Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mdc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N ASP 55.A OD2 no hydrogen 3.441 N/A SER 1.A OG ASP 55.A OD1 no hydrogen 2.696 N/A THR 3.A N VAL 53.A O no hydrogen 2.838 N/A THR 3.A OG1 GLU 27.A OE1 no hydrogen 3.078 N/A LEU 4.A N GLU 27.A O no hydrogen 2.879 N/A TYR 5.A N VAL 51.A O no hydrogen 2.859 N/A HIS 6.A N SER 29.A O no hydrogen 3.017 N/A HIS 7.A N SER 12.A OG no hydrogen 3.295 N/A HIS 7.A NE2 GLN 119.A OE1 no hydrogen 2.977 N/A SER 9.A OG SER 12.A OG no hydrogen 2.805 N/A SER 12.A N SER 9.A OG no hydrogen 3.061 N/A SER 12.A OG SER 9.A OG no hydrogen 2.805 N/A ARG 13.A N SER 9.A O no hydrogen 2.989 N/A ARG 13.A NE PRO 8.A O no hydrogen 2.713 N/A ARG 13.A NH1 SER 173.A OG no hydrogen 2.797 N/A ARG 13.A NH1 TYR 219.A OH no hydrogen 2.871 N/A ARG 13.A NH2 GLU 208.A OE2 no hydrogen 3.127 N/A ARG 13.A NH2 TYR 219.A OH no hydrogen 3.313 N/A PHE 14.A N PRO 10.A O no hydrogen 2.832 N/A VAL 15.A N ALA 11.A O no hydrogen 3.194 N/A ARG 16.A N SER 12.A O no hydrogen 3.025 N/A ARG 16.A NH1 GLU 208.A OE1 no hydrogen 2.817 N/A ARG 16.A NH1 GLU 208.A OE2 no hydrogen 3.092 N/A ARG 16.A NH2 GLU 208.A OE1 no hydrogen 2.704 N/A LEU 17.A N ARG 13.A O no hydrogen 2.948 N/A ILE 18.A N PHE 14.A O no hydrogen 3.112 N/A LEU 19.A N VAL 15.A O no hydrogen 2.914 N/A SER 20.A N ARG 16.A O no hydrogen 2.959 N/A SER 20.A OG ARG 16.A O no hydrogen 3.146 N/A GLU 21.A N LEU 17.A O no hydrogen 2.933 N/A TYR 22.A N ILE 18.A O no hydrogen 2.964 N/A GLY 23.A N SER 20.A O no hydrogen 3.057 N/A TYR 24.A N LEU 19.A O no hydrogen 2.858 N/A TYR 24.A OH SER 73.A OG no hydrogen 2.458 N/A GLU 27.A N PRO 2.A O no hydrogen 2.941 N/A SER 29.A N LEU 4.A O no hydrogen 2.895 N/A GLU 31.A N HIS 6.A O no hydrogen 2.821 N/A GLU 35.A N GLN 32.A O no hydrogen 3.042 N/A ASN 36.A N PRO 33.A O no hydrogen 2.942 N/A ARG 37.A NE GLU 31.A OE1 no hydrogen 3.389 N/A ARG 37.A NE GLU 31.A OE2 no hydrogen 3.055 N/A ARG 37.A NH2 GLU 31.A OE1 no hydrogen 2.819 N/A LEU 41.A N ARG 37.A O no hydrogen 2.931 N/A THR 42.A N ARG 38.A O no hydrogen 2.927 N/A THR 42.A OG1 ARG 38.A O no hydrogen 2.956 N/A LEU 43.A N ASP 39.A O no hydrogen 3.248 N/A ASN 44.A N PHE 40.A O no hydrogen 2.882 N/A ASN 44.A ND2 THR 48.A O no hydrogen 2.893 N/A ASN 44.A ND2 THR 48.A OG1 no hydrogen 2.924 N/A ALA 46.A N ASN 44.A OD1 no hydrogen 3.127 N/A GLY 47.A N ASN 44.A O no hydrogen 2.920 N/A VAL 51.A N TYR 5.A O no hydrogen 3.005 N/A TYR 52.A N LEU 59.A O no hydrogen 2.869 N/A VAL 53.A N THR 3.A O no hydrogen 2.855 N/A SER 56.A N ASP 54.A OD1 no hydrogen 3.013 N/A SER 56.A OG ASP 54.A OD1 no hydrogen 2.583 N/A ARG 57.A NE SER 56.A OG no hydrogen 3.164 N/A LEU 59.A N TYR 52.A O no hydrogen 2.968 N/A CYS 60.A SG LEU 43.A O no hydrogen 3.789 N/A CYS 60.A SG ALA 58.A O no hydrogen 3.838 N/A GLY 61.A N PRO 50.A O no hydrogen 2.930 N/A ILE 65.A N GLY 61.A O no hydrogen 3.069 N/A SER 66.A N ALA 62.A O no hydrogen 2.925 N/A SER 66.A OG ALA 62.A O no hydrogen 2.980 N/A SER 66.A OG THR 63.A O no hydrogen 2.995 N/A GLU 67.A N THR 63.A O no hydrogen 2.937 N/A TYR 68.A N ILE 64.A O no hydrogen 2.950 N/A LEU 69.A N ILE 65.A O no hydrogen 2.843 N/A ASP 70.A N SER 66.A O no hydrogen 3.092 N/A GLU 71.A N GLU 67.A O no hydrogen 2.990 N/A THR 72.A N TYR 68.A O no hydrogen 2.990 N/A THR 72.A OG1 TYR 68.A O no hydrogen 2.830 N/A SER 73.A OG TYR 24.A OH no hydrogen 2.458 N/A SER 73.A OG THR 72.A O no hydrogen 3.242 N/A GLY 74.A N LEU 69.A O no hydrogen 2.916 N/A ILE 75.A N ASP 70.A O no hydrogen 2.905 N/A ARG 79.A N LYS 76.A O no hydrogen 2.951 N/A ARG 80.A N ARG 77.A O no hydrogen 3.087 N/A ARG 80.A NE ASP 70.A OD1 no hydrogen 3.018 N/A ARG 80.A NH1 GLU 84.A OE1 no hydrogen 2.693 N/A ARG 80.A NH2 ASP 70.A OD1 no hydrogen 3.508 N/A ARG 80.A NH2 ASP 70.A OD2 no hydrogen 2.661 N/A LEU 81.A N TYR 22.A OH no hydrogen 2.851 N/A GLN 88.A N ASP 85.A OD2 no hydrogen 2.951 N/A GLN 88.A NE2 ALA 157.A O no hydrogen 3.038 N/A ARG 89.A N ASP 85.A O no hydrogen 2.865 N/A ARG 89.A NH1 ALA 83.A O.A no hydrogen 2.835 N/A ARG 89.A NH1 ALA 83.A O.B no hydrogen 2.824 N/A ALA 90.A N PRO 86.A O no hydrogen 2.905 N/A GLU 91.A N PHE 87.A O no hydrogen 3.052 N/A ILE 92.A N GLN 88.A O no hydrogen 2.965 N/A ARG 93.A N ARG 89.A O no hydrogen 2.959 N/A ARG 93.A NE GLU 67.A OE2 no hydrogen 2.817 N/A ARG 93.A NH2 GLU 67.A OE1 no hydrogen 2.874 N/A ARG 93.A NH2 GLU 67.A OE2 no hydrogen 3.468 N/A ARG 94.A N ALA 90.A O no hydrogen 2.842 N/A ARG 94.A NE GLU 91.A OE1 no hydrogen 2.885 N/A ARG 94.A NH1 TYR 145.A OH no hydrogen 2.873 N/A ARG 94.A NH2 GLU 91.A OE2 no hydrogen 2.821 N/A ARG 94.A NH2 TYR 145.A OH no hydrogen 3.009 N/A LEU 95.A N GLU 91.A O no hydrogen 3.099 N/A THR 96.A N ILE 92.A O no hydrogen 2.975 N/A THR 96.A OG1 ILE 92.A O no hydrogen 2.889 N/A GLU 97.A N ARG 93.A O no hydrogen 2.868 N/A TRP 98.A N ARG 94.A O no hydrogen 2.906 N/A PHE 99.A N LEU 95.A O no hydrogen 3.156 N/A LEU 100.A N THR 96.A O no hydrogen 2.948 N/A GLN 101.A N GLU 97.A O no hydrogen 2.822 N/A LYS 102.A N GLU 97.A O no hydrogen 3.107 N/A LYS 102.A NZ ASP 105.A OD1 no hydrogen 3.006 N/A LYS 102.A NZ ASP 105.A OD2 no hydrogen 3.129 N/A ALA 104.A N GLN 101.A O no hydrogen 3.003 N/A ASP 105.A N LYS 102.A O no hydrogen 2.950 N/A ARG 108.A N GLU 103.A O no hydrogen 2.830 N/A LEU 110.A N VAL 106.A O no hydrogen 3.165 N/A VAL 111.A N THR 107.A O no hydrogen 2.902 N/A ARG 112.A N ARG 108.A O no hydrogen 2.915 N/A GLU 113.A N PRO 109.A O no hydrogen 3.059 N/A ARG 114.A N LEU 110.A O no hydrogen 2.917 N/A ARG 114.A NH2 LEU 178.A O no hydrogen 2.951 N/A ARG 114.A NH2 GLU 180.A OE2 no hydrogen 2.740 N/A ILE 115.A N VAL 111.A O no hydrogen 2.703 N/A PHE 116.A N VAL 111.A O no hydrogen 3.046 N/A LYS 117.A N ARG 112.A O no hydrogen 2.905 N/A LYS 117.A NZ GLU 113.A OE1 no hydrogen 2.683 N/A LYS 117.A NZ GLU 113.A OE2 no hydrogen 3.547 N/A LYS 117.A NZ ALA 127.A O no hydrogen 3.332 N/A LEU 118.A N ILE 115.A O no hydrogen 3.036 N/A GLN 119.A N ILE 115.A O no hydrogen 3.259 N/A THR 120.A N GLN 123.A OE1 no hydrogen 2.904 N/A GLN 123.A N THR 120.A O no hydrogen 2.940 N/A GLN 123.A N THR 120.A OG1 no hydrogen 3.318 N/A GLY 124.A N PRO 121.A O no hydrogen 3.101 N/A GLY 125.A N THR 120.A O no hydrogen 2.897 N/A GLY 126.A N LYS 117.A O no hydrogen 3.145 N/A ASP 129.A N GLU 113.A OE1 no hydrogen 2.711 N/A ILE 132.A N ASP 129.A OD1 no hydrogen 2.920 N/A LEU 133.A N ASP 129.A O no hydrogen 3.048 N/A ARG 134.A N SER 130.A O no hydrogen 2.915 N/A THR 135.A N LYS 131.A O no hydrogen 3.023 N/A THR 135.A OG1 LYS 131.A O no hydrogen 3.082 N/A SER 136.A N ILE 132.A O no hydrogen 2.964 N/A SER 136.A OG ILE 132.A O no hydrogen 2.893 N/A ARG 137.A N LEU 133.A O no hydrogen 2.959 N/A ARG 137.A NE GLU 180.A OE1 no hydrogen 2.833 N/A ARG 137.A NH2 GLU 180.A OE1 no hydrogen 3.504 N/A ARG 137.A NH2 GLU 180.A OE2 no hydrogen 2.774 N/A SER 138.A N ARG 134.A O no hydrogen 2.956 N/A SER 138.A OG THR 135.A O no hydrogen 2.755 N/A ASN 139.A N SER 136.A O no hydrogen 3.207 N/A ASN 139.A ND2 ASP 105.A O no hydrogen 3.024 N/A ILE 140.A N ARG 137.A O no hydrogen 3.156 N/A HIS 143.A NE2 ASP 105.A OD2 no hydrogen 2.862 N/A TYR 145.A N GLN 142.A O no hydrogen 3.083 N/A LEU 146.A N HIS 143.A O no hydrogen 3.004 N/A TRP 148.A N LYS 144.A O no hydrogen 3.030 N/A LEU 149.A N TYR 145.A O no hydrogen 2.928 N/A ALA 150.A N LEU 146.A O no hydrogen 2.838 N/A GLY 151.A N SER 147.A O no hydrogen 2.932 N/A SER 152.A N LEU 149.A O no hydrogen 3.247 N/A SER 152.A OG TRP 148.A O no hydrogen 2.818 N/A SER 152.A OG LEU 149.A O no hydrogen 3.440 N/A TRP 155.A N GLY 158.A O no hydrogen 2.896 N/A LEU 156.A N ASP 165.A OD1 no hydrogen 2.953 N/A GLY 158.A N TRP 155.A O no hydrogen 3.116 N/A ARG 160.A NH2 LEU 82.A O.B no hydrogen 3.057 N/A SER 162.A N ASP 165.A OD2 no hydrogen 2.932 N/A SER 162.A OG ASP 165.A OD2 no hydrogen 3.550 N/A TYR 163.A N LEU 81.A O no hydrogen 2.963 N/A TYR 163.A OH SER 66.A O no hydrogen 2.693 N/A GLY 164.A N SER 162.A OG no hydrogen 3.073 N/A LEU 166.A N SER 162.A O no hydrogen 3.307 N/A ALA 167.A N TYR 163.A O no hydrogen 2.839 N/A ALA 168.A N GLY 164.A O no hydrogen 3.144 N/A ALA 169.A N ASP 165.A O no hydrogen 2.906 N/A ALA 170.A N LEU 166.A O no hydrogen 2.910 N/A ALA 171.A N ALA 167.A O no hydrogen 3.102 N/A ILE 172.A N ALA 168.A O no hydrogen 2.803 N/A SER 173.A N ALA 169.A O no hydrogen 2.859 N/A SER 173.A OG ALA 169.A O no hydrogen 3.441 N/A SER 173.A OG ALA 170.A O no hydrogen 2.753 N/A VAL 174.A N ALA 170.A O no hydrogen 3.410 N/A VAL 174.A N ALA 171.A O no hydrogen 3.203 N/A LEU 175.A N ALA 171.A O no hydrogen 3.244 N/A ASP 176.A N ILE 172.A O no hydrogen 2.751 N/A TYR 177.A N SER 173.A O no hydrogen 2.944 N/A TYR 177.A OH VAL 213.A O no hydrogen 2.663 N/A LEU 178.A N VAL 174.A O no hydrogen 3.258 N/A GLY 179.A N ASP 176.A O no hydrogen 2.873 N/A GLU 180.A N LEU 175.A O no hydrogen 2.970 N/A TRP 183.A NE1 ASP 176.A OD1 no hydrogen 2.838 N/A SER 184.A N ASP 182.A OD1 no hydrogen 3.067 N/A SER 184.A OG ASP 182.A OD1 no hydrogen 2.609 N/A SER 184.A OG ASP 182.A OD2 no hydrogen 3.557 N/A ASP 185.A N ASP 182.A O no hydrogen 3.377 N/A ALA 186.A N TRP 183.A O no hydrogen 3.012 N/A THR 188.A OG1.A SER 147.A O no hydrogen 3.190 N/A LYS 190.A N ALA 186.A O no hydrogen 2.954 N/A LYS 190.A NZ PHE 224.A O no hydrogen 3.027 N/A LYS 190.A NZ PHE 224.A OXT no hydrogen 2.745 N/A GLU 191.A N PRO 187.A O no hydrogen 3.153 N/A TRP 192.A N THR 188.A O no hydrogen 3.297 N/A TRP 192.A NE1 ASP 165.A OD1 no hydrogen 3.008 N/A TYR 193.A N ALA 189.A O no hydrogen 2.866 N/A GLN 194.A N LYS 190.A O no hydrogen 2.897 N/A ARG 195.A N GLU 191.A O no hydrogen 3.291 N/A ARG 195.A NE GLU 191.A OE1 no hydrogen 3.014 N/A ARG 195.A NE GLU 191.A OE2 no hydrogen 3.290 N/A ARG 195.A NH1 PRO 154.A O no hydrogen 2.881 N/A ARG 195.A NH2 PRO 154.A O no hydrogen 3.339 N/A ARG 195.A NH2 GLU 191.A OE2 no hydrogen 2.858 N/A LEU 196.A N TRP 192.A O no hydrogen 3.163 N/A LYS 197.A N TYR 193.A O no hydrogen 2.801 N/A LYS 197.A NZ HIS 218.A O no hydrogen 3.430 N/A LYS 197.A NZ TYR 219.A O no hydrogen 2.922 N/A LYS 197.A NZ ASP 221.A O no hydrogen 2.709 N/A SER 198.A N GLN 194.A O no hydrogen 3.268 N/A SER 198.A OG.A GLN 194.A O no hydrogen 2.742 N/A SER 198.A OG.B GLN 194.A O no hydrogen 3.162 N/A SER 198.A OG.B ARG 195.A O no hydrogen 2.991 N/A ARG 199.A N LEU 196.A O no hydrogen 3.065 N/A ARG 199.A NE GLU 21.A OE2 no hydrogen 2.948 N/A ARG 199.A NH2 GLU 21.A OE1 no hydrogen 2.908 N/A SER 201.A OG GLU 21.A OE2 no hydrogen 2.607 N/A PHE 202.A N ARG 199.A O no hydrogen 2.993 N/A ARG 203.A N PRO 200.A O no hydrogen 3.038 N/A LEU 206.A N PHE 202.A O no hydrogen 3.076 N/A ALA 207.A N ARG 203.A O no hydrogen 3.051 N/A GLU 208.A N LEU 205.A O no hydrogen 3.366 N/A ARG 209.A NH1 LEU 206.A O no hydrogen 2.871 N/A ARG 209.A NH1 GLU 208.A O no hydrogen 2.811 N/A VAL 210.A N TYR 177.A OH no hydrogen 2.870 N/A VAL 213.A N VAL 210.A O no hydrogen 3.149 N/A VAL 216.A N TYR 177.A O no hydrogen 3.060 N/A HIS 218.A NE2 ASP 176.A OD1 no hydrogen 2.769 N/A TYR 219.A N VAL 216.A O no hydrogen 3.011 N/A TYR 219.A OH LEU 205.A O no hydrogen 2.644 N/A ASP 221.A N HIS 218.A O no hydrogen 2.981 N/A