Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m5a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 HIS 2.A O no hydrogen 2.897 N/A CYS 5.A N GLY 17.A O no hydrogen 2.937 N/A TRP 6.A NE1 GLY 64.A O no hydrogen 2.780 N/A ILE 7.A N LEU 15.A O no hydrogen 2.844 N/A TYR 9.A N GLY 13.A O no hydrogen 2.910 N/A GLY 12.A N TYR 9.A O no hydrogen 2.944 N/A GLY 13.A N ASP 11.A OD1 no hydrogen 2.849 N/A SER 14.A N VAL 33.A O no hydrogen 2.961 N/A LEU 15.A N ILE 7.A O no hydrogen 2.918 N/A VAL 16.A N ALA 31.A O no hydrogen 2.870 N/A GLY 17.A N CYS 5.A O no hydrogen 3.059 N/A ASN 20.A N GLU 24.A O no hydrogen 2.951 N/A ASN 20.A ND2 GLU 24.A OE1 no hydrogen 3.073 N/A ASP 22.A N ASN 20.A OD1 no hydrogen 2.842 N/A GLY 23.A N ASN 20.A O no hydrogen 2.780 N/A GLU 24.A N ASN 20.A OD1 no hydrogen 2.855 N/A THR 26.A N GLU 24.A O no hydrogen 2.871 N/A GLY 27.A N PHE 45.A O no hydrogen 3.011 N/A ILE 30.A N GLY 43.A O no hydrogen 2.989 N/A ALA 31.A N VAL 16.A O no hydrogen 2.968 N/A TYR 32.A N LEU 41.A O no hydrogen 2.887 N/A VAL 33.A N SER 14.A O no hydrogen 2.896 N/A TYR 34.A N THR 39.A O no hydrogen 2.865 N/A TYR 34.A OH ASP 95.A OD2 no hydrogen 2.711 N/A GLU 37.A N TYR 34.A O no hydrogen 2.889 N/A ARG 38.A N ASP 36.A OD1 no hydrogen 3.010 N/A ARG 38.A NH1 LEU 58.A O no hydrogen 3.052 N/A THR 39.A N ASP 36.A OD1 no hydrogen 2.902 N/A THR 39.A OG1 ASP 36.A OD1 no hydrogen 3.548 N/A THR 39.A OG1 ASP 36.A OD2 no hydrogen 2.601 N/A ALA 40.A N ALA 56.A O no hydrogen 2.928 N/A LEU 41.A N TYR 32.A O no hydrogen 2.808 N/A TYR 42.A N LYS 54.A O no hydrogen 2.848 N/A GLY 43.A N ILE 30.A O no hydrogen 2.814 N/A LYS 44.A N GLU 52.A O no hydrogen 2.934 N/A PHE 45.A N GLY 27.A O no hydrogen 3.001 N/A ILE 46.A N GLU 49.A O no hydrogen 2.889 N/A ASP 47.A N THR 26.A OG1 no hydrogen 2.756 N/A GLY 48.A N MET 25.A O no hydrogen 2.859 N/A GLU 49.A N ILE 46.A O no hydrogen 2.864 N/A ILE 51.A N LYS 44.A O no hydrogen 2.829 N/A GLU 52.A N LYS 44.A O no hydrogen 3.140 N/A GLY 53.A N TYR 77.A O no hydrogen 2.905 N/A LYS 54.A N TYR 42.A O no hydrogen 2.830 N/A LEU 55.A N SER 75.A O no hydrogen 3.120 N/A ALA 56.A N ALA 40.A O no hydrogen 2.874 N/A THR 57.A N GLU 69.A O no hydrogen 2.838 N/A LEU 58.A N ARG 38.A O no hydrogen 2.725 N/A MET 59.A N HIS 67.A O no hydrogen 2.802 N/A SER 60.A OG GLU 62.A OE2 no hydrogen 2.941 N/A GLU 62.A N ARG 65.A O no hydrogen 2.899 N/A ARG 65.A N GLU 62.A O no hydrogen 2.917 N/A ARG 65.A NH1 GLU 18.A OE2 no hydrogen 2.867 N/A ARG 65.A NH2 GLU 18.A OE2 no hydrogen 3.018 N/A HIS 67.A N SER 60.A O no hydrogen 2.822 N/A GLU 69.A N THR 57.A O no hydrogen 2.944 N/A MET 71.A N LEU 55.A O no hydrogen 2.920 N/A TYR 77.A N GLY 53.A O no hydrogen 2.878 N/A HIS 78.A ND1 PHE 79.A O no hydrogen 3.224 N/A PHE 79.A N MET 50.A O no hydrogen 2.913 N/A ASP 80.A N ARG 198.A O no hydrogen 2.764 N/A SER 82.A OG GLY 133.A O no hydrogen 2.607 N/A THR 83.A N CYS 86.A O no hydrogen 2.973 N/A SER 84.A OG.A ARG 135.A O no hydrogen 3.218 N/A SER 85.A N THR 83.A OG1 no hydrogen 3.282 N/A CYS 86.A N THR 83.A OG1 no hydrogen 2.957 N/A CYS 86.A SG SER 88.A O no hydrogen 3.774 N/A SER 88.A OG ASP 80.A OD1 no hydrogen 3.351 N/A THR 89.A N ASP 80.A OD1 no hydrogen 2.774 N/A THR 89.A OG1 ASP 80.A OD1 no hydrogen 3.001 N/A THR 89.A OG1 ASN 90.A OD1 no hydrogen 2.803 N/A ASN 90.A N SER 88.A OG no hydrogen 2.933 N/A LEU 93.A N ASN 90.A O no hydrogen 3.041 N/A ASP 95.A N ALA 175.A O no hydrogen 3.118 N/A TYR 97.A OH VAL 127.A O no hydrogen 2.619 N/A GLU 98.A N ASP 95.A OD1 no hydrogen 2.955 N/A SER 99.A N ASP 95.A O no hydrogen 2.978 N/A SER 99.A OG ASP 95.A O no hydrogen 3.251 N/A SER 99.A OG PRO 96.A O no hydrogen 3.074 N/A GLU 100.A N TYR 97.A O no hydrogen 3.355 N/A ARG 101.A N GLU 98.A O no hydrogen 2.903 N/A ARG 101.A NH1 TYR 97.A O no hydrogen 2.950 N/A ARG 101.A NH2 ASP 36.A OD2 no hydrogen 2.925 N/A VAL 102.A N GLU 98.A O no hydrogen 3.044 N/A TYR 103.A N PHE 117.A O no hydrogen 2.906 N/A TYR 103.A OH ASP 214.A OD2 no hydrogen 2.799 N/A ALA 105.A N GLY 115.A O no hydrogen 3.203 N/A SER 107.A N GLY 113.A O no hydrogen 2.800 N/A SER 107.A OG GLU 216.A OE1 no hydrogen 3.133 N/A SER 107.A OG GLU 216.A OE2 no hydrogen 2.551 N/A LEU 108.A N GLU 216.A OE1 no hydrogen 2.883 N/A ILE 109.A N SER 107.A OG no hydrogen 3.035 N/A ALA 112.A N ILE 109.A O no hydrogen 3.317 N/A GLY 115.A N ALA 105.A O no hydrogen 2.766 N/A PHE 117.A N TYR 103.A O no hydrogen 2.859 N/A SER 118.A N GLU 215.A O no hydrogen 2.953 N/A SER 118.A OG.A VAL 120.A O no hydrogen 2.476 N/A SER 118.A OG.B GLU 212.A O no hydrogen 2.520 N/A SER 118.A OG.B GLU 215.A O no hydrogen 3.118 N/A LYS 119.A N ARG 101.A O no hydrogen 2.779 N/A LYS 119.A NZ SER 99.A O no hydrogen 2.757 N/A VAL 120.A N SER 118.A OG.A no hydrogen 3.335 N/A VAL 122.A N VAL 211.A O no hydrogen 2.934 N/A ASN 125.A N THR 207.A O no hydrogen 2.838 N/A THR 126.A N THR 207.A OG1 no hydrogen 2.944 N/A THR 126.A OG1 GLY 123.A O no hydrogen 2.782 N/A MET 128.A N ILE 205.A O no hydrogen 2.811 N/A SER 129.A OG GLU 98.A OE2 no hydrogen 2.507 N/A PHE 130.A N GLU 98.A OE2 no hydrogen 2.895 N/A ALA 131.A N LYS 203.A O no hydrogen 2.836 N/A ASN 132.A ND2 ILE 87.A O no hydrogen 3.412 N/A ASN 132.A ND2 TYR 173.A OH no hydrogen 3.009 N/A VAL 134.A N ASP 162.A O no hydrogen 2.785 N/A ARG 135.A N THR 83.A O no hydrogen 3.010 N/A ARG 135.A NE SER 82.A OG no hydrogen 2.857 N/A ARG 135.A NH1 PRO 201.A O no hydrogen 3.385 N/A ARG 135.A NH2 PRO 201.A O no hydrogen 2.883 N/A ILE 136.A N VAL 160.A O no hydrogen 2.840 N/A HIS 138.A NE2 ASP 156.A O no hydrogen 2.774 N/A GLU 140.A N THR 137.A OG1 no hydrogen 3.025 N/A VAL 141.A N THR 137.A O no hydrogen 3.219 N/A ASP 142.A N HIS 138.A O no hydrogen 2.809 N/A SER 143.A N GLN 139.A O no hydrogen 3.012 N/A SER 143.A OG GLN 139.A O no hydrogen 2.708 N/A ARG 144.A N VAL 141.A O no hydrogen 3.347 N/A ARG 144.A NE ASN 149.A OD1 no hydrogen 2.665 N/A ARG 144.A NH2 ASN 149.A OD1 no hydrogen 2.961 N/A ARG 144.A NH2 ASP 162.A OD2 no hydrogen 2.924 N/A TRP 146.A NE1 GLU 230.A OE2 no hydrogen 2.747 N/A LEU 148.A N ASP 145.A O no hydrogen 2.920 N/A ASN 149.A N TRP 146.A O no hydrogen 2.814 N/A ASN 149.A ND2 VAL 141.A O no hydrogen 2.747 N/A ASN 151.A ND2.A VAL 163.A O no hydrogen 2.980 N/A ASN 151.A ND2.B HIS 179.A O no hydrogen 3.342 N/A THR 152.A OG1 ASN 149.A O no hydrogen 3.149 N/A LEU 153.A N ILE 161.A O no hydrogen 2.790 N/A SER 154.A OG ASP 156.A O no hydrogen 3.386 N/A LEU 155.A N THR 159.A O no hydrogen 2.863 N/A ASP 156.A N THR 159.A O no hydrogen 3.374 N/A GLU 158.A N ASP 156.A OD1 no hydrogen 2.851 N/A THR 159.A N ASP 156.A OD1 no hydrogen 2.956 N/A VAL 160.A N ILE 136.A O no hydrogen 2.794 N/A ILE 161.A N LEU 153.A O no hydrogen 2.738 N/A ASP 162.A N VAL 134.A O no hydrogen 2.846 N/A TYR 167.A N PRO 164.A O no hydrogen 2.807 N/A HIS 169.A N PRO 166.A O no hydrogen 3.073 N/A LYS 172.A N HIS 169.A O no hydrogen 2.879 N/A TYR 173.A N HIS 169.A O no hydrogen 3.006 N/A TYR 173.A OH SER 176.A OG no hydrogen 2.622 N/A CYS 174.A N ALA 91.A O no hydrogen 2.880 N/A CYS 174.A SG LEU 92.A O no hydrogen 3.566 N/A SER 176.A OG TYR 173.A OH no hydrogen 2.622 N/A LEU 177.A N GLU 98.A OE2 no hydrogen 2.854 N/A GLY 178.A N PHE 130.A O no hydrogen 2.907 N/A LYS 180.A N LEU 177.A O no hydrogen 3.047 N/A LYS 180.A NZ GLU 114.A OE1 no hydrogen 2.703 N/A LYS 180.A NZ ASN 168.A O no hydrogen 2.681 N/A ALA 181.A N GLY 178.A O no hydrogen 3.329 N/A ASN 182.A ND2 GLU 114.A O no hydrogen 3.027 N/A ASN 182.A ND2 GLU 216.A OE2 no hydrogen 3.097 N/A SER 184.A N VAL 219.A O no hydrogen 3.041 N/A THR 186.A N SER 184.A OG no hydrogen 3.020 N/A THR 186.A OG1 SER 184.A OG no hydrogen 3.313 N/A ASN 188.A ND2 GLU 215.A OE2 no hydrogen 2.894 N/A ASN 188.A ND2 GLU 216.A O no hydrogen 2.880 N/A CYS 189.A N THR 218.A O no hydrogen 3.063 N/A CYS 189.A SG ASN 188.A OD1 no hydrogen 3.626 N/A ILE 190.A N ARG 206.A O no hydrogen 2.883 N/A ASP 192.A N CYS 204.A O no hydrogen 3.025 N/A PHE 194.A N ILE 202.A O no hydrogen 2.989 N/A VAL 195.A N ASP 11.A OD2 no hydrogen 2.850 N/A HIS 196.A N GLY 200.A O no hydrogen 2.944 N/A HIS 196.A NE2 ASP 95.A OD2 no hydrogen 2.727 N/A ARG 198.A N HIS 196.A ND1 no hydrogen 3.082 N/A ARG 198.A NH1 LEU 93.A O no hydrogen 2.935 N/A ARG 198.A NH2 LEU 93.A O no hydrogen 2.962 N/A PHE 199.A N HIS 196.A ND1 no hydrogen 3.113 N/A GLY 200.A N HIS 196.A O no hydrogen 2.804 N/A ILE 202.A N PHE 194.A O no hydrogen 2.884 N/A LYS 203.A NZ SER 154.A O no hydrogen 2.720 N/A CYS 204.A N ASP 192.A O no hydrogen 2.784 N/A CYS 204.A SG ASP 192.A O no hydrogen 3.825 N/A ILE 205.A N SER 129.A O no hydrogen 2.877 N/A ARG 206.A N ILE 190.A O no hydrogen 2.839 N/A ARG 206.A NE ASP 192.A OD2 no hydrogen 3.038 N/A ARG 206.A NH1 ASN 125.A O no hydrogen 2.859 N/A ARG 206.A NH2 ASP 11.A O no hydrogen 3.080 N/A THR 207.A N THR 126.A O no hydrogen 2.918 N/A THR 207.A OG1 GLY 123.A O no hydrogen 2.849 N/A THR 207.A OG1 ARG 209.A O no hydrogen 3.426 N/A LEU 208.A N ASN 188.A O no hydrogen 2.754 N/A ARG 209.A NH1.A ALA 210.A O no hydrogen 3.067 N/A ARG 209.A NH1.A GLU 215.A OE2 no hydrogen 2.870 N/A ARG 209.A NH2.A GLU 215.A OE2 no hydrogen 3.024 N/A VAL 211.A N VAL 122.A O no hydrogen 2.962 N/A GLU 212.A N GLU 215.A OE1 no hydrogen 3.123 N/A ASP 214.A N SER 118.A O no hydrogen 2.627 N/A GLU 215.A N SER 118.A OG.B no hydrogen 2.999 N/A GLU 215.A N GLU 212.A O no hydrogen 3.339 N/A LEU 217.A N LEU 116.A O no hydrogen 2.799 N/A THR 218.A N ASN 188.A OD1 no hydrogen 2.899 N/A THR 218.A OG1 ASN 188.A OD1 no hydrogen 3.506 N/A VAL 219.A N ASN 182.A O no hydrogen 3.099 N/A TYR 221.A N HIS 183.A ND1 no hydrogen 2.942 N/A TYR 221.A OH ALA 181.A O no hydrogen 2.660 N/A HIS 225.A NE2 TYR 235.A OH no hydrogen 2.584 N/A SER 226.A N ASP 224.A OD2 no hydrogen 3.166 N/A GLU 230.A N ASP 224.A O no hydrogen 3.098 N/A TYR 235.A N PRO 232.A O no hydrogen 3.171 N/A TYR 235.A OH HIS 225.A NE2 no hydrogen 2.584 N/A GLN 236.A N PRO 232.A O no hydrogen 3.051 N/A GLN 236.A NE2 ALA 231.A O no hydrogen 3.103 N/A VAL 237.A N GLU 233.A O no hydrogen 2.937 N/A GLU 238.A N TRP 234.A O no hydrogen 3.196 N/A LEU 239.A N TYR 235.A O no hydrogen 2.739 N/A LYS 240.A N GLN 236.A O no hydrogen 3.137 N/A ALA 241.A N VAL 237.A O no hydrogen 3.154 N/A PHE 242.A N GLU 238.A O no hydrogen 2.810 N/A GLN 243.A N LEU 239.A O no hydrogen 2.848 N/A ALA 244.A N LYS 240.A O no hydrogen 2.973 N/A THR 245.A N ALA 241.A O no hydrogen 3.183 N/A THR 245.A OG1 PHE 242.A O no hydrogen 3.205 N/A GLN 246.A N PHE 242.A O no hydrogen 3.125 N/A