Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bue_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N MET 61.A O no hydrogen 2.970 N/A ARG 6.A N ILE 59.A O no hydrogen 3.020 N/A ARG 6.A NH1 LEU 7.A O no hydrogen 3.171 N/A ARG 6.A NH1 ASP 12.A OD2 no hydrogen 2.828 N/A ARG 6.A NH2 ASP 12.A OD1 no hydrogen 2.874 N/A ARG 6.A NH2 ASP 12.A OD2 no hydrogen 3.552 N/A MET 8.A N PRO 57.A O no hydrogen 2.932 N/A THR 9.A N ASP 12.A OD2 no hydrogen 2.869 N/A THR 9.A OG1 ASP 12.A OD2 no hydrogen 3.549 N/A HIS 11.A N THR 9.A OG1 no hydrogen 3.119 N/A ASP 12.A N THR 9.A O no hydrogen 2.921 N/A LEU 13.A N GLU 10.A O no hydrogen 3.308 N/A LEU 16.A N ASP 12.A O no hydrogen 2.869 N/A TYR 17.A N LEU 13.A O no hydrogen 2.860 N/A GLU 18.A N ALA 14.A O no hydrogen 3.033 N/A TRP 19.A N MET 15.A O no hydrogen 2.948 N/A LEU 20.A N LEU 16.A O no hydrogen 2.800 N/A ASN 21.A N GLU 18.A O no hydrogen 3.169 N/A ASN 21.A ND2 TYR 17.A O no hydrogen 2.982 N/A ASN 21.A ND2 PRO 36.A O no hydrogen 2.994 N/A ARG 22.A N TRP 19.A O no hydrogen 2.980 N/A ARG 22.A NH1 ALA 99.A O no hydrogen 2.838 N/A ARG 22.A NH1 ASN 100.A OD1 no hydrogen 3.102 N/A ARG 22.A NH2 GLU 18.A OE2 no hydrogen 3.087 N/A HIS 24.A NE2 LEU 98.A O no hydrogen 2.871 N/A ILE 25.A N ARG 22.A O no hydrogen 2.964 N/A VAL 26.A N ARG 22.A O no hydrogen 2.954 N/A GLU 27.A N SER 23.A O no hydrogen 3.269 N/A TRP 28.A N ILE 25.A O no hydrogen 2.978 N/A TRP 29.A NE1 TYR 45.A OH no hydrogen 3.022 N/A GLU 33.A N GLY 30.A O no hydrogen 2.842 N/A ALA 34.A N GLY 31.A O no hydrogen 3.154 N/A ARG 35.A NH2 ASN 21.A O no hydrogen 2.901 N/A THR 37.A N ASP 40.A OD2 no hydrogen 3.067 N/A ASP 40.A N THR 37.A OG1 no hydrogen 2.915 N/A VAL 41.A N THR 37.A O no hydrogen 3.028 N/A GLN 42.A N LEU 38.A O no hydrogen 2.823 N/A GLU 43.A N ALA 39.A O no hydrogen 2.819 N/A GLN 44.A N ASP 40.A O no hydrogen 2.869 N/A TYR 45.A N VAL 41.A O no hydrogen 2.881 N/A VAL 49.A N LEU 46.A O no hydrogen 2.856 N/A LEU 50.A N LEU 46.A O no hydrogen 3.026 N/A ALA 51.A N PRO 47.A O no hydrogen 2.894 N/A GLN 52.A N VAL 49.A O no hydrogen 3.060 N/A GLN 52.A NE2 SER 48.A O no hydrogen 2.620 N/A GLU 53.A N LEU 50.A O no hydrogen 2.888 N/A SER 54.A N ALA 51.A O no hydrogen 3.120 N/A VAL 55.A N LEU 50.A O no hydrogen 3.012 N/A THR 56.A N SER 72.A O no hydrogen 2.799 N/A TYR 58.A N ALA 70.A O no hydrogen 2.728 N/A TYR 58.A OH SER 72.A OG no hydrogen 2.706 N/A ILE 59.A N ARG 6.A O no hydrogen 2.826 N/A ALA 60.A N GLY 68.A O no hydrogen 2.918 N/A MET 61.A N THR 4.A O no hydrogen 2.816 N/A LEU 62.A N GLU 65.A O no hydrogen 2.860 N/A GLU 65.A N LEU 62.A O no hydrogen 2.944 N/A ILE 67.A N ALA 60.A O no hydrogen 2.733 N/A TYR 69.A N LEU 97.A O no hydrogen 2.964 N/A TYR 69.A OH GLN 71.A OE1 no hydrogen 2.806 N/A ALA 70.A N TYR 58.A O no hydrogen 2.984 N/A GLN 71.A N ASP 95.A O no hydrogen 2.892 N/A GLN 71.A NE2 ASP 95.A OD2 no hydrogen 2.882 N/A SER 72.A N THR 56.A O no hydrogen 2.961 N/A SER 72.A OG TYR 58.A OH no hydrogen 2.706 N/A TYR 73.A N GLY 93.A O no hydrogen 2.899 N/A VAL 74.A N SER 54.A O no hydrogen 3.086 N/A ALA 75.A N VAL 91.A O no hydrogen 3.207 N/A GLY 77.A N VAL 74.A O no hydrogen 2.968 N/A SER 78.A N ALA 75.A O no hydrogen 3.358 N/A SER 78.A OG VAL 74.A O no hydrogen 3.221 N/A SER 78.A OG ALA 75.A O no hydrogen 3.070 N/A GLY 81.A N GLU 84.A OE2.A no hydrogen 3.034 N/A GLY 81.A N GLU 84.A OE2.B no hydrogen 2.929 N/A TRP 82.A N GLY 79.A O no hydrogen 2.992 N/A GLU 86.A N TRP 83.A O no hydrogen 3.092 N/A THR 87.A N GLU 86.A OE2 no hydrogen 2.986 N/A ASP 88.A N GLU 86.A OE2 no hydrogen 2.859 N/A GLY 90.A N ASP 88.A OD1 no hydrogen 2.810 N/A VAL 91.A N ASP 88.A O no hydrogen 3.230 N/A ARG 92.A N LYS 128.A O no hydrogen 3.032 N/A ARG 92.A NH1 PRO 89.A O no hydrogen 2.739 N/A ARG 92.A NH1 VAL 91.A O no hydrogen 3.021 N/A GLY 93.A N TYR 73.A O no hydrogen 2.876 N/A ILE 94.A N GLN 130.A O no hydrogen 3.082 N/A ASP 95.A N GLN 71.A O no hydrogen 3.053 N/A LEU 97.A N TYR 69.A O no hydrogen 2.858 N/A ALA 99.A N ILE 67.A O no hydrogen 2.759 N/A ASN 100.A ND2 GLN 103.A OE1 no hydrogen 2.856 N/A GLN 103.A N ASN 100.A O no hydrogen 2.890 N/A LEU 104.A N ALA 101.A O no hydrogen 3.322 N/A LYS 106.A NZ SER 102.A O no hydrogen 3.364 N/A LYS 111.A N GLY 107.A O no hydrogen 3.115 N/A LEU 112.A N LEU 108.A O no hydrogen 2.905 N/A VAL 113.A N GLY 109.A O no hydrogen 2.860 N/A ARG 114.A N THR 110.A O no hydrogen 2.865 N/A ARG 114.A NH2.A LYS 146.A O no hydrogen 2.864 N/A ARG 114.A NH2.B LYS 146.A O no hydrogen 2.679 N/A ALA 115.A N LYS 111.A O no hydrogen 2.949 N/A LEU 116.A N LEU 112.A O no hydrogen 2.929 N/A VAL 117.A N VAL 113.A O no hydrogen 2.849 N/A GLU 118.A N ARG 114.A O no hydrogen 2.938 N/A LEU 119.A N ALA 115.A O no hydrogen 2.944 N/A LEU 120.A N LEU 116.A O no hydrogen 2.972 N/A PHE 121.A N VAL 117.A O no hydrogen 3.013 N/A ASN 122.A N GLU 118.A O no hydrogen 3.034 N/A ASN 122.A N LEU 119.A O no hydrogen 3.015 N/A ASP 123.A N LEU 120.A O no hydrogen 2.984 N/A GLU 125.A N ASP 123.A OD1 no hydrogen 3.034 N/A VAL 126.A N ASP 123.A O no hydrogen 2.953 N/A THR 127.A N GLY 90.A O no hydrogen 2.948 N/A THR 127.A OG1 ASP 88.A OD2 no hydrogen 2.745 N/A ILE 129.A N GLN 167.A O no hydrogen 2.882 N/A GLN 130.A N ARG 92.A O no hydrogen 2.779 N/A GLN 130.A NE2 TYR 73.A OH no hydrogen 2.967 N/A THR 131.A N MET 165.A O no hydrogen 2.860 N/A THR 131.A OG1 ILE 94.A O no hydrogen 2.993 N/A SER 136.A N SER 134.A OG no hydrogen 2.943 N/A ASN 137.A N SER 134.A O no hydrogen 2.919 N/A LEU 138.A N SER 136.A O no hydrogen 3.114 N/A ALA 140.A N ASN 137.A OD1 no hydrogen 3.358 N/A ILE 141.A N ASN 137.A O no hydrogen 3.049 N/A ARG 142.A N LEU 138.A O no hydrogen 2.945 N/A ARG 142.A NH1 GLU 145.A OE1 no hydrogen 3.036 N/A CYS 143.A N ARG 139.A O no hydrogen 2.949 N/A CYS 143.A SG THR 110.A OG1 no hydrogen 3.702 N/A TYR 144.A N ALA 140.A O no hydrogen 2.934 N/A TYR 144.A OH GLN 96.A OE1 no hydrogen 2.572 N/A GLU 145.A N ILE 141.A O no hydrogen 2.970 N/A LYS 146.A N ARG 142.A O no hydrogen 2.898 N/A ALA 147.A N CYS 143.A O no hydrogen 2.967 N/A GLY 148.A N GLU 145.A O no hydrogen 2.985 N/A PHE 149.A N TYR 144.A O no hydrogen 2.953 N/A GLU 150.A N VAL 166.A O no hydrogen 2.802 N/A ARG 151.A NE GLU 145.A OE2 no hydrogen 2.737 N/A ARG 151.A NH2 GLU 145.A OE1 no hydrogen 3.413 N/A ARG 151.A NH2 GLU 145.A OE2 no hydrogen 2.966 N/A GLN 152.A N TYR 164.A O no hydrogen 2.776 N/A GLN 152.A NE2 GLU 150.A O no hydrogen 3.045 N/A VAL 155.A N ALA 162.A O no hydrogen 2.900 N/A THR 157.A N GLY 160.A O no hydrogen 3.038 N/A THR 157.A OG1 GLY 160.A O no hydrogen 2.674 N/A ASP 159.A N THR 157.A OG1 no hydrogen 3.020 N/A GLY 160.A N THR 157.A O no hydrogen 2.832 N/A ALA 162.A N VAL 155.A O no hydrogen 2.783 N/A VAL 163.A N PRO 133.A O no hydrogen 2.942 N/A TYR 164.A N GLY 153.A O no hydrogen 2.812 N/A TYR 164.A OH GLN 130.A OE1 no hydrogen 2.649 N/A MET 165.A N THR 131.A O no hydrogen 2.913 N/A VAL 166.A N GLU 150.A O no hydrogen 3.031 N/A GLN 167.A N ILE 129.A O no hydrogen 2.887 N/A ARG 169.A N THR 127.A O no hydrogen 3.056 N/A ARG 169.A NE VAL 126.A O no hydrogen 2.978 N/A ARG 169.A NH1 PHE 121.A O no hydrogen 2.964 N/A ARG 169.A NH2 PHE 121.A O no hydrogen 2.976 N/A ARG 169.A NH2 VAL 126.A O no hydrogen 2.777 N/A ALA 171.A N THR 168.A OG1 no hydrogen 3.029 N/A PHE 172.A N THR 168.A O no hydrogen 3.073 N/A GLU 173.A N ARG 169.A O no hydrogen 2.933 N/A ARG 174.A N GLN 170.A O no hydrogen 2.952 N/A THR 175.A N ALA 171.A O no hydrogen 3.020 N/A THR 175.A OG1 ALA 171.A O no hydrogen 2.993 N/A THR 175.A OG1 PHE 172.A O no hydrogen 3.297 N/A ARG 176.A N GLU 173.A O no hydrogen 3.203 N/A ARG 176.A NE PHE 172.A O no hydrogen 2.779 N/A ARG 176.A NH1 THR 175.A OG1 no hydrogen 2.881 N/A ALA 179.A N SER 177.A OG no hydrogen 3.245 N/A