Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d3z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 6.A OD1 no hydrogen 2.620 N/A SER 2.A OG ASP 184.A OD1 no hydrogen 2.610 N/A ARG 5.A N SER 2.A OG no hydrogen 3.282 N/A ARG 5.A NE GLU 178.A OE1 no hydrogen 2.906 N/A ARG 5.A NH1 SER 1.A OG no hydrogen 2.950 N/A ARG 5.A NH2 GLU 178.A OE2 no hydrogen 2.657 N/A ASP 6.A N SER 2.A O no hydrogen 2.868 N/A GLY 7.A N ALA 3.A O no hydrogen 2.865 N/A TYR 8.A N LEU 4.A O no hydrogen 3.060 N/A ARG 9.A N ARG 5.A O no hydrogen 3.105 N/A GLN 10.A N ASP 6.A O no hydrogen 2.965 N/A ALA 11.A N GLY 7.A O no hydrogen 2.807 N/A GLY 12.A N TYR 8.A O no hydrogen 3.175 N/A VAL 13.A N ARG 9.A O no hydrogen 3.101 N/A SER 14.A N.A GLN 10.A O no hydrogen 2.886 N/A SER 14.A N.B GLN 10.A O no hydrogen 2.865 N/A SER 14.A OG.A GLN 10.A O no hydrogen 2.870 N/A SER 14.A OG.B GLN 10.A O no hydrogen 2.728 N/A GLY 15.A N GLY 12.A O no hydrogen 3.260 N/A ARG 16.A N ALA 11.A O no hydrogen 2.911 N/A ARG 16.A NE SER 14.A OG.A no hydrogen 2.801 N/A ARG 16.A NH2 SER 14.A OG.A no hydrogen 3.109 N/A ARG 16.A NH2 SER 14.A OG.B no hydrogen 3.420 N/A ARG 18.A NH1 ASP 22.A OD1 no hydrogen 3.321 N/A ARG 18.A NH1 ASP 194.A OD2 no hydrogen 2.788 N/A TYR 20.A N ARG 16.A O no hydrogen 3.166 N/A TYR 20.A OH LEU 4.A O no hydrogen 2.883 N/A LEU 21.A N VAL 17.A O no hydrogen 2.826 N/A ASP 22.A N ARG 18.A O no hydrogen 3.042 N/A LEU 23.A N SER 19.A O no hydrogen 3.050 N/A LEU 24.A N TYR 20.A O no hydrogen 2.963 N/A ALA 25.A N LEU 21.A O no hydrogen 2.945 N/A GLY 26.A N ASP 22.A O no hydrogen 2.994 N/A LEU 27.A N LEU 23.A O no hydrogen 2.944 N/A SER 28.A N LEU 24.A O no hydrogen 2.966 N/A SER 28.A OG ALA 25.A O no hydrogen 2.611 N/A ASP 29.A N ALA 25.A O no hydrogen 3.349 N/A ASP 29.A N GLY 26.A O no hydrogen 3.229 N/A PHE 30.A N LEU 27.A O no hydrogen 3.054 N/A ARG 31.A N SER 28.A O no hydrogen 3.068 N/A ARG 31.A NH1 GLY 91.A O no hydrogen 3.292 N/A ARG 31.A NH1 THR 185.A O no hydrogen 2.925 N/A ARG 31.A NH1 THR 188.A OG1 no hydrogen 2.914 N/A ARG 31.A NH2 GLY 91.A O no hydrogen 2.877 N/A ARG 31.A NH2 GLU 96.A O no hydrogen 3.028 N/A PHE 34.A N LEU 98.A O no hydrogen 2.922 N/A SER 37.A N ASP 35.A OD1 no hydrogen 2.854 N/A SER 37.A OG ASP 35.A OD1 no hydrogen 2.920 N/A VAL 45.A N ALA 86.A O no hydrogen 2.782 N/A MET 47.A N VAL 84.A O no hydrogen 2.948 N/A ALA 48.A N VAL 84.A O no hydrogen 3.194 N/A GLY 50.A N ASP 49.A OD1 no hydrogen 2.899 N/A THR 55.A N PRO 121.A O no hydrogen 3.110 N/A VAL 56.A N PRO 83.A O no hydrogen 2.761 N/A ILE 57.A N VAL 123.A O no hydrogen 2.856 N/A CYS 58.A N ARG 85.A O no hydrogen 2.742 N/A CYS 59.A N ALA 125.A O no hydrogen 2.687 N/A CYS 59.A SG ALA 125.A O no hydrogen 3.840 N/A ALA 60.A N VAL 87.A O no hydrogen 2.899 N/A GLY 61.A N GLU 70.A OE1 no hydrogen 2.735 N/A SER 66.A N ALA 63.A O no hydrogen 2.944 N/A SER 66.A OG ALA 63.A O no hydrogen 3.402 N/A SER 66.A OG GLU 70.A OE2 no hydrogen 2.628 N/A GLY 67.A N GLU 70.A OE1 no hydrogen 3.072 N/A GLU 70.A N GLY 67.A O no hydrogen 2.946 N/A PHE 71.A N PRO 68.A O no hydrogen 3.026 N/A THR 72.A N HIS 69.A O no hydrogen 3.206 N/A THR 72.A OG1 HIS 69.A O no hydrogen 3.288 N/A ALA 75.A N PHE 71.A O no hydrogen 2.724 N/A GLY 76.A N THR 72.A O no hydrogen 2.865 N/A ALA 77.A N ARG 73.A O no hydrogen 3.008 N/A LEU 78.A N LEU 74.A O no hydrogen 2.956 N/A LEU 78.A N ALA 75.A O no hydrogen 3.059 N/A ARG 79.A N GLY 76.A O no hydrogen 3.416 N/A GLY 80.A N ASP 49.A O no hydrogen 2.875 N/A ILE 81.A N LEU 78.A O no hydrogen 2.783 N/A ALA 82.A N LEU 78.A O no hydrogen 3.104 N/A VAL 84.A N ALA 48.A O no hydrogen 2.854 N/A ARG 85.A N VAL 56.A O no hydrogen 2.971 N/A ARG 85.A NE ASP 46.A OD1 no hydrogen 2.799 N/A ARG 85.A NH1 GLN 117.A OE1 no hydrogen 2.851 N/A ARG 85.A NH2 ASP 46.A OD1 no hydrogen 3.528 N/A ALA 86.A N VAL 45.A O no hydrogen 2.789 N/A VAL 87.A N CYS 58.A O no hydrogen 2.797 N/A GLN 89.A NE2 ALA 60.A O no hydrogen 2.899 N/A GLY 91.A N GLU 96.A OE1 no hydrogen 2.735 N/A TYR 92.A OH THR 62.A O no hydrogen 2.634 N/A GLU 96.A N GLU 93.A O no hydrogen 3.156 N/A LEU 98.A N GLU 32.A O no hydrogen 3.020 N/A SER 100.A N.A PHE 34.A O no hydrogen 2.992 N/A SER 100.A N.B PHE 34.A O no hydrogen 3.023 N/A SER 100.A OG.A PHE 34.A O no hydrogen 3.160 N/A SER 100.A OG.B PHE 34.A O no hydrogen 3.285 N/A ALA 104.A N SER 101.A OG no hydrogen 3.099 N/A VAL 105.A N SER 101.A O no hydrogen 3.476 N/A ALA 106.A N MET 102.A O no hydrogen 2.981 N/A ALA 107.A N ALA 103.A O no hydrogen 2.890 N/A VAL 108.A N ALA 104.A O no hydrogen 3.195 N/A GLN 109.A N VAL 105.A O no hydrogen 3.023 N/A GLN 109.A NE2 PRO 88.A O no hydrogen 2.916 N/A GLN 109.A NE2 GLN 89.A OE1 no hydrogen 2.808 N/A ALA 110.A N ALA 106.A O no hydrogen 2.821 N/A ASP 111.A N ALA 107.A O no hydrogen 2.984 N/A ALA 112.A N VAL 108.A O no hydrogen 3.225 N/A VAL 113.A N GLN 109.A O no hydrogen 2.936 N/A ILE 114.A N ALA 110.A O no hydrogen 2.941 N/A ARG 115.A N ASP 111.A O no hydrogen 2.916 N/A ARG 115.A NH2 LEU 42.A O no hydrogen 2.814 N/A THR 116.A N ALA 112.A O no hydrogen 2.987 N/A THR 116.A OG1 ALA 112.A O no hydrogen 2.721 N/A GLN 117.A N VAL 113.A O no hydrogen 2.761 N/A GLN 117.A NE2 LYS 120.A O no hydrogen 3.061 N/A GLY 118.A N ILE 114.A O no hydrogen 3.119 N/A LYS 120.A N GLN 117.A O no hydrogen 2.957 N/A VAL 123.A N THR 55.A O no hydrogen 2.845 N/A VAL 124.A N GLY 150.A O no hydrogen 3.141 N/A ALA 125.A N ILE 57.A O no hydrogen 2.765 N/A GLY 126.A N VAL 152.A O no hydrogen 3.086 N/A HIS 127.A NE2 HIS 243.A O no hydrogen 2.747 N/A SER 128.A N ILE 154.A O no hydrogen 2.719 N/A SER 128.A OG HIS 243.A NE2 no hydrogen 3.122 N/A ALA 131.A N SER 128.A O no hydrogen 2.834 N/A MET 133.A N ALA 129.A O no hydrogen 3.065 N/A ALA 134.A N GLY 130.A O no hydrogen 2.789 N/A TYR 135.A N ALA 131.A O no hydrogen 2.869 N/A TYR 135.A OH ARG 203.A O no hydrogen 2.507 N/A TYR 135.A OH THR 205.A OG1 no hydrogen 2.831 N/A ALA 136.A N LEU 132.A O no hydrogen 2.926 N/A LEU 137.A N MET 133.A O no hydrogen 3.037 N/A ALA 138.A N ALA 134.A O no hydrogen 2.906 N/A THR 139.A N TYR 135.A O no hydrogen 2.956 N/A THR 139.A OG1 TYR 135.A O no hydrogen 2.889 N/A GLU 140.A N ALA 136.A O no hydrogen 3.009 N/A LEU 141.A N LEU 137.A O no hydrogen 2.861 N/A LEU 142.A N ALA 138.A O no hydrogen 2.906 N/A ASP 143.A N THR 139.A O no hydrogen 2.839 N/A ARG 144.A N LEU 141.A O no hydrogen 3.106 N/A ARG 144.A NE GLU 140.A OE2 no hydrogen 3.083 N/A ARG 144.A NH1 ASP 111.A OD1 no hydrogen 2.722 N/A ARG 144.A NH2 ASP 111.A OD1 no hydrogen 2.828 N/A ARG 144.A NH2 GLU 140.A OE2 no hydrogen 3.221 N/A GLY 145.A N LEU 142.A O no hydrogen 3.011 N/A HIS 146.A N LEU 141.A O no hydrogen 2.890 N/A ARG 149.A N PHE 122.A O no hydrogen 2.815 N/A VAL 151.A N PRO 208.A O no hydrogen 2.808 N/A VAL 152.A N VAL 124.A O no hydrogen 2.794 N/A LEU 153.A N LEU 210.A O no hydrogen 2.792 N/A ILE 154.A N GLY 126.A O no hydrogen 2.800 N/A ASP 155.A N VAL 212.A O no hydrogen 2.796 N/A TYR 157.A OH TRP 226.A O no hydrogen 2.598 N/A GLN 160.A NE2 TYR 157.A O no hydrogen 2.988 N/A ASN 164.A N GLN 160.A O no hydrogen 2.952 N/A ALA 165.A N ASP 161.A O no hydrogen 2.861 N/A TRP 166.A N ALA 162.A O no hydrogen 2.909 N/A LEU 167.A N ASN 164.A O no hydrogen 3.373 N/A LEU 170.A N TRP 166.A O no hydrogen 2.784 N/A THR 171.A N LEU 167.A O no hydrogen 2.992 N/A THR 171.A OG1 LEU 167.A O no hydrogen 2.727 N/A ALA 172.A N GLU 168.A O no hydrogen 2.963 N/A THR 173.A N GLU 169.A O no hydrogen 2.957 N/A THR 173.A OG1 GLU 169.A O no hydrogen 2.791 N/A LEU 174.A N LEU 170.A O no hydrogen 2.929 N/A PHE 175.A N THR 171.A O no hydrogen 3.276 N/A ASP 176.A N ALA 172.A O no hydrogen 3.132 N/A ARG 177.A N THR 173.A O no hydrogen 3.027 N/A ARG 177.A N LEU 174.A O no hydrogen 3.225 N/A ARG 177.A NH1 GLU 249.A OE1 no hydrogen 3.054 N/A ARG 177.A NH2 GLU 249.A OE1 no hydrogen 3.441 N/A ARG 177.A NH2 GLU 249.A OE2 no hydrogen 2.783 N/A GLU 178.A N PHE 175.A O no hydrogen 3.421 N/A THR 179.A N ARG 177.A O no hydrogen 2.809 N/A MET 182.A N GLU 178.A OE1 no hydrogen 2.789 N/A ASP 183.A N ARG 181.A O no hydrogen 2.968 N/A THR 185.A OG1 GLU 94.A OE1 no hydrogen 3.283 N/A THR 185.A OG1 GLU 94.A OE2 no hydrogen 2.441 N/A ARG 186.A N ASP 183.A OD1 no hydrogen 2.819 N/A ARG 186.A NH1 ALA 64.A O no hydrogen 2.827 N/A ARG 186.A NH1 SER 66.A O no hydrogen 2.679 N/A ARG 186.A NH2 SER 66.A O no hydrogen 2.999 N/A ARG 186.A NH2 GLU 93.A OE2 no hydrogen 2.964 N/A LEU 187.A N ASP 183.A O no hydrogen 2.972 N/A THR 188.A N ASP 184.A O no hydrogen 2.973 N/A THR 188.A OG1 ASP 184.A O no hydrogen 2.722 N/A THR 188.A OG1 THR 185.A O no hydrogen 3.162 N/A ALA 189.A N THR 185.A O no hydrogen 3.045 N/A LEU 190.A N ARG 186.A O no hydrogen 2.876 N/A GLY 191.A N LEU 187.A O no hydrogen 3.101 N/A ALA 192.A N THR 188.A O no hydrogen 3.057 N/A TYR 193.A N ALA 189.A O no hydrogen 2.859 N/A TYR 193.A OH PRO 90.A O no hydrogen 2.606 N/A ASP 194.A N LEU 190.A O no hydrogen 2.801 N/A ARG 195.A N GLY 191.A O no hydrogen 3.064 N/A ARG 195.A NH1 ASP 29.A OD2 no hydrogen 3.052 N/A ARG 195.A NH2 ASP 29.A OD1 no hydrogen 2.529 N/A LEU 196.A N ALA 192.A O no hydrogen 2.980 N/A THR 197.A N TYR 193.A O no hydrogen 2.838 N/A THR 197.A OG1 TYR 193.A O no hydrogen 3.106 N/A THR 197.A OG1 ASP 194.A O no hydrogen 3.409 N/A GLY 198.A N ASP 194.A O no hydrogen 3.009 N/A GLN 199.A N ARG 195.A O no hydrogen 3.076 N/A TRP 200.A N THR 197.A O no hydrogen 3.392 N/A ARG 201.A NH1 GLY 198.A O no hydrogen 2.968 N/A ARG 201.A NH1 TRP 200.A O no hydrogen 2.719 N/A ARG 203.A NH2 ASP 143.A OD2 no hydrogen 3.099 N/A THR 205.A OG1 TYR 135.A OH no hydrogen 2.831 N/A LEU 207.A N THR 205.A OG1 no hydrogen 3.216 N/A THR 209.A OG1 LEU 207.A O no hydrogen 2.824 N/A LEU 210.A N VAL 151.A O no hydrogen 2.789 N/A LEU 211.A N ASP 235.A O no hydrogen 2.798 N/A VAL 212.A N LEU 153.A O no hydrogen 2.874 N/A SER 213.A N.A VAL 237.A O no hydrogen 2.811 N/A SER 213.A N.B VAL 237.A O no hydrogen 2.814 N/A SER 213.A OG.A ALA 214.A O no hydrogen 2.982 N/A SER 213.A OG.B VAL 237.A O no hydrogen 3.096 N/A ALA 214.A N ASP 155.A OD2 no hydrogen 2.851 N/A GLY 215.A N GLY 241.A O no hydrogen 2.856 N/A TRP 221.A NE1 SER 225.A OG no hydrogen 2.960 N/A SER 225.A N ASP 223.A OD1 no hydrogen 2.942 N/A SER 225.A OG ASP 223.A OD1 no hydrogen 2.558 N/A THR 229.A N VAL 156.A O no hydrogen 3.273 N/A HIS 234.A ND1 PHE 232.A O no hydrogen 2.653 N/A ASP 235.A N THR 209.A O no hydrogen 2.761 N/A VAL 237.A N LEU 211.A O no hydrogen 2.953 N/A VAL 239.A N SER 213.A O.A no hydrogen 2.994 N/A VAL 239.A N SER 213.A O.B no hydrogen 3.011 N/A ASP 242.A N THR 245.A OG1 no hydrogen 3.006 N/A HIS 243.A ND1 ASP 155.A OD1 no hydrogen 2.642 N/A PHE 244.A N ASP 242.A OD1 no hydrogen 2.861 N/A THR 245.A N ASP 242.A OD1 no hydrogen 2.842 N/A THR 245.A OG1 ASP 242.A OD1 no hydrogen 3.437 N/A MET 246.A N ASP 242.A O no hydrogen 2.969 N/A GLN 248.A N THR 245.A O no hydrogen 3.260 N/A GLN 248.A NE2 GLU 70.A O no hydrogen 2.815 N/A GLU 249.A N GLU 249.A OE2 no hydrogen 2.667 N/A HIS 250.A N THR 245.A O no hydrogen 2.898 N/A ALA 251.A N GLN 248.A O no hydrogen 3.218 N/A ALA 253.A N HIS 250.A O no hydrogen 3.032 N/A ALA 255.A N ALA 251.A O no hydrogen 2.827 N/A ARG 256.A N ASP 252.A O no hydrogen 3.011 N/A ARG 256.A NH1 ASP 252.A OD2 no hydrogen 2.929 N/A HIS 257.A N ALA 253.A O no hydrogen 3.206 N/A ILE 258.A N ILE 254.A O no hydrogen 2.992 N/A ASP 259.A N ALA 255.A O no hydrogen 2.872 N/A ALA 260.A N ARG 256.A O no hydrogen 2.967 N/A TRP 261.A N HIS 257.A O no hydrogen 2.846 N/A LEU 262.A N ILE 258.A O no hydrogen 2.903 N/A GLY 263.A N ALA 260.A O no hydrogen 2.906 N/A