Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1dxj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N ASP 1.A OD2 no hydrogen 3.050 N/A SER 4.A N ASP 1.A O no hydrogen 3.347 N/A VAL 5.A N VAL 2.A O no hydrogen 3.056 N/A ILE 6.A N VAL 2.A O no hydrogen 3.181 N/A LEU 10.A N ASP 7.A OD1 no hydrogen 3.160 N/A PHE 11.A N ASP 7.A O no hydrogen 3.073 N/A ASP 12.A N ALA 8.A O no hydrogen 3.017 N/A GLN 13.A N SER 9.A O no hydrogen 2.860 N/A LEU 14.A N LEU 10.A O no hydrogen 2.829 N/A LEU 15.A N PHE 11.A O no hydrogen 2.948 N/A HIS 17.A ND1 ALA 81.A O no hydrogen 3.158 N/A ARG 18.A NE TYR 29.A O no hydrogen 2.958 N/A ARG 18.A NH1 ASP 12.A OD1 no hydrogen 2.878 N/A ARG 18.A NH1 LEU 15.A O no hydrogen 2.739 N/A ARG 18.A NH2 ASP 12.A OD1 no hydrogen 3.133 N/A ARG 18.A NH2 ASP 12.A OD2 no hydrogen 3.479 N/A ASP 20.A N HIS 17.A O no hydrogen 3.109 N/A ALA 22.A N ASP 20.A OD1 no hydrogen 2.936 N/A CYS 23.A N ASP 20.A O no hydrogen 2.846 N/A CYS 23.A SG HIS 17.A O no hydrogen 3.346 N/A GLU 24.A N CYS 85.A O no hydrogen 2.850 N/A GLY 27.A N ASN 19.A OD1 no hydrogen 2.755 N/A PHE 28.A N GLY 25.A O no hydrogen 3.193 N/A TYR 29.A OH PHE 86.A O no hydrogen 2.868 N/A SER 30.A N PHE 28.A O no hydrogen 2.985 N/A TYR 31.A OH ILE 6.A O no hydrogen 2.702 N/A ALA 33.A N SER 30.A OG no hydrogen 3.090 N/A PHE 34.A N SER 30.A O no hydrogen 3.068 N/A VAL 35.A N TYR 31.A O no hydrogen 2.928 N/A THR 36.A N ASN 32.A O no hydrogen 2.983 N/A THR 36.A OG1 ASN 32.A O no hydrogen 2.627 N/A ALA 37.A N ALA 33.A O no hydrogen 3.045 N/A ALA 38.A N PHE 34.A O no hydrogen 2.899 N/A ARG 39.A N VAL 35.A O no hydrogen 3.146 N/A ARG 39.A NE ASP 1.A OD1 no hydrogen 2.919 N/A SER 40.A N ALA 37.A O no hydrogen 3.118 N/A PHE 41.A N ALA 38.A O no hydrogen 3.000 N/A PHE 44.A N PHE 41.A O no hydrogen 3.168 N/A GLY 45.A N GLU 56.A OE1 no hydrogen 2.928 N/A THR 46.A N GLY 43.A O no hydrogen 3.319 N/A THR 47.A OG1 GLY 43.A O no hydrogen 2.764 N/A THR 52.A N ASP 49.A O no hydrogen 3.063 N/A THR 52.A OG1 ASP 49.A OD1 no hydrogen 2.804 N/A ARG 53.A N ASP 49.A O no hydrogen 3.157 N/A ARG 53.A NE GLY 48.A O no hydrogen 2.740 N/A ARG 53.A NH2 GLY 48.A O no hydrogen 3.258 N/A LYS 54.A N THR 50.A O no hydrogen 3.030 N/A LYS 54.A NZ LEU 224.A O no hydrogen 3.101 N/A ARG 55.A N ASN 51.A O no hydrogen 2.847 N/A ARG 55.A NH1 TYR 217.A OH no hydrogen 2.920 N/A ARG 55.A NH1 SER 227.A O no hydrogen 2.861 N/A ARG 55.A NH2 SER 227.A O no hydrogen 2.812 N/A GLU 56.A N THR 52.A O no hydrogen 2.857 N/A VAL 57.A N ARG 53.A O no hydrogen 3.167 N/A ALA 58.A N LYS 54.A O no hydrogen 2.903 N/A ALA 59.A N ARG 55.A O no hydrogen 2.917 N/A PHE 60.A N GLU 56.A O no hydrogen 2.980 N/A LEU 61.A N VAL 57.A O no hydrogen 2.955 N/A ALA 62.A N ALA 58.A O no hydrogen 2.899 N/A GLN 63.A N ALA 59.A O no hydrogen 3.084 N/A GLN 63.A NE2 THR 193.A OG1 no hydrogen 2.965 N/A THR 64.A N PHE 60.A O no hydrogen 3.109 N/A THR 64.A OG1 PHE 60.A O no hydrogen 2.737 N/A THR 64.A OG1 LEU 61.A O no hydrogen 3.321 N/A THR 64.A OG1 TYR 84.A OH no hydrogen 2.767 N/A SER 65.A N LEU 61.A O no hydrogen 2.862 N/A SER 65.A OG LEU 61.A O no hydrogen 2.622 N/A SER 65.A OG TYR 220.A OH no hydrogen 2.769 N/A HIS 66.A N ALA 62.A O no hydrogen 3.101 N/A HIS 66.A ND1 ASP 212.A OD2 no hydrogen 2.640 N/A GLU 67.A N GLN 63.A O no hydrogen 3.273 N/A THR 68.A N THR 64.A O no hydrogen 3.205 N/A THR 68.A N SER 65.A O no hydrogen 3.304 N/A THR 68.A OG1 THR 64.A O no hydrogen 2.848 N/A THR 68.A OG1 SER 65.A O no hydrogen 3.509 N/A THR 69.A N HIS 66.A O no hydrogen 3.416 N/A GLY 70.A N TRP 82.A O no hydrogen 2.941 N/A GLY 71.A N THR 69.A OG1 no hydrogen 2.986 N/A ALA 72.A N SER 75.A OG no hydrogen 2.891 N/A SER 75.A N ALA 72.A O no hydrogen 3.148 N/A SER 75.A OG ALA 72.A O no hydrogen 3.042 N/A GLY 78.A N SER 75.A O no hydrogen 2.829 N/A ALA 81.A N GLY 78.A O no hydrogen 3.346 N/A TRP 82.A N PRO 79.A O no hydrogen 3.468 N/A TRP 82.A NE1 PRO 76.A O no hydrogen 2.817 N/A TYR 84.A N THR 68.A OG1 no hydrogen 2.941 N/A TYR 84.A OH THR 64.A OG1 no hydrogen 2.767 N/A CYS 85.A N THR 68.A O no hydrogen 2.982 N/A CYS 85.A SG ALA 22.A O no hydrogen 3.961 N/A PHE 86.A N THR 68.A O no hydrogen 2.994 N/A VAL 87.A N GLU 24.A OE1 no hydrogen 2.773 N/A THR 88.A N GLU 24.A OE1 no hydrogen 2.986 N/A THR 88.A OG1 GLU 24.A OE1 no hydrogen 3.530 N/A THR 88.A OG1 GLU 24.A OE2 no hydrogen 2.709 N/A GLU 89.A N GLY 111.A O no hydrogen 2.967 N/A ARG 90.A NH1 THR 88.A O no hydrogen 3.059 N/A LYS 92.A NZ THR 88.A OG1 no hydrogen 2.900 N/A LYS 92.A NZ GLU 89.A O no hydrogen 2.734 N/A SER 93.A N ASP 91.A OD1 no hydrogen 3.034 N/A SER 93.A OG ASP 91.A OD1 no hydrogen 2.877 N/A LYS 95.A NZ LYS 107.A O no hydrogen 2.719 N/A TYR 96.A N ASN 94.A OD1 no hydrogen 3.201 N/A TYR 96.A OH GLU 89.A OE2 no hydrogen 2.880 N/A CYS 97.A SG LYS 95.A O no hydrogen 3.921 N/A ASP 98.A N ASN 120.A OD1 no hydrogen 2.917 N/A THR 101.A N ASP 98.A O no hydrogen 3.267 N/A LYS 107.A N PRO 104.A O no hydrogen 3.341 N/A LYS 107.A NZ ASN 136.A O no hydrogen 2.917 N/A TYR 109.A N LYS 95.A O no hydrogen 2.733 N/A TYR 109.A OH ILE 135.A O no hydrogen 2.605 N/A GLY 111.A N GLU 89.A OE1 no hydrogen 2.856 N/A ARG 112.A N LEU 117.A O no hydrogen 3.300 N/A ARG 112.A NH1 SER 108.A O no hydrogen 2.898 N/A ARG 112.A NH1 TYR 123.A OH no hydrogen 3.030 N/A ARG 112.A NH2 SER 108.A O no hydrogen 3.135 N/A ARG 112.A NH2 ASP 139.A OD1 no hydrogen 3.175 N/A GLY 113.A N VAL 87.A O no hydrogen 2.816 N/A GLN 116.A N GLY 113.A O no hydrogen 2.936 N/A GLN 116.A NE2 VAL 87.A O no hydrogen 2.952 N/A GLN 116.A NE2 GLY 113.A O no hydrogen 2.863 N/A LEU 117.A N ARG 112.A O no hydrogen 3.035 N/A THR 118.A OG1 GLN 116.A O no hydrogen 2.891 N/A HIS 119.A N TYR 109.A O no hydrogen 2.898 N/A HIS 119.A ND1 ASP 98.A OD1 no hydrogen 2.951 N/A ASN 120.A N TYR 96.A O no hydrogen 2.963 N/A ASN 120.A ND2 ASP 98.A O no hydrogen 3.256 N/A ASN 120.A ND2 PRO 102.A O no hydrogen 2.917 N/A ASN 122.A N HIS 119.A O no hydrogen 3.022 N/A ASN 122.A ND2 THR 118.A O no hydrogen 2.940 N/A TYR 123.A N HIS 119.A O no hydrogen 3.162 N/A TYR 123.A OH TYR 110.A O no hydrogen 2.824 N/A TYR 123.A OH LEU 117.A O no hydrogen 2.905 N/A ALA 124.A N ASN 120.A O no hydrogen 2.915 N/A GLN 125.A N TYR 121.A O no hydrogen 3.071 N/A ALA 126.A N ASN 122.A O no hydrogen 2.983 N/A GLY 127.A N TYR 123.A O no hydrogen 2.822 N/A ARG 128.A N ALA 124.A O no hydrogen 3.042 N/A ALA 129.A N GLN 125.A O no hydrogen 3.140 N/A LEU 130.A N ALA 126.A O no hydrogen 2.956 N/A VAL 132.A N GLY 127.A O no hydrogen 3.051 N/A ASN 136.A N ASP 133.A OD1 no hydrogen 3.082 N/A ASN 136.A ND2 ASP 133.A OD2 no hydrogen 2.917 N/A ASN 137.A N ASP 133.A O no hydrogen 3.240 N/A ASN 137.A ND2 ASP 133.A O no hydrogen 3.155 N/A LEU 140.A N ASN 137.A O no hydrogen 3.125 N/A VAL 141.A N PRO 138.A O no hydrogen 3.164 N/A ALA 142.A N ASP 139.A O no hydrogen 2.941 N/A ARG 143.A N LEU 140.A O no hydrogen 3.157 N/A ASP 144.A N LEU 140.A O no hydrogen 2.809 N/A ILE 147.A N ASP 144.A OD1 no hydrogen 3.068 N/A SER 148.A N ASP 144.A O no hydrogen 2.859 N/A SER 148.A OG VAL 141.A O no hydrogen 2.686 N/A PHE 149.A N ALA 145.A O no hydrogen 3.063 N/A LYS 150.A N VAL 146.A O no hydrogen 2.881 N/A LYS 150.A NZ SER 40.A OG no hydrogen 3.404 N/A THR 151.A N ILE 147.A O no hydrogen 2.909 N/A THR 151.A OG1 SER 148.A O no hydrogen 2.828 N/A ILE 153.A N PHE 149.A O no hydrogen 2.959 N/A TRP 154.A N LYS 150.A O no hydrogen 2.808 N/A PHE 155.A N THR 151.A O no hydrogen 3.114 N/A TRP 156.A N ALA 152.A O no hydrogen 3.060 N/A TRP 156.A NE1 GLU 56.A OE2 no hydrogen 2.850 N/A MET 157.A N ILE 153.A O no hydrogen 2.986 N/A MET 157.A N TRP 154.A O no hydrogen 3.131 N/A THR 158.A N PHE 155.A O no hydrogen 3.325 N/A THR 158.A OG1 TRP 154.A O no hydrogen 2.693 N/A GLN 160.A N LYS 163.A O no hydrogen 3.037 N/A GLN 160.A NE2 GLN 125.A OE1 no hydrogen 3.596 N/A LYS 163.A N GLN 160.A O no hydrogen 2.890 N/A HIS 167.A N TRP 156.A O no hydrogen 3.115 N/A HIS 167.A ND1 GLU 56.A OE2 no hydrogen 2.564 N/A ASP 168.A N SER 165.A OG no hydrogen 3.011 N/A VAL 169.A N SER 165.A O no hydrogen 3.292 N/A ILE 170.A N CYS 166.A O no hydrogen 3.100 N/A THR 171.A N HIS 167.A O no hydrogen 3.142 N/A THR 171.A OG1 HIS 167.A O no hydrogen 2.850 N/A ASN 172.A N VAL 169.A O no hydrogen 3.176 N/A ARG 173.A N ASP 168.A O no hydrogen 2.854 N/A ARG 173.A NH1 ASP 168.A OD1 no hydrogen 2.766 N/A TRP 174.A N ASP 168.A O no hydrogen 3.098 N/A SER 177.A N ASP 180.A OD2 no hydrogen 2.733 N/A SER 177.A OG ASP 180.A OD2 no hydrogen 3.183 N/A ASP 180.A N SER 177.A OG no hydrogen 3.321 N/A VAL 181.A N SER 177.A O no hydrogen 3.035 N/A ALA 182.A N ALA 178.A O no hydrogen 2.931 N/A ALA 183.A N ALA 179.A O no hydrogen 3.045 N/A ASN 184.A N VAL 181.A O no hydrogen 3.070 N/A ASN 184.A ND2 ASP 236.A O no hydrogen 3.620 N/A ARG 185.A N ASP 180.A O no hydrogen 2.962 N/A ARG 185.A NE ASP 180.A OD1 no hydrogen 3.040 N/A ARG 185.A NH1 ARG 238.A O no hydrogen 2.968 N/A ARG 185.A NH2 ASP 180.A OD1 no hydrogen 2.979 N/A ARG 185.A NH2 GLY 242.A O no hydrogen 3.530 N/A GLY 190.A N ASN 231.A O no hydrogen 2.968 N/A THR 193.A N PHE 189.A O no hydrogen 3.127 N/A ASN 194.A N GLY 190.A O no hydrogen 2.955 N/A ASN 194.A ND2 GLN 237.A OE1 no hydrogen 3.016 N/A ASN 194.A ND2 ARG 238.A O no hydrogen 3.291 N/A ILE 195.A N VAL 191.A O no hydrogen 2.770 N/A ILE 196.A N ILE 192.A O no hydrogen 2.943 N/A ASN 197.A N THR 193.A O no hydrogen 2.791 N/A ASN 197.A ND2 GLU 201.A OE2 no hydrogen 3.039 N/A GLY 198.A N ASN 194.A O no hydrogen 2.885 N/A ILE 200.A N ASN 197.A O no hydrogen 3.221 N/A GLU 201.A N ASN 197.A O no hydrogen 3.027 N/A CYS 202.A N GLY 198.A O no hydrogen 3.014 N/A GLY 203.A N CYS 234.A O no hydrogen 2.860 N/A GLY 205.A N ARG 235.A O no hydrogen 3.327 N/A GLY 211.A N SER 207.A O no hydrogen 2.941 N/A ASP 212.A N PRO 208.A O no hydrogen 2.926 N/A ARG 213.A N ALA 209.A O no hydrogen 3.111 N/A ARG 213.A NE GLU 201.A OE1 no hydrogen 2.806 N/A ARG 213.A NH1 GLN 63.A OE1 no hydrogen 2.758 N/A ARG 213.A NH1 GLU 67.A OE2 no hydrogen 2.829 N/A ARG 213.A NH2 GLU 67.A OE2 no hydrogen 2.795 N/A ARG 213.A NH2 GLU 201.A OE2 no hydrogen 2.838 N/A ILE 214.A N SER 210.A O no hydrogen 3.022 N/A GLY 215.A N GLY 211.A O no hydrogen 2.944 N/A PHE 216.A N ASP 212.A O no hydrogen 3.211 N/A TYR 217.A N ARG 213.A O no hydrogen 3.056 N/A LYS 218.A N ILE 214.A O no hydrogen 2.867 N/A ARG 219.A N GLY 215.A O no hydrogen 3.100 N/A ARG 219.A NH1 LEU 14.A O no hydrogen 2.900 N/A ARG 219.A NH1 TYR 80.A O no hydrogen 2.826 N/A ARG 219.A NH2 GLN 13.A O no hydrogen 2.926 N/A TYR 220.A N PHE 216.A O no hydrogen 2.915 N/A TYR 220.A OH SER 65.A OG no hydrogen 2.769 N/A CYS 221.A N TYR 217.A O no hydrogen 2.849 N/A CYS 221.A SG TYR 217.A O no hydrogen 3.313 N/A ASP 222.A N LYS 218.A O no hydrogen 2.904 N/A VAL 223.A N ARG 219.A O no hydrogen 3.048 N/A LEU 224.A N TYR 220.A O no hydrogen 2.967 N/A HIS 225.A N ASP 222.A O no hydrogen 3.346 N/A LEU 226.A N CYS 221.A O no hydrogen 2.787 N/A TYR 228.A OH ASP 222.A OD1 no hydrogen 2.691 N/A TYR 228.A OH ASP 222.A OD2 no hydrogen 3.100 N/A ASN 231.A ND2 PRO 187.A O no hydrogen 3.038 N/A CYS 234.A SG GLU 201.A O no hydrogen 3.768 N/A GLN 237.A N CYS 234.A O no hydrogen 3.147 N/A ARG 238.A N ALA 183.A O no hydrogen 3.029 N/A PHE 240.A N ASN 194.A OD1 no hydrogen 3.310 N/A