Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3w2x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N ILE 254.A O no hydrogen 2.804 N/A LYS 4.A N ASP 31.A OD2 no hydrogen 2.831 N/A LYS 4.A NZ GLU 28.A O no hydrogen 2.909 N/A LYS 4.A NZ GLU 28.A OE2 no hydrogen 2.733 N/A ILE 5.A N LEU 252.A O no hydrogen 2.783 N/A ILE 6.A N ILE 32.A O no hydrogen 2.939 N/A SER 7.A N ILE 250.A O no hydrogen 2.900 N/A TRP 8.A N CYS 34.A O no hydrogen 2.899 N/A TRP 8.A NE1 HIS 247.A O no hydrogen 2.870 N/A ASN 9.A ND2 ASP 150.A OD2 no hydrogen 2.896 N/A VAL 10.A N GLN 36.A O no hydrogen 3.034 N/A ASN 11.A N ASN 9.A OD1 no hydrogen 3.061 N/A GLY 12.A N GLU 37.A O no hydrogen 2.740 N/A LEU 13.A N ILE 38.A O no hydrogen 2.951 N/A VAL 16.A N GLY 12.A O no hydrogen 3.073 N/A HIS 17.A N LEU 13.A O no hydrogen 3.039 N/A ARG 18.A N ARG 14.A O no hydrogen 3.224 N/A LYS 19.A N VAL 16.A O no hydrogen 2.962 N/A LYS 19.A NZ GLY 244.A O no hydrogen 3.570 N/A PHE 21.A N VAL 16.A O no hydrogen 3.072 N/A LYS 23.A NZ GLU 27.A OE2 no hydrogen 3.301 N/A TRP 24.A N GLY 20.A O no hydrogen 3.019 N/A PHE 25.A N PHE 21.A O no hydrogen 2.843 N/A MET 26.A N LEU 22.A O no hydrogen 2.923 N/A GLU 27.A N LYS 23.A O no hydrogen 3.127 N/A GLU 28.A N TRP 24.A O no hydrogen 2.891 N/A LYS 29.A N PHE 25.A O no hydrogen 3.078 N/A LYS 29.A NZ MET 26.A O no hydrogen 3.344 N/A ASP 31.A N LYS 4.A O no hydrogen 2.828 N/A ILE 32.A N LYS 4.A O no hydrogen 3.219 N/A LEU 33.A N TYR 73.A O no hydrogen 2.770 N/A CYS 34.A N ILE 6.A O no hydrogen 2.770 N/A LEU 35.A N ALA 71.A O no hydrogen 2.805 N/A GLN 36.A N TRP 8.A O no hydrogen 2.881 N/A GLN 36.A NE2 SER 7.A OG no hydrogen 3.061 N/A GLN 36.A NE2 ASN 108.A OD1 no hydrogen 2.809 N/A ILE 38.A N GLY 69.A O no hydrogen 2.915 N/A LYS 39.A N SER 68.A O no hydrogen 2.833 N/A GLN 44.A N ALA 41.A O no hydrogen 2.992 N/A LEU 45.A N PRO 42.A O no hydrogen 3.105 N/A LEU 49.A N PRO 46.A O no hydrogen 2.989 N/A ARG 50.A N PRO 46.A O no hydrogen 2.954 N/A ARG 50.A NE SER 57.A OG no hydrogen 2.835 N/A ARG 50.A NH2 SER 57.A O no hydrogen 3.040 N/A ARG 50.A NH2 SER 57.A OG no hydrogen 3.250 N/A HIS 51.A N ARG 47.A O no hydrogen 2.817 N/A HIS 51.A NE2 GLU 53.A OE1 no hydrogen 2.918 N/A TYR 55.A N VAL 52.A O no hydrogen 3.045 N/A TYR 55.A OH PRO 30.A O no hydrogen 2.569 N/A ARG 56.A N THR 74.A O no hydrogen 2.754 N/A PHE 58.A N MET 72.A O no hydrogen 2.905 N/A THR 60.A N VAL 70.A O no hydrogen 2.857 N/A THR 60.A OG1 GLU 83.A OE1 no hydrogen 2.722 N/A GLU 63.A N THR 92.A O no hydrogen 2.839 N/A LYS 65.A NZ GLU 63.A O no hydrogen 3.256 N/A TYR 67.A N ARG 64.A O no hydrogen 3.334 N/A TYR 67.A OH GLU 93.A OE1 no hydrogen 3.385 N/A SER 68.A OG GLU 93.A O no hydrogen 2.679 N/A SER 68.A OG GLY 94.A O no hydrogen 3.299 N/A VAL 70.A N THR 60.A O no hydrogen 2.991 N/A ALA 71.A N LEU 35.A O no hydrogen 2.995 N/A MET 72.A N PHE 58.A O no hydrogen 2.854 N/A TYR 73.A N LEU 33.A O no hydrogen 2.830 N/A TYR 73.A OH ARG 50.A O no hydrogen 2.758 N/A THR 74.A N ARG 56.A O no hydrogen 2.879 N/A THR 74.A OG1 VAL 76.A O no hydrogen 2.644 N/A LYS 75.A N ASP 31.A O no hydrogen 3.052 N/A SER 79.A N ASP 100.A O no hydrogen 2.882 N/A SER 79.A OG ASP 100.A O no hydrogen 3.420 N/A ARG 82.A N ILE 98.A O no hydrogen 2.835 N/A ARG 82.A NH1 GLY 84.A O no hydrogen 2.764 N/A ARG 82.A NH1 ASP 134.A OD1 no hydrogen 2.799 N/A ARG 82.A NH1 ASP 134.A OD2 no hydrogen 3.506 N/A ARG 82.A NH2 ASP 134.A OD2 no hydrogen 2.865 N/A ARG 82.A NH2 GLU 138.A OE2 no hydrogen 3.037 N/A PHE 85.A N ASP 91.A OD1 no hydrogen 2.800 N/A GLY 86.A N ASP 91.A OD2 no hydrogen 2.713 N/A ARG 89.A NH1 GLU 126.A OE1 no hydrogen 2.553 N/A ARG 89.A NH2 GLU 126.A OE1 no hydrogen 3.026 N/A PHE 90.A N VAL 87.A O no hydrogen 2.749 N/A ASP 91.A N VAL 87.A O no hydrogen 3.183 N/A ASP 91.A N GLU 88.A O no hydrogen 3.127 N/A THR 92.A OG1 GLU 88.A O no hydrogen 3.298 N/A ARG 95.A NE GLU 93.A OE1 no hydrogen 2.792 N/A ARG 95.A NH1 TYR 110.A O no hydrogen 2.902 N/A ARG 95.A NH2 TYR 67.A OH no hydrogen 2.784 N/A ARG 95.A NH2 GLU 93.A OE1 no hydrogen 3.523 N/A GLN 97.A N ASN 108.A O no hydrogen 3.178 N/A GLN 97.A NE2 PHE 58.A O no hydrogen 3.013 N/A ILE 98.A N ARG 82.A O no hydrogen 2.800 N/A ALA 99.A N LEU 106.A O no hydrogen 2.838 N/A ASP 100.A N SER 80.A O no hydrogen 2.990 N/A PHE 101.A N PHE 104.A O no hydrogen 2.981 N/A LEU 105.A N ASN 144.A O no hydrogen 2.963 N/A LEU 106.A N ALA 99.A O no hydrogen 2.847 N/A TYR 107.A N ILE 146.A O no hydrogen 2.776 N/A TYR 107.A OH ASP 134.A OD2 no hydrogen 2.721 N/A ASN 108.A N GLN 97.A O no hydrogen 2.708 N/A ASN 108.A ND2 LEU 35.A O no hydrogen 3.428 N/A ASN 108.A ND2 GLN 97.A OE1 no hydrogen 2.995 N/A ILE 109.A N CYS 148.A O no hydrogen 2.968 N/A TYR 110.A N ARG 95.A O no hydrogen 2.935 N/A PHE 111.A N ASP 150.A O no hydrogen 2.894 N/A ASN 113.A ND2 ASN 152.A OD1 no hydrogen 2.879 N/A LYS 115.A N ASN 113.A OD1 no hydrogen 3.160 N/A LYS 115.A NZ SER 170.A O no hydrogen 3.093 N/A ARG 120.A N SER 117.A OG no hydrogen 3.245 N/A ARG 120.A NH1 GLU 93.A OE2 no hydrogen 3.158 N/A ARG 120.A NH2 GLU 93.A OE1 no hydrogen 3.033 N/A LEU 121.A N SER 117.A O no hydrogen 2.955 N/A LYS 122.A N GLU 118.A O no hydrogen 2.866 N/A LYS 122.A NZ GLU 126.A OE1 no hydrogen 3.505 N/A LYS 122.A NZ GLU 126.A OE2 no hydrogen 2.846 N/A TYR 123.A N GLU 119.A O no hydrogen 2.949 N/A TYR 123.A OH ARG 89.A O no hydrogen 2.514 N/A LYS 124.A N ARG 120.A O no hydrogen 2.856 N/A LYS 124.A NZ ASN 152.A O no hydrogen 2.804 N/A LYS 124.A NZ THR 153.A OG1 no hydrogen 2.819 N/A LYS 124.A NZ GLU 176.A OE2 no hydrogen 2.741 N/A LEU 125.A N LEU 121.A O no hydrogen 3.025 N/A GLU 126.A N LYS 122.A O no hydrogen 2.988 N/A PHE 127.A N TYR 123.A O no hydrogen 2.770 N/A TYR 128.A N LYS 124.A O no hydrogen 2.912 N/A TYR 128.A OH PHE 151.A O no hydrogen 2.619 N/A TYR 128.A OH THR 153.A OG1 no hydrogen 2.698 N/A ASP 129.A N LEU 125.A O no hydrogen 3.009 N/A ALA 130.A N GLU 126.A O no hydrogen 2.911 N/A PHE 131.A N PHE 127.A O no hydrogen 2.840 N/A LEU 132.A N TYR 128.A O no hydrogen 2.969 N/A GLU 133.A N ASP 129.A O no hydrogen 3.050 N/A ASP 134.A N ALA 130.A O no hydrogen 2.967 N/A VAL 135.A N PHE 131.A O no hydrogen 2.880 N/A ASN 136.A N LEU 132.A O no hydrogen 2.884 N/A ASN 136.A ND2 ASN 186.A OD1 no hydrogen 2.984 N/A ARG 137.A N GLU 133.A O no hydrogen 2.925 N/A ARG 137.A NH1 ASP 134.A OD1 no hydrogen 3.198 N/A ARG 137.A NH2 ASP 134.A OD1 no hydrogen 2.871 N/A GLU 138.A N ASP 134.A O no hydrogen 3.051 N/A ARG 139.A N VAL 135.A O no hydrogen 2.688 N/A ARG 139.A NE ASP 140.A OD1 no hydrogen 3.171 N/A ARG 139.A NH1 ASN 186.A O no hydrogen 2.781 N/A ARG 139.A NH2 ASP 140.A OD1 no hydrogen 3.075 N/A ASP 140.A N ASN 136.A O no hydrogen 2.675 N/A SER 141.A N ARG 137.A O no hydrogen 3.260 N/A SER 141.A N GLU 138.A O no hydrogen 3.192 N/A SER 141.A OG GLU 138.A O no hydrogen 2.742 N/A GLY 142.A N ARG 139.A O no hydrogen 3.126 N/A ARG 143.A N GLU 138.A O no hydrogen 3.213 N/A ARG 143.A NH1 ASP 100.A OD2 no hydrogen 3.104 N/A ARG 143.A NH2 ASP 100.A OD1 no hydrogen 2.960 N/A VAL 145.A N ASN 226.A OD1 no hydrogen 2.823 N/A ILE 146.A N LEU 105.A O no hydrogen 2.863 N/A ILE 147.A N PHE 224.A O no hydrogen 2.801 N/A CYS 148.A N TYR 107.A O no hydrogen 2.876 N/A CYS 148.A SG TYR 107.A O no hydrogen 3.823 N/A GLY 149.A N TYR 222.A O no hydrogen 3.282 N/A ASP 150.A N ILE 109.A O no hydrogen 3.186 N/A PHE 151.A N LEU 220.A O no hydrogen 2.822 N/A ASN 152.A N ASP 150.A OD1 no hydrogen 2.923 N/A ASN 152.A ND2 PHE 111.A O no hydrogen 2.923 N/A THR 153.A OG1 TYR 128.A OH no hydrogen 2.698 N/A ALA 154.A N GLY 171.A O no hydrogen 2.929 N/A HIS 155.A NE2 ASP 181.A OD1 no hydrogen 2.693 N/A ARG 156.A N ASP 159.A OD2 no hydrogen 2.773 N/A ASP 159.A N ARG 156.A O no hydrogen 2.846 N/A ALA 161.A N GLY 217.A O no hydrogen 2.981 N/A ASN 166.A N PRO 163.A O no hydrogen 3.359 N/A ASN 166.A ND2 ARG 162.A O no hydrogen 2.995 N/A SER 167.A N LYS 164.A O no hydrogen 3.291 N/A SER 167.A OG LYS 164.A O no hydrogen 3.460 N/A VAL 169.A N ASN 166.A O no hydrogen 3.021 N/A SER 170.A OG GLU 176.A OE2 no hydrogen 2.753 N/A GLY 171.A N GLU 176.A OE1 no hydrogen 2.688 N/A GLY 171.A N GLU 176.A OE2 no hydrogen 3.306 N/A PHE 172.A N VAL 169.A O no hydrogen 2.954 N/A LEU 173.A N GLU 176.A OE1 no hydrogen 3.012 N/A ARG 177.A N LEU 173.A O no hydrogen 3.031 N/A ARG 177.A NE HIS 155.A O no hydrogen 3.121 N/A ALA 178.A N PRO 174.A O no hydrogen 2.872 N/A TRP 179.A N VAL 175.A O no hydrogen 3.174 N/A ILE 180.A N GLU 176.A O no hydrogen 3.274 N/A ASP 181.A N ARG 177.A O no hydrogen 3.062 N/A LYS 182.A N ALA 178.A O no hydrogen 2.878 N/A PHE 183.A N TRP 179.A O no hydrogen 2.705 N/A ILE 184.A N ILE 180.A O no hydrogen 2.870 N/A GLU 185.A N ASP 181.A O no hydrogen 2.749 N/A ASN 186.A N LYS 182.A O no hydrogen 2.882 N/A ASN 186.A N PHE 183.A O no hydrogen 3.126 N/A ASN 186.A ND2 LYS 182.A O no hydrogen 2.921 N/A GLY 187.A N ILE 184.A O no hydrogen 2.853 N/A TYR 188.A N ILE 184.A O no hydrogen 3.357 N/A TYR 188.A OH ASN 136.A OD1 no hydrogen 2.815 N/A VAL 189.A N VAL 225.A O no hydrogen 2.777 N/A THR 191.A N PHE 223.A O no hydrogen 2.965 N/A THR 191.A OG1 PHE 223.A O no hydrogen 2.709 N/A THR 191.A OG1 SER 236.A OG no hydrogen 2.753 N/A ARG 193.A N ASP 190.A O no hydrogen 3.123 N/A ARG 193.A NH1 ASN 196.A O no hydrogen 3.047 N/A ARG 193.A NH1 ASP 198.A O no hydrogen 2.817 N/A ARG 193.A NH2 ASP 159.A OD1 no hydrogen 2.756 N/A MET 194.A N THR 191.A O no hydrogen 3.034 N/A PHE 195.A N PHE 192.A O no hydrogen 3.131 N/A ASN 196.A N PHE 192.A O no hydrogen 2.961 N/A ASP 198.A N ASN 196.A OD1 no hydrogen 2.816 N/A THR 203.A N TRP 218.A O no hydrogen 2.907 N/A THR 203.A OG1 ASP 221.A OD2 no hydrogen 2.713 N/A TRP 204.A N TRP 218.A O no hydrogen 2.928 N/A TRP 204.A NE1 ASP 246.A OD2 no hydrogen 2.899 N/A TRP 205.A N ASP 246.A O no hydrogen 3.049 N/A TRP 205.A NE1 ASN 215.A OD1 no hydrogen 3.005 N/A ARG 208.A N SER 206.A OG no hydrogen 3.046 N/A ALA 211.A N ARG 208.A O no hydrogen 3.236 N/A ARG 212.A NH2 SER 240.A O no hydrogen 2.909 N/A ARG 212.A NH2 VAL 242.A O no hydrogen 2.922 N/A ARG 214.A N ARG 210.A O no hydrogen 3.034 N/A ASN 215.A N ARG 212.A O no hydrogen 3.185 N/A ASN 215.A ND2 GLY 200.A O no hydrogen 3.110 N/A VAL 216.A N ALA 211.A O no hydrogen 2.914 N/A TRP 218.A N TRP 204.A O no hydrogen 2.904 N/A ARG 219.A N ASP 159.A O no hydrogen 2.723 N/A ARG 219.A NE ASP 159.A OD1 no hydrogen 2.829 N/A ARG 219.A NH1 ASP 159.A OD1 no hydrogen 3.028 N/A ARG 219.A NH1 ASP 190.A OD2 no hydrogen 2.756 N/A ARG 219.A NH2 ASP 190.A OD1 no hydrogen 3.089 N/A ARG 219.A NH2 ASP 190.A OD2 no hydrogen 3.375 N/A LEU 220.A N THR 203.A OG1 no hydrogen 2.998 N/A ASP 221.A N THR 203.A OG1 no hydrogen 3.128 N/A TYR 222.A N GLY 149.A O no hydrogen 3.172 N/A TYR 222.A OH THR 153.A O no hydrogen 2.730 N/A PHE 224.A N ILE 147.A O no hydrogen 2.784 N/A VAL 225.A N VAL 189.A O no hydrogen 3.249 N/A ASN 226.A N VAL 145.A O no hydrogen 3.399 N/A ASN 226.A ND2 ASN 144.A OD1 no hydrogen 3.057 N/A ASN 226.A ND2 GLU 228.A OE1 no hydrogen 3.036 N/A GLU 227.A N GLY 187.A O no hydrogen 2.955 N/A GLU 228.A N GLU 228.A OE1 no hydrogen 2.796 N/A PHE 229.A N ASN 226.A O no hydrogen 2.957 N/A LYS 230.A N GLU 227.A O no hydrogen 3.210 N/A LYS 230.A NZ GLU 227.A OE1 no hydrogen 3.196 N/A LYS 232.A N PHE 229.A O no hydrogen 3.068 N/A LYS 232.A NZ GLU 255.A O.A no hydrogen 3.034 N/A LYS 232.A NZ GLU 255.A O.B no hydrogen 2.979 N/A VAL 233.A N LYS 230.A O no hydrogen 2.941 N/A LYS 234.A N GLU 253.A O no hydrogen 2.864 N/A LYS 234.A NZ GLU 255.A OE1.A no hydrogen 2.776 N/A LYS 234.A NZ GLU 255.A OE1.B no hydrogen 3.306 N/A ARG 235.A N GLU 253.A O no hydrogen 3.326 N/A ARG 235.A NH1 GLU 253.A OE1 no hydrogen 3.344 N/A SER 236.A OG THR 191.A OG1 no hydrogen 2.753 N/A TRP 237.A N GLY 251.A O no hydrogen 2.988 N/A LEU 239.A N PRO 249.A O no hydrogen 2.920 N/A SER 240.A OG ILE 238.A O no hydrogen 3.481 N/A VAL 242.A N LEU 239.A O no hydrogen 3.307 N/A SER 245.A OG ASN 9.A O no hydrogen 2.698 N/A SER 245.A OG ASP 246.A OD1 no hydrogen 3.459 N/A HIS 247.A N SER 245.A OG no hydrogen 3.174 N/A HIS 247.A ND1 ASP 221.A OD2 no hydrogen 2.589 N/A CYS 248.A N THR 203.A O no hydrogen 3.003 N/A CYS 248.A SG TYR 202.A O no hydrogen 4.032 N/A CYS 248.A SG PRO 249.A O no hydrogen 3.646 N/A ILE 250.A N SER 7.A O no hydrogen 2.863 N/A GLY 251.A N TRP 237.A O no hydrogen 2.777 N/A LEU 252.A N ILE 5.A O no hydrogen 2.788 N/A GLU 253.A N ARG 235.A O no hydrogen 2.916 N/A ILE 254.A N LEU 3.A O no hydrogen 2.858 N/A GLU 255.A N.A LYS 232.A O no hydrogen 2.901 N/A GLU 255.A N.B LYS 232.A O no hydrogen 2.907 N/A