Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gtu_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A OG SER 30.A O no hydrogen 2.720 N/A SER 5.A OG GLU 3.A OE1 no hydrogen 3.336 N/A SER 5.A OG GLU 3.A OE2 no hydrogen 2.777 N/A VAL 7.A N LEU 67.A O no hydrogen 3.140 N/A LEU 8.A N GLU 32.A O no hydrogen 2.787 N/A GLY 9.A N TYR 65.A O no hydrogen 2.866 N/A TYR 10.A N LYS 34.A O no hydrogen 3.053 N/A ASP 12.A N TYR 36.A O no hydrogen 2.960 N/A ARG 14.A N PRO 210.A O no hydrogen 2.954 N/A ARG 14.A NE ASP 165.A OD1 no hydrogen 3.490 N/A ARG 14.A NH1 ASP 168.A OD2 no hydrogen 3.108 N/A ARG 14.A NH2 ASP 165.A OD1 no hydrogen 3.225 N/A ARG 14.A NH2 ASP 168.A OD2 no hydrogen 2.878 N/A GLY 15.A N ILE 211.A O no hydrogen 3.027 N/A LEU 16.A N TYR 10.A OH no hydrogen 3.082 N/A HIS 18.A N ARG 14.A O no hydrogen 3.076 N/A ARG 21.A N ALA 17.A O no hydrogen 2.815 N/A ARG 21.A NE GLU 33.A OE2 no hydrogen 3.074 N/A ARG 21.A NH1 ILE 13.A O no hydrogen 3.005 N/A ARG 21.A NH2 TRP 11.A O no hydrogen 3.526 N/A ARG 21.A NH2 ILE 13.A O no hydrogen 2.960 N/A ARG 21.A NH2 GLU 33.A OE2 no hydrogen 3.371 N/A LEU 22.A N HIS 18.A O no hydrogen 3.138 N/A LEU 23.A N ALA 19.A O no hydrogen 3.025 N/A LEU 24.A N ILE 20.A O no hydrogen 2.896 N/A GLU 25.A N ARG 21.A O no hydrogen 2.974 N/A PHE 26.A N LEU 22.A O no hydrogen 2.838 N/A THR 27.A N LEU 23.A O no hydrogen 3.035 N/A THR 27.A OG1 LEU 23.A O no hydrogen 2.794 N/A THR 27.A OG1 LEU 24.A O no hydrogen 3.333 N/A THR 27.A OG1 THR 29.A OG1 no hydrogen 2.872 N/A ASP 28.A N GLU 25.A O no hydrogen 2.916 N/A THR 29.A N LEU 24.A O no hydrogen 2.878 N/A THR 29.A OG1 THR 27.A OG1 no hydrogen 2.872 N/A SER 30.A OG GLU 3.A OE2 no hydrogen 3.434 N/A TYR 31.A OH GLU 25.A OE2 no hydrogen 3.212 N/A GLU 32.A N MET 6.A O no hydrogen 2.816 N/A LYS 34.A N LEU 8.A O no hydrogen 2.739 N/A TYR 36.A N TYR 10.A O no hydrogen 2.827 N/A TYR 36.A OH TYR 65.A OH no hydrogen 2.802 N/A THR 37.A N GLN 48.A OE1 no hydrogen 3.052 N/A THR 37.A OG1 GLN 48.A OE1 no hydrogen 3.512 N/A CYS 38.A SG GLY 39.A O no hydrogen 3.472 N/A ASP 45.A N ASP 43.A O no hydrogen 2.655 N/A SER 47.A OG ASP 45.A OD1 no hydrogen 3.027 N/A SER 47.A OG ASP 45.A OD2 no hydrogen 2.918 N/A TRP 49.A N ARG 46.A O no hydrogen 3.107 N/A LEU 50.A N ARG 46.A O no hydrogen 3.314 N/A ASP 51.A N SER 47.A O no hydrogen 2.866 N/A VAL 52.A N TRP 49.A O no hydrogen 3.089 N/A LYS 53.A N TRP 49.A O no hydrogen 2.854 N/A LYS 55.A N VAL 52.A O no hydrogen 2.868 N/A LEU 63.A N ASN 62.A OD1 no hydrogen 2.980 N/A TYR 65.A N GLY 9.A O no hydrogen 2.955 N/A TYR 65.A OH TYR 36.A OH no hydrogen 2.802 N/A LEU 66.A N ILE 73.A O no hydrogen 2.954 N/A LEU 67.A N VAL 7.A O no hydrogen 2.964 N/A ASP 68.A N ASN 71.A O no hydrogen 2.765 N/A ASN 71.A N ASP 68.A O no hydrogen 2.903 N/A LYS 72.A NZ GLY 69.A O no hydrogen 3.341 N/A ILE 73.A N LEU 66.A O no hydrogen 2.762 N/A THR 74.A OG1 PHE 60.A O no hydrogen 3.403 N/A ALA 78.A N GLN 75.A O no hydrogen 2.846 N/A ILE 79.A N GLN 75.A O no hydrogen 3.060 N/A LEU 80.A N SER 76.A O no hydrogen 2.959 N/A ARG 81.A N ASN 77.A O no hydrogen 3.013 N/A ARG 81.A NE GLU 104.A OE1 no hydrogen 3.237 N/A ARG 81.A NH2 ASP 101.A OD1 no hydrogen 3.117 N/A ARG 81.A NH2 GLU 104.A OE1 no hydrogen 2.755 N/A TYR 82.A N ALA 78.A O no hydrogen 3.031 N/A TYR 82.A OH ASP 68.A OD2 no hydrogen 2.674 N/A TYR 82.A OH ASN 71.A OD1 no hydrogen 3.373 N/A ILE 83.A N ILE 79.A O no hydrogen 3.057 N/A ALA 84.A N LEU 80.A O no hydrogen 2.934 N/A ARG 85.A N ARG 81.A O no hydrogen 2.792 N/A LYS 86.A N TYR 82.A O no hydrogen 3.216 N/A LYS 86.A NZ TYR 82.A OH no hydrogen 3.180 N/A HIS 87.A N ALA 84.A O no hydrogen 2.818 N/A HIS 87.A NE2 THR 29.A OG1 no hydrogen 3.035 N/A ASN 88.A N ARG 85.A O no hydrogen 3.125 N/A MET 89.A N ALA 84.A O no hydrogen 2.938 N/A GLU 92.A N GLU 96.A OE1 no hydrogen 3.024 N/A THR 93.A N GLU 96.A OE1 no hydrogen 3.033 N/A THR 93.A OG1 GLU 96.A OE1 no hydrogen 3.228 N/A GLU 96.A N THR 93.A OG1 no hydrogen 3.363 N/A LYS 97.A N THR 93.A O no hydrogen 2.879 N/A ILE 98.A N GLU 94.A O no hydrogen 3.047 N/A ARG 99.A N GLU 95.A O no hydrogen 3.256 N/A ARG 99.A NH1 PHE 144.A O no hydrogen 3.427 N/A ARG 99.A NH1 PHE 151.A O no hydrogen 2.682 N/A ARG 99.A NH2 PHE 144.A O no hydrogen 3.083 N/A VAL 100.A N GLU 96.A O no hydrogen 2.952 N/A ASP 101.A N LYS 97.A O no hydrogen 2.956 N/A ILE 102.A N ILE 98.A O no hydrogen 2.946 N/A ILE 103.A N ARG 99.A O no hydrogen 2.853 N/A GLU 104.A N VAL 100.A O no hydrogen 2.900 N/A ASN 105.A N ASP 101.A O no hydrogen 3.392 N/A ASN 105.A ND2 ASP 101.A O no hydrogen 2.690 N/A GLN 106.A N ILE 102.A O no hydrogen 2.801 N/A GLN 106.A NE2 GLN 137.A OE1 no hydrogen 3.600 N/A VAL 107.A N ILE 103.A O no hydrogen 2.811 N/A ASP 109.A N ASN 105.A O no hydrogen 3.171 N/A PHE 110.A N GLN 106.A O no hydrogen 3.001 N/A ARG 111.A N VAL 107.A O no hydrogen 2.823 N/A ARG 111.A NH2 ASP 165.A OD2 no hydrogen 3.514 N/A THR 112.A N MET 108.A O no hydrogen 3.014 N/A THR 112.A OG1 MET 108.A O no hydrogen 2.776 N/A GLN 113.A N ASP 109.A O no hydrogen 3.391 N/A LEU 114.A N PHE 110.A O no hydrogen 3.291 N/A ILE 115.A N ARG 111.A O no hydrogen 2.842 N/A ARG 116.A N THR 112.A O no hydrogen 2.950 N/A LEU 117.A N GLN 113.A O no hydrogen 2.916 N/A CYS 118.A N LEU 114.A O no hydrogen 2.777 N/A CYS 118.A SG LEU 114.A O no hydrogen 3.335 N/A TYR 119.A N ILE 115.A O no hydrogen 2.817 N/A SER 120.A N ARG 116.A O no hydrogen 2.935 N/A ASP 122.A N SER 120.A OG no hydrogen 3.170 N/A HIS 123.A N SER 120.A O no hydrogen 3.184 N/A HIS 123.A ND1 LEU 117.A O no hydrogen 2.757 N/A LEU 126.A N ASP 122.A O no hydrogen 2.946 N/A LYS 127.A N HIS 123.A O no hydrogen 2.786 N/A LYS 127.A N GLU 124.A O no hydrogen 3.139 N/A TYR 130.A N LEU 126.A O no hydrogen 3.127 N/A LEU 131.A N LYS 127.A O no hydrogen 3.096 N/A GLU 132.A N PRO 128.A O no hydrogen 2.863 N/A GLU 133.A N GLN 129.A O no hydrogen 3.155 N/A GLU 133.A N TYR 130.A O no hydrogen 3.293 N/A LEU 134.A N LEU 131.A O no hydrogen 3.059 N/A LEU 138.A N LEU 134.A O no hydrogen 3.070 N/A LYS 139.A N PRO 135.A O no hydrogen 2.827 N/A GLN 140.A N GLY 136.A O no hydrogen 3.222 N/A GLN 140.A NE2 GLN 137.A OE1 no hydrogen 3.053 N/A PHE 141.A N GLN 137.A O no hydrogen 3.271 N/A SER 142.A N LEU 138.A O no hydrogen 3.016 N/A MET 143.A N LYS 139.A O no hydrogen 2.915 N/A PHE 144.A N GLN 140.A O no hydrogen 2.895 N/A LEU 145.A N PHE 141.A O no hydrogen 2.920 N/A GLY 146.A N SER 142.A O no hydrogen 2.989 N/A PHE 148.A N LEU 145.A O no hydrogen 3.166 N/A SER 149.A N GLU 154.A OE2 no hydrogen 2.899 N/A SER 149.A OG GLU 154.A OE1 no hydrogen 2.805 N/A SER 149.A OG GLU 154.A OE2 no hydrogen 2.925 N/A TRP 150.A N GLY 153.A O no hydrogen 3.023 N/A PHE 151.A N ASP 160.A OD1 no hydrogen 3.047 N/A GLY 153.A N TRP 150.A O no hydrogen 2.949 N/A LYS 155.A NZ GLU 92.A OE2 no hydrogen 3.165 N/A THR 157.A N ASP 160.A OD2 no hydrogen 3.071 N/A PHE 158.A N MET 89.A O no hydrogen 3.049 N/A ASP 160.A N THR 157.A O no hydrogen 3.166 N/A LEU 162.A N PHE 158.A O no hydrogen 3.302 N/A THR 163.A N VAL 159.A O no hydrogen 2.836 N/A THR 163.A OG1 VAL 159.A O no hydrogen 2.760 N/A TYR 164.A N ASP 160.A O no hydrogen 2.856 N/A TYR 164.A OH GLU 192.A OE2 no hydrogen 3.214 N/A ASP 165.A N PHE 161.A O no hydrogen 3.158 N/A ILE 166.A N LEU 162.A O no hydrogen 3.244 N/A LEU 167.A N THR 163.A O no hydrogen 2.921 N/A ASP 168.A N TYR 164.A O no hydrogen 2.775 N/A GLN 169.A N ASP 165.A O no hydrogen 3.034 N/A ASN 170.A N ILE 166.A O no hydrogen 3.079 N/A ASN 170.A ND2 TYR 130.A OH no hydrogen 2.840 N/A ARG 171.A N LEU 167.A O no hydrogen 2.846 N/A ARG 171.A NH2 GLU 192.A OE1 no hydrogen 2.987 N/A ILE 172.A N ASP 168.A O no hydrogen 2.896 N/A PHE 173.A N GLN 169.A O no hydrogen 3.017 N/A ASP 174.A N ASN 170.A O no hydrogen 2.815 N/A CYS 177.A N ASP 174.A O no hydrogen 2.978 N/A CYS 177.A SG ASN 170.A O no hydrogen 3.648 N/A CYS 177.A SG ASP 174.A O no hydrogen 2.825 N/A ASP 179.A N LYS 176.A O no hydrogen 2.964 N/A PHE 181.A N LEU 178.A O no hydrogen 2.848 N/A ASN 183.A ND2 SER 142.A O no hydrogen 2.941 N/A ASN 183.A ND2 SER 142.A OG no hydrogen 3.379 N/A ASN 183.A ND2 GLY 146.A O no hydrogen 3.044 N/A LEU 184.A N PHE 181.A O no hydrogen 2.948 N/A LYS 185.A N PHE 181.A O no hydrogen 3.294 N/A LYS 185.A NZ ASP 179.A O no hydrogen 3.416 N/A ALA 186.A N PRO 182.A O no hydrogen 3.272 N/A PHE 187.A N ASN 183.A O no hydrogen 3.349 N/A MET 188.A N LEU 184.A O no hydrogen 2.953 N/A CYS 189.A N LYS 185.A O no hydrogen 3.263 N/A CYS 189.A SG LYS 185.A O no hydrogen 3.468 N/A ARG 190.A N ALA 186.A O no hydrogen 3.017 N/A ARG 190.A NE SER 149.A O no hydrogen 3.002 N/A ARG 190.A NH2 SER 149.A O no hydrogen 2.762 N/A PHE 191.A N PHE 187.A O no hydrogen 2.863 N/A GLU 192.A N MET 188.A O no hydrogen 2.945 N/A LEU 194.A N PHE 191.A O no hydrogen 3.203 N/A LYS 196.A NZ ASP 28.A OD2 no hydrogen 3.166 N/A ALA 198.A N LEU 194.A O no hydrogen 2.890 N/A ALA 199.A N GLU 195.A O no hydrogen 3.113 N/A TYR 200.A N LYS 196.A O no hydrogen 3.201 N/A LEU 201.A N ILE 197.A O no hydrogen 2.867 N/A GLN 202.A N ALA 198.A O no hydrogen 3.238 N/A GLN 202.A N ALA 199.A O no hydrogen 3.175 N/A SER 203.A N TYR 200.A O no hydrogen 2.933 N/A SER 203.A OG GLN 205.A OE1 no hydrogen 2.642 N/A GLN 205.A N GLN 205.A OE1 no hydrogen 2.716 N/A CYS 207.A N SER 203.A O no hydrogen 3.421 N/A CYS 207.A N ASP 204.A O no hydrogen 2.907 N/A CYS 207.A SG SER 203.A O no hydrogen 3.155 N/A LYS 208.A N ASP 204.A O no hydrogen 3.376 N/A LYS 208.A N GLN 205.A O no hydrogen 3.015 N/A LYS 208.A NZ ASP 204.A O no hydrogen 2.839 N/A MET 209.A N PHE 206.A O no hydrogen 3.393 N/A ASN 212.A N GLY 219.A O no hydrogen 2.837 N/A ASN 212.A ND2 TRP 218.A O no hydrogen 2.879 N/A ASN 213.A N TYR 119.A OH no hydrogen 3.142 N/A LYS 214.A N ASN 213.A OD1 no hydrogen 2.785 N/A LYS 214.A NZ CYS 38.A O no hydrogen 3.141 N/A LYS 214.A NZ GLU 40.A OE1 no hydrogen 3.440 N/A ALA 216.A N ASN 213.A O no hydrogen 2.840 N/A ASN 220.A ND2 LYS 214.A O no hydrogen 3.403 N/A