Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2dfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N LYS 28.A O no hydrogen 3.402 N/A ALA 1.A N ASP 29.A OD1 no hydrogen 2.594 N/A THR 2.A N GLU 258.A OE1 no hydrogen 3.042 N/A THR 2.A OG1 GLU 258.A OE2 no hydrogen 2.993 N/A TYR 3.A N THR 30.A O no hydrogen 2.912 N/A LEU 4.A N LEU 255.A O no hydrogen 2.859 N/A ILE 5.A N TRP 32.A O no hydrogen 2.824 N/A GLY 10.A N LEU 37.A O no hydrogen 2.888 N/A CYS 11.A SG HIS 9.A O no hydrogen 3.167 N/A GLU 14.A N GLU 14.A OE1 no hydrogen 2.797 N/A LEU 15.A N CYS 11.A O no hydrogen 3.376 N/A ILE 16.A N TYR 12.A O no hydrogen 3.021 N/A ALA 17.A N ASP 13.A O no hydrogen 2.924 N/A LEU 18.A N GLU 14.A O no hydrogen 2.827 N/A LEU 19.A N LEU 15.A O no hydrogen 2.780 N/A HIS 20.A N ILE 16.A O no hydrogen 2.769 N/A LYS 21.A N ALA 17.A O no hydrogen 3.133 N/A LYS 21.A NZ VAL 264.A O no hydrogen 3.293 N/A LYS 21.A NZ GLN 265.A OE1 no hydrogen 2.874 N/A VAL 22.A N LEU 19.A O no hydrogen 3.424 N/A GLU 23.A N HIS 20.A O no hydrogen 2.779 N/A PHE 24.A N LEU 19.A O no hydrogen 2.916 N/A THR 25.A N ASP 29.A OD2 no hydrogen 2.795 N/A THR 25.A OG1 GLU 23.A O no hydrogen 2.930 N/A ASP 29.A N THR 25.A O no hydrogen 2.629 N/A THR 30.A N ALA 1.A O no hydrogen 2.942 N/A LEU 31.A N SER 57.A O no hydrogen 2.794 N/A TRP 32.A N TYR 3.A O no hydrogen 2.696 N/A LEU 33.A N ARG 59.A O no hydrogen 2.896 N/A THR 34.A N ILE 5.A O no hydrogen 3.150 N/A ASP 36.A N ASP 66.A OD2 no hydrogen 2.662 N/A LEU 37.A N ASP 66.A OD1 no hydrogen 2.928 N/A GLY 41.A N HIS 9.A O no hydrogen 3.105 N/A GLY 43.A N GLY 10.A O no hydrogen 2.624 N/A SER 44.A OG VAL 38.A O no hydrogen 2.873 N/A VAL 47.A N GLY 43.A O no hydrogen 3.096 N/A LEU 48.A N SER 44.A O no hydrogen 2.770 N/A ARG 49.A N LEU 45.A O no hydrogen 2.951 N/A ARG 49.A NE ASP 93.A OD1 no hydrogen 2.827 N/A ARG 49.A NH2 ASP 93.A OD1 no hydrogen 3.329 N/A ARG 49.A NH2 ASP 93.A OD2 no hydrogen 2.812 N/A TYR 50.A N ASP 46.A O no hydrogen 2.794 N/A VAL 51.A N VAL 47.A O no hydrogen 3.125 N/A LYS 52.A N LEU 48.A O no hydrogen 3.121 N/A LYS 52.A NZ GLU 96.A OE2 no hydrogen 2.798 N/A SER 53.A N ARG 49.A O no hydrogen 3.138 N/A SER 53.A OG TYR 50.A O no hydrogen 2.522 N/A LEU 54.A N VAL 51.A O no hydrogen 3.001 N/A GLY 55.A N LYS 52.A O no hydrogen 3.265 N/A SER 57.A N LEU 54.A O no hydrogen 2.895 N/A SER 57.A OG PRO 26.A O no hydrogen 2.763 N/A VAL 58.A N GLY 55.A O no hydrogen 2.881 N/A ARG 59.A NH2 ILE 109.A O no hydrogen 3.003 N/A VAL 61.A N LEU 33.A O no hydrogen 3.307 N/A LEU 62.A N PRO 105.A O no hydrogen 3.038 N/A GLY 63.A N ASP 66.A OD2 no hydrogen 2.806 N/A HIS 65.A N ASP 36.A OD1 no hydrogen 2.826 N/A HIS 65.A ND1 ASP 36.A OD2 no hydrogen 3.262 N/A LEU 67.A N GLY 63.A O no hydrogen 3.199 N/A HIS 68.A N ASN 64.A O no hydrogen 2.942 N/A LEU 69.A N HIS 65.A O no hydrogen 2.855 N/A LEU 70.A N ASP 66.A O no hydrogen 2.996 N/A ALA 71.A N LEU 67.A O no hydrogen 2.782 N/A VAL 72.A N HIS 68.A O no hydrogen 2.855 N/A PHE 73.A N LEU 69.A O no hydrogen 2.946 N/A ALA 74.A N LEU 70.A O no hydrogen 2.954 N/A GLY 75.A N VAL 72.A O no hydrogen 3.010 N/A ILE 76.A N ALA 71.A O no hydrogen 2.789 N/A SER 77.A N ALA 71.A O no hydrogen 3.271 N/A ASP 83.A N LYS 80.A O no hydrogen 2.763 N/A ARG 84.A N PRO 81.A O no hydrogen 3.179 N/A LEU 89.A N LEU 85.A O no hydrogen 2.770 N/A GLU 90.A N THR 86.A O no hydrogen 2.635 N/A ALA 91.A N LEU 88.A O no hydrogen 3.122 N/A ALA 94.A N ALA 91.A O no hydrogen 3.072 N/A LEU 97.A N ASP 93.A O no hydrogen 3.047 N/A LEU 98.A N ALA 94.A O no hydrogen 2.940 N/A ASN 99.A N ASP 95.A O no hydrogen 2.871 N/A TRP 100.A N GLU 96.A O no hydrogen 3.092 N/A TRP 100.A N LEU 97.A O no hydrogen 3.071 N/A LEU 101.A N LEU 97.A O no hydrogen 2.934 N/A ARG 102.A N LEU 98.A O no hydrogen 2.950 N/A ARG 102.A NE LEU 142.A O no hydrogen 3.081 N/A ARG 102.A NH2 LEU 142.A O no hydrogen 3.565 N/A ARG 103.A NH1 ASN 99.A O no hydrogen 2.680 N/A GLN 104.A N LEU 101.A O no hydrogen 2.973 N/A LEU 106.A N GLU 139.A OE2 no hydrogen 2.964 N/A GLN 108.A N MET 117.A O no hydrogen 2.821 N/A ASP 110.A N LEU 115.A O no hydrogen 2.992 N/A GLU 112.A N ASP 110.A OD1 no hydrogen 2.889 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.605 N/A LYS 113.A N ASP 110.A OD1 no hydrogen 3.233 N/A LYS 113.A NZ THR 2.A OG1 no hydrogen 2.838 N/A LYS 114.A N GLU 111.A O no hydrogen 3.223 N/A LYS 114.A NZ GLU 111.A OE1 no hydrogen 3.239 N/A LEU 115.A N ASP 110.A O no hydrogen 2.992 N/A VAL 116.A N SER 221.A O no hydrogen 2.851 N/A MET 117.A N GLN 108.A O no hydrogen 2.889 N/A HIS 119.A ND1 THR 34.A O no hydrogen 2.707 N/A HIS 119.A NE2 ASN 64.A OD1 no hydrogen 2.918 N/A ALA 120.A N PHE 179.A O no hydrogen 2.668 N/A TRP 126.A N THR 123.A O no hydrogen 3.044 N/A THR 130.A N ASP 127.A O no hydrogen 2.941 N/A THR 130.A N ASP 127.A OD2 no hydrogen 2.942 N/A THR 130.A OG1 ASP 127.A OD2 no hydrogen 2.904 N/A ALA 131.A N ASP 127.A O no hydrogen 3.075 N/A LYS 132.A N LEU 128.A O no hydrogen 2.835 N/A GLU 133.A N GLN 129.A O no hydrogen 3.108 N/A CYS 134.A N THR 130.A O no hydrogen 2.811 N/A CYS 134.A SG THR 130.A O no hydrogen 3.319 N/A ALA 135.A N ALA 131.A O no hydrogen 3.117 N/A ARG 136.A N LYS 132.A O no hydrogen 2.915 N/A ASP 137.A N GLU 133.A O no hydrogen 2.840 N/A VAL 138.A N CYS 134.A O no hydrogen 3.076 N/A GLU 139.A N ALA 135.A O no hydrogen 2.961 N/A ALA 140.A N ARG 136.A O no hydrogen 2.998 N/A VAL 141.A N ASP 137.A O no hydrogen 3.413 N/A LEU 142.A N VAL 138.A O no hydrogen 2.862 N/A SER 143.A N GLU 139.A O no hydrogen 2.741 N/A SER 143.A OG GLU 139.A O no hydrogen 3.097 N/A SER 144.A N VAL 141.A O no hydrogen 2.888 N/A SER 144.A OG VAL 141.A O no hydrogen 2.581 N/A TYR 147.A N SER 144.A O no hydrogen 3.155 N/A PHE 149.A N SER 146.A O no hydrogen 3.201 N/A LEU 151.A N TYR 147.A O no hydrogen 3.034 N/A ASP 152.A N PRO 148.A O no hydrogen 3.086 N/A ALA 153.A N PHE 149.A O no hydrogen 2.986 N/A MET 154.A N PHE 150.A O no hydrogen 2.884 N/A GLU 165.A N SER 163.A OG no hydrogen 3.110 N/A LEU 166.A N SER 163.A O no hydrogen 2.955 N/A ARG 167.A NE GLU 165.A O no hydrogen 3.096 N/A ARG 171.A N GLY 168.A O no hydrogen 2.905 N/A LEU 172.A N GLY 168.A O no hydrogen 3.318 N/A ARG 173.A N LEU 169.A O no hydrogen 3.304 N/A PHE 174.A N GLY 170.A O no hydrogen 3.344 N/A ILE 175.A N ARG 171.A O no hydrogen 3.178 N/A THR 176.A N LEU 172.A O no hydrogen 2.984 N/A THR 176.A OG1 LEU 172.A O no hydrogen 3.028 N/A ASN 177.A N ARG 173.A O no hydrogen 2.905 N/A ALA 178.A N PHE 174.A O no hydrogen 2.748 N/A PHE 179.A N ILE 175.A O no hydrogen 3.021 N/A THR 180.A N THR 176.A O no hydrogen 3.035 N/A THR 180.A OG1 THR 176.A O no hydrogen 2.738 N/A ARG 181.A N ASN 177.A O no hydrogen 2.900 N/A ARG 181.A NH1 ASP 157.A OD1 no hydrogen 3.167 N/A ARG 181.A NH2 ASP 157.A OD1 no hydrogen 3.410 N/A CYS 185.A N LYS 207.A O no hydrogen 3.022 N/A PHE 186.A N GLN 190.A O no hydrogen 3.047 N/A LEU 191.A N ASN 160.A O no hydrogen 3.019 N/A ASP 192.A N PHE 184.A O no hydrogen 3.229 N/A TYR 194.A N ASP 192.A OD2 no hydrogen 3.367 N/A TYR 194.A OH ASP 157.A OD2 no hydrogen 3.224 N/A SER 195.A N ASP 192.A OD2 no hydrogen 2.867 N/A GLU 201.A N SER 198.A O no hydrogen 3.078 N/A LYS 207.A N CYS 185.A O no hydrogen 3.047 N/A TRP 209.A N ARG 183.A O no hydrogen 2.713 N/A ALA 211.A N PRO 208.A O no hydrogen 2.674 N/A ILE 212.A N TRP 209.A O no hydrogen 3.280 N/A GLU 218.A N GLY 214.A O no hydrogen 3.099 N/A GLU 219.A N VAL 216.A O no hydrogen 2.870 N/A TYR 220.A N VAL 216.A O no hydrogen 2.592 N/A TYR 220.A OH GLU 111.A OE1 no hydrogen 2.709 N/A SER 221.A N LYS 114.A O no hydrogen 2.910 N/A ILE 222.A N GLY 238.A O no hydrogen 2.835 N/A ALA 223.A N VAL 116.A O no hydrogen 2.917 N/A PHE 224.A N TYR 240.A O no hydrogen 3.197 N/A GLY 225.A N HIS 119.A O no hydrogen 2.880 N/A SER 229.A OG LYS 196.A O no hydrogen 2.715 N/A LEU 230.A N TRP 227.A O no hydrogen 3.134 N/A GLU 231.A N ALA 228.A O no hydrogen 2.755 N/A LYS 233.A N LEU 230.A O no hydrogen 3.172 N/A ILE 239.A N PRO 236.A O no hydrogen 3.063 N/A TYR 240.A N ILE 222.A O no hydrogen 2.792 N/A LEU 242.A N PHE 224.A O no hydrogen 3.129 N/A THR 244.A OG1 THR 253.A OG1 no hydrogen 2.922 N/A GLY 245.A N ASP 243.A OD1 no hydrogen 2.800 N/A SER 251.A N THR 244.A O no hydrogen 3.098 N/A LEU 252.A N GLN 265.A O no hydrogen 2.794 N/A THR 253.A OG1 THR 244.A OG1 no hydrogen 2.922 N/A CYS 254.A N PHE 263.A O no hydrogen 2.850 N/A LEU 255.A N LEU 4.A O no hydrogen 2.916 N/A ARG 256.A N GLN 261.A O no hydrogen 3.012 N/A ARG 256.A NE TYR 3.A OH no hydrogen 3.194 N/A ARG 256.A NH1 ASP 259.A OD2 no hydrogen 2.579 N/A ARG 256.A NH1 GLN 261.A OE1 no hydrogen 3.378 N/A ARG 256.A NH2 TYR 3.A OH no hydrogen 3.488 N/A TRP 257.A N THR 2.A O no hydrogen 2.870 N/A LYS 260.A NZ TRP 257.A O no hydrogen 2.622 N/A GLN 261.A N ARG 256.A O no hydrogen 3.361 N/A PHE 263.A N CYS 254.A O no hydrogen 2.879 N/A GLN 265.A N LEU 252.A O no hydrogen 2.842 N/A SER 267.A OG TRP 248.A O no hydrogen 3.545 N/A SER 267.A OG GLY 249.A O no hydrogen 3.568 N/A SER 267.A OG GLY 250.A O no hydrogen 3.125 N/A