Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pga_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG VAL 3.A O no hydrogen 2.676 N/A SER 1.A OG LEU 8.A O no hydrogen 3.459 N/A ASP 2.A N LEU 8.A O no hydrogen 2.798 N/A VAL 3.A N SER 1.A OG no hydrogen 3.199 N/A HIS 5.A N GLU 77.A OE1 no hydrogen 2.824 N/A HIS 5.A ND1 GLU 77.A OE2 no hydrogen 2.689 N/A LEU 6.A N GLU 77.A OE1 no hydrogen 3.161 N/A THR 9.A N ASP 12.A OD1 no hydrogen 2.891 N/A LYS 10.A N ASP 2.A OD2 no hydrogen 2.835 N/A ASP 12.A N THR 9.A O no hydrogen 3.039 N/A ASP 12.A N THR 9.A OG1 no hydrogen 3.226 N/A LEU 13.A N LYS 10.A O no hydrogen 3.028 N/A GLN 14.A N ASN 11.A O no hydrogen 3.103 N/A GLN 14.A NE2 ASN 11.A O no hydrogen 2.725 N/A GLN 14.A NE2 ASN 11.A OD1 no hydrogen 3.333 N/A ALA 16.A N LEU 13.A O no hydrogen 2.902 N/A ALA 19.A N THR 85.A O no hydrogen 2.832 N/A ILE 20.A N ILE 60.A O no hydrogen 2.853 N/A VAL 21.A N LEU 87.A O no hydrogen 2.819 N/A GLU 26.A N ASP 24.A OD2 no hydrogen 2.776 N/A ARG 27.A N ASP 24.A O no hydrogen 2.941 N/A VAL 28.A N PRO 25.A O no hydrogen 3.315 N/A ILE 31.A N ARG 27.A O no hydrogen 3.032 N/A ALA 32.A N VAL 28.A O no hydrogen 2.991 N/A ALA 33.A N GLU 29.A O no hydrogen 2.940 N/A LEU 34.A N ILE 31.A O no hydrogen 3.026 N/A MET 35.A N ALA 32.A O no hydrogen 2.969 N/A ASP 36.A N GLU 53.A O no hydrogen 2.917 N/A VAL 39.A N ARG 51.A O no hydrogen 2.802 N/A LEU 41.A N SER 49.A O no hydrogen 2.771 N/A ALA 42.A N SER 49.A O no hydrogen 3.258 N/A SER 43.A OG THR 48.A OG1 no hydrogen 3.057 N/A HIS 44.A N PHE 47.A O no hydrogen 2.950 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.680 N/A PHE 47.A N HIS 44.A O no hydrogen 2.761 N/A THR 48.A N SER 63.A OG no hydrogen 2.922 N/A THR 48.A OG1 SER 43.A OG no hydrogen 3.057 N/A SER 49.A N ALA 42.A O no hydrogen 2.848 N/A SER 49.A OG ALA 42.A O no hydrogen 3.515 N/A TRP 50.A N VAL 61.A O no hydrogen 2.821 N/A ARG 51.A N VAL 39.A O no hydrogen 2.894 N/A ARG 51.A NH1 ASP 12.A O no hydrogen 2.863 N/A ALA 52.A N VAL 59.A O no hydrogen 2.923 N/A GLU 53.A N ASP 36.A O no hydrogen 2.745 N/A LEU 54.A N LYS 57.A O no hydrogen 2.788 N/A LYS 57.A N LEU 54.A O no hydrogen 2.929 N/A VAL 59.A N ALA 52.A O no hydrogen 2.866 N/A ILE 60.A N LEU 18.A O no hydrogen 3.078 N/A VAL 61.A N TRP 50.A O no hydrogen 2.858 N/A CYS 62.A N ILE 20.A O no hydrogen 2.963 N/A CYS 62.A SG THR 48.A O no hydrogen 3.973 N/A CYS 62.A SG SER 63.A O no hydrogen 3.655 N/A SER 63.A N THR 48.A O no hydrogen 2.990 N/A SER 63.A OG GLU 46.A O no hydrogen 2.634 N/A THR 64.A N PRO 22.A O no hydrogen 2.982 N/A THR 64.A OG1 PRO 22.A O no hydrogen 3.349 N/A THR 64.A OG1 GLY 65.A O no hydrogen 2.804 N/A GLY 65.A N GLY 23.A O no hydrogen 2.933 N/A GLY 67.A N GLU 195.A OE2 no hydrogen 2.799 N/A SER 70.A OG THR 64.A O no hydrogen 2.592 N/A SER 70.A OG ILE 66.A O no hydrogen 3.344 N/A SER 70.A OG GLY 67.A O no hydrogen 3.343 N/A THR 71.A N GLY 67.A O no hydrogen 3.113 N/A THR 71.A OG1 GLY 67.A O no hydrogen 2.755 N/A SER 72.A N GLY 68.A O no hydrogen 2.757 N/A SER 72.A OG GLY 68.A O no hydrogen 3.469 N/A SER 72.A OG PRO 69.A O no hydrogen 2.770 N/A ILE 73.A N PRO 69.A O no hydrogen 3.346 N/A ALA 74.A N SER 70.A O no hydrogen 3.059 N/A VAL 75.A N THR 71.A O no hydrogen 2.920 N/A GLU 76.A N SER 72.A O no hydrogen 3.060 N/A GLU 77.A N ILE 73.A O no hydrogen 2.950 N/A LEU 78.A N ALA 74.A O no hydrogen 2.858 N/A ALA 79.A N VAL 75.A O no hydrogen 2.798 N/A GLN 80.A N GLU 76.A O no hydrogen 2.951 N/A GLN 80.A NE2 GLU 76.A OE2 no hydrogen 2.858 N/A LEU 81.A N GLU 77.A O no hydrogen 3.084 N/A GLY 82.A N LEU 78.A O no hydrogen 3.083 N/A GLY 82.A N ALA 79.A O no hydrogen 3.010 N/A ILE 83.A N LEU 78.A O no hydrogen 2.964 N/A ARG 84.A N GLN 17.A O no hydrogen 2.791 N/A ARG 84.A NH1 ALA 79.A O no hydrogen 2.870 N/A ARG 84.A NH1 ILE 83.A O no hydrogen 2.875 N/A THR 85.A N GLN 17.A O no hydrogen 3.102 N/A PHE 86.A N ARG 209.A O no hydrogen 2.735 N/A LEU 87.A N ALA 19.A O no hydrogen 2.898 N/A ARG 88.A N GLY 211.A O no hydrogen 2.880 N/A ARG 88.A NE GLU 193.A OE1 no hydrogen 3.035 N/A ARG 88.A NH2 GLU 193.A OE1 no hydrogen 3.115 N/A GLY 90.A N VAL 213.A O no hydrogen 2.952 N/A THR 92.A N GLY 215.A O no hydrogen 2.941 N/A THR 92.A OG1 TYR 192.A O no hydrogen 2.655 N/A ALA 94.A N VAL 218.A O no hydrogen 2.942 N/A ILE 95.A N MET 190.A O no hydrogen 2.889 N/A GLN 96.A NE2 GLN 185.A O no hydrogen 3.007 N/A GLN 96.A NE2 VAL 189.A O no hydrogen 2.831 N/A ILE 99.A N GLN 96.A O no hydrogen 3.111 N/A ASN 100.A N ASP 103.A OD1 no hydrogen 3.137 N/A GLY 102.A N VAL 216.A O no hydrogen 2.713 N/A ASP 103.A N ASN 100.A O no hydrogen 2.952 N/A VAL 104.A N THR 147.A O no hydrogen 2.881 N/A LEU 105.A N ALA 214.A O no hydrogen 2.805 N/A VAL 106.A N HIS 149.A O no hydrogen 2.857 N/A THR 107.A N MET 212.A O no hydrogen 3.071 N/A THR 107.A OG1 THR 153.A OG1 no hydrogen 2.708 N/A THR 108.A N GLY 151.A O no hydrogen 2.892 N/A SER 110.A N ALA 127.A O no hydrogen 2.851 N/A SER 110.A OG SER 196.A OG no hydrogen 2.705 N/A VAL 111.A N THR 153.A O no hydrogen 2.787 N/A ARG 112.A NE SER 117.A OG no hydrogen 2.811 N/A ARG 112.A NH1 PRO 122.A O no hydrogen 2.864 N/A ARG 112.A NH1 PHE 125.A O no hydrogen 2.787 N/A ARG 112.A NH2 SER 117.A OG no hydrogen 2.982 N/A ARG 112.A NH2 ALA 121.A O no hydrogen 2.798 N/A LEU 113.A N VAL 111.A O no hydrogen 3.076 N/A LEU 113.A N SER 155.A O no hydrogen 2.888 N/A GLY 115.A N ASP 157.A OD1 no hydrogen 2.809 N/A SER 117.A N ASP 114.A OD1 no hydrogen 2.846 N/A SER 117.A OG ASP 114.A OD1 no hydrogen 3.134 N/A SER 117.A OG ASP 114.A OD2 no hydrogen 2.643 N/A LEU 118.A N GLY 115.A O no hydrogen 3.144 N/A HIS 119.A N ALA 116.A O no hydrogen 2.829 N/A PHE 120.A N SER 117.A O no hydrogen 2.949 N/A ALA 121.A N SER 117.A O no hydrogen 3.094 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.820 N/A PHE 125.A N PRO 122.A O no hydrogen 2.969 N/A ALA 129.A N THR 108.A O no hydrogen 2.852 N/A ASP 130.A N ALA 210.A O no hydrogen 2.868 N/A CYS 133.A N ASP 130.A OD1 no hydrogen 2.865 N/A CYS 133.A SG ASP 130.A OD1 no hydrogen 3.457 N/A THR 134.A N ASP 130.A O no hydrogen 3.012 N/A THR 134.A OG1 ASP 130.A O no hydrogen 2.919 N/A THR 135.A N PHE 131.A O no hydrogen 2.871 N/A THR 135.A OG1 PHE 131.A O no hydrogen 2.804 N/A ALA 136.A N ALA 132.A O no hydrogen 2.894 N/A LEU 137.A N CYS 133.A O no hydrogen 2.941 N/A VAL 138.A N THR 134.A O no hydrogen 2.936 N/A GLU 139.A N THR 135.A O no hydrogen 2.900 N/A ALA 140.A N ALA 136.A O no hydrogen 2.900 N/A ALA 141.A N LEU 137.A O no hydrogen 2.918 N/A LYS 142.A N VAL 138.A O no hydrogen 3.197 N/A SER 143.A N GLU 139.A O no hydrogen 2.974 N/A SER 143.A OG GLU 139.A O no hydrogen 3.261 N/A ILE 144.A N ALA 140.A O no hydrogen 2.912 N/A GLY 145.A N ALA 141.A O no hydrogen 2.885 N/A ALA 146.A N ALA 141.A O no hydrogen 2.992 N/A THR 148.A OG1 ALA 146.A O no hydrogen 3.453 N/A HIS 149.A N VAL 104.A O no hydrogen 2.953 N/A HIS 149.A NE2 ASP 103.A OD1 no hydrogen 2.569 N/A GLY 151.A N VAL 106.A O no hydrogen 3.058 N/A THR 153.A N ALA 109.A O no hydrogen 3.169 N/A THR 153.A OG1 THR 107.A OG1 no hydrogen 2.708 N/A THR 153.A OG1 ASN 191.A OD1 no hydrogen 2.634 N/A ALA 154.A N ASN 191.A O no hydrogen 2.806 N/A SER 155.A N VAL 111.A O no hydrogen 3.005 N/A SER 155.A OG GLU 193.A OE2 no hydrogen 2.767 N/A SER 156.A N GLU 193.A O no hydrogen 2.856 N/A SER 156.A OG THR 158.A O no hydrogen 2.715 N/A ASP 157.A N LEU 113.A O no hydrogen 2.981 N/A THR 158.A N SER 156.A OG no hydrogen 3.007 N/A GLY 162.A N THR 158.A OG1 no hydrogen 2.771 N/A GLN 163.A N TYR 160.A O no hydrogen 3.061 N/A GLN 163.A NE2 THR 158.A O no hydrogen 3.374 N/A GLU 164.A N PRO 161.A O no hydrogen 2.887 N/A ARG 165.A N TYR 160.A O no hydrogen 2.941 N/A ARG 165.A NH1 PHE 159.A O no hydrogen 2.745 N/A ARG 165.A NH1 GLN 163.A OE1 no hydrogen 2.720 N/A TYR 166.A OH GLU 164.A OE1 no hydrogen 2.736 N/A THR 168.A N TYR 166.A O no hydrogen 2.862 N/A GLY 171.A N THR 168.A OG1 no hydrogen 2.953 N/A ARG 172.A N SER 170.A OG no hydrogen 3.183 N/A PHE 177.A N VAL 174.A O no hydrogen 2.858 N/A LYS 178.A N VAL 174.A O no hydrogen 3.109 N/A LYS 178.A N ARG 175.A O no hydrogen 3.186 N/A LYS 178.A NZ VAL 173.A O no hydrogen 2.585 N/A GLY 179.A N GLU 164.A OE1 no hydrogen 2.695 N/A SER 180.A N PHE 177.A O no hydrogen 3.010 N/A SER 180.A OG PHE 177.A O no hydrogen 2.644 N/A MET 181.A N GLU 164.A OE2 no hydrogen 2.890 N/A GLU 183.A N GLY 179.A O no hydrogen 3.376 N/A TRP 184.A N SER 180.A O no hydrogen 2.938 N/A GLN 185.A N MET 181.A O no hydrogen 2.901 N/A GLN 185.A NE2 ILE 95.A O no hydrogen 2.856 N/A ALA 186.A N GLU 182.A O no hydrogen 3.005 N/A MET 187.A N GLU 183.A O no hydrogen 3.040 N/A GLY 188.A N GLN 185.A O no hydrogen 2.958 N/A VAL 189.A N TRP 184.A O no hydrogen 2.942 N/A MET 190.A N VAL 152.A O no hydrogen 2.805 N/A ASN 191.A ND2 THR 92.A OG1 no hydrogen 3.039 N/A TYR 192.A N GLY 93.A O no hydrogen 3.399 N/A GLU 193.A N ALA 154.A O no hydrogen 3.025 N/A GLU 195.A N GLU 193.A OE1 no hydrogen 2.973 N/A SER 196.A N GLU 193.A OE1 no hydrogen 2.989 N/A SER 196.A N GLU 193.A OE2 no hydrogen 3.165 N/A SER 196.A OG SER 110.A OG no hydrogen 2.705 N/A SER 196.A OG GLU 193.A OE2 no hydrogen 2.619 N/A ALA 197.A N SER 155.A OG no hydrogen 2.896 N/A THR 198.A OG1 ASP 114.A OD1 no hydrogen 2.710 N/A LEU 199.A N GLU 195.A O no hydrogen 3.021 N/A LEU 200.A N SER 196.A O no hydrogen 2.747 N/A THR 201.A N ALA 197.A O no hydrogen 3.063 N/A THR 201.A OG1 ALA 197.A O no hydrogen 2.753 N/A MET 202.A N THR 198.A O no hydrogen 2.905 N/A CYS 203.A N LEU 199.A O no hydrogen 3.061 N/A CYS 203.A SG LEU 199.A O no hydrogen 3.369 N/A ALA 204.A N LEU 200.A O no hydrogen 2.885 N/A SER 205.A N THR 201.A O no hydrogen 3.037 N/A SER 205.A OG THR 201.A O no hydrogen 2.834 N/A GLN 206.A N CYS 203.A O no hydrogen 3.060 N/A GLN 206.A NE2 MET 202.A O no hydrogen 2.905 N/A LEU 208.A N CYS 203.A O no hydrogen 3.029 N/A ARG 209.A N ARG 84.A O no hydrogen 2.909 N/A ARG 209.A NE THR 85.A OG1 no hydrogen 2.924 N/A ARG 209.A NH2 THR 85.A OG1 no hydrogen 2.974 N/A ARG 209.A NH2 LEU 249.A O no hydrogen 3.147 N/A GLY 211.A N PHE 86.A O no hydrogen 2.898 N/A VAL 213.A N ARG 88.A O no hydrogen 2.985 N/A ALA 214.A N LEU 105.A O no hydrogen 2.904 N/A GLY 215.A N GLY 90.A O no hydrogen 2.967 N/A VAL 216.A N ASP 103.A O no hydrogen 2.864 N/A ILE 217.A N THR 92.A O no hydrogen 3.141 N/A ASN 219.A ND2 GLN 96.A O no hydrogen 2.876 N/A ASN 219.A ND2 ILE 99.A O no hydrogen 2.706 N/A ARG 220.A N ALA 94.A O no hydrogen 2.881 N/A ARG 220.A NH1 GLN 163.A O no hydrogen 2.864 N/A ARG 220.A NH2 GLN 163.A O no hydrogen 3.028 N/A ARG 220.A NH2 GLU 164.A O no hydrogen 3.238 N/A THR 221.A N ASN 219.A OD1 no hydrogen 2.692 N/A THR 221.A OG1 ASN 219.A OD1 no hydrogen 2.647 N/A GLN 222.A N ASN 219.A O no hydrogen 3.212 N/A GLN 222.A NE2 PRO 97.A O no hydrogen 3.617 N/A GLU 229.A N ASN 227.A OD1 no hydrogen 3.248 N/A GLU 235.A N MET 231.A O no hydrogen 2.681 N/A SER 236.A N LYS 232.A O no hydrogen 2.805 N/A SER 236.A OG LYS 232.A O no hydrogen 2.702 N/A HIS 237.A N GLN 233.A O no hydrogen 3.182 N/A ALA 238.A N THR 234.A O no hydrogen 2.999 N/A VAL 239.A N GLU 235.A O no hydrogen 2.912 N/A LYS 240.A N SER 236.A O no hydrogen 2.953 N/A ILE 241.A N HIS 237.A O no hydrogen 3.086 N/A VAL 242.A N ALA 238.A O no hydrogen 2.938 N/A VAL 243.A N VAL 239.A O no hydrogen 3.170 N/A GLU 244.A N LYS 240.A O no hydrogen 3.008 N/A ALA 245.A N ILE 241.A O no hydrogen 2.827 N/A ALA 246.A N VAL 242.A O no hydrogen 2.975 N/A ARG 247.A N VAL 243.A O no hydrogen 3.173 N/A ARG 247.A NE ASP 55.A OD1 no hydrogen 2.968 N/A ARG 247.A NH1 GLU 244.A OE1 no hydrogen 3.054 N/A ARG 247.A NH2 ASP 55.A OD1 no hydrogen 3.534 N/A ARG 247.A NH2 ASP 55.A OD2 no hydrogen 3.183 N/A ARG 248.A N ALA 245.A O no hydrogen 2.913 N/A ARG 248.A NE GLU 244.A O no hydrogen 3.493 N/A ARG 248.A NH1 GLU 139.A OE2 no hydrogen 3.399 N/A ARG 248.A NH2 GLU 244.A OE2 no hydrogen 2.867 N/A LEU 249.A N ALA 246.A O no hydrogen 2.957 N/A