Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qrg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH ASP 51.A OD1 no hydrogen 2.491 N/A SER 5.A N ASP 8.A OD2 no hydrogen 2.891 N/A GLN 6.A NE2 ASP 51.A OD1 no hydrogen 2.988 N/A ASN 7.A N SER 5.A OG no hydrogen 2.813 N/A ASP 8.A N SER 5.A O no hydrogen 3.052 N/A LEU 9.A N GLN 6.A O no hydrogen 3.390 N/A THR 10.A N ASN 7.A O no hydrogen 3.526 N/A THR 10.A OG1 ASN 7.A O no hydrogen 3.472 N/A ARG 14.A N SER 11.A OG no hydrogen 3.246 N/A ARG 14.A NH1 ASN 7.A O no hydrogen 2.859 N/A LEU 15.A N SER 11.A O no hydrogen 2.970 N/A ILE 16.A N THR 12.A O no hydrogen 2.927 N/A GLN 17.A N GLU 13.A O no hydrogen 3.127 N/A GLN 17.A NE2 GLU 13.A OE2 no hydrogen 3.434 N/A LEU 18.A N ARG 14.A O no hydrogen 2.872 N/A PHE 19.A N LEU 15.A O no hydrogen 2.847 N/A GLU 20.A N ILE 16.A O no hydrogen 2.766 N/A SER 21.A N GLN 17.A O no hydrogen 2.971 N/A SER 21.A OG GLN 17.A O no hydrogen 3.400 N/A SER 21.A OG LEU 18.A O no hydrogen 2.977 N/A TRP 22.A N LEU 18.A O no hydrogen 2.940 N/A TRP 22.A NE1 LEU 64.A O no hydrogen 2.929 N/A TRP 22.A NE1 ASN 65.A O no hydrogen 3.100 N/A MET 23.A N PHE 19.A O no hydrogen 3.003 N/A MET 23.A N GLU 20.A O no hydrogen 3.178 N/A LEU 24.A N GLU 20.A O no hydrogen 3.192 N/A LYS 25.A N SER 21.A O no hydrogen 2.956 N/A HIS 26.A N MET 23.A O no hydrogen 3.217 N/A ASN 27.A N LEU 24.A O no hydrogen 3.300 N/A LYS 28.A N MET 23.A O no hydrogen 2.879 N/A TYR 30.A OH ASP 69.A OD2 no hydrogen 2.448 N/A LYS 31.A N GLU 35.A OE1 no hydrogen 3.120 N/A GLU 35.A N ASN 32.A OD1 no hydrogen 3.291 N/A LYS 36.A N ASN 32.A O no hydrogen 3.003 N/A LYS 36.A NZ GLU 20.A OE1 no hydrogen 3.061 N/A LYS 36.A NZ GLU 20.A OE2 no hydrogen 3.318 N/A ILE 37.A N ILE 33.A O no hydrogen 2.669 N/A TYR 38.A N ASP 34.A O no hydrogen 3.058 N/A ARG 39.A N GLU 35.A O no hydrogen 2.633 N/A ARG 39.A NE GLU 35.A OE2 no hydrogen 3.135 N/A ARG 39.A NH1 ASP 69.A O no hydrogen 3.158 N/A ARG 39.A NH1 GLU 74.A OE1 no hydrogen 3.051 N/A ARG 39.A NH1 GLU 74.A OE2 no hydrogen 2.493 N/A ARG 39.A NH2 GLU 35.A OE2 no hydrogen 3.202 N/A ARG 39.A NH2 GLU 74.A OE2 no hydrogen 2.723 N/A PHE 40.A N LYS 36.A O no hydrogen 2.910 N/A GLU 41.A N ILE 37.A O no hydrogen 3.050 N/A ILE 42.A N TYR 38.A O no hydrogen 3.112 N/A PHE 43.A N ARG 39.A O no hydrogen 2.787 N/A LYS 44.A N PHE 40.A O no hydrogen 2.711 N/A LYS 44.A NZ GLU 41.A OE1 no hydrogen 2.958 N/A ASP 45.A N GLU 41.A O no hydrogen 3.066 N/A ASN 46.A N ILE 42.A O no hydrogen 2.918 N/A ASN 46.A ND2 ALA 68.A O no hydrogen 2.842 N/A ASN 46.A ND2 MET 70.A O no hydrogen 2.903 N/A LEU 47.A N PHE 43.A O no hydrogen 2.833 N/A LYS 48.A N LYS 44.A O no hydrogen 3.180 N/A TYR 49.A N ASP 45.A O no hydrogen 3.053 N/A TYR 49.A OH ASP 228.A OD1 no hydrogen 2.636 N/A ILE 50.A N ASN 46.A O no hydrogen 2.819 N/A ASP 51.A N LEU 47.A O no hydrogen 2.871 N/A GLU 52.A N LYS 48.A O no hydrogen 3.021 N/A THR 53.A N TYR 49.A O no hydrogen 2.734 N/A THR 53.A OG1 TYR 49.A O no hydrogen 2.908 N/A ASN 54.A N ILE 50.A O no hydrogen 2.753 N/A ASN 54.A ND2 LEU 62.A O no hydrogen 2.865 N/A LYS 55.A N GLU 52.A O no hydrogen 3.458 N/A LYS 56.A N THR 53.A O no hydrogen 3.421 N/A SER 59.A OG ILE 236.A O no hydrogen 2.772 N/A TYR 60.A OH GLY 239.A O no hydrogen 2.744 N/A TRP 61.A N GLY 234.A O no hydrogen 2.822 N/A LEU 62.A N ASN 54.A OD1 no hydrogen 2.919 N/A GLY 63.A N LEU 231.A O no hydrogen 2.906 N/A ASN 65.A N GLY 63.A O no hydrogen 2.825 N/A ASN 65.A ND2 GLN 230.A O no hydrogen 2.890 N/A ASN 65.A ND2 TYR 232.A O no hydrogen 3.025 N/A VAL 66.A N GLY 268.A O no hydrogen 2.989 N/A PHE 67.A N ASN 65.A OD1 no hydrogen 2.735 N/A ALA 68.A N ASN 65.A O no hydrogen 3.120 N/A MET 70.A N PHE 67.A O no hydrogen 3.086 N/A SER 71.A N GLU 74.A OE1 no hydrogen 3.414 N/A ASN 72.A ND2 ALA 225.A O no hydrogen 2.979 N/A ASN 72.A ND2 GLN 230.A OE1 no hydrogen 2.813 N/A GLU 74.A N SER 71.A OG no hydrogen 3.183 N/A PHE 75.A N SER 71.A O no hydrogen 2.872 N/A LYS 76.A N ASN 72.A O no hydrogen 2.736 N/A LYS 76.A NZ ASN 72.A OD1 no hydrogen 2.426 N/A LYS 76.A NZ ALA 225.A O no hydrogen 3.158 N/A GLU 77.A N ASP 73.A O no hydrogen 3.168 N/A LYS 78.A N GLU 74.A O no hydrogen 3.249 N/A LYS 78.A NZ TYR 79.A OH no hydrogen 3.131 N/A TYR 79.A N PHE 75.A O no hydrogen 3.068 N/A GLY 81.A N ASP 246.A O no hydrogen 2.949 N/A SER 82.A N ASP 246.A O no hydrogen 3.175 N/A ALA 84.A N GLY 154.A O no hydrogen 3.014 N/A VAL 93.A N TYR 254.A O no hydrogen 2.902 N/A TRP 95.A N VAL 252.A O no hydrogen 3.006 N/A TRP 95.A NE1 ILE 213.A O no hydrogen 2.825 N/A ARG 96.A N ASP 94.A OD1 no hydrogen 2.786 N/A ARG 96.A NE ASP 94.A OD1 no hydrogen 3.166 N/A ARG 96.A NE ASP 94.A OD2 no hydrogen 3.199 N/A ARG 96.A NH2 ASP 94.A OD2 no hydrogen 2.925 N/A GLN 97.A N ASP 94.A O no hydrogen 2.860 N/A LYS 98.A N TRP 95.A O no hydrogen 3.182 N/A GLY 99.A N ARG 96.A O no hydrogen 3.262 N/A ALA 100.A N TRP 95.A O no hydrogen 3.153 N/A THR 102.A OG1 GLU 123.A OE1 no hydrogen 2.694 N/A LYS 105.A NZ PRO 103.A O no hydrogen 3.109 N/A LYS 105.A NZ GLU 135.A OE1 no hydrogen 2.429 N/A GLN 107.A N SER 264.A O no hydrogen 2.767 N/A GLN 107.A NE2 CYS 110.A O no hydrogen 2.932 N/A GLY 108.A N ASN 106.A OD1 no hydrogen 2.900 N/A CYS 110.A SG GLY 178.A O no hydrogen 3.749 N/A GLY 111.A N CYS 151.A O no hydrogen 2.823 N/A SER 112.A OG TYR 176.A OH no hydrogen 2.770 N/A ALA 113.A N SER 82.A OG no hydrogen 2.991 N/A TRP 114.A NE1 GLY 150.A O no hydrogen 3.188 N/A ALA 115.A N SER 112.A O no hydrogen 2.673 N/A PHE 116.A N SER 112.A O no hydrogen 3.386 N/A SER 117.A N ALA 113.A O no hydrogen 2.782 N/A SER 117.A OG SER 219.A OG no hydrogen 2.527 N/A SER 117.A OG VAL 249.A O no hydrogen 2.918 N/A ALA 118.A N TRP 114.A O no hydrogen 3.376 N/A VAL 119.A N ALA 115.A O no hydrogen 2.851 N/A SER 120.A N PHE 116.A O no hydrogen 3.081 N/A SER 120.A N SER 117.A O no hydrogen 3.222 N/A THR 121.A N SER 117.A O no hydrogen 3.276 N/A THR 121.A OG1 ALA 118.A O no hydrogen 2.575 N/A ILE 122.A N ALA 118.A O no hydrogen 2.977 N/A GLU 123.A N VAL 119.A O no hydrogen 2.928 N/A SER 124.A N SER 120.A O no hydrogen 3.109 N/A SER 124.A OG ALA 100.A O no hydrogen 2.618 N/A SER 124.A OG SER 120.A O no hydrogen 3.135 N/A ILE 125.A N THR 121.A O no hydrogen 3.028 N/A ILE 126.A N ILE 122.A O no hydrogen 3.234 N/A LYS 127.A N GLU 123.A O no hydrogen 3.171 N/A LYS 127.A NZ LYS 98.A O no hydrogen 3.067 N/A ILE 128.A N SER 124.A O no hydrogen 2.932 N/A ARG 129.A N ILE 125.A O no hydrogen 2.923 N/A ARG 129.A NE LYS 299.A O no hydrogen 3.009 N/A THR 130.A N ILE 126.A O no hydrogen 2.631 N/A THR 130.A OG1 ILE 126.A O no hydrogen 2.501 N/A GLY 131.A N LYS 127.A O no hydrogen 2.819 N/A TYR 136.A N GLU 123.A OE2 no hydrogen 3.073 N/A SER 137.A N HIS 169.A O no hydrogen 2.942 N/A SER 137.A OG TYR 174.A O no hydrogen 2.740 N/A GLU 138.A N GLU 138.A OE1 no hydrogen 2.877 N/A GLN 139.A NE2 ASP 143.A OD1 no hydrogen 3.034 N/A GLN 139.A NE2 ASP 143.A OD2 no hydrogen 3.468 N/A GLN 139.A NE2 VAL 179.A O no hydrogen 2.594 N/A GLU 140.A N SER 137.A OG no hydrogen 2.932 N/A LEU 142.A N GLU 138.A O no hydrogen 2.911 N/A ASP 143.A N GLN 139.A O no hydrogen 2.825 N/A CYS 144.A N GLU 140.A O no hydrogen 2.753 N/A CYS 144.A SG SER 185.A OG no hydrogen 3.572 N/A ASP 145.A N LEU 141.A O no hydrogen 3.005 N/A ARG 147.A N ASP 145.A OD1 no hydrogen 3.060 N/A SER 148.A N ASP 145.A O no hydrogen 3.127 N/A SER 148.A OG ASP 145.A OD2 no hydrogen 2.750 N/A TYR 149.A N GLY 153.A O no hydrogen 2.784 N/A CYS 151.A SG GLY 178.A O no hydrogen 3.579 N/A ASN 152.A N TYR 149.A O no hydrogen 2.997 N/A GLY 153.A N GLY 150.A O no hydrogen 3.287 N/A GLY 154.A N SER 82.A O no hydrogen 2.773 N/A TYR 155.A N SER 148.A OG no hydrogen 3.179 N/A TYR 155.A OH GLY 85.A O no hydrogen 3.377 N/A SER 158.A N TYR 155.A O no hydrogen 3.110 N/A SER 158.A OG ASP 145.A OD1 no hydrogen 2.604 N/A SER 158.A OG ASP 145.A OD2 no hydrogen 2.654 N/A ALA 159.A N TYR 155.A O no hydrogen 3.227 N/A LEU 160.A N PRO 156.A O no hydrogen 2.911 N/A GLN 161.A N TRP 157.A O no hydrogen 3.113 N/A LEU 162.A N SER 158.A O no hydrogen 3.062 N/A VAL 163.A N ALA 159.A O no hydrogen 3.317 N/A ALA 164.A N LEU 160.A O no hydrogen 2.979 N/A GLN 165.A N GLN 161.A O no hydrogen 2.959 N/A GLN 165.A N LEU 162.A O no hydrogen 3.236 N/A TYR 166.A N LEU 162.A O no hydrogen 2.798 N/A ILE 168.A N ALA 193.A O no hydrogen 2.866 N/A HIS 169.A N GLU 140.A OE1 no hydrogen 2.573 N/A HIS 169.A ND1 GLU 140.A OE2 no hydrogen 2.618 N/A HIS 169.A NE2 GLY 189.A O no hydrogen 2.594 N/A ARG 171.A N GLU 135.A O no hydrogen 2.792 N/A ARG 171.A NH2 GLU 138.A OE1 no hydrogen 2.945 N/A THR 173.A N TYR 170.A O no hydrogen 2.960 N/A TYR 174.A N TYR 170.A O no hydrogen 2.992 N/A TYR 174.A N ARG 171.A O no hydrogen 3.054 N/A TYR 174.A OH ASP 143.A OD2 no hydrogen 2.522 N/A TYR 176.A OH GLN 107.A O no hydrogen 2.526 N/A TYR 176.A OH SER 112.A OG no hydrogen 2.770 N/A GLU 177.A N GLN 139.A OE1 no hydrogen 2.798 N/A GLN 180.A NE2 LEU 142.A O no hydrogen 3.173 N/A ARG 181.A N ASP 143.A OD1 no hydrogen 2.715 N/A ARG 181.A NE GLU 177.A OE2 no hydrogen 3.209 N/A ARG 184.A NE TYR 174.A OH no hydrogen 3.153 N/A ARG 184.A NE TYR 182.A O no hydrogen 3.296 N/A ARG 184.A NH1 GLU 177.A OE1 no hydrogen 2.716 N/A ARG 184.A NH2 ASP 143.A OD2 no hydrogen 2.625 N/A ARG 184.A NH2 GLU 177.A OE1 no hydrogen 2.993 N/A SER 185.A OG GLU 140.A OE2 no hydrogen 3.020 N/A GLU 187.A N ARG 184.A O no hydrogen 2.929 N/A LYS 188.A N SER 185.A O no hydrogen 3.149 N/A LYS 188.A NZ THR 173.A O no hydrogen 2.884 N/A ALA 192.A N ILE 168.A O no hydrogen 2.787 N/A ALA 193.A N ILE 168.A O no hydrogen 3.229 N/A LYS 194.A NZ ALA 164.A O no hydrogen 2.715 N/A LYS 194.A NZ THR 195.A O no hydrogen 3.113 N/A THR 195.A N VAL 163.A O no hydrogen 3.176 N/A ASP 196.A N VAL 298.A O no hydrogen 2.725 N/A GLY 197.A N VAL 298.A O no hydrogen 3.279 N/A ARG 199.A N TYR 296.A O no hydrogen 3.030 N/A ARG 199.A NE VAL 198.A O no hydrogen 2.795 N/A VAL 201.A N SER 294.A O no hydrogen 2.906 N/A TYR 204.A N TYR 291.A O no hydrogen 2.928 N/A ALA 208.A N ASN 205.A OD1 no hydrogen 2.754 N/A LEU 209.A N ASN 205.A O no hydrogen 3.151 N/A LEU 210.A N GLU 206.A O no hydrogen 2.896 N/A TYR 211.A N GLY 207.A O no hydrogen 3.001 N/A SER 212.A N ALA 208.A O no hydrogen 3.161 N/A SER 212.A OG ALA 208.A O no hydrogen 3.556 N/A ILE 213.A N LEU 209.A O no hydrogen 2.926 N/A ALA 214.A N LEU 210.A O no hydrogen 2.975 N/A ASN 215.A N SER 212.A O no hydrogen 2.834 N/A GLN 216.A N SER 212.A O no hydrogen 2.978 N/A VAL 218.A N ALA 251.A O no hydrogen 2.920 N/A SER 219.A N PHE 295.A O no hydrogen 2.741 N/A SER 219.A OG SER 117.A OG no hydrogen 2.527 N/A VAL 220.A N VAL 249.A O no hydrogen 2.931 N/A LEU 222.A N HIS 247.A O no hydrogen 3.020 N/A GLU 223.A N CYS 288.A O no hydrogen 2.834 N/A ALA 224.A N ASP 246.A OD1 no hydrogen 2.733 N/A ALA 225.A N ASP 246.A OD2 no hydrogen 3.280 N/A GLN 230.A N GLY 226.A O no hydrogen 2.824 N/A GLN 230.A NE2 PHE 67.A O no hydrogen 3.056 N/A GLN 230.A NE2 MET 70.A O no hydrogen 2.948 N/A LEU 231.A N LYS 227.A O no hydrogen 3.004 N/A TYR 232.A N PHE 229.A O no hydrogen 3.188 N/A TYR 232.A OH GLY 235.A O no hydrogen 2.671 N/A ARG 233.A N TRP 61.A O no hydrogen 2.913 N/A GLY 234.A N TRP 61.A O no hydrogen 3.351 N/A GLY 235.A N GLU 271.A OE2 no hydrogen 2.778 N/A ILE 236.A N SER 59.A O no hydrogen 2.987 N/A PHE 237.A N ARG 276.A O no hydrogen 2.741 N/A GLY 242.A N GLU 223.A OE1 no hydrogen 2.507 N/A LYS 244.A N GLU 223.A OE2 no hydrogen 2.804 N/A ASP 246.A N LEU 222.A O no hydrogen 2.985 N/A HIS 247.A N LEU 222.A O no hydrogen 3.095 N/A HIS 247.A NE2 ASN 263.A OD1 no hydrogen 2.785 N/A VAL 249.A N VAL 220.A O no hydrogen 2.767 N/A ALA 250.A N ARG 262.A O no hydrogen 3.194 N/A ALA 251.A N VAL 218.A O no hydrogen 2.730 N/A VAL 252.A N LEU 260.A O no hydrogen 2.951 N/A TYR 254.A N VAL 93.A O no hydrogen 2.962 N/A TYR 254.A OH PRO 90.A O no hydrogen 2.663 N/A GLY 255.A N TYR 258.A O no hydrogen 2.911 N/A TYR 258.A N GLY 255.A O no hydrogen 3.342 N/A ILE 259.A N ILE 277.A O no hydrogen 2.892 N/A LEU 260.A N GLY 253.A O no hydrogen 2.701 N/A ILE 261.A N ILE 275.A O no hydrogen 2.882 N/A ARG 262.A N ALA 250.A O no hydrogen 2.815 N/A ARG 262.A NE TYR 274.A OH no hydrogen 3.461 N/A ARG 262.A NH1 PRO 103.A O no hydrogen 3.338 N/A ASN 263.A N GLY 273.A O no hydrogen 3.017 N/A SER 264.A N ASN 263.A OD1 no hydrogen 2.657 N/A SER 264.A OG GLN 107.A OE1 no hydrogen 2.659 N/A GLY 266.A N LYS 105.A O no hydrogen 3.053 N/A TRP 269.A NE1 PHE 229.A O no hydrogen 3.069 N/A GLU 271.A N TYR 274.A O no hydrogen 2.830 N/A GLY 273.A N TRP 269.A O no hydrogen 2.692 N/A TYR 274.A N GLU 271.A O no hydrogen 3.229 N/A ILE 275.A N ILE 261.A O no hydrogen 2.870 N/A ARG 276.A NE GLU 271.A OE1 no hydrogen 2.617 N/A ARG 276.A NE GLU 271.A OE2 no hydrogen 3.404 N/A ARG 276.A NH2 GLU 271.A OE1 no hydrogen 3.470 N/A ARG 276.A NH2 GLU 271.A OE2 no hydrogen 2.595 N/A ILE 277.A N ILE 259.A O no hydrogen 2.962 N/A LYS 278.A N PHE 237.A O no hydrogen 2.834 N/A ARG 279.A N ASN 257.A O no hydrogen 2.826 N/A ARG 279.A NE GLY 255.A O no hydrogen 2.965 N/A ARG 279.A NH1 GLU 206.A OE1 no hydrogen 2.820 N/A ARG 279.A NH2 GLY 255.A O no hydrogen 3.342 N/A GLY 280.A N GLU 206.A OE2 no hydrogen 2.841 N/A GLY 286.A N ASN 283.A O no hydrogen 3.028 N/A GLY 289.A N GLY 286.A O no hydrogen 2.818 N/A LEU 290.A N VAL 287.A O no hydrogen 3.189 N/A TYR 291.A N TYR 285.A O no hydrogen 2.800 N/A TYR 291.A OH GLU 206.A OE2 no hydrogen 2.477 N/A THR 292.A N GLY 289.A O no hydrogen 3.097 N/A THR 292.A OG1 GLY 289.A O no hydrogen 2.577 N/A PHE 295.A N SER 219.A O no hydrogen 2.822 N/A TYR 296.A N ARG 199.A O no hydrogen 3.083 N/A VAL 298.A N GLY 197.A O no hydrogen 2.875 N/A LYS 299.A NZ LYS 194.A O no hydrogen 2.854 N/A ASN 300.A N ASP 196.A OD2 no hydrogen 2.599 N/A