Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yvd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 ASP 251.A OD1 no hydrogen 2.662 N/A TRP 5.A N GLN 259.A OE1 no hydrogen 2.816 N/A LYS 6.A N ARG 292.A O no hydrogen 2.871 N/A TYR 8.A N VAL 290.A O no hydrogen 2.722 N/A ARG 9.A N VAL 290.A O no hydrogen 3.278 N/A ILE 11.A N ILE 288.A O no hydrogen 2.699 N/A HIS 14.A ND1 ASP 36.A OD2 no hydrogen 3.176 N/A HIS 14.A NE2 THR 32.A OG1 no hydrogen 2.783 N/A LEU 15.A N ASP 36.A OD2 no hydrogen 2.769 N/A TRP 17.A NE1 GLU 264.A OE1 no hydrogen 3.099 N/A VAL 18.A N GLU 283.A O no hydrogen 3.060 N/A ARG 19.A N GLY 33.A O no hydrogen 2.989 N/A CYS 20.A N GLY 33.A O no hydrogen 3.405 N/A CYS 20.A SG VAL 60.A O no hydrogen 3.664 N/A ALA 22.A N VAL 31.A O no hydrogen 3.001 N/A GLU 24.A N TRP 29.A O no hydrogen 3.198 N/A GLY 26.A N GLU 24.A OE1 no hydrogen 2.956 N/A ASN 27.A N GLU 24.A O no hydrogen 2.982 N/A ASN 27.A ND2 ASP 273.A OD2 no hydrogen 3.063 N/A GLN 28.A N GLU 24.A OE2 no hydrogen 2.813 N/A GLN 28.A NE2 GLY 26.A O no hydrogen 3.007 N/A PHE 30.A N TRP 42.A O no hydrogen 2.909 N/A VAL 31.A N ALA 22.A O no hydrogen 2.793 N/A THR 32.A N LYS 40.A O no hydrogen 2.967 N/A THR 32.A OG1 HIS 14.A NE2 no hydrogen 2.783 N/A GLY 33.A N CYS 20.A O no hydrogen 3.138 N/A SER 34.A N THR 38.A O.A no hydrogen 3.119 N/A SER 34.A N THR 38.A O.B no hydrogen 3.113 N/A SER 34.A OG GLY 16.A O no hydrogen 3.149 N/A SER 34.A OG TRP 17.A O no hydrogen 2.912 N/A ALA 35.A N TRP 17.A O no hydrogen 2.849 N/A ASP 36.A N SER 34.A OG no hydrogen 3.024 N/A ARG 37.A N SER 34.A O no hydrogen 3.026 N/A THR 38.A N.A ASP 36.A OD1 no hydrogen 3.008 N/A THR 38.A N.B ASP 36.A OD1 no hydrogen 3.007 N/A THR 38.A OG1.A ASP 36.A OD1 no hydrogen 2.549 N/A THR 38.A OG1.A ASP 36.A OD2 no hydrogen 3.381 N/A ILE 39.A N LEU 53.A O no hydrogen 3.019 N/A LYS 40.A N THR 32.A O no hydrogen 2.849 N/A ILE 41.A N LEU 51.A O no hydrogen 2.798 N/A TRP 42.A N PHE 30.A O no hydrogen 2.897 N/A TRP 42.A NE1 THR 32.A OG1 no hydrogen 2.825 N/A ASP 43.A N LYS 48.A O no hydrogen 2.745 N/A LEU 44.A N GLN 28.A O no hydrogen 3.196 N/A SER 46.A N ASP 43.A OD2 no hydrogen 2.928 N/A GLY 47.A N ASP 43.A O no hydrogen 2.828 N/A LYS 50.A N ILE 41.A O no hydrogen 2.765 N/A LEU 51.A N ILE 41.A O no hydrogen 3.252 N/A LEU 53.A N ILE 39.A O no hydrogen 2.730 N/A HIS 56.A ND1 ASP 78.A OD1 no hydrogen 3.201 N/A HIS 56.A ND1 ASP 78.A OD2 no hydrogen 3.143 N/A HIS 56.A NE2 SER 74.A OG no hydrogen 2.714 N/A ILE 57.A N ASP 78.A OD2 no hydrogen 2.792 N/A THR 59.A N SER 58.A OG no hydrogen 2.820 N/A VAL 60.A N SER 34.A O no hydrogen 3.093 N/A ARG 61.A N CYS 75.A O no hydrogen 2.787 N/A ARG 61.A NH1 GLU 77.A OE2 no hydrogen 2.856 N/A GLY 62.A N CYS 75.A O no hydrogen 3.249 N/A ILE 64.A N PHE 73.A O no hydrogen 2.971 N/A SER 66.A N TYR 71.A O no hydrogen 2.913 N/A SER 66.A OG SER 69.A O no hydrogen 3.235 N/A ARG 68.A NH2 HIS 108.A O no hydrogen 2.640 N/A SER 69.A N SER 66.A OG no hydrogen 2.923 N/A TYR 71.A N SER 69.A O no hydrogen 2.778 N/A LEU 72.A N TRP 84.A O no hydrogen 2.983 N/A PHE 73.A N ILE 64.A O no hydrogen 2.865 N/A SER 74.A N LYS 82.A O no hydrogen 2.931 N/A SER 74.A OG HIS 56.A NE2 no hydrogen 2.714 N/A CYS 75.A N GLY 62.A O no hydrogen 3.024 N/A GLY 76.A N GLN 80.A O no hydrogen 3.035 N/A GLU 77.A N THR 59.A O no hydrogen 2.980 N/A LYS 79.A N GLY 76.A O no hydrogen 3.160 N/A GLN 80.A N ASP 78.A OD1 no hydrogen 3.119 N/A GLN 80.A NE2.B ASP 78.A OD2 no hydrogen 2.860 N/A LYS 82.A N SER 74.A O no hydrogen 2.892 N/A LYS 82.A NZ GLN 80.A OE1.B no hydrogen 3.512 N/A LYS 82.A NZ HIS 94.A NE2 no hydrogen 2.905 N/A CYS 83.A N ARG 93.A O.A no hydrogen 2.933 N/A CYS 83.A N ARG 93.A O.B no hydrogen 2.991 N/A TRP 84.A N LEU 72.A O no hydrogen 2.727 N/A TRP 84.A NE1 SER 74.A OG no hydrogen 2.934 N/A ASP 85.A N LYS 90.A O no hydrogen 2.904 N/A LEU 86.A N PRO 70.A O no hydrogen 2.771 N/A GLU 87.A N ASP 85.A OD1 no hydrogen 2.873 N/A TYR 88.A N ASP 85.A OD1 no hydrogen 3.183 N/A ASN 89.A N ASP 85.A O no hydrogen 2.651 N/A LYS 90.A N ASP 85.A O no hydrogen 3.422 N/A ILE 92.A N CYS 83.A O no hydrogen 2.867 N/A ARG 93.A N.A CYS 83.A O no hydrogen 3.444 N/A ARG 93.A N.B CYS 83.A O no hydrogen 3.429 N/A ARG 93.A NE.B ILE 92.A O no hydrogen 3.006 N/A ARG 93.A NH1.B ARG 129.A O no hydrogen 3.101 N/A ARG 93.A NH2.A TYR 71.A OH no hydrogen 3.133 N/A TYR 95.A N VAL 81.A O no hydrogen 2.884 N/A TYR 95.A OH VAL 128.A O no hydrogen 2.635 N/A HIS 98.A ND1 ASP 120.A OD2 no hydrogen 3.004 N/A HIS 98.A NE2 THR 116.A OG1 no hydrogen 2.663 N/A LEU 99.A N ASP 120.A OD2 no hydrogen 2.962 N/A VAL 102.A N GLY 76.A O no hydrogen 2.913 N/A TYR 103.A N CYS 117.A O no hydrogen 2.763 N/A GLY 104.A N CYS 117.A O no hydrogen 3.353 N/A ASP 106.A N VAL 115.A O no hydrogen 2.881 N/A LEU 107.A N ASP 106.A OD1 no hydrogen 2.923 N/A HIS 108.A N VAL 113.A O no hydrogen 3.290 N/A HIS 108.A NE2 GLN 155.A OE1 no hydrogen 2.816 N/A THR 110.A N HIS 108.A ND1 no hydrogen 2.979 N/A ILE 111.A N HIS 108.A ND1 no hydrogen 2.975 N/A VAL 113.A N ILE 111.A O no hydrogen 2.829 N/A LEU 114.A N TRP 126.A O no hydrogen 2.888 N/A VAL 115.A N ASP 106.A O no hydrogen 2.859 N/A THR 116.A N ARG 124.A O no hydrogen 2.924 N/A THR 116.A OG1 HIS 98.A NE2 no hydrogen 2.663 N/A CYS 117.A N GLY 104.A O no hydrogen 2.910 N/A CYS 117.A SG VAL 144.A O no hydrogen 3.466 N/A SER 118.A N THR 122.A O no hydrogen 3.006 N/A SER 118.A OG SER 100.A O no hydrogen 3.102 N/A SER 118.A OG ALA 101.A O no hydrogen 2.692 N/A ARG 119.A N ALA 101.A O no hydrogen 2.877 N/A ARG 119.A NE TYR 103.A OH no hydrogen 2.831 N/A ARG 119.A NH2 TYR 103.A OH no hydrogen 3.419 N/A ASP 120.A N SER 118.A OG no hydrogen 3.045 N/A SER 121.A N SER 118.A O no hydrogen 3.151 N/A THR 122.A N ASP 120.A OD1 no hydrogen 2.881 N/A THR 122.A OG1 ASP 120.A OD1 no hydrogen 2.562 N/A THR 122.A OG1 ASP 120.A OD2 no hydrogen 3.400 N/A ALA 123.A N LEU 137.A O no hydrogen 3.252 N/A ARG 124.A N THR 116.A O no hydrogen 2.779 N/A ARG 124.A NE HIS 98.A ND1 no hydrogen 3.203 N/A ARG 124.A NE THR 122.A OG1 no hydrogen 3.002 N/A ARG 124.A NH2 ASP 120.A OD2 no hydrogen 3.322 N/A ILE 125.A N HIS 135.A O no hydrogen 2.858 N/A TRP 126.A N LEU 114.A O no hydrogen 2.809 N/A TRP 126.A NE1 THR 116.A OG1 no hydrogen 2.850 N/A ASP 127.A N ALA 132.A O no hydrogen 2.803 N/A VAL 128.A N ASP 112.A O no hydrogen 3.074 N/A ARG 129.A NE.B TYR 71.A OH no hydrogen 2.772 N/A ARG 129.A NH1.B TYR 71.A OH no hydrogen 2.862 N/A THR 130.A OG1 ASP 127.A OD2 no hydrogen 2.696 N/A LYS 131.A N ASP 127.A O no hydrogen 2.933 N/A ALA 132.A N THR 130.A OG1 no hydrogen 3.155 N/A VAL 134.A N ILE 125.A O no hydrogen 2.772 N/A HIS 135.A NE2 VAL 171.A O no hydrogen 2.885 N/A LEU 137.A N ALA 123.A O no hydrogen 2.701 N/A HIS 140.A ND1 ASP 162.A OD2 no hydrogen 2.897 N/A HIS 140.A NE2 THR 158.A OG1 no hydrogen 2.653 N/A THR 141.A N ASP 162.A OD2 no hydrogen 2.996 N/A VAL 144.A N SER 118.A O no hydrogen 2.891 N/A ALA 145.A N GLY 159.A O no hydrogen 2.959 N/A THR 146.A N GLY 159.A O no hydrogen 3.416 N/A ARG 148.A N ILE 157.A O no hydrogen 2.897 N/A ARG 148.A NH1 VAL 147.A O no hydrogen 2.964 N/A CYS 149.A N ASP 106.A OD2 no hydrogen 2.825 N/A GLN 150.A N GLN 155.A O no hydrogen 2.914 N/A GLN 150.A NE2 PRO 154.A O no hydrogen 2.769 N/A ILE 157.A N ARG 148.A O no hydrogen 2.884 N/A THR 158.A N ARG 166.A O no hydrogen 2.967 N/A THR 158.A OG1 HIS 140.A NE2 no hydrogen 2.653 N/A THR 158.A OG1 ARG 166.A O no hydrogen 3.509 N/A GLY 159.A N THR 146.A O no hydrogen 3.051 N/A SER 160.A N THR 164.A O no hydrogen 3.032 N/A SER 160.A OG ASN 142.A O no hydrogen 3.184 N/A SER 160.A OG ALA 143.A O no hydrogen 2.922 N/A HIS 161.A N ALA 143.A O no hydrogen 2.882 N/A ASP 162.A N SER 160.A OG no hydrogen 2.956 N/A THR 163.A N SER 160.A O no hydrogen 2.995 N/A THR 163.A OG1 ASP 162.A O no hydrogen 2.620 N/A THR 163.A OG1 HIS 182.A O no hydrogen 3.436 N/A THR 164.A N ASP 162.A OD1 no hydrogen 2.876 N/A THR 164.A OG1 ASP 162.A OD1 no hydrogen 2.611 N/A THR 164.A OG1 ASP 162.A OD2 no hydrogen 3.364 N/A ILE 165.A N LEU 179.A O no hydrogen 2.952 N/A ARG 166.A N THR 158.A O no hydrogen 2.983 N/A ARG 166.A NH1 THR 175.A OG1 no hydrogen 2.986 N/A LEU 167.A N.A VAL 177.A O no hydrogen 2.859 N/A LEU 167.A N.B VAL 177.A O no hydrogen 2.868 N/A TRP 168.A N ILE 156.A O no hydrogen 2.861 N/A TRP 168.A NE1 THR 158.A OG1 no hydrogen 2.815 N/A ASP 169.A N LYS 174.A O no hydrogen 2.798 N/A ALA 172.A N ASP 169.A OD1 no hydrogen 3.060 N/A GLY 173.A N ASP 169.A O no hydrogen 2.860 N/A LYS 174.A N ASP 169.A O no hydrogen 3.278 N/A ARG 176.A N LEU 167.A O.A no hydrogen 2.668 N/A ARG 176.A N LEU 167.A O.B no hydrogen 2.683 N/A VAL 177.A N LEU 167.A O.A no hydrogen 3.292 N/A VAL 177.A N LEU 167.A O.B no hydrogen 3.281 N/A LEU 179.A N ILE 165.A O no hydrogen 2.737 N/A HIS 182.A ND1 SER 202.A OG no hydrogen 2.735 N/A HIS 182.A NE2 SER 200.A OG no hydrogen 2.642 N/A LYS 183.A N ASP 204.A OD2 no hydrogen 3.039 N/A LYS 184.A N ASP 204.A OD1 no hydrogen 3.073 N/A SER 185.A OG HIS 161.A O no hydrogen 3.077 N/A VAL 186.A N SER 160.A O no hydrogen 3.025 N/A ARG 187.A N GLY 201.A O no hydrogen 3.200 N/A VAL 190.A N ALA 199.A O no hydrogen 2.873 N/A HIS 192.A N THR 197.A O no hydrogen 3.021 N/A ARG 194.A N HIS 192.A ND1 no hydrogen 3.068 N/A ARG 194.A NH1 SER 234.A O no hydrogen 3.087 N/A ARG 194.A NH2 SER 234.A O no hydrogen 3.158 N/A HIS 195.A N HIS 192.A O no hydrogen 3.098 N/A PHE 198.A N TRP 209.A O no hydrogen 2.951 N/A ALA 199.A N VAL 190.A O no hydrogen 2.847 N/A SER 200.A N LYS 207.A O no hydrogen 2.909 N/A SER 200.A OG HIS 182.A NE2 no hydrogen 2.642 N/A GLY 201.A N ALA 188.A O no hydrogen 2.847 N/A SER 202.A N ASN 205.A O no hydrogen 3.131 N/A SER 202.A OG HIS 182.A ND1 no hydrogen 2.735 N/A SER 202.A OG ASP 204.A OD1 no hydrogen 2.625 N/A SER 202.A OG ASN 205.A O no hydrogen 3.181 N/A ILE 206.A N LEU 220.A O no hydrogen 3.288 N/A LYS 207.A N SER 200.A O no hydrogen 2.796 N/A LYS 207.A NZ ASN 219.A OD1 no hydrogen 2.814 N/A GLN 208.A N GLN 218.A O no hydrogen 2.919 N/A GLN 208.A NE2 TRP 252.A O no hydrogen 2.757 N/A TRP 209.A N PHE 198.A O no hydrogen 2.849 N/A TRP 209.A NE1 SER 200.A OG no hydrogen 2.813 N/A LYS 210.A N SER 215.A O no hydrogen 2.819 N/A PHE 211.A N TYR 196.A O no hydrogen 2.759 N/A GLY 214.A N LYS 210.A O no hydrogen 2.864 N/A ILE 217.A N GLN 208.A O no hydrogen 2.808 N/A GLN 218.A NE2 GLN 208.A OE1 no hydrogen 2.968 N/A GLN 218.A NE2 ARG 253.A O no hydrogen 3.416 N/A LEU 220.A N ILE 206.A O no hydrogen 2.702 N/A SER 221.A OG.A ASN 205.A OD1 no hydrogen 2.914 N/A HIS 223.A ND1 SER 240.A OG no hydrogen 2.741 N/A HIS 223.A NE2 THR 246.A OG1 no hydrogen 2.730 N/A ASN 228.A N GLY 241.A O no hydrogen 2.930 N/A ASN 228.A ND2 ASP 243.A OD1 no hydrogen 3.153 N/A ASN 228.A ND2 ILE 267.A O no hydrogen 2.810 N/A THR 229.A N GLY 241.A O no hydrogen 3.329 N/A THR 231.A N VAL 239.A O no hydrogen 3.101 N/A THR 231.A OG1 CYS 270.A O.A no hydrogen 2.837 N/A THR 231.A OG1 CYS 270.A O.B no hydrogen 2.631 N/A ASN 233.A N VAL 237.A O no hydrogen 3.150 N/A SER 234.A N GLU 276.A OE1 no hydrogen 3.420 N/A SER 234.A N GLU 276.A OE2 no hydrogen 2.835 N/A SER 234.A OG GLU 276.A OE1 no hydrogen 3.471 N/A SER 234.A OG GLU 276.A OE2 no hydrogen 3.111 N/A GLY 236.A N ASN 233.A O no hydrogen 3.104 N/A VAL 237.A N ASN 233.A OD1 no hydrogen 2.878 N/A LEU 238.A N TRP 250.A O no hydrogen 2.884 N/A VAL 239.A N THR 231.A O no hydrogen 2.764 N/A SER 240.A N HIS 248.A O no hydrogen 2.857 N/A SER 240.A OG HIS 223.A ND1 no hydrogen 2.741 N/A SER 240.A OG HIS 248.A O no hydrogen 3.184 N/A GLY 241.A N THR 229.A O no hydrogen 3.019 N/A ALA 242.A N THR 246.A O no hydrogen 2.933 N/A ASP 243.A N ILE 226.A O no hydrogen 2.869 N/A GLY 245.A N ALA 242.A O no hydrogen 3.190 N/A THR 246.A N ASN 244.A OD1 no hydrogen 3.202 N/A THR 246.A OG1 HIS 223.A NE2 no hydrogen 2.730 N/A THR 246.A OG1 ASN 244.A OD1 no hydrogen 2.716 N/A MET 247.A N VAL 261.A O no hydrogen 3.106 N/A HIS 248.A N SER 240.A O no hydrogen 3.032 N/A LEU 249.A N GLN 259.A O no hydrogen 2.885 N/A TRP 250.A N LEU 238.A O no hydrogen 2.714 N/A TRP 250.A NE1 SER 240.A OG no hydrogen 2.816 N/A ASP 251.A N TYR 256.A O no hydrogen 2.803 N/A TRP 252.A N GLY 236.A O no hydrogen 2.805 N/A TRP 252.A NE1 THR 197.A OG1 no hydrogen 3.027 N/A THR 254.A N ASP 251.A OD2 no hydrogen 3.124 N/A THR 254.A OG1 ASP 251.A OD2 no hydrogen 2.744 N/A GLY 255.A N ASP 251.A O no hydrogen 2.855 N/A TYR 256.A N THR 254.A OG1 no hydrogen 3.240 N/A ASN 257.A ND2 LEU 249.A O no hydrogen 2.882 N/A ASN 257.A ND2 GLN 259.A O no hydrogen 3.014 N/A PHE 258.A N LEU 249.A O no hydrogen 2.940 N/A GLN 259.A N LEU 249.A O no hydrogen 3.379 N/A GLN 259.A NE2 TRP 5.A O no hydrogen 2.735 N/A ARG 260.A NE ASN 257.A OD1 no hydrogen 2.762 N/A ARG 260.A NH2 ASN 257.A OD1 no hydrogen 3.537 N/A VAL 261.A N MET 247.A O no hydrogen 2.759 N/A ILE 267.A N ALA 242.A O no hydrogen 2.848 N/A PHE 268.A N ALA 282.A O no hydrogen 2.935 N/A ALA 269.A N ALA 282.A O no hydrogen 3.494 N/A CYS 270.A N.A THR 229.A OG1 no hydrogen 3.182 N/A CYS 270.A N.B THR 229.A OG1 no hydrogen 3.229 N/A CYS 270.A SG.B THR 229.A OG1 no hydrogen 3.412 N/A CYS 270.A SG.B THR 231.A OG1 no hydrogen 3.088 N/A ALA 271.A N LEU 280.A O no hydrogen 2.928 N/A ASP 273.A N ARG 278.A O no hydrogen 3.146 N/A GLN 274.A N ASN 27.A OD1 no hydrogen 2.770 N/A GLN 274.A NE2 VAL 23.A O no hydrogen 3.456 N/A GLN 274.A NE2 GLU 24.A O no hydrogen 3.088 N/A SER 275.A OG ASP 273.A OD1 no hydrogen 3.316 N/A SER 275.A OG ASP 273.A OD2 no hydrogen 2.630 N/A SER 275.A OG SER 277.A OG no hydrogen 3.100 N/A GLU 276.A N ASP 273.A O no hydrogen 3.109 N/A SER 277.A N SER 275.A OG no hydrogen 3.342 N/A SER 277.A OG SER 275.A O no hydrogen 3.551 N/A SER 277.A OG SER 275.A OG no hydrogen 3.100 N/A ARG 278.A N ASP 273.A OD1 no hydrogen 2.899 N/A ARG 278.A NE ASP 273.A OD2 no hydrogen 3.494 N/A ARG 278.A NH1 ASP 273.A OD2 no hydrogen 3.508 N/A LEU 279.A N TYR 291.A O no hydrogen 2.885 N/A LEU 280.A N ALA 271.A O no hydrogen 2.829 N/A THR 281.A N LYS 289.A O no hydrogen 2.875 N/A THR 281.A OG1 GLU 283.A OE2 no hydrogen 2.890 N/A THR 281.A OG1 LYS 289.A O no hydrogen 3.240 N/A ALA 282.A N ALA 269.A O no hydrogen 2.785 N/A GLU 283.A N THR 287.A O no hydrogen 3.047 N/A ALA 284.A N GLY 266.A O no hydrogen 2.898 N/A LYS 286.A N GLU 283.A O no hydrogen 3.318 N/A THR 287.A N ASP 285.A OD1 no hydrogen 3.383 N/A THR 287.A OG1 ASP 285.A OD1 no hydrogen 2.683 N/A THR 287.A OG1 ASP 285.A OD2 no hydrogen 3.347 N/A ILE 288.A N ILE 11.A O no hydrogen 2.863 N/A LYS 289.A N THR 281.A O no hydrogen 3.109 N/A LYS 289.A NZ ASP 285.A OD2 no hydrogen 2.811 N/A LYS 289.A NZ THR 287.A OG1 no hydrogen 3.050 N/A VAL 290.A N ARG 9.A O no hydrogen 2.738 N/A TYR 291.A N LEU 279.A O no hydrogen 2.785 N/A ARG 292.A N LYS 6.A O no hydrogen 3.056 N/A ASP 294.A N PRO 4.A O no hydrogen 2.847 N/A