Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8x17_R.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N ALA 1.A O no hydrogen 2.889 N/A ASN 6.A N LEU 2.A O no hydrogen 2.872 N/A VAL 7.A N SER 3.A O no hydrogen 2.915 N/A THR 8.A N LEU 4.A O no hydrogen 2.888 N/A THR 8.A OG1 LEU 4.A O no hydrogen 2.730 N/A THR 8.A OG1 ALA 5.A O no hydrogen 2.762 N/A TYR 9.A N ALA 5.A O no hydrogen 3.080 N/A TYR 9.A OH GLU 13.A OE2 no hydrogen 2.652 N/A ILE 10.A N ASN 6.A O no hydrogen 2.881 N/A THR 11.A N VAL 7.A O no hydrogen 2.899 N/A THR 11.A OG1 VAL 7.A O no hydrogen 3.045 N/A THR 11.A OG1 THR 8.A O no hydrogen 2.517 N/A MET 12.A N THR 8.A O no hydrogen 2.898 N/A GLU 13.A N TYR 9.A O no hydrogen 2.863 N/A ILE 14.A N ILE 10.A O no hydrogen 2.939 N/A PHE 15.A N THR 11.A O no hydrogen 2.891 N/A ILE 16.A N MET 12.A O no hydrogen 2.895 N/A GLY 17.A N GLU 13.A O no hydrogen 2.889 N/A LEU 18.A N ILE 14.A O no hydrogen 2.895 N/A CYS 19.A N PHE 15.A O no hydrogen 2.916 N/A CYS 19.A SG PHE 15.A O no hydrogen 3.390 N/A ALA 20.A N ILE 16.A O no hydrogen 2.891 N/A ILE 21.A N GLY 17.A O no hydrogen 2.875 N/A VAL 22.A N LEU 18.A O no hydrogen 2.915 N/A GLY 23.A N CYS 19.A O no hydrogen 2.907 N/A ASN 24.A N ALA 20.A O no hydrogen 2.883 N/A ASN 24.A ND2 ALA 20.A O no hydrogen 2.461 N/A ASN 24.A ND2 SER 257.A O no hydrogen 3.477 N/A VAL 25.A N ILE 21.A O no hydrogen 2.882 N/A LEU 26.A N VAL 22.A O no hydrogen 2.915 N/A VAL 27.A N GLY 23.A O no hydrogen 2.906 N/A ILE 28.A N ASN 24.A O no hydrogen 2.888 N/A CYS 29.A N VAL 25.A O no hydrogen 2.901 N/A CYS 29.A SG VAL 25.A O no hydrogen 3.080 N/A VAL 30.A N LEU 26.A O no hydrogen 2.899 N/A VAL 31.A N VAL 27.A O no hydrogen 2.912 N/A LYS 32.A N ILE 28.A O no hydrogen 2.889 N/A LEU 33.A N CYS 29.A O no hydrogen 2.893 N/A ASN 34.A ND2 THR 274.A OG1 no hydrogen 3.133 N/A SER 36.A N ASN 34.A OD1 no hydrogen 3.006 N/A SER 36.A OG ASN 34.A OD1 no hydrogen 2.336 N/A LEU 37.A N ASN 34.A O no hydrogen 3.051 N/A GLN 38.A N PRO 35.A O no hydrogen 3.296 N/A THR 40.A OG1 TYR 112.A OH no hydrogen 3.225 N/A TYR 43.A N THR 39.A O no hydrogen 3.240 N/A TYR 43.A N THR 40.A O no hydrogen 2.976 N/A TYR 43.A OH GLN 38.A O no hydrogen 3.323 N/A ILE 45.A N THR 41.A O no hydrogen 2.957 N/A VAL 46.A N PHE 42.A O no hydrogen 2.842 N/A SER 47.A N TYR 43.A O no hydrogen 2.914 N/A SER 47.A OG SER 94.A OG no hydrogen 3.236 N/A LEU 48.A N PHE 44.A O no hydrogen 2.922 N/A ALA 49.A N ILE 45.A O no hydrogen 2.881 N/A LEU 50.A N VAL 46.A O no hydrogen 2.864 N/A ALA 51.A N SER 47.A O no hydrogen 2.928 N/A ASP 52.A N LEU 48.A O no hydrogen 2.907 N/A ILE 53.A N ALA 49.A O no hydrogen 2.864 N/A ALA 54.A N LEU 50.A O no hydrogen 2.908 N/A VAL 55.A N ALA 51.A O no hydrogen 2.908 N/A GLY 56.A N ASP 52.A O no hydrogen 2.889 N/A VAL 57.A N ILE 53.A O no hydrogen 2.898 N/A VAL 57.A N ALA 54.A O no hydrogen 3.280 N/A LEU 58.A N ALA 54.A O no hydrogen 2.918 N/A LEU 58.A N VAL 55.A O no hydrogen 3.180 N/A VAL 59.A N VAL 55.A O no hydrogen 2.855 N/A LEU 62.A N LEU 58.A O no hydrogen 2.854 N/A ALA 63.A N VAL 59.A O no hydrogen 2.484 N/A ILE 64.A N MET 60.A O no hydrogen 2.897 N/A VAL 65.A N PRO 61.A O no hydrogen 2.913 N/A VAL 66.A N LEU 62.A O no hydrogen 2.883 N/A SER 67.A N ALA 63.A O no hydrogen 2.901 N/A SER 67.A OG TYR 247.A OH no hydrogen 2.970 N/A LEU 68.A N ILE 64.A O no hydrogen 2.902 N/A GLY 69.A N VAL 65.A O no hydrogen 3.158 N/A THR 71.A OG1 THR 71.A O no hydrogen 2.460 N/A PHE 74.A N THR 156.A O no hydrogen 3.000 N/A SER 76.A N HIS 73.A O no hydrogen 2.919 N/A SER 76.A OG HIS 73.A O no hydrogen 2.597 N/A CYS 77.A N HIS 73.A O no hydrogen 3.293 N/A LEU 78.A N PHE 74.A O no hydrogen 3.069 N/A PHE 79.A N TYR 75.A O no hydrogen 2.867 N/A MET 80.A N SER 76.A O no hydrogen 2.938 N/A THR 81.A N CYS 77.A O no hydrogen 2.973 N/A THR 81.A OG1 CYS 77.A O no hydrogen 2.933 N/A THR 81.A OG1 LEU 78.A O no hydrogen 2.795 N/A CYS 82.A N LEU 78.A O no hydrogen 2.725 N/A CYS 82.A SG LEU 78.A O no hydrogen 3.014 N/A CYS 82.A SG GLY 136.A O no hydrogen 3.725 N/A LEU 83.A N PHE 79.A O no hydrogen 2.912 N/A LEU 84.A N MET 80.A O no hydrogen 2.922 N/A LEU 85.A N THR 81.A O no hydrogen 2.937 N/A ILE 86.A N CYS 82.A O no hydrogen 2.818 N/A PHE 87.A N LEU 83.A O no hydrogen 2.985 N/A THR 88.A N LEU 84.A O no hydrogen 3.507 N/A THR 88.A OG1 LEU 84.A O no hydrogen 3.249 N/A THR 88.A OG1 LEU 85.A O no hydrogen 2.867 N/A HIS 89.A N LEU 85.A O no hydrogen 2.916 N/A HIS 89.A NE2 SER 175.A OG no hydrogen 2.839 N/A ALA 90.A N ILE 86.A O no hydrogen 2.863 N/A SER 91.A N PHE 87.A O no hydrogen 2.947 N/A SER 91.A OG ASP 52.A OD1 no hydrogen 3.332 N/A ILE 92.A N THR 88.A O no hydrogen 2.939 N/A MET 93.A N HIS 89.A O no hydrogen 2.878 N/A SER 94.A N ALA 90.A O no hydrogen 2.877 N/A SER 94.A OG SER 47.A OG no hydrogen 3.236 N/A LEU 95.A N SER 91.A O no hydrogen 2.941 N/A LEU 96.A N ILE 92.A O no hydrogen 2.928 N/A ALA 97.A N MET 93.A O no hydrogen 2.867 N/A ILE 98.A N SER 94.A O no hydrogen 3.177 N/A ALA 99.A N LEU 95.A O no hydrogen 2.949 N/A VAL 100.A N LEU 96.A O no hydrogen 2.892 N/A ASP 101.A N ALA 97.A O no hydrogen 2.905 N/A ARG 102.A N ILE 98.A O no hydrogen 2.891 N/A TYR 103.A N ALA 99.A O no hydrogen 2.942 N/A TYR 103.A OH ASP 193.A OD2 no hydrogen 2.982 N/A LEU 104.A N VAL 100.A O no hydrogen 2.872 N/A ARG 105.A N ASP 101.A O no hydrogen 2.939 N/A ARG 105.A NH1 ASP 101.A OD2 no hydrogen 2.460 N/A VAL 106.A N TYR 103.A O no hydrogen 3.208 N/A LYS 107.A N TYR 103.A O no hydrogen 2.909 N/A LYS 107.A NZ TYR 103.A OH no hydrogen 3.319 N/A LEU 108.A N LEU 104.A O no hydrogen 2.662 N/A TYR 112.A OH ASP 101.A OD1 no hydrogen 2.696 N/A TYR 112.A OH ASP 101.A OD2 no hydrogen 3.334 N/A VAL 115.A N ARG 111.A O no hydrogen 2.901 N/A THR 116.A N TYR 112.A O no hydrogen 2.740 N/A THR 116.A OG1 TYR 112.A O no hydrogen 2.572 N/A ARG 119.A NE ARG 119.A O no hydrogen 2.869 N/A ARG 120.A N THR 117.A OG1 no hydrogen 3.181 N/A ARG 120.A NH1 VAL 115.A O no hydrogen 2.857 N/A ILE 121.A N THR 117.A O no hydrogen 2.934 N/A TRP 122.A N HIS 118.A O no hydrogen 2.922 N/A LEU 123.A N ARG 119.A O no hydrogen 2.872 N/A ALA 124.A N ARG 120.A O no hydrogen 2.902 N/A LEU 125.A N ILE 121.A O no hydrogen 2.932 N/A GLY 126.A N TRP 122.A O no hydrogen 2.884 N/A LEU 127.A N LEU 123.A O no hydrogen 2.887 N/A CYS 128.A N ALA 124.A O no hydrogen 2.915 N/A CYS 128.A SG ALA 124.A O no hydrogen 3.263 N/A TRP 129.A N LEU 125.A O no hydrogen 2.929 N/A TRP 129.A NE1 SER 47.A OG no hydrogen 3.092 N/A LEU 130.A N GLY 126.A O no hydrogen 2.874 N/A VAL 131.A N LEU 127.A O no hydrogen 2.903 N/A SER 132.A N CYS 128.A O no hydrogen 2.919 N/A SER 132.A OG CYS 128.A O no hydrogen 3.509 N/A SER 132.A OG TRP 129.A O no hydrogen 2.466 N/A PHE 133.A N TRP 129.A O no hydrogen 2.906 N/A LEU 134.A N LEU 130.A O no hydrogen 2.893 N/A VAL 135.A N VAL 131.A O no hydrogen 2.906 N/A GLY 136.A N SER 132.A O no hydrogen 2.915 N/A LEU 137.A N PHE 133.A O no hydrogen 3.009 N/A THR 138.A OG1 VAL 135.A O no hydrogen 2.963 N/A THR 138.A OG1 TYR 170.A OH no hydrogen 2.901 N/A MET 140.A N LEU 137.A O no hydrogen 3.034 N/A ASN 144.A ND2 PRO 139.A O no hydrogen 3.239 N/A LYS 146.A N ASN 144.A OD1 no hydrogen 2.846 N/A LYS 146.A NZ HIS 152.A O no hydrogen 3.285 N/A LYS 146.A NZ VAL 155.A O no hydrogen 3.526 N/A LEU 147.A N ASN 144.A O no hydrogen 3.174 N/A THR 148.A N MET 145.A O no hydrogen 3.021 N/A THR 148.A OG1 MET 145.A O no hydrogen 2.653 N/A TYR 151.A N SER 149.A OG no hydrogen 3.137 N/A ARG 153.A NE LYS 146.A O no hydrogen 3.167 N/A ARG 153.A NE SER 149.A O no hydrogen 3.226 N/A ARG 153.A NH1 LYS 146.A O no hydrogen 2.547 N/A ASN 154.A N TYR 151.A O no hydrogen 2.913 N/A VAL 155.A N HIS 152.A O no hydrogen 3.382 N/A GLN 161.A N SER 164.A OG no hydrogen 3.040 N/A SER 164.A N GLN 161.A O no hydrogen 2.353 N/A SER 164.A OG SER 159.A O no hydrogen 3.565 N/A SER 164.A OG GLN 161.A O no hydrogen 2.425 N/A MET 166.A N PHE 162.A O no hydrogen 3.040 N/A TYR 170.A OH VAL 135.A O no hydrogen 3.152 N/A TYR 170.A OH THR 138.A OG1 no hydrogen 2.901 N/A MET 171.A N ARG 167.A O no hydrogen 2.821 N/A VAL 172.A N MET 168.A O no hydrogen 2.927 N/A TYR 173.A N ASP 169.A O no hydrogen 2.895 N/A PHE 174.A N TYR 170.A O no hydrogen 2.943 N/A SER 175.A N TYR 170.A O no hydrogen 3.473 N/A SER 175.A OG HIS 89.A NE2 no hydrogen 2.839 N/A PHE 176.A N VAL 172.A O no hydrogen 2.956 N/A THR 178.A N PHE 174.A O no hydrogen 2.929 N/A THR 178.A OG1 PHE 174.A O no hydrogen 2.997 N/A TRP 179.A N SER 175.A O no hydrogen 2.929 N/A ILE 180.A N PHE 176.A O no hydrogen 2.873 N/A PHE 181.A N PHE 176.A O no hydrogen 2.944 N/A ILE 182.A N LEU 177.A O no hydrogen 3.136 N/A LEU 184.A N ILE 180.A O no hydrogen 2.690 N/A VAL 185.A N PHE 181.A O no hydrogen 2.673 N/A VAL 186.A N ILE 182.A O no hydrogen 2.947 N/A MET 187.A N PRO 183.A O no hydrogen 2.877 N/A CYS 188.A N LEU 184.A O no hydrogen 2.898 N/A CYS 188.A SG VAL 185.A O no hydrogen 2.913 N/A ALA 189.A N VAL 185.A O no hydrogen 2.926 N/A ILE 190.A N VAL 186.A O no hydrogen 2.871 N/A TYR 191.A N MET 187.A O no hydrogen 2.895 N/A LEU 192.A N CYS 188.A O no hydrogen 2.908 N/A ASP 193.A N ALA 189.A O no hydrogen 2.905 N/A ILE 194.A N ILE 190.A O no hydrogen 2.884 N/A PHE 195.A N TYR 191.A O no hydrogen 2.891 N/A TYR 196.A N LEU 192.A O no hydrogen 2.928 N/A ILE 197.A N ASP 193.A O no hydrogen 2.894 N/A ILE 198.A N ILE 194.A O no hydrogen 2.879 N/A ARG 199.A N PHE 195.A O no hydrogen 2.899 N/A ARG 199.A NE ASN 200.A OD1 no hydrogen 2.737 N/A ASN 200.A N TYR 196.A O no hydrogen 2.925 N/A LYS 201.A N ILE 197.A O no hydrogen 2.881 N/A LEU 202.A N ILE 198.A O no hydrogen 2.890 N/A SER 203.A N ARG 199.A O no hydrogen 3.397 N/A SER 203.A OG ARG 199.A O no hydrogen 3.077 N/A SER 203.A OG SER 203.A O no hydrogen 2.378 N/A LEU 204.A N LEU 202.A O no hydrogen 2.727 N/A THR 210.A N ARG 206.A O no hydrogen 2.988 N/A THR 210.A OG1 ARG 206.A O no hydrogen 3.164 N/A THR 210.A OG1 GLU 207.A O no hydrogen 2.810 N/A ALA 211.A N GLU 207.A O no hydrogen 2.959 N/A LYS 212.A N PHE 208.A O no hydrogen 2.772 N/A SER 213.A N LYS 209.A O no hydrogen 2.946 N/A LEU 214.A N THR 210.A O no hydrogen 3.026 N/A PHE 215.A N ALA 211.A O no hydrogen 2.819 N/A PHE 215.A N LYS 212.A O no hydrogen 3.279 N/A LEU 216.A N LYS 212.A O no hydrogen 3.125 N/A VAL 217.A N SER 213.A O no hydrogen 3.425 N/A LEU 218.A N LEU 214.A O no hydrogen 3.462 N/A PHE 219.A N PHE 215.A O no hydrogen 2.619 N/A LEU 220.A N LEU 216.A O no hydrogen 2.940 N/A ALA 222.A N LEU 218.A O no hydrogen 3.340 N/A LEU 223.A N PHE 219.A O no hydrogen 3.052 N/A SER 224.A N PHE 221.A O no hydrogen 3.144 N/A SER 224.A OG LEU 220.A O no hydrogen 3.453 N/A SER 224.A OG LEU 252.A O no hydrogen 2.867 N/A TRP 225.A N PHE 221.A O no hydrogen 3.224 N/A TRP 225.A N ALA 222.A O no hydrogen 3.205 N/A LEU 226.A N ALA 222.A O no hydrogen 2.885 N/A SER 229.A N TRP 225.A O no hydrogen 2.865 N/A ILE 230.A N LEU 226.A O no hydrogen 2.989 N/A ILE 230.A N PRO 227.A O no hydrogen 3.251 N/A ILE 231.A N PRO 227.A O no hydrogen 2.922 N/A ASN 232.A N LEU 228.A O no hydrogen 2.933 N/A CYS 233.A N ILE 230.A O no hydrogen 2.543 N/A ILE 234.A N ILE 230.A O no hydrogen 2.766 N/A ILE 235.A N ILE 231.A O no hydrogen 2.923 N/A TYR 236.A OH ASP 169.A OD2 no hydrogen 2.743 N/A PHE 237.A N CYS 233.A O no hydrogen 3.062 N/A LEU 246.A N PRO 242.A O no hydrogen 3.210 N/A TYR 247.A N GLN 243.A O no hydrogen 3.241 N/A TYR 247.A OH SER 67.A OG no hydrogen 2.970 N/A MET 248.A N LEU 244.A O no hydrogen 2.806 N/A GLY 249.A N VAL 245.A O no hydrogen 3.014 N/A ILE 250.A N LEU 246.A O no hydrogen 2.927 N/A LEU 251.A N TYR 247.A O no hydrogen 2.884 N/A LEU 252.A N MET 248.A O no hydrogen 2.891 N/A SER 253.A N GLY 249.A O no hydrogen 2.906 N/A SER 253.A OG GLY 249.A O no hydrogen 3.387 N/A SER 253.A OG ILE 250.A O no hydrogen 2.557 N/A HIS 254.A N ILE 250.A O no hydrogen 2.918 N/A HIS 254.A ND1 GLU 13.A OE1 no hydrogen 3.002 N/A HIS 254.A ND1 GLU 13.A OE2 no hydrogen 2.842 N/A ALA 255.A N LEU 251.A O no hydrogen 2.877 N/A ASN 256.A ND2 SER 224.A OG no hydrogen 3.362 N/A SER 257.A N HIS 254.A O no hydrogen 3.283 N/A SER 257.A OG HIS 254.A O no hydrogen 3.364 N/A MET 258.A N ALA 255.A O no hydrogen 3.207 N/A MET 259.A N ALA 255.A O no hydrogen 2.913 N/A ASN 260.A N ASN 256.A O no hydrogen 2.895 N/A ASN 260.A ND2 ASP 52.A OD1 no hydrogen 3.213 N/A ASN 260.A ND2 ASP 52.A OD2 no hydrogen 3.354 N/A ASN 260.A ND2 ASN 256.A OD1 no hydrogen 2.987 N/A VAL 263.A N MET 259.A O no hydrogen 3.192 N/A TYR 264.A N ASN 260.A O no hydrogen 2.904 N/A TYR 264.A OH TYR 191.A OH no hydrogen 3.140 N/A ALA 265.A N PRO 261.A O no hydrogen 2.891 N/A TYR 266.A N PRO 261.A O no hydrogen 3.212 N/A ILE 268.A N ALA 265.A O no hydrogen 2.979 N/A LYS 270.A NZ SER 36.A O no hydrogen 3.050 N/A LYS 272.A N ILE 268.A O no hydrogen 2.811 N/A GLU 273.A N LYS 269.A O no hydrogen 2.909 N/A THR 274.A N LYS 270.A O no hydrogen 2.959 N/A TYR 275.A N PHE 271.A O no hydrogen 2.861 N/A LEU 276.A N LYS 272.A O no hydrogen 2.915 N/A LEU 277.A N GLU 273.A O no hydrogen 2.933 N/A ILE 278.A N THR 274.A O no hydrogen 2.893 N/A LEU 279.A N TYR 275.A O no hydrogen 2.892 N/A LYS 280.A N LEU 276.A O no hydrogen 2.943 N/A ALA 281.A N LEU 277.A O no hydrogen 2.893 N/A CYS 282.A N ILE 278.A O no hydrogen 2.541 N/A