Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d8i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 9.A N LEU 62.A O no hydrogen 3.294 N/A LEU 11.A N VAL 64.A O no hydrogen 2.791 N/A ASP 12.A N SER 15.A OG no hydrogen 3.145 N/A ALA 13.A N ASN 72.A OD1 no hydrogen 2.900 N/A SER 15.A N ASP 12.A O no hydrogen 3.132 N/A SER 15.A N ASP 12.A OD1 no hydrogen 2.916 N/A SER 15.A OG ASP 12.A OD1 no hydrogen 3.375 N/A VAL 16.A N ASP 12.A O no hydrogen 2.930 N/A THR 19.A N VAL 16.A O no hydrogen 3.049 N/A THR 19.A OG1 SER 15.A O no hydrogen 2.448 N/A VAL 20.A N VAL 16.A O no hydrogen 2.883 N/A LEU 21.A N ARG 17.A O no hydrogen 3.168 N/A GLY 22.A N THR 94.A O no hydrogen 2.774 N/A SER 23.A OG THR 19.A O no hydrogen 3.523 N/A SER 23.A OG SER 25.A O.A no hydrogen 3.203 N/A SER 23.A OG SER 25.A O.B no hydrogen 3.182 N/A SER 25.A N.A SER 23.A OG no hydrogen 3.081 N/A SER 25.A N.B SER 23.A OG no hydrogen 3.078 N/A SER 25.A OG.A PRO 58.A O no hydrogen 2.653 N/A SER 25.A OG.B ALA 26.A O no hydrogen 2.907 N/A SER 25.A OG.B PRO 58.A O no hydrogen 3.268 N/A ALA 26.A N ALA 59.A O no hydrogen 3.064 N/A TRP 27.A N PHE 90.A O no hydrogen 2.625 N/A TRP 27.A NE1 SER 23.A OG no hydrogen 3.031 N/A ALA 28.A N ASN 61.A O no hydrogen 3.002 N/A VAL 29.A N ARG 88.A O no hydrogen 2.805 N/A GLU 30.A N.A ALA 63.A O no hydrogen 2.826 N/A GLU 30.A N.B ALA 63.A O no hydrogen 2.817 N/A PHE 31.A N THR 86.A O no hydrogen 2.639 N/A PHE 32.A N LEU 65.A O no hydrogen 3.221 N/A SER 34.A N ASP 66.A OD1 no hydrogen 3.216 N/A SER 34.A OG ASP 66.A OD2 no hydrogen 2.383 N/A CYS 36.A N ALA 33.A O no hydrogen 2.741 N/A CYS 39.A SG ALA 33.A O no hydrogen 3.923 N/A ILE 40.A N CYS 36.A O no hydrogen 3.488 N/A ALA 41.A N HIS 38.A O no hydrogen 2.682 N/A PHE 42.A N CYS 39.A O no hydrogen 2.842 N/A ALA 43.A N CYS 39.A O no hydrogen 3.158 N/A TRP 46.A N PHE 42.A O no hydrogen 3.118 N/A LYS 47.A N ALA 43.A O no hydrogen 2.812 N/A LYS 47.A NZ LEU 1.A O no hydrogen 2.544 N/A GLU 48.A N PRO 44.A O no hydrogen 2.925 N/A LEU 49.A N THR 45.A O no hydrogen 2.793 N/A ALA 50.A N TRP 46.A O no hydrogen 2.930 N/A ASN 51.A N LYS 47.A O no hydrogen 3.055 N/A ASP 52.A N GLU 48.A O no hydrogen 2.782 N/A VAL 53.A N LEU 49.A O no hydrogen 2.854 N/A LYS 54.A NZ ASN 51.A O no hydrogen 2.998 N/A LYS 54.A NZ ASN 51.A OD1 no hydrogen 3.261 N/A TRP 56.A N VAL 53.A O no hydrogen 3.117 N/A TRP 56.A NE1 ASP 172.A OD1 no hydrogen 2.759 N/A ARG 57.A N LYS 54.A O no hydrogen 3.503 N/A ARG 57.A NE LYS 54.A O no hydrogen 2.648 N/A ALA 59.A N TRP 56.A O no hydrogen 2.963 N/A LEU 60.A N TRP 56.A O no hydrogen 2.993 N/A ASN 61.A N ALA 26.A O no hydrogen 2.967 N/A ASN 61.A ND2 SER 25.A OG.B no hydrogen 2.664 N/A ALA 63.A N ALA 28.A O no hydrogen 2.935 N/A VAL 64.A N THR 9.A O no hydrogen 3.163 N/A LEU 65.A N GLU 30.A O.A no hydrogen 3.042 N/A LEU 65.A N GLU 30.A O.B no hydrogen 2.993 N/A CYS 67.A N PHE 32.A O no hydrogen 2.805 N/A CYS 67.A SG LEU 65.A O no hydrogen 3.866 N/A ALA 68.A N ASP 66.A OD1 no hydrogen 2.938 N/A THR 71.A N GLU 69.A OE2 no hydrogen 3.153 N/A THR 71.A OG1 GLU 69.A OE2 no hydrogen 3.547 N/A ASN 72.A N GLU 69.A OE1 no hydrogen 3.060 N/A ASN 72.A ND2 ASP 66.A O no hydrogen 2.861 N/A SER 73.A N GLU 69.A O no hydrogen 2.553 N/A ALA 74.A N GLU 70.A O no hydrogen 3.305 N/A ALA 74.A N THR 71.A O no hydrogen 3.263 N/A VAL 75.A N THR 71.A O no hydrogen 3.388 N/A CYS 76.A N ASN 72.A O no hydrogen 2.969 N/A CYS 76.A SG ASN 72.A O no hydrogen 3.486 N/A ARG 77.A N ALA 74.A O no hydrogen 3.194 N/A GLU 78.A N ALA 74.A O no hydrogen 3.330 N/A PHE 79.A N VAL 75.A O no hydrogen 3.081 N/A ASN 80.A N ARG 77.A O no hydrogen 3.191 N/A ILE 81.A N CYS 76.A O no hydrogen 3.189 N/A THR 86.A N PHE 31.A O no hydrogen 2.852 N/A THR 86.A OG1 GLY 83.A O no hydrogen 2.641 N/A ARG 88.A N VAL 29.A O no hydrogen 2.872 N/A ARG 88.A NE THR 101.A OG1 no hydrogen 2.514 N/A ARG 88.A NH1 PHE 79.A O no hydrogen 2.783 N/A ARG 88.A NH1 SER 98.A O no hydrogen 2.913 N/A ARG 88.A NH2 ASN 80.A O no hydrogen 3.008 N/A PHE 89.A N ALA 100.A O no hydrogen 2.490 N/A PHE 90.A N TRP 27.A O no hydrogen 2.624 N/A GLN 91.A N GLN 91.A OE1 no hydrogen 2.667 N/A PHE 93.A N SER 23.A O no hydrogen 2.509 N/A THR 94.A OG1 GLN 91.A O no hydrogen 2.595 N/A ALA 100.A N PHE 89.A O no hydrogen 2.823 N/A LEU 102.A N VAL 87.A O no hydrogen 2.816 N/A ALA 107.A N GLY 104.A O no hydrogen 2.999 N/A THR 111.A OG1 ASN 108.A OD1 no hydrogen 2.863 N/A LEU 112.A N ASN 108.A O no hydrogen 3.014 N/A ARG 113.A N VAL 109.A O no hydrogen 2.852 N/A ARG 113.A NE ASP 52.A OD2 no hydrogen 2.716 N/A ARG 113.A NH1 GLU 168.A OE2 no hydrogen 3.163 N/A ARG 113.A NH2 ASP 52.A OD2 no hydrogen 2.626 N/A MET 114.A N GLN 110.A O no hydrogen 3.030 N/A ARG 115.A N THR 111.A O no hydrogen 2.906 N/A ARG 115.A NH1 GLY 104.A O no hydrogen 3.377 N/A LEU 116.A N LEU 112.A O no hydrogen 2.797 N/A ILE 117.A N ARG 113.A O no hydrogen 2.993 N/A ASP 118.A N MET 114.A O no hydrogen 2.965 N/A ALA 119.A N ARG 115.A O no hydrogen 2.991 N/A LEU 120.A N LEU 116.A O no hydrogen 3.020 N/A GLU 121.A N ILE 117.A O no hydrogen 3.087 N/A SER 122.A N ASP 118.A O no hydrogen 2.820 N/A SER 122.A N ALA 119.A O no hydrogen 3.139 N/A SER 122.A OG ASP 118.A O no hydrogen 3.012 N/A SER 122.A OG ALA 119.A O no hydrogen 2.724 N/A SER 122.A OG HIS 123.A ND1 no hydrogen 2.981 N/A HIS 123.A N LEU 120.A O no hydrogen 3.209 N/A HIS 123.A ND1 ALA 119.A O no hydrogen 2.961 N/A ARG 124.A NH1 GLU 135.A OE2 no hydrogen 3.079 N/A ARG 124.A NH2 GLU 135.A OE2 no hydrogen 2.636 N/A THR 126.A OG1 ALA 92.A O no hydrogen 2.904 N/A THR 126.A OG1 THR 126.A O no hydrogen 2.487 N/A TRP 127.A NE1 CYS 131.A O no hydrogen 2.984 N/A CYS 131.A N PRO 128.A O no hydrogen 2.999 N/A CYS 131.A SG PRO 132.A O no hydrogen 3.469 N/A ALA 137.A N ARG 183.A O no hydrogen 2.798 N/A LYS 138.A N ASP 141.A OD2 no hydrogen 2.687 N/A ASP 141.A N LYS 138.A O no hydrogen 2.934 N/A ILE 142.A N LEU 139.A O no hydrogen 3.092 N/A ASP 143.A N LEU 139.A O no hydrogen 2.925 N/A PHE 145.A N ILE 142.A O no hydrogen 3.109 N/A THR 147.A N GLY 144.A O no hydrogen 3.095 N/A THR 147.A OG1 GLY 144.A O no hydrogen 2.558 N/A ARG 148.A N PHE 145.A O no hydrogen 3.017 N/A ARG 148.A NH1 ASP 143.A O no hydrogen 2.838 N/A ARG 148.A NH2 ASP 143.A O no hydrogen 3.267 N/A ASN 149.A N PHE 145.A O no hydrogen 2.820 N/A ALA 151.A N ASN 149.A OD1 no hydrogen 2.885 N/A ASP 152.A N ALA 178.A O no hydrogen 2.887 N/A TYR 153.A N ALA 178.A O no hydrogen 3.093 N/A TYR 153.A OH PRO 233.A O no hydrogen 2.868 N/A LEU 154.A N LEU 206.A O no hydrogen 2.979 N/A ALA 155.A N ALA 180.A O no hydrogen 2.811 N/A LEU 156.A N TYR 204.A O no hydrogen 2.731 N/A VAL 157.A N ARG 182.A O no hydrogen 2.896 N/A PHE 158.A N SER 202.A O no hydrogen 2.880 N/A GLU 159.A N VAL 184.A O no hydrogen 2.856 N/A SER 163.A N ARG 160.A O no hydrogen 3.114 N/A SER 163.A OG GLU 159.A OE1 no hydrogen 2.604 N/A TYR 164.A OH ASP 118.A OD1 no hydrogen 2.687 N/A TYR 164.A OH ASP 118.A OD2 no hydrogen 3.275 N/A LEU 165.A N SER 163.A OG no hydrogen 3.157 N/A GLY 166.A N GLU 159.A OE1 no hydrogen 2.789 N/A ARG 167.A NH1 GLU 121.A OE1 no hydrogen 2.754 N/A ARG 167.A NH2 SER 163.A O no hydrogen 2.818 N/A GLU 168.A N TYR 164.A O no hydrogen 2.860 N/A VAL 169.A N LEU 165.A O no hydrogen 3.078 N/A THR 170.A N GLY 166.A O no hydrogen 2.992 N/A THR 170.A OG1 GLY 166.A O no hydrogen 2.758 N/A LEU 171.A N ARG 167.A O no hydrogen 3.044 N/A ASP 172.A N GLU 168.A O no hydrogen 2.800 N/A LEU 173.A N VAL 169.A O no hydrogen 3.030 N/A SER 174.A N LEU 171.A O no hydrogen 3.144 N/A SER 174.A OG ASP 55.A O no hydrogen 3.477 N/A SER 174.A OG LEU 171.A O no hydrogen 2.654 N/A GLN 175.A NE2 ARG 57.A O no hydrogen 2.895 N/A TYR 176.A N LEU 173.A O no hydrogen 2.963 N/A VAL 179.A N TYR 176.A O no hydrogen 3.254 N/A ALA 180.A N TYR 153.A O no hydrogen 2.824 N/A ARG 182.A N ALA 155.A O no hydrogen 2.902 N/A ARG 182.A NH2 GLU 135.A O no hydrogen 2.928 N/A ARG 183.A NE GLU 159.A OE2 no hydrogen 3.247 N/A VAL 184.A N VAL 157.A O no hydrogen 2.828 N/A ASN 186.A N GLU 159.A O no hydrogen 2.959 N/A THR 187.A OG1 GLU 161.A OE2 no hydrogen 3.368 N/A GLU 188.A N LEU 185.A O no hydrogen 2.978 N/A SER 189.A N THR 187.A O no hydrogen 2.965 N/A SER 189.A OG ASP 190.A OD1 no hydrogen 3.190 N/A VAL 192.A N GLU 188.A O no hydrogen 2.992 N/A ASN 193.A N SER 189.A O no hydrogen 2.728 N/A LYS 194.A N ASP 190.A O no hydrogen 2.864 N/A PHE 195.A N LEU 191.A O no hydrogen 3.013 N/A GLY 196.A N ASN 193.A O no hydrogen 2.878 N/A VAL 197.A N VAL 192.A O no hydrogen 2.893 N/A SER 202.A N PHE 158.A O no hydrogen 3.159 N/A SER 202.A OG ASP 199.A O no hydrogen 2.777 N/A CYS 203.A SG LEU 156.A O no hydrogen 3.789 N/A TYR 204.A N LEU 156.A O no hydrogen 2.875 N/A LEU 205.A N SER 213.A O no hydrogen 2.847 N/A LEU 206.A N LEU 154.A O no hydrogen 2.841 N/A LEU 207.A N SER 211.A O no hydrogen 2.947 N/A ARG 208.A N ASP 152.A O no hydrogen 3.235 N/A ARG 208.A NH2 ASN 149.A O no hydrogen 3.038 N/A ARG 208.A NH2 ALA 151.A O no hydrogen 2.875 N/A GLY 210.A N LEU 207.A O no hydrogen 2.964 N/A SER 211.A N ASN 209.A OD1 no hydrogen 2.982 N/A SER 213.A N LEU 205.A O no hydrogen 3.105 N/A ARG 214.A NH1 ASP 199.A OD2 no hydrogen 3.224 N/A ARG 214.A NH2 ASP 199.A OD2 no hydrogen 3.470 N/A ARG 214.A NH2 GLU 220.A OE2 no hydrogen 3.438 N/A VAL 215.A N CYS 203.A O no hydrogen 2.778 N/A SER 221.A N VAL 219.A O no hydrogen 2.765 N/A SER 221.A OG SER 223.A OG no hydrogen 3.049 N/A ARG 222.A NE ASP 172.A OD2 no hydrogen 2.712 N/A ARG 222.A NH1 ASP 52.A OD1 no hydrogen 3.192 N/A ARG 222.A NH1 ASP 52.A OD2 no hydrogen 2.974 N/A ARG 222.A NH2 ASP 52.A O no hydrogen 3.082 N/A ARG 222.A NH2 ASP 172.A OD1 no hydrogen 2.909 N/A ARG 222.A NH2 ASP 172.A OD2 no hydrogen 3.460 N/A SER 223.A OG SER 221.A OG no hydrogen 3.049 N/A TYR 225.A N SER 221.A O no hydrogen 2.869 N/A TYR 225.A OH GLU 220.A OE1 no hydrogen 2.549 N/A THR 226.A N ARG 222.A O no hydrogen 2.747 N/A THR 226.A OG1 ASP 172.A OD2 no hydrogen 2.821 N/A THR 226.A OG1 ARG 222.A O no hydrogen 3.150 N/A SER 227.A N SER 223.A O no hydrogen 2.952 N/A SER 227.A OG SER 223.A O no hydrogen 2.899 N/A SER 227.A OG PHE 224.A O no hydrogen 3.240 N/A TYR 228.A N PHE 224.A O no hydrogen 3.021 N/A LEU 229.A N TYR 225.A O no hydrogen 2.916 N/A ARG 230.A N.A THR 226.A O no hydrogen 3.034 N/A ARG 230.A N.B THR 226.A O no hydrogen 3.030 N/A ARG 230.A NH2.A ASP 172.A O no hydrogen 2.808 N/A GLY 231.A N SER 227.A O no hydrogen 3.334 N/A GLY 231.A N TYR 228.A O no hydrogen 3.220 N/A LEU 232.A N LEU 229.A O no hydrogen 3.180 N/A LEU 235.A N LEU 232.A O no hydrogen 3.443 N/A