Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q9w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ.A ASP 109.A OD2.B no hydrogen 2.765 N/A LYS 5.A NZ.B GLY 2.A O no hydrogen 3.331 N/A MET 8.A N GLY 31.A O no hydrogen 3.026 N/A LYS 9.A N ASP 109.A O.A no hydrogen 2.862 N/A LYS 9.A N ASP 109.A O.B no hydrogen 2.842 N/A ILE 10.A N GLY 29.A O no hydrogen 2.924 N/A LYS 11.A N.A PHE 111.A O no hydrogen 2.879 N/A LYS 11.A N.B PHE 111.A O no hydrogen 2.888 N/A LEU 12.A N GLY 27.A O no hydrogen 3.002 N/A LYS 13.A N TYR 113.A O no hydrogen 3.143 N/A MET 14.A N ILE 25.A O no hydrogen 2.819 N/A GLU 15.A N ILE 115.A O no hydrogen 3.007 N/A GLY 16.A N PHE 23.A O no hydrogen 2.943 N/A ASN 17.A N LEU 117.A O no hydrogen 2.915 N/A ASN 17.A ND2 GLY 20.A O no hydrogen 3.581 N/A VAL 18.A N TYR 21.A O.A no hydrogen 2.892 N/A VAL 18.A N TYR 21.A O.B no hydrogen 2.982 N/A ASN 19.A N GLY 119.A O no hydrogen 2.869 N/A ASN 19.A ND2 PHE 122.A O no hydrogen 2.926 N/A TYR 21.A N.A VAL 18.A O no hydrogen 2.920 N/A TYR 21.A N.B VAL 18.A O no hydrogen 2.911 N/A TYR 21.A OH.B GLY 47.A O no hydrogen 2.476 N/A PHE 23.A N GLY 16.A O no hydrogen 2.942 N/A VAL 24.A N GLU 46.A O no hydrogen 2.969 N/A ILE 25.A N MET 14.A O no hydrogen 2.963 N/A GLU 26.A N GLU 43.A O no hydrogen 3.004 N/A GLY 27.A N LEU 12.A O no hydrogen 2.936 N/A GLU 28.A N ASN 41.A O no hydrogen 2.986 N/A GLY 29.A N ILE 10.A O no hydrogen 2.906 N/A GLU 30.A N THR 39.A O.A no hydrogen 2.954 N/A GLU 30.A N THR 39.A O.B no hydrogen 2.978 N/A GLY 31.A N MET 8.A O no hydrogen 2.858 N/A LYS 32.A N THR 37.A O no hydrogen 2.901 N/A LYS 32.A NZ ASP 7.A OD1 no hydrogen 3.053 N/A TYR 34.A OH ILE 4.A O no hydrogen 2.734 N/A ASP 35.A N LYS 32.A O no hydrogen 3.065 N/A GLY 36.A N PRO 33.A O no hydrogen 3.423 N/A THR 37.A N LYS 32.A O no hydrogen 3.381 N/A ASN 38.A N GLU 208.A O no hydrogen 3.057 N/A ASN 38.A ND2 GLU 208.A O no hydrogen 3.048 N/A ASN 38.A ND2 GLU 208.A OE1 no hydrogen 3.024 N/A THR 39.A N.A GLU 30.A O no hydrogen 2.890 N/A THR 39.A N.B GLU 30.A O no hydrogen 2.883 N/A THR 39.A OG1.B GLU 30.A O no hydrogen 3.299 N/A ILE 40.A N VAL 206.A O no hydrogen 2.845 N/A ASN 41.A N GLU 28.A O no hydrogen 2.827 N/A ASN 41.A ND2 GLU 28.A O no hydrogen 3.437 N/A ASN 41.A ND2 GLU 28.A OE2 no hydrogen 3.001 N/A LEU 42.A N VAL 204.A O no hydrogen 2.767 N/A GLU 43.A N GLU 26.A O no hydrogen 2.834 N/A VAL 44.A N ASN 202.A O no hydrogen 2.884 N/A LYS 45.A N VAL 24.A O no hydrogen 2.805 N/A LYS 45.A NZ GLU 43.A OE1 no hydrogen 2.827 N/A GLU 46.A N VAL 24.A O no hydrogen 3.279 N/A SER 53.A N VAL 128.A O no hydrogen 2.813 N/A SER 53.A OG THR 133.A OG1 no hydrogen 2.563 N/A ASP 55.A N SER 53.A OG no hydrogen 3.155 N/A ILE 56.A N SER 53.A O no hydrogen 3.276 N/A LEU 57.A N TYR 54.A O no hydrogen 2.932 N/A THR 58.A OG1 ASP 55.A O no hydrogen 3.282 N/A ALA 60.A N LEU 57.A O no hydrogen 3.067 N/A PHE 61.A N THR 58.A O no hydrogen 3.074 N/A ASN 62.A ND2 TYR 113.A OH no hydrogen 3.051 N/A ARG 63.A NE THR 66.A OG1 no hydrogen 2.800 N/A ARG 63.A NH2 PHE 65.A O no hydrogen 2.905 N/A ARG 63.A NH2 GLU 208.A OE1 no hydrogen 2.919 N/A ALA 64.A N ASN 62.A OD1 no hydrogen 3.002 N/A PHE 65.A N ASN 62.A O no hydrogen 2.939 N/A THR 66.A OG1 ARG 63.A O no hydrogen 2.704 N/A LYS 67.A N ALA 210.A O no hydrogen 2.996 N/A TYR 68.A OH HIS 186.A NE2 no hydrogen 2.727 N/A ILE 72.A N PRO 69.A O no hydrogen 3.189 N/A TYR 75.A OH TYR 174.A O no hydrogen 3.220 N/A LYS 77.A N ASN 74.A OD1 no hydrogen 3.049 N/A LYS 77.A NZ PRO 33.A O no hydrogen 2.919 N/A LYS 77.A NZ ALA 64.A O no hydrogen 2.932 N/A GLN 78.A N ASN 74.A O no hydrogen 3.088 N/A GLN 78.A NE2 ASN 74.A O no hydrogen 3.132 N/A GLN 78.A NE2 LYS 181.A O no hydrogen 2.882 N/A SER 79.A N PHE 76.A O no hydrogen 3.205 N/A SER 79.A OG PHE 76.A O no hydrogen 2.803 N/A PHE 80.A N LYS 77.A O no hydrogen 3.291 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.688 N/A GLY 83.A N SER 79.A O no hydrogen 2.820 N/A TYR 84.A N ILE 104.A O no hydrogen 3.295 N/A TYR 84.A OH ASN 62.A OD1 no hydrogen 2.742 N/A SER 85.A N ARG 175.A O no hydrogen 3.087 N/A TRP 86.A N SER 102.A O no hydrogen 2.914 N/A GLU 87.A N ILE 173.A O no hydrogen 3.000 N/A ARG 88.A N VAL 100.A O no hydrogen 2.788 N/A ARG 88.A NE THR 172.A OG1 no hydrogen 2.788 N/A ARG 88.A NH1 THR 59.A O no hydrogen 2.914 N/A ARG 88.A NH2 TYR 174.A OH no hydrogen 3.425 N/A THR 89.A N LYS 171.A O no hydrogen 2.880 N/A MET 90.A N VAL 98.A O no hydrogen 2.798 N/A THR 91.A N.A ASP 169.A O no hydrogen 2.919 N/A THR 91.A N.B ASP 169.A O no hydrogen 2.896 N/A THR 91.A OG1.A ASP 169.A O no hydrogen 3.426 N/A PHE 92.A N GLY 96.A O no hydrogen 2.947 N/A GLU 93.A N.A ARG 167.A O no hydrogen 2.930 N/A LYS 95.A N PHE 92.A O no hydrogen 2.896 N/A ILE 97.A N GLU 120.A O.A no hydrogen 2.979 N/A ILE 97.A N GLU 120.A O.B no hydrogen 2.954 N/A VAL 98.A N MET 90.A O no hydrogen 2.935 N/A LYS 99.A N LYS 118.A O no hydrogen 2.898 N/A VAL 100.A N ARG 88.A O no hydrogen 2.947 N/A LYS 101.A N TYR 116.A O.A no hydrogen 2.951 N/A LYS 101.A N TYR 116.A O.B no hydrogen 2.935 N/A SER 102.A N TRP 86.A O no hydrogen 2.915 N/A ASP 103.A N GLU 114.A O no hydrogen 3.036 N/A ILE 104.A N TYR 84.A O no hydrogen 2.894 N/A SER 105.A N ILE 112.A O no hydrogen 2.929 N/A SER 105.A OG ILE 112.A O no hydrogen 3.444 N/A GLU 107.A N SER 110.A O no hydrogen 2.884 N/A SER 110.A N GLU 107.A O no hydrogen 2.993 N/A PHE 111.A N LYS 9.A O no hydrogen 2.851 N/A ILE 112.A N SER 105.A O no hydrogen 2.855 N/A TYR 113.A N LYS 11.A O.A no hydrogen 2.864 N/A TYR 113.A N LYS 11.A O.B no hydrogen 2.853 N/A GLU 114.A N ASP 103.A O no hydrogen 3.087 N/A ILE 115.A N LYS 13.A O no hydrogen 2.907 N/A TYR 116.A N.A LYS 101.A O no hydrogen 2.917 N/A TYR 116.A N.B LYS 101.A O no hydrogen 2.918 N/A TYR 116.A OH.A GLU 114.A OE2 no hydrogen 2.503 N/A LEU 117.A N GLU 15.A O no hydrogen 3.000 N/A LYS 118.A N LYS 99.A O no hydrogen 2.850 N/A GLY 119.A N ASN 17.A O no hydrogen 2.793 N/A GLU 120.A N.A ILE 97.A O no hydrogen 2.836 N/A GLU 120.A N.B ILE 97.A O no hydrogen 2.869 N/A PHE 122.A N ASN 19.A OD1 no hydrogen 3.134 N/A GLY 126.A N PRO 123.A O no hydrogen 2.981 N/A GLN 130.A N GLY 126.A O no hydrogen 3.098 N/A LYS 131.A N VAL 128.A O no hydrogen 3.260 N/A LYS 132.A N PRO 127.A O no hydrogen 2.863 N/A THR 133.A OG1 SER 53.A OG no hydrogen 2.563 N/A THR 133.A OG1 ASP 55.A OD2 no hydrogen 2.598 N/A THR 134.A N LEU 159.A O no hydrogen 2.830 N/A THR 134.A OG1 LEU 159.A O no hydrogen 3.398 N/A TRP 136.A NE1 ASP 55.A O no hydrogen 2.874 N/A ASP 137.A N.A LYS 157.A O no hydrogen 3.041 N/A ASP 137.A N.B LYS 157.A O no hydrogen 3.111 N/A SER 139.A N HIS 190.A O no hydrogen 2.998 N/A THR 140.A OG1 ASP 189.A OD1 no hydrogen 2.827 N/A GLU 141.A N VAL 188.A O no hydrogen 2.795 N/A ARG 142.A N ASP 153.A O no hydrogen 2.873 N/A MET 143.A N HIS 186.A O no hydrogen 2.862 N/A TYR 144.A N LYS 151.A O no hydrogen 2.914 N/A TYR 144.A OH ASP 153.A OD2 no hydrogen 2.615 N/A ARG 146.A N VAL 149.A O no hydrogen 2.948 N/A ARG 146.A NH1 VAL 145.A O no hydrogen 2.923 N/A VAL 149.A N ARG 146.A O no hydrogen 3.101 N/A LEU 150.A N TYR 174.A O no hydrogen 3.105 N/A LYS 151.A N TYR 144.A O no hydrogen 2.777 N/A GLY 152.A N THR 172.A O no hydrogen 2.877 N/A ASP 153.A N ARG 142.A O no hydrogen 2.929 N/A VAL 154.A N PHE 170.A O no hydrogen 2.989 N/A HIS 156.A N VAL 168.A O no hydrogen 2.826 N/A LYS 157.A N HIS 156.A ND1 no hydrogen 2.887 N/A LYS 157.A NZ ASP 137.A OD2.A no hydrogen 3.487 N/A LEU 158.A N TYR 166.A O no hydrogen 2.841 N/A LEU 159.A N GLY 135.A O no hydrogen 2.839 N/A LEU 160.A N GLY 164.A O no hydrogen 3.089 N/A GLU 161.A N LYS 132.A O no hydrogen 2.845 N/A GLY 163.A N LEU 160.A O no hydrogen 3.026 N/A TYR 166.A N LEU 158.A O no hydrogen 2.811 N/A TYR 166.A OH ASP 94.A OD1 no hydrogen 2.613 N/A TYR 166.A OH ASP 94.A OD2 no hydrogen 3.351 N/A ARG 167.A N GLU 93.A OE2.A no hydrogen 2.929 N/A VAL 168.A N HIS 156.A O no hydrogen 2.968 N/A ASP 169.A N THR 91.A O.A no hydrogen 2.931 N/A ASP 169.A N THR 91.A O.B no hydrogen 2.903 N/A PHE 170.A N VAL 154.A O no hydrogen 2.836 N/A LYS 171.A N THR 89.A O no hydrogen 2.939 N/A THR 172.A N GLY 152.A O no hydrogen 2.851 N/A ILE 173.A N GLU 87.A O no hydrogen 2.869 N/A TYR 174.A N LEU 150.A O no hydrogen 2.760 N/A TYR 174.A OH GLU 141.A OE2 no hydrogen 2.637 N/A ARG 175.A N SER 85.A O no hydrogen 2.849 N/A ALA 176.A N TYR 75.A OH no hydrogen 2.875 N/A LYS 177.A N GLY 83.A O no hydrogen 2.917 N/A LYS 177.A NZ ASP 103.A OD1 no hydrogen 3.516 N/A LYS 177.A NZ ASP 103.A OD2 no hydrogen 2.730 N/A LYS 178.A NZ PHE 80.A O no hydrogen 3.201 N/A LYS 178.A NZ GLU 82.A OE1 no hydrogen 2.798 N/A LYS 181.A N GLN 78.A OE1 no hydrogen 2.914 N/A HIS 186.A N MET 143.A O no hydrogen 3.016 N/A HIS 186.A ND1 ASP 184.A O no hydrogen 2.878 N/A HIS 186.A NE2 TYR 68.A OH no hydrogen 2.727 N/A PHE 187.A N ARG 213.A O no hydrogen 2.914 N/A VAL 188.A N GLU 141.A O no hydrogen 2.853 N/A ASP 189.A N VAL 211.A O.A no hydrogen 2.862 N/A ASP 189.A N VAL 211.A O.B no hydrogen 2.893 N/A HIS 190.A N SER 139.A O no hydrogen 2.824 N/A ARG 191.A N SER 209.A O no hydrogen 3.019 N/A ARG 191.A NH1 GLU 193.A OE2.A no hydrogen 3.078 N/A GLU 193.A N.A TYR 207.A O no hydrogen 2.881 N/A GLU 193.A N.B TYR 207.A O no hydrogen 2.845 N/A LEU 195.A N THR 205.A O no hydrogen 2.771 N/A ASP 198.A N LYS 203.A O no hydrogen 3.083 N/A TYR 201.A N ASP 198.A O no hydrogen 2.883 N/A LYS 203.A N ASP 198.A OD1 no hydrogen 2.866 N/A VAL 204.A N LEU 42.A O no hydrogen 3.072 N/A THR 205.A N ASN 196.A O no hydrogen 2.949 N/A THR 205.A OG1 ASN 41.A OD1 no hydrogen 2.727 N/A THR 205.A OG1 ASN 196.A OD1 no hydrogen 2.965 N/A VAL 206.A N ILE 40.A O no hydrogen 2.872 N/A TYR 207.A N GLU 193.A O.A no hydrogen 2.902 N/A TYR 207.A N GLU 193.A O.B no hydrogen 2.896 N/A GLU 208.A N ASN 38.A O no hydrogen 2.955 N/A SER 209.A N ARG 191.A O no hydrogen 3.049 N/A ALA 210.A N GLY 36.A O no hydrogen 2.842 N/A VAL 211.A N.A ASP 189.A O no hydrogen 3.025 N/A VAL 211.A N.B ASP 189.A O no hydrogen 3.032 N/A ALA 212.A N LYS 67.A O no hydrogen 2.800 N/A ARG 213.A N PHE 187.A O no hydrogen 2.906 N/A ARG 213.A NE ASP 189.A OD2 no hydrogen 2.711 N/A ARG 213.A NH2 ASP 189.A OD1 no hydrogen 2.910 N/A ARG 213.A NH2 ASP 189.A OD2 no hydrogen 3.465 N/A ASN 214.A ND2.B ASP 217.A OD1 no hydrogen 3.348 N/A SER 215.A OG TYR 185.A O no hydrogen 2.804 N/A THR 216.A N ASN 214.A OD1.B no hydrogen 3.015 N/A