Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8s52_M.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG HIS 5.A ND1 no hydrogen 3.598 N/A ALA 8.A N HIS 5.A O no hydrogen 3.416 N/A VAL 11.A N ILE 20.A O no hydrogen 2.905 N/A ASP 13.A N ASP 18.A O no hydrogen 2.959 N/A TYR 14.A OH ASP 34.A OD2 no hydrogen 2.997 N/A ALA 16.A N ASP 13.A OD1 no hydrogen 2.984 N/A ASP 18.A N ASP 13.A O no hydrogen 2.966 N/A ILE 20.A N VAL 11.A O no hydrogen 2.947 N/A CYS 21.A N LEU 26.A O no hydrogen 3.087 N/A CYS 21.A SG HIS 5.A ND1 no hydrogen 3.733 N/A GLY 25.A N CYS 21.A O no hydrogen 2.895 N/A VAL 28.A N MET 19.A O no hydrogen 3.026 N/A VAL 32.A N GLY 17.A O no hydrogen 3.139 N/A ARG 39.A NH2 GLU 38.A OE2 no hydrogen 3.010 N/A GLN 44.A NE2 ASP 52.A O no hydrogen 3.331 N/A LEU 48.A N ASN 45.A O no hydrogen 3.051 N/A SER 49.A OG ASP 50.A OD1 no hydrogen 3.331 N/A SER 49.A OG ASP 84.A OD1 no hydrogen 2.644 N/A SER 65.A N GLY 62.A O no hydrogen 3.167 N/A SER 65.A OG GLY 62.A O no hydrogen 2.724 N/A PHE 66.A N ALA 63.A O no hydrogen 3.107 N/A GLU 68.A N ASP 67.A OD1 no hydrogen 2.574 N/A SER 72.A OG TYR 74.A O no hydrogen 3.071 N/A LYS 73.A N SER 65.A O no hydrogen 3.172 N/A ASN 76.A ND2 ILE 57.A O no hydrogen 3.057 N/A ARG 77.A N GLN 75.A O no hydrogen 2.819 N/A SER 83.A N SER 81.A OG no hydrogen 3.145 N/A ARG 85.A N SER 81.A O no hydrogen 3.004 N/A ALA 86.A N SER 82.A O no hydrogen 2.860 N/A MET 87.A N SER 83.A O no hydrogen 2.969 N/A MET 88.A N ASP 84.A O no hydrogen 2.874 N/A ASN 89.A N ARG 85.A O no hydrogen 2.914 N/A ALA 90.A N ALA 86.A O no hydrogen 3.214 N/A PHE 91.A N MET 87.A O no hydrogen 2.887 N/A LYS 92.A N MET 88.A O no hydrogen 2.991 N/A GLU 93.A N ASN 89.A O no hydrogen 3.051 N/A ILE 94.A N ALA 90.A O no hydrogen 2.844 N/A THR 95.A N PHE 91.A O no hydrogen 2.929 N/A THR 95.A OG1 PHE 91.A O no hydrogen 2.873 N/A THR 96.A N LYS 92.A O no hydrogen 3.186 N/A THR 96.A OG1 LYS 92.A O no hydrogen 2.939 N/A MET 97.A N GLU 93.A O no hydrogen 2.892 N/A ALA 98.A N ILE 94.A O no hydrogen 2.842 N/A ASP 99.A N THR 95.A O no hydrogen 2.967 N/A ARG 100.A N MET 97.A O no hydrogen 3.247 N/A ILE 101.A N ALA 98.A O no hydrogen 3.330 N/A LEU 103.A N ALA 98.A O no hydrogen 3.186 N/A ILE 107.A N PRO 104.A O no hydrogen 3.171 N/A ASP 109.A N ARG 105.A O no hydrogen 2.864 N/A ARG 110.A N ASN 106.A O no hydrogen 2.945 N/A ARG 110.A NE GLU 144.A OE2 no hydrogen 2.442 N/A THR 111.A N ILE 107.A O no hydrogen 2.865 N/A THR 111.A OG1 ILE 107.A O no hydrogen 2.553 N/A ASN 112.A N VAL 108.A O no hydrogen 2.867 N/A ASN 113.A N ASP 109.A O no hydrogen 2.937 N/A LEU 114.A N ARG 110.A O no hydrogen 2.948 N/A PHE 115.A N THR 111.A O no hydrogen 2.872 N/A LYS 116.A N ASN 112.A O no hydrogen 2.904 N/A LYS 116.A NZ PRO 46.A O no hydrogen 3.174 N/A GLN 117.A N ASN 113.A O no hydrogen 2.955 N/A VAL 118.A N LEU 114.A O no hydrogen 2.936 N/A TYR 119.A N PHE 115.A O no hydrogen 2.879 N/A GLU 120.A N LYS 116.A O no hydrogen 2.898 N/A GLN 121.A N GLN 117.A O no hydrogen 2.909 N/A LYS 122.A N VAL 118.A O no hydrogen 2.969 N/A LYS 122.A NZ GLU 120.A O no hydrogen 3.277 N/A ARG 127.A N LEU 124.A O no hydrogen 3.364 N/A ALA 131.A N ALA 128.A O no hydrogen 2.986 N/A ILE 132.A N ALA 128.A O no hydrogen 3.091 N/A ALA 133.A N ASN 129.A O no hydrogen 2.805 N/A SER 134.A N ASP 130.A O no hydrogen 3.039 N/A SER 134.A OG ASP 130.A O no hydrogen 2.889 N/A SER 134.A OG SER 157.A OG no hydrogen 3.033 N/A ALA 135.A N ALA 131.A O no hydrogen 2.968 N/A CYS 136.A N ILE 132.A O no hydrogen 2.859 N/A CYS 136.A SG ILE 132.A O no hydrogen 3.374 N/A LEU 137.A N ALA 133.A O no hydrogen 2.897 N/A TYR 138.A N SER 134.A O no hydrogen 2.966 N/A ILE 139.A N ALA 135.A O no hydrogen 2.921 N/A ALA 140.A N CYS 136.A O no hydrogen 2.861 N/A CYS 141.A N LEU 137.A O no hydrogen 2.927 N/A CYS 141.A SG LEU 137.A O no hydrogen 3.406 N/A ARG 142.A N TYR 138.A O no hydrogen 2.938 N/A ARG 142.A NH1 ASP 180.A O no hydrogen 3.106 N/A ARG 142.A NH2 TYR 138.A OH no hydrogen 2.560 N/A GLN 143.A N ILE 139.A O no hydrogen 2.862 N/A GLU 144.A N ALA 140.A O no hydrogen 3.243 N/A GLY 145.A N ARG 142.A O no hydrogen 3.478 N/A VAL 146.A N CYS 141.A O no hydrogen 3.345 N/A THR 149.A N GLU 152.A OE1 no hydrogen 3.025 N/A THR 149.A OG1 GLU 152.A OE1 no hydrogen 3.274 N/A LYS 151.A NZ GLY 252.A O no hydrogen 2.749 N/A GLU 152.A N THR 149.A O no hydrogen 2.955 N/A GLU 152.A N THR 149.A OG1 no hydrogen 3.161 N/A ILE 153.A N THR 149.A O no hydrogen 3.200 N/A CYS 154.A N PHE 150.A O no hydrogen 2.896 N/A CYS 154.A SG ILE 159.A O no hydrogen 3.539 N/A ALA 155.A N LYS 151.A O no hydrogen 3.042 N/A VAL 156.A N ILE 153.A O no hydrogen 3.351 N/A SER 157.A N CYS 154.A O no hydrogen 3.021 N/A SER 157.A OG SER 134.A OG no hydrogen 3.033 N/A ARG 158.A NE ASP 130.A OD2 no hydrogen 2.767 N/A ARG 158.A NH2 ASP 130.A OD2 no hydrogen 2.781 N/A ILE 159.A N SER 157.A OG no hydrogen 2.920 N/A ILE 164.A N SER 160.A O no hydrogen 2.973 N/A GLY 165.A N LYS 161.A O no hydrogen 2.940 N/A ARG 166.A N LYS 162.A O no hydrogen 3.063 N/A CYS 167.A N GLU 163.A O no hydrogen 2.998 N/A CYS 167.A SG GLU 163.A O no hydrogen 3.103 N/A PHE 168.A N ILE 164.A O no hydrogen 2.844 N/A LYS 169.A N GLY 165.A O no hydrogen 2.953 N/A LEU 170.A N ARG 166.A O no hydrogen 2.956 N/A ILE 171.A N CYS 167.A O no hydrogen 2.819 N/A LEU 172.A N PHE 168.A O no hydrogen 2.999 N/A LYS 173.A N LYS 169.A O no hydrogen 3.055 N/A ALA 174.A N LEU 170.A O no hydrogen 2.912 N/A LEU 175.A N ILE 171.A O no hydrogen 2.921 N/A GLU 176.A N LEU 172.A O no hydrogen 3.161 N/A THR 177.A OG1 SER 178.A O no hydrogen 3.378 N/A GLY 185.A N THR 183.A O no hydrogen 2.314 N/A GLY 185.A N THR 183.A OG1 no hydrogen 2.899 N/A ASP 186.A N THR 183.A O no hydrogen 3.090 N/A MET 188.A N GLY 185.A O no hydrogen 2.922 N/A ARG 190.A NH1 GLU 152.A OE2 no hydrogen 3.193 N/A ARG 190.A NH2 PRO 147.A O no hydrogen 2.834 N/A CYS 192.A N MET 188.A O no hydrogen 2.979 N/A CYS 192.A SG MET 188.A O no hydrogen 3.506 N/A SER 193.A N SER 189.A O no hydrogen 2.906 N/A SER 193.A OG SER 189.A O no hydrogen 3.126 N/A SER 193.A OG ARG 190.A O no hydrogen 3.132 N/A SER 193.A OG ASN 194.A OD1 no hydrogen 3.379 N/A ASN 194.A N ARG 190.A O no hydrogen 2.974 N/A LEU 195.A N CYS 192.A O no hydrogen 2.372 N/A CYS 196.A N SER 193.A O no hydrogen 2.754 N/A GLN 200.A N GLN 200.A OE1 no hydrogen 2.850 N/A GLN 202.A N PRO 198.A O no hydrogen 3.197 N/A MET 203.A N LYS 199.A O no hydrogen 3.030 N/A ALA 204.A N GLN 200.A O no hydrogen 2.916 N/A ALA 205.A N VAL 201.A O no hydrogen 2.875 N/A THR 206.A N GLN 202.A O no hydrogen 2.959 N/A THR 206.A OG1 GLN 202.A O no hydrogen 2.528 N/A HIS 207.A N MET 203.A O no hydrogen 2.939 N/A ILE 208.A N ALA 204.A O no hydrogen 2.892 N/A ALA 209.A N ALA 205.A O no hydrogen 2.950 N/A ARG 210.A N THR 206.A O no hydrogen 2.972 N/A LYS 211.A N HIS 207.A O no hydrogen 2.882 N/A LYS 211.A NZ HIS 207.A NE2 no hydrogen 3.329 N/A ALA 212.A N ILE 208.A O no hydrogen 2.903 N/A VAL 213.A N ALA 209.A O no hydrogen 2.972 N/A GLU 214.A N ARG 210.A O no hydrogen 2.886 N/A LEU 215.A N LYS 211.A O no hydrogen 3.186 N/A ASP 216.A N VAL 213.A O no hydrogen 3.200 N/A LEU 217.A N ALA 212.A O no hydrogen 3.252 N/A ARG 221.A NH1 GLN 260.A OE1 no hydrogen 2.828 N/A ARG 221.A NH2 GLN 260.A OE1 no hydrogen 3.054 N/A SER 222.A OG SER 225.A OG no hydrogen 2.987 N/A SER 225.A OG SER 222.A OG no hydrogen 2.987 N/A VAL 226.A N SER 222.A O no hydrogen 3.260 N/A ALA 227.A N PRO 223.A O no hydrogen 2.883 N/A ALA 228.A N ILE 224.A O no hydrogen 2.872 N/A ALA 229.A N SER 225.A O no hydrogen 2.973 N/A ALA 230.A N VAL 226.A O no hydrogen 2.917 N/A ILE 231.A N ALA 227.A O no hydrogen 2.922 N/A TYR 232.A N ALA 228.A O no hydrogen 2.906 N/A MET 233.A N ALA 229.A O no hydrogen 2.942 N/A ALA 234.A N ALA 230.A O no hydrogen 2.883 N/A SER 235.A N ILE 231.A O no hydrogen 2.907 N/A SER 235.A N TYR 232.A O no hydrogen 3.232 N/A SER 235.A OG GLU 240.A O no hydrogen 2.991 N/A GLN 236.A N TYR 232.A O no hydrogen 3.379 N/A SER 238.A N SER 235.A O no hydrogen 2.997 N/A ARG 242.A NE LEU 195.A O no hydrogen 2.706 N/A ARG 242.A NH1 GLU 240.A OE2 no hydrogen 2.583 N/A ARG 242.A NH1 LYS 241.A O no hydrogen 2.506 N/A ARG 242.A NH2 LEU 195.A O no hydrogen 2.923 N/A ARG 242.A NH2 GLU 240.A OE2 no hydrogen 2.731 N/A THR 243.A N GLU 246.A OE1 no hydrogen 3.105 N/A LYS 245.A NZ ASP 255.A OD2 no hydrogen 2.789 N/A GLY 248.A N GLN 244.A O no hydrogen 2.889 N/A ASP 249.A N LYS 245.A O no hydrogen 2.917 N/A ILE 250.A N GLU 246.A O no hydrogen 2.927 N/A ALA 251.A N ILE 247.A O no hydrogen 2.933 N/A GLY 252.A N GLY 248.A O no hydrogen 2.896 N/A THR 257.A N ALA 254.A O no hydrogen 3.218 N/A ILE 258.A N ALA 254.A O no hydrogen 3.195 N/A ARG 259.A N ASP 255.A O no hydrogen 2.941 N/A GLN 260.A N VAL 256.A O no hydrogen 3.187 N/A GLN 260.A NE2 VAL 256.A O no hydrogen 2.942 N/A SER 261.A N THR 257.A O no hydrogen 3.066 N/A SER 261.A OG THR 257.A O no hydrogen 2.855 N/A TYR 262.A N ILE 258.A O no hydrogen 2.862 N/A TYR 262.A OH PRO 287.A O no hydrogen 2.824 N/A ARG 263.A N ARG 259.A O no hydrogen 2.941 N/A ARG 263.A NH1 LEU 289.A O no hydrogen 2.814 N/A LEU 264.A N GLN 260.A O no hydrogen 3.017 N/A ILE 265.A N SER 261.A O no hydrogen 2.939 N/A ARG 268.A NE ASP 271.A OD2 no hydrogen 2.731 N/A ARG 268.A NH2 ASP 271.A OD2 no hydrogen 2.593 N/A LEU 272.A N ALA 269.A O no hydrogen 3.230 N/A THR 275.A OG1 ASP 276.A OD1 no hydrogen 3.567 N/A ASP 276.A N ASP 276.A OD1 no hydrogen 2.475 N/A LYS 278.A NZ ASP 280.A OD1 no hydrogen 3.328 N/A ASP 280.A N LYS 278.A O no hydrogen 2.937 N/A THR 281.A N ALA 237.A O no hydrogen 3.307 N/A THR 281.A OG1 GLN 236.A O no hydrogen 2.965 N/A LYS 285.A N PRO 282.A O no hydrogen 3.129 N/A