Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7x8s_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 4.A OE2 no hydrogen 3.128 N/A THR 5.A OG1 SER 1.A O no hydrogen 3.208 N/A VAL 6.A N LEU 2.A O no hydrogen 2.914 N/A GLN 7.A N TRP 3.A O no hydrogen 2.921 N/A GLN 7.A NE2 GLU 4.A O no hydrogen 3.474 N/A LYS 8.A N GLU 4.A O no hydrogen 2.910 N/A TRP 9.A N THR 5.A O no hydrogen 2.881 N/A ARG 10.A N VAL 6.A O no hydrogen 2.914 N/A GLU 11.A N GLN 7.A O no hydrogen 2.926 N/A TYR 12.A N LYS 8.A O no hydrogen 2.883 N/A ARG 13.A N TRP 9.A O no hydrogen 2.901 N/A ARG 14.A N ARG 10.A O no hydrogen 2.907 N/A GLN 15.A N GLU 11.A O no hydrogen 2.896 N/A CYS 16.A N TYR 12.A O no hydrogen 2.895 N/A CYS 16.A SG TYR 12.A O no hydrogen 3.237 N/A GLN 17.A N ARG 13.A O no hydrogen 2.890 N/A ARG 18.A N ARG 14.A O no hydrogen 2.908 N/A SER 19.A N GLN 15.A O no hydrogen 2.895 N/A LEU 20.A N CYS 16.A O no hydrogen 2.907 N/A THR 21.A N GLN 17.A O no hydrogen 2.952 N/A THR 21.A OG1 GLN 17.A O no hydrogen 2.331 N/A ASP 23.A N ARG 18.A O no hydrogen 3.021 N/A GLN 27.A N GLU 25.A OE2 no hydrogen 3.219 N/A LEU 28.A N GLU 25.A OE1 no hydrogen 2.780 N/A LEU 29.A N GLU 25.A O no hydrogen 2.797 N/A PHE 30.A N GLU 26.A O no hydrogen 2.903 N/A LEU 31.A N GLN 27.A O no hydrogen 2.914 N/A TYR 32.A N LEU 28.A O no hydrogen 2.878 N/A TYR 32.A OH ASP 85.A OD2 no hydrogen 2.953 N/A ILE 33.A N LEU 29.A O no hydrogen 2.897 N/A ILE 34.A N PHE 30.A O no hydrogen 2.928 N/A TYR 35.A N LEU 31.A O no hydrogen 2.979 N/A THR 36.A N TYR 32.A O no hydrogen 2.894 N/A THR 36.A OG1 TYR 32.A O no hydrogen 2.340 N/A THR 36.A OG1 ILE 33.A O no hydrogen 2.925 N/A VAL 37.A N ILE 33.A O no hydrogen 2.938 N/A GLY 38.A N ILE 34.A O no hydrogen 2.972 N/A TYR 39.A N TYR 35.A O no hydrogen 2.864 N/A ALA 40.A N THR 36.A O no hydrogen 2.889 N/A LEU 41.A N VAL 37.A O no hydrogen 2.923 N/A SER 42.A N GLY 38.A O no hydrogen 2.922 N/A SER 42.A OG GLY 38.A O no hydrogen 3.069 N/A SER 42.A OG SER 268.A O no hydrogen 2.621 N/A PHE 43.A N TYR 39.A O no hydrogen 2.836 N/A SER 44.A N ALA 40.A O no hydrogen 2.958 N/A ALA 45.A N LEU 41.A O no hydrogen 2.895 N/A LEU 46.A N SER 42.A O no hydrogen 2.900 N/A VAL 47.A N PHE 43.A O no hydrogen 2.910 N/A ILE 48.A N SER 44.A O no hydrogen 2.988 N/A ALA 49.A N ALA 45.A O no hydrogen 2.846 N/A SER 50.A N LEU 46.A O no hydrogen 2.894 N/A SER 50.A OG LEU 46.A O no hydrogen 3.281 N/A ALA 51.A N ILE 48.A O no hydrogen 3.195 N/A ILE 52.A N ALA 49.A O no hydrogen 2.765 N/A LEU 53.A N ALA 49.A O no hydrogen 3.045 N/A CYS 61.A SG LEU 59.A O no hydrogen 3.721 N/A THR 62.A OG1 GLU 149.A OE2 no hydrogen 3.393 N/A ASN 64.A ND2 LEU 59.A O no hydrogen 2.241 N/A TYR 65.A N CYS 61.A O no hydrogen 3.218 N/A ILE 66.A N THR 62.A O no hydrogen 3.355 N/A HIS 67.A N ARG 63.A O no hydrogen 2.916 N/A HIS 67.A ND1 ARG 63.A O no hydrogen 2.981 N/A LEU 68.A N ASN 64.A O no hydrogen 2.843 N/A ASN 69.A N TYR 65.A O no hydrogen 2.921 N/A LEU 70.A N ILE 66.A O no hydrogen 2.889 N/A PHE 71.A N HIS 67.A O no hydrogen 2.910 N/A ALA 72.A N LEU 68.A O no hydrogen 2.892 N/A SER 73.A N ASN 69.A O no hydrogen 2.906 N/A SER 73.A OG ALA 126.A O no hydrogen 2.627 N/A PHE 74.A N LEU 70.A O no hydrogen 2.923 N/A ILE 75.A N PHE 71.A O no hydrogen 2.918 N/A LEU 76.A N ALA 72.A O no hydrogen 2.881 N/A ARG 77.A N SER 73.A O no hydrogen 2.934 N/A ARG 77.A NH1 ASN 127.A OD1 no hydrogen 3.252 N/A ARG 77.A NH2 TYR 128.A OH no hydrogen 3.417 N/A ALA 78.A N PHE 74.A O no hydrogen 2.953 N/A LEU 79.A N ILE 75.A O no hydrogen 2.882 N/A SER 80.A N LEU 76.A O no hydrogen 2.895 N/A SER 80.A OG LEU 76.A O no hydrogen 3.405 N/A SER 80.A OG ARG 77.A O no hydrogen 2.640 N/A VAL 81.A N ARG 77.A O no hydrogen 2.950 N/A PHE 82.A N ALA 78.A O no hydrogen 2.915 N/A ILE 83.A N LEU 79.A O no hydrogen 2.924 N/A LYS 84.A N SER 80.A O no hydrogen 2.902 N/A ASP 85.A N VAL 81.A O no hydrogen 2.927 N/A ALA 86.A N PHE 82.A O no hydrogen 2.901 N/A ALA 87.A N ILE 83.A O no hydrogen 2.890 N/A LEU 88.A N LYS 84.A O no hydrogen 2.958 N/A LYS 89.A N ASP 85.A O no hydrogen 2.892 N/A LYS 89.A NZ TYR 32.A OH no hydrogen 3.236 N/A TRP 90.A N ALA 86.A O no hydrogen 2.902 N/A MET 91.A N ALA 87.A O no hydrogen 2.893 N/A TYR 92.A N LEU 88.A O no hydrogen 2.944 N/A SER 93.A N LYS 89.A O no hydrogen 2.877 N/A SER 93.A OG LYS 89.A O no hydrogen 3.278 N/A THR 94.A N TRP 90.A O no hydrogen 3.142 N/A THR 94.A OG1 TRP 90.A O no hydrogen 3.170 N/A ALA 95.A N MET 91.A O no hydrogen 3.011 N/A GLN 100.A N GLN 97.A O no hydrogen 3.268 N/A GLY 103.A N ASP 102.A OD1 no hydrogen 2.591 N/A LEU 105.A N TRP 101.A O no hydrogen 3.238 N/A SER 106.A N ASP 102.A O no hydrogen 2.743 N/A SER 106.A OG ASP 102.A O no hydrogen 3.469 N/A SER 106.A OG GLY 103.A O no hydrogen 2.799 N/A TYR 107.A N LEU 104.A O no hydrogen 2.930 N/A GLN 108.A N LEU 104.A O no hydrogen 2.429 N/A ASP 109.A N LEU 105.A O no hydrogen 2.776 N/A SER 110.A OG TYR 107.A O no hydrogen 2.867 N/A ARG 114.A NE SER 110.A O no hydrogen 3.091 N/A ARG 114.A NH2 ASP 109.A O no hydrogen 2.650 N/A LEU 115.A N LEU 111.A O no hydrogen 2.900 N/A VAL 116.A N SER 112.A O no hydrogen 2.919 N/A PHE 117.A N CYS 113.A O no hydrogen 2.915 N/A LEU 118.A N ARG 114.A O no hydrogen 2.925 N/A LEU 119.A N LEU 115.A O no hydrogen 2.913 N/A MET 120.A N VAL 116.A O no hydrogen 2.902 N/A GLN 121.A N PHE 117.A O no hydrogen 2.904 N/A TYR 122.A N LEU 118.A O no hydrogen 2.856 N/A CYS 123.A N LEU 119.A O no hydrogen 2.900 N/A CYS 123.A SG LEU 76.A O no hydrogen 3.733 N/A CYS 123.A SG LEU 119.A O no hydrogen 3.220 N/A VAL 124.A N MET 120.A O no hydrogen 2.963 N/A ALA 125.A N GLN 121.A O no hydrogen 2.930 N/A ALA 126.A N TYR 122.A O no hydrogen 2.846 N/A ASN 127.A N CYS 123.A O no hydrogen 2.932 N/A ASN 127.A N VAL 124.A O no hydrogen 3.167 N/A TYR 128.A N VAL 124.A O no hydrogen 2.925 N/A TYR 129.A OH PRO 199.A O no hydrogen 3.393 N/A VAL 133.A N TYR 129.A O no hydrogen 3.028 N/A GLU 134.A N TRP 130.A O no hydrogen 2.934 N/A GLY 135.A N LEU 131.A O no hydrogen 2.919 N/A VAL 136.A N LEU 132.A O no hydrogen 2.899 N/A TYR 137.A N VAL 133.A O no hydrogen 2.910 N/A LEU 138.A N GLU 134.A O no hydrogen 2.983 N/A TYR 139.A N GLY 135.A O no hydrogen 2.927 N/A THR 140.A N VAL 136.A O no hydrogen 2.893 N/A THR 140.A OG1 VAL 136.A O no hydrogen 3.188 N/A THR 140.A OG1 TYR 137.A O no hydrogen 2.536 N/A LEU 141.A N TYR 137.A O no hydrogen 2.950 N/A LEU 142.A N LEU 138.A O no hydrogen 2.981 N/A ALA 143.A N THR 140.A O no hydrogen 3.384 N/A SER 145.A N THR 140.A O no hydrogen 3.199 N/A SER 145.A OG ALA 143.A O no hydrogen 2.815 N/A ILE 152.A N GLU 149.A O no hydrogen 3.205 N/A PHE 153.A N GLU 149.A O no hydrogen 2.891 N/A TYR 156.A N ILE 152.A O no hydrogen 2.902 N/A VAL 157.A N PHE 153.A O no hydrogen 2.904 N/A SER 158.A N ARG 154.A O no hydrogen 2.906 N/A SER 158.A OG LEU 155.A O no hydrogen 2.707 N/A ILE 159.A N LEU 155.A O no hydrogen 2.900 N/A GLY 160.A N TYR 156.A O no hydrogen 2.884 N/A TRP 161.A N VAL 157.A O no hydrogen 2.958 N/A GLY 162.A N SER 158.A O no hydrogen 2.857 N/A VAL 163.A N SER 158.A O no hydrogen 3.318 N/A LEU 165.A N TRP 161.A O no hydrogen 3.442 N/A LEU 166.A N GLY 162.A O no hydrogen 2.722 N/A PHE 167.A N VAL 163.A O no hydrogen 2.983 N/A PHE 167.A N PRO 164.A O no hydrogen 3.344 N/A VAL 168.A N PRO 164.A O no hydrogen 2.940 N/A VAL 168.A N LEU 165.A O no hydrogen 3.203 N/A VAL 169.A N LEU 165.A O no hydrogen 2.968 N/A GLY 172.A N VAL 168.A O no hydrogen 3.074 N/A ILE 173.A N VAL 169.A O no hydrogen 2.928 N/A VAL 174.A N PRO 170.A O no hydrogen 2.905 N/A LYS 175.A N TRP 171.A O no hydrogen 2.910 N/A TYR 176.A N GLY 172.A O no hydrogen 2.904 N/A LEU 177.A N ILE 173.A O no hydrogen 3.291 N/A CYS 183.A SG GLY 182.A O no hydrogen 3.021 N/A CYS 183.A SG THR 185.A OG1 no hydrogen 3.189 N/A TRP 184.A N GLU 181.A O no hydrogen 3.094 N/A TRP 184.A NE1 ASP 180.A OD1 no hydrogen 2.406 N/A THR 185.A N GLY 182.A O no hydrogen 2.995 N/A THR 185.A OG1 GLY 182.A O no hydrogen 3.086 N/A ARG 186.A NH1 TRP 3.A O no hydrogen 3.164 N/A TRP 193.A N ASN 189.A O no hydrogen 3.373 N/A TRP 193.A N MET 190.A O no hydrogen 2.852 N/A LEU 194.A N MET 190.A O no hydrogen 2.912 N/A ILE 195.A N ASN 191.A O no hydrogen 2.935 N/A ILE 196.A N TRP 193.A O no hydrogen 3.228 N/A ARG 197.A N TRP 193.A O no hydrogen 2.916 N/A ARG 197.A N LEU 194.A O no hydrogen 3.036 N/A LEU 198.A N LEU 194.A O no hydrogen 2.875 N/A LEU 201.A N ARG 197.A O no hydrogen 3.021 N/A PHE 202.A N LEU 198.A O no hydrogen 2.900 N/A ALA 203.A N PRO 199.A O no hydrogen 2.920 N/A ILE 204.A N ILE 200.A O no hydrogen 2.924 N/A GLY 205.A N LEU 201.A O no hydrogen 2.901 N/A VAL 206.A N PHE 202.A O no hydrogen 2.928 N/A ASN 207.A N ALA 203.A O no hydrogen 2.961 N/A PHE 208.A N ILE 204.A O no hydrogen 2.909 N/A LEU 209.A N GLY 205.A O no hydrogen 2.950 N/A ILE 210.A N VAL 206.A O no hydrogen 2.937 N/A PHE 211.A N ASN 207.A O no hydrogen 2.900 N/A VAL 212.A N PHE 208.A O no hydrogen 2.951 N/A ARG 213.A N LEU 209.A O no hydrogen 2.959 N/A VAL 214.A N ILE 210.A O no hydrogen 2.883 N/A ILE 215.A N PHE 211.A O no hydrogen 2.960 N/A CYS 216.A N VAL 212.A O no hydrogen 2.929 N/A CYS 216.A SG VAL 212.A O no hydrogen 3.182 N/A ILE 217.A N ARG 213.A O no hydrogen 2.909 N/A VAL 218.A N VAL 214.A O no hydrogen 2.911 N/A VAL 219.A N ILE 215.A O no hydrogen 2.883 N/A SER 220.A N CYS 216.A O no hydrogen 2.919 N/A SER 220.A OG CYS 216.A O no hydrogen 3.407 N/A LYS 221.A N ILE 217.A O no hydrogen 2.900 N/A LEU 222.A N VAL 218.A O no hydrogen 2.916 N/A LYS 223.A N VAL 219.A O no hydrogen 2.880 N/A ASN 225.A N LYS 221.A O no hydrogen 3.337 N/A ARG 230.A N ASP 226.A O no hydrogen 2.929 N/A ARG 230.A NE SER 234.A OG no hydrogen 3.390 N/A LEU 231.A N ILE 227.A O no hydrogen 2.919 N/A ALA 232.A N LYS 228.A O no hydrogen 2.896 N/A LYS 233.A N CYS 229.A O no hydrogen 2.915 N/A SER 234.A N ARG 230.A O no hydrogen 2.912 N/A SER 234.A OG ARG 230.A O no hydrogen 3.039 N/A THR 235.A N LEU 231.A O no hydrogen 2.918 N/A THR 235.A OG1 LEU 231.A O no hydrogen 3.291 N/A LEU 236.A N ALA 232.A O no hydrogen 2.908 N/A THR 237.A N LYS 233.A O no hydrogen 2.909 N/A THR 237.A OG1 LYS 233.A O no hydrogen 2.900 N/A LEU 238.A N SER 234.A O no hydrogen 2.901 N/A ILE 239.A N THR 235.A O no hydrogen 2.956 N/A LEU 242.A N LEU 238.A O no hydrogen 3.258 N/A THR 244.A N ILE 239.A O no hydrogen 3.392 N/A GLU 246.A N GLY 243.A O no hydrogen 3.454 N/A VAL 247.A N THR 244.A O no hydrogen 2.937 N/A ILE 248.A N HIS 245.A O no hydrogen 3.282 N/A ALA 250.A N GLU 246.A O no hydrogen 2.985 N/A VAL 252.A N PHE 249.A O no hydrogen 2.804 N/A LYS 259.A N LEU 255.A O no hydrogen 2.549 N/A PHE 261.A N PHE 257.A O no hydrogen 3.161 N/A THR 262.A N ILE 258.A O no hydrogen 2.876 N/A THR 262.A OG1 ILE 258.A O no hydrogen 2.476 N/A THR 262.A OG1 LYS 259.A O no hydrogen 3.079 N/A GLU 263.A N LYS 259.A O no hydrogen 2.941 N/A LEU 264.A N LEU 260.A O no hydrogen 2.941 N/A SER 265.A N PHE 261.A O no hydrogen 2.913 N/A SER 265.A OG PHE 261.A O no hydrogen 3.033 N/A SER 265.A OG THR 262.A O no hydrogen 2.754 N/A PHE 266.A N THR 262.A O no hydrogen 2.933 N/A THR 267.A N GLU 263.A O no hydrogen 2.912 N/A THR 267.A OG1 GLU 263.A O no hydrogen 3.119 N/A SER 268.A N LEU 264.A O no hydrogen 2.915 N/A SER 268.A OG TYR 35.A O no hydrogen 2.742 N/A GLN 270.A N THR 267.A O no hydrogen 3.293 N/A LEU 272.A N SER 42.A OG no hydrogen 3.247 N/A MET 273.A N PHE 269.A O no hydrogen 2.930 N/A VAL 274.A N GLN 270.A O no hydrogen 2.939 N/A ALA 275.A N GLY 271.A O no hydrogen 2.918 N/A ILE 276.A N LEU 272.A O no hydrogen 2.891 N/A LEU 277.A N MET 273.A O no hydrogen 2.923 N/A TYR 278.A OH THR 237.A O no hydrogen 3.397 N/A CYS 279.A SG ALA 49.A O no hydrogen 3.588 N/A VAL 281.A N ILE 276.A O no hydrogen 3.137 N/A ASN 283.A N ASN 282.A OD1 no hydrogen 3.190 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.726 N/A GLN 286.A N ASN 282.A O no hydrogen 3.376 N/A LEU 287.A N ASN 283.A O no hydrogen 2.907 N/A GLU 288.A N GLU 284.A O no hydrogen 2.927 N/A PHE 289.A N VAL 285.A O no hydrogen 2.900 N/A ARG 290.A N GLN 286.A O no hydrogen 2.936 N/A ARG 290.A NH2 GLN 286.A OE1 no hydrogen 3.166 N/A LYS 291.A N LEU 287.A O no hydrogen 2.893 N/A SER 292.A N GLU 288.A O no hydrogen 2.888 N/A SER 292.A OG GLU 288.A O no hydrogen 2.608 N/A TRP 293.A N PHE 289.A O no hydrogen 2.948 N/A GLU 294.A N ARG 290.A O no hydrogen 2.895 N/A ARG 295.A N LYS 291.A O no hydrogen 2.909 N/A ARG 295.A NE LYS 291.A O no hydrogen 3.440 N/A ARG 297.A N TRP 293.A O no hydrogen 2.971 N/A