Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xa9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 HIS 3.A O no hydrogen 2.747 N/A MET 9.A N GLY 32.A O no hydrogen 2.943 N/A THR 10.A N ASN 112.A O no hydrogen 3.010 N/A THR 10.A OG1 ASN 112.A O no hydrogen 3.154 N/A MET 11.A N GLY 30.A O no hydrogen 3.116 N/A LYS 12.A N ILE 114.A O no hydrogen 2.876 N/A TYR 13.A N GLY 28.A O no hydrogen 2.905 N/A HIS 14.A N HIS 116.A O no hydrogen 3.248 N/A MET 15.A N ILE 26.A O no hydrogen 2.781 N/A GLU 16.A N SER 118.A O no hydrogen 3.156 N/A GLY 17.A N PHE 24.A O no hydrogen 2.930 N/A CYS 18.A N PHE 120.A O no hydrogen 2.896 N/A VAL 19.A N HIS 22.A O no hydrogen 2.881 N/A ASN 20.A N GLY 122.A O no hydrogen 2.785 N/A ASN 20.A ND2 PHE 125.A O no hydrogen 2.749 N/A HIS 22.A N VAL 19.A O no hydrogen 2.613 N/A HIS 22.A NE2 GLY 48.A O no hydrogen 2.688 N/A PHE 24.A N GLY 17.A O no hydrogen 3.046 N/A VAL 25.A N GLU 47.A O no hydrogen 2.608 N/A ILE 26.A N MET 15.A O no hydrogen 2.598 N/A THR 27.A N CYS 44.A O no hydrogen 3.113 N/A GLY 28.A N TYR 13.A O no hydrogen 2.835 N/A GLU 29.A N ASN 42.A O no hydrogen 3.051 N/A GLY 30.A N MET 11.A O no hydrogen 3.140 N/A ILE 31.A N THR 40.A O no hydrogen 3.127 N/A GLY 32.A N MET 9.A O no hydrogen 3.010 N/A TYR 33.A N LYS 38.A O no hydrogen 2.741 N/A TYR 33.A OH GLU 8.A OE1 no hydrogen 2.562 N/A LYS 36.A N TYR 33.A O no hydrogen 2.544 N/A GLY 37.A N TYR 33.A O no hydrogen 2.636 N/A LYS 38.A N TYR 33.A O no hydrogen 3.325 N/A GLN 39.A N GLU 215.A O no hydrogen 2.855 N/A THR 40.A N ILE 31.A O no hydrogen 3.152 N/A THR 40.A OG1 THR 214.A OG1 no hydrogen 3.033 N/A ILE 41.A N LEU 213.A O no hydrogen 2.859 N/A ASN 42.A N GLU 29.A O no hydrogen 2.664 N/A ASN 42.A ND2 GLN 212.A OE1 no hydrogen 3.165 N/A LEU 43.A N TRP 211.A O no hydrogen 2.656 N/A CYS 44.A N THR 27.A O no hydrogen 3.011 N/A VAL 45.A N GLN 209.A O no hydrogen 2.997 N/A GLU 47.A N VAL 25.A O no hydrogen 3.206 N/A LEU 51.A N GLN 209.A OE1 no hydrogen 2.657 N/A SER 54.A N VAL 131.A O no hydrogen 2.819 N/A SER 54.A OG ASP 56.A OD2 no hydrogen 3.217 N/A SER 54.A OG THR 136.A OG1 no hydrogen 2.403 N/A LEU 58.A N GLU 55.A O no hydrogen 3.069 N/A SER 59.A N ASP 56.A O no hydrogen 3.215 N/A GLY 61.A N LEU 58.A O no hydrogen 2.702 N/A PHE 62.A N LEU 58.A O no hydrogen 3.089 N/A PHE 62.A N SER 59.A O no hydrogen 2.839 N/A ARG 64.A NE THR 67.A OG1 no hydrogen 2.642 N/A ARG 64.A NH2 PHE 66.A O no hydrogen 3.268 N/A ARG 64.A NH2 THR 67.A OG1 no hydrogen 3.045 N/A ARG 64.A NH2 GLU 215.A OE2 no hydrogen 3.088 N/A ILE 65.A N ASP 63.A OD1 no hydrogen 2.717 N/A PHE 66.A N ASP 63.A O no hydrogen 3.084 N/A THR 67.A OG1 ARG 64.A O no hydrogen 2.696 N/A GLU 68.A N ALA 217.A O no hydrogen 3.132 N/A TYR 69.A OH HIS 192.A NE2 no hydrogen 2.543 N/A ILE 73.A N PRO 70.A O no hydrogen 3.158 N/A TYR 76.A OH GLY 153.A O no hydrogen 2.356 N/A LYS 78.A N ASP 75.A OD1 no hydrogen 2.834 N/A LYS 78.A NZ PRO 34.A O no hydrogen 2.960 N/A LYS 78.A NZ ILE 65.A O no hydrogen 3.063 N/A LYS 78.A NZ ASP 75.A OD2 no hydrogen 3.472 N/A ASN 79.A N ASP 75.A O no hydrogen 3.087 N/A SER 80.A N PHE 77.A O no hydrogen 3.122 N/A SER 80.A OG PHE 77.A O no hydrogen 2.684 N/A SER 80.A OG GLY 84.A O no hydrogen 3.009 N/A CYS 81.A N LYS 78.A O no hydrogen 2.966 N/A CYS 81.A SG PHE 77.A O no hydrogen 3.513 N/A GLY 84.A N SER 80.A O no hydrogen 2.585 N/A TYR 85.A N ILE 105.A O no hydrogen 3.150 N/A TYR 85.A OH ASP 63.A OD1 no hydrogen 2.820 N/A THR 86.A N LYS 180.A O no hydrogen 3.074 N/A TRP 87.A N VAL 103.A O no hydrogen 3.182 N/A GLY 88.A N VAL 178.A O no hydrogen 3.095 N/A ARG 89.A N CYS 101.A O no hydrogen 2.888 N/A ARG 89.A NE THR 177.A OG1 no hydrogen 2.844 N/A ARG 89.A NH1 ALA 60.A O no hydrogen 2.796 N/A SER 90.A N ASP 176.A O no hydrogen 3.094 N/A PHE 91.A N CYS 99.A O no hydrogen 2.571 N/A LEU 92.A N GLN 174.A O no hydrogen 2.956 N/A PHE 93.A N ALA 97.A O no hydrogen 3.040 N/A GLU 94.A N ARG 172.A O no hydrogen 2.802 N/A GLY 96.A N PHE 93.A O no hydrogen 3.448 N/A ALA 97.A N ASP 95.A OD2 no hydrogen 3.459 N/A VAL 98.A N MET 123.A O no hydrogen 2.927 N/A CYS 99.A N PHE 91.A O no hydrogen 2.945 N/A ILE 100.A N ASN 121.A O no hydrogen 2.671 N/A CYS 101.A N ARG 89.A O no hydrogen 2.849 N/A CYS 101.A SG ILE 119.A O no hydrogen 3.807 N/A ASN 102.A N ILE 119.A O no hydrogen 3.200 N/A VAL 103.A N TRP 87.A O no hydrogen 2.845 N/A ASP 104.A N LYS 117.A O no hydrogen 2.835 N/A ILE 105.A N TYR 85.A O no hydrogen 2.809 N/A THR 106.A N TYR 115.A O no hydrogen 2.797 N/A THR 106.A OG1 ILE 105.A O no hydrogen 3.132 N/A VAL 107.A N PRO 82.A O no hydrogen 2.937 N/A SER 108.A N CYS 113.A O no hydrogen 2.822 N/A ASN 112.A ND2 GLU 8.A O no hydrogen 2.717 N/A ILE 114.A N THR 10.A O no hydrogen 2.635 N/A TYR 115.A N THR 106.A O no hydrogen 2.881 N/A TYR 115.A OH GLU 111.A OE1 no hydrogen 2.736 N/A HIS 116.A N LYS 12.A O no hydrogen 3.114 N/A HIS 116.A ND1 LYS 12.A O no hydrogen 2.979 N/A HIS 116.A NE2 ASP 63.A OD2 no hydrogen 2.680 N/A LYS 117.A N ASP 104.A O no hydrogen 2.888 N/A SER 118.A N HIS 14.A O no hydrogen 3.238 N/A ILE 119.A N ASN 102.A O no hydrogen 3.189 N/A PHE 120.A N GLU 16.A O no hydrogen 2.897 N/A ASN 121.A N ILE 100.A O no hydrogen 2.962 N/A GLY 122.A N CYS 18.A O no hydrogen 2.935 N/A MET 123.A N VAL 98.A O no hydrogen 3.047 N/A PHE 125.A N ASN 20.A OD1 no hydrogen 3.036 N/A GLY 129.A N PRO 126.A O no hydrogen 2.844 N/A LYS 133.A N GLY 129.A O no hydrogen 2.769 N/A LYS 134.A N VAL 131.A O no hydrogen 3.283 N/A LYS 134.A NZ LEU 51.A O no hydrogen 3.112 N/A MET 135.A N PRO 130.A O no hydrogen 2.861 N/A THR 136.A OG1 ASP 56.A OD2 no hydrogen 2.839 N/A THR 137.A N LEU 164.A O no hydrogen 2.936 N/A TRP 139.A NE1 ASP 56.A O no hydrogen 2.974 N/A GLU 140.A N TYR 162.A O no hydrogen 2.730 N/A SER 142.A N HIS 196.A O no hydrogen 2.981 N/A GLU 144.A N ILE 194.A O no hydrogen 2.559 N/A LYS 145.A N ASP 158.A O no hydrogen 3.044 N/A ILE 146.A N HIS 192.A O no hydrogen 2.749 N/A MET 147.A N LYS 156.A O no hydrogen 2.755 N/A VAL 149.A N ILE 154.A O no hydrogen 2.707 N/A GLN 152.A N VAL 149.A O no hydrogen 3.190 N/A LEU 155.A N TYR 179.A O no hydrogen 2.745 N/A LYS 156.A N MET 147.A O no hydrogen 2.690 N/A GLY 157.A N THR 177.A O no hydrogen 2.901 N/A ASP 158.A N LYS 145.A O no hydrogen 2.900 N/A VAL 159.A N PHE 175.A O no hydrogen 3.052 N/A MET 161.A N CYS 173.A O no hydrogen 2.929 N/A LEU 163.A N TYR 171.A O no hydrogen 2.729 N/A LEU 164.A N ASN 138.A O no hydrogen 2.519 N/A LEU 165.A N GLY 169.A O no hydrogen 2.860 N/A LYS 166.A N MET 135.A O no hydrogen 2.776 N/A LYS 166.A NZ LYS 134.A O no hydrogen 2.483 N/A GLY 168.A N LEU 165.A O no hydrogen 2.572 N/A ARG 170.A NE GLU 140.A OE1 no hydrogen 3.117 N/A ARG 170.A NE GLU 140.A OE2 no hydrogen 2.618 N/A ARG 170.A NH2 GLU 140.A OE1 no hydrogen 2.650 N/A ARG 170.A NH2 GLU 140.A OE2 no hydrogen 3.431 N/A TYR 171.A N LEU 163.A O no hydrogen 2.914 N/A TYR 171.A OH ASP 95.A OD1 no hydrogen 2.774 N/A TYR 171.A OH ASP 95.A OD2 no hydrogen 2.885 N/A ARG 172.A N GLU 94.A OE2 no hydrogen 2.879 N/A ARG 172.A NE SER 160.A OG no hydrogen 3.422 N/A CYS 173.A N MET 161.A O no hydrogen 3.001 N/A GLN 174.A N LEU 92.A O no hydrogen 2.737 N/A PHE 175.A N VAL 159.A O no hydrogen 2.783 N/A THR 177.A N GLY 157.A O no hydrogen 3.059 N/A VAL 178.A N GLY 88.A O no hydrogen 2.865 N/A TYR 179.A N LEU 155.A O no hydrogen 2.582 N/A TYR 179.A OH GLU 144.A OE2 no hydrogen 2.817 N/A LYS 180.A N THR 86.A O no hydrogen 2.961 N/A ALA 181.A N TYR 76.A OH no hydrogen 2.706 N/A LYS 182.A N GLY 84.A O no hydrogen 3.450 N/A LYS 182.A NZ ALA 83.A O no hydrogen 3.027 N/A LYS 182.A NZ ASP 104.A OD2 no hydrogen 3.268 N/A LYS 182.A NZ ILE 105.A O no hydrogen 3.350 N/A SER 183.A OG VAL 184.A O no hydrogen 3.407 N/A HIS 192.A N ILE 146.A O no hydrogen 2.765 N/A HIS 192.A ND1 GLU 190.A O no hydrogen 2.988 N/A HIS 192.A NE2 TYR 69.A OH no hydrogen 2.543 N/A PHE 193.A N PHE 220.A O no hydrogen 2.761 N/A ILE 194.A N GLU 144.A O no hydrogen 2.844 N/A GLN 195.A N ILE 218.A O no hydrogen 2.942 N/A HIS 196.A N SER 142.A O no hydrogen 2.830 N/A HIS 196.A ND1 GLU 215.A OE2 no hydrogen 2.844 N/A HIS 196.A NE2 GLU 144.A OE1 no hydrogen 2.888 N/A LYS 197.A N HIS 216.A O no hydrogen 2.986 N/A LEU 199.A N THR 214.A O no hydrogen 3.122 N/A ARG 200.A N ASN 138.A OD1 no hydrogen 2.603 N/A ARG 200.A NE ASP 56.A OD1 no hydrogen 2.444 N/A ARG 200.A NH1 GLU 55.A OE1 no hydrogen 2.560 N/A ARG 200.A NH2 ASP 56.A OD2 no hydrogen 2.811 N/A GLU 201.A N GLN 212.A O no hydrogen 3.004 N/A ARG 203.A N LYS 210.A O no hydrogen 2.881 N/A ARG 203.A NH2 GLU 201.A OE1 no hydrogen 3.223 N/A SER 204.A N ASP 202.A OD1 no hydrogen 3.150 N/A SER 204.A OG ASP 202.A OD1 no hydrogen 2.546 N/A SER 204.A OG ASP 202.A OD2 no hydrogen 2.602 N/A SER 204.A OG LYS 210.A O no hydrogen 3.308 N/A ASP 205.A N ASN 208.A O no hydrogen 2.921 N/A LYS 207.A N ASP 205.A O no hydrogen 2.294 N/A ASN 208.A N ASP 205.A O no hydrogen 2.702 N/A GLN 209.A NE2 GLU 55.A OE2 no hydrogen 3.210 N/A LYS 210.A NZ ARG 203.A O no hydrogen 2.338 N/A TRP 211.A N LEU 43.A O no hydrogen 2.846 N/A GLN 212.A N GLU 201.A O no hydrogen 2.907 N/A LEU 213.A N ILE 41.A O no hydrogen 2.828 N/A THR 214.A N LEU 199.A O no hydrogen 3.139 N/A THR 214.A OG1 GLN 39.A O no hydrogen 3.415 N/A THR 214.A OG1 THR 40.A OG1 no hydrogen 3.033 N/A GLU 215.A N GLN 39.A O no hydrogen 2.878 N/A HIS 216.A N LYS 197.A O no hydrogen 3.316 N/A HIS 216.A ND1 GLY 37.A O no hydrogen 3.270 N/A ALA 217.A N GLY 37.A O no hydrogen 2.780 N/A ILE 218.A N GLN 195.A O no hydrogen 2.927 N/A ALA 219.A N GLU 68.A O no hydrogen 2.969 N/A PHE 220.A N PHE 193.A O no hydrogen 2.705 N/A LEU 224.A N SER 222.A OG no hydrogen 3.048 N/A