Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2buk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N ALA 4.A O no hydrogen 2.622 N/A MET 8.A N ALA 4.A O no hydrogen 3.196 N/A ILE 9.A N VAL 5.A O no hydrogen 3.174 N/A ASN 10.A ND2 LYS 6.A O no hydrogen 2.906 N/A THR 11.A N ARG 7.A O no hydrogen 3.016 N/A HIS 12.A N ILE 9.A O no hydrogen 3.295 N/A HIS 12.A ND1 MET 8.A O no hydrogen 2.555 N/A LYS 16.A NZ ASP 183.A OD1 no hydrogen 2.673 N/A ARG 17.A N ILE 46.A O no hydrogen 3.048 N/A ARG 17.A NH2 GLU 178.A OE2 no hydrogen 3.147 N/A PHE 18.A N ALA 179.A O no hydrogen 2.990 N/A LEU 20.A N TYR 177.A O no hydrogen 2.966 N/A ASN 22.A N SER 175.A O no hydrogen 2.671 N/A ASN 22.A ND2 GLN 34.A OE1 no hydrogen 3.227 N/A GLY 24.A N ASP 174.A OD1 no hydrogen 2.936 N/A ASN 25.A N TRP 173.A O no hydrogen 3.041 N/A ASN 27.A N GLY 171.A O no hydrogen 2.976 N/A ASN 27.A ND2 GLN 72.A OE1 no hydrogen 3.045 N/A ASN 27.A ND2 THR 73.A O no hydrogen 3.008 N/A ALA 28.A N GLN 164.A OE1 no hydrogen 3.419 N/A THR 32.A N GLN 164.A O no hydrogen 3.012 N/A GLN 34.A N MET 162.A O no hydrogen 2.742 N/A GLN 34.A NE2 THR 32.A OG1 no hydrogen 3.099 N/A ASN 35.A ND2 THR 88.A OG1 no hydrogen 3.035 N/A LEU 36.A N ILE 160.A O no hydrogen 3.290 N/A ASN 38.A ND2 VAL 151.A O no hydrogen 2.692 N/A ASN 38.A ND2 ASN 155.A OD1 no hydrogen 2.987 N/A ILE 40.A N SER 37.A O no hydrogen 3.447 N/A GLN 42.A N ALA 148.A O no hydrogen 3.146 N/A GLN 42.A NE2 GLY 51.A O no hydrogen 3.456 N/A GLN 42.A NE2 ASP 52.A OD1 no hydrogen 3.252 N/A GLY 43.A N ARG 49.A O no hydrogen 3.053 N/A ASP 45.A N GLN 48.A OE1 no hydrogen 2.948 N/A ILE 46.A N ASP 45.A OD2 no hydrogen 2.764 N/A GLN 48.A N ASP 45.A O no hydrogen 3.300 N/A ARG 49.A N ILE 41.A O no hydrogen 2.908 N/A ARG 49.A NE ILE 40.A O no hydrogen 2.533 N/A ARG 49.A NH1 GLY 51.A O no hydrogen 2.839 N/A ARG 49.A NH1 ASP 52.A OD1 no hydrogen 3.148 N/A ARG 49.A NH1 GLY 147.A O no hydrogen 3.429 N/A ARG 49.A NH2 GLY 147.A O no hydrogen 2.569 N/A SER 50.A N ASP 183.A OD1 no hydrogen 2.944 N/A SER 50.A N ASP 183.A OD2 no hydrogen 3.412 N/A GLN 53.A NE2 ASN 144.A OD1 no hydrogen 2.829 N/A VAL 54.A N VAL 143.A O no hydrogen 3.083 N/A ARG 55.A N THR 182.A O no hydrogen 3.066 N/A ILE 56.A N GLN 141.A O no hydrogen 2.967 N/A VAL 57.A N VAL 180.A O no hydrogen 2.547 N/A SER 58.A N VAL 180.A O no hydrogen 3.314 N/A HIS 59.A N LEU 138.A O no hydrogen 2.898 N/A HIS 59.A ND1 TYR 177.A OH no hydrogen 2.839 N/A LYS 60.A N GLU 178.A O no hydrogen 2.847 N/A LEU 61.A N ILE 136.A O no hydrogen 2.832 N/A HIS 62.A N SER 176.A O no hydrogen 2.950 N/A HIS 62.A NE2 ASP 133.A OD2 no hydrogen 2.699 N/A VAL 63.A N ARG 134.A O no hydrogen 2.956 N/A ARG 64.A N ASP 174.A O no hydrogen 2.903 N/A ARG 64.A NE ASP 174.A OD2 no hydrogen 3.029 N/A ARG 64.A NH2 ASP 174.A OD2 no hydrogen 3.435 N/A GLY 65.A N LYS 132.A O no hydrogen 2.892 N/A THR 66.A N LEU 172.A O no hydrogen 2.744 N/A ALA 67.A N SER 130.A O no hydrogen 2.957 N/A SER 71.A OG SER 125.A OG no hydrogen 3.322 N/A GLN 72.A N CYS 124.A O no hydrogen 2.933 N/A GLN 72.A NE2 ILE 68.A O no hydrogen 3.253 N/A GLN 72.A NE2 VAL 70.A O no hydrogen 2.814 N/A THR 73.A N ASP 167.A OD2 no hydrogen 2.836 N/A PHE 74.A N LEU 122.A O no hydrogen 2.894 N/A ARG 75.A N ILE 165.A O no hydrogen 2.880 N/A ARG 75.A NE ASP 119.A OD2 no hydrogen 2.883 N/A ARG 75.A NH1 PHE 100.A O no hydrogen 3.123 N/A ARG 75.A NH1 SER 102.A O no hydrogen 2.746 N/A ARG 75.A NH2 SER 102.A O no hydrogen 3.358 N/A ARG 75.A NH2 ASP 119.A OD1 no hydrogen 2.925 N/A ARG 75.A NH2 ASP 119.A OD2 no hydrogen 3.506 N/A PHE 76.A N VAL 120.A O no hydrogen 2.675 N/A ILE 77.A N LEU 163.A O no hydrogen 2.822 N/A TRP 78.A N LYS 118.A O no hydrogen 2.731 N/A PHE 79.A N PHE 161.A O no hydrogen 2.951 N/A ARG 80.A N THR 115.A O no hydrogen 2.945 N/A ARG 80.A NE ASN 82.A OD1 no hydrogen 2.720 N/A ARG 80.A NH2 ASN 82.A OD1 no hydrogen 3.170 N/A ASP 81.A N ALA 159.A O no hydrogen 2.859 N/A ASN 82.A N ARG 113.A O no hydrogen 2.944 N/A ASN 82.A ND2 LYS 112.A O no hydrogen 3.226 N/A ASN 82.A ND2 THR 115.A OG1 no hydrogen 3.076 N/A MET 83.A N ASP 81.A OD1 no hydrogen 3.359 N/A ASN 84.A ND2 ASP 81.A OD2 no hydrogen 2.724 N/A ASN 84.A ND2 THR 87.A O no hydrogen 3.032 N/A GLY 86.A N ASN 84.A OD1 no hydrogen 2.985 N/A THR 87.A N ASN 84.A OD1 no hydrogen 3.309 N/A THR 90.A N GLU 93.A OE2 no hydrogen 3.183 N/A GLU 93.A N THR 90.A O no hydrogen 3.342 N/A VAL 94.A N VAL 91.A O no hydrogen 3.346 N/A LEU 95.A N VAL 91.A O no hydrogen 2.860 N/A ASN 96.A N GLN 103.A O no hydrogen 3.080 N/A THR 97.A N SER 102.A OG no hydrogen 3.383 N/A ASN 99.A N THR 97.A O no hydrogen 2.721 N/A MET 101.A N ASN 99.A OD1 no hydrogen 3.105 N/A SER 102.A N ASN 99.A O no hydrogen 3.333 N/A SER 102.A OG THR 97.A O no hydrogen 3.557 N/A SER 102.A OG GLN 103.A O no hydrogen 2.754 N/A TYR 104.A OH ASP 119.A OD1 no hydrogen 2.357 N/A ASN 105.A N VAL 94.A O no hydrogen 2.906 N/A ASN 105.A ND2 LEU 92.A O no hydrogen 2.910 N/A ILE 107.A N ASN 105.A OD1 no hydrogen 2.997 N/A THR 108.A N ASN 105.A OD1 no hydrogen 3.274 N/A THR 108.A OG1 GLU 93.A O no hydrogen 2.656 N/A THR 108.A OG1 ASN 105.A O no hydrogen 3.375 N/A LEU 109.A N ASN 105.A O no hydrogen 3.263 N/A ARG 113.A N THR 108.A O no hydrogen 2.950 N/A ARG 113.A NH1 GLN 111.A OE1 no hydrogen 2.934 N/A ARG 113.A NH2 GLU 93.A OE1 no hydrogen 3.052 N/A THR 115.A N ARG 80.A O no hydrogen 2.960 N/A LEU 117.A N TRP 78.A O no hydrogen 2.813 N/A LYS 118.A N TRP 78.A O no hydrogen 3.212 N/A VAL 120.A N PHE 76.A O no hydrogen 2.755 N/A LEU 122.A N PHE 74.A O no hydrogen 2.750 N/A CYS 124.A N GLN 72.A O no hydrogen 2.905 N/A CYS 124.A SG GLY 65.A O no hydrogen 3.043 N/A SER 125.A N GLU 129.A O no hydrogen 2.973 N/A SER 125.A OG SER 71.A OG no hydrogen 3.322 N/A SER 125.A OG THR 127.A OG1 no hydrogen 3.057 N/A LEU 126.A N SER 71.A OG no hydrogen 2.943 N/A THR 127.A OG1 SER 125.A OG no hydrogen 3.057 N/A LYS 132.A N GLY 65.A O no hydrogen 3.143 N/A LYS 132.A NZ ASN 123.A O no hydrogen 2.862 N/A ARG 134.A N VAL 63.A O no hydrogen 2.845 N/A ILE 136.A N LEU 61.A O no hydrogen 2.863 N/A LEU 138.A N HIS 59.A O no hydrogen 2.913 N/A GLY 140.A N VAL 57.A O no hydrogen 3.245 N/A VAL 143.A N VAL 54.A O no hydrogen 2.850 N/A ASN 144.A N PRO 157.A O no hydrogen 3.042 N/A ASN 144.A ND2 PRO 157.A O no hydrogen 3.137 N/A TYR 145.A N ASP 52.A O no hydrogen 2.841 N/A TYR 145.A OH SER 37.A O no hydrogen 2.564 N/A ASN 146.A N SER 154.A O no hydrogen 2.832 N/A ASN 146.A ND2 ASN 155.A O no hydrogen 3.021 N/A SER 154.A N VAL 151.A O no hydrogen 3.048 N/A SER 154.A OG THR 149.A O no hydrogen 2.447 N/A ASN 155.A N ALA 152.A O no hydrogen 3.167 N/A ASN 155.A ND2 ASN 35.A OD1 no hydrogen 2.764 N/A ASN 155.A ND2 THR 87.A O no hydrogen 3.523 N/A GLY 158.A N ASP 81.A O no hydrogen 2.644 N/A ALA 159.A N GLY 156.A O no hydrogen 2.882 N/A ILE 160.A N SER 37.A OG no hydrogen 3.130 N/A PHE 161.A N PHE 79.A O no hydrogen 2.847 N/A MET 162.A N GLN 34.A O no hydrogen 3.036 N/A LEU 163.A N ILE 77.A O no hydrogen 2.807 N/A GLN 164.A N THR 32.A O no hydrogen 2.912 N/A GLN 164.A NE2 ASN 27.A OD1 no hydrogen 3.023 N/A ILE 165.A N ARG 75.A O no hydrogen 3.122 N/A GLY 166.A N ALA 28.A O no hydrogen 2.744 N/A VAL 170.A N SER 168.A OG no hydrogen 3.424 N/A LEU 172.A N THR 66.A O no hydrogen 3.057 N/A TRP 173.A N ASN 25.A O no hydrogen 2.782 N/A ASP 174.A N ARG 64.A O no hydrogen 2.817 N/A SER 175.A N ASN 22.A O no hydrogen 2.899 N/A SER 175.A OG ASN 22.A O no hydrogen 3.545 N/A SER 176.A N HIS 62.A O no hydrogen 3.033 N/A TYR 177.A N LEU 20.A O no hydrogen 2.847 N/A TYR 177.A OH HIS 59.A ND1 no hydrogen 2.839 N/A GLU 178.A N LYS 60.A O no hydrogen 3.003 N/A ALA 179.A N PHE 18.A O no hydrogen 2.933 N/A VAL 180.A N SER 58.A O no hydrogen 2.886 N/A TYR 181.A N LYS 16.A O no hydrogen 3.042 N/A TYR 181.A OH GLN 48.A O no hydrogen 2.817 N/A THR 182.A N ARG 55.A O no hydrogen 2.757 N/A