Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8frn_F.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 LEU 100.A O no hydrogen 3.530 N/A TYR 5.A N ILE 1.A O no hydrogen 2.951 N/A TYR 5.A OH GLU 83.A OE1 no hydrogen 2.777 N/A LEU 6.A N ILE 2.A O no hydrogen 3.306 N/A VAL 7.A N ARG 3.A O no hydrogen 2.944 N/A LYS 8.A N ARG 4.A O no hydrogen 3.158 N/A GLN 9.A N TYR 5.A O no hydrogen 3.315 N/A GLN 9.A NE2 TYR 5.A O no hydrogen 3.471 N/A VAL 10.A N LEU 6.A O no hydrogen 2.775 N/A VAL 11.A N VAL 7.A O no hydrogen 2.896 N/A SER 12.A N LYS 8.A O no hydrogen 3.141 N/A SER 12.A OG LYS 8.A O no hydrogen 2.797 N/A THR 13.A N GLN 9.A O no hydrogen 3.075 N/A SER 14.A N VAL 10.A O no hydrogen 2.750 N/A LEU 15.A N VAL 11.A O no hydrogen 3.023 N/A VAL 16.A N SER 12.A O no hydrogen 3.277 N/A VAL 17.A N THR 13.A O no hydrogen 3.128 N/A ILE 18.A N SER 14.A O no hydrogen 2.699 N/A ALA 19.A N LEU 15.A O no hydrogen 2.923 N/A LEU 20.A N VAL 16.A O no hydrogen 2.760 N/A LEU 21.A N VAL 17.A O no hydrogen 2.693 N/A THR 22.A N ILE 18.A O no hydrogen 2.849 N/A THR 22.A OG1 ILE 18.A O no hydrogen 2.871 N/A LEU 23.A N ALA 19.A O no hydrogen 3.275 N/A ILE 24.A N LEU 20.A O no hydrogen 3.270 N/A ILE 24.A N LEU 21.A O no hydrogen 3.096 N/A MET 25.A N LEU 21.A O no hydrogen 2.548 N/A MET 26.A N THR 22.A O no hydrogen 3.132 N/A GLY 28.A N ILE 24.A O no hydrogen 3.123 N/A LEU 30.A N MET 26.A O no hydrogen 2.847 N/A ILE 31.A N GLY 27.A O no hydrogen 3.100 N/A LYS 32.A N GLY 28.A O no hydrogen 3.040 N/A TYR 33.A N ARG 29.A O no hydrogen 2.713 N/A PHE 34.A N LEU 30.A O no hydrogen 2.848 N/A GLY 35.A N ILE 31.A O no hydrogen 2.885 N/A VAL 36.A N LYS 32.A O no hydrogen 3.170 N/A ALA 37.A N TYR 33.A O no hydrogen 2.968 N/A ALA 38.A N PHE 34.A O no hydrogen 2.922 N/A GLN 39.A N VAL 36.A O no hydrogen 3.164 N/A GLY 40.A N ALA 37.A O no hydrogen 3.172 N/A ARG 41.A N VAL 36.A O no hydrogen 3.318 N/A ARG 41.A NH1 GLN 39.A OE1 no hydrogen 3.443 N/A ASP 43.A N GLN 134.A OE1 no hydrogen 3.278 N/A VAL 46.A N ASP 43.A O no hydrogen 3.210 N/A SER 49.A N VAL 46.A O no hydrogen 2.682 N/A ILE 50.A N VAL 46.A O no hydrogen 3.068 N/A GLY 52.A N PHE 48.A O no hydrogen 3.265 N/A TYR 53.A N SER 49.A O no hydrogen 3.053 N/A ARG 54.A N ILE 50.A O no hydrogen 2.997 N/A ARG 54.A NE GLU 57.A OE1 no hydrogen 2.870 N/A ARG 54.A NH2 GLU 57.A OE1 no hydrogen 3.036 N/A ARG 54.A NH2 GLU 57.A OE2 no hydrogen 2.943 N/A PHE 58.A N ARG 54.A O no hydrogen 3.194 N/A LEU 59.A N MET 55.A O no hydrogen 2.971 N/A THR 60.A N PRO 56.A O no hydrogen 3.188 N/A THR 60.A OG1 PRO 56.A O no hydrogen 2.584 N/A THR 60.A OG1 THR 120.A OG1 no hydrogen 2.710 N/A LEU 61.A N PHE 58.A O no hydrogen 2.881 N/A ILE 62.A N PHE 58.A O no hydrogen 2.907 N/A LEU 63.A N LEU 59.A O no hydrogen 3.153 N/A LEU 65.A N LEU 61.A O no hydrogen 3.244 N/A GLY 66.A N ILE 62.A O no hydrogen 2.357 N/A PHE 67.A N LEU 63.A O no hydrogen 2.939 N/A PHE 68.A N PRO 64.A O no hydrogen 2.946 N/A ILE 69.A N LEU 65.A O no hydrogen 2.893 N/A GLY 70.A N GLY 66.A O no hydrogen 2.810 N/A LEU 71.A N PHE 67.A O no hydrogen 2.915 N/A MET 72.A N PHE 68.A O no hydrogen 3.176 N/A LEU 73.A N ILE 69.A O no hydrogen 2.960 N/A VAL 74.A N GLY 70.A O no hydrogen 3.262 N/A PHE 75.A N LEU 71.A O no hydrogen 2.970 N/A GLY 76.A N MET 72.A O no hydrogen 2.633 N/A ARG 77.A N LEU 73.A O no hydrogen 2.919 N/A ARG 77.A NE GLN 9.A OE1 no hydrogen 2.993 N/A ARG 77.A NH1 GLU 83.A OE2 no hydrogen 2.826 N/A ARG 77.A NH2 GLU 83.A OE1 no hydrogen 2.496 N/A ARG 77.A NH2 GLU 83.A OE2 no hydrogen 2.949 N/A LEU 78.A N VAL 74.A O no hydrogen 3.026 N/A TYR 79.A N PHE 75.A O no hydrogen 3.324 N/A VAL 80.A N GLY 76.A O no hydrogen 2.846 N/A ASP 81.A N ARG 77.A O no hydrogen 3.096 N/A HIS 82.A N TYR 79.A O no hydrogen 3.464 N/A MET 84.A N LEU 78.A O no hydrogen 2.850 N/A LEU 87.A N MET 84.A O no hydrogen 3.203 N/A ASN 88.A N MET 84.A O no hydrogen 2.724 N/A GLY 89.A N ALA 85.A O no hydrogen 2.851 N/A SER 90.A N LEU 87.A O no hydrogen 3.339 N/A SER 90.A OG VAL 86.A O no hydrogen 2.424 N/A GLY 91.A N ASN 88.A O no hydrogen 3.100 N/A ILE 92.A N LEU 87.A O no hydrogen 2.824 N/A ARG 96.A N SER 93.A OG no hydrogen 3.082 N/A LEU 97.A N SER 93.A O no hydrogen 3.206 N/A GLY 98.A N ARG 94.A O no hydrogen 2.959 N/A GLN 99.A N ILE 95.A O no hydrogen 2.898 N/A LEU 100.A N ARG 96.A O no hydrogen 3.108 N/A LEU 100.A N LEU 97.A O no hydrogen 3.343 N/A LEU 101.A N GLY 98.A O no hydrogen 3.362 N/A ALA 105.A N LEU 101.A O no hydrogen 2.860 N/A LEU 106.A N ILE 102.A O no hydrogen 2.891 N/A VAL 107.A N PRO 103.A O no hydrogen 3.345 N/A PHE 108.A N LEU 104.A O no hydrogen 3.002 N/A LEU 109.A N ALA 105.A O no hydrogen 2.710 N/A VAL 110.A N LEU 106.A O no hydrogen 2.882 N/A ILE 111.A N VAL 107.A O no hydrogen 2.894 N/A GLN 112.A N PHE 108.A O no hydrogen 2.941 N/A GLY 113.A N LEU 109.A O no hydrogen 2.745 N/A ILE 114.A N VAL 110.A O no hydrogen 3.026 N/A LEU 115.A N ILE 111.A O no hydrogen 3.119 N/A MET 116.A N GLN 112.A O no hydrogen 2.719 N/A LEU 117.A N GLY 113.A O no hydrogen 3.136 N/A TRP 118.A N ILE 114.A O no hydrogen 2.953 N/A MET 119.A N ILE 114.A O no hydrogen 3.209 N/A THR 120.A N LEU 115.A O no hydrogen 2.649 N/A THR 120.A OG1 PRO 56.A O no hydrogen 3.037 N/A THR 120.A OG1 THR 60.A OG1 no hydrogen 2.710 N/A THR 120.A OG1 LEU 115.A O no hydrogen 2.937 N/A TRP 122.A N TRP 118.A O no hydrogen 2.969 N/A GLY 123.A N MET 119.A O no hydrogen 2.578 N/A LEU 124.A N THR 120.A O no hydrogen 3.069 N/A ARG 125.A N PRO 121.A O no hydrogen 2.716 N/A ARG 125.A NE ALA 189.A O no hydrogen 3.248 N/A GLN 126.A N TRP 122.A O no hydrogen 3.230 N/A PHE 127.A N GLY 123.A O no hydrogen 3.124 N/A ASP 128.A N LEU 124.A O no hydrogen 3.046 N/A GLN 129.A N ARG 125.A O no hydrogen 3.270 N/A LEU 130.A N GLN 126.A O no hydrogen 3.003 N/A SER 131.A N PHE 127.A O no hydrogen 2.648 N/A SER 132.A N ASP 128.A O no hydrogen 3.045 N/A SER 132.A OG ASP 128.A O no hydrogen 3.017 N/A SER 133.A N GLN 129.A O no hydrogen 3.204 N/A SER 133.A N LEU 130.A O no hydrogen 3.062 N/A GLN 134.A N LEU 130.A O no hydrogen 3.284 N/A GLN 134.A N SER 131.A O no hydrogen 3.053 N/A ARG 137.A NE GLY 40.A O no hydrogen 3.197 N/A ARG 137.A NH2 GLY 40.A O no hydrogen 2.359 N/A THR 138.A OG1 SER 151.A OG no hydrogen 3.013 N/A GLY 139.A N SER 151.A OG no hydrogen 3.306 N/A LEU 142.A N GLY 139.A O no hydrogen 3.410 N/A LYS 146.A N ALA 158.A O no hydrogen 2.621 N/A LYS 146.A NZ GLY 159.A O no hydrogen 2.739 N/A ILE 149.A N ILE 156.A O no hydrogen 2.912 N/A SER 150.A OG THR 155.A OG1 no hydrogen 3.185 N/A SER 151.A N TYR 154.A O no hydrogen 2.910 N/A SER 151.A OG THR 138.A OG1 no hydrogen 3.013 N/A TYR 154.A N SER 151.A O no hydrogen 3.203 N/A THR 155.A N TYR 174.A O no hydrogen 2.998 N/A THR 155.A OG1 SER 150.A OG no hydrogen 3.185 N/A ILE 156.A N ILE 149.A O no hydrogen 2.889 N/A TYR 157.A N PHE 172.A O no hydrogen 2.821 N/A GLY 159.A N ASP 170.A O no hydrogen 2.969 N/A ASP 160.A N LYS 169.A O no hydrogen 3.130 N/A LEU 161.A N ASP 160.A OD1 no hydrogen 2.393 N/A SER 162.A OG LYS 166.A O no hydrogen 3.136 N/A ASP 164.A N ASP 164.A OD1 no hydrogen 2.560 N/A ARG 165.A NH1 ALA 38.A O no hydrogen 3.361 N/A ARG 165.A NH2 VAL 143.A O no hydrogen 2.692 N/A LYS 166.A N ASP 164.A O no hydrogen 2.778 N/A LEU 168.A N ALA 184.A O no hydrogen 2.577 N/A LYS 169.A N ASP 160.A O no hydrogen 3.266 N/A ASP 170.A N LYS 182.A O no hydrogen 2.973 N/A ILE 171.A N ALA 181.A O no hydrogen 2.792 N/A PHE 172.A N TYR 157.A O no hydrogen 2.678 N/A PHE 173.A N ILE 179.A O no hydrogen 2.626 N/A TYR 174.A N THR 155.A O no hydrogen 2.904 N/A ILE 179.A N PHE 173.A O no hydrogen 2.711 N/A ALA 181.A N ILE 171.A O no hydrogen 2.923 N/A ALA 184.A N LEU 168.A O no hydrogen 3.108 N/A THR 185.A OG1 ASN 167.A OD1 no hydrogen 3.556 N/A ALA 189.A N LYS 186.A O no hydrogen 3.392 N/A SER 192.A OG LEU 117.A O no hydrogen 2.564 N/A LYS 194.A N PRO 191.A O no hydrogen 3.049 N/A TRP 196.A N SER 193.A O no hydrogen 3.153 N/A TRP 199.A N ASN 197.A O no hydrogen 2.702 N/A TRP 199.A NE1 TRP 196.A O no hydrogen 3.070 N/A ALA 205.A N ASP 201.A O no hydrogen 2.747 N/A SER 206.A N PRO 202.A O no hydrogen 2.844 N/A SER 206.A OG PRO 202.A O no hydrogen 2.926 N/A SER 206.A OG VAL 203.A O no hydrogen 2.580 N/A SER 206.A OG SER 263.A OG no hydrogen 2.603 N/A GLU 207.A N VAL 203.A O no hydrogen 3.046 N/A MET 208.A N ILE 204.A O no hydrogen 2.605 N/A TRP 210.A N SER 206.A O no hydrogen 3.047 N/A ARG 211.A N GLU 207.A O no hydrogen 2.983 N/A ARG 211.A N MET 208.A O no hydrogen 3.128 N/A ARG 211.A NE GLU 207.A OE2 no hydrogen 2.640 N/A ARG 211.A NH1 LEU 190.A O no hydrogen 3.325 N/A ARG 211.A NH1 SER 192.A OG no hydrogen 2.472 N/A ARG 211.A NH2 VAL 187.A O no hydrogen 3.393 N/A ARG 211.A NH2 LEU 190.A O no hydrogen 2.933 N/A ARG 211.A NH2 GLU 207.A OE2 no hydrogen 2.877 N/A VAL 212.A N MET 208.A O no hydrogen 3.001 N/A PHE 213.A N GLY 209.A O no hydrogen 2.955 N/A THR 217.A N GLY 214.A O no hydrogen 3.159 N/A THR 217.A OG1 GLY 214.A O no hydrogen 2.818 N/A ILE 218.A N PRO 215.A O no hydrogen 3.278 N/A ILE 220.A N PHE 216.A O no hydrogen 3.474 N/A ALA 221.A N THR 217.A O no hydrogen 2.712 N/A LEU 222.A N VAL 219.A O no hydrogen 2.959 N/A MET 223.A N VAL 219.A O no hydrogen 3.132 N/A MET 224.A N ILE 220.A O no hydrogen 3.064 N/A VAL 226.A N LEU 222.A O no hydrogen 3.213 N/A LEU 228.A N MET 224.A O no hydrogen 3.256 N/A CYS 229.A SG VAL 226.A O no hydrogen 3.152 N/A GLN 235.A N SER 232.A O no hydrogen 2.991 N/A GLY 236.A N SER 232.A O no hydrogen 3.298 N/A ARG 237.A NE LEU 73.A O no hydrogen 2.853 N/A ARG 237.A NH1 TYR 238.A OH no hydrogen 3.503 N/A LEU 241.A N TYR 238.A O no hydrogen 3.448 N/A ALA 244.A N LEU 241.A O no hydrogen 2.982 N/A ILE 245.A N LEU 241.A O no hydrogen 2.626 N/A PHE 248.A N ALA 244.A O no hydrogen 3.075 N/A ALA 249.A N ILE 245.A O no hydrogen 2.730 N/A SER 250.A N PHE 246.A O no hydrogen 2.905 N/A SER 250.A OG ILE 247.A O no hydrogen 2.584 N/A SER 250.A OG TYR 279.A OH no hydrogen 2.360 N/A LEU 251.A N PHE 248.A O no hydrogen 2.937 N/A ILE 252.A N PHE 248.A O no hydrogen 3.342 N/A VAL 253.A N ALA 249.A O no hydrogen 2.884 N/A LEU 254.A N SER 250.A O no hydrogen 3.143 N/A LEU 255.A N LEU 251.A O no hydrogen 2.866 N/A ILE 256.A N ILE 252.A O no hydrogen 2.755 N/A ALA 257.A N VAL 253.A O no hydrogen 2.979 N/A ILE 258.A N LEU 255.A O no hydrogen 3.328 N/A ARG 259.A N LEU 255.A O no hydrogen 3.014 N/A ARG 259.A NH1 GLU 207.A OE1 no hydrogen 2.600 N/A ARG 259.A NH2 GLU 207.A OE1 no hydrogen 2.535 N/A THR 260.A N ILE 256.A O no hydrogen 3.356 N/A THR 260.A OG1 ILE 256.A O no hydrogen 3.203 N/A ILE 262.A N ILE 258.A O no hydrogen 3.050 N/A SER 263.A N ARG 259.A O no hydrogen 3.230 N/A SER 263.A OG SER 206.A OG no hydrogen 2.603 N/A SER 263.A OG ARG 259.A O no hydrogen 2.861 N/A ARG 264.A N THR 260.A O no hydrogen 3.230 N/A ASP 265.A N ILE 262.A O no hydrogen 2.733 N/A GLU 266.A N ARG 261.A O no hydrogen 3.017 N/A ALA 271.A N GLY 268.A O no hydrogen 3.493 N/A TYR 272.A N VAL 269.A O no hydrogen 3.390 N/A TYR 272.A OH SER 206.A O no hydrogen 2.901 N/A ALA 275.A N ALA 271.A O no hydrogen 3.100 N/A LEU 276.A N TYR 272.A O no hydrogen 3.242 N/A ALA 277.A N PRO 273.A O no hydrogen 2.549 N/A VAL 278.A N ALA 274.A O no hydrogen 3.006 N/A TYR 279.A N ALA 275.A O no hydrogen 3.373 N/A TYR 279.A OH SER 250.A OG no hydrogen 2.360 N/A GLY 280.A N LEU 276.A O no hydrogen 2.591 N/A ILE 281.A N ALA 277.A O no hydrogen 2.645 N/A ALA 282.A N VAL 278.A O no hydrogen 2.909 N/A ALA 283.A N TYR 279.A O no hydrogen 3.009 N/A ALA 284.A N GLY 280.A O no hydrogen 2.977 N/A LEU 285.A N ILE 281.A O no hydrogen 2.804 N/A PHE 286.A N ALA 282.A O no hydrogen 2.986 N/A SER 287.A N ALA 283.A O no hydrogen 2.990 N/A ARG 288.A N LEU 285.A O no hydrogen 3.169 N/A ARG 288.A NH1 ALA 284.A O no hydrogen 3.306 N/A