Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2yjy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLU 28.A OE2 no hydrogen 2.642 N/A SER 3.A OG GLU 28.A OE1 no hydrogen 2.549 N/A LEU 6.A N SER 3.A OG no hydrogen 3.358 N/A GLU 7.A N SER 3.A O no hydrogen 3.146 N/A ASP 8.A N LEU 5.A O no hydrogen 3.414 N/A PHE 9.A N LEU 5.A O no hydrogen 3.155 N/A ARG 10.A N LEU 6.A O no hydrogen 2.838 N/A ARG 10.A NE ASP 32.A OD1 no hydrogen 3.311 N/A ARG 10.A NH2 ASP 32.A OD1 no hydrogen 3.070 N/A ASN 11.A N GLU 7.A O no hydrogen 3.310 N/A ASN 12.A N PHE 9.A O no hydrogen 3.198 N/A ASN 12.A ND2 ASN 12.A O no hydrogen 2.754 N/A ARG 13.A N ASP 8.A O no hydrogen 3.031 N/A GLU 21.A N GLN 18.A O no hydrogen 2.802 N/A ILE 22.A N LEU 19.A O no hydrogen 2.993 N/A GLY 24.A N GLU 57.A OE2 no hydrogen 2.781 N/A HIS 25.A N ILE 22.A O no hydrogen 3.104 N/A HIS 25.A ND1 ALA 23.A O no hydrogen 2.964 N/A PHE 29.A N HIS 25.A O no hydrogen 2.930 N/A SER 30.A N ILE 26.A O no hydrogen 2.827 N/A SER 30.A OG ILE 26.A O no hydrogen 2.451 N/A GLN 31.A N MET 27.A O no hydrogen 3.315 N/A ASP 32.A N PHE 29.A O no hydrogen 2.899 N/A GLY 35.A N ASP 32.A OD2 no hydrogen 3.293 N/A SER 36.A N ASP 32.A O no hydrogen 3.227 N/A SER 36.A OG PHE 70.A O no hydrogen 3.061 N/A ARG 37.A N GLN 33.A O no hydrogen 3.102 N/A PHE 38.A N HIS 34.A O no hydrogen 2.703 N/A ILE 39.A N GLY 35.A O no hydrogen 2.907 N/A GLN 40.A N SER 36.A O no hydrogen 2.830 N/A GLN 40.A NE2 SER 36.A OG no hydrogen 2.979 N/A LEU 41.A N ARG 37.A O no hydrogen 2.950 N/A LYS 42.A N PHE 38.A O no hydrogen 2.966 N/A LEU 43.A N ILE 39.A O no hydrogen 2.927 N/A ALA 46.A N LEU 43.A O no hydrogen 3.240 N/A THR 47.A N GLU 50.A OE1 no hydrogen 2.828 N/A GLU 50.A N THR 47.A OG1 no hydrogen 3.397 N/A ARG 51.A N THR 47.A O no hydrogen 2.981 N/A ARG 51.A NH1 LEU 43.A O no hydrogen 3.350 N/A GLN 52.A N PRO 48.A O no hydrogen 2.716 N/A LEU 53.A N ALA 49.A O no hydrogen 2.694 N/A VAL 54.A N GLU 50.A O no hydrogen 2.941 N/A PHE 55.A N ARG 51.A O no hydrogen 2.674 N/A ASN 56.A N GLN 52.A O no hydrogen 2.796 N/A GLU 57.A N VAL 54.A O no hydrogen 3.217 N/A ILE 58.A N PHE 55.A O no hydrogen 3.147 N/A LEU 59.A N PHE 55.A O no hydrogen 3.197 N/A ALA 61.A N ILE 58.A O no hydrogen 3.292 N/A ALA 62.A N LEU 59.A O no hydrogen 2.876 N/A LEU 65.A N ALA 61.A O no hydrogen 3.241 N/A MET 66.A N ALA 62.A O no hydrogen 2.648 N/A VAL 67.A N TYR 63.A O no hydrogen 3.261 N/A ASP 68.A N LEU 65.A O no hydrogen 2.883 N/A PHE 70.A N ASP 68.A OD2 no hydrogen 3.190 N/A GLY 71.A N ASP 68.A OD2 no hydrogen 3.235 N/A ASN 72.A N ASP 68.A O no hydrogen 3.267 N/A ASN 72.A ND2 ASP 68.A O no hydrogen 2.708 N/A TYR 73.A N PHE 70.A O no hydrogen 3.293 N/A VAL 74.A N GLY 71.A O no hydrogen 3.029 N/A ILE 75.A N GLY 71.A O no hydrogen 3.430 N/A GLN 76.A N ASN 72.A O no hydrogen 2.989 N/A GLN 76.A NE2 ASN 72.A O no hydrogen 3.566 N/A GLN 76.A NE2 ASN 72.A OD1 no hydrogen 2.725 N/A LYS 77.A N TYR 73.A O no hydrogen 2.828 N/A LYS 77.A NZ GLN 40.A OE1 no hydrogen 3.350 N/A PHE 78.A N VAL 74.A O no hydrogen 3.281 N/A PHE 78.A N ILE 75.A O no hydrogen 2.864 N/A PHE 79.A N ILE 75.A O no hydrogen 3.320 N/A GLU 80.A N GLN 76.A O no hydrogen 3.137 N/A GLU 80.A N LYS 77.A O no hydrogen 3.159 N/A PHE 81.A N LYS 77.A O no hydrogen 2.772 N/A GLY 82.A N PHE 78.A O no hydrogen 2.752 N/A SER 83.A N GLN 86.A OE1 no hydrogen 2.758 N/A SER 83.A OG GLN 86.A OE1 no hydrogen 2.585 N/A LYS 87.A N SER 83.A O no hydrogen 2.874 N/A LEU 88.A N LEU 84.A O no hydrogen 2.761 N/A ALA 89.A N GLU 85.A O no hydrogen 2.591 N/A LEU 90.A N GLN 86.A O no hydrogen 3.021 N/A ALA 91.A N LYS 87.A O no hydrogen 2.939 N/A GLU 92.A N LEU 88.A O no hydrogen 2.907 N/A ARG 93.A N ALA 89.A O no hydrogen 3.148 N/A ARG 93.A NE LEU 59.A O no hydrogen 2.887 N/A ARG 93.A NH2 LEU 59.A O no hydrogen 2.964 N/A ILE 94.A N LEU 90.A O no hydrogen 2.897 N/A ARG 95.A N ALA 91.A O no hydrogen 2.787 N/A ARG 95.A NH2 GLN 122.A O no hydrogen 3.019 N/A GLY 96.A N GLU 129.A OE1 no hydrogen 3.097 N/A GLY 96.A N GLU 129.A OE2 no hydrogen 2.819 N/A HIS 97.A N ILE 94.A O no hydrogen 2.743 N/A VAL 98.A N GLU 129.A OE2 no hydrogen 2.954 N/A LEU 101.A N HIS 97.A O no hydrogen 3.118 N/A ALA 102.A N VAL 98.A O no hydrogen 2.859 N/A LEU 103.A N LEU 99.A O no hydrogen 3.148 N/A GLN 104.A N LEU 101.A O no hydrogen 2.858 N/A GLN 104.A NE2 VAL 67.A O no hydrogen 3.533 N/A TYR 106.A N GLN 104.A OE1 no hydrogen 2.668 N/A GLY 107.A N GLN 104.A OE1 no hydrogen 2.648 N/A CYS 108.A N GLN 104.A O no hydrogen 2.587 N/A CYS 108.A SG MET 105.A O no hydrogen 3.474 N/A CYS 108.A SG ASN 142.A O no hydrogen 3.733 N/A ARG 109.A N TYR 106.A O no hydrogen 2.990 N/A ILE 111.A N GLY 107.A O no hydrogen 3.141 N/A GLN 112.A N CYS 108.A O no hydrogen 2.987 N/A GLN 112.A NE2 CYS 108.A O no hydrogen 3.441 N/A LYS 113.A N ARG 109.A O no hydrogen 2.946 N/A LYS 113.A NZ GLU 116.A OE1 no hydrogen 3.567 N/A ALA 114.A N VAL 110.A O no hydrogen 2.801 N/A LEU 115.A N ILE 111.A O no hydrogen 2.993 N/A GLU 116.A N LYS 113.A O no hydrogen 2.778 N/A PHE 117.A N ALA 114.A O no hydrogen 3.068 N/A ILE 118.A N ALA 114.A O no hydrogen 3.042 N/A GLN 123.A N PRO 119.A O no hydrogen 3.048 N/A GLN 123.A NE2 LEU 115.A O no hydrogen 2.948 N/A GLN 123.A NE2 CYS 153.A O no hydrogen 3.001 N/A ASN 124.A N SER 120.A O no hydrogen 2.976 N/A GLU 125.A N ASP 121.A O no hydrogen 3.300 N/A MET 126.A N GLN 122.A O no hydrogen 3.254 N/A VAL 127.A N GLN 123.A O no hydrogen 2.851 N/A ARG 128.A N ASN 124.A O no hydrogen 2.970 N/A GLU 129.A N MET 126.A O no hydrogen 3.145 N/A LEU 130.A N VAL 127.A O no hydrogen 2.527 N/A ASP 131.A N ARG 128.A O no hydrogen 3.167 N/A HIS 133.A N LEU 130.A O no hydrogen 3.007 N/A CYS 137.A N HIS 133.A O no hydrogen 3.295 N/A CYS 137.A SG HIS 133.A O no hydrogen 3.431 N/A VAL 138.A N VAL 134.A O no hydrogen 2.907 N/A LYS 139.A N LEU 135.A O no hydrogen 3.249 N/A ASP 140.A N CYS 137.A O no hydrogen 2.790 N/A ASN 142.A N ASP 140.A OD2 no hydrogen 2.825 N/A ASN 142.A ND2 LEU 103.A O no hydrogen 2.924 N/A GLY 143.A N ASP 140.A OD2 no hydrogen 2.733 N/A ASN 144.A N ASP 140.A O no hydrogen 3.060 N/A ASN 144.A ND2 ASP 140.A O no hydrogen 2.359 N/A VAL 147.A N GLY 143.A O no hydrogen 3.038 N/A GLN 148.A N ASN 144.A O no hydrogen 2.971 N/A GLN 148.A NE2 ASN 144.A O no hydrogen 3.623 N/A GLN 148.A NE2 ASN 144.A OD1 no hydrogen 3.266 N/A LYS 149.A N HIS 145.A O no hydrogen 2.780 N/A CYS 150.A N VAL 146.A O no hydrogen 2.795 N/A CYS 150.A SG VAL 146.A O no hydrogen 3.592 N/A ILE 151.A N VAL 147.A O no hydrogen 3.067 N/A GLU 152.A N GLN 148.A O no hydrogen 3.118 N/A CYS 153.A N LYS 149.A O no hydrogen 2.797 N/A CYS 153.A N CYS 150.A O no hydrogen 3.271 N/A VAL 154.A N CYS 150.A O no hydrogen 2.814 N/A SER 158.A N GLN 155.A O no hydrogen 3.006 N/A LEU 159.A N PRO 156.A O no hydrogen 2.423 N/A GLN 160.A NE2 ASP 164.A OD1 no hydrogen 2.772 N/A ASP 164.A N GLN 160.A O no hydrogen 2.638 N/A ALA 165.A N PHE 161.A O no hydrogen 2.938 N/A PHE 166.A N ILE 163.A O no hydrogen 3.107 N/A LYS 167.A N ASP 164.A O no hydrogen 2.953 N/A LYS 167.A NZ ASP 164.A OD1 no hydrogen 2.722 N/A GLY 168.A N GLU 201.A OE2 no hydrogen 2.529 N/A GLN 169.A N PHE 166.A O no hydrogen 2.641 N/A GLN 169.A NE2 GLY 168.A O no hydrogen 3.387 N/A VAL 170.A N GLU 201.A OE1 no hydrogen 3.192 N/A LEU 173.A N GLN 169.A O no hydrogen 2.940 N/A SER 174.A N VAL 170.A O no hydrogen 2.690 N/A SER 174.A OG VAL 170.A O no hydrogen 2.678 N/A THR 175.A N PHE 171.A O no hydrogen 3.070 N/A THR 175.A OG1 PHE 171.A O no hydrogen 3.021 N/A THR 175.A OG1 ALA 172.A O no hydrogen 3.216 N/A HIS 176.A N LEU 173.A O no hydrogen 3.035 N/A TYR 178.A N HIS 176.A ND1 no hydrogen 3.005 N/A GLY 179.A N HIS 176.A ND1 no hydrogen 3.196 N/A CYS 180.A N HIS 176.A O no hydrogen 3.114 N/A CYS 180.A SG HIS 176.A O no hydrogen 3.287 N/A CYS 180.A SG PRO 177.A O no hydrogen 3.404 N/A ARG 181.A N TYR 178.A O no hydrogen 2.770 N/A ARG 181.A NE ASN 144.A OD1 no hydrogen 3.376 N/A ARG 181.A NH2 ASN 144.A OD1 no hydrogen 3.007 N/A VAL 182.A N TYR 178.A O no hydrogen 3.470 N/A ILE 183.A N GLY 179.A O no hydrogen 2.991 N/A GLN 184.A N CYS 180.A O no hydrogen 3.432 N/A ARG 185.A N ARG 181.A O no hydrogen 3.207 N/A ARG 185.A NE GLU 188.A OE1 no hydrogen 2.719 N/A ARG 185.A NH1 GLN 148.A OE1 no hydrogen 3.249 N/A ARG 185.A NH2 GLU 188.A OE1 no hydrogen 2.949 N/A ARG 185.A NH2 GLU 188.A OE2 no hydrogen 2.681 N/A ILE 186.A N VAL 182.A O no hydrogen 3.026 N/A LEU 187.A N ILE 183.A O no hydrogen 2.864 N/A GLU 188.A N GLN 184.A O no hydrogen 2.738 N/A GLU 188.A N ARG 185.A O no hydrogen 2.692 N/A HIS 189.A N ARG 185.A O no hydrogen 2.836 N/A CYS 190.A N ILE 186.A O no hydrogen 2.860 N/A CYS 190.A SG GLN 194.A OE1 no hydrogen 3.634 N/A LEU 191.A N GLN 194.A OE1 no hydrogen 3.337 N/A GLN 194.A NE2 PRO 156.A O no hydrogen 3.582 N/A GLN 194.A NE2 LEU 159.A O no hydrogen 3.108 N/A GLN 194.A NE2 GLN 160.A OE1 no hydrogen 3.230 N/A THR 195.A N LEU 191.A O no hydrogen 2.771 N/A THR 195.A OG1 LEU 191.A O no hydrogen 3.046 N/A THR 195.A OG1 PRO 192.A O no hydrogen 3.523 N/A LEU 196.A N ASP 193.A O no hydrogen 2.695 N/A LEU 199.A N THR 195.A O no hydrogen 3.053 N/A GLU 200.A N LEU 196.A O no hydrogen 2.922 N/A GLU 201.A N PRO 197.A O no hydrogen 3.209 N/A LEU 202.A N ILE 198.A O no hydrogen 3.003 N/A HIS 203.A N LEU 199.A O no hydrogen 2.777 N/A HIS 203.A NE2 ASP 230.A OD1 no hydrogen 2.923 N/A GLN 204.A N GLU 200.A O no hydrogen 2.919 N/A HIS 205.A N LEU 202.A O no hydrogen 3.135 N/A THR 206.A N HIS 203.A O no hydrogen 3.381 N/A GLN 208.A N GLN 208.A OE1 no hydrogen 2.648 N/A LEU 209.A N HIS 205.A O no hydrogen 2.840 N/A VAL 210.A N THR 206.A O no hydrogen 2.968 N/A GLN 211.A N GLN 208.A O no hydrogen 3.190 N/A GLN 211.A NE2 GLU 207.A O no hydrogen 3.156 N/A ASP 212.A N LEU 209.A O no hydrogen 3.066 N/A TYR 214.A N ASP 212.A OD1 no hydrogen 2.672 N/A GLY 215.A N ASP 212.A OD1 no hydrogen 2.909 N/A SER 216.A N ASP 212.A O no hydrogen 2.719 N/A VAL 218.A N TYR 214.A O no hydrogen 3.035 N/A ILE 219.A N GLY 215.A O no hydrogen 2.977 N/A ARG 220.A N SER 216.A O no hydrogen 3.125 N/A ARG 220.A NH2 SER 216.A OG no hydrogen 3.061 N/A HIS 221.A N TYR 217.A O no hydrogen 2.977 N/A HIS 221.A NE2 GLU 188.A OE2 no hydrogen 2.844 N/A VAL 222.A N VAL 218.A O no hydrogen 3.308 N/A LEU 223.A N ILE 219.A O no hydrogen 2.859 N/A GLU 224.A N ARG 220.A O no hydrogen 2.768 N/A GLU 224.A N HIS 221.A O no hydrogen 3.234 N/A HIS 225.A N HIS 221.A O no hydrogen 2.769 N/A GLY 226.A N VAL 222.A O no hydrogen 2.540 N/A LYS 231.A N ARG 227.A O no hydrogen 2.729 N/A LYS 231.A NZ LEU 223.A O no hydrogen 3.192 N/A SER 232.A N PRO 228.A O no hydrogen 3.087 N/A SER 232.A OG GLU 266.A OE2 no hydrogen 2.562 N/A LYS 233.A N GLU 229.A O no hydrogen 3.220 N/A ILE 234.A N ASP 230.A O no hydrogen 3.218 N/A VAL 235.A N LYS 231.A O no hydrogen 2.925 N/A ALA 236.A N SER 232.A O no hydrogen 2.716 N/A GLU 237.A N LYS 233.A O no hydrogen 2.994 N/A ILE 238.A N ILE 234.A O no hydrogen 3.125 N/A ARG 239.A N VAL 235.A O no hydrogen 2.845 N/A GLY 240.A N GLU 273.A OE1 no hydrogen 3.103 N/A GLY 240.A N GLU 273.A OE2 no hydrogen 2.558 N/A ASN 241.A N ILE 238.A O no hydrogen 2.554 N/A ASN 241.A ND2 GLU 237.A O no hydrogen 2.305 N/A ASN 241.A ND2 ILE 238.A O no hydrogen 3.201 N/A LEU 245.A N ASN 241.A O no hydrogen 2.872 N/A SER 246.A N VAL 242.A O no hydrogen 2.853 N/A SER 246.A OG VAL 242.A O no hydrogen 2.575 N/A HIS 248.A N LEU 245.A O no hydrogen 2.867 N/A PHE 250.A N HIS 248.A ND1 no hydrogen 2.921 N/A ALA 251.A N HIS 248.A ND1 no hydrogen 2.800 N/A SER 252.A N HIS 248.A O no hydrogen 3.008 N/A SER 252.A OG HIS 248.A O no hydrogen 2.701 N/A SER 252.A OG LYS 249.A O no hydrogen 3.276 N/A ASN 253.A N PHE 250.A O no hydrogen 3.080 N/A ASN 253.A ND2 PHE 250.A O no hydrogen 3.450 N/A VAL 254.A N ALA 251.A O no hydrogen 3.023 N/A VAL 255.A N ALA 251.A O no hydrogen 2.897 N/A GLU 256.A N SER 252.A O no hydrogen 3.098 N/A LYS 257.A NZ GLU 224.A OE2 no hydrogen 2.753 N/A CYS 258.A N VAL 254.A O no hydrogen 2.625 N/A CYS 258.A N VAL 255.A O no hydrogen 2.692 N/A CYS 258.A SG VAL 254.A O no hydrogen 3.666 N/A VAL 259.A N VAL 255.A O no hydrogen 3.110 N/A THR 260.A N GLU 256.A O no hydrogen 2.941 N/A THR 260.A OG1 GLU 256.A O no hydrogen 2.989 N/A ALA 262.A N VAL 259.A O no hydrogen 3.429 N/A ARG 267.A N SER 263.A O no hydrogen 2.562 N/A ARG 267.A NH1 VAL 259.A O no hydrogen 2.613 N/A ALA 268.A N ARG 264.A O no hydrogen 2.862 N/A ALA 268.A N THR 265.A O no hydrogen 2.732 N/A VAL 269.A N THR 265.A O no hydrogen 2.714 N/A LEU 270.A N GLU 266.A O no hydrogen 2.782 N/A ASP 272.A N ALA 268.A O no hydrogen 2.877 N/A GLU 273.A N VAL 269.A O no hydrogen 2.791 N/A VAL 274.A N ILE 271.A O no hydrogen 2.773 N/A CYS 275.A N ASP 272.A O no hydrogen 3.054 N/A THR 276.A N ASP 272.A O no hydrogen 3.276 N/A THR 276.A OG1 ASP 272.A OD1 no hydrogen 3.127 N/A HIS 282.A N ASP 279.A O no hydrogen 3.152 N/A ALA 284.A N MET 277.A O no hydrogen 3.291 N/A THR 287.A OG1 ASP 279.A OD2 no hydrogen 1.965 N/A THR 287.A OG1 ALA 284.A O no hydrogen 3.422 N/A MET 289.A N LEU 285.A O no hydrogen 3.184 N/A LYS 290.A N TYR 286.A O no hydrogen 3.253 N/A ASP 291.A N MET 288.A O no hydrogen 2.360 N/A TYR 293.A N ASP 291.A OD2 no hydrogen 2.708 N/A ALA 294.A N ASP 291.A OD2 no hydrogen 2.407 N/A ASN 295.A N ASP 291.A O no hydrogen 3.086 N/A ASN 295.A ND2 ASP 291.A O no hydrogen 2.663 N/A ASN 295.A ND2 GLN 292.A O no hydrogen 2.367 N/A TYR 296.A N TYR 293.A O no hydrogen 2.974 N/A VAL 298.A N ALA 294.A O no hydrogen 2.731 N/A GLN 299.A N ASN 295.A O no hydrogen 3.153 N/A LYS 300.A N TYR 296.A O no hydrogen 3.267 N/A MET 301.A N VAL 297.A O no hydrogen 3.033 N/A ILE 302.A N GLN 299.A O no hydrogen 3.072 N/A ASP 303.A N GLN 299.A O no hydrogen 3.409 N/A VAL 304.A N LYS 300.A O no hydrogen 3.256 N/A ALA 305.A N MET 301.A O no hydrogen 2.642 N/A GLY 308.A N GLU 306.A OE1 no hydrogen 2.551 N/A GLN 309.A N GLU 306.A OE1 no hydrogen 3.386 N/A ARG 310.A N GLU 306.A O no hydrogen 2.405 N/A ARG 310.A NE ILE 302.A O no hydrogen 3.310 N/A ARG 310.A NH2 ASP 303.A O no hydrogen 3.186 N/A LYS 311.A N PRO 307.A O no hydrogen 2.853 N/A ILE 312.A N GLY 308.A O no hydrogen 2.990 N/A VAL 313.A N GLN 309.A O no hydrogen 2.819 N/A MET 314.A N ARG 310.A O no hydrogen 2.890 N/A HIS 315.A N LYS 311.A O no hydrogen 3.406 N/A LYS 316.A N VAL 313.A O no hydrogen 2.809 N/A ILE 317.A N MET 314.A O no hydrogen 3.016 N/A ARG 318.A N HIS 315.A O no hydrogen 3.202 N/A HIS 320.A N ILE 317.A O no hydrogen 2.565 N/A ILE 321.A N ILE 317.A O no hydrogen 2.826 N/A ILE 321.A N ARG 318.A O no hydrogen 2.721 N/A THR 323.A OG1 HIS 320.A O no hydrogen 2.424 N/A LEU 324.A N ILE 321.A O no hydrogen 2.996 N/A ARG 325.A N ALA 322.A O no hydrogen 3.276 N/A LYS 326.A NZ THR 323.A O no hydrogen 3.243 N/A TYR 327.A N LEU 324.A O no hydrogen 2.673 N/A GLY 330.A N TYR 327.A O no hydrogen 3.100 N/A ILE 333.A N GLY 330.A O no hydrogen 2.560 N/A ALA 335.A N LYS 331.A O no hydrogen 3.409 N/A LYS 336.A N HIS 332.A O no hydrogen 2.727 N/A LYS 336.A NZ ASP 303.A OD1 no hydrogen 2.667 N/A