Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bvs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N GLU 69.A OE2 no hydrogen 3.194 N/A HIS 4.A N GLU 69.A OE1 no hydrogen 3.026 N/A HIS 4.A N GLU 69.A OE2 no hydrogen 3.375 N/A LYS 8.A N HIS 4.A O no hydrogen 3.043 N/A ALA 9.A N PRO 5.A O no hydrogen 2.838 N/A LEU 10.A N PHE 6.A O no hydrogen 2.958 N/A GLN 11.A N VAL 7.A O no hydrogen 2.865 N/A GLU 12.A N LYS 8.A O no hydrogen 3.114 N/A HIS 13.A N ALA 9.A O no hydrogen 3.008 N/A HIS 13.A NE2 ASP 50.A OD1 no hydrogen 2.949 N/A PHE 14.A N LEU 10.A O no hydrogen 2.922 N/A THR 15.A N GLN 11.A O no hydrogen 2.979 N/A THR 15.A OG1 GLN 11.A O no hydrogen 2.621 N/A ALA 16.A N GLU 12.A O no hydrogen 2.891 N/A HIS 17.A N HIS 13.A O no hydrogen 3.276 N/A HIS 17.A N PHE 14.A O no hydrogen 2.945 N/A GLN 18.A N THR 15.A O no hydrogen 3.362 N/A ASN 19.A N LEU 37.A O no hydrogen 2.819 N/A LYS 22.A N ASN 19.A OD1 no hydrogen 2.706 N/A ALA 23.A N ASN 19.A O no hydrogen 2.943 N/A GLU 24.A N PRO 20.A O no hydrogen 3.432 N/A ALA 27.A N ALA 23.A O no hydrogen 2.847 N/A ARG 28.A N GLU 24.A O no hydrogen 2.984 N/A TYR 29.A N PRO 25.A O no hydrogen 3.336 N/A MET 30.A N ALA 27.A O no hydrogen 3.188 N/A LYS 31.A N ARG 28.A O no hydrogen 2.754 N/A ASN 32.A N ALA 27.A O no hydrogen 2.827 N/A HIS 33.A N MET 30.A O no hydrogen 3.141 N/A LEU 37.A N GLU 77.A OE1 no hydrogen 2.811 N/A GLY 38.A N GLU 77.A OE2 no hydrogen 2.712 N/A ILE 39.A N GLU 77.A OE2 no hydrogen 3.012 N/A ARG 44.A N GLN 40.A O no hydrogen 2.931 N/A ARG 44.A NH1 THR 41.A OG1.B no hydrogen 3.082 N/A ARG 44.A NH2 ASP 84.A OD2 no hydrogen 2.805 N/A ARG 45.A N THR 41.A O no hydrogen 2.757 N/A ARG 45.A NE ASP 84.A OD1 no hydrogen 3.285 N/A ARG 45.A NE ASP 84.A OD2 no hydrogen 3.154 N/A ARG 45.A NH1 ASP 84.A OD1 no hydrogen 3.088 N/A GLN 46.A N PRO 42.A O no hydrogen 2.892 N/A GLN 46.A NE2 ASP 50.A OD2 no hydrogen 3.229 N/A LEU 47.A N GLU 43.A O no hydrogen 2.705 N/A LEU 48.A N ARG 44.A O no hydrogen 2.968 N/A LYS 49.A N ARG 45.A O no hydrogen 2.756 N/A ASP 50.A N GLN 46.A O no hydrogen 2.828 N/A ILE 51.A N LEU 47.A O no hydrogen 3.173 N/A ILE 52.A N LEU 48.A O no hydrogen 2.853 N/A GLN 53.A N LYS 49.A O no hydrogen 2.908 N/A ILE 54.A N ASP 50.A O no hydrogen 2.911 N/A HIS 55.A N ILE 51.A O no hydrogen 2.784 N/A THR 56.A OG1 HIS 55.A O no hydrogen 2.722 N/A LYS 61.A N ASP 59.A OD1 no hydrogen 2.829 N/A ASP 62.A N ASP 59.A O no hydrogen 2.708 N/A PHE 63.A N GLN 60.A O no hydrogen 3.108 N/A ILE 66.A N ASP 62.A O no hydrogen 3.103 N/A ILE 67.A N PHE 63.A O no hydrogen 3.197 N/A ARG 68.A N GLN 64.A O no hydrogen 2.930 N/A ARG 68.A NH1 GLU 103.A OE1 no hydrogen 2.786 N/A ARG 68.A NH2 GLU 103.A OE1 no hydrogen 3.347 N/A GLU 69.A N ILE 65.A O no hydrogen 2.907 N/A LEU 70.A N ILE 66.A O no hydrogen 3.029 N/A TRP 71.A N ILE 67.A O no hydrogen 2.853 N/A TRP 71.A NE1 THR 107.A O no hydrogen 3.043 N/A ASP 72.A N ARG 68.A O no hydrogen 3.123 N/A ASP 72.A N GLU 69.A O no hydrogen 3.038 N/A LEU 73.A N LEU 70.A O no hydrogen 3.136 N/A ARG 76.A N LEU 35.A O no hydrogen 2.798 N/A ARG 76.A NE ASP 112.A OD2 no hydrogen 2.754 N/A ARG 76.A NH1 GLN 79.A OE1 no hydrogen 3.112 N/A ARG 76.A NH1 LYS 108.A O no hydrogen 2.944 N/A ARG 76.A NH2 LYS 108.A O no hydrogen 3.246 N/A ARG 76.A NH2 ASP 112.A OD1 no hydrogen 2.797 N/A ARG 76.A NH2 ASP 112.A OD2 no hydrogen 3.424 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.733 N/A PHE 78.A N GLU 75.A O no hydrogen 2.994 N/A GLN 79.A N ARG 76.A O no hydrogen 3.013 N/A GLN 79.A NE2 LEU 70.A O no hydrogen 3.186 N/A GLN 79.A NE2 LEU 73.A O no hydrogen 2.982 N/A GLN 79.A NE2 GLU 75.A O no hydrogen 3.503 N/A ALA 80.A N ARG 76.A O no hydrogen 3.246 N/A ALA 81.A N GLU 77.A O no hydrogen 2.885 N/A ALA 82.A N PHE 78.A O no hydrogen 2.877 N/A LEU 83.A N GLN 79.A O no hydrogen 3.179 N/A ASP 84.A N ALA 80.A O no hydrogen 3.224 N/A ILE 85.A N ALA 81.A O no hydrogen 2.894 N/A MET 86.A N ALA 82.A O no hydrogen 2.881 N/A GLN 87.A N LEU 83.A O no hydrogen 3.127 N/A LYS 88.A N ILE 85.A O no hydrogen 2.726 N/A TYR 89.A N MET 86.A O no hydrogen 2.824 N/A TYR 89.A OH PRO 58.A O no hydrogen 2.713 N/A LYS 90.A N GLN 87.A O no hydrogen 3.269 N/A LYS 90.A NZ THR 120.A O no hydrogen 3.525 N/A LYS 90.A NZ ASP 124.A OD1 no hydrogen 2.684 N/A HIS 92.A N TYR 89.A O no hydrogen 2.653 N/A ILE 93.A N LYS 90.A O no hydrogen 2.839 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.537 N/A THR 96.A N ASN 94.A OD1 no hydrogen 2.931 N/A THR 96.A OG1 ASN 94.A OD1 no hydrogen 2.488 N/A HIS 97.A N ASN 94.A O no hydrogen 2.952 N/A HIS 97.A NE2 HIS 92.A O no hydrogen 2.830 N/A ILE 98.A N GLU 95.A O no hydrogen 3.283 N/A LEU 101.A N HIS 97.A O no hydrogen 2.975 N/A GLU 102.A N ILE 98.A O no hydrogen 2.884 N/A GLU 103.A N PRO 99.A O no hydrogen 3.150 N/A LEU 104.A N PHE 100.A O no hydrogen 3.068 N/A ILE 105.A N LEU 101.A O no hydrogen 2.909 N/A VAL 106.A N GLU 102.A O no hydrogen 3.144 N/A THR 107.A OG1 GLU 103.A O no hydrogen 2.645 N/A LYS 108.A NZ TRP 71.A O no hydrogen 2.918 N/A LYS 108.A NZ LEU 73.A O no hydrogen 2.851 N/A SER 109.A OG ILE 105.A O no hydrogen 2.729 N/A SER 113.A N TRP 110.A O no hydrogen 3.271 N/A SER 113.A OG TRP 110.A O no hydrogen 3.034 N/A VAL 114.A N TRP 110.A O no hydrogen 3.010 N/A ASP 115.A N TRP 111.A O no hydrogen 2.818 N/A SER 116.A N SER 113.A O no hydrogen 3.129 N/A SER 116.A OG ASP 112.A O no hydrogen 3.257 N/A ILE 117.A N VAL 114.A O no hydrogen 3.022 N/A VAL 118.A N VAL 114.A O no hydrogen 3.022 N/A THR 120.A OG1 SER 116.A O no hydrogen 3.194 N/A PHE 121.A N THR 120.A OG1 no hydrogen 2.737 N/A LEU 122.A N ILE 117.A O no hydrogen 3.205 N/A GLY 123.A N VAL 118.A O no hydrogen 2.891 N/A ASP 124.A N THR 120.A O no hydrogen 3.035 N/A ILE 125.A N PHE 121.A O no hydrogen 3.093 N/A PHE 126.A N LEU 122.A O no hydrogen 2.946 N/A LEU 127.A N GLY 123.A O no hydrogen 3.048 N/A LYS 128.A N ASP 124.A O no hydrogen 3.163 N/A HIS 129.A N ILE 125.A O no hydrogen 2.762 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.562 N/A LEU 132.A N HIS 129.A O no hydrogen 3.070 N/A ILE 133.A N PRO 130.A O no hydrogen 3.403 N/A ALA 135.A N LEU 132.A O no hydrogen 3.135 N/A TYR 136.A N ILE 133.A O no hydrogen 2.906 N/A ILE 137.A N ILE 133.A O no hydrogen 2.880 N/A LYS 139.A NZ GLU 102.A OE2 no hydrogen 2.595 N/A TRP 140.A N TYR 136.A O no hydrogen 2.749 N/A TRP 140.A NE1 GLU 102.A OE2 no hydrogen 2.500 N/A ILE 141.A N ILE 137.A O no hydrogen 3.035 N/A ALA 142.A N PRO 138.A O no hydrogen 2.950 N/A SER 143.A N TRP 140.A O no hydrogen 3.119 N/A SER 143.A OG TRP 140.A O no hydrogen 2.749 N/A ASN 145.A N SER 143.A OG no hydrogen 2.851 N/A TRP 147.A N ASN 145.A OD1 no hydrogen 2.759 N/A LEU 148.A N ASN 145.A OD1 no hydrogen 3.200 N/A GLN 149.A N ASN 145.A O no hydrogen 3.001 N/A GLN 149.A NE2 ILE 141.A O no hydrogen 3.396 N/A ARG 150.A N ILE 146.A O no hydrogen 2.840 N/A ARG 150.A NE ASP 115.A OD1 no hydrogen 2.756 N/A ARG 150.A NH1 PHE 182.A O no hydrogen 2.810 N/A ARG 150.A NH2 ASP 115.A OD1 no hydrogen 2.917 N/A ARG 150.A NH2 ASP 115.A OD2 no hydrogen 2.713 N/A ALA 151.A N TRP 147.A O no hydrogen 2.849 N/A ALA 152.A N LEU 148.A O no hydrogen 2.999 N/A ILE 153.A N GLN 149.A O no hydrogen 3.185 N/A LEU 154.A N ARG 150.A O no hydrogen 2.976 N/A PHE 155.A N ALA 151.A O no hydrogen 3.026 N/A LEU 157.A N LEU 154.A O no hydrogen 2.880 N/A TYR 159.A N GLN 156.A O no hydrogen 2.909 N/A TYR 159.A OH GLY 123.A O no hydrogen 2.646 N/A GLN 161.A N GLN 161.A OE1 no hydrogen 2.581 N/A LYS 162.A N TYR 159.A O no hydrogen 2.980 N/A MET 163.A N LYS 160.A O no hydrogen 2.946 N/A MET 163.A SD GLN 156.A O no hydrogen 4.009 N/A ASP 164.A N GLN 156.A OE1 no hydrogen 3.102 N/A LEU 167.A N ASP 164.A OD1 no hydrogen 2.976 N/A LEU 168.A N ASP 164.A O no hydrogen 2.888 N/A PHE 169.A N GLU 165.A O no hydrogen 2.911 N/A TRP 170.A N GLU 166.A O no hydrogen 3.040 N/A ILE 171.A N LEU 167.A O no hydrogen 2.766 N/A ILE 172.A N LEU 168.A O no hydrogen 2.869 N/A GLY 173.A N PHE 169.A O no hydrogen 2.828 N/A GLN 174.A N TRP 170.A O no hydrogen 3.185 N/A LEU 175.A N ILE 172.A O no hydrogen 3.282 N/A SER 178.A N LEU 175.A O no hydrogen 3.233 N/A GLU 180.A N SER 178.A OG no hydrogen 3.063 N/A ILE 183.A N GLU 180.A O no hydrogen 2.937 N/A GLN 184.A N GLU 180.A O no hydrogen 2.939 N/A GLN 184.A NE2 SER 178.A O no hydrogen 2.864 N/A LYS 185.A N PHE 181.A O no hydrogen 2.905 N/A ILE 187.A N ILE 183.A O no hydrogen 2.907 N/A GLY 188.A N GLN 184.A O no hydrogen 3.106 N/A TRP 189.A N LYS 185.A O no hydrogen 2.800 N/A VAL 190.A N ALA 186.A O no hydrogen 2.937 N/A LEU 191.A N ILE 187.A O no hydrogen 3.147 N/A ARG 192.A N GLY 188.A O no hydrogen 2.980 N/A ARG 192.A NH1 GLU 218.A O no hydrogen 3.105 N/A ARG 192.A NH1 GLU 218.A OE1 no hydrogen 2.850 N/A GLU 193.A N TRP 189.A O no hydrogen 2.837 N/A TYR 194.A N VAL 190.A O no hydrogen 2.734 N/A ALA 195.A N LEU 191.A O no hydrogen 2.837 N/A LYS 196.A N GLU 193.A O no hydrogen 2.838 N/A LYS 196.A NZ GLU 193.A OE1 no hydrogen 2.624 N/A LYS 196.A NZ GLU 193.A OE2 no hydrogen 3.518 N/A THR 197.A N TYR 194.A O no hydrogen 2.947 N/A ASN 198.A N TYR 194.A O no hydrogen 2.915 N/A VAL 202.A N ASN 198.A O no hydrogen 3.311 N/A TRP 203.A N PRO 199.A O no hydrogen 2.811 N/A GLU 204.A N ASP 200.A O no hydrogen 3.033 N/A TYR 205.A N VAL 201.A O no hydrogen 3.053 N/A VAL 206.A N VAL 202.A O no hydrogen 2.918 N/A GLN 207.A N TRP 203.A O no hydrogen 2.955 N/A GLN 207.A NE2 TRP 203.A O no hydrogen 3.035 N/A ASN 208.A N TYR 205.A O no hydrogen 3.173 N/A ASN 209.A ND2 TYR 205.A O no hydrogen 2.785 N/A SER 215.A OG GLN 184.A O no hydrogen 2.811 N/A LYS 216.A N ALA 212.A O no hydrogen 2.978 N/A LYS 216.A NZ GLN 207.A OE1 no hydrogen 3.216 N/A ARG 217.A N PRO 213.A O no hydrogen 2.833 N/A GLU 218.A N LEU 214.A O no hydrogen 3.015 N/A ALA 219.A N SER 215.A O no hydrogen 3.110 N/A ALA 219.A N LYS 216.A O no hydrogen 3.020 N/A ILE 220.A N LYS 216.A O no hydrogen 3.293 N/A ILE 223.A N ILE 220.A O no hydrogen 2.880 N/A LYS 224.A N ILE 220.A O no hydrogen 2.763 N/A ASN 226.A N ILE 223.A O no hydrogen 2.968 N/A TYR 227.A N LYS 224.A O no hydrogen 3.394 N/A TYR 227.A OH ASP 200.A OD1 no hydrogen 2.943 N/A