Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e5a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 2.A NH2 ASP 8.A OD1 no hydrogen 3.132 N/A GLN 3.A NE2 LYS 1.A O no hydrogen 3.367 N/A ALA 5.A N ASP 8.A OD2 no hydrogen 3.357 N/A ASP 8.A N ALA 5.A O no hydrogen 2.938 N/A PHE 9.A N LEU 6.A O no hydrogen 2.698 N/A GLU 10.A N ARG 27.A O no hydrogen 2.812 N/A GLY 12.A N LEU 25.A O no hydrogen 2.739 N/A LEU 15.A N VAL 23.A O no hydrogen 2.649 N/A LYS 19.A NZ GLU 136.A OE1 no hydrogen 2.804 N/A PHE 20.A N LYS 17.A O no hydrogen 3.033 N/A GLY 21.A N GLY 18.A O no hydrogen 2.890 N/A VAL 23.A N PHE 20.A O no hydrogen 3.255 N/A TYR 24.A N LEU 37.A O no hydrogen 2.927 N/A LEU 25.A N ARG 13.A O no hydrogen 2.865 N/A ALA 26.A N LEU 35.A O no hydrogen 2.901 N/A ARG 27.A N GLU 10.A O no hydrogen 2.836 N/A ARG 27.A NH1 LYS 32.A O no hydrogen 3.383 N/A GLU 28.A N PHE 33.A O no hydrogen 2.972 N/A LYS 29.A N ASP 8.A O no hydrogen 2.816 N/A LYS 29.A NZ GLU 7.A O no hydrogen 2.622 N/A GLN 30.A N GLU 28.A OE1 no hydrogen 2.922 N/A SER 31.A N GLU 28.A OE2 no hydrogen 3.332 N/A SER 31.A OG GLU 28.A OE2 no hydrogen 2.572 N/A LYS 32.A N GLU 28.A O no hydrogen 2.763 N/A LEU 35.A N ALA 26.A O no hydrogen 2.818 N/A ALA 36.A N LEU 86.A O no hydrogen 2.983 N/A LEU 37.A N TYR 24.A O no hydrogen 2.810 N/A LYS 38.A N LEU 84.A O no hydrogen 2.862 N/A VAL 39.A N ASN 22.A O no hydrogen 3.084 N/A LEU 40.A N VAL 82.A O no hydrogen 2.941 N/A LYS 42.A N THR 80.A O no hydrogen 2.921 N/A LYS 42.A NZ HIS 77.A ND1 no hydrogen 2.708 N/A LYS 42.A NZ ASP 78.A O no hydrogen 2.674 N/A GLN 44.A N PHE 41.A O no hydrogen 3.263 N/A LEU 45.A N PHE 41.A O no hydrogen 3.092 N/A GLU 46.A N LYS 42.A O no hydrogen 2.856 N/A LYS 47.A N ALA 43.A O no hydrogen 2.888 N/A ALA 48.A N GLN 44.A O no hydrogen 3.191 N/A GLY 49.A N LEU 45.A O no hydrogen 2.889 N/A VAL 50.A N LEU 45.A O no hydrogen 3.120 N/A LEU 54.A N VAL 50.A O no hydrogen 3.191 N/A ARG 55.A N GLU 51.A O no hydrogen 3.143 N/A ARG 56.A N HIS 52.A O no hydrogen 3.201 N/A GLU 57.A N GLN 53.A O no hydrogen 2.939 N/A VAL 58.A N LEU 54.A O no hydrogen 2.878 N/A GLU 59.A N ARG 55.A O no hydrogen 2.933 N/A ILE 60.A N ARG 56.A O no hydrogen 2.936 N/A GLN 61.A N GLU 57.A O no hydrogen 2.963 N/A GLN 61.A NE2 LEU 70.A O no hydrogen 2.767 N/A GLN 61.A NE2 ALA 149.A O no hydrogen 3.476 N/A SER 62.A N VAL 58.A O no hydrogen 2.899 N/A SER 62.A OG VAL 58.A O no hydrogen 2.618 N/A SER 62.A OG GLU 59.A O no hydrogen 3.507 N/A HIS 63.A N ILE 60.A O no hydrogen 3.094 N/A HIS 63.A ND1 GLU 59.A O no hydrogen 2.428 N/A LEU 64.A N GLN 61.A O no hydrogen 3.256 N/A ARG 65.A N TYR 122.A OH no hydrogen 2.754 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 2.865 N/A ASN 68.A ND2 LEU 146.A O no hydrogen 2.750 N/A ILE 69.A N HIS 66.A O no hydrogen 3.217 N/A LEU 70.A N ILE 148.A O no hydrogen 2.916 N/A ARG 71.A N GLU 87.A OE2 no hydrogen 2.672 N/A TYR 73.A N ILE 85.A O no hydrogen 2.694 N/A PHE 76.A N TYR 83.A O no hydrogen 3.118 N/A ASP 78.A N ARG 81.A O no hydrogen 2.870 N/A THR 80.A N ASP 78.A OD1 no hydrogen 2.835 N/A THR 80.A OG1 ASP 78.A OD1 no hydrogen 3.507 N/A ARG 81.A N ASP 78.A OD1 no hydrogen 2.638 N/A VAL 82.A N LEU 40.A O no hydrogen 2.827 N/A TYR 83.A N PHE 76.A O no hydrogen 2.716 N/A TYR 83.A OH ASP 78.A OD2 no hydrogen 2.764 N/A LEU 84.A N LYS 38.A O no hydrogen 2.830 N/A ILE 85.A N GLY 74.A O no hydrogen 2.934 N/A LEU 86.A N ALA 36.A O no hydrogen 2.891 N/A GLU 87.A N ARG 71.A O no hydrogen 2.713 N/A LEU 91.A N LEU 140.A O no hydrogen 2.964 N/A GLY 92.A N ALA 89.A O no hydrogen 3.441 N/A VAL 94.A N LEU 138.A O no hydrogen 3.010 N/A ARG 96.A N THR 93.A OG1 no hydrogen 3.002 N/A ARG 96.A NH1 ARG 96.A O no hydrogen 3.307 N/A GLU 97.A N THR 93.A O no hydrogen 3.145 N/A LEU 98.A N VAL 94.A O no hydrogen 2.853 N/A GLN 99.A N TYR 95.A O no hydrogen 2.899 N/A LYS 100.A N ARG 96.A O no hydrogen 2.782 N/A LEU 101.A N GLU 97.A O no hydrogen 2.819 N/A SER 102.A N LEU 98.A O no hydrogen 2.626 N/A PHE 104.A N PHE 197.A O no hydrogen 2.679 N/A ARG 108.A N ASP 105.A OD1 no hydrogen 2.698 N/A THR 109.A N ASP 105.A O no hydrogen 3.230 N/A THR 109.A OG1 ASP 105.A O no hydrogen 2.929 N/A ALA 110.A N GLU 106.A O no hydrogen 2.954 N/A THR 111.A N GLN 107.A O no hydrogen 2.948 N/A THR 111.A OG1 GLN 107.A O no hydrogen 2.822 N/A TYR 112.A N ARG 108.A O no hydrogen 2.848 N/A ILE 113.A N THR 109.A O no hydrogen 2.790 N/A THR 114.A N ALA 110.A O no hydrogen 2.763 N/A THR 114.A OG1 ALA 110.A O no hydrogen 3.366 N/A GLU 115.A N THR 111.A O no hydrogen 2.957 N/A LEU 116.A N TYR 112.A O no hydrogen 2.893 N/A ALA 117.A N ILE 113.A O no hydrogen 2.862 N/A ASN 118.A N THR 114.A O no hydrogen 3.018 N/A ALA 119.A N GLU 115.A O no hydrogen 3.188 N/A LEU 120.A N LEU 116.A O no hydrogen 2.975 N/A SER 121.A N ALA 117.A O no hydrogen 2.724 N/A TYR 122.A N ASN 118.A O no hydrogen 3.177 N/A CYS 123.A N ALA 119.A O no hydrogen 2.901 N/A CYS 123.A SG ALA 119.A O no hydrogen 3.196 N/A HIS 124.A N LEU 120.A O no hydrogen 2.578 N/A HIS 124.A NE2 ASP 186.A OD2 no hydrogen 2.885 N/A SER 125.A N SER 121.A O no hydrogen 2.915 N/A SER 125.A OG TYR 122.A O no hydrogen 2.549 N/A LYS 126.A N CYS 123.A O no hydrogen 2.932 N/A LYS 126.A NZ SER 125.A OG no hydrogen 3.134 N/A ARG 127.A N HIS 124.A O no hydrogen 2.978 N/A ARG 127.A NE HIS 124.A O no hydrogen 3.380 N/A ARG 127.A NH2 HIS 124.A O no hydrogen 3.051 N/A VAL 128.A N CYS 123.A O no hydrogen 3.242 N/A ILE 129.A N VAL 155.A O no hydrogen 2.941 N/A HIS 130.A N ASP 186.A OD2 no hydrogen 2.837 N/A ARG 131.A N ASP 186.A OD1 no hydrogen 2.893 N/A ARG 131.A NE TRP 153.A O no hydrogen 2.757 N/A ARG 131.A NH1 HIS 181.A NE2 no hydrogen 3.172 N/A ARG 131.A NH2 TRP 153.A O no hydrogen 3.111 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 2.999 N/A LYS 134.A NZ THR 167.A OG1 no hydrogen 2.779 N/A ASN 137.A N LYS 134.A O no hydrogen 2.903 N/A ASN 137.A ND2 ASP 132.A O no hydrogen 2.964 N/A ASN 137.A ND2 ASP 132.A OD2 no hydrogen 2.873 N/A LEU 138.A N PRO 135.A O no hydrogen 3.311 N/A LEU 139.A N LYS 147.A O no hydrogen 2.881 N/A LEU 140.A N GLY 92.A O no hydrogen 2.732 N/A GLY 141.A N GLU 145.A O no hydrogen 2.995 N/A ALA 143.A N GLU 145.A OE1 no hydrogen 2.916 N/A GLY 144.A N GLY 141.A O no hydrogen 2.733 N/A GLU 145.A N GLU 145.A OE1 no hydrogen 2.932 N/A LEU 146.A N GLU 115.A OE1 no hydrogen 2.960 N/A LYS 147.A N LEU 139.A O no hydrogen 2.768 N/A LYS 147.A NZ PRO 67.A O no hydrogen 2.710 N/A LYS 147.A NZ GLU 87.A OE1 no hydrogen 2.712 N/A ILE 148.A N ASN 68.A O no hydrogen 2.820 N/A ALA 149.A N ASN 137.A O no hydrogen 2.822 N/A GLY 152.A N ASP 150.A OD1 no hydrogen 3.067 N/A SER 154.A N PHE 151.A O no hydrogen 3.115 N/A SER 154.A OG PHE 151.A O no hydrogen 2.971 N/A VAL 155.A N ILE 129.A O no hydrogen 2.981 N/A ALA 157.A N ARG 127.A O no hydrogen 2.634 N/A ARG 162.A N HIS 181.A O no hydrogen 2.928 N/A THR 167.A OG1 ASP 132.A OD1 no hydrogen 3.079 N/A TYR 170.A N THR 167.A O no hydrogen 2.714 N/A TYR 170.A OH GLU 196.A OE1 no hydrogen 2.439 N/A LEU 171.A N LEU 168.A O no hydrogen 3.338 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 2.607 N/A ILE 176.A N PRO 172.A O no hydrogen 3.333 N/A GLU 177.A N PRO 173.A O no hydrogen 3.044 N/A GLY 178.A N MET 175.A O no hydrogen 2.972 N/A ARG 179.A N GLU 174.A O no hydrogen 2.881 N/A HIS 181.A N ARG 162.A O no hydrogen 2.878 N/A LYS 184.A N ASP 182.A OD1 no hydrogen 2.711 N/A LYS 184.A NZ PRO 243.A O no hydrogen 3.328 N/A LYS 184.A NZ ARG 246.A O no hydrogen 2.963 N/A VAL 185.A N ASP 182.A O no hydrogen 3.432 N/A ASP 186.A N GLU 183.A O no hydrogen 3.260 N/A LEU 187.A N LYS 184.A O no hydrogen 3.074 N/A TRP 188.A N LYS 184.A O no hydrogen 3.213 N/A SER 189.A N VAL 185.A O no hydrogen 3.002 N/A SER 189.A OG TYR 170.A O no hydrogen 2.979 N/A SER 189.A OG VAL 185.A O no hydrogen 3.396 N/A LEU 190.A N ASP 186.A O no hydrogen 3.030 N/A GLY 191.A N LEU 187.A O no hydrogen 3.095 N/A VAL 192.A N TRP 188.A O no hydrogen 3.039 N/A LEU 193.A N SER 189.A O no hydrogen 2.861 N/A CYS 194.A N LEU 190.A O no hydrogen 2.921 N/A TYR 195.A N GLY 191.A O no hydrogen 3.120 N/A TYR 195.A OH THR 222.A O no hydrogen 2.904 N/A GLU 196.A N VAL 192.A O no hydrogen 2.958 N/A PHE 197.A N LEU 193.A O no hydrogen 2.845 N/A LEU 198.A N CYS 194.A O no hydrogen 3.361 N/A VAL 199.A N TYR 195.A O no hydrogen 2.972 N/A GLY 200.A N GLU 196.A O no hydrogen 2.629 N/A GLU 211.A N THR 208.A OG1 no hydrogen 3.167 N/A THR 212.A N THR 208.A O no hydrogen 3.247 N/A THR 212.A OG1 PHE 204.A O no hydrogen 3.095 N/A TYR 213.A N TYR 209.A O no hydrogen 2.856 N/A LYS 214.A N GLN 210.A O no hydrogen 3.237 N/A LYS 214.A NZ GLU 211.A OE2 no hydrogen 3.044 N/A ARG 215.A N GLU 211.A O no hydrogen 3.140 N/A ARG 215.A NE GLU 211.A OE1 no hydrogen 3.513 N/A ILE 216.A N THR 212.A O no hydrogen 2.922 N/A SER 217.A N TYR 213.A O no hydrogen 2.961 N/A SER 217.A OG TYR 213.A O no hydrogen 3.422 N/A ARG 218.A N LYS 214.A O no hydrogen 2.950 N/A ARG 218.A NH1 GLU 220.A OE2 no hydrogen 3.115 N/A VAL 219.A N ILE 216.A O no hydrogen 3.127 N/A GLU 220.A N ARG 215.A O no hydrogen 2.739 N/A VAL 227.A N PRO 224.A O no hydrogen 2.907 N/A THR 228.A OG1 GLU 106.A OE2 no hydrogen 2.546 N/A ARG 232.A N THR 228.A O no hydrogen 2.872 N/A ASP 233.A N GLU 229.A O no hydrogen 2.814 N/A LEU 234.A N GLY 230.A O no hydrogen 3.167 N/A ILE 235.A N ALA 231.A O no hydrogen 3.033 N/A SER 236.A N ARG 232.A O no hydrogen 2.790 N/A SER 236.A OG ARG 232.A O no hydrogen 2.816 N/A ARG 237.A N ASP 233.A O no hydrogen 2.865 N/A ARG 237.A NE ASP 233.A OD2 no hydrogen 2.690 N/A LEU 238.A N LEU 234.A O no hydrogen 3.059 N/A LEU 239.A N ILE 235.A O no hydrogen 2.941 N/A HIS 241.A NE2 GLU 177.A OE2 no hydrogen 2.666 N/A GLN 245.A N ASN 242.A O no hydrogen 2.932 N/A GLN 245.A NE2 ASN 242.A OD1 no hydrogen 3.477 N/A ARG 246.A N PRO 243.A O no hydrogen 2.997 N/A ARG 246.A NE LYS 240.A O no hydrogen 2.961 N/A ARG 246.A NH1 GLU 174.A OE2 no hydrogen 2.735 N/A ARG 246.A NH1 LYS 184.A O no hydrogen 2.874 N/A ARG 246.A NH2 GLU 174.A OE1 no hydrogen 2.895 N/A ARG 246.A NH2 LYS 240.A O no hydrogen 2.978 N/A ARG 246.A NH2 HIS 241.A O no hydrogen 3.457 N/A MET 248.A N GLU 251.A OE1 no hydrogen 3.297 N/A VAL 252.A N MET 248.A O no hydrogen 3.172 N/A LEU 253.A N LEU 249.A O no hydrogen 3.004 N/A GLU 254.A N ARG 250.A O no hydrogen 3.027 N/A HIS 255.A N VAL 252.A O no hydrogen 2.945 N/A HIS 255.A NE2 ASP 233.A OD2 no hydrogen 3.149 N/A TRP 257.A N HIS 255.A ND1 no hydrogen 3.178 N/A TRP 257.A NE1 GLU 106.A OE2 no hydrogen 3.147 N/A ILE 258.A N HIS 255.A O no hydrogen 2.778 N/A THR 259.A N HIS 255.A O no hydrogen 2.871 N/A THR 259.A OG1 HIS 255.A O no hydrogen 3.302 N/A THR 259.A OG1 PRO 256.A O no hydrogen 3.029 N/A ALA 260.A N PRO 256.A O no hydrogen 2.906 N/A ASN 261.A N ILE 258.A O no hydrogen 3.126 N/A ASN 261.A ND2 TRP 257.A O no hydrogen 2.884 N/A SER 262.A N ILE 258.A O no hydrogen 2.830 N/A SER 262.A OG ILE 258.A O no hydrogen 3.278 N/A