Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5h94_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.695 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.767 N/A LEU 5.A N CYS 101.A O no hydrogen 3.000 N/A SER 6.A N TYR 27.A O no hydrogen 2.973 N/A SER 6.A OG TYR 113.A OH no hydrogen 2.637 N/A TYR 7.A N TYR 99.A O no hydrogen 2.924 N/A PHE 8.A N VAL 25.A O no hydrogen 2.913 N/A TYR 9.A N ASN 97.A O no hydrogen 2.775 N/A TYR 9.A OH TYR 99.A OH no hydrogen 2.674 N/A THR 10.A N ILE 23.A O no hydrogen 2.816 N/A ALA 11.A N PHE 95.A O no hydrogen 2.834 N/A VAL 12.A N ARG 21.A O no hydrogen 2.908 N/A SER 13.A N HIS 93.A O no hydrogen 3.024 N/A ARG 14.A N ASP 19.A O no hydrogen 2.830 N/A ARG 14.A NE ASP 19.A OD1 no hydrogen 2.882 N/A ARG 14.A NH1 ASP 39.A OD2 no hydrogen 3.250 N/A ARG 14.A NH2 ASP 19.A OD1 no hydrogen 3.323 N/A ARG 14.A NH2 ASP 19.A OD2 no hydrogen 2.810 N/A ARG 14.A NH2 ASP 39.A OD1 no hydrogen 3.443 N/A ARG 17.A N ARG 14.A O no hydrogen 2.983 N/A ARG 17.A NH1 ASP 39.A OD1 no hydrogen 3.002 N/A GLY 18.A N PRO 15.A O no hydrogen 3.102 N/A ASP 19.A N ARG 14.A O no hydrogen 3.329 N/A ARG 21.A N VAL 12.A O no hydrogen 2.866 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 3.019 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.363 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.504 N/A PHE 22.A N SER 38.A OG no hydrogen 2.847 N/A ILE 23.A N THR 10.A O no hydrogen 2.856 N/A ALA 24.A N PHE 36.A O no hydrogen 2.917 N/A VAL 25.A N PHE 8.A O no hydrogen 3.050 N/A GLY 26.A N VAL 34.A O no hydrogen 3.148 N/A TYR 27.A N SER 6.A O no hydrogen 2.866 N/A VAL 28.A N THR 31.A O no hydrogen 2.837 N/A ASP 29.A N SER 4.A O no hydrogen 2.874 N/A ASP 30.A N TYR 209.A OH no hydrogen 3.332 N/A THR 31.A N VAL 28.A O no hydrogen 2.875 N/A THR 31.A OG1 TYR 209.A OH no hydrogen 2.805 N/A GLN 32.A NE2 VAL 34.A O no hydrogen 3.109 N/A PHE 33.A N GLY 26.A O no hydrogen 2.852 N/A ARG 35.A N GLU 46.A O no hydrogen 2.984 N/A ARG 35.A NE GLU 46.A OE1 no hydrogen 2.893 N/A ARG 35.A NH2 GLU 46.A OE1 no hydrogen 2.903 N/A PHE 36.A N ALA 24.A O no hydrogen 2.836 N/A SER 38.A N PHE 22.A O no hydrogen 2.922 N/A SER 38.A OG PHE 22.A O no hydrogen 3.486 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.971 N/A ALA 40.A N SER 38.A O no hydrogen 2.910 N/A ARG 44.A NH1 ASP 61.A OD1 no hydrogen 3.485 N/A ARG 44.A NH2 ASP 61.A OD1 no hydrogen 3.074 N/A GLU 45.A N THR 64.A OG1 no hydrogen 2.928 N/A GLU 46.A N ARG 35.A O no hydrogen 2.864 N/A ARG 48.A N PHE 33.A O no hydrogen 2.704 N/A ILE 52.A N ALA 49.A O no hydrogen 3.378 N/A GLN 53.A N PRO 50.A O no hydrogen 3.332 N/A GLU 55.A N ILE 52.A O no hydrogen 2.960 N/A GLN 57.A NE2 ASP 61.A OD1 no hydrogen 2.702 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.648 N/A TRP 60.A N GLY 56.A O no hydrogen 3.395 N/A TRP 60.A NE1 GLU 55.A O no hydrogen 3.023 N/A ASP 61.A N GLN 57.A O no hydrogen 2.867 N/A ARG 62.A N GLU 58.A O no hydrogen 3.014 N/A ARG 62.A NH2 GLU 63.A OE2 no hydrogen 2.780 N/A GLU 63.A N TYR 59.A O no hydrogen 3.081 N/A THR 64.A N TRP 60.A O no hydrogen 2.921 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.804 N/A GLN 65.A N ASP 61.A O no hydrogen 3.004 N/A GLN 65.A NE2 ASP 69.A OD1 no hydrogen 3.441 N/A GLN 65.A NE2 ASP 69.A OD2 no hydrogen 3.208 N/A ILE 66.A N ARG 62.A O no hydrogen 2.984 N/A SER 67.A N GLU 63.A O no hydrogen 2.932 N/A SER 67.A OG GLU 45.A OE2 no hydrogen 2.954 N/A SER 67.A OG GLU 63.A O no hydrogen 3.201 N/A LYS 68.A N THR 64.A O no hydrogen 2.873 N/A LYS 68.A NZ PRO 43.A O no hydrogen 3.123 N/A ASP 69.A N GLN 65.A O no hydrogen 2.901 N/A ASN 70.A N ILE 66.A O no hydrogen 2.757 N/A ALA 71.A N SER 67.A O no hydrogen 2.836 N/A GLN 72.A N LYS 68.A O no hydrogen 3.386 N/A THR 73.A N ASP 69.A O no hydrogen 2.956 N/A THR 73.A OG1 ASP 69.A O no hydrogen 3.294 N/A TYR 74.A N ASN 70.A O no hydrogen 2.834 N/A ARG 75.A N ALA 71.A O no hydrogen 3.041 N/A VAL 76.A N GLN 72.A O no hydrogen 3.070 N/A ASN 77.A N THR 73.A O no hydrogen 2.784 N/A LEU 78.A N TYR 74.A O no hydrogen 2.895 N/A ASN 79.A N ARG 75.A O no hydrogen 3.221 N/A ASN 80.A N VAL 76.A O no hydrogen 2.865 N/A LEU 81.A N ASN 77.A O no hydrogen 2.857 N/A ARG 82.A N LEU 78.A O no hydrogen 3.036 N/A GLY 83.A N ASN 79.A O no hydrogen 3.023 N/A TYR 84.A N ASN 80.A O no hydrogen 2.842 N/A TYR 85.A N LEU 81.A O no hydrogen 3.034 N/A TYR 85.A OH ASP 137.A OD1 no hydrogen 3.298 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.523 N/A ASN 86.A N GLY 83.A O no hydrogen 3.042 N/A GLN 87.A N ARG 82.A O no hydrogen 2.951 N/A GLN 87.A NE2 TYR 118.A OH no hydrogen 2.516 N/A ALA 90.A N SER 88.A OG no hydrogen 3.034 N/A SER 92.A OG SER 13.A O no hydrogen 2.737 N/A HIS 93.A N SER 13.A OG no hydrogen 2.954 N/A THR 94.A N ASP 119.A OD1 no hydrogen 2.904 N/A PHE 95.A N ALA 11.A O no hydrogen 2.823 N/A GLN 96.A N ALA 117.A O no hydrogen 2.843 N/A ASN 97.A N TYR 9.A O no hydrogen 2.990 N/A ASN 97.A ND2 GLN 115.A O no hydrogen 3.013 N/A MET 98.A N GLN 115.A O no hydrogen 2.912 N/A TYR 99.A N TYR 7.A O no hydrogen 3.139 N/A TYR 99.A OH TYR 9.A OH no hydrogen 2.674 N/A GLY 100.A N TYR 113.A O no hydrogen 2.996 N/A CYS 101.A N LEU 5.A O no hydrogen 2.883 N/A TYR 102.A N HIS 111.A O no hydrogen 2.780 N/A LEU 103.A N HIS 3.A O no hydrogen 2.897 N/A GLY 104.A N LEU 108.A O no hydrogen 2.870 N/A GLY 107.A N GLY 104.A O no hydrogen 3.021 N/A LEU 108.A N ASP 106.A OD1 no hydrogen 3.024 N/A LEU 110.A N TYR 102.A O no hydrogen 2.668 N/A HIS 111.A N TYR 102.A O no hydrogen 3.456 N/A TYR 113.A N GLY 100.A O no hydrogen 3.049 N/A TYR 113.A OH SER 6.A OG no hydrogen 2.637 N/A HIS 114.A ND1 GLU 156.A OE1 no hydrogen 2.740 N/A HIS 114.A NE2 TYR 116.A OH no hydrogen 2.656 N/A GLN 115.A N MET 98.A O no hydrogen 2.842 N/A TYR 116.A N ILE 124.A O no hydrogen 2.886 N/A TYR 116.A OH HIS 114.A NE2 no hydrogen 2.656 N/A ALA 117.A N GLN 96.A O no hydrogen 2.941 N/A TYR 118.A N ALA 121.A O no hydrogen 2.874 N/A ASP 119.A N THR 94.A O no hydrogen 2.799 N/A ALA 121.A N TYR 118.A O no hydrogen 3.001 N/A TYR 123.A N TYR 116.A O no hydrogen 2.882 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.733 N/A ALA 125.A N THR 134.A O no hydrogen 3.049 N/A LEU 126.A N HIS 114.A O no hydrogen 2.777 N/A ASN 127.A N SER 132.A O no hydrogen 2.810 N/A ASN 127.A ND2 SER 132.A OG no hydrogen 2.959 N/A LEU 130.A N ASN 127.A O no hydrogen 2.973 N/A ARG 131.A N ASP 129.A OD1 no hydrogen 2.817 N/A ARG 131.A NE GLU 154.A OE2 no hydrogen 2.740 N/A SER 132.A OG ASP 129.A OD1 no hydrogen 2.842 N/A SER 132.A OG ASP 129.A OD2 no hydrogen 3.301 N/A THR 134.A N ALA 125.A O no hydrogen 2.857 N/A THR 134.A OG1 ASN 127.A OD1 no hydrogen 2.481 N/A ALA 136.A N TYR 123.A O no hydrogen 2.873 N/A ALA 140.A N ASP 137.A OD1 no hydrogen 2.951 N/A GLN 141.A N ASP 137.A O no hydrogen 3.101 N/A GLN 141.A N THR 138.A O no hydrogen 2.946 N/A ILE 142.A N THR 138.A O no hydrogen 3.268 N/A THR 143.A N ALA 139.A O no hydrogen 3.088 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.733 N/A THR 143.A OG1 ALA 139.A O no hydrogen 3.568 N/A LYS 144.A N ALA 140.A O no hydrogen 2.755 N/A LYS 144.A NZ GLU 148.A OE2 no hydrogen 2.761 N/A ARG 145.A N GLN 141.A O no hydrogen 3.143 N/A LYS 146.A N ILE 142.A O no hydrogen 3.041 N/A LYS 146.A NZ TYR 84.A OH no hydrogen 3.090 N/A TRP 147.A N THR 143.A O no hydrogen 2.761 N/A GLU 148.A N LYS 144.A O no hydrogen 2.868 N/A ALA 149.A N ARG 145.A O no hydrogen 3.095 N/A SER 150.A N LYS 146.A O no hydrogen 2.937 N/A GLY 151.A N TRP 147.A O no hydrogen 2.801 N/A TRP 152.A N SER 150.A OG no hydrogen 3.289 N/A GLU 154.A N GLY 151.A O no hydrogen 3.078 N/A GLN 155.A N TRP 152.A O no hydrogen 2.928 N/A GLN 155.A NE2 GLY 151.A O no hydrogen 3.662 N/A GLU 156.A N TRP 152.A O no hydrogen 3.082 N/A ARG 157.A N ALA 153.A O no hydrogen 2.830 N/A SER 158.A N GLU 154.A O no hydrogen 3.036 N/A TYR 159.A N GLN 155.A O no hydrogen 2.939 N/A LEU 160.A N GLU 156.A O no hydrogen 2.804 N/A GLN 161.A N ARG 157.A O no hydrogen 3.061 N/A GLY 162.A N TYR 159.A O no hydrogen 3.183 N/A CYS 164.A N TYR 159.A O no hydrogen 2.870 N/A CYS 164.A SG TYR 159.A OH no hydrogen 3.697 N/A GLU 166.A N GLY 162.A O no hydrogen 2.871 N/A SER 167.A N LEU 163.A O no hydrogen 2.818 N/A SER 167.A OG LEU 163.A O no hydrogen 2.875 N/A SER 167.A OG CYS 164.A O no hydrogen 3.234 N/A LEU 168.A N CYS 164.A O no hydrogen 2.952 N/A ARG 169.A N VAL 165.A O no hydrogen 2.935 N/A ARG 169.A NH1 GLY 107.A O no hydrogen 3.505 N/A GLU 170.A N GLU 166.A O no hydrogen 3.172 N/A TYR 171.A N SER 167.A O no hydrogen 2.855 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.648 N/A LEU 172.A N LEU 168.A O no hydrogen 2.844 N/A GLU 173.A N ARG 169.A O no hydrogen 3.180 N/A MET 174.A N GLU 170.A O no hydrogen 2.974 N/A GLY 175.A N TYR 171.A O no hydrogen 2.903 N/A LYS 176.A N GLU 173.A O no hydrogen 3.219 N/A THR 178.A N GLY 175.A O no hydrogen 3.035 N/A THR 178.A OG1 GLY 175.A O no hydrogen 3.321 N/A LEU 179.A N GLY 175.A O no hydrogen 2.786 N/A GLN 180.A N LYS 176.A O no hydrogen 2.871 N/A GLN 180.A NE2 LEU 172.A O no hydrogen 2.902 N/A ARG 181.A N THR 178.A O no hydrogen 3.487 N/A GLU 183.A N TYR 209.A O no hydrogen 2.744 N/A LYS 186.A N LEU 206.A O no hydrogen 2.754 N/A HIS 188.A N TRP 204.A O no hydrogen 3.278 N/A THR 190.A N ARG 202.A O no hydrogen 2.879 N/A ARG 191.A NH1 GLU 254.A OE2 no hydrogen 2.747 N/A HIS 192.A N THR 200.A O no hydrogen 2.821 N/A SER 194.A N GLY 198.A O no hydrogen 3.031 N/A SER 194.A OG GLY 198.A O no hydrogen 3.011 N/A SER 194.A OG THR 200.A OG1 no hydrogen 3.027 N/A SER 195.A N GLY 198.A O no hydrogen 2.913 N/A GLY 198.A N SER 195.A O no hydrogen 3.363 N/A VAL 199.A N VAL 249.A O no hydrogen 2.819 N/A THR 200.A N HIS 192.A O no hydrogen 2.828 N/A THR 200.A OG1 SER 194.A OG no hydrogen 3.027 N/A LEU 201.A N LEU 247.A O no hydrogen 2.970 N/A ARG 202.A N THR 190.A O no hydrogen 2.907 N/A CYS 203.A N ALA 245.A O no hydrogen 2.711 N/A TRP 204.A N HIS 188.A O no hydrogen 2.803 N/A TRP 204.A NE1 THR 190.A OG1 no hydrogen 3.155 N/A ALA 205.A N LYS 243.A O no hydrogen 2.866 N/A LEU 206.A N LYS 186.A O no hydrogen 2.765 N/A GLY 207.A N PHE 241.A O no hydrogen 2.871 N/A PHE 208.A N PHE 241.A O no hydrogen 3.119 N/A TYR 209.A N GLU 183.A O no hydrogen 2.938 N/A TYR 209.A OH THR 31.A OG1 no hydrogen 2.805 N/A LYS 211.A N ASP 30.A OD2 no hydrogen 2.997 N/A SER 214.A N GLN 262.A O no hydrogen 2.908 N/A THR 216.A N HIS 260.A O no hydrogen 3.081 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 2.906 N/A GLN 218.A N THR 258.A O no hydrogen 2.806 N/A ARG 219.A N GLN 222.A O no hydrogen 2.880 N/A GLU 220.A N SER 256.A O no hydrogen 2.964 N/A GLN 222.A N ARG 219.A O no hydrogen 2.883 N/A GLN 224.A N TRP 217.A O no hydrogen 2.828 N/A SER 225.A N ASP 223.A OD2 no hydrogen 2.973 N/A SER 225.A OG ASP 223.A OD1 no hydrogen 3.294 N/A SER 225.A OG ASP 223.A OD2 no hydrogen 2.773 N/A GLN 226.A N GLN 226.A OE1 no hydrogen 2.715 N/A GLN 226.A NE2 ASP 223.A O no hydrogen 3.637 N/A ASP 227.A N GLN 224.A O no hydrogen 2.839 N/A MET 228.A N SER 225.A O no hydrogen 3.251 N/A GLU 229.A N ALA 246.A O no hydrogen 2.783 N/A VAL 231.A N TRP 244.A O no hydrogen 3.188 N/A ARG 234.A N GLN 242.A O no hydrogen 2.951 N/A ARG 234.A NE GLN 242.A OE1 no hydrogen 2.978 N/A ARG 234.A NH2 GLN 242.A OE1 no hydrogen 3.087 N/A SER 236.A N THR 240.A O no hydrogen 2.766 N/A SER 236.A OG THR 240.A OG1 no hydrogen 2.899 N/A THR 240.A N ASP 238.A OD1 no hydrogen 2.978 N/A THR 240.A OG1 SER 236.A OG no hydrogen 2.899 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.634 N/A PHE 241.A N PHE 208.A O no hydrogen 2.888 N/A GLN 242.A N ARG 234.A O no hydrogen 2.773 N/A LYS 243.A N ALA 205.A O no hydrogen 2.927 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.736 N/A LYS 243.A NZ THR 233.A OG1 no hydrogen 3.021 N/A ALA 245.A N CYS 203.A O no hydrogen 2.940 N/A ALA 246.A N GLU 229.A O no hydrogen 2.816 N/A LEU 247.A N LEU 201.A O no hydrogen 2.986 N/A VAL 249.A N VAL 199.A O no hydrogen 2.747 N/A GLU 253.A N PRO 250.A O no hydrogen 3.129 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.713 N/A SER 256.A N GLU 253.A O no hydrogen 2.948 N/A TYR 257.A N GLU 254.A O no hydrogen 3.209 N/A THR 258.A N GLN 218.A O no hydrogen 2.905 N/A CYS 259.A N LEU 272.A O no hydrogen 2.752 N/A CYS 259.A SG THR 216.A O no hydrogen 3.788 N/A HIS 260.A N THR 216.A O no hydrogen 2.735 N/A VAL 261.A N LEU 270.A O no hydrogen 2.895 N/A GLN 262.A N SER 214.A O no hydrogen 2.882 N/A HIS 263.A NE2 PRO 210.A O no hydrogen 2.907 N/A GLY 265.A N HIS 263.A ND1 no hydrogen 2.959 N/A LEU 266.A N HIS 263.A O no hydrogen 2.987 N/A LEU 270.A N VAL 261.A O no hydrogen 2.979 N/A LEU 272.A N CYS 259.A O no hydrogen 2.799 N/A