Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bin_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 3.A N VAL 19.A O no hydrogen 2.756 N/A CYS 5.A N CYS 17.A O no hydrogen 2.930 N/A CYS 5.A SG MET 3.A O no hydrogen 3.880 N/A LYS 6.A N TRP 73.A O no hydrogen 3.049 N/A LYS 6.A NZ THR 16.A OG1 no hydrogen 2.922 N/A VAL 7.A N TYR 15.A O no hydrogen 2.751 N/A ILE 8.A N PHE 75.A O no hydrogen 2.849 N/A LEU 9.A N SER 13.A O no hydrogen 2.749 N/A GLY 12.A N LEU 9.A O no hydrogen 3.011 N/A SER 13.A N ASP 11.A OD1 no hydrogen 2.932 N/A SER 13.A OG ASP 11.A OD1 no hydrogen 2.649 N/A TYR 15.A N VAL 7.A O no hydrogen 2.815 N/A CYS 17.A N CYS 5.A O no hydrogen 3.206 N/A VAL 19.A N MET 3.A O no hydrogen 3.074 N/A LYS 21.A N ALA 1.A O no hydrogen 3.184 N/A ARG 22.A N.A GLU 20.A OE2.A no hydrogen 2.924 N/A ARG 22.A N.B GLU 20.A OE2.A no hydrogen 2.917 N/A ARG 22.A NE.A GLU 20.A OE2.A no hydrogen 2.575 N/A ARG 22.A NH2.A GLU 20.A OE2.A no hydrogen 3.399 N/A SER 23.A N GLU 20.A O.A no hydrogen 2.980 N/A SER 23.A N GLU 20.A O.B no hydrogen 3.203 N/A SER 23.A OG GLU 20.A O.A no hydrogen 2.737 N/A SER 23.A OG GLU 20.A O.B no hydrogen 2.875 N/A GLY 25.A N LYS 62.A O no hydrogen 2.971 N/A GLN 26.A N PRO 60.A O no hydrogen 2.976 N/A GLN 26.A NE2 ASP 30.A OD1 no hydrogen 2.853 N/A VAL 27.A N ARG 24.A O no hydrogen 3.126 N/A LEU 28.A N GLY 25.A O no hydrogen 3.165 N/A PHE 29.A N GLY 25.A O no hydrogen 3.089 N/A ASP 30.A N GLN 26.A O no hydrogen 2.873 N/A LYS 31.A N VAL 27.A O no hydrogen 3.190 N/A VAL 32.A N LEU 28.A O no hydrogen 2.957 N/A CYS 33.A N PHE 29.A O no hydrogen 3.048 N/A CYS 33.A SG PHE 29.A O no hydrogen 3.286 N/A GLU 34.A N ASP 30.A O no hydrogen 3.011 N/A HIS 35.A N LYS 31.A O no hydrogen 3.023 N/A LEU 36.A N VAL 32.A O no hydrogen 2.988 N/A ASN 37.A N GLU 34.A O no hydrogen 3.159 N/A LEU 38.A N CYS 33.A O no hydrogen 2.964 N/A LYS 41.A NZ ASP 30.A OD1 no hydrogen 2.557 N/A PHE 44.A N LYS 41.A O no hydrogen 3.045 N/A GLY 45.A N ASN 78.A O no hydrogen 2.930 N/A THR 47.A N SER 76.A O no hydrogen 2.858 N/A THR 47.A OG1 SER 76.A O no hydrogen 3.414 N/A TYR 48.A N ASN 56.A O no hydrogen 3.074 N/A ARG 49.A NH1 ASN 53.A O no hydrogen 2.631 N/A ASP 50.A N GLN 54.A O no hydrogen 3.040 N/A GLU 52.A N ASP 50.A OD1 no hydrogen 3.003 N/A ASN 53.A N ASP 50.A O no hydrogen 2.696 N/A GLN 54.A N ASP 50.A OD1 no hydrogen 2.977 N/A GLN 54.A NE2 GLU 52.A O no hydrogen 3.326 N/A ASN 56.A N TYR 48.A O no hydrogen 2.940 N/A ASN 56.A ND2 ASP 50.A OD2 no hydrogen 3.011 N/A ASN 56.A ND2 GLN 54.A O no hydrogen 2.909 N/A LEU 58.A N LEU 46.A O no hydrogen 2.751 N/A ASP 59.A N GLN 67.A OE1 no hydrogen 2.693 N/A ALA 61.A N ASP 59.A OD1 no hydrogen 3.125 N/A LYS 62.A N ASP 59.A O no hydrogen 3.349 N/A ILE 64.A N SER 23.A O no hydrogen 3.023 N/A LYS 66.A N GLU 63.A O no hydrogen 3.282 N/A GLN 67.A N ILE 64.A O no hydrogen 3.067 N/A GLN 67.A NE2 ASP 59.A O no hydrogen 2.884 N/A GLN 67.A NE2 GLU 63.A O no hydrogen 3.060 N/A VAL 68.A N ILE 64.A O no hydrogen 2.878 N/A ALA 72.A N SER 70.A OG no hydrogen 3.075 N/A HIS 74.A N.B ALA 72.A O no hydrogen 2.903 N/A PHE 75.A N LYS 6.A O no hydrogen 2.751 N/A SER 76.A N THR 47.A O no hydrogen 2.833 N/A PHE 77.A N ILE 8.A O no hydrogen 2.957 N/A ASN 78.A N GLY 45.A O no hydrogen 2.994 N/A ASN 78.A ND2 THR 47.A OG1 no hydrogen 3.326 N/A ASN 78.A ND2 SER 76.A O no hydrogen 3.361 N/A ASN 78.A ND2 SER 76.A OG no hydrogen 3.079 N/A VAL 79.A N GLN 101.A OE1 no hydrogen 3.110 N/A LYS 80.A N TYR 43.A O no hydrogen 2.785 N/A LYS 80.A NZ GLU 273.A OE1 no hydrogen 2.504 N/A PHE 81.A N TYR 43.A O no hydrogen 2.942 N/A TYR 82.A OH ASP 105.A OD2 no hydrogen 2.506 N/A ALA 87.A N ASP 85.A OD1 no hydrogen 3.123 N/A GLN 88.A N ASP 85.A O no hydrogen 3.103 N/A GLN 88.A NE2 ASP 85.A OD2 no hydrogen 3.390 N/A LEU 89.A N PRO 86.A O no hydrogen 3.248 N/A SER 90.A N GLU 40.A OE2 no hydrogen 2.846 N/A GLU 91.A N GLU 40.A OE1 no hydrogen 3.049 N/A THR 94.A OG1 GLU 40.A OE1 no hydrogen 2.597 N/A THR 94.A OG1 GLU 91.A O no hydrogen 3.553 N/A ARG 95.A NH1 PRO 86.A O no hydrogen 2.964 N/A ARG 95.A NH1 LEU 89.A O no hydrogen 2.846 N/A ARG 95.A NH2 ASP 92.A OD1 no hydrogen 2.868 N/A TYR 96.A N ASP 92.A O no hydrogen 3.007 N/A TYR 96.A OH GLU 129.A OE2 no hydrogen 2.994 N/A TYR 97.A N ILE 93.A O no hydrogen 3.076 N/A TYR 97.A OH LEU 36.A O no hydrogen 2.662 N/A LEU 98.A N THR 94.A O no hydrogen 2.942 N/A CYS 99.A N ARG 95.A O no hydrogen 2.838 N/A CYS 99.A SG ARG 95.A O no hydrogen 3.243 N/A CYS 99.A SG GLU 176.A O no hydrogen 3.928 N/A LEU 100.A N TYR 96.A O no hydrogen 3.047 N/A GLN 101.A N TYR 97.A O no hydrogen 3.094 N/A GLN 101.A NE2 GLN 101.A O no hydrogen 3.185 N/A GLN 101.A NE2 ASP 105.A OD1 no hydrogen 2.894 N/A LEU 102.A N LEU 98.A O no hydrogen 3.075 N/A ARG 103.A N CYS 99.A O no hydrogen 2.889 N/A ARG 103.A NH1 GLU 129.A OE2 no hydrogen 3.316 N/A ARG 103.A NH2 GLU 129.A OE2 no hydrogen 3.218 N/A ASP 104.A N LEU 100.A O no hydrogen 3.241 N/A ASP 105.A N GLN 101.A O no hydrogen 2.777 N/A ILE 106.A N LEU 102.A O no hydrogen 2.915 N/A VAL 107.A N ARG 103.A O no hydrogen 3.040 N/A SER 108.A N ASP 104.A O no hydrogen 2.773 N/A SER 108.A OG ASP 104.A O no hydrogen 3.248 N/A SER 108.A OG ASP 105.A O no hydrogen 3.247 N/A GLY 109.A N ILE 106.A O no hydrogen 2.852 N/A ARG 110.A N SER 108.A OG no hydrogen 3.325 N/A ARG 110.A NH2 ASP 104.A OD2 no hydrogen 3.114 N/A ARG 110.A NH2 ASP 105.A OD1 no hydrogen 2.739 N/A LEU 111.A N ASP 105.A O no hydrogen 2.991 N/A SER 114.A OG THR 117.A OG1 no hydrogen 2.869 N/A THR 117.A N SER 114.A OG no hydrogen 3.197 N/A THR 117.A OG1 SER 114.A OG no hydrogen 2.869 N/A LEU 118.A N SER 114.A O no hydrogen 2.824 N/A ALA 119.A N PHE 115.A O no hydrogen 3.078 N/A LEU 120.A N VAL 116.A O no hydrogen 3.128 N/A LEU 121.A N THR 117.A O no hydrogen 2.772 N/A GLY 122.A N LEU 118.A O no hydrogen 2.929 N/A SER 123.A N ALA 119.A O no hydrogen 2.890 N/A SER 123.A OG ALA 119.A O no hydrogen 3.344 N/A SER 123.A OG LEU 120.A O no hydrogen 2.770 N/A SER 123.A OG HIS 167.A NE2 no hydrogen 2.769 N/A TYR 124.A N LEU 120.A O no hydrogen 3.232 N/A THR 125.A N LEU 121.A O no hydrogen 3.090 N/A THR 125.A OG1 LEU 121.A O no hydrogen 3.327 N/A VAL 126.A N GLY 122.A O no hydrogen 3.071 N/A GLN 127.A N SER 123.A O no hydrogen 3.076 N/A GLN 127.A NE2 ASP 132.A OD1 no hydrogen 2.762 N/A GLN 127.A NE2 MET 170.A O no hydrogen 2.910 N/A SER 128.A N TYR 124.A O no hydrogen 2.947 N/A SER 128.A OG GLU 176.A OE2 no hydrogen 2.780 N/A GLU 129.A N THR 125.A O no hydrogen 2.870 N/A LEU 130.A N VAL 126.A O no hydrogen 2.686 N/A GLY 131.A N GLN 127.A O no hydrogen 3.071 N/A GLU 137.A N ASP 134.A O no hydrogen 3.208 N/A CYS 138.A N ASP 134.A O no hydrogen 2.842 N/A TYR 142.A OH HIS 164.A ND1 no hydrogen 2.911 N/A SER 144.A OG ASP 141.A O no hydrogen 3.074 N/A SER 144.A OG ASP 141.A OD1 no hydrogen 2.749 N/A PHE 148.A N HIS 152.A NE2 no hydrogen 2.941 N/A GLU 157.A N THR 153.A O no hydrogen 3.195 N/A ASP 158.A N LYS 154.A O no hydrogen 3.294 N/A LYS 159.A N GLU 155.A O no hydrogen 3.124 N/A LYS 159.A NZ GLU 162.A OE1 no hydrogen 3.298 N/A VAL 160.A N LEU 156.A O no hydrogen 2.893 N/A ILE 161.A N GLU 157.A O no hydrogen 3.142 N/A GLU 162.A N ASP 158.A O no hydrogen 2.953 N/A LEU 163.A N LYS 159.A O no hydrogen 2.953 N/A HIS 164.A N VAL 160.A O no hydrogen 2.884 N/A HIS 164.A ND1 TYR 142.A OH no hydrogen 2.911 N/A HIS 164.A NE2 GLY 131.A O no hydrogen 2.742 N/A LYS 165.A N ILE 161.A O no hydrogen 3.026 N/A SER 166.A N LEU 163.A O no hydrogen 3.057 N/A SER 166.A OG LEU 163.A O no hydrogen 2.327 N/A HIS 167.A N HIS 164.A O no hydrogen 3.025 N/A HIS 167.A NE2 SER 123.A OG no hydrogen 2.769 N/A GLY 169.A N ASP 132.A OD1 no hydrogen 2.876 N/A MET 170.A N HIS 167.A O no hydrogen 3.077 N/A ALA 175.A N THR 171.A O no hydrogen 2.850 N/A GLU 176.A N PRO 172.A O no hydrogen 2.853 N/A MET 177.A N ALA 173.A O no hydrogen 3.033 N/A HIS 178.A N GLU 174.A O no hydrogen 2.983 N/A HIS 178.A NE2 GLU 174.A OE2 no hydrogen 2.841 N/A PHE 179.A N ALA 175.A O no hydrogen 2.918 N/A LEU 180.A N GLU 176.A O no hydrogen 2.893 N/A GLU 181.A N MET 177.A O no hydrogen 3.123 N/A ASN 182.A N HIS 178.A O no hydrogen 3.182 N/A ASN 182.A ND2 HIS 178.A O no hydrogen 2.628 N/A ALA 183.A N PHE 179.A O no hydrogen 3.025 N/A LYS 184.A N LEU 180.A O no hydrogen 2.867 N/A LYS 184.A NZ ASP 85.A OD1 no hydrogen 3.339 N/A LYS 184.A NZ GLU 181.A OE2 no hydrogen 2.925 N/A LEU 186.A N ALA 183.A O no hydrogen 3.103 N/A TYR 189.A N LEU 186.A O no hydrogen 3.187 N/A TYR 189.A OH PRO 83.A O no hydrogen 2.580 N/A VAL 191.A N MET 188.A O no hydrogen 3.019 N/A ASP 192.A N VAL 208.A O no hydrogen 2.985 N/A HIS 194.A N LEU 206.A O no hydrogen 3.241 N/A ALA 196.A N ILE 204.A O no hydrogen 3.014 N/A LYS 197.A N LYS 257.A O no hydrogen 2.837 N/A ASP 198.A N VAL 202.A O no hydrogen 3.001 N/A SER 199.A OG GLU 200.A OE2 no hydrogen 2.840 N/A GLU 200.A N ASP 198.A OD1 no hydrogen 2.699 N/A GLY 201.A N ASP 198.A O no hydrogen 2.958 N/A GLY 201.A N ASP 198.A OD1 no hydrogen 3.131 N/A VAL 202.A N ASP 198.A OD1 no hydrogen 3.323 N/A ILE 204.A N ALA 196.A O no hydrogen 2.980 N/A MET 205.A N TYR 216.A O no hydrogen 3.012 N/A LEU 206.A N HIS 194.A O no hydrogen 2.769 N/A GLY 207.A N LEU 214.A O no hydrogen 2.846 N/A VAL 208.A N ASP 192.A O no hydrogen 3.002 N/A CYS 209.A N GLY 212.A O no hydrogen 3.089 N/A CYS 209.A SG SER 211.A OG no hydrogen 3.493 N/A CYS 209.A SG GLY 212.A O no hydrogen 3.785 N/A LEU 213.A N PHE 223.A O no hydrogen 2.958 N/A LEU 214.A N GLY 207.A O no hydrogen 2.883 N/A ILE 215.A N ASN 221.A O no hydrogen 3.181 N/A TYR 216.A N MET 205.A O no hydrogen 2.885 N/A ILE 220.A N ILE 215.A O no hydrogen 3.057 N/A ASN 221.A N ILE 215.A O no hydrogen 3.140 N/A ARG 222.A N ASN 221.A OD1 no hydrogen 2.816 N/A PHE 223.A N LEU 213.A O no hydrogen 2.634 N/A TRP 225.A N SER 211.A O no hydrogen 2.972 N/A TRP 225.A NE1 CYS 209.A O no hydrogen 3.186 N/A LYS 227.A N ALA 224.A O no hydrogen 2.945 N/A LYS 227.A NZ GLU 248.A OE2 no hydrogen 3.317 N/A VAL 228.A N TRP 225.A O no hydrogen 2.818 N/A LEU 229.A N LYS 241.A O no hydrogen 2.854 N/A SER 232.A N.A TYR 239.A O no hydrogen 2.842 N/A SER 232.A N.B TYR 239.A O no hydrogen 2.809 N/A LYS 234.A N ASN 237.A O no hydrogen 3.120 N/A ASN 237.A N LYS 234.A O no hydrogen 2.984 N/A PHE 238.A N PHE 256.A O no hydrogen 2.869 N/A TYR 239.A N SER 232.A O.A no hydrogen 2.749 N/A TYR 239.A N SER 232.A O.B no hydrogen 3.080 N/A ILE 240.A N ILE 254.A O no hydrogen 2.936 N/A LYS 241.A N LYS 230.A O no hydrogen 3.028 N/A LYS 241.A NZ GLU 251.A OE1 no hydrogen 3.380 N/A ILE 242.A N SER 252.A O no hydrogen 2.946 N/A ARG 243.A NE.A GLU 251.A OE2 no hydrogen 3.396 N/A ARG 243.A NH1.A GLU 248.A O no hydrogen 2.892 N/A ARG 243.A NH2.A GLU 251.A OE2 no hydrogen 3.492 N/A GLU 248.A N GLY 245.A O no hydrogen 3.195 N/A SER 252.A N ILE 242.A O no hydrogen 2.887 N/A ILE 254.A N ILE 240.A O no hydrogen 2.700 N/A PHE 256.A N PHE 238.A O no hydrogen 2.891 N/A LYS 257.A N LYS 197.A O no hydrogen 2.796 N/A LYS 257.A NZ ASN 237.A OD1 no hydrogen 2.671 N/A LEU 258.A N ASN 236.A O no hydrogen 2.696 N/A ALA 263.A N ASN 260.A OD1 no hydrogen 2.752 N/A ALA 264.A N ASN 260.A O no hydrogen 3.232 N/A LYS 265.A N HIS 261.A O no hydrogen 2.863 N/A LYS 265.A NZ TYR 233.A OH no hydrogen 2.862 N/A ARG 266.A N ARG 262.A O no hydrogen 2.927 N/A ARG 266.A NH1 ASN 56.A OD1 no hydrogen 3.522 N/A LEU 267.A N ALA 263.A O no hydrogen 3.015 N/A TRP 268.A N ALA 264.A O no hydrogen 2.917 N/A TRP 268.A NE1 ILE 231.A O no hydrogen 3.019 N/A LYS 269.A N LYS 265.A O no hydrogen 3.039 N/A VAL 270.A N ARG 266.A O no hydrogen 3.115 N/A CYS 271.A N LEU 267.A O no hydrogen 3.055 N/A CYS 271.A SG LEU 267.A O no hydrogen 3.439 N/A VAL 272.A N TRP 268.A O no hydrogen 2.928 N/A GLU 273.A N LYS 269.A O no hydrogen 2.869 N/A HIS 274.A N VAL 270.A O no hydrogen 2.988 N/A HIS 275.A N CYS 271.A O no hydrogen 2.986 N/A THR 276.A N VAL 272.A O no hydrogen 2.857 N/A THR 276.A OG1 VAL 272.A O no hydrogen 2.787 N/A PHE 277.A N GLU 273.A O no hydrogen 2.949 N/A PHE 278.A N HIS 274.A O no hydrogen 2.922 N/A ARG 279.A N HIS 275.A O no hydrogen 2.819 N/A LEU 280.A N THR 276.A O no hydrogen 2.825 N/A