Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7ccc_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG HIS 3.A ND1 no hydrogen 3.225 N/A HIS 3.A ND1 SER 2.A OG no hydrogen 3.225 N/A GLN 4.A NE2 SER 2.A O no hydrogen 3.442 N/A THR 5.A N ALA 103.A O no hydrogen 3.085 N/A THR 5.A OG1 THR 104.A OG1 no hydrogen 2.905 N/A ILE 7.A N THR 5.A OG1 no hydrogen 3.108 N/A SER 10.A N LEU 37.A O no hydrogen 3.084 N/A SER 10.A OG ASP 12.A OD1 no hydrogen 3.444 N/A ASP 12.A N SER 10.A OG no hydrogen 3.009 N/A VAL 13.A N SER 10.A O no hydrogen 2.874 N/A LYS 14.A N SER 10.A O no hydrogen 3.167 N/A LYS 14.A NZ GLU 11.A OE2 no hydrogen 3.454 N/A GLU 15.A N GLU 11.A O no hydrogen 2.974 N/A ILE 16.A N ASP 12.A O no hydrogen 2.953 N/A PHE 17.A N VAL 13.A O no hydrogen 2.835 N/A ALA 18.A N LYS 14.A O no hydrogen 2.977 N/A ARG 19.A N GLU 15.A O no hydrogen 2.978 N/A ARG 19.A NE TYR 25.A OH no hydrogen 3.106 N/A ALA 20.A N ILE 16.A O no hydrogen 2.824 N/A ARG 21.A N PHE 17.A O no hydrogen 2.980 N/A ASN 22.A N ARG 19.A O no hydrogen 3.068 N/A GLY 23.A N ALA 20.A O no hydrogen 2.990 N/A ARG 26.A N SER 43.A O no hydrogen 2.991 N/A ARG 26.A NE ASP 52.A OD2 no hydrogen 2.832 N/A ARG 26.A NH1 ARG 72.A O no hydrogen 2.538 N/A ARG 26.A NH1 ASP 74.A OD1 no hydrogen 3.009 N/A ARG 26.A NH2 ASP 47.A O no hydrogen 2.816 N/A ARG 26.A NH2 ASP 74.A OD1 no hydrogen 3.333 N/A LEU 28.A N LEU 70.A O no hydrogen 2.904 N/A LYS 29.A N SER 41.A O no hydrogen 3.215 N/A LYS 29.A NZ LEU 60.A O no hydrogen 2.749 N/A ILE 30.A N TYR 68.A O no hydrogen 2.879 N/A SER 31.A N VAL 38.A O no hydrogen 2.940 N/A SER 31.A OG TYR 101.A OH no hydrogen 3.251 N/A ILE 32.A N TYR 101.A OH no hydrogen 2.840 N/A GLU 33.A N GLN 36.A O no hydrogen 2.870 N/A GLN 36.A N GLU 33.A O no hydrogen 2.942 N/A LEU 37.A N GLN 8.A O no hydrogen 3.133 N/A VAL 38.A N SER 31.A O no hydrogen 2.896 N/A GLY 40.A N LYS 29.A O no hydrogen 2.771 N/A SER 43.A N LEU 27.A O no hydrogen 3.043 N/A SER 46.A N ASP 52.A OD2 no hydrogen 3.286 N/A SER 46.A OG ASP 47.A OD2 no hydrogen 3.362 N/A SER 46.A OG ASP 52.A OD1 no hydrogen 2.668 N/A SER 46.A OG ASP 52.A OD2 no hydrogen 3.530 N/A ASP 47.A N ASP 52.A OD1 no hydrogen 3.160 N/A TRP 49.A N ASP 74.A OD2 no hydrogen 2.765 N/A LYS 51.A N SER 48.A O no hydrogen 2.907 N/A LYS 51.A N SER 48.A OG no hydrogen 3.252 N/A ASP 52.A N SER 48.A O no hydrogen 2.810 N/A TYR 53.A N TRP 49.A O no hydrogen 3.215 N/A TYR 53.A OH VAL 129.A O no hydrogen 2.247 N/A SER 55.A N ASP 52.A O no hydrogen 3.164 N/A SER 55.A OG ASP 52.A O no hydrogen 3.165 N/A PHE 56.A N ASP 52.A O no hydrogen 2.858 N/A VAL 57.A N TYR 53.A O no hydrogen 2.915 N/A LEU 60.A N VAL 57.A O no hydrogen 2.896 N/A LEU 61.A N LEU 58.A O no hydrogen 3.159 N/A GLU 62.A N GLU 62.A OE1 no hydrogen 2.655 N/A GLN 65.A NE2 GLN 97.A OE1 no hydrogen 2.936 N/A CYS 67.A N TRP 88.A O no hydrogen 2.901 N/A CYS 67.A SG GLU 62.A OE1 no hydrogen 3.790 N/A TYR 68.A N ILE 30.A O no hydrogen 2.931 N/A TYR 68.A OH TYR 101.A O no hydrogen 2.598 N/A ILE 69.A N ILE 86.A O no hydrogen 2.946 N/A LEU 70.A N LEU 28.A O no hydrogen 2.854 N/A PHE 71.A N ILE 84.A O no hydrogen 2.910 N/A ARG 72.A N ARG 26.A O no hydrogen 2.756 N/A ARG 72.A NE LEU 73.A O no hydrogen 3.378 N/A ARG 72.A NH1 ASP 74.A OD1 no hydrogen 3.333 N/A LEU 73.A N GLU 82.A O no hydrogen 2.904 N/A ASN 77.A N GLY 80.A O no hydrogen 2.705 N/A ASN 77.A ND2 GLN 79.A OE1 no hydrogen 2.823 N/A GLY 80.A N ASN 77.A OD1 no hydrogen 3.238 N/A TRP 83.A N HIS 116.A O no hydrogen 2.698 N/A ILE 84.A N PHE 71.A O no hydrogen 2.855 N/A PHE 85.A N ASP 119.A O no hydrogen 2.863 N/A ILE 86.A N ILE 69.A O no hydrogen 2.846 N/A ALA 87.A N VAL 121.A O no hydrogen 2.744 N/A TRP 88.A N CYS 67.A O no hydrogen 2.925 N/A TRP 88.A NE1 GLU 62.A O no hydrogen 2.704 N/A SER 89.A N GLY 123.A O no hydrogen 3.160 N/A SER 93.A N PRO 90.A O no hydrogen 3.297 N/A SER 93.A OG PRO 90.A O no hydrogen 2.622 N/A LYS 98.A N HIS 94.A O no hydrogen 3.152 N/A LYS 98.A NZ ASP 91.A O no hydrogen 2.938 N/A MET 99.A N VAL 95.A O no hydrogen 2.848 N/A LEU 100.A N ARG 96.A O no hydrogen 2.981 N/A TYR 101.A N GLN 97.A O no hydrogen 2.926 N/A TYR 101.A OH SER 31.A OG no hydrogen 3.251 N/A ALA 102.A N LYS 98.A O no hydrogen 2.928 N/A ALA 103.A N MET 99.A O no hydrogen 2.855 N/A THR 104.A OG1 THR 5.A OG1 no hydrogen 2.905 N/A THR 104.A OG1 LEU 100.A O no hydrogen 2.653 N/A ARG 105.A NH2 GLU 120.A OE2 no hydrogen 2.345 N/A THR 107.A OG1 GLN 4.A OE1 no hydrogen 2.855 N/A LEU 108.A N THR 104.A O no hydrogen 2.967 N/A LYS 109.A N ARG 105.A O no hydrogen 2.899 N/A LYS 109.A NZ GLU 120.A OE1 no hydrogen 3.035 N/A LYS 110.A N ALA 106.A O no hydrogen 2.928 N/A GLU 111.A N THR 107.A O no hydrogen 2.924 N/A PHE 112.A N LEU 108.A O no hydrogen 2.938 N/A GLY 113.A N LYS 109.A O no hydrogen 3.071 N/A HIS 116.A N GLY 113.A O no hydrogen 3.321 N/A ILE 117.A N GLY 114.A O no hydrogen 3.354 N/A LYS 118.A N TRP 83.A O no hydrogen 2.965 N/A VAL 121.A N PHE 85.A O no hydrogen 2.844 N/A GLY 123.A N ALA 87.A O no hydrogen 3.126 N/A THR 124.A N ASP 128.A OD1 no hydrogen 3.260 N/A THR 124.A OG1 ASP 128.A OD1 no hydrogen 3.489 N/A LYS 126.A NZ LEU 58.A O no hydrogen 3.065 N/A ASP 128.A N VAL 125.A O no hydrogen 3.110 N/A VAL 129.A N LYS 126.A O no hydrogen 3.172 N/A SER 130.A N LYS 126.A O no hydrogen 2.800 N/A SER 130.A OG LYS 126.A O no hydrogen 3.517 N/A SER 130.A OG GLU 127.A O no hydrogen 3.557 N/A TYR 134.A N SER 130.A O no hydrogen 2.935 N/A TYR 134.A OH ASP 119.A OD1 no hydrogen 2.608 N/A LYS 135.A N LEU 131.A O no hydrogen 2.962 N/A LYS 136.A N HIS 132.A O no hydrogen 2.959 N/A TYR 137.A N GLY 133.A O no hydrogen 2.878 N/A LEU 138.A N TYR 134.A O no hydrogen 3.055 N/A LEU 139.A N LYS 135.A O no hydrogen 2.930 N/A SER 140.A N LYS 136.A O no hydrogen 2.813 N/A GLN 141.A N TYR 137.A O no hydrogen 2.998 N/A SER 142.A N LEU 138.A O no hydrogen 2.988 N/A SER 142.A OG LEU 138.A O no hydrogen 3.564 N/A SER 143.A N SER 140.A O no hydrogen 3.222 N/A SER 143.A OG LEU 139.A O no hydrogen 3.437 N/A GLU 152.A N THR 148.A O no hydrogen 3.078 N/A GLU 153.A N ALA 149.A O no hydrogen 2.956 N/A LEU 154.A N ALA 150.A O no hydrogen 2.980 N/A ARG 155.A NH2 GLU 152.A OE2 no hydrogen 3.034 N/A GLN 156.A N GLU 152.A O no hydrogen 2.952 N/A ILE 157.A N GLU 153.A O no hydrogen 2.985 N/A LYS 158.A N LEU 154.A O no hydrogen 2.895 N/A ILE 159.A N ARG 155.A O no hydrogen 2.954 N/A ASN 160.A N GLN 156.A O no hydrogen 3.080 N/A GLU 161.A N ILE 157.A O no hydrogen 2.846 N/A VAL 162.A N LYS 158.A O no hydrogen 2.895 N/A GLN 163.A N ILE 159.A O no hydrogen 3.050 N/A GLN 163.A NE2 GLN 163.A O no hydrogen 2.516 N/A THR 164.A N ASN 160.A O no hydrogen 2.983 N/A ASP 165.A N GLU 161.A O no hydrogen 2.864 N/A VAL 166.A N VAL 162.A O no hydrogen 3.332 N/A GLY 167.A N THR 164.A O no hydrogen 3.115 N/A LYS 171.A N ASP 169.A O no hydrogen 2.493 N/A GLN 173.A N THR 170.A O no hydrogen 3.263 N/A THR 174.A OG1 LEU 175.A O no hydrogen 3.019 N/A SER 183.A N ILE 212.A O no hydrogen 3.049 N/A GLU 185.A N GLU 185.A OE2 no hydrogen 2.609 N/A ALA 186.A N SER 183.A OG no hydrogen 2.773 N/A PHE 187.A N SER 183.A O no hydrogen 2.732 N/A GLN 188.A N ARG 184.A O no hydrogen 2.874 N/A ALA 189.A N GLU 185.A O no hydrogen 2.924 N/A LEU 190.A N ALA 186.A O no hydrogen 2.928 N/A GLU 191.A N PHE 187.A O no hydrogen 2.929 N/A LYS 192.A N GLN 188.A O no hydrogen 2.892 N/A LEU 193.A N ALA 189.A O no hydrogen 2.920 N/A ASN 194.A N LEU 190.A O no hydrogen 2.940 N/A ASN 195.A N GLU 191.A O no hydrogen 3.126 N/A ARG 196.A N LEU 193.A O no hydrogen 2.831 N/A ARG 196.A NH1 ASN 194.A O no hydrogen 3.523 N/A ARG 196.A NH2 GLU 251.A O no hydrogen 2.789 N/A GLN 197.A N LYS 192.A O no hydrogen 2.779 N/A LEU 198.A N LYS 192.A O no hydrogen 3.372 N/A ASN 199.A ND2 ASN 219.A OD1 no hydrogen 3.236 N/A TYR 200.A OH HIS 237.A ND1 no hydrogen 2.488 N/A VAL 201.A N PHE 238.A O no hydrogen 2.925 N/A GLN 202.A N ASN 216.A O no hydrogen 2.834 N/A GLN 202.A NE2 TYR 200.A OH no hydrogen 2.897 N/A GLN 202.A NE2 ARG 228.A O no hydrogen 3.022 N/A LEU 203.A N TYR 236.A O no hydrogen 2.877 N/A GLU 204.A N ILE 213.A O no hydrogen 2.958 N/A ILE 205.A N TYR 272.A OH no hydrogen 2.890 N/A ASP 206.A N ILE 211.A O no hydrogen 2.762 N/A LYS 208.A NZ ASN 209.A OD1 no hydrogen 2.832 N/A ASN 209.A N ASP 206.A OD2 no hydrogen 2.978 N/A ILE 211.A N ASP 206.A O no hydrogen 3.295 N/A ILE 212.A N PRO 181.A O no hydrogen 2.943 N/A ILE 213.A N GLU 204.A O no hydrogen 2.702 N/A ALA 215.A N GLN 202.A O no hydrogen 2.903 N/A ASN 216.A N GLN 202.A O no hydrogen 3.002 N/A THR 218.A N ASN 216.A OD1 no hydrogen 2.530 N/A THR 218.A OG1 ASN 216.A OD1 no hydrogen 2.653 N/A THR 220.A N ASN 199.A OD1 no hydrogen 3.221 N/A THR 220.A OG1 THR 218.A O no hydrogen 2.879 N/A LYS 223.A NZ ASP 224.A OD1 no hydrogen 3.452 N/A LYS 223.A NZ ASP 224.A OD2 no hydrogen 3.006 N/A LEU 225.A N LEU 222.A O no hydrogen 3.425 N/A LYS 227.A N ASP 224.A O no hydrogen 3.001 N/A LYS 227.A NZ ASP 224.A OD2 no hydrogen 3.190 N/A ARG 228.A N LEU 225.A O no hydrogen 2.907 N/A ARG 228.A NE THR 220.A OG1 no hydrogen 2.678 N/A ARG 228.A NH2 ASN 219.A O no hydrogen 3.200 N/A ILE 229.A N PRO 226.A O no hydrogen 3.337 N/A ALA 234.A N GLU 268.A OE2 no hydrogen 3.143 N/A ARG 235.A N SER 258.A O no hydrogen 2.895 N/A ARG 235.A NE GLN 202.A OE1 no hydrogen 2.955 N/A ARG 235.A NH1 ALA 234.A O no hydrogen 2.725 N/A TYR 236.A N LEU 203.A O no hydrogen 2.992 N/A TYR 236.A OH TYR 272.A O no hydrogen 2.310 N/A HIS 237.A N ILE 256.A O no hydrogen 2.843 N/A HIS 237.A ND1 TYR 200.A OH no hydrogen 2.488 N/A HIS 237.A NE2 SER 258.A OG no hydrogen 3.223 N/A PHE 238.A N VAL 201.A O no hydrogen 2.882 N/A PHE 239.A N VAL 254.A O no hydrogen 2.943 N/A LEU 240.A N ASN 199.A O no hydrogen 3.005 N/A LYS 242.A NZ GLU 251.A OE2 no hydrogen 3.164 N/A HIS 243.A N LEU 250.A O no hydrogen 2.941 N/A HIS 243.A ND1 TYR 241.A O no hydrogen 3.312 N/A HIS 243.A NE2 HIS 313.A NE2 no hydrogen 3.353 N/A HIS 245.A N ASP 248.A O no hydrogen 2.896 N/A ASP 248.A N HIS 245.A O no hydrogen 2.956 N/A TYR 249.A OH GLU 251.A OE2 no hydrogen 3.201 N/A LEU 250.A N HIS 243.A O no hydrogen 2.884 N/A SER 252.A N TYR 241.A O no hydrogen 2.962 N/A SER 252.A OG TYR 241.A O no hydrogen 3.447 N/A VAL 254.A N PHE 239.A O no hydrogen 2.819 N/A PHE 255.A N ARG 293.A O no hydrogen 2.978 N/A ILE 256.A N HIS 237.A O no hydrogen 2.864 N/A TYR 257.A N ILE 295.A O no hydrogen 2.809 N/A TYR 257.A OH SER 273.A OG no hydrogen 3.014 N/A SER 258.A N ARG 235.A O no hydrogen 2.978 N/A SER 258.A OG HIS 237.A NE2 no hydrogen 3.223 N/A MET 259.A N ILE 297.A O no hydrogen 3.082 N/A CYS 264.A N GLY 261.A O no hydrogen 3.074 N/A CYS 264.A SG GLY 261.A O no hydrogen 3.759 N/A GLU 268.A N SER 265.A OG no hydrogen 3.291 N/A ARG 269.A N SER 265.A O no hydrogen 2.942 N/A MET 270.A N ILE 266.A O no hydrogen 2.863 N/A LEU 271.A N ARG 267.A O no hydrogen 2.941 N/A TYR 272.A N GLU 268.A O no hydrogen 2.936 N/A SER 273.A N ARG 269.A O no hydrogen 3.444 N/A SER 273.A OG TYR 257.A OH no hydrogen 3.014 N/A SER 273.A OG ARG 269.A O no hydrogen 2.657 N/A SER 274.A N MET 270.A O no hydrogen 2.917 N/A SER 274.A OG MET 270.A O no hydrogen 2.914 N/A CYS 275.A N LEU 271.A O no hydrogen 2.933 N/A CYS 275.A SG LEU 271.A O no hydrogen 3.233 N/A LYS 276.A NZ GLU 296.A OE2 no hydrogen 3.111 N/A LEU 279.A N CYS 275.A O no hydrogen 2.972 N/A LEU 280.A N LYS 276.A O no hydrogen 2.959 N/A GLU 281.A N SER 277.A O no hydrogen 3.126 N/A ILE 282.A N ARG 278.A O no hydrogen 2.979 N/A VAL 283.A N LEU 279.A O no hydrogen 2.926 N/A GLU 284.A N LEU 280.A O no hydrogen 2.896 N/A ARG 285.A N GLU 281.A O no hydrogen 2.860 N/A GLN 286.A N ILE 282.A O no hydrogen 3.116 N/A GLN 288.A NE2 ARG 285.A O no hydrogen 3.629 N/A MET 289.A N VAL 283.A O no hydrogen 3.351 N/A ILE 292.A N ILE 253.A O no hydrogen 3.235 N/A LYS 294.A NZ GLU 284.A OE2 no hydrogen 3.411 N/A ILE 295.A N PHE 255.A O no hydrogen 2.746 N/A ILE 297.A N TYR 257.A O no hydrogen 3.272 N/A ASP 298.A N GLU 302.A OE2 no hydrogen 3.411 N/A GLU 302.A N ASN 299.A O no hydrogen 3.134 N/A LEU 303.A N GLY 300.A O no hydrogen 3.165 N/A THR 304.A N GLU 302.A O no hydrogen 2.914 N/A PHE 307.A N THR 304.A OG1 no hydrogen 2.808 N/A LEU 308.A N THR 304.A O no hydrogen 2.906 N/A TYR 309.A N ALA 305.A O no hydrogen 2.956 N/A TYR 309.A OH HIS 245.A ND1 no hydrogen 3.384 N/A GLU 310.A N ASP 306.A O no hydrogen 2.880 N/A GLU 311.A N PHE 307.A O no hydrogen 2.967 N/A VAL 312.A N LEU 308.A O no hydrogen 3.034 N/A HIS 313.A N TYR 309.A O no hydrogen 2.916 N/A LYS 315.A NZ GLU 310.A OE2 no hydrogen 2.793 N/A