Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yne_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N GLU 59.A OE2 no hydrogen 3.184 N/A HIS 8.A ND1 VAL 6.A O no hydrogen 2.978 N/A ILE 9.A N VAL 75.A O no hydrogen 2.735 N/A ARG 11.A N GLU 78.A OE2 no hydrogen 2.874 N/A ARG 11.A NE GLU 78.A O no hydrogen 2.702 N/A ARG 11.A NH1 PRO 81.A O no hydrogen 3.287 N/A ARG 11.A NH2 GLU 78.A O no hydrogen 3.191 N/A ARG 11.A NH2 PRO 81.A O no hydrogen 2.733 N/A ASP 13.A N LYS 10.A O no hydrogen 3.238 N/A ILE 14.A N ARG 11.A O no hydrogen 2.902 N/A VAL 15.A N GLU 32.A O no hydrogen 2.993 N/A LYS 17.A N LEU 30.A O no hydrogen 2.762 N/A TRP 18.A N LEU 30.A O no hydrogen 3.436 N/A LEU 20.A N VAL 28.A O no hydrogen 2.738 N/A GLY 21.A N VAL 28.A O no hydrogen 3.309 N/A GLY 23.A N GLY 26.A O no hydrogen 3.212 N/A GLY 26.A N GLY 23.A O no hydrogen 2.989 N/A VAL 28.A N GLY 21.A O no hydrogen 2.966 N/A PHE 29.A N VAL 45.A O no hydrogen 2.737 N/A LEU 30.A N TRP 18.A O no hydrogen 2.804 N/A ALA 31.A N VAL 43.A O no hydrogen 2.984 N/A GLU 32.A N VAL 15.A O no hydrogen 2.918 N/A CYS 33.A N MET 41.A O no hydrogen 2.703 N/A CYS 33.A SG ASP 13.A O no hydrogen 3.913 N/A HIS 34.A N ASP 13.A O no hydrogen 2.957 N/A MET 41.A N CYS 33.A O no hydrogen 3.238 N/A VAL 43.A N ALA 31.A O no hydrogen 2.800 N/A ALA 44.A N PHE 86.A O no hydrogen 2.836 N/A VAL 45.A N PHE 29.A O no hydrogen 2.804 N/A LYS 46.A N MET 84.A O no hydrogen 2.835 N/A ALA 47.A N LYS 27.A O no hydrogen 2.984 N/A LEU 48.A N LEU 82.A O no hydrogen 2.995 N/A ARG 56.A N GLN 52.A O no hydrogen 3.513 N/A GLU 57.A N ASP 53.A O no hydrogen 2.910 N/A ALA 58.A N PHE 54.A O no hydrogen 2.823 N/A GLU 59.A N GLN 55.A O no hydrogen 2.893 N/A LEU 60.A N ARG 56.A O no hydrogen 2.950 N/A LEU 61.A N GLU 57.A O no hydrogen 2.753 N/A THR 62.A N ALA 58.A O no hydrogen 2.879 N/A THR 62.A OG1 ALA 58.A O no hydrogen 2.736 N/A MET 63.A N GLU 59.A O no hydrogen 3.077 N/A LEU 64.A N LEU 60.A O no hydrogen 2.912 N/A GLN 65.A N MET 63.A O no hydrogen 2.960 N/A HIS 68.A N HIS 66.A ND1 no hydrogen 2.940 N/A ILE 69.A N HIS 66.A O no hydrogen 3.073 N/A VAL 70.A N ILE 163.A O no hydrogen 2.971 N/A ARG 71.A N GLU 87.A OE1 no hydrogen 2.787 N/A PHE 73.A N VAL 85.A O no hydrogen 2.740 N/A VAL 75.A N HIS 7.A O no hydrogen 2.911 N/A CYS 76.A N LEU 83.A O no hydrogen 2.886 N/A CYS 76.A SG ILE 9.A O no hydrogen 3.191 N/A LEU 83.A N CYS 76.A O no hydrogen 2.936 N/A MET 84.A N LYS 46.A O no hydrogen 2.923 N/A VAL 85.A N GLY 74.A O no hydrogen 2.862 N/A PHE 86.A N ALA 44.A O no hydrogen 2.726 N/A GLU 87.A N ARG 71.A O no hydrogen 2.920 N/A ARG 90.A NH1 GLU 112.A OE2 no hydrogen 2.684 N/A ARG 90.A NH1 GLN 157.A OE1 no hydrogen 2.873 N/A ARG 90.A NH2 GLU 112.A OE1 no hydrogen 2.881 N/A ARG 90.A NH2 GLU 112.A OE2 no hydrogen 3.538 N/A HIS 91.A N VAL 155.A O no hydrogen 2.853 N/A HIS 91.A NE2 ASP 113.A OD1 no hydrogen 2.820 N/A HIS 91.A NE2 ASP 113.A OD2 no hydrogen 2.749 N/A GLY 92.A N MET 89.A O no hydrogen 3.080 N/A LEU 94.A N CYS 153.A O no hydrogen 2.751 N/A ASN 95.A ND2 THR 150.A OG1 no hydrogen 3.242 N/A ASN 95.A ND2 GLU 207.A OE2 no hydrogen 3.522 N/A ASN 95.A ND2 GLY 212.A O no hydrogen 3.191 N/A ARG 96.A N ASP 93.A OD1 no hydrogen 2.900 N/A PHE 97.A N ASP 93.A O no hydrogen 3.128 N/A LEU 98.A N LEU 94.A O no hydrogen 2.929 N/A ARG 99.A N ASN 95.A O no hydrogen 3.082 N/A ARG 99.A NE ASN 95.A OD1 no hydrogen 2.971 N/A SER 100.A N ARG 96.A O no hydrogen 2.902 N/A SER 100.A OG ARG 96.A O no hydrogen 3.397 N/A SER 100.A OG PHE 97.A O no hydrogen 2.779 N/A HIS 101.A N PHE 97.A O no hydrogen 3.253 N/A HIS 101.A N LEU 98.A O no hydrogen 2.981 N/A HIS 101.A ND1 GLY 117.A O no hydrogen 2.810 N/A GLY 102.A N ARG 99.A O no hydrogen 3.139 N/A ALA 105.A N GLY 102.A O no hydrogen 3.187 N/A GLU 112.A N GLU 112.A OE1 no hydrogen 2.597 N/A GLY 120.A N GLN 123.A OE1 no hydrogen 2.799 N/A LEU 124.A N GLY 120.A O no hydrogen 2.879 N/A LEU 125.A N LEU 121.A O no hydrogen 2.896 N/A ALA 126.A N GLY 122.A O no hydrogen 2.902 N/A VAL 127.A N GLN 123.A O no hydrogen 2.907 N/A ALA 128.A N LEU 124.A O no hydrogen 3.045 N/A SER 129.A N LEU 125.A O no hydrogen 2.842 N/A GLN 130.A N ALA 126.A O no hydrogen 3.028 N/A GLN 130.A NE2 ALA 126.A O no hydrogen 3.106 N/A GLN 130.A NE2 LEU 159.A O no hydrogen 3.186 N/A VAL 131.A N VAL 127.A O no hydrogen 3.204 N/A ALA 132.A N ALA 128.A O no hydrogen 2.982 N/A ALA 133.A N SER 129.A O no hydrogen 2.814 N/A GLY 134.A N GLN 130.A O no hydrogen 3.101 N/A MET 135.A N VAL 131.A O no hydrogen 3.010 N/A VAL 136.A N ALA 132.A O no hydrogen 2.802 N/A TYR 137.A N ALA 133.A O no hydrogen 3.259 N/A LEU 138.A N GLY 134.A O no hydrogen 3.213 N/A ALA 139.A N MET 135.A O no hydrogen 2.887 N/A GLY 140.A N VAL 136.A O no hydrogen 2.968 N/A LEU 141.A N TYR 137.A O no hydrogen 3.283 N/A LEU 141.A N LEU 138.A O no hydrogen 3.000 N/A HIS 142.A N ALA 139.A O no hydrogen 2.933 N/A PHE 143.A N LEU 138.A O no hydrogen 2.874 N/A HIS 145.A N ASP 197.A OD2 no hydrogen 2.881 N/A HIS 145.A NE2 ASP 165.A O no hydrogen 2.889 N/A ASP 147.A N HIS 145.A ND1 no hydrogen 3.050 N/A THR 150.A N GLU 207.A OE1 no hydrogen 2.944 N/A THR 150.A OG1 GLU 207.A OE2 no hydrogen 2.741 N/A ARG 151.A NE TYR 172.A OH no hydrogen 2.896 N/A ARG 151.A NH2 ASP 147.A OD1 no hydrogen 2.795 N/A ASN 152.A N ALA 149.A O no hydrogen 2.949 N/A ASN 152.A ND2 ASP 147.A O no hydrogen 2.746 N/A CYS 153.A N THR 150.A O no hydrogen 2.990 N/A CYS 153.A SG ALA 149.A O no hydrogen 3.779 N/A LEU 154.A N LYS 162.A O no hydrogen 2.773 N/A VAL 155.A N GLY 92.A O no hydrogen 2.934 N/A GLY 156.A N VAL 160.A O no hydrogen 2.765 N/A GLY 158.A N ASP 113.A OD2 no hydrogen 2.851 N/A LEU 159.A N GLY 156.A O no hydrogen 3.103 N/A VAL 160.A N GLN 157.A O no hydrogen 3.514 N/A VAL 161.A N GLN 130.A OE1 no hydrogen 2.826 N/A LYS 162.A N LEU 154.A O no hydrogen 2.927 N/A LYS 162.A NZ GLU 87.A OE1 no hydrogen 2.676 N/A LYS 162.A NZ GLU 87.A OE2 no hydrogen 3.542 N/A ILE 163.A N HIS 68.A O no hydrogen 2.926 N/A GLY 164.A N ASN 152.A O no hydrogen 2.798 N/A ASP 165.A N ASN 152.A O no hydrogen 3.091 N/A TYR 172.A OH ASP 147.A OD2 no hydrogen 2.457 N/A TYR 173.A N LEU 177.A O no hydrogen 3.071 N/A LEU 177.A N TYR 173.A O no hydrogen 3.108 N/A ARG 180.A NH1 PRO 215.A O no hydrogen 3.161 N/A ARG 180.A NH1 TRP 216.A O no hydrogen 2.870 N/A ARG 180.A NH1 LEU 219.A O no hydrogen 3.229 N/A ARG 180.A NH2 LEU 219.A O no hydrogen 2.905 N/A ARG 180.A NH2 ASN 221.A OD1 no hydrogen 3.259 N/A TRP 181.A N PRO 178.A O no hydrogen 2.861 N/A TRP 181.A NE1 GLU 207.A OE1 no hydrogen 2.812 N/A MET 182.A N ILE 179.A O no hydrogen 3.030 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.814 N/A SER 186.A N PRO 183.A O no hydrogen 3.063 N/A SER 186.A OG LYS 191.A O no hydrogen 2.832 N/A ILE 187.A N PRO 183.A O no hydrogen 3.238 N/A LEU 188.A N PRO 184.A O no hydrogen 2.767 N/A TYR 189.A N GLU 185.A O no hydrogen 3.015 N/A ARG 190.A N SER 186.A O no hydrogen 3.103 N/A LYS 191.A N GLU 185.A O no hydrogen 3.148 N/A THR 193.A N SER 196.A OG no hydrogen 2.765 N/A THR 193.A OG1 GLU 195.A OE1 no hydrogen 2.843 N/A THR 193.A OG1 SER 196.A OG no hydrogen 3.198 N/A THR 194.A OG1 GLU 195.A OE1 no hydrogen 3.501 N/A SER 196.A N THR 193.A OG1 no hydrogen 3.415 N/A SER 196.A OG GLU 185.A OE2 no hydrogen 2.902 N/A SER 196.A OG THR 193.A OG1 no hydrogen 3.198 N/A ASP 197.A N THR 193.A O no hydrogen 3.207 N/A VAL 198.A N THR 194.A O no hydrogen 3.167 N/A TRP 199.A N GLU 195.A O no hydrogen 3.288 N/A SER 200.A N SER 196.A O no hydrogen 3.075 N/A SER 200.A OG TRP 181.A O no hydrogen 2.688 N/A SER 200.A OG SER 196.A O no hydrogen 3.513 N/A PHE 201.A N ASP 197.A O no hydrogen 2.788 N/A GLY 202.A N VAL 198.A O no hydrogen 2.962 N/A VAL 203.A N TRP 199.A O no hydrogen 3.137 N/A VAL 204.A N SER 200.A O no hydrogen 2.892 N/A LEU 205.A N PHE 201.A O no hydrogen 2.839 N/A TRP 206.A N GLY 202.A O no hydrogen 3.115 N/A TRP 206.A NE1 GLU 235.A O no hydrogen 2.877 N/A GLU 207.A N VAL 203.A O no hydrogen 2.854 N/A ILE 208.A N VAL 204.A O no hydrogen 2.899 N/A PHE 209.A N LEU 205.A O no hydrogen 3.079 N/A THR 210.A N TRP 206.A O no hydrogen 2.970 N/A THR 210.A N GLU 207.A O no hydrogen 3.298 N/A THR 210.A OG1 TRP 206.A O no hydrogen 3.055 N/A THR 210.A OG1 GLU 207.A O no hydrogen 3.064 N/A TYR 211.A N ILE 208.A O no hydrogen 3.122 N/A GLY 212.A N GLU 207.A O no hydrogen 2.598 N/A LYS 213.A N THR 210.A OG1 no hydrogen 3.091 N/A GLN 214.A NE2 THR 170.A O no hydrogen 3.313 N/A GLN 214.A NE2 ASP 171.A OD1 no hydrogen 2.849 N/A GLN 218.A N GLN 218.A OE1 no hydrogen 2.359 N/A LEU 219.A N TRP 216.A O no hydrogen 2.706 N/A SER 220.A N GLU 223.A OE1 no hydrogen 2.804 N/A SER 220.A OG THR 222.A OG1 no hydrogen 3.358 N/A THR 222.A OG1 SER 220.A OG no hydrogen 3.358 N/A GLU 223.A N SER 220.A OG no hydrogen 3.097 N/A ALA 224.A N SER 220.A O no hydrogen 2.888 N/A ILE 225.A N ASN 221.A O no hydrogen 2.976 N/A ASP 226.A N THR 222.A O no hydrogen 2.905 N/A CYS 227.A N GLU 223.A O no hydrogen 3.043 N/A CYS 227.A SG GLU 223.A O no hydrogen 3.550 N/A ILE 228.A N ALA 224.A O no hydrogen 2.940 N/A THR 229.A N ILE 225.A O no hydrogen 2.992 N/A THR 229.A OG1 ILE 225.A O no hydrogen 2.907 N/A THR 229.A OG1 ASP 226.A O no hydrogen 3.426 N/A GLN 230.A N ASP 226.A O no hydrogen 2.938 N/A GLN 230.A N CYS 227.A O no hydrogen 3.283 N/A ARG 232.A N CYS 227.A O no hydrogen 2.956 N/A ARG 236.A NH1 CYS 240.A O no hydrogen 2.730 N/A ARG 236.A NH1 TYR 279.A OH no hydrogen 2.659 N/A CYS 240.A N PRO 237.A O no hydrogen 2.984 N/A CYS 240.A SG PRO 241.A O no hydrogen 3.423 N/A GLU 243.A N GLU 243.A OE1 no hydrogen 3.023 N/A VAL 244.A N PRO 241.A O no hydrogen 2.985 N/A TYR 245.A N PRO 241.A O no hydrogen 3.046 N/A TYR 245.A OH LEU 234.A O no hydrogen 2.617 N/A ALA 246.A N PRO 242.A O no hydrogen 2.958 N/A ILE 247.A N GLU 243.A O no hydrogen 3.398 N/A MET 248.A N VAL 244.A O no hydrogen 3.090 N/A ARG 249.A N TYR 245.A O no hydrogen 2.942 N/A GLY 250.A N ALA 246.A O no hydrogen 2.971 N/A CYS 251.A N ILE 247.A O no hydrogen 3.196 N/A CYS 251.A N MET 248.A O no hydrogen 2.923 N/A CYS 251.A SG VAL 198.A O no hydrogen 3.474 N/A CYS 251.A SG ILE 247.A O no hydrogen 3.476 N/A TRP 252.A N ARG 249.A O no hydrogen 3.152 N/A ARG 254.A NH1 THR 229.A O no hydrogen 3.359 N/A ARG 254.A NH2 THR 229.A O no hydrogen 3.101 N/A GLN 258.A N GLU 255.A O no hydrogen 2.957 N/A ARG 259.A N PRO 256.A O no hydrogen 3.132 N/A ARG 259.A NE GLN 253.A O no hydrogen 2.758 N/A ARG 259.A NH1 GLU 185.A OE2 no hydrogen 2.868 N/A ARG 259.A NH1 GLU 195.A O no hydrogen 2.954 N/A ARG 259.A NH2 GLU 185.A OE1 no hydrogen 2.758 N/A ARG 259.A NH2 GLU 185.A OE2 no hydrogen 3.529 N/A ARG 259.A NH2 GLN 253.A O no hydrogen 3.208 N/A ARG 259.A NH2 ARG 254.A O no hydrogen 3.197 N/A ASP 264.A N SER 261.A OG no hydrogen 3.103 N/A VAL 265.A N SER 261.A O no hydrogen 2.993 N/A HIS 266.A N ILE 262.A O no hydrogen 2.903 N/A ALA 267.A N LYS 263.A O no hydrogen 2.999 N/A ARG 268.A N ASP 264.A O no hydrogen 3.110 N/A ARG 268.A NE ASP 264.A OD2 no hydrogen 3.514 N/A LEU 269.A N VAL 265.A O no hydrogen 3.001 N/A GLN 270.A N HIS 266.A O no hydrogen 2.826 N/A ALA 271.A N ALA 267.A O no hydrogen 3.103 N/A LEU 272.A N ARG 268.A O no hydrogen 3.105 N/A ALA 273.A N LEU 269.A O no hydrogen 2.850 N/A GLN 274.A N GLN 270.A O no hydrogen 3.060 N/A GLN 274.A N ALA 271.A O no hydrogen 3.179 N/A ALA 275.A N ALA 271.A O no hydrogen 3.144 N/A ALA 275.A N LEU 272.A O no hydrogen 2.937 N/A TYR 279.A OH ARG 238.A O no hydrogen 2.529 N/A