Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5bqu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N LEU 41.A O no hydrogen 2.587 N/A LYS 5.A N LEU 2.A O no hydrogen 3.308 N/A LYS 5.A NZ SER 1.A O no hydrogen 3.370 N/A VAL 7.A N TRP 39.A O no hydrogen 2.841 N/A THR 8.A N GLU 134.A O no hydrogen 2.738 N/A THR 8.A OG1 SER 139.A OG no hydrogen 2.505 N/A SER 10.A N ILE 132.A O no hydrogen 3.040 N/A CYS 11.A N LEU 17.A O no hydrogen 3.070 N/A CYS 11.A SG LEU 17.A O no hydrogen 3.734 N/A LYS 12.A N LYS 130.A O no hydrogen 2.939 N/A LYS 12.A NZ ASN 94.A O no hydrogen 3.095 N/A LYS 12.A NZ ASN 95.A OD1 no hydrogen 3.034 N/A ASP 14.A N CYS 11.A O no hydrogen 3.092 N/A ASN 16.A N ASP 14.A OD1 no hydrogen 3.137 N/A LEU 17.A N ASP 14.A O no hydrogen 2.962 N/A PHE 18.A N PHE 29.A O no hydrogen 2.711 N/A PHE 19.A N ILE 9.A O no hydrogen 2.752 N/A TYR 20.A N SER 27.A O no hydrogen 2.893 N/A GLN 21.A N LEU 36.A O no hydrogen 3.022 N/A GLN 21.A NE2 SER 54.A OG no hydrogen 3.156 N/A VAL 22.A N ASN 25.A O no hydrogen 3.104 N/A GLY 24.A N GLN 21.A OE1 no hydrogen 3.007 N/A ASN 25.A N VAL 22.A O no hydrogen 2.975 N/A ASN 25.A ND2 VAL 22.A O no hydrogen 3.501 N/A SER 27.A N TYR 20.A O no hydrogen 2.870 N/A LEU 28.A N ARG 116.A O no hydrogen 2.774 N/A PHE 29.A N PHE 18.A O no hydrogen 3.016 N/A THR 32.A N GLU 37.A OE1 no hydrogen 3.009 N/A THR 32.A OG1 ASN 34.A OD1 no hydrogen 2.751 N/A ARG 33.A NE ASP 140.A O no hydrogen 2.902 N/A LEU 36.A N ASN 34.A OD1 no hydrogen 3.224 N/A GLU 37.A N ASN 34.A O no hydrogen 3.069 N/A ARG 38.A N TYR 35.A O no hydrogen 3.262 N/A ARG 38.A NH2 ASP 140.A OD2 no hydrogen 2.754 N/A TRP 39.A N VAL 7.A O no hydrogen 3.010 N/A TRP 39.A NE1 PHE 19.A O no hydrogen 3.375 N/A ARG 40.A N LYS 53.A O no hydrogen 2.734 N/A ARG 40.A NH1 ASP 4.A O no hydrogen 3.106 N/A LEU 41.A N LYS 5.A O no hydrogen 2.901 N/A ILE 42.A N LYS 51.A O no hydrogen 2.967 N/A TYR 43.A N ASN 3.A OD1 no hydrogen 3.001 N/A ASP 44.A N ALA 49.A O no hydrogen 2.954 N/A ASN 46.A N ASP 44.A OD1 no hydrogen 2.963 N/A LYS 47.A N ASP 44.A OD1 no hydrogen 3.077 N/A ALA 48.A N ASP 44.A O no hydrogen 2.730 N/A TYR 50.A N TRP 86.A O no hydrogen 2.894 N/A LYS 51.A N ILE 42.A O no hydrogen 2.786 N/A LYS 51.A NZ ASP 78.A OD1 no hydrogen 3.352 N/A LYS 51.A NZ ASP 78.A OD2 no hydrogen 2.610 N/A LYS 51.A NZ ASN 80.A OD1 no hydrogen 2.837 N/A LYS 53.A N ARG 40.A O no hydrogen 2.955 N/A LYS 53.A NZ SER 54.A O no hydrogen 3.467 N/A LYS 53.A NZ THR 60.A O no hydrogen 2.716 N/A SER 54.A N LEU 62.A O no hydrogen 2.904 N/A MET 55.A N ARG 38.A O no hydrogen 3.143 N/A ASP 56.A N SER 54.A OG no hydrogen 3.134 N/A HIS 58.A N ASP 56.A OD2 no hydrogen 3.005 N/A ASN 59.A N ASP 56.A OD2 no hydrogen 2.834 N/A ASN 61.A ND2 GLN 77.A OE1 no hydrogen 3.384 N/A ASN 61.A ND2 ASP 78.A O no hydrogen 3.644 N/A VAL 63.A N GLN 76.A O no hydrogen 3.065 N/A LEU 64.A N ILE 52.A O no hydrogen 2.816 N/A THR 65.A N SER 74.A O no hydrogen 2.779 N/A THR 65.A OG1 VAL 63.A O no hydrogen 2.789 N/A TRP 66.A N ASN 83.A O no hydrogen 3.014 N/A TRP 66.A NE1 THR 70.A O no hydrogen 2.664 N/A ASN 67.A N ASN 72.A O no hydrogen 2.955 N/A ALA 68.A N TRP 66.A O no hydrogen 2.914 N/A THR 70.A N ASN 67.A O no hydrogen 2.949 N/A THR 70.A OG1 ASN 67.A O no hydrogen 2.672 N/A ASN 72.A N THR 70.A OG1 no hydrogen 2.971 N/A SER 74.A N THR 65.A O no hydrogen 2.981 N/A SER 74.A OG ASN 67.A OD1 no hydrogen 2.744 N/A THR 75.A N GLY 24.A O no hydrogen 3.173 N/A THR 75.A OG1 GLN 21.A OE1 no hydrogen 2.794 N/A GLN 76.A N VAL 63.A O no hydrogen 3.246 N/A GLN 76.A NE2 SER 74.A OG no hydrogen 2.555 N/A ASP 78.A N ASN 61.A O no hydrogen 2.932 N/A SER 79.A N GLN 84.A OE1 no hydrogen 2.989 N/A SER 79.A OG GLN 84.A OE1 no hydrogen 3.297 N/A ASN 80.A N ASP 78.A OD1 no hydrogen 2.807 N/A ALA 81.A N GLN 84.A OE1 no hydrogen 3.188 N/A ASN 83.A ND2 TRP 66.A O no hydrogen 3.004 N/A GLN 84.A N ALA 81.A O no hydrogen 2.820 N/A GLN 84.A NE2 THR 65.A OG1 no hydrogen 3.101 N/A GLN 84.A NE2 GLN 77.A O no hydrogen 3.129 N/A TYR 85.A N ASP 82.A O no hydrogen 3.318 N/A TYR 85.A OH ASN 80.A OD1 no hydrogen 2.728 N/A TRP 86.A N TYR 50.A O no hydrogen 2.894 N/A TRP 86.A NE1 LEU 64.A O no hydrogen 3.147 N/A LEU 87.A N ALA 100.A O no hydrogen 2.699 N/A LEU 89.A N ILE 98.A O no hydrogen 2.963 N/A ASP 91.A N SER 96.A O no hydrogen 2.846 N/A ASN 94.A N ASP 91.A O no hydrogen 3.155 N/A SER 96.A OG ASN 94.A O no hydrogen 3.385 N/A SER 96.A OG ASN 94.A OD1 no hydrogen 2.548 N/A PHE 97.A N PHE 131.A O no hydrogen 2.671 N/A ILE 98.A N LEU 89.A O no hydrogen 2.886 N/A ALA 100.A N LEU 87.A O no hydrogen 2.999 N/A SER 101.A N LEU 107.A O no hydrogen 2.936 N/A TYR 102.A N TYR 85.A O no hydrogen 3.035 N/A ASN 104.A N SER 101.A OG no hydrogen 3.210 N/A ASN 106.A N ASN 104.A OD1 no hydrogen 3.177 N/A LEU 107.A N ASN 104.A O no hydrogen 3.053 N/A VAL 108.A N SER 121.A O no hydrogen 2.757 N/A LEU 109.A N ILE 99.A O no hydrogen 2.951 N/A TYR 110.A N LYS 119.A O no hydrogen 2.766 N/A ALA 111.A N TYR 128.A O no hydrogen 2.779 N/A ASP 112.A N ASN 117.A O no hydrogen 2.987 N/A ALA 115.A N ASP 112.A OD1 no hydrogen 3.174 N/A ARG 116.A NE THR 113.A O no hydrogen 2.949 N/A ASN 117.A N ASP 112.A O no hydrogen 3.204 N/A LYS 119.A N TYR 110.A O no hydrogen 2.966 N/A LEU 120.A N HIS 71.A O no hydrogen 2.910 N/A SER 121.A N VAL 108.A O no hydrogen 2.740 N/A SER 121.A OG THR 122.A O no hydrogen 2.632 N/A SER 126.A N ASN 124.A OD1 no hydrogen 2.712 N/A SER 126.A OG ASN 124.A OD1 no hydrogen 2.733 N/A TYR 128.A N SER 126.A OG no hydrogen 3.112 N/A LYS 130.A N ASN 127.A O no hydrogen 3.073 N/A LYS 130.A NZ ASN 94.A OD1 no hydrogen 2.829 N/A PHE 131.A N PHE 97.A O no hydrogen 2.803 N/A ILE 132.A N SER 10.A O no hydrogen 2.755 N/A GLU 134.A N THR 8.A O no hydrogen 3.004 N/A TYR 136.A N ILE 6.A O no hydrogen 3.279 N/A ILE 137.A N ASP 135.A OD2 no hydrogen 3.023 N/A SER 139.A N ASP 135.A O no hydrogen 2.935 N/A SER 139.A OG THR 8.A OG1 no hydrogen 2.505 N/A ASP 140.A N TYR 136.A O no hydrogen 2.866 N/A LEU 141.A N ILE 137.A O no hydrogen 2.879 N/A LEU 141.A N ILE 138.A O no hydrogen 3.234 N/A ASN 142.A N ILE 138.A O no hydrogen 2.934 N/A ASN 143.A N ILE 183.A O no hydrogen 2.565 N/A PHE 144.A N LEU 141.A O no hydrogen 3.211 N/A THR 145.A OG1 THR 182.A OG1 no hydrogen 2.472 N/A CYS 146.A N TRP 181.A O no hydrogen 2.805 N/A CYS 146.A SG TRP 181.A O no hydrogen 3.378 N/A LYS 147.A N ARG 282.A O no hydrogen 3.083 N/A SER 149.A N ASN 280.A O no hydrogen 2.854 N/A SER 149.A OG LYS 156.A O no hydrogen 2.626 N/A ILE 151.A N LYS 278.A O no hydrogen 3.427 N/A ASN 155.A N ASP 153.A OD1 no hydrogen 3.044 N/A LYS 156.A N ASP 153.A O no hydrogen 3.167 N/A LYS 156.A NZ THR 260.A O no hydrogen 2.473 N/A LYS 156.A NZ ASN 262.A OD1 no hydrogen 3.481 N/A VAL 157.A N TYR 171.A O no hydrogen 2.605 N/A VAL 158.A N ILE 148.A O no hydrogen 2.815 N/A GLN 159.A N ASN 169.A O no hydrogen 2.889 N/A GLN 159.A NE2 ASN 169.A OD1 no hydrogen 2.987 N/A GLN 160.A N ASN 178.A O no hydrogen 3.148 N/A GLN 160.A NE2 ASP 162.A O no hydrogen 2.852 N/A VAL 161.A N ASN 167.A O no hydrogen 3.243 N/A ASP 162.A N ASN 165.A O no hydrogen 3.321 N/A THR 164.A N ASP 162.A OD1 no hydrogen 3.304 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 3.236 N/A ASN 165.A N ASP 162.A OD1 no hydrogen 2.850 N/A ASN 167.A N ASN 165.A OD1 no hydrogen 3.117 N/A ASN 169.A N GLN 159.A O no hydrogen 2.960 N/A LEU 170.A N THR 264.A O no hydrogen 3.090 N/A TYR 171.A N VAL 157.A O no hydrogen 2.849 N/A TRP 173.A N ASN 155.A O no hydrogen 3.346 N/A ASP 174.A N GLN 179.A OE1 no hydrogen 2.634 N/A GLY 176.A N ASP 174.A OD1 no hydrogen 3.103 N/A ASN 178.A ND2 GLN 159.A OE1 no hydrogen 3.211 N/A ASN 178.A ND2 GLN 160.A O no hydrogen 2.918 N/A GLN 179.A N GLY 176.A O no hydrogen 2.965 N/A GLN 179.A NE2 GLN 159.A OE1 no hydrogen 2.731 N/A GLN 179.A NE2 THR 172.A O no hydrogen 3.393 N/A LYS 180.A N ARG 177.A O no hydrogen 3.087 N/A TRP 181.A N CYS 146.A O no hydrogen 2.932 N/A TRP 181.A NE1 VAL 158.A O no hydrogen 2.968 N/A THR 182.A N PHE 195.A O no hydrogen 2.622 N/A THR 182.A OG1 THR 145.A OG1 no hydrogen 2.472 N/A ILE 183.A N PHE 144.A O no hydrogen 2.897 N/A ARG 184.A N GLN 193.A O no hydrogen 3.075 N/A ARG 184.A NH1 ASN 143.A OD1 no hydrogen 2.775 N/A TYR 185.A N ASN 142.A OD1 no hydrogen 2.797 N/A ASN 186.A N ALA 191.A O no hydrogen 2.813 N/A LYS 189.A N ASN 186.A OD1 no hydrogen 3.345 N/A LYS 189.A NZ ASN 223.A OD1 no hydrogen 2.694 N/A ALA 191.A N ASN 186.A O no hydrogen 3.415 N/A TYR 192.A N TRP 229.A O no hydrogen 2.910 N/A GLN 193.A N ARG 184.A O no hydrogen 2.911 N/A GLN 193.A NE2 GLN 227.A OE1 no hydrogen 3.348 N/A PHE 195.A N THR 182.A O no hydrogen 2.829 N/A ASN 196.A N GLY 202.A O no hydrogen 3.095 N/A ASN 196.A ND2 ASN 178.A O no hydrogen 2.999 N/A THR 197.A N LYS 180.A O no hydrogen 2.951 N/A THR 197.A OG1 ARG 177.A O no hydrogen 2.829 N/A ILE 198.A N ASN 196.A OD1 no hydrogen 3.159 N/A LEU 199.A N ASN 196.A O no hydrogen 3.275 N/A VAL 203.A N SER 217.A O no hydrogen 2.932 N/A LEU 204.A N PHE 194.A O no hydrogen 2.949 N/A THR 205.A N ARG 215.A O no hydrogen 2.795 N/A THR 205.A OG1 VAL 203.A O no hydrogen 2.778 N/A THR 205.A OG1 SER 217.A OG no hydrogen 3.091 N/A TRP 206.A N ALA 226.A O no hydrogen 3.457 N/A TRP 206.A NE1 GLY 211.A O no hydrogen 2.515 N/A ILE 207.A N THR 213.A O no hydrogen 2.926 N/A ASN 210.A N ILE 207.A O no hydrogen 2.653 N/A ARG 215.A N THR 205.A O no hydrogen 2.940 N/A VAL 216.A N LEU 166.A O no hydrogen 3.115 N/A SER 217.A N VAL 203.A O no hydrogen 3.151 N/A SER 217.A OG THR 205.A OG1 no hydrogen 3.091 N/A SER 219.A N ASN 201.A O no hydrogen 2.982 N/A ASN 220.A N SER 218.A OG no hydrogen 3.245 N/A ALA 226.A N ASN 224.A OD1 no hydrogen 3.097 N/A GLN 227.A N ASN 224.A O no hydrogen 2.986 N/A TYR 228.A N ASP 225.A O no hydrogen 3.165 N/A TRP 229.A N TYR 192.A O no hydrogen 2.873 N/A TRP 229.A NE1 LEU 204.A O no hydrogen 3.011 N/A LEU 230.A N THR 244.A O no hydrogen 2.635 N/A ASN 232.A N THR 242.A O no hydrogen 2.886 N/A VAL 234.A N THR 240.A O no hydrogen 2.770 N/A THR 237.A N VAL 234.A O no hydrogen 3.349 N/A THR 237.A OG1 VAL 234.A O no hydrogen 2.598 N/A THR 237.A OG1 THR 240.A O no hydrogen 3.341 N/A THR 240.A OG1 ASN 280.A OD1 no hydrogen 2.874 N/A TYR 241.A N TRP 279.A O no hydrogen 2.771 N/A THR 242.A N ASN 232.A O no hydrogen 2.832 N/A THR 242.A OG1 ASN 232.A O no hydrogen 3.511 N/A THR 244.A N LEU 230.A O no hydrogen 2.896 N/A ASN 245.A N LYS 251.A O no hydrogen 3.031 N/A ASN 245.A ND2 ALA 226.A O no hydrogen 2.775 N/A LEU 246.A N TYR 228.A O no hydrogen 2.956 N/A ARG 247.A N ASN 245.A OD1 no hydrogen 3.048 N/A THR 250.A N ASP 248.A OD1 no hydrogen 2.901 N/A THR 250.A OG1 ASP 248.A OD1 no hydrogen 2.769 N/A THR 250.A OG1 ASP 248.A OD2 no hydrogen 3.443 N/A LYS 251.A N ASP 248.A O no hydrogen 3.082 N/A LYS 251.A NZ ASN 270.A OD1 no hydrogen 3.504 N/A ALA 252.A N PHE 269.A O no hydrogen 2.822 N/A LEU 253.A N ILE 243.A O no hydrogen 2.789 N/A ASP 254.A N GLN 267.A O no hydrogen 2.482 N/A LEU 255.A N ASN 276.A O no hydrogen 3.290 N/A TYR 256.A N ALA 265.A O no hydrogen 3.077 N/A GLY 258.A N LEU 255.A O no hydrogen 3.197 N/A GLN 259.A N TYR 256.A O no hydrogen 2.885 N/A GLY 263.A N LEU 170.A O no hydrogen 3.027 N/A THR 264.A N ALA 261.A O no hydrogen 3.332 N/A THR 264.A OG1 ALA 261.A O no hydrogen 2.436 N/A ILE 266.A N VAL 168.A O no hydrogen 3.306 N/A GLN 267.A N ASP 254.A O no hydrogen 2.777 N/A VAL 268.A N ASN 212.A O no hydrogen 3.122 N/A PHE 269.A N ALA 252.A O no hydrogen 2.873 N/A TYR 271.A N THR 250.A O no hydrogen 2.730 N/A HIS 272.A N GLN 277.A OE1 no hydrogen 2.698 N/A GLY 273.A N GLN 277.A OE1 no hydrogen 2.759 N/A GLN 277.A N ASP 274.A O no hydrogen 3.001 N/A GLN 277.A NE2 ASP 254.A OD2 no hydrogen 3.358 N/A GLN 277.A NE2 ASN 270.A O no hydrogen 2.748 N/A LYS 278.A N ASP 275.A O no hydrogen 3.104 N/A TRP 279.A N TYR 241.A O no hydrogen 2.764 N/A TRP 279.A NE1 LEU 253.A O no hydrogen 3.102 N/A ASN 280.A N SER 149.A O no hydrogen 2.659 N/A ASN 280.A ND2 GLU 239.A OE2 no hydrogen 3.508 N/A ILE 281.A N GLU 239.A O no hydrogen 3.023 N/A ARG 282.A N LYS 147.A O no hydrogen 3.081 N/A ARG 282.A NH2 SER 149.A OG no hydrogen 3.035 N/A ARG 282.A NH2 LEU 154.A O no hydrogen 2.917 N/A