Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ij6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASN 52.A O no hydrogen 2.693 N/A LYS 3.A NZ THR 53.A OG1 no hydrogen 3.109 N/A LYS 3.A NZ ASP 272.A OD1 no hydrogen 2.718 N/A LYS 3.A NZ THR 276.A OG1 no hydrogen 2.967 N/A ILE 4.A N PHE 293.A O no hydrogen 2.725 N/A ASP 5.A N LYS 54.A O no hydrogen 2.839 N/A ALA 6.A N PHE 258.A O no hydrogen 3.074 N/A TYR 7.A N ASP 5.A OD1 no hydrogen 3.348 N/A TYR 7.A OH GLN 127.A OE1 no hydrogen 2.806 N/A ALA 8.A N VAL 56.A O no hydrogen 3.282 N/A HIS 9.A N ALA 262.A O no hydrogen 2.682 N/A HIS 9.A NE2 ASP 261.A OD1 no hydrogen 2.777 N/A ILE 10.A N SER 58.A O no hydrogen 2.858 N/A LEU 11.A N LEU 38.A O no hydrogen 2.753 N/A LYS 14.A N GLU 83.A OE1 no hydrogen 3.245 N/A TYR 15.A OH ILE 62.A O no hydrogen 2.531 N/A TYR 16.A N PRO 12.A O no hydrogen 2.957 N/A GLN 17.A N ALA 13.A O no hydrogen 3.106 N/A LYS 18.A N LYS 14.A O no hydrogen 3.131 N/A LYS 18.A NZ SER 79.A OG.A no hydrogen 3.029 N/A MET 19.A N TYR 15.A O no hydrogen 3.015 N/A LEU 20.A N TYR 16.A O no hydrogen 2.963 N/A SER 21.A N GLN 17.A O no hydrogen 3.397 N/A SER 21.A OG GLN 17.A O no hydrogen 3.357 N/A VAL 22.A N MET 19.A O no hydrogen 3.178 N/A GLU 23.A N MET 19.A O no hydrogen 2.895 N/A ILE 26.A N GLU 23.A O no hydrogen 3.432 N/A MET 29.A N ASN 25.A O no hydrogen 2.865 N/A PHE 30.A N ILE 26.A O no hydrogen 2.917 N/A LYS 34.A N PRO 31.A O no hydrogen 3.531 N/A ILE 35.A N PHE 32.A O no hydrogen 3.336 N/A THR 37.A OG1 PRO 268.A O no hydrogen 2.668 N/A LEU 38.A N ILE 35.A O no hydrogen 3.247 N/A ASP 40.A N LYS 36.A O no hydrogen 3.076 N/A ARG 44.A N ASP 40.A O no hydrogen 3.119 N/A ARG 44.A NE GLN 55.A OE1 no hydrogen 3.066 N/A ARG 44.A NH1 HIS 9.A O no hydrogen 2.641 N/A ARG 44.A NH1 GLN 55.A OE1 no hydrogen 2.881 N/A ARG 44.A NH2 HIS 9.A O no hydrogen 2.677 N/A ARG 44.A NH2 THR 37.A O no hydrogen 3.230 N/A LEU 45.A N LEU 41.A O no hydrogen 3.004 N/A THR 46.A N ASP 42.A O no hydrogen 2.897 N/A THR 46.A OG1 ASP 42.A O no hydrogen 2.687 N/A LYS 47.A N GLU 43.A O no hydrogen 2.960 N/A LYS 47.A NZ GLU 43.A OE2 no hydrogen 2.999 N/A TRP 48.A N LEU 45.A O no hydrogen 3.470 N/A TRP 48.A NE1 THR 53.A O no hydrogen 3.140 N/A GLN 51.A N GLN 51.A OE1 no hydrogen 2.812 N/A ASN 52.A N ASP 50.A OD1 no hydrogen 2.850 N/A THR 53.A N ASP 50.A O no hydrogen 3.098 N/A THR 53.A OG1 ASP 272.A OD1 no hydrogen 3.453 N/A THR 53.A OG1 ASP 272.A OD2 no hydrogen 3.167 N/A LYS 54.A N LYS 3.A O no hydrogen 2.875 N/A LYS 54.A NZ PRO 92.A O no hydrogen 3.442 N/A GLN 55.A N LYS 94.A O no hydrogen 2.874 N/A VAL 56.A N ASP 5.A O no hydrogen 2.775 N/A ILE 57.A N GLY 97.A O no hydrogen 3.001 N/A SER 58.A N ALA 8.A O no hydrogen 3.107 N/A SER 58.A OG ALA 8.A O no hydrogen 3.135 N/A SER 58.A OG HIS 9.A ND1 no hydrogen 3.396 N/A ALA 60.A N ILE 10.A O no hydrogen 3.404 N/A ILE 62.A N ALA 60.A O no hydrogen 2.651 N/A SER 63.A OG ASN 61.A OD1 no hydrogen 3.211 N/A ASP 66.A N SER 63.A O no hydrogen 3.162 N/A PHE 67.A N PRO 64.A O no hydrogen 3.172 N/A THR 68.A N PRO 64.A O no hydrogen 2.809 N/A THR 68.A OG1 PRO 64.A O no hydrogen 2.701 N/A LYS 71.A NZ GLU 75.A OE2 no hydrogen 2.855 N/A THR 72.A N ASP 69.A OD1 no hydrogen 3.022 N/A THR 72.A OG1 ASP 69.A OD1 no hydrogen 2.929 N/A THR 72.A OG1 ASP 69.A OD2 no hydrogen 3.176 N/A SER 73.A N ASP 69.A O no hydrogen 2.908 N/A SER 73.A OG ASN 105.A OD1 no hydrogen 2.952 N/A ALA 74.A N SER 70.A O no hydrogen 3.218 N/A GLU 75.A N LYS 71.A O no hydrogen 3.147 N/A LEU 76.A N THR 72.A O no hydrogen 2.934 N/A CYS 77.A N SER 73.A O no hydrogen 2.838 N/A CYS 77.A SG SER 73.A O no hydrogen 3.275 N/A GLN 78.A N ALA 74.A O no hydrogen 3.093 N/A SER 79.A N GLU 75.A O no hydrogen 3.125 N/A SER 79.A OG.B GLU 75.A O no hydrogen 3.191 N/A ALA 80.A N LEU 76.A O no hydrogen 2.956 N/A ASN 81.A N CYS 77.A O no hydrogen 2.836 N/A ASN 81.A ND2 ILE 101.A O no hydrogen 3.086 N/A GLU 82.A N GLN 78.A O no hydrogen 3.072 N/A GLU 83.A N SER 79.A O no hydrogen 3.154 N/A LEU 84.A N ALA 80.A O no hydrogen 2.740 N/A SER 85.A N ASN 81.A O no hydrogen 2.775 N/A SER 85.A OG ASP 120.A OD1 no hydrogen 2.664 N/A SER 85.A OG ASP 120.A OD2 no hydrogen 3.099 N/A ASN 86.A N GLU 82.A O no hydrogen 2.879 N/A LEU 87.A N GLU 83.A O no hydrogen 2.965 N/A VAL 88.A N LEU 84.A O no hydrogen 3.316 N/A ASP 89.A N SER 85.A O no hydrogen 3.052 N/A GLN 90.A N ASN 86.A O no hydrogen 2.802 N/A GLN 90.A NE2 ASN 86.A OD1 no hydrogen 3.392 N/A HIS 91.A N LEU 87.A O no hydrogen 3.085 N/A LYS 94.A N HIS 91.A O no hydrogen 3.185 N/A PHE 95.A N HIS 91.A O no hydrogen 3.014 N/A ALA 96.A N GLN 55.A O no hydrogen 2.917 N/A ALA 98.A N ASN 122.A O no hydrogen 2.817 N/A VAL 99.A N ILE 57.A O no hydrogen 2.755 N/A ALA 100.A N GLY 125.A O no hydrogen 2.824 N/A ILE 101.A N ASN 81.A OD1 no hydrogen 2.706 N/A MET 104.A N GLU 65.A OE1 no hydrogen 2.808 N/A ASN 106.A N PRO 103.A O no hydrogen 2.871 N/A ASN 106.A ND2 SER 70.A O no hydrogen 2.949 N/A SER 109.A N ASN 106.A OD1 no hydrogen 3.085 N/A ALA 110.A N ASN 106.A O no hydrogen 2.738 N/A CYS 111.A N ILE 107.A O no hydrogen 2.860 N/A CYS 111.A SG ILE 107.A O no hydrogen 3.589 N/A CYS 111.A SG PRO 144.A O no hydrogen 3.929 N/A LYS 112.A N GLU 108.A O no hydrogen 3.189 N/A VAL 113.A N SER 109.A O no hydrogen 2.982 N/A ILE 114.A N ALA 110.A O no hydrogen 3.166 N/A SER 115.A N CYS 111.A O no hydrogen 3.047 N/A SER 115.A OG CYS 111.A O no hydrogen 3.158 N/A SER 116.A N LYS 112.A O no hydrogen 2.815 N/A SER 116.A OG VAL 113.A O no hydrogen 2.824 N/A ILE 117.A N VAL 113.A O no hydrogen 3.205 N/A ILE 117.A N ILE 114.A O no hydrogen 3.321 N/A ASN 122.A N ASP 120.A OD2 no hydrogen 2.848 N/A ASN 122.A ND2 SER 85.A OG no hydrogen 3.306 N/A ASN 122.A ND2 ASP 120.A OD2 no hydrogen 3.346 N/A VAL 124.A N ALA 98.A O no hydrogen 2.914 N/A ALA 126.A N PRO 155.A O no hydrogen 3.330 N/A GLN 127.A N ALA 100.A O no hydrogen 2.812 N/A GLN 127.A NE2 LEU 59.A O no hydrogen 3.033 N/A ILE 128.A N TRP 157.A O no hydrogen 2.851 N/A PHE 129.A N HIS 132.A NE2 no hydrogen 2.865 N/A THR 130.A N HIS 159.A O no hydrogen 3.120 N/A ARG 131.A NH2 GLY 134.A O no hydrogen 3.049 N/A HIS 132.A N LYS 135.A O no hydrogen 2.832 N/A HIS 132.A ND1 GLU 65.A OE2 no hydrogen 2.719 N/A LYS 135.A N HIS 132.A O no hydrogen 2.895 N/A SER 136.A OG GLN 185.A OE1 no hydrogen 2.577 N/A ILE 137.A N THR 130.A O no hydrogen 3.057 N/A ALA 138.A N SER 136.A OG no hydrogen 3.048 N/A ASP 139.A N SER 136.A O no hydrogen 2.882 N/A GLU 141.A N ASP 139.A OD2 no hydrogen 3.028 N/A PHE 142.A N ASP 139.A O no hydrogen 3.047 N/A ARG 143.A N LYS 140.A O no hydrogen 3.187 N/A ARG 143.A NH1 SER 189.A O no hydrogen 3.196 N/A ARG 143.A NH2 SER 189.A OG no hydrogen 2.791 N/A VAL 145.A N PHE 142.A O no hydrogen 3.052 N/A ALA 147.A N ARG 143.A O no hydrogen 2.872 N/A GLN 148.A N PRO 144.A O no hydrogen 2.979 N/A GLN 148.A NE2 CYS 111.A O no hydrogen 3.527 N/A ALA 149.A N VAL 145.A O no hydrogen 3.234 N/A ALA 150.A N LEU 146.A O no hydrogen 3.011 N/A LYS 151.A N ALA 147.A O no hydrogen 2.889 N/A LYS 151.A NZ.A GLN 148.A OE1 no hydrogen 2.915 N/A LEU 152.A N GLN 148.A O no hydrogen 2.803 N/A HIS 153.A N ALA 150.A O no hydrogen 3.239 N/A VAL 154.A N ALA 149.A O no hydrogen 2.831 N/A LEU 156.A N LYS 199.A O no hydrogen 2.887 N/A TRP 157.A N ALA 126.A O no hydrogen 2.917 N/A TRP 157.A NE1 ALA 6.A O no hydrogen 2.581 N/A MET 158.A N LEU 201.A O no hydrogen 2.698 N/A HIS 159.A N ILE 128.A O no hydrogen 3.003 N/A VAL 161.A N THR 130.A OG1 no hydrogen 3.261 N/A ARG 165.A N ASP 163.A OD1 no hydrogen 3.031 N/A ARG 165.A NE ASP 163.A OD1 no hydrogen 3.086 N/A ARG 165.A NE ASP 163.A OD2 no hydrogen 3.056 N/A ARG 165.A NH2 ASP 163.A OD2 no hydrogen 2.760 N/A LYS 166.A N ASP 163.A O no hydrogen 3.119 N/A LYS 166.A NZ ASP 163.A OD2 no hydrogen 2.737 N/A LYS 166.A NZ GLU 178.A OE1 no hydrogen 3.412 N/A LYS 166.A NZ GLU 178.A OE2 no hydrogen 2.778 N/A ASN 169.A ND2 ASP 163.A O no hydrogen 2.886 N/A ASN 170.A N SER 174.A OG no hydrogen 2.900 N/A ASN 170.A ND2 ASP 168.A O no hydrogen 2.950 N/A VAL 172.A N ASN 170.A OD1 no hydrogen 3.062 N/A PHE 173.A N ASN 170.A OD1 no hydrogen 2.997 N/A SER 174.A OG ASN 170.A O no hydrogen 3.365 N/A TYR 177.A N PHE 173.A O no hydrogen 3.247 N/A GLU 178.A N SER 174.A O no hydrogen 3.117 N/A LEU 179.A N TRP 175.A O no hydrogen 3.082 N/A SER 180.A N GLU 176.A O no hydrogen 3.201 N/A SER 180.A OG GLU 176.A O no hydrogen 2.940 N/A GLN 181.A N TYR 177.A O no hydrogen 2.837 N/A ALA 182.A N GLU 178.A O no hydrogen 2.950 N/A MET 183.A N LEU 179.A O no hydrogen 2.954 N/A LEU 184.A N SER 180.A O no hydrogen 3.111 N/A GLN 185.A N GLN 181.A O no hydrogen 2.789 N/A LEU 186.A N ALA 182.A O no hydrogen 2.944 N/A VAL 187.A N MET 183.A O no hydrogen 2.861 N/A GLN 188.A N LEU 184.A O no hydrogen 2.859 N/A SER 189.A N GLN 185.A O no hydrogen 3.224 N/A SER 189.A N LEU 186.A O no hydrogen 3.257 N/A SER 189.A OG GLN 185.A O no hydrogen 2.731 N/A SER 189.A OG LEU 186.A O no hydrogen 2.933 N/A ASP 190.A N VAL 187.A O no hydrogen 3.099 N/A LEU 191.A N LEU 186.A O no hydrogen 3.171 N/A GLN 193.A NE2 ASP 227.A OD2 no hydrogen 2.844 N/A ASP 194.A N ASP 190.A O no hydrogen 3.154 N/A TYR 195.A N LEU 191.A O no hydrogen 2.715 N/A LEU 198.A N TYR 195.A O no hydrogen 3.186 N/A LYS 199.A NZ HIS 153.A O no hydrogen 3.391 N/A LYS 199.A NZ LEU 300.A O no hydrogen 2.747 N/A LEU 201.A N LEU 156.A O no hydrogen 2.670 N/A VAL 202.A N TYR 232.A O no hydrogen 2.747 N/A HIS 203.A N MET 158.A O no hydrogen 3.312 N/A HIS 203.A ND1 ASP 234.A OD2 no hydrogen 2.652 N/A HIS 203.A NE2 ASP 261.A OD1 no hydrogen 2.718 N/A HIS 204.A N ASP 234.A OD1 no hydrogen 2.826 N/A HIS 204.A ND1 ALA 236.A O no hydrogen 2.591 N/A ALA 207.A N HIS 204.A O no hydrogen 2.965 N/A MET 208.A N SER 180.A OG no hydrogen 3.244 N/A VAL 209.A N GLY 206.A O no hydrogen 3.050 N/A PHE 212.A N MET 208.A O no hydrogen 3.043 N/A ILE 216.A N PHE 212.A O no hydrogen 3.186 N/A ASP 217.A N SER 213.A O no hydrogen 2.826 N/A HIS 218.A N GLY 214.A O no hydrogen 3.182 N/A HIS 218.A ND1 GLY 214.A O no hydrogen 2.722 N/A ILE 219.A N ILE 216.A O no hydrogen 3.254 N/A LEU 220.A N ILE 216.A O no hydrogen 2.992 N/A HIS 224.A N ASP 221.A OD1 no hydrogen 3.014 N/A HIS 224.A ND1 ASP 221.A OD1 no hydrogen 2.700 N/A HIS 224.A ND1 ASP 221.A OD2 no hydrogen 3.281 N/A HIS 224.A NE2 ASP 190.A OD1 no hydrogen 2.666 N/A ALA 225.A N ASP 221.A O no hydrogen 2.990 N/A GLN 226.A N GLU 222.A O no hydrogen 3.102 N/A ASP 227.A N LYS 223.A O no hydrogen 3.224 N/A PHE 228.A N ALA 225.A O no hydrogen 3.350 N/A LYS 229.A N GLN 226.A O no hydrogen 3.142 N/A LYS 229.A NZ GLN 226.A OE1 no hydrogen 2.957 N/A LYS 230.A N ASP 227.A O no hydrogen 3.114 N/A LYS 230.A NZ ASP 227.A OD1 no hydrogen 3.447 N/A TYR 232.A N ILE 200.A O no hydrogen 2.951 N/A VAL 233.A N HIS 255.A O no hydrogen 2.695 N/A ASP 234.A N VAL 202.A O no hydrogen 2.992 N/A THR 235.A OG1 GLY 259.A O no hydrogen 3.071 N/A ALA 236.A N ASP 234.A OD1 no hydrogen 3.032 N/A ILE 237.A N THR 235.A O no hydrogen 2.896 N/A THR 241.A OG1 ALA 278.A O no hydrogen 2.779 N/A LEU 244.A N ASN 240.A O no hydrogen 3.052 N/A GLN 245.A N THR 241.A O no hydrogen 2.880 N/A GLN 245.A NE2 GLN 245.A O no hydrogen 3.207 N/A GLN 245.A NE2 ASP 249.A OD1 no hydrogen 2.841 N/A LEU 246.A N PRO 242.A O no hydrogen 2.973 N/A ALA 247.A N ALA 243.A O no hydrogen 2.997 N/A ILE 248.A N LEU 244.A O no hydrogen 3.048 N/A ASP 249.A N GLN 245.A O no hydrogen 2.878 N/A TYR 250.A N LEU 246.A O no hydrogen 3.091 N/A TYR 251.A N ALA 247.A O no hydrogen 2.880 N/A GLY 252.A N ILE 248.A O no hydrogen 2.759 N/A HIS 255.A N GLY 252.A O no hydrogen 3.165 N/A HIS 255.A ND1 PHE 231.A O no hydrogen 2.896 N/A LEU 257.A N VAL 233.A O no hydrogen 2.890 N/A PHE 258.A N ILE 292.A O no hydrogen 2.869 N/A GLY 259.A N THR 235.A OG1 no hydrogen 3.112 N/A THR 260.A N ASP 5.A OD1 no hydrogen 2.908 N/A THR 260.A OG1 ASP 5.A OD1 no hydrogen 3.259 N/A THR 260.A OG1 ASP 5.A OD2 no hydrogen 2.558 N/A ASP 261.A N TYR 7.A O no hydrogen 2.788 N/A ALA 262.A N THR 260.A OG1 no hydrogen 2.852 N/A PHE 264.A N ASP 261.A O no hydrogen 2.990 N/A VAL 266.A N PHE 264.A O no hydrogen 2.814 N/A SER 269.A OG LYS 47.A O no hydrogen 2.691 N/A GLY 270.A N VAL 266.A O no hydrogen 2.881 N/A ILE 275.A N ALA 271.A O no hydrogen 3.117 N/A THR 276.A N ASP 272.A O no hydrogen 2.801 N/A THR 276.A OG1 ASP 272.A O no hydrogen 2.781 N/A THR 276.A OG1 ASP 272.A OD1 no hydrogen 3.200 N/A GLN 277.A N GLN 273.A O no hydrogen 3.063 N/A GLN 277.A NE2 ASP 281.A OD1 no hydrogen 2.773 N/A GLN 277.A NE2 ASP 281.A OD2 no hydrogen 3.139 N/A ALA 278.A N ILE 274.A O no hydrogen 3.023 N/A ILE 279.A N ILE 275.A O no hydrogen 3.093 N/A ASN 280.A N THR 276.A O no hydrogen 2.903 N/A ASP 281.A N GLN 277.A O no hydrogen 2.874 N/A LEU 282.A N ILE 279.A O no hydrogen 3.107 N/A LYS 289.A N SER 285.A O no hydrogen 3.061 N/A LYS 289.A NZ ASN 280.A O no hydrogen 2.853 N/A LYS 289.A NZ LEU 282.A O no hydrogen 3.381 N/A GLN 290.A N ASP 286.A O no hydrogen 2.836 N/A GLN 290.A NE2 ASP 295.A OD2 no hydrogen 3.097 N/A LYS 291.A N LYS 287.A O no hydrogen 2.834 N/A LYS 291.A NZ ASP 254.A OD1 no hydrogen 2.660 N/A ILE 292.A N ASP 288.A O no hydrogen 3.121 N/A PHE 293.A N LYS 289.A O no hydrogen 2.843 N/A HIS 294.A N GLN 290.A O no hydrogen 2.888 N/A HIS 294.A ND1 ASP 295.A OD1 no hydrogen 2.906 N/A ASP 295.A N GLN 290.A O no hydrogen 3.122 N/A ASN 296.A N LYS 291.A O no hydrogen 2.834 N/A ASN 296.A ND2 ILE 253.A O no hydrogen 2.702 N/A ASN 296.A ND2 VAL 256.A O no hydrogen 2.847 N/A SER 299.A N ASP 295.A O no hydrogen 3.039 N/A SER 299.A OG ASP 295.A O no hydrogen 3.283 N/A LEU 300.A N ASN 296.A O no hydrogen 2.827 N/A ILE 301.A N TYR 297.A O no hydrogen 2.987 N/A LYS 302.A N TYR 298.A O no hydrogen 3.285 N/A