Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2qs2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 80.A OD1 no hydrogen 3.088 N/A ARG 1.A NH2 ASP 80.A OD1 no hydrogen 2.789 N/A LEU 3.A N LEU 47.A O no hydrogen 2.840 N/A ILE 4.A N ASP 80.A OD2 no hydrogen 2.822 N/A VAL 5.A N ASP 49.A O.A no hydrogen 2.936 N/A VAL 5.A N ASP 49.A O.B no hydrogen 2.804 N/A THR 6.A N LEU 81.A O no hydrogen 2.832 N/A THR 7.A N LYS 51.A O.A no hydrogen 3.406 N/A THR 7.A N LYS 51.A O.B no hydrogen 3.218 N/A THR 7.A OG1 VAL 83.A O no hydrogen 2.641 N/A ILE 8.A N THR 7.A OG1 no hydrogen 2.827 N/A GLU 10.A N VAL 14.A O no hydrogen 2.903 N/A TYR 13.A N GLU 10.A O no hydrogen 2.677 N/A VAL 14.A N GLU 10.A O no hydrogen 2.937 N/A MET 15.A N.A GLU 30.A O no hydrogen 2.849 N/A MET 15.A N.B GLU 30.A O no hydrogen 2.865 N/A ARG 17.A N ARG 28.A O no hydrogen 2.942 N/A ARG 17.A NE GLU 30.A OE1 no hydrogen 2.920 N/A SER 19.A N ARG 17.A O no hydrogen 2.885 N/A LYS 21.A N SER 19.A OG no hydrogen 3.030 N/A ASN 26.A ND2 TYR 48.A O no hydrogen 2.816 N/A ASP 27.A N TYR 24.A O no hydrogen 3.042 N/A ARG 28.A N GLY 25.A O no hydrogen 3.286 N/A ARG 28.A NE GLY 25.A O no hydrogen 2.736 N/A ARG 28.A NH2 GLY 25.A O no hydrogen 3.443 N/A PHE 29.A N ASN 26.A O no hydrogen 3.180 N/A GLU 30.A N MET 15.A O.A no hydrogen 2.881 N/A GLU 30.A N MET 15.A O.B no hydrogen 2.806 N/A TYR 32.A N PRO 12.A O no hydrogen 2.950 N/A CYS 33.A N TYR 13.A O no hydrogen 2.923 N/A ASP 35.A N GLY 31.A O no hydrogen 2.978 N/A LEU 36.A N TYR 32.A O no hydrogen 2.845 N/A LEU 37.A N CYS 33.A O no hydrogen 2.885 N/A LYS 38.A N LEU 34.A O no hydrogen 2.951 N/A LYS 38.A NZ TYR 48.A OH no hydrogen 2.943 N/A GLU 39.A N ASP 35.A O no hydrogen 3.051 N/A LEU 40.A N LEU 36.A O no hydrogen 2.854 N/A SER 41.A N.A LEU 37.A O no hydrogen 2.875 N/A SER 41.A N.B LEU 37.A O no hydrogen 2.877 N/A SER 41.A OG.A PHE 46.A O no hydrogen 2.609 N/A SER 41.A OG.B LEU 37.A O no hydrogen 3.561 N/A SER 41.A OG.B LYS 38.A O no hydrogen 2.684 N/A ASN 42.A N LYS 38.A O no hydrogen 3.074 N/A ILE 43.A N GLU 39.A O no hydrogen 2.997 N/A LEU 44.A N LEU 40.A O no hydrogen 2.895 N/A GLY 45.A N SER 41.A O.A no hydrogen 2.707 N/A GLY 45.A N SER 41.A O.B no hydrogen 2.918 N/A PHE 46.A N SER 41.A O.A no hydrogen 3.200 N/A PHE 46.A N SER 41.A O.B no hydrogen 3.181 N/A ASP 49.A N.A LEU 3.A O no hydrogen 2.800 N/A ASP 49.A N.B LEU 3.A O no hydrogen 2.779 N/A VAL 50.A N ASN 26.A OD1 no hydrogen 2.853 N/A LYS 51.A N.A VAL 5.A O no hydrogen 2.851 N/A LYS 51.A N.B VAL 5.A O no hydrogen 2.840 N/A VAL 53.A N THR 7.A O no hydrogen 2.898 N/A GLY 56.A N VAL 53.A O no hydrogen 3.012 N/A LYS 57.A N ASP 55.A OD1 no hydrogen 3.047 N/A TYR 58.A OH GLU 10.A OE2 no hydrogen 2.512 N/A ALA 60.A N ASN 68.A OD1 no hydrogen 2.815 N/A ASN 62.A N GLU 66.A O no hydrogen 2.896 N/A ASN 62.A ND2 GLU 66.A OE1 no hydrogen 3.420 N/A LYS 64.A N ASN 62.A OD1 no hydrogen 2.895 N/A GLY 65.A N ASN 62.A O no hydrogen 2.981 N/A GLU 66.A N ASN 62.A OD1 no hydrogen 2.967 N/A ASN 68.A N ALA 60.A O no hydrogen 3.165 N/A GLY 69.A N ASP 55.A OD2 no hydrogen 2.936 N/A MET 70.A N LYS 57.A O no hydrogen 3.173 N/A VAL 71.A N TYR 58.A O no hydrogen 3.450 N/A LYS 72.A N ASN 68.A O no hydrogen 3.084 N/A LYS 72.A NZ ASP 76.A OD2 no hydrogen 2.724 N/A GLU 73.A N GLY 69.A O no hydrogen 3.219 N/A LEU 74.A N MET 70.A O no hydrogen 3.088 N/A ILE 75.A N VAL 71.A O no hydrogen 2.976 N/A ASP 76.A N LYS 72.A O no hydrogen 2.875 N/A HIS 77.A N LEU 74.A O no hydrogen 3.038 N/A ARG 78.A N GLU 73.A O no hydrogen 2.854 N/A ARG 78.A NH2 ASP 76.A OD2 no hydrogen 2.710 N/A ALA 79.A N GLU 73.A O no hydrogen 3.256 N/A ASP 80.A N ILE 4.A O no hydrogen 2.720 N/A LEU 81.A N ILE 4.A O no hydrogen 3.239 N/A ALA 82.A N GLY 216.A O no hydrogen 2.803 N/A VAL 83.A N THR 6.A O no hydrogen 3.121 N/A LEU 86.A N ALA 84.A O no hydrogen 2.774 N/A ILE 88.A N GLY 212.A O no hydrogen 2.848 N/A ARG 92.A N THR 89.A OG1 no hydrogen 3.348 N/A ARG 92.A NE GLY 59.A O no hydrogen 3.223 N/A ARG 92.A NH1 THR 87.A O no hydrogen 3.001 N/A ARG 92.A NH2 GLY 59.A O no hydrogen 2.943 N/A GLU 93.A N THR 89.A O no hydrogen 3.005 N/A LYS 94.A N VAL 91.A O no hydrogen 3.236 N/A LYS 94.A NZ TYR 90.A OH no hydrogen 3.310 N/A VAL 95.A N ARG 92.A O no hydrogen 2.930 N/A ILE 96.A N ARG 92.A O no hydrogen 2.910 N/A ASP 97.A N THR 217.A O no hydrogen 2.832 N/A SER 99.A N VAL 215.A O no hydrogen 2.848 N/A SER 99.A OG LYS 100.A O no hydrogen 2.880 N/A LYS 100.A N THR 228.A OG1 no hydrogen 2.903 N/A PHE 102.A N TYR 213.A O no hydrogen 2.933 N/A LEU 105.A N LYS 211.A O no hydrogen 2.899 N/A GLY 106.A N SER 188.A OG no hydrogen 3.043 N/A ILE 107.A N ASP 209.A OD1 no hydrogen 2.886 N/A SER 108.A N MET 186.A O no hydrogen 2.713 N/A SER 108.A OG ILE 204.A O no hydrogen 3.559 N/A SER 108.A OG GLY 206.A O no hydrogen 2.825 N/A LEU 110.A N LEU 184.A O no hydrogen 2.717 N/A TYR 111.A N THR 202.A O no hydrogen 2.982 N/A TYR 111.A OH ASP 181.A OD1 no hydrogen 2.832 N/A ARG 112.A NH1 TYR 182.A O no hydrogen 2.890 N/A ARG 112.A NH2 TYR 182.A O no hydrogen 2.793 N/A LYS 113.A N ASN 200.A O no hydrogen 3.204 N/A LYS 113.A NZ CYS 199.A O no hydrogen 2.557 N/A LYS 113.A NZ LEU 201.A O no hydrogen 3.059 N/A ASP 118.A N ASP 122.A OD2 no hydrogen 2.861 N/A ALA 124.A N ALA 120.A O no hydrogen 2.888 N/A LYS 125.A N ASP 121.A O no hydrogen 3.404 N/A GLN 126.A N LEU 123.A O no hydrogen 3.264 N/A GLN 126.A NE2 LEU 123.A O no hydrogen 2.968 N/A GLN 126.A NE2 ILE 129.A O no hydrogen 3.031 N/A ILE 129.A N GLN 126.A OE1 no hydrogen 2.702 N/A GLU 130.A N ASP 181.A O no hydrogen 3.261 N/A GLY 132.A N ALA 183.A O no hydrogen 3.292 N/A ARG 135.A N VAL 167.A O no hydrogen 2.774 N/A ARG 135.A NH2 GLN 162.A O no hydrogen 3.413 N/A ARG 135.A NH2 LEU 166.A O no hydrogen 3.438 N/A GLY 137.A N VAL 134.A O no hydrogen 3.397 N/A THR 141.A N GLY 137.A O no hydrogen 3.044 N/A THR 141.A OG1 GLY 137.A O no hydrogen 2.778 N/A PHE 142.A N SER 138.A O no hydrogen 2.883 N/A PHE 143.A N THR 139.A O no hydrogen 3.374 N/A LYS 144.A N MET 140.A O no hydrogen 2.976 N/A LYS 145.A N THR 141.A O no hydrogen 2.938 N/A LYS 145.A N PHE 142.A O no hydrogen 3.119 N/A ILE 148.A N SER 146.A OG no hydrogen 3.401 N/A THR 150.A OG1 ASP 121.A OD2 no hydrogen 3.556 N/A TYR 151.A N ILE 148.A O no hydrogen 3.072 N/A GLU 152.A N ILE 148.A O no hydrogen 2.879 N/A LYS 153.A N SER 149.A O no hydrogen 2.994 N/A MET 154.A N THR 150.A O no hydrogen 3.223 N/A TRP 155.A N TYR 151.A O no hydrogen 2.870 N/A ALA 156.A N GLU 152.A O no hydrogen 2.898 N/A PHE 157.A N LYS 153.A O no hydrogen 3.149 N/A MET 158.A N MET 154.A O no hydrogen 3.078 N/A SER 159.A N TRP 155.A O no hydrogen 2.777 N/A SER 159.A OG TRP 155.A O no hydrogen 2.911 N/A SER 159.A OG ALA 156.A O no hydrogen 3.078 N/A SER 160.A N ALA 156.A O no hydrogen 3.031 N/A SER 160.A OG ALA 156.A O no hydrogen 2.975 N/A SER 160.A OG PHE 157.A O no hydrogen 3.195 N/A ARG 161.A N PHE 157.A O no hydrogen 3.151 N/A SER 164.A N ARG 161.A O no hydrogen 3.167 N/A SER 164.A OG GLU 130.A OE2 no hydrogen 2.960 N/A SER 164.A OG ARG 161.A O no hydrogen 3.479 N/A ALA 165.A N ARG 161.A O no hydrogen 2.769 N/A LEU 166.A N GLN 162.A O no hydrogen 3.455 N/A VAL 167.A N ALA 133.A O no hydrogen 3.064 N/A LYS 168.A N GLU 172.A OE2 no hydrogen 2.878 N/A GLU 172.A N ASN 169.A OD1 no hydrogen 2.782 N/A GLY 173.A N ASN 169.A O no hydrogen 3.020 N/A ILE 174.A N SER 170.A O no hydrogen 2.926 N/A GLN 175.A N ASP 171.A O no hydrogen 3.204 N/A ARG 176.A N GLU 172.A O no hydrogen 2.899 N/A ARG 176.A NH1 SER 164.A O no hydrogen 2.604 N/A ARG 176.A NH2 SER 164.A O no hydrogen 2.875 N/A VAL 177.A N GLY 173.A O no hydrogen 2.902 N/A LEU 178.A N ILE 174.A O no hydrogen 2.866 N/A THR 179.A N GLN 175.A O no hydrogen 2.927 N/A THR 179.A OG1 GLN 175.A O no hydrogen 2.619 N/A THR 180.A N ARG 176.A O no hydrogen 2.887 N/A THR 180.A OG1 ARG 176.A O no hydrogen 2.477 N/A TYR 182.A OH ALA 165.A O no hydrogen 2.668 N/A ALA 183.A N GLU 130.A O no hydrogen 2.998 N/A LEU 184.A N LEU 110.A O no hydrogen 2.884 N/A LEU 185.A N GLY 132.A O no hydrogen 2.889 N/A MET 186.A N SER 108.A O no hydrogen 2.995 N/A SER 188.A N GLY 106.A O no hydrogen 2.762 N/A SER 188.A OG GLY 106.A O no hydrogen 3.166 N/A ILE 191.A N GLU 187.A O no hydrogen 3.051 N/A GLU 192.A N SER 188.A O no hydrogen 2.942 N/A TYR 193.A N THR 189.A O no hydrogen 3.045 N/A TYR 193.A OH GLU 11.A OE1 no hydrogen 2.571 N/A VAL 194.A N SER 190.A O no hydrogen 2.931 N/A THR 195.A N ILE 191.A O no hydrogen 2.804 N/A THR 195.A OG1 ILE 191.A O no hydrogen 2.939 N/A THR 195.A OG1 GLU 192.A O no hydrogen 3.187 N/A GLN 196.A N GLU 192.A O no hydrogen 3.196 N/A ARG 197.A N VAL 194.A O no hydrogen 2.884 N/A ARG 197.A NH1 TYR 193.A O no hydrogen 2.908 N/A ARG 197.A NH1 TRP 248.A O no hydrogen 2.694 N/A ARG 197.A NH2 TRP 247.A O no hydrogen 3.041 N/A ARG 197.A NH2 TRP 248.A O no hydrogen 3.510 N/A ASN 198.A N VAL 194.A O no hydrogen 2.778 N/A LEU 201.A N ASN 198.A O no hydrogen 3.195 N/A THR 202.A N TYR 111.A O no hydrogen 2.751 N/A THR 202.A OG1 GLN 203.A O no hydrogen 3.440 N/A GLN 203.A NE2 GLY 205.A O no hydrogen 3.282 N/A ILE 204.A N ILE 109.A O no hydrogen 2.784 N/A ILE 208.A N ILE 107.A O no hydrogen 2.610 N/A LYS 211.A N LEU 105.A O no hydrogen 2.909 N/A LYS 211.A NZ GLU 187.A OE1 no hydrogen 2.495 N/A LYS 211.A NZ ASP 209.A OD1 no hydrogen 3.241 N/A LYS 211.A NZ ASP 209.A OD2 no hydrogen 2.875 N/A TYR 213.A N MET 103.A O.A no hydrogen 2.914 N/A TYR 213.A N MET 103.A O.B no hydrogen 2.957 N/A GLY 214.A N LEU 86.A O no hydrogen 3.195 N/A VAL 215.A N SER 99.A OG no hydrogen 2.882 N/A GLY 216.A N ALA 82.A O no hydrogen 2.976 N/A THR 217.A N ASP 97.A O no hydrogen 2.856 N/A THR 217.A OG1 PRO 218.A O no hydrogen 2.907 N/A GLY 220.A N ASP 97.A OD2 no hydrogen 2.837 N/A SER 221.A N PRO 218.A O no hydrogen 3.080 N/A TYR 223.A N SER 221.A OG no hydrogen 3.033 N/A ARG 224.A N SER 221.A O no hydrogen 3.431 N/A ARG 224.A NH2 ASP 97.A OD2 no hydrogen 3.135 N/A LYS 226.A NZ PRO 222.A O no hydrogen 3.085 N/A ILE 227.A N TYR 223.A O no hydrogen 2.866 N/A THR 228.A N ARG 224.A O no hydrogen 2.984 N/A THR 228.A OG1 ARG 224.A O no hydrogen 3.417 N/A ILE 229.A N.A ASP 225.A O no hydrogen 3.027 N/A ILE 229.A N.B ASP 225.A O no hydrogen 3.044 N/A ALA 230.A N LYS 226.A O no hydrogen 3.000 N/A ILE 231.A N ILE 227.A O no hydrogen 2.825 N/A LEU 232.A N THR 228.A O no hydrogen 2.883 N/A GLN 233.A N.A ILE 229.A O.A no hydrogen 2.991 N/A GLN 233.A N.A ILE 229.A O.B no hydrogen 2.997 N/A GLN 233.A N.B ILE 229.A O.A no hydrogen 2.974 N/A GLN 233.A N.B ILE 229.A O.B no hydrogen 2.981 N/A GLN 233.A NE2.B ILE 229.A O.A no hydrogen 3.476 N/A GLN 233.A NE2.B ILE 229.A O.B no hydrogen 3.401 N/A LEU 234.A N ALA 230.A O no hydrogen 2.935 N/A GLN 235.A N ILE 231.A O no hydrogen 2.834 N/A GLU 236.A N LEU 232.A O no hydrogen 2.879 N/A GLU 237.A N.A GLN 233.A O.A no hydrogen 2.925 N/A GLU 237.A N.A GLN 233.A O.B no hydrogen 2.846 N/A GLU 237.A N.B GLN 233.A O.A no hydrogen 2.920 N/A GLU 237.A N.B GLN 233.A O.B no hydrogen 2.839 N/A GLY 238.A N GLN 235.A O no hydrogen 3.204 N/A LYS 239.A N LEU 234.A O no hydrogen 2.810 N/A LEU 240.A N LEU 234.A O no hydrogen 3.237 N/A MET 242.A N GLY 238.A O no hydrogen 3.082 N/A MET 243.A N.A LYS 239.A O no hydrogen 2.876 N/A MET 243.A N.B LYS 239.A O no hydrogen 2.874 N/A LYS 244.A N LEU 240.A O no hydrogen 2.932 N/A LYS 244.A NZ GLU 192.A OE1 no hydrogen 2.767 N/A GLU 245.A N.A HIS 241.A O no hydrogen 2.862 N/A GLU 245.A N.B HIS 241.A O no hydrogen 2.859 N/A LYS 246.A N MET 242.A O no hydrogen 2.922 N/A LYS 246.A NZ ASP 35.A OD1 no hydrogen 3.551 N/A LYS 246.A NZ ASP 35.A OD2 no hydrogen 2.769 N/A TRP 247.A N MET 243.A O.A no hydrogen 3.441 N/A TRP 247.A N LYS 244.A O no hydrogen 3.229 N/A TRP 247.A NE1 ASP 35.A OD2 no hydrogen 2.849 N/A TRP 248.A N LYS 244.A O no hydrogen 2.813 N/A TRP 248.A NE1 THR 189.A O no hydrogen 2.944 N/A ARG 249.A N GLU 245.A O.A no hydrogen 3.223 N/A ARG 249.A N GLU 245.A O.B no hydrogen 3.091 N/A GLY 250.A N GLN 196.A OE1 no hydrogen 2.968 N/A