Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vvu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 131.A O no hydrogen 3.254 N/A ILE 1.A N ARG 132.A O no hydrogen 2.646 N/A ILE 1.A N ASP 184.A OD2 no hydrogen 2.738 N/A VAL 2.A N ASP 179.A O no hydrogen 2.752 N/A GLY 4.A N GLU 178.A OE2 no hydrogen 2.824 N/A GLN 5.A N MET 145.A O no hydrogen 2.865 N/A CYS 7.A N LEU 143.A O no hydrogen 2.622 N/A CYS 7.A SG LYS 8.A O no hydrogen 3.791 N/A LYS 8.A NZ GLN 5.A OE1 no hydrogen 2.638 N/A GLY 10.A N ASN 103.A OD1 no hydrogen 2.737 N/A GLU 11.A N LYS 8.A O no hydrogen 3.048 N/A GLN 15.A N CYS 12.A O no hydrogen 3.148 N/A GLN 15.A NE2 ALA 16.A O no hydrogen 3.043 N/A ALA 16.A N GLY 29.A O no hydrogen 2.938 N/A LEU 17.A N ARG 53.A O no hydrogen 2.752 N/A LEU 18.A N CYS 27.A O no hydrogen 2.826 N/A ILE 19.A N LYS 51.A O no hydrogen 2.699 N/A ASN 20.A N GLU 24.A O no hydrogen 2.616 N/A ASN 23.A N ASN 20.A O no hydrogen 2.693 N/A ASN 23.A ND2 GLU 21.A O no hydrogen 3.663 N/A PHE 26.A N LEU 18.A O no hydrogen 3.329 N/A CYS 27.A SG PHE 26.A O no hydrogen 3.270 N/A CYS 27.A SG GLN 46.A OE1 no hydrogen 3.874 N/A CYS 27.A SG SER 185.A O no hydrogen 3.332 N/A GLY 28.A N SER 185.A O no hydrogen 2.822 N/A GLY 29.A N ALA 16.A O no hydrogen 2.879 N/A THR 30.A N LEU 38.A O no hydrogen 2.740 N/A ILE 31.A N TRP 14.A O no hydrogen 2.719 N/A LEU 32.A N TYR 36.A O no hydrogen 2.952 N/A SER 33.A N TYR 36.A O no hydrogen 3.337 N/A TYR 36.A N SER 33.A O no hydrogen 3.274 N/A ILE 37.A N LEU 92.A O no hydrogen 2.858 N/A LEU 38.A N THR 30.A O no hydrogen 2.884 N/A THR 39.A N ALA 90.A O no hydrogen 2.896 N/A THR 39.A OG1 GLY 28.A O no hydrogen 2.795 N/A HIS 42.A N ASP 88.A OD1 no hydrogen 2.879 N/A HIS 42.A ND1 ASP 88.A OD2 no hydrogen 2.522 N/A CYS 43.A N ALA 40.A O no hydrogen 2.860 N/A CYS 43.A SG SER 185.A O no hydrogen 3.491 N/A LEU 44.A N ALA 41.A O no hydrogen 2.883 N/A LYS 51.A N ILE 19.A O no hydrogen 3.224 N/A LYS 51.A NZ GLU 70.A OE1 no hydrogen 2.822 N/A VAL 52.A N HIS 69.A O no hydrogen 3.001 N/A ARG 53.A N LEU 17.A O no hydrogen 2.653 N/A ARG 53.A NH1 ASP 56.A OD2 no hydrogen 3.279 N/A VAL 54.A N ALA 67.A O no hydrogen 3.379 N/A ASN 58.A N ASP 56.A OD1 no hydrogen 2.874 N/A THR 59.A N THR 141.A O no hydrogen 3.146 N/A GLU 60.A N ASN 58.A OD1 no hydrogen 2.958 N/A GLN 61.A N ASN 58.A O no hydrogen 2.771 N/A GLN 61.A NE2 GLU 63.A OE1 no hydrogen 3.349 N/A GLU 63.A N GLU 66.A OE1 no hydrogen 2.849 N/A GLY 64.A N GLU 66.A OE2 no hydrogen 3.130 N/A GLU 66.A N GLU 66.A OE2 no hydrogen 2.770 N/A HIS 69.A N VAL 52.A O no hydrogen 2.981 N/A HIS 69.A ND1 THR 96.A O no hydrogen 2.820 N/A GLU 72.A N ARG 93.A O no hydrogen 2.683 N/A VAL 73.A N ARG 93.A O no hydrogen 3.193 N/A ILE 75.A N VAL 91.A O no hydrogen 2.975 N/A LYS 76.A NZ TYR 45.A OH no hydrogen 3.009 N/A HIS 77.A N ILE 89.A O no hydrogen 3.102 N/A ARG 79.A N HIS 77.A ND1 no hydrogen 3.064 N/A PHE 80.A N HIS 77.A O no hydrogen 2.809 N/A THR 81.A OG1 GLU 83.A OE1 no hydrogen 2.714 N/A THR 84.A N THR 81.A O no hydrogen 3.220 N/A THR 84.A OG1 THR 81.A O no hydrogen 3.544 N/A TYR 85.A N THR 81.A O no hydrogen 2.660 N/A ASP 86.A N THR 84.A OG1 no hydrogen 3.161 N/A PHE 87.A N ASP 86.A OD1 no hydrogen 2.814 N/A ILE 89.A N PHE 87.A O no hydrogen 2.925 N/A ALA 90.A N THR 39.A O no hydrogen 2.998 N/A VAL 91.A N ILE 75.A O no hydrogen 2.959 N/A LEU 92.A N ILE 37.A O no hydrogen 2.806 N/A ARG 93.A N VAL 73.A O no hydrogen 2.979 N/A ARG 93.A NH1 TYR 36.A OH no hydrogen 2.779 N/A LEU 94.A N PHE 35.A O no hydrogen 2.920 N/A LYS 95.A N GLU 70.A O no hydrogen 2.924 N/A LYS 95.A NZ VAL 71.A O no hydrogen 3.494 N/A THR 96.A OG1 HIS 69.A ND1 no hydrogen 3.357 N/A ILE 98.A N GLU 34.A O no hydrogen 2.738 N/A ARG 101.A N VAL 104.A O no hydrogen 3.005 N/A ARG 101.A NE GLY 65.A O no hydrogen 2.974 N/A ARG 101.A NH2 GLY 65.A O no hydrogen 2.516 N/A ASN 103.A ND2 ASP 9.A OD1 no hydrogen 3.084 N/A VAL 104.A N ARG 101.A O no hydrogen 2.712 N/A ALA 105.A N PRO 13.A O no hydrogen 3.050 N/A ALA 107.A N ILE 31.A O no hydrogen 3.016 N/A CYS 108.A N TYR 197.A O no hydrogen 3.183 N/A CYS 108.A SG TYR 197.A O no hydrogen 3.998 N/A ARG 112.A NE GLU 116.A OE2 no hydrogen 2.890 N/A ARG 112.A NH2 GLU 116.A OE2 no hydrogen 3.537 N/A ASP 113.A N GLU 111A.A OE2 no hydrogen 3.339 N/A TRP 114.A N GLU 111A.A OE1 no hydrogen 3.139 N/A ALA 115.A N GLU 111A.A O no hydrogen 3.075 N/A GLU 116.A N ARG 112.A O no hydrogen 3.023 N/A SER 117.A N ASP 113.A O no hydrogen 3.021 N/A SER 117.A OG ASP 113.A O no hydrogen 3.212 N/A SER 117.A OG TRP 114.A O no hydrogen 3.519 N/A SER 117.A OG THR 118.A OG1 no hydrogen 3.398 N/A THR 118.A OG1 TRP 114.A O no hydrogen 3.058 N/A THR 118.A OG1 SER 117.A OG no hydrogen 3.398 N/A THR 121.A OG1 SER 117.A O no hydrogen 2.977 N/A GLN 122.A N LEU 119A.A O no hydrogen 3.085 N/A GLN 122.A NE2 THR 118.A O no hydrogen 2.408 N/A THR 124.A OG1 GLU 147.A OE1 no hydrogen 2.777 N/A GLY 125.A N VAL 148.A O no hydrogen 2.756 N/A ILE 126.A N VAL 190.A O no hydrogen 2.894 N/A VAL 127.A N LEU 146.A O no hydrogen 2.945 N/A SER 128.A OG GLN 15.A OE1 no hydrogen 2.596 N/A GLY 129.A N LYS 144.A O no hydrogen 2.863 N/A GLY 131.A N ASP 184.A OD1 no hydrogen 2.892 N/A ARG 132.A N GLN 182.A O no hydrogen 2.859 N/A ARG 132.A NH1 GLU 135.A O no hydrogen 3.254 N/A GLY 137.A N HIS 134.A O no hydrogen 2.631 N/A GLN 139.A NE2 PHE 130.A O no hydrogen 2.789 N/A SER 140.A N PHE 130.A O no hydrogen 3.250 N/A SER 140.A N GLY 131.A O no hydrogen 3.453 N/A SER 140.A OG ARG 142.A O no hydrogen 2.652 N/A THR 141.A OG1 GLU 60.A OE1 no hydrogen 3.338 N/A ARG 142.A N SER 140.A OG no hydrogen 2.978 N/A ARG 142.A NH1 GLU 6.A OE2 no hydrogen 3.001 N/A LEU 143.A N ARG 57.A O no hydrogen 2.910 N/A LYS 144.A N GLY 129.A O no hydrogen 3.168 N/A LYS 144.A NZ ILE 1.A O no hydrogen 2.648 N/A LYS 144.A NZ GLY 3.A O no hydrogen 2.775 N/A MET 145.A N GLN 5.A O no hydrogen 2.805 N/A LEU 146.A N VAL 127.A O no hydrogen 2.712 N/A VAL 148.A N GLY 125.A O no hydrogen 2.696 N/A TYR 150.A N LYS 123.A O no hydrogen 3.027 N/A TYR 150.A OH THR 191.A OG1 no hydrogen 2.652 N/A VAL 151.A N CYS 170.A O no hydrogen 3.140 N/A ARG 153.A NH1 THR 165.A O no hydrogen 2.891 N/A ASN 154.A N ASP 152.A OD1 no hydrogen 3.143 N/A SER 155.A N ASP 152.A OD1 no hydrogen 3.321 N/A SER 155.A OG ASP 152.A OD2 no hydrogen 2.772 N/A CYS 156.A N ASP 152.A O no hydrogen 2.999 N/A LYS 157.A N ARG 153.A O no hydrogen 2.898 N/A LEU 158.A N ASN 154.A O no hydrogen 3.025 N/A SER 159.A N SER 155.A O no hydrogen 3.075 N/A SER 159.A OG SER 155.A O no hydrogen 3.330 N/A SER 159.A OG CYS 156.A O no hydrogen 2.795 N/A SER 160.A N LYS 157.A O no hydrogen 3.338 N/A SER 160.A OG PHE 162.A O no hydrogen 2.673 N/A SER 161.A N GLU 207.A OE2 no hydrogen 2.868 N/A SER 161.A OG GLU 207.A OE1 no hydrogen 2.917 N/A SER 161.A OG GLU 207.A OE2 no hydrogen 3.072 N/A PHE 162.A N SER 160.A OG no hydrogen 2.822 N/A THR 165.A OG1 ASP 86.A OD1 no hydrogen 2.729 N/A ASN 167.A N THR 165.A OG1 no hydrogen 3.045 N/A ASN 167.A ND2 ASP 86.A OD1 no hydrogen 2.737 N/A ASN 167.A ND2 ASP 86.A OD2 no hydrogen 3.349 N/A MET 168.A N THR 165.A O no hydrogen 3.162 N/A PHE 169.A N TYR 218.A O no hydrogen 2.895 N/A ALA 171.A N GLY 216.A O no hydrogen 2.814 N/A GLY 172.A N PRO 149.A O no hydrogen 3.022 N/A TYR 173.A OH GLU 147.A O no hydrogen 3.140 N/A LYS 176.A NZ GLU 178.A OE1 no hydrogen 2.309 N/A GLN 177.A NE2 ALA 210.A O no hydrogen 2.942 N/A GLN 177.A NE2 THR 175B.A O no hydrogen 2.543 N/A GLU 178.A N LYS 176.A O no hydrogen 2.876 N/A ASP 179.A N VAL 2.A O no hydrogen 2.948 N/A ALA 180.A N ASP 179.A OD1 no hydrogen 2.600 N/A CYS 181.A N ASP 184.A OD2 no hydrogen 3.012 N/A ASP 184.A N CYS 181.A O no hydrogen 3.097 N/A SER 185.A OG HIS 42.A NE2 no hydrogen 3.170 N/A SER 185.A OG SER 204.A O no hydrogen 3.275 N/A GLY 186.A N VAL 203.A O no hydrogen 2.842 N/A GLY 187.A N ASP 184.A O no hydrogen 2.801 N/A HIS 189.A N GLY 201.A O no hydrogen 3.180 N/A HIS 189.A ND1 THR 200.A OG1 no hydrogen 2.807 N/A VAL 190.A N ILE 126.A O no hydrogen 2.925 N/A THR 191.A N PHE 198.A O no hydrogen 2.675 N/A THR 191.A OG1 TYR 150.A OH no hydrogen 2.652 N/A THR 191.A OG1 THR 200.A OG1 no hydrogen 2.737 N/A ARG 192.A NH2 ASP 195.A OD1 no hydrogen 2.854 N/A PHE 193.A N THR 196.A O no hydrogen 2.723 N/A THR 196.A N PHE 193.A O no hydrogen 2.949 N/A PHE 198.A N THR 191.A O no hydrogen 2.941 N/A VAL 199.A N CYS 108.A O no hydrogen 2.787 N/A THR 200.A N HIS 189.A O no hydrogen 2.859 N/A THR 200.A OG1 HIS 189.A ND1 no hydrogen 2.807 N/A THR 200.A OG1 HIS 189.A O no hydrogen 3.389 N/A THR 200.A OG1 THR 191.A OG1 no hydrogen 2.737 N/A GLY 201.A N HIS 189.A O no hydrogen 3.174 N/A ILE 202.A N THR 219.A O no hydrogen 3.251 N/A VAL 203.A N GLY 187.A O no hydrogen 2.977 N/A SER 204.A N ILE 217.A O no hydrogen 3.035 N/A SER 204.A OG ASP 88.A OD2 no hydrogen 3.244 N/A TRP 205.A N ILE 217.A O no hydrogen 2.954 N/A CYS 209.A N GLU 135.A OE1 no hydrogen 3.357 N/A ALA 210.A N ASP 179.A OD2 no hydrogen 3.176 N/A ARG 211.A NE GLU 135.A OE1 no hydrogen 3.226 N/A ARG 211.A NE GLU 135.A OE2 no hydrogen 3.336 N/A ARG 211.A NH2 GLU 135.A OE2 no hydrogen 2.778 N/A LYS 214.A N ARG 211.A O no hydrogen 3.179 N/A LYS 214.A NZ SER 159.A O no hydrogen 3.112 N/A LYS 214.A NZ GLU 207.A OE1 no hydrogen 2.752 N/A LYS 214.A NZ GLU 207.A OE2 no hydrogen 3.120 N/A GLY 216.A N ALA 171.A O no hydrogen 2.800 N/A ILE 217.A N TRP 205.A O no hydrogen 2.752 N/A TYR 218.A N PHE 169.A O no hydrogen 2.858 N/A THR 219.A N ILE 202.A O no hydrogen 2.827 N/A THR 219.A OG1 ASP 88.A O no hydrogen 2.505 N/A LYS 220.A N ASN 167.A O no hydrogen 2.786 N/A LYS 220.A NZ GLN 166.A O no hydrogen 2.817 N/A VAL 221.A N THR 200.A O no hydrogen 3.268 N/A ALA 223.A N LYS 220.A O no hydrogen 2.926 N/A PHE 224.A N VAL 221.A O no hydrogen 2.935 N/A ILE 228.A N PHE 224.A O no hydrogen 2.834 N/A ASP 229.A N LEU 225.A O no hydrogen 3.282 N/A ARG 230.A N LYS 226.A O no hydrogen 3.068 N/A SER 231.A N TRP 227.A O no hydrogen 2.994 N/A SER 231.A OG TRP 227.A O no hydrogen 2.432 N/A MET 232.A N ILE 228.A O no hydrogen 2.918 N/A LYS 233.A N ARG 230.A O no hydrogen 2.872 N/A THR 234.A N ASP 229.A O no hydrogen 2.976 N/A LEU 119A.A N ALA 115.A O no hydrogen 2.818 N/A GLY 213A.A N ASP 174A.A O no hydrogen 2.795 N/A GLY 213A.A N ASP 174A.A OD1 no hydrogen 2.955 N/A MET 120B.A N ALA 115.A O no hydrogen 2.811 N/A