Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fj1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 2.A OH GLU 245.A OE2 no hydrogen 2.989 N/A GLY 5.A N GLU 245.A OE2 no hydrogen 3.459 N/A ARG 6.A NE ASP 8.A OD2 no hydrogen 2.796 N/A ARG 6.A NH1 ARG 31.A O no hydrogen 2.916 N/A ARG 6.A NH2 ASP 8.A OD1 no hydrogen 2.914 N/A LEU 7.A N LEU 32.A O no hydrogen 2.699 N/A LYS 10.A N LEU 7.A O no hydrogen 2.977 N/A VAL 11.A N ASP 89.A OD2 no hydrogen 2.793 N/A ALA 12.A N LYS 35.A O no hydrogen 2.748 N/A LEU 13.A N ILE 90.A O no hydrogen 2.758 N/A VAL 14.A N VAL 37.A O no hydrogen 3.134 N/A THR 15.A N VAL 92.A O no hydrogen 2.945 N/A THR 15.A OG1 SER 95.A OG no hydrogen 3.354 N/A GLY 16.A N ASN 39.A OD1 no hydrogen 3.057 N/A SER 17.A N ASN 39.A O no hydrogen 2.860 N/A SER 17.A OG VAL 14.A O no hydrogen 2.701 N/A SER 17.A OG ASN 39.A O no hydrogen 3.415 N/A ARG 19.A NE SER 43.A OG no hydrogen 3.242 N/A ARG 19.A NH1 ASP 194.A OD2 no hydrogen 3.010 N/A ALA 23.A N ARG 19.A O no hydrogen 3.337 N/A ALA 24.A N GLY 20.A O no hydrogen 3.362 N/A VAL 25.A N ILE 21.A O no hydrogen 2.923 N/A ALA 26.A N GLY 22.A O no hydrogen 2.909 N/A VAL 27.A N ALA 23.A O no hydrogen 3.011 N/A HIS 28.A N ALA 24.A O no hydrogen 2.973 N/A LEU 29.A N VAL 25.A O no hydrogen 2.880 N/A GLY 30.A N ALA 26.A O no hydrogen 3.120 N/A ARG 31.A N VAL 27.A O no hydrogen 2.810 N/A ARG 31.A NH1 HIS 28.A ND1 no hydrogen 3.136 N/A LEU 32.A N HIS 28.A O no hydrogen 2.908 N/A GLY 33.A N GLY 30.A O no hydrogen 2.989 N/A ALA 34.A N LEU 29.A O no hydrogen 2.935 N/A LYS 35.A N LYS 10.A O no hydrogen 2.900 N/A VAL 36.A N ASP 60.A O no hydrogen 2.962 N/A VAL 37.A N ALA 12.A O no hydrogen 2.775 N/A VAL 38.A N ILE 62.A O no hydrogen 2.752 N/A ASN 39.A N VAL 14.A O no hydrogen 3.215 N/A ASN 39.A ND2 ILE 64.A O no hydrogen 3.159 N/A ASN 39.A ND2 ALA 66.A O no hydrogen 3.210 N/A TYR 40.A N ILE 64.A O no hydrogen 3.338 N/A THR 44.A N ASN 42.A O no hydrogen 2.925 N/A ALA 47.A N SER 43.A O no hydrogen 2.942 N/A GLU 48.A N THR 44.A O no hydrogen 3.015 N/A LYS 49.A N LYS 45.A O no hydrogen 2.990 N/A LYS 49.A NZ ASP 46.A OD1 no hydrogen 3.272 N/A VAL 50.A N ASP 46.A O no hydrogen 3.006 N/A VAL 51.A N ALA 47.A O no hydrogen 2.968 N/A SER 52.A N GLU 48.A O no hydrogen 2.898 N/A GLU 53.A N LYS 49.A O no hydrogen 2.937 N/A ILE 54.A N VAL 50.A O no hydrogen 2.987 N/A LYS 55.A N VAL 51.A O no hydrogen 3.007 N/A ALA 56.A N SER 52.A O no hydrogen 2.888 N/A LEU 57.A N GLU 53.A O no hydrogen 3.026 N/A GLY 58.A N LYS 55.A O no hydrogen 3.017 N/A SER 59.A N ILE 54.A O no hydrogen 3.134 N/A SER 59.A OG ALA 34.A O no hydrogen 2.559 N/A ASP 60.A N SER 59.A OG no hydrogen 2.706 N/A ALA 61.A N ASP 60.A OD1 no hydrogen 2.905 N/A ILE 62.A N VAL 36.A O no hydrogen 3.105 N/A ILE 64.A N VAL 38.A O no hydrogen 2.883 N/A ALA 66.A N TYR 40.A O no hydrogen 2.933 N/A ASP 67.A N GLU 73.A OE1 no hydrogen 2.762 N/A ARG 69.A N ASP 67.A OD1 no hydrogen 3.080 N/A ARG 69.A NE ARG 113.A O no hydrogen 3.347 N/A ARG 69.A NE SER 116.A OG no hydrogen 2.842 N/A ARG 69.A NH2 ARG 113.A O no hydrogen 2.840 N/A GLN 70.A N ASP 67.A O no hydrogen 2.905 N/A GLU 73.A N GLN 70.A O no hydrogen 2.895 N/A ILE 74.A N GLN 70.A O no hydrogen 3.100 N/A VAL 75.A N VAL 71.A O no hydrogen 3.013 N/A LYS 76.A N PRO 72.A O no hydrogen 3.142 N/A LEU 77.A N GLU 73.A O no hydrogen 2.917 N/A PHE 78.A N ILE 74.A O no hydrogen 3.102 N/A ASP 79.A N VAL 75.A O no hydrogen 2.924 N/A GLN 80.A N LYS 76.A O no hydrogen 2.837 N/A ALA 81.A N LEU 77.A O no hydrogen 2.921 N/A VAL 82.A N PHE 78.A O no hydrogen 3.096 N/A ALA 83.A N ASP 79.A O no hydrogen 2.934 N/A HIS 84.A N GLN 80.A O no hydrogen 2.998 N/A PHE 85.A N ALA 81.A O no hydrogen 3.109 N/A GLY 86.A N VAL 82.A O no hydrogen 2.722 N/A ASP 89.A N VAL 11.A O no hydrogen 2.899 N/A ILE 90.A N VAL 11.A O no hydrogen 3.020 N/A ALA 91.A N ARG 138.A O no hydrogen 2.935 N/A VAL 92.A N LEU 13.A O no hydrogen 2.725 N/A SER 93.A N VAL 140.A O no hydrogen 2.730 N/A SER 93.A OG GLN 122.A OE1 no hydrogen 2.826 N/A ASN 94.A N THR 15.A OG1 no hydrogen 2.795 N/A ASN 94.A ND2 THR 15.A O no hydrogen 3.097 N/A SER 95.A N THR 15.A OG1 no hydrogen 3.139 N/A SER 95.A OG THR 15.A OG1 no hydrogen 3.354 N/A VAL 97.A N ASN 118.A OD1 no hydrogen 2.935 N/A SER 99.A OG GLU 110.A OE2 no hydrogen 2.569 N/A GLY 101.A N LYS 154.A O no hydrogen 2.726 N/A LYS 104.A N HIS 102.A ND1 no hydrogen 3.051 N/A LYS 104.A NZ ASP 105.A OD2 no hydrogen 2.713 N/A ASP 105.A N HIS 102.A O no hydrogen 2.864 N/A VAL 106.A N LEU 103.A O no hydrogen 3.242 N/A GLU 109.A N GLU 109.A OE1 no hydrogen 2.763 N/A GLU 110.A N THR 107.A OG1 no hydrogen 3.057 N/A PHE 111.A N THR 107.A O no hydrogen 3.033 N/A ASP 112.A N GLU 108.A O no hydrogen 2.928 N/A ARG 113.A N GLU 109.A O no hydrogen 2.855 N/A ARG 113.A NE GLU 110.A OE1 no hydrogen 2.865 N/A ARG 113.A NH2 VAL 98.A O no hydrogen 3.239 N/A ARG 113.A NH2 GLU 110.A OE2 no hydrogen 2.829 N/A VAL 114.A N GLU 110.A O no hydrogen 3.077 N/A PHE 115.A N PHE 111.A O no hydrogen 2.918 N/A SER 116.A N ASP 112.A O no hydrogen 2.900 N/A SER 116.A OG ASP 112.A O no hydrogen 2.644 N/A SER 116.A OG ARG 113.A O no hydrogen 3.171 N/A LEU 117.A N VAL 114.A O no hydrogen 3.357 N/A ASN 118.A N VAL 114.A O no hydrogen 2.892 N/A ASN 118.A ND2 VAL 97.A O no hydrogen 2.797 N/A ASN 118.A ND2 SER 161.A OG no hydrogen 3.149 N/A THR 119.A N PHE 115.A O no hydrogen 3.083 N/A THR 119.A OG1 SER 161.A O no hydrogen 2.797 N/A ARG 120.A N PHE 115.A O no hydrogen 2.898 N/A GLY 121.A N SER 116.A O no hydrogen 2.973 N/A GLN 122.A NE2 ASN 118.A O no hydrogen 2.754 N/A GLN 122.A NE2 THR 142.A O no hydrogen 2.824 N/A PHE 123.A N THR 119.A O no hydrogen 2.909 N/A PHE 124.A N ARG 120.A O no hydrogen 3.072 N/A VAL 125.A N GLY 121.A O no hydrogen 2.902 N/A ALA 126.A N GLN 122.A O no hydrogen 3.006 N/A ARG 127.A N PHE 123.A O no hydrogen 2.940 N/A ARG 127.A NE GLU 128.A OE2 no hydrogen 2.972 N/A ARG 127.A NH2 GLU 128.A OE2 no hydrogen 2.962 N/A GLU 128.A N PHE 124.A O no hydrogen 2.917 N/A ALA 129.A N VAL 125.A O no hydrogen 2.757 N/A TYR 130.A N ALA 126.A O no hydrogen 2.847 N/A TYR 130.A OH ASP 178.A OD1 no hydrogen 2.482 N/A ARG 131.A N ARG 127.A O no hydrogen 3.078 N/A HIS 132.A N GLU 128.A O no hydrogen 3.026 N/A HIS 132.A N ALA 129.A O no hydrogen 3.209 N/A HIS 132.A ND1 GLU 128.A O no hydrogen 2.752 N/A HIS 132.A NE2 ASP 79.A OD1 no hydrogen 2.513 N/A LEU 133.A N ALA 129.A O no hydrogen 2.833 N/A THR 134.A N LEU 88.A O no hydrogen 2.928 N/A THR 134.A OG1 LEU 88.A O no hydrogen 3.496 N/A THR 134.A OG1 ASP 89.A OD1 no hydrogen 2.541 N/A GLY 136.A N LYS 179.A O no hydrogen 2.992 N/A ARG 138.A N ASP 89.A O no hydrogen 2.984 N/A ARG 138.A NE LEU 241.A O no hydrogen 3.330 N/A ARG 138.A NE SER 243.A O no hydrogen 3.177 N/A ARG 138.A NH1 GLY 137.A O no hydrogen 3.037 N/A ARG 138.A NH2 SER 243.A O no hydrogen 3.003 N/A ARG 138.A NH2 LYS 244.A O no hydrogen 3.494 N/A ILE 139.A N THR 182.A O no hydrogen 2.858 N/A VAL 140.A N ALA 91.A O no hydrogen 3.012 N/A LEU 141.A N ASN 184.A O no hydrogen 2.855 N/A THR 142.A N GLN 122.A OE1 no hydrogen 3.042 N/A THR 142.A OG1 SER 93.A O no hydrogen 2.729 N/A SER 143.A N VAL 186.A O no hydrogen 2.735 N/A SER 143.A OG SER 144.A O no hydrogen 3.549 N/A SER 143.A OG LYS 162.A O no hydrogen 3.358 N/A SER 143.A OG ASP 166.A OD1 no hydrogen 2.591 N/A SER 144.A N SER 143.A OG no hydrogen 2.601 N/A SER 144.A OG ASN 145.A OD1 no hydrogen 3.536 N/A SER 144.A OG THR 146.A OG1 no hydrogen 2.677 N/A ASN 145.A N PRO 188.A O no hydrogen 2.961 N/A THR 146.A N SER 144.A OG no hydrogen 2.960 N/A THR 146.A OG1 SER 144.A OG no hydrogen 2.677 N/A SER 147.A N SER 144.A O no hydrogen 3.180 N/A SER 147.A OG ASP 166.A OD2 no hydrogen 2.471 N/A ASP 149.A N ASN 145.A O no hydrogen 2.890 N/A PHE 150.A N ASN 145.A O no hydrogen 2.850 N/A HIS 155.A ND1 SER 99.A O no hydrogen 3.160 N/A HIS 155.A NE2 TYR 203.A OH no hydrogen 2.888 N/A SER 159.A N HIS 155.A O no hydrogen 3.062 N/A SER 159.A OG THR 146.A O no hydrogen 3.169 N/A SER 159.A OG HIS 155.A O no hydrogen 2.763 N/A GLY 160.A N SER 156.A O no hydrogen 2.966 N/A SER 161.A N LEU 157.A O no hydrogen 3.015 N/A SER 161.A OG TYR 158.A O no hydrogen 2.652 N/A LYS 162.A N TYR 158.A O no hydrogen 3.168 N/A LYS 162.A NZ THR 142.A O no hydrogen 3.268 N/A LYS 162.A NZ SER 143.A O no hydrogen 3.019 N/A LYS 162.A NZ TYR 158.A OH no hydrogen 3.449 N/A GLY 163.A N SER 159.A O no hydrogen 2.898 N/A ALA 164.A N GLY 160.A O no hydrogen 3.088 N/A ASP 166.A N LYS 162.A O no hydrogen 3.190 N/A SER 167.A N GLY 163.A O no hydrogen 3.382 N/A PHE 168.A N ALA 164.A O no hydrogen 2.859 N/A VAL 169.A N VAL 165.A O no hydrogen 2.992 N/A ILE 171.A N SER 167.A O no hydrogen 3.391 N/A PHE 172.A N PHE 168.A O no hydrogen 2.661 N/A SER 173.A N VAL 169.A O no hydrogen 3.044 N/A SER 173.A OG ARG 170.A O no hydrogen 2.746 N/A LYS 174.A N ILE 171.A O no hydrogen 2.869 N/A LYS 174.A NZ ARG 170.A O no hydrogen 3.006 N/A ASP 175.A N ILE 171.A O no hydrogen 3.275 N/A CYS 176.A N PHE 172.A O no hydrogen 2.756 N/A CYS 176.A SG PHE 172.A O no hydrogen 3.354 N/A GLY 177.A N SER 173.A O no hydrogen 3.301 N/A ASP 178.A N ASP 175.A O no hydrogen 3.403 N/A LYS 179.A N CYS 176.A O no hydrogen 3.034 N/A LYS 179.A NZ TYR 130.A O no hydrogen 2.686 N/A LYS 179.A NZ LEU 133.A O no hydrogen 2.799 N/A LYS 180.A N GLY 177.A O no hydrogen 2.988 N/A ILE 181.A N CYS 176.A O no hydrogen 3.117 N/A THR 182.A N GLY 137.A O no hydrogen 3.276 N/A VAL 183.A N ASN 250.A OD1 no hydrogen 2.997 N/A ASN 184.A N ILE 139.A O no hydrogen 3.011 N/A ASN 184.A ND2 VAL 249.A O no hydrogen 2.839 N/A ALA 185.A N LYS 252.A O no hydrogen 2.887 N/A VAL 186.A N LEU 141.A O no hydrogen 3.015 N/A ALA 187.A N LEU 254.A O no hydrogen 2.861 N/A GLY 189.A N LEU 256.A O no hydrogen 2.926 N/A THR 191.A OG1 GLY 189.A O no hydrogen 2.841 N/A VAL 192.A N GLY 229.A O no hydrogen 2.975 N/A THR 193.A OG1 THR 191.A O no hydrogen 3.527 N/A PHE 196.A N THR 193.A O no hydrogen 3.227 N/A GLU 198.A N MET 195.A O no hydrogen 2.961 N/A VAL 199.A N MET 195.A O no hydrogen 3.224 N/A VAL 199.A N PHE 196.A O no hydrogen 3.036 N/A HIS 202.A N VAL 199.A O no hydrogen 2.819 N/A TYR 203.A N VAL 199.A O no hydrogen 2.985 N/A TYR 203.A N SER 200.A O no hydrogen 3.177 N/A TYR 203.A OH HIS 155.A NE2 no hydrogen 2.888 N/A GLY 207.A N ILE 204.A O no hydrogen 3.082 N/A SER 209.A N ASN 206.A O no hydrogen 2.957 N/A SER 209.A OG ASN 206.A O no hydrogen 2.715 N/A TYR 210.A N GLY 207.A O no hydrogen 3.172 N/A THR 211.A N GLN 214.A OE1 no hydrogen 2.865 N/A GLN 214.A N THR 211.A OG1 no hydrogen 3.182 N/A ARG 215.A N THR 211.A O no hydrogen 2.914 N/A ARG 215.A NE SER 200.A OG no hydrogen 2.805 N/A ARG 215.A NH1 GLY 207.A O no hydrogen 3.237 N/A GLN 216.A N ALA 212.A O no hydrogen 3.006 N/A GLN 216.A NE2 ASN 228.A OD1 no hydrogen 3.368 N/A GLN 217.A N GLU 213.A O no hydrogen 2.955 N/A MET 218.A N GLN 214.A O no hydrogen 2.762 N/A ALA 219.A N ARG 215.A O no hydrogen 2.782 N/A ALA 220.A N GLN 216.A O no hydrogen 3.003 N/A HIS 221.A N GLN 217.A O no hydrogen 3.124 N/A ALA 222.A N ALA 219.A O no hydrogen 3.222 N/A SER 223.A N ALA 220.A O no hydrogen 3.232 N/A SER 223.A OG GLY 258.A O no hydrogen 2.826 N/A LEU 225.A N SER 223.A OG no hydrogen 2.865 N/A HIS 226.A N SER 223.A O no hydrogen 2.921 N/A HIS 226.A ND1 SER 223.A O no hydrogen 3.086 N/A ARG 227.A NH1 ASN 228.A O no hydrogen 2.832 N/A ARG 227.A NH1 ASP 233.A OD1 no hydrogen 3.557 N/A ARG 227.A NH1 ASP 233.A OD2 no hydrogen 2.867 N/A ARG 227.A NH2 ASP 233.A OD1 no hydrogen 2.874 N/A ASN 228.A ND2 GLN 216.A O no hydrogen 2.842 N/A TRP 230.A N ASP 233.A OD2 no hydrogen 2.862 N/A GLN 232.A NE2 HIS 28.A ND1 no hydrogen 3.283 N/A GLN 232.A NE2 ASN 236.A OD1 no hydrogen 2.799 N/A ASP 233.A N TRP 230.A O no hydrogen 2.890 N/A ALA 235.A N PRO 231.A O no hydrogen 2.973 N/A ASN 236.A N GLN 232.A O no hydrogen 2.850 N/A VAL 238.A N VAL 234.A O no hydrogen 2.942 N/A GLY 239.A N ALA 235.A O no hydrogen 2.907 N/A PHE 240.A N ASN 236.A O no hydrogen 3.299 N/A LEU 241.A N VAL 237.A O no hydrogen 2.945 N/A VAL 242.A N VAL 238.A O no hydrogen 2.937 N/A SER 243.A N PHE 240.A O no hydrogen 3.143 N/A SER 243.A OG PHE 240.A O no hydrogen 2.699 N/A SER 243.A OG GLU 245.A OE1 no hydrogen 3.441 N/A GLU 245.A N GLU 245.A OE1 no hydrogen 2.749 N/A GLY 246.A N SER 243.A O no hydrogen 3.306 N/A GLU 247.A N LYS 244.A O no hydrogen 3.160 N/A VAL 249.A N GLY 246.A O no hydrogen 2.944 N/A GLY 251.A N VAL 183.A O no hydrogen 2.713 N/A LYS 252.A N ASN 184.A OD1 no hydrogen 2.987 N/A LYS 252.A NZ ASN 250.A O no hydrogen 2.692 N/A LEU 254.A N ALA 185.A O no hydrogen 2.951 N/A THR 255.A OG1 ASP 149.A OD2 no hydrogen 2.566 N/A LEU 256.A N ALA 187.A O no hydrogen 2.910 N/A GLY 259.A N ASP 257.A OD1 no hydrogen 2.899 N/A ALA 260.A N ASP 257.A O no hydrogen 3.105 N/A ALA 261.A N ASP 257.A OD2 no hydrogen 2.971 N/A