Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6r49_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 2.915 N/A ASP 6.A N ALA 3.A O no hydrogen 3.028 N/A PHE 7.A N LEU 4.A O no hydrogen 2.960 N/A GLU 8.A N ARG 25.A O no hydrogen 2.964 N/A GLY 10.A N LEU 23.A O no hydrogen 2.809 N/A ARG 11.A NH1 PRO 12.A O no hydrogen 2.799 N/A LEU 13.A N VAL 21.A O no hydrogen 2.724 N/A GLY 16.A N GLY 19.A O no hydrogen 2.744 N/A ASN 20.A N VAL 37.A O no hydrogen 2.853 N/A VAL 21.A N GLY 14.A O no hydrogen 3.056 N/A TYR 22.A N LEU 35.A O no hydrogen 2.868 N/A LEU 23.A N ARG 11.A O no hydrogen 3.020 N/A ALA 24.A N LEU 33.A O no hydrogen 2.875 N/A ARG 25.A N GLU 8.A O no hydrogen 2.962 N/A ARG 25.A NH2 GLU 8.A OE1 no hydrogen 3.116 N/A GLU 26.A N PHE 31.A O no hydrogen 2.951 N/A LYS 27.A N ASP 6.A O no hydrogen 3.031 N/A LYS 27.A NZ GLU 5.A O no hydrogen 3.009 N/A GLN 28.A N GLU 26.A OE2 no hydrogen 3.080 N/A SER 29.A N GLU 26.A OE1 no hydrogen 2.661 N/A SER 29.A OG GLU 26.A OE1 no hydrogen 2.776 N/A LYS 30.A N GLU 26.A O no hydrogen 2.745 N/A PHE 31.A N SER 29.A OG no hydrogen 3.184 N/A LEU 33.A N ALA 24.A O no hydrogen 2.883 N/A ALA 34.A N LEU 84.A O no hydrogen 3.042 N/A LEU 35.A N TYR 22.A O no hydrogen 2.711 N/A LYS 36.A N LEU 82.A O no hydrogen 2.981 N/A LYS 36.A NZ GLU 55.A OE2 no hydrogen 2.894 N/A VAL 37.A N ASN 20.A O no hydrogen 2.915 N/A LEU 38.A N VAL 80.A O no hydrogen 2.810 N/A LYS 40.A N THR 78.A O no hydrogen 3.021 N/A LYS 40.A NZ HIS 75.A ND1 no hydrogen 2.882 N/A LYS 40.A NZ ASP 76.A O no hydrogen 2.876 N/A GLN 42.A NE2 LYS 17.A O no hydrogen 3.019 N/A LEU 43.A N PHE 39.A O no hydrogen 3.024 N/A GLU 44.A N LYS 40.A O no hydrogen 2.806 N/A LYS 45.A N ALA 41.A O no hydrogen 2.847 N/A ALA 46.A N GLN 42.A O no hydrogen 3.008 N/A GLY 47.A N GLU 44.A O no hydrogen 3.046 N/A VAL 48.A N LEU 43.A O no hydrogen 3.155 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.737 N/A LEU 52.A N VAL 48.A O no hydrogen 3.341 N/A ARG 53.A N GLU 49.A O no hydrogen 3.099 N/A ARG 54.A N HIS 50.A O no hydrogen 3.195 N/A ARG 54.A NE SER 152.A O no hydrogen 3.081 N/A GLU 55.A N GLN 51.A O no hydrogen 2.956 N/A VAL 56.A N LEU 52.A O no hydrogen 2.981 N/A GLU 57.A N ARG 53.A O no hydrogen 2.798 N/A ILE 58.A N ARG 54.A O no hydrogen 2.798 N/A GLN 59.A N GLU 55.A O no hydrogen 3.115 N/A GLN 59.A NE2 LEU 68.A O no hydrogen 3.003 N/A SER 60.A N VAL 56.A O no hydrogen 3.216 N/A SER 60.A OG VAL 56.A O no hydrogen 2.899 N/A SER 60.A OG GLU 57.A O no hydrogen 3.390 N/A HIS 61.A N ILE 58.A O no hydrogen 3.280 N/A HIS 61.A NE2 GLU 57.A OE2 no hydrogen 3.006 N/A LEU 62.A N ILE 58.A O no hydrogen 3.212 N/A ARG 63.A N TYR 120.A OH no hydrogen 3.166 N/A ARG 63.A NH2 SER 60.A O no hydrogen 3.413 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 3.038 N/A ASN 66.A ND2 LEU 144.A O no hydrogen 3.088 N/A ILE 67.A N HIS 64.A O no hydrogen 2.936 N/A LEU 68.A N ILE 146.A O no hydrogen 3.003 N/A ARG 69.A N GLU 85.A OE1 no hydrogen 2.896 N/A TYR 71.A N ILE 83.A O no hydrogen 2.820 N/A PHE 74.A N TYR 81.A O no hydrogen 3.135 N/A ASP 76.A N ARG 79.A O no hydrogen 2.961 N/A THR 78.A N ASP 76.A OD1 no hydrogen 3.007 N/A ARG 79.A N ASP 76.A OD1 no hydrogen 2.885 N/A ARG 79.A NE TYR 81.A OH no hydrogen 2.655 N/A ARG 79.A NH2 ASP 76.A OD2 no hydrogen 3.251 N/A VAL 80.A N LEU 38.A O no hydrogen 2.819 N/A TYR 81.A N PHE 74.A O no hydrogen 2.854 N/A TYR 81.A OH ASP 76.A OD2 no hydrogen 2.816 N/A LEU 82.A N LYS 36.A O no hydrogen 2.935 N/A ILE 83.A N GLY 72.A O no hydrogen 2.863 N/A LEU 84.A N ALA 34.A O no hydrogen 2.851 N/A GLU 85.A N ARG 69.A O no hydrogen 3.067 N/A LEU 89.A N LEU 138.A O no hydrogen 3.127 N/A VAL 92.A N LEU 136.A O no hydrogen 2.833 N/A ARG 94.A N THR 91.A OG1 no hydrogen 2.935 N/A GLU 95.A N THR 91.A O no hydrogen 3.286 N/A LEU 96.A N VAL 92.A O no hydrogen 2.943 N/A GLN 97.A N TYR 93.A O no hydrogen 3.117 N/A LYS 98.A N ARG 94.A O no hydrogen 2.985 N/A LYS 98.A NZ GLU 95.A OE1 no hydrogen 2.945 N/A LYS 98.A NZ GLU 95.A OE2 no hydrogen 3.069 N/A LEU 99.A N GLU 95.A O no hydrogen 3.133 N/A SER 100.A N LEU 96.A O no hydrogen 2.860 N/A PHE 102.A N PHE 191.A O no hydrogen 2.813 N/A GLN 105.A NE2 ASN 255.A OD1 no hydrogen 3.241 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 2.750 N/A THR 107.A N ASP 103.A O no hydrogen 3.091 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.960 N/A ALA 108.A N GLU 104.A O no hydrogen 2.909 N/A THR 109.A N GLN 105.A O no hydrogen 3.101 N/A THR 109.A OG1 GLN 105.A O no hydrogen 2.719 N/A TYR 110.A N ARG 106.A O no hydrogen 3.042 N/A ILE 111.A N THR 107.A O no hydrogen 2.894 N/A THR 112.A N ALA 108.A O no hydrogen 3.031 N/A THR 112.A OG1 ALA 108.A O no hydrogen 3.144 N/A THR 112.A OG1 SER 256.A OG no hydrogen 3.108 N/A GLU 113.A N THR 109.A O no hydrogen 3.185 N/A LEU 114.A N TYR 110.A O no hydrogen 2.985 N/A ALA 115.A N ILE 111.A O no hydrogen 2.755 N/A ASN 116.A N THR 112.A O no hydrogen 2.747 N/A ASN 116.A ND2 PRO 259.A O no hydrogen 3.138 N/A ALA 117.A N GLU 113.A O no hydrogen 2.979 N/A LEU 118.A N LEU 114.A O no hydrogen 2.842 N/A SER 119.A N ALA 115.A O no hydrogen 2.900 N/A TYR 120.A N ASN 116.A O no hydrogen 3.287 N/A CYS 121.A N ALA 117.A O no hydrogen 3.082 N/A CYS 121.A SG ALA 117.A O no hydrogen 3.502 N/A HIS 122.A N LEU 118.A O no hydrogen 2.895 N/A HIS 122.A NE2 ASP 180.A OD2 no hydrogen 2.909 N/A SER 123.A N SER 119.A O no hydrogen 3.094 N/A SER 123.A OG TYR 120.A O no hydrogen 2.642 N/A LYS 124.A N CYS 121.A O no hydrogen 2.901 N/A ARG 125.A N HIS 122.A O no hydrogen 2.765 N/A ARG 125.A NE GLU 177.A OE2 no hydrogen 2.789 N/A ARG 125.A NH2 GLU 177.A OE1 no hydrogen 3.280 N/A ARG 125.A NH2 GLU 177.A OE2 no hydrogen 3.299 N/A VAL 126.A N CYS 121.A O no hydrogen 2.984 N/A ILE 127.A N VAL 153.A O no hydrogen 3.101 N/A HIS 128.A N ASP 180.A OD2 no hydrogen 2.956 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 2.984 N/A ARG 129.A N ASP 180.A OD1 no hydrogen 3.009 N/A ARG 129.A NE TRP 151.A O no hydrogen 2.733 N/A ARG 129.A NH1 SER 158.A O no hydrogen 3.545 N/A ARG 129.A NH1 HIS 175.A NE2 no hydrogen 2.930 N/A ARG 129.A NH2 TRP 151.A O no hydrogen 2.987 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.163 N/A LYS 132.A NZ ASP 130.A OD1 no hydrogen 3.004 N/A ASN 135.A N LYS 132.A O no hydrogen 2.801 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 3.111 N/A LEU 136.A N PRO 133.A O no hydrogen 2.968 N/A LEU 137.A N LYS 145.A O no hydrogen 2.783 N/A LEU 138.A N GLY 90.A O no hydrogen 2.783 N/A GLY 139.A N GLU 143.A O no hydrogen 2.859 N/A ALA 141.A N GLU 143.A OE1 no hydrogen 3.153 N/A GLY 142.A N GLY 139.A O no hydrogen 2.854 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.724 N/A LEU 144.A N GLU 113.A OE1 no hydrogen 3.277 N/A LYS 145.A N LEU 137.A O no hydrogen 2.681 N/A LYS 145.A NZ PRO 65.A O no hydrogen 2.959 N/A LYS 145.A NZ GLU 85.A OE2 no hydrogen 3.062 N/A ILE 146.A N ASN 66.A O no hydrogen 3.040 N/A ALA 147.A N ASN 135.A O no hydrogen 3.001 N/A SER 152.A N PHE 149.A O no hydrogen 3.162 N/A SER 152.A OG PHE 149.A O no hydrogen 2.878 N/A VAL 153.A N ILE 127.A O no hydrogen 3.133 N/A ALA 155.A N ARG 125.A O no hydrogen 3.358 N/A SER 157.A N HIS 175.A O no hydrogen 3.180 N/A SER 157.A OG PRO 156.A O no hydrogen 2.467 N/A THR 161.A OG1 ASP 163.A OD2 no hydrogen 2.683 N/A ASP 163.A N THR 161.A OG1 no hydrogen 3.276 N/A TYR 164.A OH GLU 190.A OE1 no hydrogen 2.626 N/A TYR 164.A OH GLU 190.A OE2 no hydrogen 3.382 N/A LEU 165.A N LEU 162.A O no hydrogen 2.954 N/A GLU 168.A N GLU 168.A OE1 no hydrogen 2.587 N/A MET 169.A N PRO 166.A O no hydrogen 3.184 N/A ILE 170.A N PRO 166.A O no hydrogen 3.179 N/A GLU 171.A N PRO 167.A O no hydrogen 2.940 N/A GLY 172.A N MET 169.A O no hydrogen 3.227 N/A ARG 173.A NH1 GLU 171.A OE1 no hydrogen 2.730 N/A HIS 175.A N SER 157.A O no hydrogen 3.057 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.720 N/A LYS 178.A N ASP 176.A OD1 no hydrogen 2.979 N/A LYS 178.A NZ ARG 240.A O no hydrogen 2.733 N/A LYS 178.A NZ PRO 241.A O no hydrogen 3.004 N/A VAL 179.A N ASP 176.A O no hydrogen 3.161 N/A ASP 180.A N GLU 177.A O no hydrogen 3.054 N/A TRP 182.A N LYS 178.A O no hydrogen 3.098 N/A SER 183.A N VAL 179.A O no hydrogen 3.150 N/A SER 183.A OG TYR 164.A O no hydrogen 2.797 N/A SER 183.A OG VAL 179.A O no hydrogen 3.461 N/A LEU 184.A N ASP 180.A O no hydrogen 3.006 N/A GLY 185.A N LEU 181.A O no hydrogen 3.221 N/A VAL 186.A N TRP 182.A O no hydrogen 3.076 N/A LEU 187.A N SER 183.A O no hydrogen 2.950 N/A CYS 188.A N LEU 184.A O no hydrogen 2.978 N/A TYR 189.A N GLY 185.A O no hydrogen 3.158 N/A TYR 189.A OH THR 216.A O no hydrogen 2.681 N/A GLU 190.A N VAL 186.A O no hydrogen 3.009 N/A PHE 191.A N LEU 187.A O no hydrogen 2.876 N/A LEU 192.A N CYS 188.A O no hydrogen 3.306 N/A VAL 193.A N TYR 189.A O no hydrogen 2.915 N/A GLY 194.A N GLU 190.A O no hydrogen 2.874 N/A GLU 199.A N PRO 196.A O no hydrogen 3.301 N/A GLN 204.A N GLN 204.A OE1 no hydrogen 2.785 N/A GLU 205.A N THR 202.A OG1 no hydrogen 3.077 N/A THR 206.A N THR 202.A O no hydrogen 3.081 N/A THR 206.A OG1 THR 202.A O no hydrogen 3.003 N/A TYR 207.A N TYR 203.A O no hydrogen 3.046 N/A LYS 208.A N GLN 204.A O no hydrogen 3.215 N/A ARG 209.A N GLU 205.A O no hydrogen 2.965 N/A ARG 209.A NE GLU 214.A O no hydrogen 3.241 N/A ARG 209.A NH1 GLU 199.A O no hydrogen 2.881 N/A ARG 209.A NH2 GLU 214.A O no hydrogen 2.803 N/A ILE 210.A N THR 206.A O no hydrogen 2.934 N/A SER 211.A N TYR 207.A O no hydrogen 3.084 N/A SER 211.A OG TYR 207.A O no hydrogen 3.210 N/A SER 211.A OG LYS 208.A O no hydrogen 3.168 N/A ARG 212.A N LYS 208.A O no hydrogen 3.159 N/A VAL 213.A N ILE 210.A O no hydrogen 3.016 N/A GLU 214.A N ARG 209.A O no hydrogen 2.888 N/A VAL 221.A N PRO 218.A O no hydrogen 3.226 N/A THR 222.A OG1 GLU 104.A OE2 no hydrogen 2.583 N/A ARG 226.A N THR 222.A O no hydrogen 3.071 N/A ARG 226.A NE VAL 221.A O no hydrogen 2.934 N/A ARG 226.A NH2 VAL 221.A O no hydrogen 3.455 N/A ASP 227.A N GLU 223.A O no hydrogen 2.928 N/A LEU 228.A N GLY 224.A O no hydrogen 3.175 N/A ILE 229.A N ALA 225.A O no hydrogen 2.923 N/A SER 230.A N ARG 226.A O no hydrogen 3.004 N/A SER 230.A OG ARG 226.A O no hydrogen 3.088 N/A ARG 231.A N ASP 227.A O no hydrogen 3.264 N/A ARG 231.A NE ASP 227.A OD2 no hydrogen 2.769 N/A ARG 231.A NH2 ASP 227.A OD1 no hydrogen 3.311 N/A LEU 232.A N LEU 228.A O no hydrogen 3.205 N/A LEU 233.A N ILE 229.A O no hydrogen 3.062 N/A SER 238.A N ASN 236.A OD1 no hydrogen 3.419 N/A SER 238.A OG ASN 236.A OD1 no hydrogen 2.986 N/A GLN 239.A N ASN 236.A O no hydrogen 2.919 N/A ARG 240.A N PRO 237.A O no hydrogen 2.908 N/A ARG 240.A NE LYS 234.A O no hydrogen 2.938 N/A ARG 240.A NH1 GLU 168.A OE2 no hydrogen 2.843 N/A ARG 240.A NH1 LYS 178.A O no hydrogen 3.037 N/A ARG 240.A NH2 GLU 168.A OE1 no hydrogen 2.952 N/A ARG 240.A NH2 GLU 168.A OE2 no hydrogen 3.184 N/A ARG 240.A NH2 LYS 234.A O no hydrogen 3.149 N/A ARG 240.A NH2 HIS 235.A O no hydrogen 3.267 N/A MET 242.A N GLU 245.A OE2 no hydrogen 3.101 N/A VAL 246.A N MET 242.A O no hydrogen 3.186 N/A LEU 247.A N LEU 243.A O no hydrogen 3.017 N/A GLU 248.A N ARG 244.A O no hydrogen 3.120 N/A GLU 248.A N GLU 245.A O no hydrogen 3.272 N/A HIS 249.A N VAL 246.A O no hydrogen 3.111 N/A HIS 249.A NE2 ASP 227.A OD2 no hydrogen 2.769 N/A TRP 251.A N HIS 249.A ND1 no hydrogen 3.110 N/A TRP 251.A NE1 GLU 104.A OE2 no hydrogen 2.915 N/A THR 253.A N HIS 249.A O no hydrogen 2.989 N/A THR 253.A OG1 PRO 250.A O no hydrogen 3.276 N/A ALA 254.A N PRO 250.A O no hydrogen 3.023 N/A ASN 255.A N ILE 252.A O no hydrogen 3.185 N/A ASN 255.A ND2 TRP 251.A O no hydrogen 3.029 N/A SER 256.A N ILE 252.A O no hydrogen 2.898 N/A SER 256.A OG THR 112.A OG1 no hydrogen 3.108 N/A SER 256.A OG LYS 258.A O no hydrogen 3.032 N/A SER 257.A N THR 109.A OG1 no hydrogen 3.052 N/A LYS 258.A N SER 256.A OG no hydrogen 3.250 N/A LYS 258.A NZ GLU 113.A OE2 no hydrogen 2.394 N/A