Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f53_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N TYR 172.A O no hydrogen 2.861 N/A SER 5.A OG ASP 76.A OD2 no hydrogen 3.494 N/A ARG 7.A N SER 5.A OG no hydrogen 3.151 N/A ARG 7.A NH1 TYR 160.A OH no hydrogen 2.779 N/A TYR 8.A N ASP 76.A OD2 no hydrogen 2.972 N/A TYR 8.A OH ASP 216.A OD2 no hydrogen 2.560 N/A ILE 9.A N ASP 76.A OD1 no hydrogen 2.804 N/A GLN 10.A NE2 GLN 10.A O no hydrogen 3.441 N/A GLN 10.A NE2 ASP 13.A OD1 no hydrogen 2.868 N/A GLN 10.A NE2 ALA 39.A O no hydrogen 2.910 N/A GLN 11.A N ARG 7.A O no hydrogen 3.092 N/A GLN 11.A NE2 GLY 6.A O no hydrogen 2.844 N/A ASP 13.A N GLN 10.A O no hydrogen 2.957 N/A GLN 14.A N GLN 11.A O no hydrogen 3.089 N/A CYS 16.A N LEU 12.A O no hydrogen 2.950 N/A GLN 17.A N ASP 13.A O no hydrogen 2.902 N/A GLN 17.A NE2 ILE 37.A O no hydrogen 3.087 N/A GLU 18.A N GLN 14.A O no hydrogen 3.085 N/A ILE 19.A N ARG 15.A O no hydrogen 2.943 N/A ALA 20.A N CYS 16.A O no hydrogen 2.923 N/A ALA 21.A N GLN 17.A O no hydrogen 3.157 N/A GLU 22.A N GLU 18.A O no hydrogen 2.921 N/A LEU 23.A N ILE 19.A O no hydrogen 2.867 N/A CYS 24.A N ALA 20.A O no hydrogen 2.873 N/A GLN 25.A N ALA 21.A O no hydrogen 3.112 N/A SER 26.A N GLU 22.A O no hydrogen 2.996 N/A SER 26.A OG GLU 22.A O no hydrogen 3.351 N/A GLY 27.A N CYS 24.A O no hydrogen 2.850 N/A LEU 28.A N LEU 23.A O no hydrogen 2.981 N/A LYS 30.A NZ ASN 93.A OD1 no hydrogen 2.806 N/A ARG 36.A N PRO 33.A O no hydrogen 3.014 N/A ARG 36.A NE ASP 57.A OD1 no hydrogen 2.810 N/A ARG 36.A NH2 ASP 57.A OD1 no hydrogen 3.349 N/A ARG 36.A NH2 ASP 57.A OD2 no hydrogen 2.729 N/A ILE 37.A N SER 34.A O no hydrogen 3.083 N/A VAL 38.A N PHE 56.A O no hydrogen 3.070 N/A ALA 39.A N ASP 13.A OD1 no hydrogen 2.832 N/A ARG 40.A N ARG 54.A O no hydrogen 2.966 N/A ARG 40.A NH1 ALA 39.A O no hydrogen 2.959 N/A ASN 41.A N ASN 72.A O no hydrogen 2.868 N/A ALA 42.A N GLN 52.A O no hydrogen 2.956 N/A GLY 44.A N GLN 48.A O no hydrogen 2.999 N/A ILE 45.A N GLN 48.A OE1 no hydrogen 2.940 N/A THR 46.A N ARG 89.A O no hydrogen 2.891 N/A THR 46.A OG1 ARG 89.A O no hydrogen 3.372 N/A GLN 48.A N ILE 45.A O no hydrogen 2.863 N/A GLN 52.A N ALA 42.A O no hydrogen 3.063 N/A GLN 52.A NE2 LEU 51.A O no hydrogen 3.074 N/A TRP 53.A N HIS 98.A ND1 no hydrogen 2.983 N/A ARG 54.A N ARG 40.A O no hydrogen 2.918 N/A ARG 54.A NE ALA 42.A O no hydrogen 2.864 N/A ARG 54.A NH1 THR 96.A OG1 no hydrogen 2.835 N/A ARG 54.A NH2 ALA 42.A O no hydrogen 2.971 N/A CYS 55.A N ALA 95.A O no hydrogen 2.756 N/A PHE 56.A N VAL 38.A O no hydrogen 2.850 N/A ASP 57.A N ASN 93.A O no hydrogen 2.928 N/A THR 58.A N ARG 36.A O no hydrogen 2.753 N/A THR 58.A OG1 ARG 36.A O no hydrogen 3.421 N/A ALA 59.A N ASP 57.A OD1 no hydrogen 2.969 N/A SER 60.A N ASP 57.A O no hydrogen 2.870 N/A SER 60.A OG ASP 57.A O no hydrogen 2.756 N/A LEU 61.A N THR 58.A O no hydrogen 3.137 N/A LEU 62.A N GLY 86.A O no hydrogen 2.580 N/A ASN 65.A ND2 GLU 67.A O no hydrogen 3.398 N/A GLN 66.A N ASN 69.A OD1 no hydrogen 2.960 N/A ASN 69.A ND2 VAL 87.A O no hydrogen 2.721 N/A VAL 71.A N GLY 85.A O no hydrogen 3.418 N/A ASN 72.A N ASN 41.A O no hydrogen 2.912 N/A ASN 72.A ND2 ASN 41.A O no hydrogen 2.835 N/A CYS 73.A N ILE 81.A O no hydrogen 2.737 N/A VAL 74.A N GLN 10.A OE1 no hydrogen 2.909 N/A ASP 75.A N HIS 79.A O no hydrogen 2.939 N/A CYS 77.A N ASP 75.A OD1 no hydrogen 2.997 N/A GLY 78.A N ASP 75.A O no hydrogen 2.959 N/A HIS 79.A N ASP 75.A OD1 no hydrogen 2.905 N/A ILE 81.A N CYS 73.A O no hydrogen 2.773 N/A CYS 83.A N VAL 71.A O no hydrogen 2.875 N/A CYS 83.A SG.B VAL 71.A O no hydrogen 3.906 N/A GLY 86.A N LEU 62.A O no hydrogen 2.548 N/A VAL 87.A N ASN 69.A O no hydrogen 2.809 N/A ARG 89.A NE GLY 44.A O no hydrogen 2.693 N/A ARG 89.A NH2 ILE 45.A O no hydrogen 3.255 N/A ARG 89.A NH2 ASN 49.A OD1 no hydrogen 2.883 N/A GLN 90.A N HIS 88.A ND1 no hydrogen 3.274 N/A ASN 91.A N HIS 88.A ND1 no hydrogen 3.116 N/A SER 92.A OG HIS 94.A ND1 no hydrogen 2.613 N/A ASN 93.A N SER 60.A OG no hydrogen 3.004 N/A ASN 93.A ND2 LYS 30.A O no hydrogen 2.860 N/A ASN 93.A ND2 ASP 57.A OD2 no hydrogen 2.974 N/A HIS 94.A ND1 SER 92.A OG no hydrogen 2.613 N/A HIS 94.A NE2 GLN 48.A OE1 no hydrogen 3.017 N/A ALA 95.A N CYS 55.A O no hydrogen 2.927 N/A ARG 97.A N TRP 53.A O no hydrogen 2.931 N/A ARG 97.A NH1 THR 96.A O no hydrogen 2.814 N/A LEU 101.A N ARG 97.A O no hydrogen 3.243 N/A SER 102.A N HIS 98.A O no hydrogen 2.930 N/A SER 102.A OG HIS 98.A O no hydrogen 2.652 N/A LYS 103.A N GLU 99.A O no hydrogen 2.974 N/A LEU 104.A N ILE 100.A O no hydrogen 3.000 N/A VAL 105.A N LEU 101.A O no hydrogen 3.046 N/A GLU 106.A N SER 102.A O no hydrogen 3.030 N/A GLU 107.A N LYS 103.A O no hydrogen 2.985 N/A GLY 108.A N LEU 104.A O no hydrogen 2.928 N/A VAL 109.A N VAL 105.A O no hydrogen 2.895 N/A ARG 111.A NE GLU 217.A OE2 no hydrogen 2.751 N/A ARG 111.A NH2 GLU 217.A OE1 no hydrogen 3.533 N/A ARG 111.A NH2 GLU 217.A OE2 no hydrogen 2.900 N/A PHE 112.A N GLY 108.A O no hydrogen 2.836 N/A CYS 113.A N VAL 109.A O no hydrogen 2.957 N/A CYS 113.A SG SER 114.A O no hydrogen 3.730 N/A SER 114.A OG ALA 164.A O no hydrogen 3.078 N/A SER 114.A OG SER 165.A O no hydrogen 2.844 N/A TYR 116.A N SER 114.A OG no hydrogen 3.146 N/A GLN 117.A N SER 114.A OG no hydrogen 3.278 N/A GLN 117.A NE2 ASN 121.A OD1 no hydrogen 2.980 N/A GLN 117.A NE2 ALA 133.A O no hydrogen 2.882 N/A ALA 118.A N SER 114.A O no hydrogen 2.804 N/A SER 119.A N PRO 115.A O no hydrogen 3.050 N/A SER 119.A OG ALA 198.A O no hydrogen 2.752 N/A ALA 120.A N TYR 116.A O no hydrogen 3.171 N/A ASN 121.A N GLN 117.A O no hydrogen 2.797 N/A LYS 122.A N ALA 118.A O no hydrogen 2.866 N/A LYS 122.A NZ ASP 126.A OD2 no hydrogen 3.023 N/A TYR 123.A N SER 119.A O no hydrogen 3.001 N/A TYR 123.A OH GLU 191.A OE1 no hydrogen 3.077 N/A CYS 124.A N ALA 120.A O no hydrogen 3.150 N/A CYS 124.A SG ALA 120.A O no hydrogen 3.603 N/A ASN 125.A N ASN 121.A O no hydrogen 2.914 N/A ASP 126.A N LYS 122.A O no hydrogen 2.929 N/A LYS 127.A N TYR 123.A O no hydrogen 3.063 N/A LYS 127.A NZ TYR 123.A OH no hydrogen 3.529 N/A LYS 127.A NZ GLU 191.A OE1 no hydrogen 2.998 N/A LYS 127.A NZ GLU 191.A OE2 no hydrogen 3.085 N/A PHE 128.A N CYS 124.A O no hydrogen 2.662 N/A GLY 130.A N ASN 125.A OD1 no hydrogen 2.824 N/A THR 131.A N PHE 128.A O no hydrogen 3.081 N/A THR 131.A OG1 PHE 128.A O no hydrogen 2.683 N/A ILE 132.A N TYR 150.A O no hydrogen 3.012 N/A ALA 133.A N ASN 121.A OD1 no hydrogen 2.995 N/A ARG 134.A N ARG 148.A O no hydrogen 3.249 N/A ARG 134.A NE GLY 175.A O no hydrogen 3.028 N/A ARG 134.A NH1 ALA 133.A O no hydrogen 2.999 N/A ARG 134.A NH2 ASP 75.A OD2 no hydrogen 2.825 N/A ARG 134.A NH2 PRO 174.A O no hydrogen 2.839 N/A ARG 135.A N GLU 162.A O no hydrogen 2.908 N/A ARG 135.A NH1 GLU 162.A OE1 no hydrogen 2.899 N/A SER 136.A N ALA 146.A O no hydrogen 2.992 N/A LYS 137.A N SER 136.A OG no hydrogen 2.772 N/A LYS 137.A NZ ASN 142.A O no hydrogen 2.870 N/A GLY 140.A N THR 180.A O no hydrogen 2.946 N/A VAL 143.A N ASN 141.A OD1 no hydrogen 2.925 N/A GLU 144.A N ASN 141.A OD1 no hydrogen 2.957 N/A ALA 146.A N SER 136.A O no hydrogen 3.077 N/A TRP 147.A N GLU 192.A OE1 no hydrogen 3.033 N/A ARG 148.A N ARG 134.A O no hydrogen 3.029 N/A ARG 148.A NE SER 136.A O no hydrogen 3.084 N/A ARG 148.A NH1 THR 190.A OG1 no hydrogen 2.833 N/A ARG 148.A NH2 SER 136.A O no hydrogen 2.982 N/A ARG 148.A NH2 GLU 144.A O no hydrogen 3.496 N/A CYS 149.A N TYR 189.A O no hydrogen 2.793 N/A TYR 150.A N ILE 132.A O no hydrogen 2.781 N/A TYR 150.A OH LYS 137.A O no hydrogen 2.783 N/A GLU 151.A N ARG 187.A O no hydrogen 3.046 N/A LYS 152.A NZ GLY 130.A O no hydrogen 2.779 N/A SER 154.A N GLU 151.A O no hydrogen 2.946 N/A SER 154.A OG GLU 151.A O no hydrogen 2.703 N/A SER 154.A OG ARG 187.A O no hydrogen 3.374 N/A LEU 155.A N LYS 152.A O no hydrogen 3.052 N/A LEU 156.A N GLY 176.A O no hydrogen 2.922 N/A TYR 157.A N PRO 82.A O no hydrogen 2.846 N/A TYR 157.A OH VAL 74.A O no hydrogen 2.726 N/A VAL 159.A N LEU 156.A O no hydrogen 3.008 N/A TYR 160.A OH SER 5.A O no hydrogen 2.881 N/A ALA 161.A N CYS 173.A O no hydrogen 2.854 N/A CYS 163.A N TRP 171.A O no hydrogen 2.844 N/A ALA 164.A N GLN 117.A OE1 no hydrogen 2.861 N/A SER 165.A N THR 169.A O no hydrogen 2.889 N/A SER 165.A OG THR 169.A O no hydrogen 3.169 N/A SER 165.A OG THR 169.A OG1 no hydrogen 2.686 N/A ASN 166.A ND2 GLU 217.A O no hydrogen 3.069 N/A ASN 166.A ND2 ASN 218.A OD1 no hydrogen 3.148 N/A CYS 167.A N SER 165.A OG no hydrogen 3.186 N/A GLY 168.A N SER 165.A O no hydrogen 2.942 N/A THR 169.A N SER 165.A OG no hydrogen 3.004 N/A THR 169.A OG1 SER 165.A OG no hydrogen 2.686 N/A TYR 172.A N PRO 3.A O no hydrogen 3.041 N/A CYS 173.A N ALA 161.A O no hydrogen 2.822 N/A GLY 175.A N VAL 159.A O no hydrogen 2.967 N/A GLY 176.A N LEU 156.A O no hydrogen 3.002 N/A ARG 177.A N SER 136.A OG no hydrogen 3.273 N/A ARG 177.A NE SER 154.A O no hydrogen 3.075 N/A ARG 177.A NE SER 154.A OG no hydrogen 3.073 N/A ARG 177.A NH1 ASP 185.A O no hydrogen 2.828 N/A ARG 177.A NH1 HIS 188.A ND1 no hydrogen 3.443 N/A ARG 177.A NH2 SER 154.A OG no hydrogen 3.094 N/A ARG 177.A NH2 HIS 188.A ND1 no hydrogen 3.020 N/A THR 180.A OG1 ASP 185.A OD1 no hydrogen 3.219 N/A THR 180.A OG1 ASP 185.A OD2 no hydrogen 2.614 N/A THR 182.A N ASP 185.A OD2 no hydrogen 2.918 N/A THR 182.A OG1 ASP 185.A OD2 no hydrogen 2.786 N/A ASP 185.A N THR 182.A O no hydrogen 3.009 N/A LYS 186.A N GLU 183.A O no hydrogen 3.077 N/A LYS 186.A NZ GLU 183.A OE1 no hydrogen 3.281 N/A ARG 187.A N LEU 184.A O no hydrogen 3.010 N/A ARG 187.A NE GLU 151.A OE1 no hydrogen 3.258 N/A ARG 187.A NE GLU 151.A OE2 no hydrogen 3.157 N/A ARG 187.A NH2 GLU 151.A OE2 no hydrogen 2.688 N/A HIS 188.A N LYS 186.A O no hydrogen 2.934 N/A TYR 189.A N CYS 149.A O no hydrogen 2.772 N/A TYR 189.A OH GLU 151.A OE2 no hydrogen 3.358 N/A GLU 191.A N TRP 147.A O no hydrogen 2.964 N/A ILE 195.A N GLU 191.A O no hydrogen 2.976 N/A ARG 196.A N GLU 192.A O no hydrogen 3.031 N/A ARG 196.A NH1 GLU 192.A OE1 no hydrogen 2.394 N/A GLN 197.A N GLU 193.A O no hydrogen 3.008 N/A ALA 198.A N GLY 194.A O no hydrogen 3.079 N/A ILE 199.A N ILE 195.A O no hydrogen 2.941 N/A GLY 200.A N ARG 196.A O no hydrogen 2.850 N/A SER 201.A N ALA 198.A O no hydrogen 3.358 N/A SER 201.A OG ALA 198.A O no hydrogen 2.799 N/A VAL 202.A N ILE 199.A O no hydrogen 3.249 N/A SER 204.A OG CYS 206.A O no hydrogen 3.243 N/A CYS 206.A N SER 204.A OG no hydrogen 3.015 N/A SER 207.A N GLU 210.A OE1 no hydrogen 2.889 N/A VAL 209.A N SER 207.A OG no hydrogen 2.995 N/A GLU 210.A N SER 207.A O no hydrogen 3.174 N/A VAL 211.A N LEU 223.A O no hydrogen 2.714 N/A CYS 212.A SG ASN 166.A O no hydrogen 3.991 N/A LEU 213.A N LEU 221.A O no hydrogen 2.774 N/A LYS 215.A N ASN 166.A OD1 no hydrogen 3.123 N/A ASN 218.A N ARG 111.A O no hydrogen 2.866 N/A ASN 218.A ND2 GLN 110.A O no hydrogen 3.409 N/A ASN 218.A ND2 CYS 113.A O no hydrogen 2.875 N/A LEU 221.A N LEU 213.A O no hydrogen 2.876 N/A LEU 223.A N VAL 211.A O no hydrogen 2.973 N/A GLU 225.A N VAL 209.A O no hydrogen 3.038 N/A