Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5fck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ILE 126.A O no hydrogen 2.869 N/A ILE 1.A N ASP 178.A OD1 no hydrogen 3.471 N/A ILE 1.A N ASP 178.A OD2 no hydrogen 2.645 N/A LEU 2.A N ASP 173.A O no hydrogen 2.720 N/A ARG 5.A N HIS 139.A O no hydrogen 3.003 N/A ALA 7.A N LEU 137.A O no hydrogen 2.755 N/A ALA 11.A N GLU 8.A O no hydrogen 3.322 N/A ARG 12.A NE ASP 120.A OD2 no hydrogen 2.767 N/A ARG 12.A NH2 ASP 120.A OD1 no hydrogen 3.391 N/A ARG 12.A NH2 ASP 120.A OD2 no hydrogen 3.529 N/A MET 15.A N ARG 12.A O no hydrogen 2.963 N/A ALA 16.A N GLY 28.A O no hydrogen 2.882 N/A SER 17.A N LEU 50.A O no hydrogen 2.937 N/A SER 17.A OG HIS 24.A ND1 no hydrogen 2.662 N/A VAL 18.A N CYS 26.A O no hydrogen 2.806 N/A GLN 19.A N GLN 48.A O no hydrogen 2.847 N/A GLN 19.A NE2 SER 17.A OG no hydrogen 2.907 N/A LEU 20.A N ALA 23.A O no hydrogen 2.936 N/A ASN 21.A N LYS 46.A O no hydrogen 2.858 N/A ALA 23.A N LEU 20.A O no hydrogen 3.003 N/A HIS 24.A ND1 SER 17.A OG no hydrogen 2.662 N/A HIS 24.A NE2 GLY 177.A O no hydrogen 2.734 N/A LEU 25.A N VAL 18.A O no hydrogen 2.693 N/A CYS 26.A N VAL 18.A O no hydrogen 3.078 N/A CYS 26.A SG LEU 25.A O no hydrogen 3.302 N/A CYS 26.A SG SER 179.A OG no hydrogen 3.382 N/A GLY 28.A N ALA 16.A O no hydrogen 2.893 N/A VAL 29.A N LEU 37.A O no hydrogen 2.865 N/A LEU 30.A N TYR 14.A O no hydrogen 2.827 N/A VAL 31.A N TRP 35.A O no hydrogen 3.007 N/A ALA 32.A N TRP 35.A O no hydrogen 3.258 N/A GLN 34.A NE2 LEU 91.A O no hydrogen 2.940 N/A GLN 34.A NE2 SER 92.A O no hydrogen 3.642 N/A TRP 35.A N ALA 32.A O no hydrogen 3.311 N/A VAL 36.A N LEU 89.A O no hydrogen 2.886 N/A LEU 37.A N VAL 29.A O no hydrogen 2.876 N/A SER 38.A N LEU 87.A O no hydrogen 2.634 N/A SER 38.A OG GLY 27.A O no hydrogen 2.631 N/A HIS 41.A N SER 195.A OG no hydrogen 3.062 N/A HIS 41.A ND1 SER 195.A OG no hydrogen 3.156 N/A HIS 41.A NE2 GLN 78.A O no hydrogen 2.939 N/A CYS 42.A N ALA 39.A O no hydrogen 3.080 N/A CYS 42.A SG SER 38.A OG no hydrogen 3.689 N/A CYS 42.A SG ALA 39.A O no hydrogen 3.301 N/A CYS 42.A SG SER 179.A O no hydrogen 4.034 N/A LYS 46.A N ASN 21.A OD1 no hydrogen 3.383 N/A LYS 46.A NZ ASP 67.A OD1 no hydrogen 2.474 N/A GLN 48.A N GLN 19.A O no hydrogen 2.863 N/A GLN 48.A NE2 ASP 67.A OD1 no hydrogen 3.198 N/A VAL 49.A N TYR 66.A O no hydrogen 2.770 N/A LEU 50.A N SER 17.A O no hydrogen 2.812 N/A LEU 51.A N ARG 64.A O no hydrogen 2.977 N/A HIS 54.A N GLU 60.A OE1 no hydrogen 2.859 N/A HIS 54.A NE2 GLU 6.A OE2 no hydrogen 2.791 N/A SER 55.A N GLU 60.A OE2 no hydrogen 2.879 N/A SER 55.A OG ASP 135.A OD1 no hydrogen 3.117 N/A SER 55.A OG ASP 135.A OD2 no hydrogen 2.438 N/A LEU 56.A N ASP 135.A O no hydrogen 2.860 N/A SER 57.A N SER 55.A OG no hydrogen 3.232 N/A SER 57.A N ASP 135.A OD1 no hydrogen 3.152 N/A SER 57.A OG SER 55.A OG no hydrogen 3.348 N/A SER 57.A OG ASP 135.A OD1 no hydrogen 2.600 N/A GLN 58.A N SER 55.A OG no hydrogen 2.909 N/A SER 62.A OG GLY 52.A O no hydrogen 2.740 N/A LYS 63.A N GLU 60.A O no hydrogen 2.836 N/A LYS 63.A NZ SER 55.A O no hydrogen 2.864 N/A LYS 63.A NZ LEU 56.A O no hydrogen 2.636 N/A LYS 63.A NZ GLN 58.A O no hydrogen 2.747 N/A ARG 64.A N LEU 51.A O no hydrogen 2.960 N/A ARG 64.A NH2 GLU 93.A OE2 no hydrogen 2.372 N/A TYR 66.A N VAL 49.A O no hydrogen 2.706 N/A LEU 69.A N GLN 90.A O no hydrogen 2.823 N/A ARG 70.A N GLN 90.A O no hydrogen 3.519 N/A ARG 70.A NE GLN 90.A OE1 no hydrogen 2.866 N/A ARG 70.A NH1 SER 225.A OG no hydrogen 3.272 N/A ARG 70.A NH2 GLN 90.A OE1 no hydrogen 3.290 N/A ARG 70.A NH2 SER 225.A OG no hydrogen 2.611 N/A VAL 72.A N LEU 88.A O no hydrogen 2.757 N/A HIS 74.A N LEU 86.A O no hydrogen 2.896 N/A ASP 76.A N HIS 74.A ND1 no hydrogen 3.118 N/A SER 77.A N HIS 74.A O no hydrogen 3.130 N/A SER 77.A OG HIS 74.A O no hydrogen 2.784 N/A THR 81.A N GLN 78.A O no hydrogen 3.326 N/A THR 81.A OG1 GLN 78.A O no hydrogen 3.442 N/A ASP 83.A N THR 81.A OG1 no hydrogen 3.407 N/A HIS 84.A ND1 TYR 215.A OH no hydrogen 2.487 N/A LEU 86.A N HIS 84.A O no hydrogen 2.962 N/A LEU 87.A N SER 38.A O no hydrogen 2.902 N/A LEU 88.A N VAL 72.A O no hydrogen 2.978 N/A LEU 89.A N VAL 36.A O no hydrogen 2.730 N/A GLN 90.A N ARG 70.A O no hydrogen 2.781 N/A LEU 91.A N GLN 34.A O no hydrogen 2.821 N/A SER 92.A N ASP 67.A O no hydrogen 2.727 N/A SER 92.A OG.A ASP 67.A O no hydrogen 3.550 N/A ALA 95.A N GLU 33.A O no hydrogen 2.869 N/A THR 96.A N TYR 66.A OH no hydrogen 2.959 N/A GLY 98.A N VAL 101.A O no hydrogen 2.938 N/A VAL 101.A N GLY 98.A O no hydrogen 3.111 N/A ARG 102.A N PRO 13.A O no hydrogen 3.003 N/A LEU 104.A N LEU 30.A O no hydrogen 2.828 N/A GLN 107.A N LEU 189.A O no hydrogen 2.861 N/A GLN 107.A NE2 GLU 190.A OE2 no hydrogen 3.245 N/A ARG 108.A NH1.A ASP 220.A OD1 no hydrogen 3.022 N/A ARG 108.A NH1.A ASP 220.A OD2 no hydrogen 2.345 N/A ARG 108.A NH2.A ASP 220.A OD1 no hydrogen 2.941 N/A ARG 108.A NH2.B TRP 106A.A O no hydrogen 2.687 N/A VAL 109.A N GLN 107.A OE1 no hydrogen 2.997 N/A ARG 111.A N VAL 109.A O no hydrogen 2.887 N/A GLY 116.A N VAL 144.A O no hydrogen 2.848 N/A THR 117.A N ALA 114.A O no hydrogen 3.194 N/A THR 117.A OG1 ALA 114.A O no hydrogen 2.740 N/A CYS 119.A N LEU 142.A O no hydrogen 2.787 N/A CYS 119.A SG THR 117.A O no hydrogen 3.625 N/A ASP 120.A N VAL 184.A O no hydrogen 2.747 N/A VAL 121.A N VAL 140.A O no hydrogen 2.898 N/A GLY 123.A N GLN 138.A O no hydrogen 2.981 N/A TRP 124.A NE1 HIS 54.A O no hydrogen 2.785 N/A GLY 125.A N ASP 178.A OD1 no hydrogen 2.802 N/A ILE 126.A N LYS 176.A O no hydrogen 2.799 N/A VAL 127.A N ARG 132.A O no hydrogen 2.822 N/A GLY 131.A N ASN 128.A O no hydrogen 3.104 N/A ARG 132.A N ASN 128.A OD1 no hydrogen 2.882 N/A SER 136.A OG.B ASP 135.A OD2 no hydrogen 3.512 N/A LEU 137.A N HIS 54.A O no hydrogen 2.973 N/A GLN 138.A N GLY 123.A O no hydrogen 3.020 N/A GLN 138.A NE2 SER 136.A O no hydrogen 3.216 N/A HIS 139.A N ARG 5.A O no hydrogen 2.889 N/A HIS 139.A ND1 ASP 120.A OD1 no hydrogen 2.558 N/A VAL 140.A N VAL 121.A O no hydrogen 2.757 N/A LEU 142.A N CYS 119.A O no hydrogen 2.736 N/A VAL 144.A N THR 117.A O no hydrogen 2.817 N/A LEU 145.A N CYS 166.A O no hydrogen 3.002 N/A ARG 147.A NE THR 161.A O no hydrogen 3.108 N/A ARG 147.A NE LEU 164.A O no hydrogen 3.201 N/A ARG 147.A NH1 ASP 112A.A OD1 no hydrogen 3.431 N/A ARG 147.A NH1 ASP 112A.A OD2 no hydrogen 2.783 N/A ARG 147.A NH2 LEU 164.A O no hydrogen 2.802 N/A ARG 147.A NH2 ASP 112A.A OD1 no hydrogen 2.862 N/A THR 149.A N ASP 146.A OD2 no hydrogen 2.705 N/A THR 149.A OG1 ASP 146.A OD1 no hydrogen 2.657 N/A THR 149.A OG1 ASP 146.A OD2 no hydrogen 3.025 N/A CYS 150.A N ASP 146.A O no hydrogen 3.021 N/A ASN 151.A N ARG 147.A O no hydrogen 2.906 N/A ASN 151.A N ALA 148.A O no hydrogen 3.270 N/A ASN 151.A ND2 ILE 160.A O no hydrogen 2.848 N/A ARG 152.A N THR 149.A O no hydrogen 3.021 N/A HIS 155.A N ARG 152.A O no hydrogen 2.593 N/A HIS 155.A ND1 THR 154B.A OG1 no hydrogen 2.878 N/A HIS 156.A N CYS 150.A O no hydrogen 2.824 N/A HIS 156.A NE2 PRO 206.A O no hydrogen 2.746 N/A ASP 157.A N ARG 152.A O no hydrogen 3.000 N/A GLY 158.A N ASN 151.A O no hydrogen 2.944 N/A ALA 159.A N HIS 156.A O no hydrogen 2.957 N/A ILE 160.A N ASN 151.A OD1 no hydrogen 2.655 N/A ARG 163.A N THR 161.A OG1 no hydrogen 3.176 N/A ARG 163.A NE SER 214.A OG no hydrogen 3.038 N/A ARG 163.A NH2 SER 214.A O no hydrogen 2.825 N/A LEU 164.A N THR 161.A O no hydrogen 3.063 N/A MET 165.A N TYR 209.A O no hydrogen 2.805 N/A ALA 167.A N GLY 207.A O no hydrogen 3.071 N/A GLU 168.A N PRO 143.A O no hydrogen 2.946 N/A SER 169.A OG ASN 202.A O no hydrogen 2.765 N/A ARG 171.A N GLY 201.A O no hydrogen 2.910 N/A ARG 172.A N ASN 170.A O no hydrogen 2.798 N/A ASP 173.A N LEU 2.A O no hydrogen 3.029 N/A SER 174.A OG ASP 173.A OD1 no hydrogen 3.541 N/A SER 174.A OG TYR 209.A OH no hydrogen 2.826 N/A CYS 175.A N ASP 178.A OD2 no hydrogen 2.855 N/A ASP 178.A N CYS 175.A O no hydrogen 2.767 N/A GLY 180.A N VAL 193.A O no hydrogen 2.914 N/A GLY 181.A N ASP 178.A O no hydrogen 3.097 N/A LEU 183.A N GLY 191.A O no hydrogen 2.764 N/A VAL 184.A N ASP 120.A O no hydrogen 2.868 N/A CYS 185.A N VAL 188.A O no hydrogen 3.051 N/A VAL 188.A N CYS 185.A O no hydrogen 3.116 N/A LEU 189.A N PRO 105.A O no hydrogen 2.840 N/A GLU 190.A N LEU 183.A O no hydrogen 2.953 N/A GLY 191.A N LEU 183.A O no hydrogen 3.167 N/A VAL 192.A N THR 210.A O no hydrogen 2.993 N/A VAL 193.A N GLY 181.A O no hydrogen 2.858 N/A THR 194.A N ILE 208.A O no hydrogen 3.111 N/A THR 194.A OG1 ILE 208.A O no hydrogen 2.887 N/A SER 195.A N ASP 85.A OD2 no hydrogen 2.698 N/A SER 195.A OG HIS 41.A ND1 no hydrogen 3.156 N/A SER 195.A OG ASP 85.A OD1 no hydrogen 2.833 N/A SER 195.A OG ASP 85.A OD2 no hydrogen 3.030 N/A ARG 198.A NH1 ASP 173.A OD1 no hydrogen 3.487 N/A ARG 198.A NH1 ASP 173.A OD2 no hydrogen 3.138 N/A ARG 198.A NH1 SER 174.A O no hydrogen 2.981 N/A ARG 198.A NH2 ASP 173.A OD1 no hydrogen 3.473 N/A ARG 198.A NH2 ASP 173.A OD2 no hydrogen 2.764 N/A ARG 198.A NH2 LYS 205.A O no hydrogen 3.091 N/A CYS 200.A SG SER 174.A O no hydrogen 3.806 N/A CYS 200.A SG ARG 198.A O no hydrogen 3.691 N/A GLY 201.A N ASP 173.A OD2 no hydrogen 2.964 N/A LYS 205.A N ASN 202.A O no hydrogen 2.846 N/A LYS 205.A NZ HIS 155.A O no hydrogen 2.980 N/A TYR 209.A N MET 165.A O no hydrogen 2.789 N/A TYR 209.A OH SER 174.A OG no hydrogen 2.826 N/A THR 210.A N VAL 192.A O no hydrogen 2.780 N/A ARG 211.A N ARG 163.A O no hydrogen 2.884 N/A ARG 211.A NH1 ASP 110.A OD1 no hydrogen 2.712 N/A ARG 211.A NH1 GLU 162.A O no hydrogen 2.788 N/A ARG 211.A NH2 ASP 110.A OD1 no hydrogen 2.929 N/A ARG 211.A NH2 ARG 111.A O no hydrogen 3.418 N/A VAL 212.A N GLU 190.A O no hydrogen 3.156 N/A SER 214.A N ARG 211.A O no hydrogen 3.036 N/A TYR 215.A N VAL 212.A O no hydrogen 2.936 N/A TYR 215.A OH HIS 84.A ND1 no hydrogen 2.487 N/A ALA 216.A N ALA 213.A O no hydrogen 3.361 N/A ILE 219.A N TYR 215.A O no hydrogen 2.887 N/A ASP 220.A N ALA 216.A O no hydrogen 2.719 N/A SER 221.A N ALA 217.A O no hydrogen 2.866 N/A VAL 222.A N TRP 218.A O no hydrogen 2.969 N/A LEU 223.A N ILE 219.A O no hydrogen 2.768 N/A ALA 224.A N ASP 220.A O no hydrogen 3.193 N/A SER 225.A N VAL 222.A O no hydrogen 3.260 N/A SER 225.A OG VAL 222.A O no hydrogen 2.700 N/A LYS 204A.A N ASN 202.A OD1 no hydrogen 2.821 N/A THR 154B.A OG1 HIS 155.A ND1 no hydrogen 2.878 N/A