Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6bss_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 4.A N VAL 79.A O no hydrogen 3.110 N/A ASP 8.A N ARG 5.A O no hydrogen 3.038 N/A LEU 9.A N ASN 6.A O no hydrogen 3.270 N/A ILE 10.A N VAL 27.A O no hydrogen 2.851 N/A ASN 12.A N LYS 25.A O no hydrogen 2.776 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 3.001 N/A SER 14.A OG ILE 23.A O no hydrogen 3.494 N/A LEU 15.A N ILE 23.A O no hydrogen 2.893 N/A GLY 18.A N THR 21.A O no hydrogen 3.112 N/A THR 21.A N GLY 18.A O no hydrogen 3.378 N/A LYS 22.A N VAL 46.A O no hydrogen 2.882 N/A ILE 23.A N GLY 16.A O no hydrogen 2.873 N/A PHE 24.A N LEU 44.A O no hydrogen 2.905 N/A LYS 25.A N GLU 13.A O no hydrogen 2.890 N/A LYS 25.A NZ GLU 41.A OE2 no hydrogen 3.309 N/A GLY 26.A N VAL 42.A O no hydrogen 2.930 N/A VAL 27.A N ILE 10.A O no hydrogen 2.918 N/A ARG 28.A N THR 40.A O no hydrogen 2.847 N/A ARG 29.A N ASP 8.A O no hydrogen 2.885 N/A GLU 30.A N HIS 38.A O no hydrogen 2.989 N/A GLY 32.A N GLN 36.A O no hydrogen 2.763 N/A GLY 35.A N GLY 32.A O no hydrogen 3.274 N/A GLN 36.A N ASP 33.A O no hydrogen 3.269 N/A HIS 38.A N GLU 30.A O no hydrogen 2.869 N/A THR 40.A N ARG 28.A O no hydrogen 2.917 N/A THR 40.A OG1 GLU 30.A OE2 no hydrogen 2.734 N/A VAL 42.A N GLY 26.A O no hydrogen 2.879 N/A LEU 43.A N GLN 89.A O no hydrogen 2.913 N/A LEU 44.A N PHE 24.A O no hydrogen 2.919 N/A LYS 45.A N LEU 87.A O no hydrogen 2.922 N/A LYS 45.A NZ GLN 89.A OE1 no hydrogen 2.942 N/A LYS 45.A NZ ASP 162.A OD1 no hydrogen 2.653 N/A VAL 46.A N LYS 22.A O no hydrogen 2.897 N/A LEU 47.A N ASN 85.A O no hydrogen 3.153 N/A ASP 48.A N PHE 20.A O no hydrogen 2.837 N/A HIS 51.A N ASP 48.A O no hydrogen 3.037 N/A ARG 52.A N LYS 49.A O no hydrogen 2.924 N/A TYR 54.A N HIS 51.A O no hydrogen 2.940 N/A SER 55.A N ARG 52.A O no hydrogen 2.916 N/A SER 55.A OG ARG 52.A O no hydrogen 3.394 N/A PHE 58.A N TYR 54.A O no hydrogen 2.793 N/A PHE 59.A N SER 55.A O no hydrogen 2.768 N/A GLU 60.A N GLU 56.A O no hydrogen 2.647 N/A ALA 61.A N SER 57.A O no hydrogen 2.970 N/A SER 63.A N PHE 59.A O no hydrogen 2.759 N/A MET 64.A N GLU 60.A O no hydrogen 2.902 N/A MET 65.A N ALA 62.A O no hydrogen 2.958 N/A SER 66.A N SER 63.A O no hydrogen 2.943 N/A LYS 67.A N SER 63.A O no hydrogen 3.179 N/A HIS 72.A N HIS 70.A ND1 no hydrogen 3.035 N/A HIS 72.A ND1 ILE 158.A O no hydrogen 2.731 N/A LEU 73.A N HIS 70.A O no hydrogen 3.266 N/A VAL 74.A N LEU 160.A O no hydrogen 2.956 N/A LEU 75.A N GLU 90.A OE2 no hydrogen 2.643 N/A ASN 76.A ND2 SER 66.A OG no hydrogen 2.823 N/A TYR 77.A N VAL 88.A O no hydrogen 2.693 N/A GLY 78.A N VAL 88.A O no hydrogen 2.978 N/A VAL 79.A N HIS 2.A O no hydrogen 3.027 N/A CYS 80.A N ILE 86.A O no hydrogen 2.868 N/A CYS 80.A SG ILE 4.A O no hydrogen 3.584 N/A ILE 86.A N CYS 80.A O no hydrogen 2.937 N/A LEU 87.A N LYS 45.A O no hydrogen 2.884 N/A VAL 88.A N GLY 78.A O no hydrogen 2.886 N/A GLN 89.A N LEU 43.A O no hydrogen 2.918 N/A GLN 89.A NE2 ASN 76.A OD1 no hydrogen 2.728 N/A GLN 89.A NE2 ASP 162.A OD1 no hydrogen 3.074 N/A GLU 90.A N LEU 75.A O no hydrogen 3.007 N/A SER 96.A OG ASP 98.A OD1 no hydrogen 2.740 N/A LEU 97.A N ALA 139.A O no hydrogen 3.342 N/A LEU 97.A N ILE 142.A O no hydrogen 2.744 N/A TYR 100.A N SER 96.A O no hydrogen 3.333 N/A TYR 100.A OH GLU 147.A OE1 no hydrogen 2.466 N/A LEU 101.A N LEU 97.A O no hydrogen 2.850 N/A LYS 102.A N ASP 98.A O no hydrogen 2.964 N/A LYS 103.A N THR 99.A O no hydrogen 2.885 N/A ASN 104.A N TYR 100.A O no hydrogen 2.853 N/A ASN 104.A ND2 TYR 100.A O no hydrogen 3.180 N/A CYS 107.A N ASN 104.A O no hydrogen 3.298 N/A CYS 107.A SG ASN 104.A O no hydrogen 3.558 N/A TRP 112.A N ASN 109.A OD1 no hydrogen 3.101 N/A LYS 113.A N ASN 109.A O no hydrogen 3.196 N/A LEU 114.A N ILE 110.A O no hydrogen 2.853 N/A GLU 115.A N LEU 111.A O no hydrogen 2.924 N/A VAL 116.A N TRP 112.A O no hydrogen 2.979 N/A ALA 117.A N LYS 113.A O no hydrogen 2.863 N/A LYS 118.A N LEU 114.A O no hydrogen 2.885 N/A GLN 119.A N GLU 115.A O no hydrogen 2.969 N/A GLN 119.A NE2 GLU 115.A OE2 no hydrogen 2.988 N/A GLN 119.A NE2 PRO 156.A O no hydrogen 2.490 N/A LEU 120.A N VAL 116.A O no hydrogen 2.943 N/A ALA 121.A N ALA 117.A O no hydrogen 2.860 N/A ALA 122.A N LYS 118.A O no hydrogen 2.882 N/A ALA 123.A N GLN 119.A O no hydrogen 2.996 N/A MET 124.A N LEU 120.A O no hydrogen 2.943 N/A HIS 125.A N ALA 121.A O no hydrogen 2.844 N/A PHE 126.A N ALA 122.A O no hydrogen 2.924 N/A LEU 127.A N ALA 123.A O no hydrogen 2.970 N/A GLU 128.A N MET 124.A O no hydrogen 2.851 N/A GLU 129.A N HIS 125.A O no hydrogen 2.916 N/A ASN 130.A N PHE 126.A O no hydrogen 3.318 N/A ASN 130.A ND2 PHE 126.A O no hydrogen 2.873 N/A THR 131.A N GLU 128.A O no hydrogen 2.957 N/A THR 131.A OG1 ASN 130.A O no hydrogen 2.577 N/A LEU 132.A N LEU 127.A O no hydrogen 2.938 N/A HIS 134.A N ASP 198.A OD2 no hydrogen 2.794 N/A HIS 134.A NE2 SER 161.A O no hydrogen 2.713 N/A GLY 135.A N ASP 198.A OD1 no hydrogen 2.897 N/A ASN 136.A N HIS 134.A ND1 no hydrogen 3.128 N/A ASN 136.A ND2 PRO 163.A O no hydrogen 2.884 N/A CYS 138.A SG ASN 136.A O no hydrogen 3.765 N/A CYS 138.A SG ASN 136.A OD1 no hydrogen 3.898 N/A ALA 139.A N GLU 208.A OE1 no hydrogen 2.972 N/A ASN 141.A N CYS 138.A O no hydrogen 2.959 N/A ASN 141.A ND2 ASN 136.A O no hydrogen 2.812 N/A ILE 142.A N ALA 139.A O no hydrogen 3.124 N/A LEU 143.A N LYS 159.A O no hydrogen 2.883 N/A LEU 144.A N GLY 95.A O no hydrogen 2.926 N/A ILE 145.A N PHE 157.A O no hydrogen 2.894 N/A ARG 146.A N PHE 157.A O no hydrogen 3.501 N/A ARG 146.A NE PRO 155.A O no hydrogen 2.968 N/A ARG 146.A NH2 PRO 155.A O no hydrogen 3.093 N/A ASP 149.A N ASN 154.A O no hydrogen 2.930 N/A LYS 151.A N ASP 149.A OD1 no hydrogen 2.983 N/A PHE 157.A N ARG 146.A O no hydrogen 3.231 N/A ILE 158.A N GLN 119.A OE1 no hydrogen 2.935 N/A LYS 159.A N LEU 143.A O no hydrogen 2.883 N/A LYS 159.A NZ GLU 90.A OE1 no hydrogen 3.351 N/A LYS 159.A NZ GLU 90.A OE2 no hydrogen 2.768 N/A LEU 160.A N HIS 72.A O no hydrogen 2.717 N/A SER 161.A N ASN 141.A O no hydrogen 2.746 N/A SER 161.A OG ASP 162.A OD1 no hydrogen 3.529 N/A GLY 164.A N ASP 162.A OD2 no hydrogen 3.080 N/A SER 166.A N SER 57.A OG no hydrogen 3.252 N/A SER 166.A OG THR 168.A OG1 no hydrogen 2.909 N/A THR 168.A N SER 166.A OG no hydrogen 3.179 N/A THR 168.A OG1 SER 166.A OG no hydrogen 2.909 N/A VAL 169.A N SER 166.A O no hydrogen 3.269 N/A LEU 175.A N PRO 171.A O no hydrogen 3.183 N/A GLN 176.A N LYS 172.A O no hydrogen 2.905 N/A GLU 177.A N ASP 173.A O no hydrogen 2.906 N/A ARG 178.A N ILE 174.A O no hydrogen 3.130 N/A ARG 178.A N LEU 175.A O no hydrogen 3.015 N/A ARG 178.A NH2 THR 19.A OG1 no hydrogen 2.477 N/A ILE 179.A N GLN 176.A O no hydrogen 3.178 N/A TRP 181.A N ARG 178.A O no hydrogen 2.764 N/A TRP 181.A NE1 GLU 208.A OE1 no hydrogen 2.736 N/A VAL 182.A N ARG 178.A O no hydrogen 3.164 N/A GLU 185.A N GLU 185.A OE1 no hydrogen 2.748 N/A CYS 186.A N PRO 183.A O no hydrogen 3.167 N/A CYS 186.A SG THR 197.A OG1 no hydrogen 3.504 N/A ILE 187.A N PRO 183.A O no hydrogen 3.210 N/A GLU 188.A N PRO 184.A O no hydrogen 2.905 N/A ASN 189.A N GLU 185.A O no hydrogen 2.930 N/A LYS 191.A N ASN 189.A OD1 no hydrogen 3.033 N/A ASN 192.A N ASN 189.A O no hydrogen 2.925 N/A ASN 192.A ND2 GLU 185.A O no hydrogen 3.034 N/A ASN 194.A N THR 197.A OG1 no hydrogen 3.395 N/A ALA 196.A N ASN 194.A OD1 no hydrogen 3.496 N/A THR 197.A N ASN 194.A O no hydrogen 3.253 N/A ASP 198.A N LEU 195.A O no hydrogen 3.225 N/A LYS 199.A NZ GLU 128.A OE2 no hydrogen 2.705 N/A TRP 200.A N ALA 196.A O no hydrogen 3.049 N/A TRP 200.A NE1 PRO 180.A O no hydrogen 2.734 N/A SER 201.A N THR 197.A O no hydrogen 2.936 N/A SER 201.A OG TRP 181.A O no hydrogen 2.646 N/A SER 201.A OG THR 197.A O no hydrogen 3.134 N/A PHE 202.A N ASP 198.A O no hydrogen 2.815 N/A GLY 203.A N LYS 199.A O no hydrogen 3.026 N/A THR 204.A N TRP 200.A O no hydrogen 3.062 N/A THR 204.A OG1 PRO 180.A O no hydrogen 2.905 N/A THR 204.A OG1 TRP 200.A O no hydrogen 3.341 N/A THR 205.A N SER 201.A O no hydrogen 2.877 N/A THR 205.A OG1 SER 201.A O no hydrogen 2.816 N/A LEU 206.A N PHE 202.A O no hydrogen 2.916 N/A TRP 207.A N GLY 203.A O no hydrogen 3.021 N/A TRP 207.A NE1 PRO 236.A O no hydrogen 2.697 N/A GLU 208.A N THR 204.A O no hydrogen 2.983 N/A ILE 209.A N THR 205.A O no hydrogen 2.902 N/A CYS 210.A N LEU 206.A O no hydrogen 2.924 N/A CYS 210.A SG LEU 206.A O no hydrogen 3.445 N/A SER 211.A N GLU 208.A O no hydrogen 3.005 N/A SER 211.A OG TRP 207.A O no hydrogen 2.944 N/A GLY 213.A N GLU 208.A O no hydrogen 3.508 N/A ASP 214.A N SER 211.A O no hydrogen 2.997 N/A LYS 215.A NZ GLY 213.A O no hydrogen 3.253 N/A SER 218.A N LYS 215.A O no hydrogen 3.351 N/A SER 218.A OG LYS 215.A O no hydrogen 3.338 N/A LEU 220.A N LEU 217.A O no hydrogen 3.043 N/A ARG 224.A N ASP 221.A OD1 no hydrogen 3.108 N/A LYS 225.A N ASP 221.A O no hydrogen 2.886 N/A LYS 225.A NZ GLU 177.A O no hydrogen 2.869 N/A LYS 225.A NZ ILE 179.A O no hydrogen 3.170 N/A LEU 226.A N SER 222.A O no hydrogen 2.917 N/A GLN 227.A N GLN 223.A O no hydrogen 2.942 N/A GLN 227.A NE2 ASP 231.A OD1 no hydrogen 3.082 N/A GLN 227.A NE2 ASP 231.A OD2 no hydrogen 3.165 N/A PHE 228.A N ARG 224.A O no hydrogen 2.827 N/A TYR 229.A N LYS 225.A O no hydrogen 3.009 N/A TYR 229.A OH VAL 182.A O no hydrogen 2.540 N/A GLU 230.A N LEU 226.A O no hydrogen 2.876 N/A ASP 231.A N GLN 227.A O no hydrogen 2.887 N/A ARG 232.A N TYR 229.A O no hydrogen 3.122 N/A HIS 233.A N PHE 228.A O no hydrogen 3.300 N/A GLN 234.A NE2 MET 251.A O no hydrogen 3.600 N/A GLU 242.A N GLU 242.A OE1 no hydrogen 2.802 N/A ALA 244.A N ALA 241.A O no hydrogen 3.253 N/A ILE 247.A N LEU 243.A O no hydrogen 2.876 N/A ASN 248.A N ALA 244.A O no hydrogen 2.923 N/A ASN 249.A N ASN 245.A O no hydrogen 2.879 N/A CYS 250.A N LEU 246.A O no hydrogen 2.921 N/A CYS 250.A SG LEU 246.A O no hydrogen 3.325 N/A MET 251.A N ILE 247.A O no hydrogen 2.993 N/A TYR 253.A OH HIS 233.A O no hydrogen 2.607 N/A GLU 254.A N ASP 252.A OD1 no hydrogen 2.921 N/A ASP 256.A N GLU 254.A OE1 no hydrogen 3.472 N/A HIS 257.A N GLU 254.A O no hydrogen 3.066 N/A ARG 258.A N PRO 255.A O no hydrogen 3.324 N/A ARG 258.A NE ASP 252.A O no hydrogen 2.708 N/A ARG 258.A NH1 GLU 185.A OE2 no hydrogen 2.835 N/A ARG 258.A NH1 ALA 196.A O no hydrogen 2.882 N/A ARG 258.A NH2 GLU 185.A OE1 no hydrogen 2.884 N/A ARG 258.A NH2 GLU 185.A OE2 no hydrogen 3.434 N/A ARG 258.A NH2 ASP 252.A O no hydrogen 2.991 N/A PHE 261.A N GLU 128.A OE1 no hydrogen 3.295 N/A ALA 263.A N SER 260.A OG no hydrogen 3.249 N/A ILE 264.A N SER 260.A O no hydrogen 2.970 N/A ILE 265.A N PHE 261.A O no hydrogen 2.900 N/A ARG 266.A N ARG 262.A O no hydrogen 2.907 N/A ASP 267.A N ALA 263.A O no hydrogen 2.915 N/A LEU 268.A N ILE 264.A O no hydrogen 2.940 N/A ASN 269.A N ILE 265.A O no hydrogen 2.895 N/A SER 270.A N ARG 266.A O no hydrogen 2.880 N/A SER 270.A OG ASP 267.A O no hydrogen 2.633 N/A LEU 271.A N ASP 267.A O no hydrogen 2.976 N/A