Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wkm_L.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 3.A N SER 26.A OG no hydrogen 2.861 N/A THR 5.A N ARG 24.A O no hydrogen 2.648 N/A THR 5.A OG1 ARG 24.A O no hydrogen 3.560 N/A GLN 6.A NE2 TYR 90.A O no hydrogen 2.494 N/A GLN 6.A NE2 THR 106.A OG1 no hydrogen 3.054 N/A SER 7.A N SER 22.A O no hydrogen 2.895 N/A LEU 11.A N LYS 107.A O no hydrogen 3.079 N/A VAL 13.A N GLU 109.A O no hydrogen 2.860 N/A LEU 15.A N LYS 111.A O no hydrogen 2.995 N/A GLY 16.A N VAL 82.A O.A no hydrogen 3.081 N/A GLY 16.A N VAL 82.A O.B no hydrogen 3.034 N/A GLN 17.A N SER 14.A O no hydrogen 2.894 N/A ARG 18.A NE ASP 80.A OD1 no hydrogen 2.888 N/A ARG 18.A NH2 ASP 80.A OD1 no hydrogen 3.291 N/A ALA 19.A N ILE 79.A O no hydrogen 2.737 N/A ILE 21.A N LEU 77.A O no hydrogen 2.933 N/A SER 22.A N SER 7.A O no hydrogen 2.638 N/A SER 22.A OG SER 7.A O no hydrogen 3.077 N/A CYS 23.A N PHE 75.A O no hydrogen 2.716 N/A ARG 24.A N THR 5.A O no hydrogen 2.709 N/A ARG 24.A NE THR 73.A O no hydrogen 3.231 N/A ALA 25.A N THR 73.A O no hydrogen 2.929 N/A SER 26.A N VAL 3.A O no hydrogen 2.780 N/A VAL 29.A N ARG 72.A O no hydrogen 3.068 N/A SER 31.A N ASP 34.A O no hydrogen 2.865 N/A SER 31.A OG ASP 30.A O no hydrogen 2.749 N/A SER 31.A OG ASN 96.A OD1 no hydrogen 2.698 N/A ASP 34.A N SER 31.A O no hydrogen 3.244 N/A SER 35.A OG ASP 30.A OD2 no hydrogen 2.690 N/A PHE 36.A N VAL 29.A O no hydrogen 2.750 N/A HIS 38.A N GLN 93.A O no hydrogen 2.690 N/A HIS 38.A NE2 ASN 95.A OD1 no hydrogen 2.820 N/A TRP 39.A N ILE 52.A O no hydrogen 2.850 N/A TYR 40.A N TYR 91.A O no hydrogen 2.783 N/A GLN 41.A N LYS 49.A O no hydrogen 2.843 N/A GLN 41.A NE2 TYR 90.A OH no hydrogen 3.014 N/A GLN 42.A N THR 89.A O no hydrogen 2.702 N/A GLN 42.A NE2 GLN 46.A O no hydrogen 2.885 N/A LYS 43.A NZ GLN 41.A OE1 no hydrogen 3.076 N/A LYS 43.A NZ ASP 85.A O no hydrogen 3.338 N/A LYS 43.A NZ ASP 85.A OD1 no hydrogen 3.176 N/A LYS 43.A NZ ASP 85.A OD2 no hydrogen 3.418 N/A GLN 46.A N LYS 43.A O no hydrogen 3.139 N/A LYS 49.A N GLN 41.A O no hydrogen 2.883 N/A LYS 49.A NZ LEU 50.A O no hydrogen 3.033 N/A LEU 51.A N TRP 39.A O no hydrogen 2.870 N/A ILE 52.A N TRP 39.A O no hydrogen 3.420 N/A TYR 53.A N ASN 57.A O no hydrogen 2.989 N/A LEU 54.A N HIS 38.A ND1 no hydrogen 2.977 N/A ALA 55.A N MET 37.A O.A no hydrogen 2.821 N/A ALA 55.A N MET 37.A O.B no hydrogen 2.822 N/A SER 56.A N LEU 54.A O no hydrogen 2.757 N/A ASN 57.A N TYR 53.A O no hydrogen 3.100 N/A GLU 59.A N LEU 51.A O no hydrogen 3.007 N/A SER 60.A N GLU 59.A OE2 no hydrogen 2.878 N/A VAL 62.A N GLU 59.A O no hydrogen 2.981 N/A ARG 65.A NH1 PRO 81.A O no hydrogen 2.942 N/A ARG 65.A NH1 ASP 86.A OD1 no hydrogen 3.374 N/A ARG 65.A NH1 ASP 86.A OD2 no hydrogen 2.514 N/A ARG 65.A NH2 ASP 86.A OD1 no hydrogen 2.747 N/A PHE 66.A N PRO 63.A O no hydrogen 2.986 N/A SER 67.A N THR 78.A O no hydrogen 2.970 N/A SER 69.A N THR 76.A O no hydrogen 2.979 N/A ARG 72.A N ASP 30.A OD2 no hydrogen 2.933 N/A ARG 72.A NE SER 28.A OG no hydrogen 3.137 N/A ASP 74.A N SER 71.A O no hydrogen 3.285 N/A PHE 75.A N CYS 23.A O no hydrogen 2.985 N/A THR 76.A N SER 69.A O no hydrogen 2.937 N/A LEU 77.A N ILE 21.A O no hydrogen 2.760 N/A THR 78.A N SER 67.A O no hydrogen 2.776 N/A ILE 79.A N ALA 19.A O no hydrogen 2.764 N/A ASP 80.A N ARG 65.A O no hydrogen 2.935 N/A VAL 82.A N.A GLN 17.A O no hydrogen 2.927 N/A VAL 82.A N.B GLN 17.A O no hydrogen 2.937 N/A GLU 83.A N ASP 86.A OD2 no hydrogen 2.866 N/A ASP 86.A N GLU 83.A O no hydrogen 2.946 N/A ALA 87.A N ALA 84.A O no hydrogen 3.397 N/A THR 89.A N GLN 42.A O no hydrogen 3.087 N/A TYR 90.A N THR 106.A O no hydrogen 2.747 N/A TYR 90.A OH ASP 86.A O no hydrogen 2.667 N/A TYR 91.A N TYR 40.A O no hydrogen 3.003 N/A CYS 92.A N GLN 6.A OE1 no hydrogen 3.208 N/A CYS 92.A SG GLN 6.A OE1 no hydrogen 3.616 N/A GLN 93.A N HIS 38.A O no hydrogen 2.809 N/A GLN 94.A N THR 101.A O no hydrogen 2.990 N/A GLN 94.A NE2 GLU 97.A O no hydrogen 3.347 N/A GLN 94.A NE2 PRO 99.A O no hydrogen 3.186 N/A GLN 94.A NE2 THR 101.A OG1 no hydrogen 2.980 N/A ASN 95.A N PHE 36.A O no hydrogen 3.050 N/A ASN 96.A N GLN 94.A OE1 no hydrogen 2.812 N/A ASN 96.A ND2 SER 28.A O no hydrogen 3.696 N/A THR 101.A N GLN 94.A O no hydrogen 3.301 N/A THR 101.A OG1 ILE 2.A O no hydrogen 2.764 N/A GLY 103.A N CYS 92.A O no hydrogen 2.896 N/A GLY 105.A N GLN 6.A OE1 no hydrogen 3.129 N/A THR 106.A N TYR 90.A O no hydrogen 2.850 N/A THR 106.A OG1 PRO 8.A O no hydrogen 2.697 N/A LYS 107.A N VAL 9.A O no hydrogen 3.005 N/A LEU 108.A N ALA 88.A O no hydrogen 2.775 N/A GLU 109.A N LEU 11.A O no hydrogen 2.728 N/A ILE 110.A N GLN 170.A OE1 no hydrogen 2.914 N/A LYS 111.A N VAL 13.A O no hydrogen 2.652 N/A ARG 112.A NE ASP 174.A O no hydrogen 2.988 N/A ARG 112.A NH1 ALA 113.A O no hydrogen 3.090 N/A ARG 112.A NH2 ASP 174.A O no hydrogen 3.187 N/A ALA 115.A N TYR 144.A O no hydrogen 2.933 N/A THR 118.A N ASN 141.A O no hydrogen 2.960 N/A SER 120.A N PHE 139.A O no hydrogen 2.928 N/A PHE 122.A N VAL 137.A O no hydrogen 2.783 N/A GLN 128.A N SER 125.A O no hydrogen 2.880 N/A GLN 128.A N SER 125.A OG no hydrogen 2.925 N/A GLN 128.A NE2 SER 135.A OG no hydrogen 2.825 N/A LEU 129.A N SER 125.A O no hydrogen 2.902 N/A THR 130.A N SER 126.A O no hydrogen 2.784 N/A THR 130.A OG1 SER 126.A O no hydrogen 3.259 N/A SER 131.A OG GLU 127.A O no hydrogen 3.230 N/A SER 131.A OG GLN 128.A O no hydrogen 2.876 N/A GLY 132.A N LEU 129.A O no hydrogen 3.299 N/A GLY 133.A N GLN 128.A O no hydrogen 3.234 N/A SER 135.A N GLN 128.A OE1 no hydrogen 2.676 N/A VAL 136.A N LEU 183.A O no hydrogen 2.788 N/A VAL 137.A N PHE 122.A O no hydrogen 3.144 N/A CYS 138.A N SER 181.A O no hydrogen 2.781 N/A CYS 138.A SG SER 120.A O no hydrogen 3.485 N/A PHE 139.A N SER 120.A O no hydrogen 2.799 N/A LEU 140.A N MET 179.A O no hydrogen 2.672 N/A ASN 141.A N THR 118.A O no hydrogen 2.967 N/A ASN 142.A N SER 178.A OG no hydrogen 2.938 N/A ASN 142.A ND2 ASP 174.A OD2 no hydrogen 2.843 N/A PHE 143.A N TYR 177.A O no hydrogen 2.834 N/A TYR 144.A N ALA 115.A O no hydrogen 2.940 N/A TYR 144.A OH GLU 109.A OE2 no hydrogen 2.748 N/A ASN 149.A N.A THR 201.A O no hydrogen 3.000 N/A ASN 149.A N.B THR 201.A O no hydrogen 3.034 N/A LYS 151.A N GLU 199.A O no hydrogen 2.821 N/A LYS 151.A NZ GLU 158.A OE2 no hydrogen 3.307 N/A TRP 152.A NE1 SER 181.A OG no hydrogen 2.884 N/A LYS 153.A N THR 197.A O no hydrogen 2.982 N/A LYS 153.A NZ GLU 199.A OE2 no hydrogen 2.999 N/A ILE 154.A N SER 157.A O no hydrogen 2.828 N/A ASP 155.A N SER 195.A O no hydrogen 2.823 N/A SER 157.A N ILE 154.A O no hydrogen 3.145 N/A SER 157.A OG ILE 154.A O no hydrogen 2.970 N/A ARG 159.A N TRP 152.A O no hydrogen 3.069 N/A ARG 159.A NH1 ASN 161.A O no hydrogen 3.400 N/A ARG 159.A NH2 GLU 189.A OE2 no hydrogen 2.874 N/A VAL 163.A N GLN 160.A O no hydrogen 3.414 N/A LEU 164.A N THR 182.A O no hydrogen 2.877 N/A SER 166.A N SER 180.A O no hydrogen 2.987 N/A TRP 167.A NE1 LYS 146.A O no hydrogen 3.008 N/A THR 168.A N SER 178.A O no hydrogen 2.983 N/A THR 168.A OG1 ASP 169.A O no hydrogen 3.310 N/A THR 168.A OG1 SER 178.A O no hydrogen 3.383 N/A GLN 170.A NE2 ILE 110.A O no hydrogen 2.618 N/A GLN 170.A NE2 SER 175.A O no hydrogen 2.882 N/A ASP 171.A N THR 176.A O no hydrogen 2.846 N/A LYS 173.A N ASP 171.A OD2 no hydrogen 3.008 N/A ASP 174.A N ASP 171.A OD2 no hydrogen 2.880 N/A SER 175.A N ASP 171.A O no hydrogen 3.033 N/A THR 176.A N ASP 174.A OD1 no hydrogen 3.103 N/A THR 176.A OG1 ASP 174.A OD1 no hydrogen 2.509 N/A THR 176.A OG1 ASP 174.A OD2 no hydrogen 3.326 N/A TYR 177.A N PHE 143.A O no hydrogen 2.811 N/A SER 178.A N THR 168.A OG1 no hydrogen 3.026 N/A MET 179.A N LEU 140.A O no hydrogen 2.683 N/A SER 180.A N SER 166.A O no hydrogen 2.956 N/A SER 181.A N CYS 138.A O no hydrogen 2.765 N/A SER 181.A OG ASN 165.A OD1 no hydrogen 2.905 N/A THR 182.A N LEU 164.A O no hydrogen 2.859 N/A LEU 183.A N VAL 136.A O no hydrogen 2.786 N/A THR 184.A N GLY 162.A O no hydrogen 2.893 N/A LEU 185.A N ALA 134.A O no hydrogen 3.198 N/A LYS 187.A NZ LEU 129.A O no hydrogen 2.926 N/A GLU 189.A N THR 186.A OG1 no hydrogen 3.349 N/A TYR 190.A N THR 186.A O no hydrogen 3.213 N/A GLU 191.A N LYS 187.A O no hydrogen 3.158 N/A ARG 192.A N GLU 189.A O no hydrogen 3.185 N/A HIS 193.A N TYR 190.A O no hydrogen 3.354 N/A HIS 193.A ND1 ASP 155.A OD2 no hydrogen 2.778 N/A ASN 194.A N ASP 155.A OD1 no hydrogen 3.202 N/A SER 195.A N ASP 155.A OD1 no hydrogen 2.653 N/A TYR 196.A N PHE 213.A O no hydrogen 3.061 N/A TYR 196.A OH TYR 190.A O no hydrogen 2.686 N/A THR 197.A N LYS 153.A O no hydrogen 2.825 N/A THR 197.A OG1 SER 212.A OG no hydrogen 2.433 N/A CYS 198.A N LYS 211.A O no hydrogen 2.786 N/A GLU 199.A N LYS 151.A O no hydrogen 2.906 N/A ALA 200.A N ILE 209.A O no hydrogen 2.833 N/A THR 201.A N ASN 149.A O.A no hydrogen 2.920 N/A THR 201.A N ASN 149.A O.B no hydrogen 2.700 N/A HIS 202.A ND1 THR 204.A OG1 no hydrogen 2.864 N/A HIS 202.A NE2 PRO 145.A O no hydrogen 3.139 N/A LYS 203.A NZ ASP 114.A OD2 no hydrogen 3.428 N/A THR 204.A N HIS 202.A ND1 no hydrogen 3.288 N/A THR 204.A OG1 HIS 202.A ND1 no hydrogen 2.864 N/A SER 205.A N HIS 202.A O no hydrogen 2.778 N/A SER 205.A OG SER 207.A O no hydrogen 2.900 N/A SER 205.A OG SER 207.A OG no hydrogen 3.301 N/A SER 207.A OG SER 205.A OG no hydrogen 3.301 N/A ILE 209.A N ALA 200.A O no hydrogen 3.008 N/A LYS 211.A N CYS 198.A O no hydrogen 2.789 N/A SER 212.A OG TYR 196.A O no hydrogen 3.279 N/A PHE 213.A N TYR 196.A O no hydrogen 3.257 N/A ARG 215.A N ASN 194.A O no hydrogen 2.888 N/A ARG 215.A NE HIS 193.A O no hydrogen 3.052 N/A