Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bgd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N PRO 1.A O no hydrogen 2.938 N/A VAL 5.A N ASP 2.A O no hydrogen 3.087 N/A GLN 6.A NE2 TYR 174.A OH no hydrogen 3.237 N/A GLN 6.A NE2 HIS 179.A O no hydrogen 2.858 N/A LYS 7.A N GLU 4.A O no hydrogen 3.139 N/A GLN 9.A N GLN 6.A O no hydrogen 2.779 N/A LEU 11.A N ASN 146.A OD1 no hydrogen 2.755 N/A THR 12.A N ASP 15.A OD2 no hydrogen 2.832 N/A ASP 15.A N THR 12.A OG1 no hydrogen 3.092 N/A TRP 16.A N THR 12.A O no hydrogen 3.089 N/A LYS 17.A N LEU 13.A O no hydrogen 3.113 N/A LYS 17.A NZ GLU 14.A OE1 no hydrogen 2.499 N/A GLU 18.A N GLU 14.A O no hydrogen 2.968 N/A LYS 19.A N ASP 15.A O no hydrogen 3.028 N/A LYS 19.A NZ HIS 24.A O no hydrogen 2.256 N/A TRP 20.A N TRP 16.A O no hydrogen 3.339 N/A VAL 21.A N LYS 17.A O no hydrogen 3.073 N/A THR 22.A N GLU 18.A O no hydrogen 2.902 N/A THR 22.A OG1 GLU 18.A O no hydrogen 2.827 N/A THR 22.A OG1 LYS 19.A O no hydrogen 3.441 N/A THR 22.A OG1 HIS 24.A ND1 no hydrogen 2.834 N/A ARG 23.A N TRP 20.A O no hydrogen 3.315 N/A ARG 23.A NE TRP 20.A O no hydrogen 3.406 N/A ARG 23.A NH1 GLU 85.A OE2 no hydrogen 3.361 N/A ARG 23.A NH2 TRP 20.A O no hydrogen 3.537 N/A ARG 23.A NH2 GLU 85.A OE1 no hydrogen 2.478 N/A ARG 23.A NH2 GLU 85.A OE2 no hydrogen 3.475 N/A HIS 24.A N LYS 19.A O no hydrogen 2.619 N/A HIS 28.A N ILE 25.A O no hydrogen 3.084 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.787 N/A GLY 32.A N GLN 29.A O no hydrogen 2.886 N/A HIS 33.A N GLU 62.A OE2 no hydrogen 2.670 N/A HIS 33.A NE2 GLU 224.A OE2 no hydrogen 2.557 N/A GLN 34.A NE2 GLY 32.A O no hydrogen 2.928 N/A LEU 36.A N HIS 33.A ND1 no hydrogen 3.421 N/A LYS 37.A N HIS 33.A O no hydrogen 3.285 N/A LYS 38.A N GLN 34.A O no hydrogen 3.120 N/A HIS 39.A N LEU 35.A O no hydrogen 2.974 N/A HIS 39.A NE2 GLU 205.A OE1 no hydrogen 3.150 N/A PHE 43.A N HIS 39.A O no hydrogen 2.934 N/A LEU 44.A N LEU 40.A O no hydrogen 2.924 N/A LEU 44.A N ASP 41.A O no hydrogen 3.213 N/A LYS 45.A N THR 42.A O no hydrogen 3.169 N/A GLN 47.A N LEU 44.A O no hydrogen 3.185 N/A LEU 50.A N HIS 71.A ND1 no hydrogen 2.954 N/A ARG 51.A N ASP 134.A OD2 no hydrogen 3.056 N/A ARG 51.A NH1 ILE 130.A O no hydrogen 2.735 N/A ARG 51.A NH1 LYS 132.A O no hydrogen 2.849 N/A ARG 51.A NH2 ILE 130.A O no hydrogen 2.685 N/A VAL 52.A N THR 72.A O no hydrogen 2.758 N/A PHE 53.A N ARG 135.A O no hydrogen 2.922 N/A PHE 54.A N VAL 74.A O no hydrogen 2.771 N/A CYS 57.A N VAL 76.A O no hydrogen 3.013 N/A CYS 57.A SG GLY 58.A O no hydrogen 3.563 N/A CYS 57.A SG VAL 76.A O no hydrogen 3.680 N/A GLY 58.A N GLU 77.A OE1 no hydrogen 2.882 N/A LYS 59.A NZ GLU 85.A OE2 no hydrogen 2.337 N/A LYS 59.A NZ GLU 89.A OE2 no hydrogen 2.711 N/A ALA 60.A N CYS 57.A O no hydrogen 2.845 N/A MET 63.A N ALA 60.A O no hydrogen 3.150 N/A LYS 64.A N ILE 61.A O no hydrogen 2.908 N/A LYS 64.A NZ ASP 68.A OD1 no hydrogen 2.997 N/A LYS 64.A NZ ASP 68.A OD2 no hydrogen 3.121 N/A PHE 66.A N GLU 62.A O no hydrogen 3.336 N/A ALA 67.A N MET 63.A O no hydrogen 3.168 N/A ASP 68.A N LYS 64.A O no hydrogen 2.963 N/A ARG 69.A N PHE 66.A O no hydrogen 2.977 N/A ARG 69.A NH1 TRP 65.A O no hydrogen 3.030 N/A GLY 70.A N ALA 67.A O no hydrogen 3.138 N/A HIS 71.A N PHE 66.A O no hydrogen 3.241 N/A THR 72.A N LEU 50.A O no hydrogen 2.789 N/A VAL 73.A N SER 114.A O no hydrogen 2.838 N/A VAL 74.A N VAL 52.A O no hydrogen 2.865 N/A GLY 75.A N SER 116.A O no hydrogen 2.912 N/A VAL 76.A N PHE 54.A O no hydrogen 3.385 N/A GLU 77.A N TYR 118.A O no hydrogen 2.921 N/A SER 79.A N GLU 77.A OE2 no hydrogen 2.896 N/A GLY 82.A N SER 79.A OG no hydrogen 3.211 N/A ILE 83.A N SER 79.A O no hydrogen 3.146 N/A ARG 84.A N GLU 80.A O no hydrogen 2.878 N/A ARG 84.A NH2 GLU 96.A OE1 no hydrogen 2.419 N/A GLU 85.A N ILE 81.A O no hydrogen 3.008 N/A PHE 86.A N GLY 82.A O no hydrogen 3.072 N/A PHE 86.A N ILE 83.A O no hydrogen 3.265 N/A PHE 87.A N ILE 83.A O no hydrogen 3.522 N/A ALA 88.A N ARG 84.A O no hydrogen 3.000 N/A GLU 89.A N GLU 85.A O no hydrogen 2.832 N/A GLN 90.A N PHE 86.A O no hydrogen 2.744 N/A ASN 91.A N ALA 88.A O no hydrogen 3.350 N/A LEU 92.A N PHE 87.A O no hydrogen 3.056 N/A THR 95.A N LYS 109.A O no hydrogen 3.022 N/A THR 95.A OG1 GLU 97.A OE1 no hydrogen 2.959 N/A GLU 97.A N VAL 107.A O no hydrogen 2.936 N/A LEU 99.A N ALA 105.A O no hydrogen 3.108 N/A GLU 101.A N GLU 101.A OE2 no hydrogen 2.531 N/A ALA 105.A N ILE 102.A O no hydrogen 3.152 N/A LYS 106.A N CYS 119.A O no hydrogen 3.443 N/A LYS 106.A NZ GLU 80.A OE1 no hydrogen 2.979 N/A LYS 106.A NZ GLU 96.A OE2 no hydrogen 3.350 N/A VAL 107.A N GLU 97.A O no hydrogen 2.720 N/A PHE 108.A N LEU 117.A O no hydrogen 3.044 N/A LYS 109.A N THR 95.A O no hydrogen 3.178 N/A SER 110.A N ILE 115.A O no hydrogen 2.756 N/A SER 110.A OG ILE 115.A O no hydrogen 3.478 N/A SER 111.A N SER 93.A O no hydrogen 2.989 N/A GLY 113.A N SER 110.A O no hydrogen 2.924 N/A ILE 115.A N SER 110.A OG no hydrogen 2.969 N/A SER 116.A N VAL 73.A O no hydrogen 2.980 N/A LEU 117.A N PHE 108.A O no hydrogen 2.837 N/A TYR 118.A N GLY 75.A O no hydrogen 2.844 N/A CYS 119.A N LYS 106.A O no hydrogen 2.759 N/A CYS 119.A SG GLU 77.A O no hydrogen 3.800 N/A CYS 119.A SG ILE 78.A O no hydrogen 3.505 N/A CYS 120.A SG SER 121.A O no hydrogen 3.561 N/A PHE 123.A N SER 121.A OG no hydrogen 3.169 N/A ASP 124.A N SER 121.A O no hydrogen 2.984 N/A LEU 125.A N SER 121.A O no hydrogen 3.119 N/A LEU 125.A N ILE 122.A O no hydrogen 3.346 N/A ARG 127.A N ASP 124.A O no hydrogen 3.176 N/A ARG 127.A NE GLU 101.A O no hydrogen 3.105 N/A ARG 127.A NH1 ASP 124.A OD1 no hydrogen 3.129 N/A ARG 127.A NH2 GLU 101.A O no hydrogen 3.437 N/A ALA 128.A N LEU 125.A O no hydrogen 2.600 N/A ASN 129.A N PRO 126.A O no hydrogen 3.370 N/A ASN 129.A ND2 PRO 126.A O no hydrogen 3.535 N/A LYS 132.A NZ SER 159.A O no hydrogen 3.247 N/A PHE 133.A N LEU 160.A O no hydrogen 2.807 N/A ASP 134.A N ARG 51.A O no hydrogen 3.039 N/A ARG 135.A N ARG 51.A O no hydrogen 3.273 N/A ARG 135.A NE PHE 43.A O no hydrogen 2.647 N/A ARG 135.A NH1 ASP 134.A O no hydrogen 3.156 N/A ARG 135.A NH2 PHE 43.A O no hydrogen 3.123 N/A ARG 135.A NH2 GLN 47.A OE1 no hydrogen 3.228 N/A ILE 136.A N GLN 166.A O no hydrogen 3.155 N/A TRP 137.A N PHE 53.A O no hydrogen 3.129 N/A ASP 138.A N LEU 168.A O no hydrogen 2.856 N/A ARG 139.A NH1 PHE 27.A O no hydrogen 3.161 N/A ARG 139.A NH2 PHE 27.A O no hydrogen 2.839 N/A LEU 142.A N ASP 138.A OD1 no hydrogen 2.823 N/A ALA 144.A N ALA 141.A O no hydrogen 2.761 N/A ILE 145.A N ALA 141.A O no hydrogen 3.099 N/A ASN 146.A ND2 LEU 11.A O no hydrogen 3.053 N/A ASP 149.A N ASN 146.A O no hydrogen 2.772 N/A HIS 150.A N PRO 147.A O no hydrogen 3.188 N/A HIS 150.A ND1 GLU 190.A OE2 no hydrogen 2.755 N/A TYR 153.A N ASP 149.A O no hydrogen 2.826 N/A TYR 153.A OH ASP 138.A OD2 no hydrogen 2.573 N/A ALA 154.A N HIS 150.A O no hydrogen 2.861 N/A ASP 155.A N ASP 151.A O no hydrogen 3.017 N/A ILE 156.A N ARG 152.A O no hydrogen 3.115 N/A ILE 157.A N TYR 153.A O no hydrogen 3.021 N/A LEU 158.A N ALA 154.A O no hydrogen 3.032 N/A SER 159.A N ASP 155.A O no hydrogen 2.958 N/A SER 159.A OG ILE 156.A O no hydrogen 2.847 N/A LEU 160.A N ILE 157.A O no hydrogen 3.094 N/A LEU 161.A N LEU 158.A O no hydrogen 3.465 N/A ARG 162.A N PHE 133.A O no hydrogen 2.913 N/A PHE 165.A N GLU 231.A OE1 no hydrogen 3.245 N/A GLN 166.A N ASP 134.A O no hydrogen 3.066 N/A TYR 167.A N LEU 229.A O no hydrogen 2.805 N/A TYR 167.A OH ASP 138.A OD2 no hydrogen 2.743 N/A LEU 168.A N ILE 136.A O no hydrogen 3.038 N/A VAL 169.A N TYR 227.A O no hydrogen 3.000 N/A ALA 170.A N ASP 138.A O no hydrogen 2.784 N/A VAL 171.A N LYS 225.A O no hydrogen 2.883 N/A SER 173.A N PHE 223.A O no hydrogen 2.881 N/A TYR 174.A OH PRO 183.A O no hydrogen 2.410 N/A THR 177.A N ASP 175.A OD1 no hydrogen 3.182 N/A THR 177.A OG1 ASP 175.A OD1 no hydrogen 2.666 N/A THR 177.A OG1 ASP 175.A OD2 no hydrogen 3.267 N/A LYS 178.A N ASP 175.A O no hydrogen 3.064 N/A LYS 178.A NZ ASP 175.A OD2 no hydrogen 2.741 N/A HIS 179.A NE2 PRO 182.A O no hydrogen 3.161 N/A GLY 181.A N GLN 9.A OE1 no hydrogen 3.159 N/A PHE 184.A N VAL 143.A O no hydrogen 2.713 N/A TYR 185.A N GLN 6.A OE1 no hydrogen 3.075 N/A SER 188.A OG TYR 227.A OH no hydrogen 2.447 N/A GLU 190.A N PRO 187.A O no hydrogen 2.926 N/A LEU 191.A N PRO 187.A O no hydrogen 3.253 N/A LYS 192.A N SER 188.A O no hydrogen 2.951 N/A ARG 193.A N ALA 189.A O no hydrogen 3.090 N/A ARG 193.A NE GLU 190.A OE1 no hydrogen 2.806 N/A ARG 193.A NH1 ASP 151.A OD1 no hydrogen 2.869 N/A ARG 193.A NH2 GLU 190.A OE1 no hydrogen 3.165 N/A ARG 193.A NH2 GLU 190.A OE2 no hydrogen 2.475 N/A LEU 194.A N GLU 190.A O no hydrogen 2.921 N/A PHE 195.A N LEU 191.A O no hydrogen 3.010 N/A GLY 196.A N LYS 192.A O no hydrogen 2.621 N/A LYS 198.A N PHE 195.A O no hydrogen 3.182 N/A CYS 199.A N PHE 195.A O no hydrogen 2.909 N/A SER 200.A N THR 230.A O no hydrogen 3.027 N/A SER 200.A OG THR 230.A O no hydrogen 3.169 N/A SER 200.A OG THR 230.A OG1 no hydrogen 2.886 N/A SER 200.A OG GLU 231.A O no hydrogen 2.888 N/A GLN 202.A N LEU 228.A O no hydrogen 2.959 N/A CYS 203.A SG GLU 205.A O no hydrogen 3.432 N/A CYS 203.A SG LEU 226.A O no hydrogen 3.954 N/A LEU 204.A N LEU 226.A O no hydrogen 2.799 N/A GLU 205.A N LEU 226.A O no hydrogen 3.433 N/A VAL 207.A N GLU 224.A O no hydrogen 2.952 N/A ALA 209.A N LEU 222.A O no hydrogen 2.570 N/A LEU 210.A N ASP 208.A OD1 no hydrogen 2.938 N/A GLU 211.A N HIS 214.A ND1 no hydrogen 3.007 N/A HIS 214.A N GLU 211.A O no hydrogen 2.754 N/A LYS 215.A N GLU 211.A O no hydrogen 3.346 N/A LYS 215.A NZ ASP 220.A OD1 no hydrogen 2.730 N/A ALA 216.A N GLU 212.A O no hydrogen 3.332 N/A GLY 218.A N LYS 215.A O no hydrogen 2.889 N/A LEU 219.A N HIS 214.A O no hydrogen 2.982 N/A PHE 223.A N SER 173.A O no hydrogen 2.938 N/A GLU 224.A N VAL 207.A O no hydrogen 2.844 N/A LYS 225.A N VAL 171.A O no hydrogen 2.971 N/A LYS 225.A NZ SER 188.A OG no hydrogen 2.542 N/A LEU 226.A N GLU 205.A O no hydrogen 3.155 N/A TYR 227.A N VAL 169.A O no hydrogen 3.078 N/A LEU 228.A N GLN 202.A O no hydrogen 2.809 N/A LEU 229.A N TYR 167.A O no hydrogen 2.742 N/A THR 230.A N SER 200.A O no hydrogen 3.272 N/A THR 230.A OG1 SER 200.A OG no hydrogen 2.886 N/A GLU 231.A N GLU 231.A OE1 no hydrogen 2.560 N/A LYS 232.A NZ GLY 196.A O no hydrogen 3.461 N/A