Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ik4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 2.A N THR 5.A OG1 no hydrogen 3.037 N/A THR 4.A OG1 ASP 72.A OD2 no hydrogen 2.573 N/A THR 5.A N LEU 2.A O no hydrogen 2.636 N/A THR 5.A OG1 LEU 2.A O no hydrogen 2.993 N/A ILE 6.A N ALA 71.A O no hydrogen 2.837 N/A GLN 7.A N GLN 32.A O no hydrogen 3.217 N/A ALA 8.A N GLN 32.A O no hydrogen 3.442 N/A SER 10.A N LYS 30.A O no hydrogen 3.012 N/A GLU 12.A N LEU 28.A O no hydrogen 3.122 N/A ILE 14.A N ASN 26.A O no hydrogen 2.813 N/A LEU 16.A N ALA 24.A O no hydrogen 3.052 N/A LEU 18.A N ALA 22.A O no hydrogen 3.131 N/A THR 19.A N PHE 319.A O no hydrogen 2.810 N/A ALA 24.A N LEU 16.A O no hydrogen 2.810 N/A ASN 26.A N ILE 14.A O no hydrogen 2.855 N/A ASN 26.A ND2 GLU 42.A OE2 no hydrogen 2.902 N/A ASN 26.A ND2 VAL 290.A O no hydrogen 2.844 N/A VAL 27.A N ALA 43.A O no hydrogen 2.889 N/A LEU 28.A N GLU 12.A O no hydrogen 2.854 N/A VAL 29.A N GLY 41.A O no hydrogen 2.718 N/A LYS 30.A N SER 10.A O no hydrogen 2.891 N/A VAL 31.A N GLY 39.A O no hydrogen 2.851 N/A GLN 32.A N ALA 8.A O no hydrogen 2.756 N/A LEU 33.A N THR 37.A O no hydrogen 2.963 N/A ALA 34.A N THR 5.A O no hydrogen 2.950 N/A ASP 35.A N PRO 3.A O no hydrogen 3.157 N/A GLY 36.A N LEU 33.A O no hydrogen 2.839 N/A THR 37.A N ASP 35.A OD1 no hydrogen 3.345 N/A THR 37.A OG1 ASP 35.A OD1 no hydrogen 3.126 N/A GLY 39.A N VAL 31.A O no hydrogen 2.783 N/A LEU 40.A N ASP 103.A OD2 no hydrogen 2.795 N/A GLY 41.A N VAL 29.A O no hydrogen 2.886 N/A ALA 43.A N VAL 27.A O no hydrogen 2.818 N/A GLN 54.A NE2 ASN 15.A OD1 no hydrogen 2.924 N/A GLN 54.A NE2 ASN 26.A O no hydrogen 2.763 N/A GLY 56.A N THR 53.A OG1 no hydrogen 2.803 N/A THR 57.A N THR 53.A O no hydrogen 2.950 N/A THR 57.A OG1 THR 53.A O no hydrogen 2.843 N/A SER 58.A N GLN 54.A O no hydrogen 3.010 N/A SER 58.A OG GLN 54.A O no hydrogen 3.131 N/A ALA 59.A N THR 55.A O no hydrogen 3.300 N/A ALA 60.A N GLY 56.A O no hydrogen 3.174 N/A ILE 61.A N THR 57.A O no hydrogen 3.103 N/A GLU 62.A N SER 58.A O no hydrogen 3.023 N/A ARG 63.A N ALA 59.A O no hydrogen 3.042 N/A ARG 63.A NE GLU 87.A OE1 no hydrogen 3.045 N/A ARG 63.A NE GLU 87.A OE2 no hydrogen 3.326 N/A ARG 63.A NH2 GLU 87.A OE2 no hydrogen 3.024 N/A LEU 64.A N ALA 60.A O no hydrogen 2.903 N/A GLN 65.A NE2 ILE 9.A O no hydrogen 2.846 N/A SER 66.A OG HIS 67.A ND1 no hydrogen 3.341 N/A HIS 67.A N LEU 64.A O no hydrogen 3.163 N/A LEU 68.A N GLN 65.A O no hydrogen 3.034 N/A LEU 69.A N GLN 65.A O no hydrogen 2.989 N/A GLY 70.A N ILE 6.A O no hydrogen 2.626 N/A ALA 71.A N LEU 68.A O no hydrogen 3.140 N/A VAL 73.A N THR 4.A O no hydrogen 2.836 N/A ARG 74.A N ASP 72.A OD2 no hydrogen 3.282 N/A ARG 74.A NH2 THR 4.A OG1 no hydrogen 3.181 N/A ARG 74.A NH2 ASP 72.A OD2 no hydrogen 3.320 N/A GLY 75.A N ASP 72.A O no hydrogen 3.224 N/A LEU 79.A N GLY 75.A O no hydrogen 2.964 N/A ALA 80.A N TRP 76.A O no hydrogen 3.007 N/A ALA 81.A N ARG 77.A O no hydrogen 3.215 N/A MET 82.A N LYS 78.A O no hydrogen 3.133 N/A LEU 83.A N LEU 79.A O no hydrogen 3.034 N/A ASP 84.A N ALA 80.A O no hydrogen 3.311 N/A HIS 85.A N ALA 81.A O no hydrogen 3.020 N/A ALA 86.A N MET 82.A O no hydrogen 2.978 N/A GLU 87.A N LEU 83.A O no hydrogen 2.877 N/A HIS 88.A ND1 ASP 84.A OD2 no hydrogen 2.795 N/A ALA 90.A N GLU 87.A O no hydrogen 3.339 N/A ALA 92.A N GLU 52.A OE2 no hydrogen 3.068 N/A ARG 94.A N ALA 90.A O no hydrogen 2.987 N/A ARG 94.A NE GLU 87.A O no hydrogen 2.991 N/A ARG 94.A NH1 HIS 88.A O no hydrogen 2.712 N/A CYS 95.A N ALA 91.A O no hydrogen 2.789 N/A GLY 96.A N ALA 92.A O no hydrogen 3.001 N/A LEU 97.A N ALA 93.A O no hydrogen 3.093 N/A GLU 98.A N ARG 94.A O no hydrogen 2.778 N/A MET 99.A N CYS 95.A O no hydrogen 2.768 N/A ALA 100.A N GLY 96.A O no hydrogen 2.906 N/A MET 101.A N LEU 97.A O no hydrogen 2.958 N/A LEU 102.A N GLU 98.A O no hydrogen 3.048 N/A ASP 103.A N MET 99.A O no hydrogen 2.962 N/A ALA 104.A N ALA 100.A O no hydrogen 2.927 N/A LEU 105.A N MET 101.A O no hydrogen 2.909 N/A THR 106.A N LEU 102.A O no hydrogen 2.983 N/A THR 106.A OG1 LEU 102.A O no hydrogen 2.709 N/A THR 106.A OG1 ASP 103.A O no hydrogen 3.416 N/A ARG 107.A N ASP 103.A O no hydrogen 2.953 N/A ARG 107.A NE ASP 103.A OD1 no hydrogen 2.887 N/A ARG 107.A NE ASP 103.A OD2 no hydrogen 3.122 N/A ARG 107.A NH1 ASN 347.A OD1 no hydrogen 2.796 N/A ARG 107.A NH2 HIS 344.A ND1 no hydrogen 3.548 N/A HIS 108.A N ALA 104.A O no hydrogen 2.898 N/A HIS 108.A ND1 ASP 35.A OD2 no hydrogen 3.066 N/A TYR 109.A N LEU 105.A O no hydrogen 3.293 N/A HIS 110.A N ARG 107.A O no hydrogen 3.218 N/A MET 111.A N THR 106.A O no hydrogen 2.727 N/A LEU 113.A N GLY 343.A O no hydrogen 2.883 N/A HIS 114.A N ASN 301.A OD1 no hydrogen 2.955 N/A HIS 114.A NE2 ALA 339.A O no hydrogen 2.892 N/A VAL 115.A N PRO 112.A O no hydrogen 3.173 N/A PHE 116.A N PRO 112.A O no hydrogen 3.084 N/A PHE 117.A N LEU 113.A O no hydrogen 3.005 N/A GLY 118.A N VAL 115.A O no hydrogen 3.239 N/A GLY 119.A N HIS 114.A O no hydrogen 2.765 N/A VAL 120.A N GLY 305.A O no hydrogen 3.165 N/A SER 121.A N ALA 304.A O no hydrogen 2.940 N/A SER 121.A OG ALA 304.A O no hydrogen 2.878 N/A LEU 124.A N LEU 336.A O no hydrogen 2.972 N/A THR 126.A N GLY 334.A O no hydrogen 2.838 N/A THR 126.A OG1 ASP 127.A O no hydrogen 2.981 N/A THR 126.A OG1 ILE 312.A O no hydrogen 3.170 N/A ASP 127.A N ILE 312.A O no hydrogen 2.947 N/A THR 129.A N ASP 315.A OD1 no hydrogen 2.844 N/A THR 129.A OG1 ASP 315.A OD1 no hydrogen 2.889 N/A ILE 130.A N LYS 154.A O no hydrogen 2.902 N/A THR 131.A OG1 GLU 20.A OE1 no hydrogen 3.078 N/A HIS 137.A N ASP 134.A OD1 no hydrogen 2.845 N/A HIS 137.A ND1 ASP 134.A OD1 no hydrogen 3.083 N/A ALA 139.A N GLU 135.A O no hydrogen 3.438 N/A ALA 140.A N VAL 136.A O no hydrogen 3.276 N/A SER 141.A N HIS 137.A O no hydrogen 2.909 N/A SER 141.A OG HIS 137.A O no hydrogen 2.728 N/A ALA 142.A N ALA 138.A O no hydrogen 2.936 N/A LYS 143.A N ALA 139.A O no hydrogen 3.071 N/A ALA 144.A N ALA 140.A O no hydrogen 2.937 N/A ILE 145.A N SER 141.A O no hydrogen 2.851 N/A LEU 146.A N ALA 142.A O no hydrogen 3.297 N/A ALA 147.A N LYS 143.A O no hydrogen 3.056 N/A ARG 148.A N ILE 145.A O no hydrogen 3.142 N/A GLY 149.A N LEU 146.A O no hydrogen 3.345 N/A ILE 153.A N PRO 180.A O no hydrogen 3.208 N/A LYS 154.A N MET 128.A O no hydrogen 2.714 N/A LYS 154.A NZ GLU 212.A OE1 no hydrogen 2.910 N/A LYS 154.A NZ ASP 313.A OD1 no hydrogen 2.779 N/A VAL 155.A N ILE 182.A O no hydrogen 2.789 N/A THR 157.A N ASP 184.A O no hydrogen 2.844 N/A THR 157.A OG1 ASP 184.A O no hydrogen 3.523 N/A THR 157.A OG1 TYR 189.A OH no hydrogen 2.824 N/A GLY 159.A N ASP 165.A OD2 no hydrogen 3.019 N/A TYR 164.A N ASP 161.A OD2 no hydrogen 2.733 N/A ASP 165.A N ASP 161.A O no hydrogen 2.969 N/A LEU 166.A N VAL 162.A O no hydrogen 2.845 N/A ALA 167.A N ALA 163.A O no hydrogen 3.055 N/A ARG 168.A N TYR 164.A O no hydrogen 2.986 N/A LEU 169.A N ASP 165.A O no hydrogen 3.018 N/A ARG 170.A N LEU 166.A O no hydrogen 2.782 N/A ARG 170.A NE GLU 204.A OE1 no hydrogen 2.883 N/A ARG 170.A NE GLU 204.A OE2 no hydrogen 3.011 N/A ARG 170.A NH1 GLU 204.A OE2 no hydrogen 2.698 N/A ALA 171.A N ALA 167.A O no hydrogen 3.269 N/A ILE 172.A N ARG 168.A O no hydrogen 3.131 N/A HIS 173.A N LEU 169.A O no hydrogen 2.758 N/A GLN 174.A N ARG 170.A O no hydrogen 2.812 N/A ALA 175.A N ALA 171.A O no hydrogen 2.839 N/A ALA 176.A N ILE 172.A O no hydrogen 2.875 N/A LEU 181.A N PRO 207.A O no hydrogen 2.915 N/A ILE 182.A N ILE 153.A O no hydrogen 2.943 N/A VAL 183.A N LEU 210.A O no hydrogen 2.831 N/A ASP 184.A N VAL 155.A O no hydrogen 2.735 N/A GLY 185.A N GLU 212.A O no hydrogen 2.910 N/A ASN 186.A N ASP 184.A OD1 no hydrogen 2.957 N/A CYS 187.A N GLN 213.A O no hydrogen 2.771 N/A CYS 187.A SG LEU 215.A O no hydrogen 3.758 N/A GLY 188.A N GLY 185.A O no hydrogen 3.068 N/A TYR 189.A N PRO 214.A O no hydrogen 2.816 N/A TYR 189.A OH THR 157.A OG1 no hydrogen 2.824 N/A ARG 193.A N ASP 190.A OD2 no hydrogen 3.083 N/A ARG 193.A NE GLY 159.A O no hydrogen 2.746 N/A ARG 193.A NH2 GLY 159.A O no hydrogen 3.470 N/A ARG 193.A NH2 GLY 188.A O no hydrogen 2.904 N/A ALA 194.A N ASP 190.A O no hydrogen 2.852 N/A LEU 195.A N VAL 191.A O no hydrogen 2.832 N/A ALA 196.A N GLU 192.A O no hydrogen 2.847 N/A PHE 197.A N ARG 193.A O no hydrogen 3.052 N/A CYS 198.A N ALA 194.A O no hydrogen 3.017 N/A CYS 198.A SG ALA 194.A O no hydrogen 3.241 N/A ALA 199.A N LEU 195.A O no hydrogen 2.793 N/A ALA 200.A N ALA 196.A O no hydrogen 3.222 N/A CYS 201.A N PHE 197.A O no hydrogen 3.161 N/A CYS 201.A SG PHE 197.A O no hydrogen 3.176 N/A LYS 202.A N CYS 198.A O no hydrogen 2.850 N/A LYS 202.A NZ GLY 231.A O no hydrogen 3.545 N/A ALA 203.A N ALA 199.A O no hydrogen 2.888 N/A GLU 204.A N ALA 200.A O no hydrogen 2.902 N/A SER 205.A N LYS 202.A O no hydrogen 3.061 N/A ILE 206.A N CYS 201.A O no hydrogen 2.637 N/A MET 208.A N ILE 206.A O no hydrogen 2.864 N/A VAL 209.A N LEU 181.A O no hydrogen 2.819 N/A PHE 211.A N ALA 233.A O no hydrogen 2.870 N/A GLU 212.A N VAL 183.A O no hydrogen 2.674 N/A GLN 213.A N ALA 235.A O no hydrogen 2.881 N/A GLN 213.A NE2 LEU 215.A O no hydrogen 3.063 N/A GLN 213.A NE2 SER 239.A OG no hydrogen 2.896 N/A ARG 217.A NH1 ASP 245.A OD2 no hydrogen 2.962 N/A ARG 217.A NH2 GLU 238.A O no hydrogen 3.025 N/A ARG 217.A NH2 ASP 245.A OD1 no hydrogen 3.012 N/A ASP 219.A N PRO 216.A O no hydrogen 3.142 N/A GLY 222.A N ASP 219.A OD2 no hydrogen 2.880 N/A MET 223.A N ASP 219.A O no hydrogen 2.962 N/A ALA 224.A N TRP 220.A O no hydrogen 3.050 N/A GLN 225.A N ALA 221.A O no hydrogen 2.913 N/A VAL 226.A N GLY 222.A O no hydrogen 3.032 N/A THR 227.A N MET 223.A O no hydrogen 2.934 N/A THR 227.A OG1 MET 223.A O no hydrogen 2.819 N/A THR 227.A OG1 THR 254.A O no hydrogen 2.838 N/A ALA 228.A N ALA 224.A O no hydrogen 2.840 N/A GLN 229.A N GLN 225.A O no hydrogen 2.988 N/A SER 230.A N VAL 226.A O no hydrogen 3.110 N/A SER 230.A OG VAL 226.A O no hydrogen 2.677 N/A PHE 232.A N SER 230.A OG no hydrogen 3.267 N/A VAL 234.A N SER 256.A OG no hydrogen 2.826 N/A ALA 235.A N PHE 211.A O no hydrogen 2.982 N/A ALA 236.A N VAL 257.A O no hydrogen 2.795 N/A ASP 237.A N GLN 213.A OE1 no hydrogen 2.763 N/A SER 239.A N GLN 213.A OE1 no hydrogen 3.086 N/A ALA 240.A N ASP 237.A O no hydrogen 2.922 N/A ARG 241.A N ASP 245.A OD1 no hydrogen 2.736 N/A ALA 243.A N GLU 269.A OE1 no hydrogen 2.890 N/A ASP 245.A N SER 242.A OG no hydrogen 3.021 N/A VAL 246.A N SER 242.A O no hydrogen 3.133 N/A LEU 247.A N ALA 243.A O no hydrogen 2.893 N/A ARG 248.A N HIS 244.A O no hydrogen 3.033 N/A ARG 248.A NE GLU 252.A OE1 no hydrogen 3.183 N/A ARG 248.A NE GLU 252.A OE2 no hydrogen 3.477 N/A ILE 249.A N ASP 245.A O no hydrogen 2.822 N/A ALA 250.A N VAL 246.A O no hydrogen 2.930 N/A ARG 251.A N LEU 247.A O no hydrogen 3.036 N/A GLU 252.A N ARG 248.A O no hydrogen 2.865 N/A THR 254.A N ILE 249.A O no hydrogen 3.046 N/A SER 256.A N VAL 234.A O no hydrogen 2.846 N/A SER 256.A OG VAL 234.A O no hydrogen 3.268 N/A VAL 257.A N VAL 234.A O no hydrogen 2.915 N/A ILE 258.A N GLY 283.A O no hydrogen 2.745 N/A ASN 259.A N ALA 236.A O no hydrogen 2.886 N/A ASN 259.A ND2 GLU 212.A OE2 no hydrogen 3.228 N/A ILE 260.A N MET 285.A O no hydrogen 2.746 N/A LYS 261.A NZ ASP 237.A OD2 no hydrogen 3.399 N/A LYS 261.A NZ GLY 288.A O no hydrogen 3.117 N/A LYS 264.A N LYS 261.A O no hydrogen 2.900 N/A GLY 266.A N LEU 262.A O no hydrogen 2.776 N/A VAL 267.A N GLU 98.A OE2 no hydrogen 3.200 N/A ALA 268.A N GLU 98.A OE2 no hydrogen 2.901 N/A GLY 270.A N GLY 266.A O no hydrogen 3.318 N/A LEU 271.A N VAL 267.A O no hydrogen 2.858 N/A LYS 272.A N ALA 268.A O no hydrogen 3.316 N/A MET 273.A N GLU 269.A O no hydrogen 3.080 N/A ILE 274.A N GLY 270.A O no hydrogen 3.027 N/A ALA 275.A N LEU 271.A O no hydrogen 3.340 N/A ILE 276.A N LYS 272.A O no hydrogen 2.963 N/A ALA 277.A N MET 273.A O no hydrogen 2.897 N/A GLN 278.A N ILE 274.A O no hydrogen 2.901 N/A ALA 279.A N ALA 275.A O no hydrogen 3.215 N/A ALA 280.A N ILE 276.A O no hydrogen 2.807 N/A GLY 281.A N GLN 278.A O no hydrogen 3.398 N/A LEU 282.A N ALA 277.A O no hydrogen 2.791 N/A GLY 283.A N SER 256.A O no hydrogen 2.930 N/A MET 285.A N ILE 258.A O no hydrogen 2.682 N/A ILE 286.A N PHE 311.A O no hydrogen 3.005 N/A GLY 287.A N ILE 260.A O no hydrogen 3.074 N/A MET 289.A N GLU 291.A OE1 no hydrogen 2.928 N/A GLU 291.A N THR 316.A OG1 no hydrogen 3.418 N/A SER 292.A N GLU 42.A OE2 no hydrogen 2.951 N/A SER 292.A OG GLU 42.A OE1 no hydrogen 2.691 N/A LEU 294.A N SER 292.A OG no hydrogen 2.973 N/A ALA 295.A N GLU 42.A OE1 no hydrogen 2.910 N/A MET 296.A N SER 292.A O no hydrogen 3.295 N/A SER 297.A N ILE 293.A O no hydrogen 3.003 N/A SER 297.A OG ILE 293.A O no hydrogen 2.638 N/A PHE 298.A N LEU 294.A O no hydrogen 3.285 N/A SER 299.A N ALA 295.A O no hydrogen 2.927 N/A SER 299.A OG ALA 295.A O no hydrogen 3.426 N/A ALA 300.A N MET 296.A O no hydrogen 2.859 N/A ASN 301.A N SER 297.A O no hydrogen 2.886 N/A ASN 301.A ND2 SER 297.A O no hydrogen 2.709 N/A LEU 302.A N PHE 298.A O no hydrogen 3.101 N/A LEU 302.A N SER 299.A O no hydrogen 3.239 N/A ALA 303.A N SER 299.A O no hydrogen 2.945 N/A ALA 304.A N ALA 300.A O no hydrogen 3.077 N/A GLY 305.A N ASN 301.A O no hydrogen 3.029 N/A ASN 306.A N LEU 302.A O no hydrogen 2.759 N/A GLY 307.A N ALA 303.A O no hydrogen 3.083 N/A ASP 310.A N LEU 284.A O no hydrogen 2.881 N/A PHE 311.A N LEU 284.A O no hydrogen 3.236 N/A ASP 313.A N ILE 286.A O no hydrogen 2.819 N/A LEU 314.A N THR 126.A OG1 no hydrogen 2.864 N/A THR 316.A OG1 GLU 291.A O no hydrogen 2.603 N/A LEU 318.A N ASP 315.A O no hydrogen 3.183 N/A PHE 319.A N THR 316.A O no hydrogen 2.864 N/A ILE 320.A N PRO 317.A O no hydrogen 3.390 N/A ALA 321.A N PRO 17.A O no hydrogen 2.783 N/A ILE 326.A N ASN 347.A O no hydrogen 2.742 N/A GLY 328.A N GLY 345.A O no hydrogen 2.870 N/A PHE 329.A N SER 297.A OG no hydrogen 3.037 N/A ALA 330.A N GLN 337.A O no hydrogen 2.784 N/A GLN 331.A NE2 GLY 333.A O no hydrogen 3.010 N/A THR 332.A N THR 335.A O no hydrogen 3.007 N/A THR 335.A N THR 332.A O no hydrogen 2.974 N/A THR 335.A OG1 GLU 125.A OE1 no hydrogen 2.820 N/A LEU 336.A N LEU 124.A O no hydrogen 2.727 N/A GLN 337.A N ALA 330.A O no hydrogen 2.703 N/A GLN 337.A NE2 GLN 123.A OE1 no hydrogen 3.439 N/A LEU 338.A N LYS 122.A O no hydrogen 2.695 N/A GLY 343.A N MET 111.A O no hydrogen 2.928 N/A HIS 344.A N ASP 103.A OD1 no hydrogen 3.084 N/A HIS 344.A NE2 LEU 40.A O no hydrogen 2.579 N/A VAL 346.A N HIS 344.A ND1 no hydrogen 3.188 N/A ASN 347.A N ILE 326.A O no hydrogen 2.731 N/A GLU 349.A N PRO 324.A O no hydrogen 3.063 N/A