Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3sc1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 PRO 2.A O no hydrogen 3.462 N/A LYS 4.A NZ THR 76.A O no hydrogen 3.331 N/A LYS 5.A NZ GLU 29.A OE2 no hydrogen 2.833 N/A ARG 6.A N ASP 9.A OD2 no hydrogen 2.958 N/A ASP 9.A N ARG 6.A O no hydrogen 2.824 N/A PHE 10.A N PRO 7.A O no hydrogen 3.018 N/A LYS 11.A N ARG 28.A O no hydrogen 2.845 N/A GLY 13.A N LEU 26.A O no hydrogen 2.818 N/A LEU 16.A N VAL 24.A O no hydrogen 2.716 N/A GLY 17.A N VAL 24.A O no hydrogen 3.212 N/A GLY 19.A N SER 22.A O no hydrogen 2.751 N/A THR 23.A N ILE 40.A O no hydrogen 3.034 N/A VAL 24.A N GLY 17.A O no hydrogen 2.730 N/A VAL 25.A N ILE 38.A O no hydrogen 2.866 N/A LEU 26.A N LYS 14.A O no hydrogen 2.922 N/A ALA 27.A N TYR 36.A O no hydrogen 2.915 N/A ARG 28.A N LYS 11.A O no hydrogen 2.922 N/A GLU 29.A N ARG 34.A O no hydrogen 2.764 N/A LEU 30.A N ASP 9.A O no hydrogen 2.822 N/A THR 32.A OG1 GLU 29.A OE1 no hydrogen 2.579 N/A SER 33.A N GLU 29.A O no hydrogen 2.864 N/A ARG 34.A N THR 32.A OG1 no hydrogen 2.983 N/A TYR 36.A N ALA 27.A O no hydrogen 2.801 N/A ALA 37.A N LEU 87.A O no hydrogen 2.808 N/A ILE 38.A N VAL 25.A O no hydrogen 2.829 N/A LYS 39.A N PHE 85.A O no hydrogen 2.996 N/A LYS 39.A NZ GLU 58.A OE1 no hydrogen 3.216 N/A ILE 40.A N THR 23.A O no hydrogen 2.661 N/A LEU 41.A N LEU 83.A O no hydrogen 2.933 N/A LYS 43.A N GLU 81.A O no hydrogen 2.965 N/A LYS 43.A NZ ASP 79.A O no hydrogen 2.827 N/A LYS 43.A NZ ASP 80.A O no hydrogen 3.193 N/A ILE 46.A N GLU 42.A O no hydrogen 3.122 N/A ILE 47.A N LYS 43.A O no hydrogen 2.764 N/A LYS 48.A N ARG 44.A O no hydrogen 2.659 N/A GLU 49.A N HIS 45.A O no hydrogen 2.997 N/A ASN 50.A N ILE 47.A O no hydrogen 3.206 N/A LYS 51.A N ILE 46.A O no hydrogen 2.949 N/A TYR 54.A N LYS 51.A O no hydrogen 2.696 N/A VAL 55.A N LYS 51.A O no hydrogen 2.907 N/A THR 56.A N VAL 52.A O no hydrogen 2.965 N/A THR 56.A OG1 VAL 52.A O no hydrogen 2.942 N/A ARG 57.A N PRO 53.A O no hydrogen 3.167 N/A GLU 58.A N TYR 54.A O no hydrogen 2.899 N/A ARG 59.A N VAL 55.A O no hydrogen 3.061 N/A ASP 60.A N THR 56.A O no hydrogen 2.914 N/A VAL 61.A N ARG 57.A O no hydrogen 2.948 N/A MET 62.A N GLU 58.A O no hydrogen 3.062 N/A SER 63.A N ARG 59.A O no hydrogen 3.057 N/A SER 63.A N ASP 60.A O no hydrogen 3.273 N/A SER 63.A OG ASP 60.A O no hydrogen 2.775 N/A ARG 64.A N VAL 61.A O no hydrogen 3.105 N/A ARG 64.A NH2 LYS 127.A O no hydrogen 3.402 N/A ASP 66.A N TYR 123.A OH no hydrogen 2.992 N/A PHE 69.A N HIS 67.A ND1 no hydrogen 2.912 N/A PHE 70.A N HIS 67.A O no hydrogen 3.040 N/A VAL 71.A N ILE 149.A O no hydrogen 3.258 N/A LYS 72.A N SER 88.A OG no hydrogen 3.040 N/A TYR 74.A N GLY 86.A O no hydrogen 2.653 N/A PHE 77.A N TYR 84.A O no hydrogen 3.185 N/A ASP 79.A N LYS 82.A O no hydrogen 3.013 N/A LYS 82.A N ASP 79.A OD1 no hydrogen 2.436 N/A LEU 83.A N LEU 41.A O no hydrogen 2.697 N/A TYR 84.A N PHE 77.A O no hydrogen 2.967 N/A TYR 84.A OH ASP 79.A OD2 no hydrogen 2.722 N/A PHE 85.A N LYS 39.A O no hydrogen 2.986 N/A GLY 86.A N PHE 75.A O no hydrogen 2.732 N/A LEU 87.A N ALA 37.A O no hydrogen 2.837 N/A SER 88.A N LYS 72.A O no hydrogen 3.149 N/A ASN 92.A N LEU 141.A O no hydrogen 2.853 N/A GLY 93.A N ALA 90.A O no hydrogen 3.242 N/A LEU 95.A N ILE 139.A O no hydrogen 2.980 N/A LEU 96.A N PRO 136.A O no hydrogen 3.463 N/A LYS 97.A N GLU 94.A O no hydrogen 3.067 N/A LYS 97.A NZ ASN 92.A O no hydrogen 2.955 N/A LYS 97.A NZ TYR 98.A OH no hydrogen 3.512 N/A TYR 98.A N LEU 95.A O no hydrogen 2.940 N/A TYR 98.A OH ASN 92.A O no hydrogen 3.302 N/A ILE 99.A N LEU 95.A O no hydrogen 3.043 N/A ARG 100.A N LEU 96.A O no hydrogen 2.913 N/A LYS 101.A N LYS 97.A O no hydrogen 3.177 N/A ILE 102.A N TYR 98.A O no hydrogen 3.145 N/A SER 104.A OG VAL 195.A O no hydrogen 3.348 N/A PHE 105.A N LEU 194.A O no hydrogen 2.796 N/A CYS 109.A N ASP 106.A OD1 no hydrogen 3.075 N/A CYS 109.A SG ASP 106.A OD1 no hydrogen 3.271 N/A CYS 109.A SG LYS 276.A O no hydrogen 3.554 N/A CYS 109.A SG THR 278.A O no hydrogen 3.512 N/A THR 110.A N ASP 106.A O no hydrogen 3.168 N/A THR 110.A OG1 ASP 106.A O no hydrogen 3.027 N/A ARG 111.A N GLU 107.A O no hydrogen 3.010 N/A PHE 112.A N THR 108.A O no hydrogen 2.847 N/A TYR 113.A N CYS 109.A O no hydrogen 2.915 N/A TYR 113.A OH MET 145.A O no hydrogen 2.453 N/A THR 114.A N THR 110.A O no hydrogen 2.760 N/A THR 114.A OG1 THR 110.A O no hydrogen 2.645 N/A ALA 115.A N ARG 111.A O no hydrogen 2.994 N/A GLU 116.A N PHE 112.A O no hydrogen 3.088 N/A ILE 117.A N TYR 113.A O no hydrogen 3.132 N/A VAL 118.A N THR 114.A O no hydrogen 2.882 N/A SER 119.A N ALA 115.A O no hydrogen 2.840 N/A ALA 120.A N GLU 116.A O no hydrogen 2.776 N/A LEU 121.A N ILE 117.A O no hydrogen 2.868 N/A GLU 122.A N VAL 118.A O no hydrogen 2.829 N/A TYR 123.A N SER 119.A O no hydrogen 3.334 N/A LEU 124.A N ALA 120.A O no hydrogen 2.924 N/A HIS 125.A N LEU 121.A O no hydrogen 2.816 N/A HIS 125.A NE2 ASP 183.A OD2 no hydrogen 2.870 N/A GLY 126.A N GLU 122.A O no hydrogen 2.925 N/A LYS 127.A N TYR 123.A O no hydrogen 3.319 N/A LYS 127.A N LEU 124.A O no hydrogen 2.810 N/A LYS 127.A NZ ARG 64.A O no hydrogen 3.261 N/A GLY 128.A N HIS 125.A O no hydrogen 2.822 N/A ILE 130.A N LYS 156.A O no hydrogen 2.870 N/A HIS 131.A N ASP 183.A OD2 no hydrogen 2.887 N/A HIS 131.A NE2 THR 150.A O no hydrogen 3.084 N/A ARG 132.A N ASP 183.A OD1 no hydrogen 2.984 N/A ARG 132.A NE THR 154.A O no hydrogen 2.786 N/A ARG 132.A NH2 THR 154.A O no hydrogen 2.969 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 3.105 N/A LYS 135.A NZ THR 164.A OG1 no hydrogen 2.739 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.407 N/A ASN 138.A N LYS 135.A O no hydrogen 2.716 N/A LEU 140.A N GLN 148.A O no hydrogen 2.817 N/A LEU 141.A N GLY 93.A O no hydrogen 2.716 N/A ASN 142.A N HIS 146.A O no hydrogen 2.926 N/A MET 145.A N ASN 142.A O no hydrogen 2.647 N/A HIS 146.A N ASN 142.A OD1 no hydrogen 3.123 N/A HIS 146.A ND1 GLU 116.A OE2 no hydrogen 2.647 N/A ILE 147.A N GLU 116.A OE1 no hydrogen 3.380 N/A GLN 148.A N LEU 140.A O no hydrogen 2.564 N/A ILE 149.A N PHE 69.A O no hydrogen 3.026 N/A THR 150.A N ASN 138.A O no hydrogen 2.945 N/A THR 154.A OG1 HIS 131.A O no hydrogen 3.450 N/A ALA 155.A N PHE 152.A O no hydrogen 3.053 N/A LYS 156.A N ILE 130.A O no hydrogen 2.851 N/A LEU 158.A N GLY 128.A O no hydrogen 2.924 N/A THR 164.A OG1 ASP 133.A OD1 no hydrogen 2.888 N/A TYR 167.A N THR 164.A O no hydrogen 2.958 N/A TYR 167.A OH GLN 193.A OE1 no hydrogen 2.616 N/A VAL 168.A N ALA 165.A O no hydrogen 3.268 N/A GLU 171.A N GLU 171.A OE1 no hydrogen 2.999 N/A LEU 172.A N SER 169.A O no hydrogen 3.167 N/A THR 174.A N GLU 171.A O no hydrogen 3.289 N/A THR 174.A OG1 PRO 170.A O no hydrogen 3.352 N/A GLU 175.A N GLU 171.A O no hydrogen 2.861 N/A LYS 176.A NZ ASN 160.A O no hydrogen 3.099 N/A CYS 179.A N SER 182.A OG no hydrogen 3.009 N/A LYS 180.A NZ HIS 125.A O no hydrogen 3.267 N/A LYS 180.A NZ GLU 247.A OE2 no hydrogen 3.507 N/A SER 181.A OG ALA 240.A O no hydrogen 2.887 N/A SER 182.A N CYS 179.A O no hydrogen 2.678 N/A SER 182.A OG GLU 171.A OE2 no hydrogen 2.728 N/A SER 182.A OG CYS 179.A O no hydrogen 3.135 N/A ASP 183.A N LYS 180.A O no hydrogen 3.140 N/A TRP 185.A N SER 181.A O no hydrogen 2.849 N/A ALA 186.A N SER 182.A O no hydrogen 3.087 N/A LEU 187.A N ASP 183.A O no hydrogen 2.873 N/A GLY 188.A N LEU 184.A O no hydrogen 2.948 N/A CYS 189.A N TRP 185.A O no hydrogen 3.013 N/A CYS 189.A SG GLN 166.A O no hydrogen 3.952 N/A CYS 189.A SG TRP 185.A O no hydrogen 3.596 N/A ILE 190.A N ALA 186.A O no hydrogen 2.840 N/A ILE 191.A N LEU 187.A O no hydrogen 2.837 N/A TYR 192.A N GLY 188.A O no hydrogen 3.292 N/A TYR 192.A OH ASP 219.A O no hydrogen 2.711 N/A GLN 193.A N CYS 189.A O no hydrogen 3.004 N/A LEU 194.A N ILE 190.A O no hydrogen 2.803 N/A LEU 194.A N ILE 191.A O no hydrogen 2.971 N/A VAL 195.A N ILE 191.A O no hydrogen 3.179 N/A VAL 195.A N TYR 192.A O no hydrogen 3.182 N/A ALA 196.A N TYR 192.A O no hydrogen 2.698 N/A ARG 202.A NH1 PRO 199.A O no hydrogen 2.461 N/A LEU 208.A N ASN 205.A OD1 no hydrogen 2.705 N/A ILE 209.A N ASN 205.A O no hydrogen 3.025 N/A PHE 210.A N GLU 206.A O no hydrogen 2.843 N/A GLN 211.A N TYR 207.A O no hydrogen 3.011 N/A LYS 212.A N LEU 208.A O no hydrogen 3.251 N/A LYS 212.A NZ ARG 202.A O no hydrogen 3.351 N/A ILE 213.A N ILE 209.A O no hydrogen 3.080 N/A ILE 214.A N PHE 210.A O no hydrogen 3.105 N/A LYS 215.A N GLN 211.A O no hydrogen 3.168 N/A LYS 215.A N LYS 212.A O no hydrogen 3.164 N/A LEU 216.A N ILE 213.A O no hydrogen 2.952 N/A GLU 217.A N LYS 212.A O no hydrogen 2.697 N/A PHE 224.A N PRO 221.A O no hydrogen 2.909 N/A ARG 229.A N PHE 225.A O no hydrogen 2.818 N/A ARG 229.A NE GLU 233.A OE2 no hydrogen 2.904 N/A ARG 229.A NH2 GLU 233.A OE2 no hydrogen 3.319 N/A ASP 230.A N PRO 226.A O no hydrogen 2.820 N/A LEU 231.A N LYS 227.A O no hydrogen 3.227 N/A VAL 232.A N ALA 228.A O no hydrogen 2.869 N/A GLU 233.A N ARG 229.A O no hydrogen 2.990 N/A LYS 234.A N LEU 231.A O no hydrogen 2.898 N/A LYS 234.A NZ ASP 230.A OD1 no hydrogen 2.836 N/A LYS 234.A NZ ASP 230.A OD2 no hydrogen 3.365 N/A LEU 235.A N VAL 232.A O no hydrogen 3.110 N/A LEU 236.A N VAL 232.A O no hydrogen 2.930 N/A THR 241.A N ASP 239.A OD1 no hydrogen 2.802 N/A THR 241.A OG1 ASP 239.A OD1 no hydrogen 2.659 N/A THR 241.A OG1 ASP 239.A OD2 no hydrogen 3.154 N/A LYS 242.A N ASP 239.A O no hydrogen 3.069 N/A ARG 243.A NE VAL 237.A O no hydrogen 2.998 N/A ARG 243.A NH1 GLU 171.A OE1 no hydrogen 3.291 N/A ARG 243.A NH1 GLU 171.A OE2 no hydrogen 3.014 N/A ARG 243.A NH1 SER 181.A O no hydrogen 2.854 N/A ARG 243.A NH2 GLU 171.A OE1 no hydrogen 2.474 N/A ARG 243.A NH2 VAL 237.A O no hydrogen 3.426 N/A LEU 244.A N LYS 234.A O no hydrogen 2.881 N/A CYS 246.A N ARG 243.A O no hydrogen 3.082 N/A CYS 246.A SG ALA 240.A O no hydrogen 3.490 N/A CYS 246.A SG ARG 243.A O no hydrogen 3.109 N/A CYS 246.A SG GLU 248.A OE1 no hydrogen 3.291 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.577 N/A MET 249.A N CYS 246.A O no hydrogen 2.931 N/A GLU 250.A N GLU 247.A O no hydrogen 2.956 N/A GLY 251.A N CYS 246.A O no hydrogen 2.908 N/A TYR 252.A OH HIS 125.A ND1 no hydrogen 2.577 N/A LYS 256.A N TYR 252.A O no hydrogen 2.872 N/A LYS 256.A NZ GLU 122.A OE1 no hydrogen 2.950 N/A LYS 256.A NZ GLU 122.A OE2 no hydrogen 3.234 N/A ALA 257.A N GLY 253.A O no hydrogen 2.968 N/A ALA 257.A N PRO 254.A O no hydrogen 3.209 N/A HIS 258.A N LEU 255.A O no hydrogen 3.280 N/A HIS 258.A NE2 ASP 230.A OD1 no hydrogen 2.801 N/A PHE 260.A N HIS 258.A ND1 no hydrogen 3.088 N/A PHE 261.A N HIS 258.A O no hydrogen 2.815 N/A GLU 262.A N PRO 259.A O no hydrogen 3.062 N/A VAL 264.A N PHE 261.A O no hydrogen 2.846 N/A GLN 271.A N ASN 268.A O no hydrogen 2.796 N/A GLN 272.A N LEU 269.A O no hydrogen 3.297 N/A