Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6r2e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A NE2 ARG 247.A O no hydrogen 2.763 N/A GLU 5.A N HIS 3.A ND1 no hydrogen 3.022 N/A LEU 6.A N HIS 3.A O no hydrogen 3.083 N/A GLN 7.A N GLY 4.A O no hydrogen 2.840 N/A GLN 7.A NE2 GLY 4.A O no hydrogen 3.191 N/A GLN 7.A NE2 ARG 38.A O no hydrogen 3.028 N/A TYR 8.A OH MET 192.A O no hydrogen 2.537 N/A LEU 9.A N GLU 5.A O no hydrogen 3.087 N/A GLY 10.A N LEU 6.A O no hydrogen 2.688 N/A GLN 11.A N GLN 7.A O no hydrogen 2.860 N/A ILE 12.A N TYR 8.A O no hydrogen 2.981 N/A GLN 13.A N LEU 9.A O no hydrogen 3.041 N/A HIS 14.A N GLY 10.A O no hydrogen 2.921 N/A ILE 15.A N GLN 11.A O no hydrogen 3.002 N/A LEU 16.A N ILE 12.A O no hydrogen 2.829 N/A ARG 17.A N GLN 13.A O no hydrogen 3.006 N/A VAL 19.A N SER 31.A O no hydrogen 2.996 N/A LYS 21.A N THR 29.A O no hydrogen 2.937 N/A ARG 24.A NH1 VAL 286.A O no hydrogen 3.060 N/A ARG 24.A NH2 VAL 286.A O no hydrogen 3.408 N/A THR 25.A N ASP 23.A OD2 no hydrogen 3.045 N/A THR 25.A OG1 ASP 23.A OD1 no hydrogen 3.117 N/A THR 25.A OG1 ASP 23.A OD2 no hydrogen 2.918 N/A THR 25.A OG1 THR 27.A OG1 no hydrogen 3.062 N/A GLY 26.A N ASP 23.A O no hydrogen 3.053 N/A THR 27.A N THR 25.A OG1 no hydrogen 3.170 N/A THR 27.A OG1 THR 25.A OG1 no hydrogen 3.062 N/A GLY 28.A N ASP 23.A OD1 no hydrogen 2.846 N/A THR 29.A N LYS 21.A O no hydrogen 3.103 N/A LEU 30.A N ILE 230.A O no hydrogen 2.775 N/A SER 31.A N VAL 19.A O no hydrogen 2.797 N/A VAL 32.A N ALA 228.A O no hydrogen 3.066 N/A GLY 34.A N GLY 226.A O no hydrogen 2.822 N/A MET 35.A N LEU 225.A O no hydrogen 3.129 N/A ALA 37.A N HIS 223.A O no hydrogen 2.982 N/A ARG 38.A N GLN 7.A OE1 no hydrogen 2.907 N/A TYR 39.A N PHE 221.A O no hydrogen 2.813 N/A LEU 41.A N GLY 219.A O no hydrogen 2.848 N/A ARG 42.A N SER 40.A OG no hydrogen 3.250 N/A ARG 42.A NE GLU 180.A OE1 no hydrogen 2.895 N/A ARG 42.A NE GLU 180.A OE2 no hydrogen 3.097 N/A ARG 42.A NH1 SER 40.A OG no hydrogen 3.268 N/A ARG 42.A NH1 ASP 220.A OD1 no hydrogen 2.793 N/A ARG 42.A NH1 ASP 220.A OD2 no hydrogen 3.530 N/A ARG 42.A NH2 GLU 180.A OE1 no hydrogen 3.012 N/A ARG 42.A NH2 ASP 220.A OD2 no hydrogen 2.819 N/A PHE 45.A N PRO 250.A O no hydrogen 2.859 N/A LEU 47.A N PHE 45.A O no hydrogen 2.716 N/A THR 49.A N GLU 5.A OE1 no hydrogen 3.030 N/A THR 49.A N GLU 5.A OE2 no hydrogen 2.611 N/A THR 49.A OG1 GLU 5.A OE2 no hydrogen 2.764 N/A THR 49.A OG1 ARG 247.A O no hydrogen 3.209 N/A THR 50.A N GLU 5.A OE1 no hydrogen 2.718 N/A THR 50.A OG1 GLU 5.A OE1 no hydrogen 2.493 N/A LYS 51.A NZ GLY 193.A O no hydrogen 2.861 N/A ARG 52.A N PRO 278.A O no hydrogen 3.455 N/A VAL 53.A N TYR 274.A OH no hydrogen 3.123 N/A LYS 56.A NZ LYS 78.A O no hydrogen 3.109 N/A VAL 58.A N PHE 54.A O no hydrogen 3.236 N/A LEU 59.A N TRP 55.A O no hydrogen 3.054 N/A GLU 60.A N LYS 56.A O no hydrogen 2.808 N/A GLU 61.A N GLY 57.A O no hydrogen 2.884 N/A LEU 62.A N VAL 58.A O no hydrogen 2.894 N/A LEU 63.A N LEU 59.A O no hydrogen 3.163 N/A TRP 64.A N GLU 60.A O no hydrogen 3.151 N/A TRP 64.A NE1 ASN 71.A O no hydrogen 2.974 N/A PHE 65.A N GLU 61.A O no hydrogen 3.052 N/A ILE 66.A N LEU 62.A O no hydrogen 2.750 N/A LYS 67.A N LEU 63.A O no hydrogen 2.780 N/A GLY 68.A N TRP 64.A O no hydrogen 3.035 N/A GLY 68.A N PHE 65.A O no hydrogen 2.832 N/A SER 69.A N TRP 64.A O no hydrogen 3.187 N/A THR 70.A OG1 TYR 120.A OH no hydrogen 2.687 N/A ASN 71.A N SER 69.A OG no hydrogen 3.230 N/A ALA 72.A N GLY 103.A O no hydrogen 2.826 N/A LYS 73.A N ASN 71.A OD1 no hydrogen 3.242 N/A LEU 75.A N ASN 71.A O no hydrogen 3.402 N/A SER 76.A N ALA 72.A O no hydrogen 2.705 N/A SER 76.A OG ASP 84.A OD1 no hydrogen 2.844 N/A SER 76.A OG ASP 84.A OD2 no hydrogen 2.509 N/A SER 77.A N LYS 73.A O no hydrogen 2.698 N/A SER 77.A OG LYS 73.A O no hydrogen 2.971 N/A SER 77.A OG GLU 74.A O no hydrogen 2.856 N/A LYS 78.A N LEU 75.A O no hydrogen 2.753 N/A GLY 79.A N SER 76.A O no hydrogen 3.301 N/A ASP 84.A N LYS 81.A O no hydrogen 3.196 N/A ASN 86.A N TRP 83.A O no hydrogen 2.895 N/A GLY 87.A N ASP 84.A O no hydrogen 3.036 N/A SER 88.A N ALA 85.A O no hydrogen 3.502 N/A SER 88.A OG ALA 85.A O no hydrogen 3.479 N/A ARG 89.A NE ASP 93.A OD1 no hydrogen 3.276 N/A ARG 89.A NE ASP 93.A OD2 no hydrogen 2.938 N/A ARG 89.A NH1 ARG 100.A O no hydrogen 2.515 N/A ARG 89.A NH2 ASP 93.A OD1 no hydrogen 3.057 N/A ARG 89.A NH2 PHE 97.A O no hydrogen 3.300 N/A ARG 89.A NH2 ARG 100.A O no hydrogen 3.150 N/A PHE 91.A N SER 88.A OG no hydrogen 3.352 N/A LEU 92.A N SER 88.A O no hydrogen 2.808 N/A ASP 93.A N ARG 89.A O no hydrogen 2.781 N/A SER 94.A N ASP 90.A O no hydrogen 2.952 N/A SER 94.A OG PHE 91.A O no hydrogen 2.883 N/A LEU 95.A N PHE 91.A O no hydrogen 3.069 N/A LEU 95.A N LEU 92.A O no hydrogen 3.253 N/A GLY 96.A N ASP 93.A O no hydrogen 3.121 N/A PHE 97.A N LEU 92.A O no hydrogen 3.076 N/A ARG 100.A N PHE 97.A O no hydrogen 3.143 N/A ARG 100.A NH1 ASP 104.A O no hydrogen 2.526 N/A ARG 100.A NH2 LEU 163.A O no hydrogen 2.319 N/A ASP 104.A N GLU 101.A O no hydrogen 3.289 N/A LEU 105.A N THR 70.A O no hydrogen 3.187 N/A GLY 106.A N ASP 104.A OD1 no hydrogen 3.345 N/A VAL 108.A N GLY 106.A O no hydrogen 2.933 N/A GLN 112.A N VAL 108.A O no hydrogen 3.226 N/A GLN 112.A NE2 PRO 107.A O no hydrogen 2.786 N/A GLN 112.A NE2 ASP 160.A OD2 no hydrogen 2.891 N/A TRP 113.A N TYR 109.A O no hydrogen 2.782 N/A ARG 114.A N GLY 110.A O no hydrogen 3.219 N/A ARG 114.A NE ASP 133.A OD1 no hydrogen 3.022 N/A ARG 114.A NH1 ILE 66.A O no hydrogen 3.009 N/A ARG 114.A NH1 ASP 262.A OD1 no hydrogen 3.086 N/A ARG 114.A NH2 ASP 133.A OD1 no hydrogen 3.346 N/A ARG 114.A NH2 ASP 133.A OD2 no hydrogen 2.655 N/A HIS 115.A ND1 GLN 130.A O no hydrogen 2.937 N/A PHE 116.A N VAL 132.A O no hydrogen 3.082 N/A ALA 118.A N HIS 115.A O no hydrogen 2.938 N/A TYR 120.A OH THR 70.A OG1 no hydrogen 2.687 N/A TYR 120.A OH ASP 104.A OD1 no hydrogen 2.504 N/A ARG 121.A N TYR 127.A OH no hydrogen 2.774 N/A ASP 122.A N SER 125.A OG no hydrogen 3.320 N/A MET 123.A N ASP 104.A OD2 no hydrogen 3.014 N/A GLU 124.A N ASP 122.A OD1 no hydrogen 2.962 N/A SER 125.A N ASP 122.A O no hydrogen 3.154 N/A SER 125.A OG ASP 122.A O no hydrogen 3.363 N/A SER 125.A OG ASP 122.A OD1 no hydrogen 3.323 N/A TYR 127.A OH ASP 122.A O no hydrogen 2.706 N/A GLN 130.A N TYR 127.A O no hydrogen 2.783 N/A VAL 132.A N PHE 116.A O no hydrogen 2.855 N/A GLN 134.A NE2 GLN 112.A O no hydrogen 2.933 N/A GLN 134.A NE2 CYS 154.A O no hydrogen 2.600 N/A LEU 135.A N TRP 113.A O no hydrogen 3.194 N/A GLN 136.A N ASP 133.A OD1 no hydrogen 2.789 N/A GLN 136.A NE2 ASP 140.A OD1 no hydrogen 3.091 N/A ARG 137.A N ASP 133.A O no hydrogen 2.921 N/A VAL 138.A N GLN 134.A O no hydrogen 2.880 N/A ILE 139.A N LEU 135.A O no hydrogen 3.222 N/A ASP 140.A N GLN 136.A O no hydrogen 2.866 N/A THR 141.A N ARG 137.A O no hydrogen 2.692 N/A THR 141.A OG1 ARG 137.A O no hydrogen 3.006 N/A ILE 142.A N VAL 138.A O no hydrogen 2.877 N/A LYS 143.A N ILE 139.A O no hydrogen 3.097 N/A THR 144.A N ASP 140.A O no hydrogen 2.974 N/A THR 144.A N THR 141.A O no hydrogen 3.140 N/A ASN 145.A N THR 141.A O no hydrogen 2.790 N/A ASP 148.A N ASN 145.A O no hydrogen 3.050 N/A ARG 150.A N ASP 148.A OD1 no hydrogen 2.783 N/A MET 153.A N CYS 172.A O no hydrogen 2.943 N/A CYS 154.A N GLN 134.A OE1 no hydrogen 2.923 N/A CYS 154.A SG TRP 156.A O no hydrogen 3.836 N/A ALA 155.A N ALA 170.A O no hydrogen 2.709 N/A ASN 157.A ND2 GLN 112.A OE1 no hydrogen 2.838 N/A ARG 159.A NH1 GLU 119.A OE1 no hydrogen 3.536 N/A ARG 159.A NH1 GLU 119.A OE2 no hydrogen 3.443 N/A ARG 159.A NH2 GLU 119.A OE1 no hydrogen 3.514 N/A ARG 159.A NH2 GLU 119.A OE2 no hydrogen 3.522 N/A ASP 160.A N ASN 157.A OD1 no hydrogen 3.400 N/A LEU 161.A N PRO 158.A O no hydrogen 3.355 N/A LEU 163.A N ASP 160.A O no hydrogen 3.021 N/A MET 164.A N LEU 161.A O no hydrogen 3.012 N/A ALA 165.A N LEU 105.A O no hydrogen 2.580 N/A HIS 169.A ND1 TYR 203.A OH no hydrogen 2.941 N/A ALA 170.A N TYR 186.A O no hydrogen 3.182 N/A CYS 172.A N MET 153.A O no hydrogen 2.932 N/A CYS 172.A SG MET 153.A O no hydrogen 3.954 N/A GLN 173.A N GLN 184.A O no hydrogen 2.966 N/A PHE 174.A N ILE 151.A O no hydrogen 2.940 N/A TYR 175.A N SER 182.A O no hydrogen 3.093 N/A VAL 177.A N GLU 180.A O no hydrogen 3.228 N/A GLU 180.A N VAL 177.A O no hydrogen 3.147 N/A LEU 181.A N LYS 217.A O no hydrogen 2.538 N/A SER 182.A N TYR 175.A O no hydrogen 3.031 N/A SER 182.A OG ASP 220.A O no hydrogen 3.081 N/A CYS 183.A N ASP 220.A O no hydrogen 2.912 N/A CYS 183.A SG GLN 173.A O no hydrogen 3.986 N/A GLN 184.A N GLN 173.A O no hydrogen 2.803 N/A LEU 185.A N ILE 222.A O no hydrogen 2.790 N/A TYR 186.A N LEU 171.A O no hydrogen 2.606 N/A GLN 187.A N THR 224.A O no hydrogen 2.906 N/A GLN 187.A NE2 SER 189.A O no hydrogen 3.142 N/A GLN 187.A NE2 ASN 199.A OD1 no hydrogen 2.933 N/A ARG 188.A NE PRO 168.A O no hydrogen 2.669 N/A ARG 188.A NH2 PRO 167.A O no hydrogen 3.018 N/A ARG 188.A NH2 PRO 168.A O no hydrogen 3.543 N/A GLY 190.A N ASP 227.A O no hydrogen 2.871 N/A MET 192.A N HIS 229.A O no hydrogen 2.875 N/A LEU 194.A N ASP 191.A OD1 no hydrogen 3.278 N/A GLY 195.A N ASP 191.A O no hydrogen 2.996 N/A VAL 196.A N ASP 191.A O no hydrogen 2.950 N/A ASN 199.A N GLY 195.A O no hydrogen 2.650 N/A ILE 200.A N VAL 196.A O no hydrogen 2.908 N/A ALA 201.A N PRO 197.A O no hydrogen 3.477 N/A SER 202.A N PHE 198.A O no hydrogen 2.859 N/A TYR 203.A N ASN 199.A O no hydrogen 2.926 N/A TYR 203.A N ILE 200.A O no hydrogen 3.121 N/A TYR 203.A OH HIS 169.A ND1 no hydrogen 2.941 N/A ALA 204.A N ILE 200.A O no hydrogen 2.981 N/A LEU 205.A N ALA 201.A O no hydrogen 2.834 N/A LEU 206.A N SER 202.A O no hydrogen 2.976 N/A THR 207.A N TYR 203.A O no hydrogen 2.987 N/A THR 207.A OG1 TYR 203.A O no hydrogen 2.803 N/A TYR 208.A N ALA 204.A O no hydrogen 2.952 N/A TYR 208.A OH LEU 41.A O no hydrogen 2.770 N/A TYR 208.A OH GLU 44.A O no hydrogen 2.899 N/A MET 209.A N LEU 205.A O no hydrogen 2.976 N/A ILE 210.A N LEU 206.A O no hydrogen 2.993 N/A ALA 211.A N THR 207.A O no hydrogen 2.890 N/A HIS 212.A N TYR 208.A O no hydrogen 2.978 N/A ILE 213.A N MET 209.A O no hydrogen 3.156 N/A THR 214.A N ILE 210.A O no hydrogen 3.048 N/A THR 214.A OG1 ILE 210.A O no hydrogen 2.614 N/A THR 214.A OG1 ALA 211.A O no hydrogen 3.378 N/A LEU 216.A N ALA 211.A O no hydrogen 2.918 N/A LYS 217.A N SER 179.A O no hydrogen 2.671 N/A GLY 219.A N LEU 181.A O no hydrogen 2.733 N/A ASP 220.A N SER 182.A OG no hydrogen 2.846 N/A PHE 221.A N TYR 39.A O no hydrogen 2.885 N/A ILE 222.A N CYS 183.A O no hydrogen 2.792 N/A HIS 223.A N ALA 37.A O no hydrogen 2.900 N/A HIS 223.A NE2 GLN 187.A OE1 no hydrogen 2.753 N/A THR 224.A N LEU 185.A O no hydrogen 2.944 N/A THR 224.A OG1 GLN 184.A OE1 no hydrogen 2.775 N/A LEU 225.A N MET 35.A O no hydrogen 2.712 N/A GLY 226.A N GLN 187.A O no hydrogen 2.831 N/A ASP 227.A N ARG 188.A O no hydrogen 3.088 N/A ALA 228.A N VAL 32.A O no hydrogen 3.018 N/A HIS 229.A N GLY 190.A O no hydrogen 2.819 N/A ILE 230.A N LEU 30.A O no hydrogen 2.800 N/A LEU 232.A N GLY 28.A O no hydrogen 3.079 N/A HIS 234.A N TYR 231.A O no hydrogen 2.916 N/A HIS 234.A NE2 GLU 283.A O no hydrogen 2.929 N/A ILE 235.A N LEU 232.A O no hydrogen 3.169 N/A LEU 238.A N HIS 234.A O no hydrogen 2.936 N/A LYS 239.A N ILE 235.A O no hydrogen 2.943 N/A LYS 239.A N GLU 236.A O no hydrogen 2.862 N/A ILE 240.A N GLU 236.A O no hydrogen 3.161 N/A GLN 241.A N PRO 237.A O no hydrogen 3.184 N/A GLN 241.A NE2 THR 50.A OG1 no hydrogen 3.024 N/A LEU 242.A N LEU 238.A O no hydrogen 2.875 N/A GLN 243.A N ILE 240.A O no hydrogen 3.237 N/A ARG 244.A N GLN 241.A O no hydrogen 3.110 N/A ARG 244.A NH1 THR 50.A O no hydrogen 2.921 N/A ARG 244.A NH1 PRO 278.A O no hydrogen 2.889 N/A ARG 247.A N THR 49.A OG1 no hydrogen 2.845 N/A ARG 247.A NH1 ASN 275.A O no hydrogen 2.930 N/A LYS 251.A N GLU 272.A O no hydrogen 3.038 N/A ARG 253.A N GLN 270.A O no hydrogen 2.791 N/A LEU 255.A N ASP 268.A O no hydrogen 2.812 N/A ARG 256.A NE ASP 268.A OD1 no hydrogen 2.924 N/A ARG 256.A NH2 ASP 263.A O no hydrogen 2.890 N/A VAL 258.A N HIS 212.A NE2 no hydrogen 3.002 N/A ASP 263.A N LYS 260.A O no hydrogen 2.915 N/A LYS 265.A N ASP 268.A OD2 no hydrogen 3.055 N/A ASP 268.A N LYS 265.A O no hydrogen 2.846 N/A PHE 269.A N ALA 266.A O no hydrogen 3.446 N/A GLN 270.A N ARG 253.A O no hydrogen 2.956 N/A GLU 272.A N LYS 251.A O no hydrogen 2.848 N/A TYR 274.A OH LEU 48.A O no hydrogen 2.692 N/A HIS 277.A N THR 49.A O no hydrogen 2.824 N/A HIS 277.A NE2 GLU 245.A O no hydrogen 2.926 N/A