Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bq0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ HIS 34.A ND1 no hydrogen 2.787 N/A LEU 6.A N ASP 2.A O no hydrogen 3.051 N/A VAL 7.A N LYS 3.A O no hydrogen 2.577 N/A GLN 8.A N SER 4.A O no hydrogen 2.888 N/A LYS 9.A N GLU 5.A O no hydrogen 2.736 N/A ALA 10.A N LEU 6.A O no hydrogen 2.727 N/A LYS 11.A N VAL 7.A O no hydrogen 2.878 N/A LYS 11.A NZ GLU 39.A OE2 no hydrogen 2.794 N/A LEU 12.A N GLN 8.A O no hydrogen 2.947 N/A ALA 13.A N LYS 9.A O no hydrogen 2.938 N/A GLU 14.A N ALA 10.A O no hydrogen 3.052 N/A GLN 15.A N LYS 11.A O no hydrogen 3.116 N/A ALA 16.A N LEU 12.A O no hydrogen 2.736 N/A GLU 17.A N GLU 14.A O no hydrogen 2.890 N/A ARG 18.A N ALA 13.A O no hydrogen 2.896 N/A ARG 18.A NE ASP 21.A OD2 no hydrogen 2.881 N/A ARG 18.A NH2 ASP 21.A OD2 no hydrogen 2.905 N/A MET 22.A N ARG 18.A O no hydrogen 3.154 N/A ALA 23.A N TYR 19.A O no hydrogen 2.905 N/A ALA 24.A N ASP 20.A O no hydrogen 2.924 N/A ALA 25.A N ASP 21.A O no hydrogen 2.927 N/A MET 26.A N MET 22.A O no hydrogen 3.035 N/A LYS 27.A N ALA 23.A O no hydrogen 2.719 N/A LYS 27.A NZ GLU 31.A OE2 no hydrogen 2.785 N/A ALA 28.A N ALA 24.A O no hydrogen 2.900 N/A VAL 29.A N ALA 25.A O no hydrogen 3.068 N/A VAL 29.A N MET 26.A O no hydrogen 3.252 N/A THR 30.A N MET 26.A O no hydrogen 2.980 N/A THR 30.A OG1 MET 26.A O no hydrogen 2.889 N/A GLU 31.A N LYS 27.A O no hydrogen 3.059 N/A GLN 32.A N VAL 29.A O no hydrogen 3.199 N/A GLN 32.A NE2 MET 1.A O no hydrogen 2.950 N/A GLY 33.A N THR 30.A O no hydrogen 3.308 N/A SER 37.A N GLU 40.A OE1 no hydrogen 2.678 N/A SER 37.A OG GLU 40.A OE1 no hydrogen 3.228 N/A GLU 39.A N SER 37.A OG no hydrogen 3.247 N/A GLU 40.A N SER 37.A OG no hydrogen 3.083 N/A ARG 41.A N SER 37.A O no hydrogen 2.654 N/A ARG 41.A NH1 SER 114.A OG no hydrogen 3.412 N/A ARG 41.A NH2 GLU 113.A OE2 no hydrogen 3.503 N/A ASN 42.A N ASN 38.A O no hydrogen 3.121 N/A LEU 43.A N GLU 39.A O no hydrogen 2.993 N/A LEU 44.A N GLU 40.A O no hydrogen 3.081 N/A SER 45.A N ARG 41.A O no hydrogen 3.226 N/A VAL 46.A N ASN 42.A O no hydrogen 2.746 N/A ALA 47.A N LEU 43.A O no hydrogen 2.865 N/A TYR 48.A N LEU 44.A O no hydrogen 3.135 N/A LYS 49.A N SER 45.A O no hydrogen 2.837 N/A ASN 50.A N VAL 46.A O no hydrogen 3.118 N/A ASN 50.A ND2 VAL 46.A O no hydrogen 2.705 N/A VAL 51.A N ALA 47.A O no hydrogen 3.031 N/A VAL 52.A N TYR 48.A O no hydrogen 2.928 N/A GLY 53.A N LYS 49.A O no hydrogen 2.845 N/A ALA 54.A N ASN 50.A O no hydrogen 3.118 N/A ARG 55.A NE GLU 89.A OE1 no hydrogen 2.895 N/A ARG 55.A NH1 VAL 51.A O no hydrogen 3.034 N/A ARG 55.A NH2 GLU 89.A OE1 no hydrogen 3.298 N/A ARG 56.A N VAL 52.A O no hydrogen 2.990 N/A ARG 56.A NE GLU 131.A OE1 no hydrogen 3.008 N/A ARG 56.A NH2 GLU 131.A OE1 no hydrogen 3.282 N/A ARG 56.A NH2 GLU 131.A OE2 no hydrogen 3.061 N/A SER 57.A N GLY 53.A O no hydrogen 3.024 N/A SER 58.A N ALA 54.A O no hydrogen 3.037 N/A SER 58.A OG ALA 54.A O no hydrogen 2.939 N/A TRP 59.A N ARG 55.A O no hydrogen 2.877 N/A TRP 59.A NE1 GLU 87.A OE2 no hydrogen 3.035 N/A ARG 60.A N ARG 56.A O no hydrogen 3.222 N/A VAL 61.A N SER 57.A O no hydrogen 3.056 N/A ILE 62.A N SER 58.A O no hydrogen 2.946 N/A SER 63.A N TRP 59.A O no hydrogen 2.667 N/A SER 63.A OG TRP 59.A O no hydrogen 3.286 N/A SER 64.A N ARG 60.A O no hydrogen 2.760 N/A ILE 65.A N VAL 61.A O no hydrogen 3.079 N/A GLU 66.A N ILE 62.A O no hydrogen 2.915 N/A GLN 67.A N SER 64.A O no hydrogen 3.085 N/A LYS 68.A N ILE 65.A O no hydrogen 3.162 N/A ASN 72.A N GLU 70.A OE2 no hydrogen 3.041 N/A LYS 75.A N ASN 72.A OD1 no hydrogen 2.882 N/A GLN 76.A N ASN 72.A O no hydrogen 3.026 N/A GLN 77.A N GLU 73.A O no hydrogen 2.906 N/A MET 78.A N LYS 74.A O no hydrogen 3.001 N/A GLY 79.A N LYS 75.A O no hydrogen 3.110 N/A LYS 80.A N GLN 76.A O no hydrogen 3.059 N/A LYS 80.A NZ GLU 84.A OE2 no hydrogen 3.080 N/A GLU 81.A N GLN 77.A O no hydrogen 2.828 N/A TYR 82.A N MET 78.A O no hydrogen 2.787 N/A ARG 83.A N GLY 79.A O no hydrogen 3.105 N/A ARG 83.A NE GLU 87.A OE2 no hydrogen 2.770 N/A ARG 83.A NH1 GLU 66.A OE1 no hydrogen 3.262 N/A GLU 84.A N LYS 80.A O no hydrogen 3.016 N/A LYS 85.A N GLU 81.A O no hydrogen 3.065 N/A ILE 86.A N TYR 82.A O no hydrogen 3.112 N/A GLU 87.A N ARG 83.A O no hydrogen 2.889 N/A ALA 88.A N GLU 84.A O no hydrogen 3.040 N/A GLU 89.A N LYS 85.A O no hydrogen 3.093 N/A LEU 90.A N ILE 86.A O no hydrogen 2.810 N/A GLN 91.A N GLU 87.A O no hydrogen 2.715 N/A ASP 92.A N ALA 88.A O no hydrogen 2.916 N/A ILE 93.A N GLU 89.A O no hydrogen 2.859 N/A CYS 94.A N LEU 90.A O no hydrogen 2.940 N/A CYS 94.A SG LEU 90.A O no hydrogen 3.449 N/A CYS 94.A SG TYR 125.A O no hydrogen 3.687 N/A ASN 95.A N GLN 91.A O no hydrogen 2.936 N/A ASP 96.A N ASP 92.A O no hydrogen 3.076 N/A VAL 97.A N ILE 93.A O no hydrogen 3.184 N/A LEU 98.A N CYS 94.A O no hydrogen 2.906 N/A GLU 99.A N ASN 95.A O no hydrogen 2.890 N/A LEU 100.A N ASP 96.A O no hydrogen 3.067 N/A LEU 101.A N VAL 97.A O no hydrogen 3.011 N/A ASP 102.A N LEU 98.A O no hydrogen 2.922 N/A LYS 103.A N GLU 99.A O no hydrogen 2.756 N/A TYR 104.A N LEU 100.A O no hydrogen 3.126 N/A LEU 105.A N LEU 100.A O no hydrogen 3.010 N/A ILE 106.A N LEU 101.A O no hydrogen 2.892 N/A ASN 108.A N TYR 104.A O no hydrogen 2.966 N/A ALA 109.A N ILE 106.A O no hydrogen 3.213 N/A THR 110.A N GLU 35.A OE2 no hydrogen 2.745 N/A LYS 115.A N GLN 111.A O no hydrogen 3.185 N/A VAL 116.A N PRO 112.A O no hydrogen 3.020 N/A PHE 117.A N GLU 113.A O no hydrogen 3.077 N/A TYR 118.A N SER 114.A O no hydrogen 2.856 N/A LEU 119.A N LYS 115.A O no hydrogen 3.123 N/A LYS 120.A N VAL 116.A O no hydrogen 2.847 N/A LYS 120.A NZ ASP 124.A OD2 no hydrogen 2.810 N/A MET 121.A N PHE 117.A O no hydrogen 3.058 N/A LYS 122.A N TYR 118.A O no hydrogen 2.727 N/A GLY 123.A N LEU 119.A O no hydrogen 2.872 N/A ASP 124.A N LYS 120.A O no hydrogen 2.942 N/A TYR 125.A N MET 121.A O no hydrogen 2.941 N/A PHE 126.A N LYS 122.A O no hydrogen 2.984 N/A ARG 127.A N GLY 123.A O no hydrogen 2.760 N/A ARG 127.A NE TYR 149.A OH no hydrogen 3.298 N/A ARG 127.A NH2 TYR 149.A OH no hydrogen 2.884 N/A TYR 128.A N ASP 124.A O no hydrogen 2.904 N/A LEU 129.A N TYR 125.A O no hydrogen 3.078 N/A SER 130.A N PHE 126.A O no hydrogen 3.013 N/A SER 130.A OG ARG 127.A O no hydrogen 2.774 N/A GLU 131.A N ARG 127.A O no hydrogen 3.128 N/A VAL 132.A N LEU 129.A O no hydrogen 3.175 N/A ALA 133.A N SER 130.A O no hydrogen 2.984 N/A THR 140.A N ASP 136.A O no hydrogen 3.172 N/A THR 140.A OG1 ASP 136.A O no hydrogen 2.562 N/A THR 141.A N ASN 137.A O no hydrogen 2.915 N/A VAL 142.A N LYS 138.A O no hydrogen 3.093 N/A SER 143.A N GLN 139.A O no hydrogen 3.014 N/A ASN 144.A N THR 140.A O no hydrogen 2.757 N/A SER 145.A N THR 141.A O no hydrogen 3.052 N/A SER 145.A OG GLY 123.A O no hydrogen 2.694 N/A GLN 146.A N VAL 142.A O no hydrogen 3.098 N/A GLN 147.A N SER 143.A O no hydrogen 3.041 N/A ALA 148.A N ASN 144.A O no hydrogen 3.307 N/A TYR 149.A N SER 145.A O no hydrogen 3.035 N/A TYR 149.A OH ASP 124.A OD1 no hydrogen 2.428 N/A GLN 150.A N GLN 146.A O no hydrogen 2.879 N/A GLN 150.A NE2 GLU 154.A OE2 no hydrogen 3.264 N/A GLU 151.A N GLN 147.A O no hydrogen 2.844 N/A ALA 152.A N ALA 148.A O no hydrogen 3.044 N/A PHE 153.A N TYR 149.A O no hydrogen 2.863 N/A GLU 154.A N GLN 150.A O no hydrogen 3.082 N/A ILE 155.A N GLU 151.A O no hydrogen 3.301 N/A SER 156.A N ALA 152.A O no hydrogen 2.796 N/A SER 156.A OG PHE 153.A O no hydrogen 3.177 N/A LYS 157.A N PHE 153.A O no hydrogen 2.955 N/A LYS 157.A NZ GLU 198.A OE2 no hydrogen 2.621 N/A LYS 158.A N GLU 154.A O no hydrogen 3.204 N/A LYS 158.A N ILE 155.A O no hydrogen 3.088 N/A GLU 159.A N ILE 155.A O no hydrogen 2.818 N/A MET 160.A N SER 156.A O no hydrogen 3.053 N/A THR 163.A OG1 THR 205.A OG1 no hydrogen 2.549 N/A HIS 164.A N GLN 161.A O no hydrogen 3.045 N/A ILE 166.A N HIS 164.A ND1 no hydrogen 3.041 N/A ARG 167.A NH1 MET 160.A O no hydrogen 2.745 N/A ARG 167.A NH2 GLU 198.A OE1 no hydrogen 2.853 N/A LEU 168.A N HIS 164.A O no hydrogen 2.859 N/A GLY 169.A N PRO 165.A O no hydrogen 2.754 N/A LEU 170.A N ILE 166.A O no hydrogen 2.979 N/A ALA 171.A N ARG 167.A O no hydrogen 3.164 N/A LEU 172.A N LEU 168.A O no hydrogen 2.765 N/A ASN 173.A N GLY 169.A O no hydrogen 2.773 N/A ASN 173.A ND2 ASP 124.A OD1 no hydrogen 2.877 N/A ASN 173.A ND2 ASP 124.A OD2 no hydrogen 3.366 N/A PHE 174.A N LEU 170.A O no hydrogen 2.632 N/A SER 175.A N ALA 171.A O no hydrogen 2.779 N/A SER 175.A OG ALA 171.A O no hydrogen 2.807 N/A SER 175.A OG LEU 172.A O no hydrogen 2.695 N/A VAL 176.A N LEU 172.A O no hydrogen 2.982 N/A PHE 177.A N ASN 173.A O no hydrogen 2.693 N/A TYR 178.A N PHE 174.A O no hydrogen 3.076 N/A TYR 179.A N SER 175.A O no hydrogen 3.159 N/A GLU 180.A N VAL 176.A O no hydrogen 2.905 N/A ILE 181.A N PHE 177.A O no hydrogen 2.869 N/A LEU 182.A N PHE 177.A O no hydrogen 3.260 N/A SER 184.A N TYR 178.A O no hydrogen 2.903 N/A LYS 187.A N SER 184.A OG no hydrogen 3.311 N/A ALA 188.A N SER 184.A O no hydrogen 3.152 N/A CYS 189.A N PRO 185.A O no hydrogen 2.838 N/A CYS 189.A SG PRO 185.A O no hydrogen 3.218 N/A SER 190.A N GLU 186.A O no hydrogen 3.050 N/A LEU 191.A N LYS 187.A O no hydrogen 3.322 N/A ALA 192.A N ALA 188.A O no hydrogen 3.229 N/A LYS 193.A N CYS 189.A O no hydrogen 2.987 N/A LYS 193.A NZ ASP 197.A OD1 no hydrogen 3.413 N/A LYS 193.A NZ ASP 197.A OD2 no hydrogen 2.685 N/A THR 194.A N SER 190.A O no hydrogen 2.930 N/A THR 194.A OG1 SER 190.A O no hydrogen 2.919 N/A ALA 195.A N LEU 191.A O no hydrogen 3.003 N/A PHE 196.A N ALA 192.A O no hydrogen 3.046 N/A ASP 197.A N LYS 193.A O no hydrogen 2.930 N/A GLU 198.A N THR 194.A O no hydrogen 2.880 N/A ALA 199.A N ALA 195.A O no hydrogen 3.004 N/A ILE 200.A N PHE 196.A O no hydrogen 2.855 N/A ALA 201.A N ASP 197.A O no hydrogen 2.954 N/A GLU 202.A N ALA 199.A O no hydrogen 2.814 N/A THR 205.A N GLU 202.A O no hydrogen 3.073 N/A THR 205.A OG1 THR 163.A OG1 no hydrogen 2.549 N/A THR 205.A OG1 GLU 202.A O no hydrogen 2.621 N/A LEU 206.A N LEU 203.A O no hydrogen 2.940 N/A SER 210.A N ASN 207.A OD1 no hydrogen 3.279 N/A SER 210.A OG ASN 207.A OD1 no hydrogen 3.130 N/A TYR 211.A N GLU 208.A O no hydrogen 3.414 N/A SER 214.A N SER 210.A O no hydrogen 2.927 N/A SER 214.A OG THR 163.A O no hydrogen 2.484 N/A SER 214.A OG SER 210.A O no hydrogen 3.099 N/A THR 215.A N TYR 211.A O no hydrogen 3.025 N/A THR 215.A OG1 TYR 211.A O no hydrogen 2.988 N/A THR 215.A OG1 LYS 212.A O no hydrogen 3.153 N/A LEU 216.A N LYS 212.A O no hydrogen 2.907 N/A ILE 217.A N ASP 213.A O no hydrogen 3.084 N/A MET 218.A N SER 214.A O no hydrogen 2.984 N/A GLN 219.A N THR 215.A O no hydrogen 2.854 N/A GLN 219.A NE2 ASP 223.A OD1 no hydrogen 3.105 N/A LEU 220.A N LEU 216.A O no hydrogen 3.059 N/A LEU 221.A N ILE 217.A O no hydrogen 2.923 N/A ARG 222.A N MET 218.A O no hydrogen 2.985 N/A ASP 223.A N GLN 219.A O no hydrogen 2.808 N/A ASN 224.A N LEU 220.A O no hydrogen 3.035 N/A LEU 225.A N LEU 221.A O no hydrogen 3.031 N/A THR 226.A N ARG 222.A O no hydrogen 3.034 N/A THR 226.A N ASP 223.A O no hydrogen 2.825 N/A THR 226.A OG1 ASP 223.A O no hydrogen 2.631 N/A LEU 227.A N ASP 223.A O no hydrogen 2.957 N/A TRP 228.A N ASN 224.A O no hydrogen 2.804 N/A THR 229.A N LEU 225.A O no hydrogen 3.376 N/A THR 229.A N THR 226.A O no hydrogen 3.108 N/A THR 229.A OG1 LEU 225.A O no hydrogen 2.854 N/A THR 229.A OG1 THR 226.A O no hydrogen 2.853 N/A SER 230.A N THR 226.A O no hydrogen 2.945 N/A SER 230.A OG THR 226.A O no hydrogen 2.864 N/A