogen 2.773 N/A GLU 288.A N THR 285.A OG1 no hydrogen 3.235 N/A LEU 289.A N THR 285.A O no hydrogen 2.968 N/A MET 290.A N ARG 286.A O no hydrogen 3.241 N/A GLU 291.A N SER 287.A O no hydrogen 2.982 N/A VAL 292.A N GLU 288.A O no hydrogen 2.896 N/A VAL 293.A N LEU 289.A O no hydrogen 3.140 N/A ALA 294.A N MET 290.A O no hydrogen 2.767 N/A LEU 295.A N GLU 291.A O no hydrogen 3.027 N/A ALA 296.A N VAL 292.A O no hydrogen 3.091 N/A ARG 297.A N VAL 293.A O no hydrogen 2.919 N/A ARG 297.A NH1 ILE 128.A O no hydrogen 3.420 N/A ARG 297.A NH1 ASP 130.A OD1 no hydrogen 2.695 N/A ARG 297.A NH2 ASP 130.A OD1 no hydrogen 3.374 N/A ALA 298.A N ALA 294.A O no hydrogen 3.187 N/A ALA 298.A N LEU 295.A O no hydrogen 3.153 N/A GLY 299.A N ALA 296.A O no hydrogen 2.826 N/A ARG 300.A N LEU 295.A O no hydrogen 2.997 N/A ASP 302.A N GLN 177.A OE1 no hydrogen 2.694 N/A HIS 304.A N HIS 173.A NE2 no hydrogen 3.189 N/A THR 309.A OG1 GLU 312.A OE1 no hydrogen 3.118 N/A GLU 312.A N THR 309.A OG1 no hydrogen 3.141 N/A ALA 316.A N GLU 312.A O no hydrogen 2.780 N/A TYR 317.A N GLY 313.A O no hydrogen 3.135 N/A TYR 317.A N PRO 314.A O no hydrogen 3.236 N/A TYR 317.A OH ASP 37.A OD2 no hydrogen 2.891 N/A ARG 319.A N ALA 315.A O no hydrogen 3.464 N/A ARG 319.A NE SER 324.A OG no hydrogen 2.777 N/A ARG 319.A NH1 GLU 306.A OE2 no hydrogen 3.529 N/A ARG 319.A NH2 GLU 306.A OE1 no hydrogen 3.401 N/A ARG 319.A NH2 GLU 306.A OE2 no hydrogen 3.129 N/A ARG 319.A NH2 SER 324.A O no hydrogen 3.381 N/A ARG 321.A N TYR 317.A O no hydrogen 3.171 N/A ARG 321.A NH1 ASP 42.A OD1 no hydrogen 2.776 N/A GLU 322.A N ARG 318.A O no hydrogen 3.000 N/A GLY 323.A N LEU 320.A O no hydrogen 2.868 N/A SER 324.A N ARG 319.A O no hydrogen 2.920 N/A SER 324.A OG ARG 319.A O no hydrogen 2.855 N/A SER 324.A OG GLU 322.A OE1 no hydrogen 3.459 N/A ARG 326.A NE ASP 195.A OD1 no hydrogen 3.037 N/A ARG 326.A NE ASP 195.A OD2 no hydrogen 2.975 N/A ARG 326.A NH1 GLU 202.A OE2 no hydrogen 3.365 N/A ARG 328.A N HIS 304.A O no hydrogen 2.795 N/A ARG 328.A NE GLU 58.A OE1 no hydrogen 3.479 N/A ARG 328.A NE GLU 58.A OE2 no hydrogen 2.902 N/A ARG 328.A NH2 GLU 58.A OE2 no hydrogen 3.281 N/A VAL 330.A N GLU 306.A O no hydrogen 3.179 N/A VAL 331.A N ALA 31.A O no hydrogen 2.584 N/A VAL 332.A N PHE 308.A O no hydrogen 2.825 N/A