Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5n9s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG TYR 10.A O no hydrogen 3.504 N/A VAL 5.A N ARG 8.A O no hydrogen 2.886 N/A LYS 6.A N GLU 77.A OE1 no hydrogen 2.709 N/A ARG 8.A N VAL 5.A O no hydrogen 3.035 N/A ILE 9.A N GLU 30.A OE2 no hydrogen 2.912 N/A TYR 10.A N MET 3.A O no hydrogen 2.714 N/A SER 11.A N LEU 28.A O no hydrogen 2.839 N/A SER 11.A OG LEU 28.A O no hydrogen 3.442 N/A ILE 12.A N GLN 1.A O no hydrogen 3.363 N/A LEU 13.A N GLN 26.A O no hydrogen 2.838 N/A LYS 14.A N GLN 26.A O no hydrogen 3.377 N/A ILE 16.A N VAL 24.A O no hydrogen 2.767 N/A SER 21.A OG GLY 20.A O no hydrogen 2.236 N/A SER 22.A OG TYR 39.A O no hydrogen 2.823 N/A LYS 23.A N TYR 39.A O no hydrogen 3.094 N/A VAL 24.A N GLY 17.A O no hydrogen 3.131 N/A PHE 25.A N ILE 37.A O no hydrogen 2.912 N/A GLN 26.A N LYS 14.A O no hydrogen 2.823 N/A VAL 27.A N TYR 35.A O no hydrogen 2.912 N/A LEU 28.A N SER 11.A O no hydrogen 2.910 N/A ASN 29.A N GLN 33.A O no hydrogen 3.068 N/A ASN 29.A ND2 GLN 33.A OE1 no hydrogen 3.520 N/A LYS 31.A N ASN 29.A OD1 no hydrogen 3.081 N/A LYS 32.A N ASN 29.A O no hydrogen 2.741 N/A GLN 33.A N ASN 29.A OD1 no hydrogen 2.874 N/A TYR 35.A N VAL 27.A O no hydrogen 2.859 N/A TYR 35.A OH GLN 33.A OE1 no hydrogen 3.310 N/A ALA 36.A N MET 87.A O no hydrogen 2.903 N/A ILE 37.A N PHE 25.A O no hydrogen 2.895 N/A LYS 38.A N MET 85.A O no hydrogen 2.851 N/A LYS 38.A NZ SER 22.A OG no hydrogen 2.905 N/A TYR 39.A N LYS 23.A O no hydrogen 2.859 N/A VAL 40.A N ILE 83.A O no hydrogen 2.745 N/A ASN 41.A N SER 21.A O no hydrogen 2.852 N/A LEU 42.A N GLN 81.A O no hydrogen 2.698 N/A GLU 43.A N ASN 41.A OD1 no hydrogen 2.793 N/A ALA 45.A N LEU 42.A O no hydrogen 2.950 N/A GLN 48.A NE2 ASN 154.A OD1 no hydrogen 3.021 N/A THR 49.A N ASP 46.A OD2 no hydrogen 2.783 N/A THR 49.A OG1 ASP 46.A OD1 no hydrogen 2.393 N/A THR 49.A OG1 ASP 46.A OD2 no hydrogen 2.569 N/A LEU 50.A N ASP 46.A O no hydrogen 2.908 N/A ASP 51.A N ASN 47.A O no hydrogen 2.919 N/A SER 52.A N GLN 48.A O no hydrogen 2.918 N/A SER 52.A OG THR 49.A O no hydrogen 2.649 N/A TYR 53.A N THR 49.A O no hydrogen 2.982 N/A ARG 54.A N LEU 50.A O no hydrogen 2.980 N/A ASN 55.A N ASP 51.A O no hydrogen 3.062 N/A GLU 56.A N SER 52.A O no hydrogen 3.007 N/A ILE 57.A N TYR 53.A O no hydrogen 2.892 N/A ALA 58.A N ARG 54.A O no hydrogen 2.963 N/A TYR 59.A N ASN 55.A O no hydrogen 3.080 N/A LEU 60.A N GLU 56.A O no hydrogen 2.907 N/A ASN 61.A N ILE 57.A O no hydrogen 3.003 N/A LYS 62.A N ALA 58.A O no hydrogen 2.806 N/A LEU 63.A N TYR 59.A O no hydrogen 2.720 N/A GLN 64.A NE2 LEU 73.A O no hydrogen 3.050 N/A GLN 65.A N GLN 65.A OE1 no hydrogen 2.718 N/A HIS 66.A N LEU 63.A O no hydrogen 3.090 N/A SER 67.A OG GLU 118.A OE2 no hydrogen 3.145 N/A LYS 69.A N SER 67.A OG no hydrogen 2.927 N/A LYS 69.A NZ ASP 68.A OD1 no hydrogen 3.180 N/A LYS 69.A NZ ASP 68.A OD2 no hydrogen 3.368 N/A LYS 69.A NZ GLU 118.A OE1 no hydrogen 3.157 N/A ILE 71.A N LEU 147.A O no hydrogen 3.124 N/A ARG 72.A N GLU 88.A OE1 no hydrogen 3.096 N/A ARG 72.A NH1 SER 67.A O no hydrogen 2.739 N/A ARG 72.A NH2 SER 67.A O no hydrogen 3.234 N/A LEU 73.A N GLN 64.A OE1 no hydrogen 2.756 N/A TYR 74.A N VAL 86.A O no hydrogen 2.760 N/A ASP 75.A N VAL 86.A O no hydrogen 3.312 N/A TYR 76.A N ASP 75.A OD1 no hydrogen 2.769 N/A GLU 77.A N TYR 84.A O no hydrogen 2.902 N/A THR 79.A N TYR 82.A O no hydrogen 3.063 N/A THR 79.A OG1 TYR 82.A O no hydrogen 3.536 N/A GLN 81.A N THR 79.A OG1 no hydrogen 3.071 N/A TYR 82.A N THR 79.A OG1 no hydrogen 3.165 N/A TYR 82.A OH GLU 77.A OE2 no hydrogen 2.597 N/A ILE 83.A N VAL 40.A O no hydrogen 2.629 N/A TYR 84.A N GLU 77.A O no hydrogen 2.929 N/A MET 85.A N LYS 38.A O no hydrogen 2.848 N/A VAL 86.A N ASP 75.A O no hydrogen 2.870 N/A MET 87.A N ALA 36.A O no hydrogen 2.779 N/A GLU 88.A N ARG 72.A O no hydrogen 3.167 N/A CYS 89.A SG GLY 90.A O no hydrogen 3.475 N/A ASN 91.A N ILE 140.A O no hydrogen 2.731 N/A LEU 94.A N PHE 138.A O no hydrogen 2.962 N/A SER 96.A N ASP 93.A OD2 no hydrogen 3.003 N/A SER 96.A OG ASP 93.A OD1 no hydrogen 2.915 N/A SER 96.A OG ASP 93.A OD2 no hydrogen 3.482 N/A TRP 97.A N ASP 93.A O no hydrogen 3.017 N/A LEU 98.A N LEU 94.A O no hydrogen 2.854 N/A LYS 99.A N ASN 95.A O no hydrogen 3.066 N/A LYS 99.A NZ ASP 159.A OD1 no hydrogen 3.085 N/A LYS 100.A N SER 96.A O no hydrogen 2.992 N/A LYS 101.A N LEU 98.A O no hydrogen 2.983 N/A ARG 109.A N ASP 105.A O no hydrogen 2.860 N/A ARG 109.A NH1 MET 192.A O no hydrogen 2.938 N/A ARG 109.A NH2 GLU 226.A OE2 no hydrogen 2.831 N/A LYS 110.A N PRO 106.A O no hydrogen 3.008 N/A LYS 110.A NZ TYR 255.A O no hydrogen 2.976 N/A SER 111.A N TRP 107.A O no hydrogen 2.885 N/A TYR 112.A N GLU 108.A O no hydrogen 3.046 N/A TRP 113.A N ARG 109.A O no hydrogen 3.026 N/A LYS 114.A N LYS 110.A O no hydrogen 3.138 N/A ASN 115.A N SER 111.A O no hydrogen 3.251 N/A MET 116.A N TYR 112.A O no hydrogen 2.876 N/A LEU 117.A N TRP 113.A O no hydrogen 2.869 N/A GLU 118.A N LYS 114.A O no hydrogen 2.904 N/A ALA 119.A N ASN 115.A O no hydrogen 3.100 N/A VAL 120.A N MET 116.A O no hydrogen 2.995 N/A HIS 121.A N LEU 117.A O no hydrogen 2.853 N/A THR 122.A N GLU 118.A O no hydrogen 3.080 N/A THR 122.A OG1 GLU 118.A O no hydrogen 2.667 N/A ILE 123.A N ALA 119.A O no hydrogen 3.212 N/A HIS 124.A N VAL 120.A O no hydrogen 2.965 N/A HIS 124.A NE2 ASP 181.A OD2 no hydrogen 2.773 N/A GLN 125.A N HIS 121.A O no hydrogen 3.081 N/A HIS 126.A N ILE 123.A O no hydrogen 2.969 N/A HIS 126.A ND1 THR 122.A O no hydrogen 3.070 N/A GLY 127.A N HIS 124.A O no hydrogen 2.908 N/A ILE 128.A N ILE 123.A O no hydrogen 3.111 N/A HIS 130.A N ASP 181.A OD2 no hydrogen 2.864 N/A SER 131.A N ASP 181.A OD1 no hydrogen 2.689 N/A SER 131.A OG HIS 130.A O no hydrogen 2.773 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 3.119 N/A LYS 134.A N ASN 137.A OD1 no hydrogen 2.723 N/A LYS 134.A NZ ASP 132.A O no hydrogen 3.121 N/A LYS 134.A NZ ASP 132.A OD2 no hydrogen 2.816 N/A ALA 136.A N GLN 161.A OE1 no hydrogen 2.848 N/A ASN 137.A N LYS 134.A O no hydrogen 2.960 N/A ASN 137.A ND2 ASP 149.A OD1 no hydrogen 2.821 N/A PHE 138.A N PRO 135.A O no hydrogen 3.058 N/A LEU 139.A N LYS 146.A O no hydrogen 2.769 N/A ILE 140.A N ILE 92.A O no hydrogen 2.893 N/A VAL 141.A N MET 144.A O no hydrogen 2.812 N/A ASP 142.A N ASN 91.A OD1 no hydrogen 3.372 N/A MET 144.A N VAL 141.A O no hydrogen 3.051 N/A LEU 145.A N ASN 115.A OD1 no hydrogen 2.866 N/A LYS 146.A N LEU 139.A O no hydrogen 2.804 N/A LYS 146.A NZ ASP 68.A O no hydrogen 2.928 N/A LYS 146.A NZ GLU 88.A OE1 no hydrogen 2.797 N/A LYS 146.A NZ GLU 88.A OE2 no hydrogen 3.522 N/A LEU 147.A N LYS 69.A O no hydrogen 2.924 N/A ILE 148.A N ASN 137.A O no hydrogen 2.945 N/A PHE 150.A N GLU 56.A OE2 no hydrogen 2.806 N/A ILE 152.A N GLU 56.A OE1 no hydrogen 3.049 N/A ALA 153.A N GLU 56.A OE1 no hydrogen 2.938 N/A ASN 154.A N SER 52.A OG no hydrogen 2.920 N/A ASN 154.A ND2 GLN 48.A OE1 no hydrogen 2.968 N/A ASN 154.A ND2 THR 49.A OG1 no hydrogen 3.048 N/A SER 160.A OG ASP 159.A O no hydrogen 2.562 N/A MET 167.A N VAL 164.A O no hydrogen 3.125 N/A GLU 170.A N GLU 170.A OE1 no hydrogen 2.867 N/A ALA 171.A N PRO 168.A O no hydrogen 2.994 N/A ILE 172.A N PRO 169.A O no hydrogen 3.280 N/A LYS 173.A N PRO 169.A O no hydrogen 3.289 N/A LYS 179.A N SER 177.A OG no hydrogen 3.009 N/A LYS 179.A NZ PRO 241.A O no hydrogen 2.927 N/A LYS 179.A NZ ARG 244.A O no hydrogen 2.595 N/A SER 180.A N SER 177.A O no hydrogen 3.015 N/A SER 180.A OG GLU 170.A OE2 no hydrogen 2.672 N/A SER 180.A OG SER 177.A O no hydrogen 3.431 N/A ASP 181.A N PRO 178.A O no hydrogen 3.163 N/A TRP 183.A N LYS 179.A O no hydrogen 3.240 N/A SER 184.A N SER 180.A O no hydrogen 3.454 N/A SER 184.A OG TYR 166.A O no hydrogen 2.642 N/A LEU 185.A N ASP 181.A O no hydrogen 3.006 N/A GLY 186.A N VAL 182.A O no hydrogen 2.841 N/A CYS 187.A N TRP 183.A O no hydrogen 2.821 N/A CYS 187.A SG ASN 165.A O no hydrogen 3.689 N/A CYS 187.A SG TRP 183.A O no hydrogen 3.805 N/A ILE 188.A N SER 184.A O no hydrogen 2.971 N/A LEU 189.A N LEU 185.A O no hydrogen 2.858 N/A TYR 190.A N GLY 186.A O no hydrogen 2.992 N/A TYR 190.A OH GLU 220.A O no hydrogen 2.515 N/A TYR 191.A N CYS 187.A O no hydrogen 3.114 N/A MET 192.A N ILE 188.A O no hydrogen 3.019 N/A THR 193.A N TYR 190.A O no hydrogen 3.026 N/A THR 193.A OG1 LEU 189.A O no hydrogen 2.782 N/A TYR 194.A N TYR 190.A O no hydrogen 2.750 N/A TYR 194.A OH PRO 222.A O no hydrogen 2.615 N/A GLY 195.A N TYR 191.A O no hydrogen 3.042 N/A LYS 196.A NZ GLN 201.A OE1 no hydrogen 2.948 N/A THR 197.A N GLN 200.A OE1 no hydrogen 2.780 N/A THR 197.A OG1 GLN 200.A OE1 no hydrogen 3.417 N/A GLN 200.A N THR 197.A O no hydrogen 3.093 N/A ILE 202.A N PHE 199.A O no hydrogen 3.265 N/A SER 207.A N ASN 204.A OD1 no hydrogen 2.883 N/A LYS 208.A N ASN 204.A O no hydrogen 2.843 N/A LYS 208.A NZ ASN 165.A OD1 no hydrogen 2.978 N/A LEU 209.A N GLN 205.A O no hydrogen 2.893 N/A HIS 210.A N ILE 206.A O no hydrogen 2.951 N/A ALA 211.A N SER 207.A O no hydrogen 2.803 N/A ILE 212.A N LYS 208.A O no hydrogen 2.945 N/A ILE 213.A N LEU 209.A O no hydrogen 3.349 N/A ASP 214.A N ALA 211.A O no hydrogen 3.232 N/A ASN 216.A N ASP 214.A OD1 no hydrogen 2.717 N/A HIS 217.A N ASP 214.A O no hydrogen 3.002 N/A LYS 227.A NZ ASP 223.A OD1 no hydrogen 3.298 N/A LYS 227.A NZ ILE 224.A O no hydrogen 3.327 N/A GLN 230.A N GLU 226.A O no hydrogen 3.412 N/A GLN 230.A NE2 PHE 221.A O no hydrogen 2.914 N/A GLN 230.A NE2 ASP 223.A OD1 no hydrogen 3.127 N/A ASP 231.A N LYS 227.A O no hydrogen 2.975 N/A VAL 232.A N ASP 228.A O no hydrogen 2.974 N/A LEU 233.A N LEU 229.A O no hydrogen 2.998 N/A LYS 234.A N GLN 230.A O no hydrogen 3.083 N/A CYS 235.A N ASP 231.A O no hydrogen 2.893 N/A CYS 236.A N VAL 232.A O no hydrogen 2.815 N/A CYS 236.A SG VAL 232.A O no hydrogen 3.312 N/A LEU 237.A N LEU 233.A O no hydrogen 2.997 N/A ARG 239.A NE ILE 212.A O no hydrogen 2.726 N/A ARG 239.A NH1 HIS 217.A O no hydrogen 3.096 N/A ARG 239.A NH2 ALA 211.A O no hydrogen 2.900 N/A ARG 239.A NH2 HIS 217.A O no hydrogen 2.921 N/A LYS 242.A N ASP 240.A OD1 no hydrogen 3.248 N/A ARG 244.A N ASP 240.A O no hydrogen 3.071 N/A ARG 244.A N PRO 241.A O no hydrogen 3.165 N/A ARG 244.A NE LYS 238.A O no hydrogen 2.902 N/A ARG 244.A NH1 GLU 170.A OE1 no hydrogen 3.353 N/A ARG 244.A NH1 GLU 170.A OE2 no hydrogen 2.785 N/A ARG 244.A NH1 LYS 179.A O no hydrogen 2.971 N/A ARG 244.A NH2 GLU 170.A OE1 no hydrogen 3.001 N/A ARG 244.A NH2 LYS 238.A O no hydrogen 2.909 N/A ILE 245.A N CYS 235.A O no hydrogen 3.333 N/A SER 246.A N GLU 249.A OE1 no hydrogen 3.276 N/A SER 246.A OG GLU 249.A OE1 no hydrogen 3.241 N/A GLU 249.A N SER 246.A OG no hydrogen 3.207 N/A LEU 250.A N SER 246.A O no hydrogen 2.776 N/A LEU 251.A N ILE 247.A O no hydrogen 3.025 N/A ALA 252.A N GLU 249.A O no hydrogen 2.934 N/A HIS 253.A N LEU 250.A O no hydrogen 3.360 N/A HIS 253.A NE2 ASP 231.A OD2 no hydrogen 2.910 N/A TYR 255.A N HIS 253.A ND1 no hydrogen 3.147 N/A VAL 256.A N HIS 253.A O no hydrogen 3.084 N/A GLN 257.A N HIS 253.A O no hydrogen 3.034 N/A GLN 257.A N PRO 254.A O no hydrogen 3.132 N/A GLN 257.A NE2 LEU 251.A O no hydrogen 2.868 N/A ILE 258.A N PRO 254.A O no hydrogen 2.811 N/A