Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gur_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N SER 26.A O no hydrogen 2.933 N/A THR 3.A N ILE 63.A O no hydrogen 2.991 N/A LEU 4.A N GLU 28.A O no hydrogen 2.915 N/A GLY 5.A N TYR 61.A O no hydrogen 2.810 N/A TYR 6.A N LYS 30.A O no hydrogen 3.133 N/A ASN 8.A N TYR 32.A O no hydrogen 2.847 N/A ARG 10.A N PRO 206.A O no hydrogen 2.817 N/A ARG 10.A NE ASP 161.A OD1 no hydrogen 2.966 N/A ARG 10.A NH1 GLU 164.A OE1 no hydrogen 2.884 N/A ARG 10.A NH2 ASP 161.A O no hydrogen 2.872 N/A ARG 10.A NH2 ASP 161.A OD1 no hydrogen 2.907 N/A ARG 10.A NH2 GLU 164.A OE1 no hydrogen 3.322 N/A GLY 11.A N VAL 207.A O no hydrogen 2.813 N/A LEU 12.A N TYR 6.A OH no hydrogen 2.662 N/A ALA 13.A N ARG 10.A O no hydrogen 3.188 N/A SER 15.A OG PHE 157.A O no hydrogen 2.713 N/A ARG 17.A N ALA 13.A O no hydrogen 2.902 N/A ARG 17.A NH1 GLU 29.A OE1 no hydrogen 3.355 N/A ARG 17.A NH2 ILE 9.A O no hydrogen 2.285 N/A LEU 18.A N HIS 14.A O no hydrogen 3.059 N/A LEU 19.A N SER 15.A O no hydrogen 2.946 N/A LEU 20.A N ILE 16.A O no hydrogen 2.855 N/A GLU 21.A N ARG 17.A O no hydrogen 3.060 N/A TYR 22.A N LEU 18.A O no hydrogen 2.943 N/A THR 23.A N LEU 19.A O no hydrogen 3.091 N/A THR 23.A OG1 LEU 19.A O no hydrogen 2.842 N/A THR 23.A OG1 LEU 20.A O no hydrogen 3.039 N/A THR 23.A OG1 SER 25.A OG no hydrogen 2.724 N/A ASP 24.A N GLU 21.A O no hydrogen 3.181 N/A SER 25.A N LEU 20.A O no hydrogen 3.018 N/A SER 25.A OG THR 23.A OG1 no hydrogen 2.724 N/A TYR 27.A OH GLU 21.A OE2 no hydrogen 2.561 N/A GLU 28.A N MET 2.A O no hydrogen 2.763 N/A LYS 30.A N LEU 4.A O no hydrogen 2.972 N/A TYR 32.A N TYR 6.A O no hydrogen 2.877 N/A TYR 32.A OH GLU 48.A OE2 no hydrogen 2.694 N/A TYR 32.A OH TYR 61.A OH no hydrogen 2.670 N/A THR 33.A N GLN 44.A OE1 no hydrogen 3.232 N/A GLY 35.A N ASP 41.A O no hydrogen 2.946 N/A TYR 40.A N ASP 36.A O no hydrogen 3.014 N/A TYR 40.A OH LYS 210.A O no hydrogen 3.294 N/A SER 43.A N ASP 41.A OD1 no hydrogen 3.272 N/A SER 43.A OG ASP 41.A OD1 no hydrogen 3.198 N/A SER 43.A OG ASP 41.A OD2 no hydrogen 3.210 N/A TRP 45.A N ARG 42.A O no hydrogen 2.926 N/A LEU 46.A N ARG 42.A O no hydrogen 3.008 N/A ASN 47.A N SER 43.A O no hydrogen 2.834 N/A GLU 48.A N TRP 45.A O no hydrogen 3.193 N/A LYS 51.A N GLU 48.A O no hydrogen 3.005 N/A LYS 51.A NZ ASN 47.A O no hydrogen 2.808 N/A LEU 59.A N ASN 58.A OD1 no hydrogen 2.765 N/A TYR 61.A N GLY 5.A O no hydrogen 2.953 N/A TYR 61.A OH TYR 32.A OH no hydrogen 2.670 N/A LEU 62.A N ILE 69.A O no hydrogen 2.773 N/A ILE 63.A N THR 3.A O no hydrogen 2.923 N/A ASP 64.A N HIS 67.A O no hydrogen 2.931 N/A HIS 67.A N ASP 64.A O no hydrogen 2.968 N/A ILE 69.A N LEU 62.A O no hydrogen 2.876 N/A THR 70.A OG1 PHE 56.A O no hydrogen 3.158 N/A ILE 75.A N GLN 71.A O no hydrogen 3.032 N/A LEU 76.A N SER 72.A O no hydrogen 2.998 N/A ARG 77.A N ASN 73.A O no hydrogen 3.038 N/A ARG 77.A NH1 GLU 100.A OE2 no hydrogen 3.250 N/A TYR 78.A N ALA 74.A O no hydrogen 3.016 N/A TYR 78.A OH ASP 64.A OD2 no hydrogen 2.812 N/A ILE 79.A N ILE 75.A O no hydrogen 3.161 N/A ALA 80.A N LEU 76.A O no hydrogen 2.895 N/A ARG 81.A N ARG 77.A O no hydrogen 3.025 N/A HIS 83.A N ALA 80.A O no hydrogen 3.064 N/A ASN 84.A N ARG 81.A O no hydrogen 3.399 N/A LEU 85.A N ALA 80.A O no hydrogen 2.835 N/A GLY 87.A N GLU 96.A OE2 no hydrogen 2.909 N/A GLU 88.A N GLU 92.A OE1 no hydrogen 2.807 N/A SER 89.A N GLU 92.A OE1 no hydrogen 2.976 N/A GLU 92.A N SER 89.A OG no hydrogen 3.123 N/A GLN 93.A N SER 89.A O no hydrogen 2.980 N/A GLN 93.A NE2 GLU 88.A O no hydrogen 3.266 N/A GLN 93.A NE2 SER 89.A O no hydrogen 3.507 N/A ILE 94.A N GLU 90.A O no hydrogen 2.889 N/A ARG 95.A N LYS 91.A O no hydrogen 3.068 N/A ARG 95.A NH2 PHE 140.A O no hydrogen 3.299 N/A ARG 95.A NH2 PHE 147.A O no hydrogen 3.215 N/A GLU 96.A N GLU 92.A O no hydrogen 2.837 N/A ASP 97.A N GLN 93.A O no hydrogen 2.967 N/A ILE 98.A N ILE 94.A O no hydrogen 2.882 N/A LEU 99.A N ARG 95.A O no hydrogen 2.936 N/A GLU 100.A N GLU 96.A O no hydrogen 3.013 N/A ASN 101.A N ASP 97.A O no hydrogen 3.223 N/A ASN 101.A ND2 ASP 97.A O no hydrogen 2.820 N/A GLN 102.A N ILE 98.A O no hydrogen 2.761 N/A PHE 103.A N LEU 99.A O no hydrogen 2.655 N/A MET 104.A N GLU 100.A O no hydrogen 3.382 N/A ASP 105.A N ASN 101.A O no hydrogen 3.077 N/A SER 106.A N GLN 102.A O no hydrogen 3.004 N/A SER 106.A OG GLN 102.A O no hydrogen 3.539 N/A SER 106.A OG TYR 137.A OH no hydrogen 2.698 N/A ARG 107.A N PHE 103.A O no hydrogen 2.769 N/A ARG 107.A NH1 ASP 161.A OD2 no hydrogen 2.654 N/A ARG 107.A NH2 ASP 161.A OD2 no hydrogen 2.735 N/A MET 108.A N MET 104.A O no hydrogen 2.834 N/A GLN 109.A N ASP 105.A O no hydrogen 2.980 N/A LEU 110.A N SER 106.A O no hydrogen 3.147 N/A ALA 111.A N ARG 107.A O no hydrogen 3.122 N/A LYS 112.A N MET 108.A O no hydrogen 2.779 N/A LEU 113.A N GLN 109.A O no hydrogen 3.277 N/A CYS 114.A N LEU 110.A O no hydrogen 2.958 N/A CYS 114.A SG LEU 110.A O no hydrogen 3.281 N/A TYR 115.A N ALA 111.A O no hydrogen 3.011 N/A TYR 115.A OH THR 209.A OG1 no hydrogen 2.986 N/A ASP 116.A N LEU 113.A O no hydrogen 3.326 N/A ASP 118.A N ASP 116.A OD1 no hydrogen 2.895 N/A PHE 119.A N ASP 116.A O no hydrogen 2.850 N/A LEU 122.A N ASP 118.A O no hydrogen 2.906 N/A LEU 122.A N PHE 119.A O no hydrogen 2.979 N/A LYS 123.A N PHE 119.A O no hydrogen 2.690 N/A LEU 127.A N LYS 123.A O no hydrogen 3.104 N/A GLN 128.A N PRO 124.A O no hydrogen 2.995 N/A ALA 129.A N GLU 125.A O no hydrogen 3.202 N/A LEU 130.A N TYR 126.A O no hydrogen 2.950 N/A MET 133.A N ALA 129.A O no hydrogen 3.244 N/A LEU 134.A N LEU 130.A O no hydrogen 2.929 N/A LYS 135.A N PRO 131.A O no hydrogen 2.913 N/A LEU 136.A N GLU 132.A O no hydrogen 3.292 N/A TYR 137.A N MET 133.A O no hydrogen 3.440 N/A TYR 137.A OH SER 106.A OG no hydrogen 2.698 N/A SER 138.A N LEU 134.A O no hydrogen 2.876 N/A GLN 139.A N LYS 135.A O no hydrogen 2.770 N/A PHE 140.A N LEU 136.A O no hydrogen 3.016 N/A LEU 141.A N TYR 137.A O no hydrogen 2.914 N/A GLY 142.A N SER 138.A O no hydrogen 3.081 N/A GLN 144.A N LEU 141.A O no hydrogen 3.089 N/A TRP 146.A N GLY 149.A O no hydrogen 3.315 N/A PHE 147.A N ASP 156.A OD1 no hydrogen 2.870 N/A GLY 149.A N TRP 146.A O no hydrogen 3.141 N/A THR 153.A N ASP 156.A OD2 no hydrogen 2.940 N/A THR 153.A OG1 ASP 156.A OD2 no hydrogen 3.508 N/A PHE 154.A N LEU 85.A O no hydrogen 3.185 N/A ASP 156.A N THR 153.A O no hydrogen 3.148 N/A PHE 157.A N PHE 154.A O no hydrogen 3.106 N/A ILE 158.A N PHE 154.A O no hydrogen 3.416 N/A ALA 159.A N VAL 155.A O no hydrogen 2.816 N/A TYR 160.A N ASP 156.A O no hydrogen 2.914 N/A TYR 160.A OH GLU 188.A OE2 no hydrogen 2.496 N/A ASP 161.A N PHE 157.A O no hydrogen 3.292 N/A VAL 162.A N ILE 158.A O no hydrogen 3.020 N/A LEU 163.A N ALA 159.A O no hydrogen 2.811 N/A GLU 164.A N TYR 160.A O no hydrogen 2.952 N/A ARG 165.A N ASP 161.A O no hydrogen 3.140 N/A ARG 165.A NH2 GLY 11.A O no hydrogen 3.056 N/A ARG 165.A NH2 ASP 161.A OD1 no hydrogen 2.834 N/A ASN 166.A N VAL 162.A O no hydrogen 3.377 N/A ASN 166.A ND2 TYR 126.A OH no hydrogen 2.467 N/A GLN 167.A N LEU 163.A O no hydrogen 3.165 N/A VAL 168.A N GLU 164.A O no hydrogen 2.902 N/A PHE 169.A N ARG 165.A O no hydrogen 3.022 N/A GLU 170.A N ASN 166.A O no hydrogen 2.744 N/A SER 172.A N GLU 170.A OE2 no hydrogen 2.917 N/A SER 172.A OG GLU 170.A OE2 no hydrogen 2.689 N/A CYS 173.A N GLU 170.A O no hydrogen 3.014 N/A CYS 173.A SG ASN 166.A O no hydrogen 3.469 N/A CYS 173.A SG GLU 170.A O no hydrogen 3.235 N/A ASP 175.A N SER 172.A O no hydrogen 3.167 N/A PHE 177.A N LEU 174.A O no hydrogen 3.053 N/A ASN 179.A ND2 SER 138.A OG no hydrogen 2.687 N/A LEU 180.A N PHE 177.A O no hydrogen 3.016 N/A LYS 181.A N PHE 177.A O no hydrogen 3.240 N/A LYS 181.A NZ ASP 175.A OD1 no hydrogen 3.085 N/A ASP 182.A N PRO 178.A O no hydrogen 2.850 N/A PHE 183.A N ASN 179.A O no hydrogen 2.845 N/A ILE 184.A N LEU 180.A O no hydrogen 3.075 N/A SER 185.A N LYS 181.A O no hydrogen 2.856 N/A SER 185.A OG LYS 181.A O no hydrogen 3.301 N/A ARG 186.A N ASP 182.A O no hydrogen 2.803 N/A PHE 187.A N PHE 183.A O no hydrogen 2.948 N/A GLU 188.A N ILE 184.A O no hydrogen 2.998 N/A GLY 189.A N SER 185.A O no hydrogen 2.816 N/A GLY 189.A N ARG 186.A O no hydrogen 3.270 N/A LEU 190.A N PHE 187.A O no hydrogen 3.161 N/A LYS 192.A NZ ASP 24.A OD2 no hydrogen 2.968 N/A SER 194.A N LEU 190.A O no hydrogen 2.890 N/A SER 194.A OG LEU 190.A O no hydrogen 3.280 N/A SER 194.A OG GLU 191.A O no hydrogen 3.431 N/A ALA 195.A N GLU 191.A O no hydrogen 3.207 N/A TYR 196.A N LYS 192.A O no hydrogen 3.145 N/A TYR 196.A OH ARG 201.A O no hydrogen 3.317 N/A MET 197.A N ILE 193.A O no hydrogen 2.789 N/A LYS 198.A N SER 194.A O no hydrogen 2.859 N/A SER 199.A N TYR 196.A O no hydrogen 3.034 N/A SER 199.A OG TYR 196.A O no hydrogen 2.805 N/A ARG 201.A N SER 199.A OG no hydrogen 3.025 N/A ARG 201.A NE GLU 21.A OE2 no hydrogen 2.904 N/A ARG 201.A NH2 GLU 21.A OE1 no hydrogen 2.971 N/A ARG 201.A NH2 GLU 21.A OE2 no hydrogen 3.137 N/A ARG 205.A NH1 PRO 204.A O no hydrogen 3.339 N/A PHE 208.A N GLY 215.A O no hydrogen 2.989 N/A THR 209.A N TYR 115.A OH no hydrogen 2.934 N/A THR 209.A OG1 TYR 115.A OH no hydrogen 2.986 N/A LYS 210.A NZ MET 34.A O no hydrogen 3.012 N/A LYS 210.A NZ ASP 36.A OD1 no hydrogen 2.787 N/A ALA 212.A N THR 209.A O no hydrogen 2.991 N/A VAL 213.A N CYS 114.A O no hydrogen 2.806 N/A TRP 214.A N CYS 114.A O no hydrogen 3.227 N/A