Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g3c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N PRO 1.A O no hydrogen 3.065 N/A LEU 6.A N VAL 2.A O no hydrogen 3.055 N/A VAL 7.A N GLU 3.A O no hydrogen 3.195 N/A HIS 8.A N TYR 5.A O no hydrogen 3.343 N/A HIS 8.A ND1 GLU 4.A O no hydrogen 3.189 N/A LEU 10.A N VAL 7.A O no hydrogen 3.005 N/A GLN 11.A N VAL 7.A O no hydrogen 3.033 N/A GLY 12.A N GLU 33.A OE1 no hydrogen 2.791 N/A SER 13.A N LEU 10.A O no hydrogen 3.279 N/A VAL 14.A N TYR 46.A O no hydrogen 2.910 N/A SER 15.A N GLY 34.A O no hydrogen 3.074 N/A GLY 17.A N LEU 36.A O no hydrogen 3.037 N/A SER 21.A N GLN 18.A O no hydrogen 3.212 N/A SER 21.A OG HIS 20.A NE2 no hydrogen 3.012 N/A LEU 22.A N GLN 18.A O no hydrogen 3.351 N/A ALA 23.A N ALA 19.A O no hydrogen 3.082 N/A SER 24.A N HIS 20.A O no hydrogen 3.112 N/A SER 24.A OG GLU 3.A OE1 no hydrogen 3.259 N/A SER 24.A OG HIS 20.A O no hydrogen 3.403 N/A LEU 25.A N SER 21.A O no hydrogen 3.123 N/A ALA 26.A N LEU 22.A O no hydrogen 2.875 N/A LYS 27.A N ALA 23.A O no hydrogen 3.277 N/A THR 28.A N LEU 25.A O no hydrogen 2.839 N/A THR 28.A OG1 LEU 25.A O no hydrogen 2.671 N/A TRP 29.A N ALA 26.A O no hydrogen 2.950 N/A TRP 29.A NE1 GLU 33.A OE2 no hydrogen 2.758 N/A ASN 32.A ND2 TYR 48.A O no hydrogen 3.290 N/A ASN 32.A ND2 ARG 115.A O no hydrogen 3.075 N/A GLU 33.A N ARG 115.A O no hydrogen 3.176 N/A GLY 34.A N SER 13.A O no hydrogen 2.955 N/A VAL 35.A N ALA 113.A O no hydrogen 3.072 N/A LEU 36.A N SER 15.A O no hydrogen 2.857 N/A LEU 37.A N TYR 111.A O no hydrogen 2.720 N/A LYS 40.A N THR 38.A OG1 no hydrogen 3.308 N/A LEU 41.A N THR 38.A O no hydrogen 3.120 N/A LYS 42.A N ASP 74.A OD2 no hydrogen 3.135 N/A VAL 44.A N GLU 47.A O no hydrogen 2.815 N/A GLU 47.A N VAL 44.A O no hydrogen 3.000 N/A TYR 48.A N ASN 32.A OD1 no hydrogen 2.953 N/A TYR 48.A OH ASP 74.A OD2 no hydrogen 2.709 N/A ARG 49.A NE GLU 116.A OE1 no hydrogen 3.073 N/A ARG 49.A NH1 GLU 47.A OE1 no hydrogen 3.310 N/A ARG 49.A NH2 ASP 31.A OD2 no hydrogen 3.460 N/A GLU 50.A N GLU 116.A OE2 no hydrogen 2.951 N/A GLU 51.A N TRP 54.A O no hydrogen 2.632 N/A VAL 52.A N ARG 49.A O no hydrogen 3.073 N/A HIS 53.A N ARG 49.A O no hydrogen 2.825 N/A MET 55.A N LYS 73.A O no hydrogen 3.074 N/A THR 56.A N GLU 51.A OE2 no hydrogen 3.379 N/A HIS 57.A N ARG 71.A O no hydrogen 3.031 N/A ARG 60.A NH1 HIS 70.A NE2 no hydrogen 3.216 N/A ARG 60.A NH2 GLU 50.A OE2 no hydrogen 2.386 N/A ARG 63.A N VAL 69.A O no hydrogen 2.907 N/A PHE 66.A N GLU 68.A OE1 no hydrogen 2.939 N/A GLY 67.A N GLY 64.A O no hydrogen 3.149 N/A GLU 68.A N GLU 68.A OE1 no hydrogen 2.663 N/A VAL 69.A N ARG 63.A O no hydrogen 3.237 N/A HIS 70.A N VAL 83.A O no hydrogen 2.870 N/A HIS 70.A ND1 VAL 61.A O no hydrogen 3.367 N/A ARG 71.A NH2 GLN 80.A OE1 no hydrogen 2.790 N/A MET 72.A N CYS 81.A O no hydrogen 2.830 N/A LYS 73.A N MET 55.A O no hydrogen 2.971 N/A ASP 74.A N PHE 79.A O no hydrogen 2.853 N/A LYS 75.A N HIS 53.A O no hydrogen 3.076 N/A LYS 75.A NZ GLU 51.A O no hydrogen 3.002 N/A GLN 76.A N ASP 74.A OD1 no hydrogen 2.831 N/A GLN 76.A NE2 HIS 53.A O no hydrogen 2.947 N/A THR 77.A N ASP 74.A OD1 no hydrogen 2.934 N/A THR 77.A OG1 LYS 40.A O no hydrogen 2.635 N/A GLY 78.A N ASP 74.A O no hydrogen 2.778 N/A PHE 79.A N THR 77.A OG1 no hydrogen 3.216 N/A CYS 81.A N MET 72.A O no hydrogen 2.930 N/A CYS 81.A SG ALA 82.A O no hydrogen 3.630 N/A ALA 82.A N MET 124.A O no hydrogen 2.961 N/A VAL 83.A N HIS 70.A O no hydrogen 2.937 N/A LYS 84.A N ILE 122.A O no hydrogen 2.683 N/A LYS 84.A NZ GLU 95.A OE2 no hydrogen 2.523 N/A LYS 84.A NZ ASP 189.A OD1 no hydrogen 3.089 N/A LYS 84.A NZ ASP 189.A OD2 no hydrogen 3.363 N/A LYS 85.A N GLU 68.A O no hydrogen 2.837 N/A LYS 85.A NZ GLU 50.A OE1 no hydrogen 2.708 N/A LYS 85.A NZ ASN 121.A OD1 no hydrogen 2.848 N/A VAL 86.A N VAL 120.A O no hydrogen 2.886 N/A LEU 88.A N PRO 118.A O no hydrogen 2.906 N/A VAL 90.A N ARG 87.A O no hydrogen 2.974 N/A PHE 91.A N LEU 88.A O no hydrogen 3.022 N/A ARG 92.A NH1 GLY 191.A O no hydrogen 2.765 N/A ARG 92.A NH1 ALA 193.A O no hydrogen 2.969 N/A ARG 92.A NH2 ALA 193.A O no hydrogen 2.931 N/A GLU 94.A N GLU 94.A OE1 no hydrogen 2.724 N/A GLU 95.A N ARG 92.A O no hydrogen 2.901 N/A LEU 96.A N VAL 93.A O no hydrogen 3.105 N/A VAL 97.A N VAL 93.A O no hydrogen 2.936 N/A ALA 98.A N GLU 94.A O no hydrogen 2.955 N/A CYS 99.A N LEU 96.A O no hydrogen 3.284 N/A CYS 99.A SG GLU 95.A O no hydrogen 3.161 N/A CYS 99.A SG LEU 96.A O no hydrogen 3.959 N/A ALA 100.A N LEU 96.A O no hydrogen 2.768 N/A LEU 102.A N CYS 99.A O no hydrogen 3.178 N/A SER 103.A N TYR 160.A OH no hydrogen 2.838 N/A ARG 106.A N SER 104.A OG no hydrogen 3.013 N/A ARG 106.A NE GLU 156.A OE1 no hydrogen 2.790 N/A ARG 106.A NH2 GLU 156.A OE1 no hydrogen 3.155 N/A ILE 107.A N SER 104.A O no hydrogen 3.129 N/A VAL 108.A N LEU 187.A O no hydrogen 2.806 N/A TYR 111.A N PHE 123.A O no hydrogen 2.737 N/A ALA 113.A N VAL 35.A O no hydrogen 3.004 N/A VAL 114.A N ASN 121.A O no hydrogen 2.854 N/A ARG 115.A N GLU 33.A O no hydrogen 2.722 N/A ARG 115.A NE GLU 33.A OE2 no hydrogen 3.267 N/A GLU 116.A N TRP 119.A O no hydrogen 2.850 N/A GLY 117.A N ASP 31.A O no hydrogen 3.236 N/A TRP 119.A N GLU 116.A O no hydrogen 3.094 N/A VAL 120.A N VAL 86.A O no hydrogen 2.747 N/A ASN 121.A N VAL 114.A O no hydrogen 2.786 N/A ASN 121.A ND2 VAL 114.A O no hydrogen 3.658 N/A ILE 122.A N LYS 84.A O no hydrogen 2.853 N/A PHE 123.A N GLY 112.A O no hydrogen 2.839 N/A MET 124.A N ALA 82.A O no hydrogen 2.972 N/A GLU 125.A N PRO 109.A O no hydrogen 3.199 N/A GLY 130.A N LEU 127.A O no hydrogen 3.129 N/A SER 131.A N GLN 134.A OE1 no hydrogen 2.863 N/A LEU 132.A N VAL 176.A O no hydrogen 2.722 N/A GLY 133.A N ALA 173.A O no hydrogen 3.090 N/A GLN 134.A N SER 131.A OG no hydrogen 2.860 N/A LEU 135.A N SER 131.A O no hydrogen 3.023 N/A ILE 136.A N LEU 132.A O no hydrogen 3.040 N/A LYS 137.A N GLY 133.A O no hydrogen 3.268 N/A GLN 138.A N GLN 134.A O no hydrogen 2.860 N/A MET 139.A N LEU 135.A O no hydrogen 2.842 N/A CYS 141.A SG LYS 312.A O no hydrogen 3.769 N/A CYS 141.A SG GLU 313.A O no hydrogen 3.715 N/A LEU 142.A N MET 231.A O no hydrogen 2.801 N/A ARG 146.A N ASP 145.A OD1 no hydrogen 2.859 N/A ARG 146.A NH1 TYR 150.A OH no hydrogen 2.904 N/A ARG 146.A NH2 SER 305.A O no hydrogen 3.102 N/A ALA 147.A N PRO 143.A O no hydrogen 3.044 N/A LEU 148.A N GLU 144.A O no hydrogen 2.947 N/A TYR 149.A N ASP 145.A O no hydrogen 2.935 N/A TYR 149.A OH SER 183.A O no hydrogen 2.473 N/A TYR 150.A N ARG 146.A O no hydrogen 3.009 N/A TYR 150.A OH GLY 182.A O no hydrogen 2.595 N/A LEU 151.A N ALA 147.A O no hydrogen 2.921 N/A GLY 152.A N LEU 148.A O no hydrogen 2.876 N/A GLN 153.A N TYR 149.A O no hydrogen 3.239 N/A GLN 153.A NE2 SER 183.A O no hydrogen 3.051 N/A ALA 154.A N TYR 150.A O no hydrogen 2.921 N/A LEU 155.A N LEU 151.A O no hydrogen 2.857 N/A GLU 156.A N GLY 152.A O no hydrogen 2.897 N/A GLY 157.A N GLN 153.A O no hydrogen 3.051 N/A LEU 158.A N ALA 154.A O no hydrogen 2.876 N/A GLU 159.A N LEU 155.A O no hydrogen 2.795 N/A TYR 160.A N GLU 156.A O no hydrogen 3.212 N/A LEU 161.A N GLY 157.A O no hydrogen 3.005 N/A HIS 162.A N LEU 158.A O no hydrogen 2.739 N/A HIS 162.A NE2 ASP 220.A OD2 no hydrogen 2.828 N/A THR 163.A N GLU 159.A O no hydrogen 3.010 N/A THR 163.A OG1 GLU 159.A O no hydrogen 2.838 N/A ARG 164.A NH1 TYR 160.A O no hydrogen 2.945 N/A ARG 165.A N HIS 162.A O no hydrogen 2.830 N/A ARG 165.A NE LEU 196.A O no hydrogen 3.491 N/A ILE 166.A N LEU 161.A O no hydrogen 2.850 N/A LEU 167.A N LEU 194.A O no hydrogen 2.835 N/A HIS 168.A N ASP 220.A OD2 no hydrogen 2.850 N/A HIS 168.A NE2 CYS 188.A O no hydrogen 2.905 N/A GLY 169.A N ASP 220.A OD1 no hydrogen 2.916 N/A ASP 170.A N HIS 168.A ND1 no hydrogen 3.074 N/A LYS 172.A NZ SER 65.A OG no hydrogen 3.269 N/A LYS 172.A NZ THR 201.A OG1 no hydrogen 3.164 N/A ASN 175.A N LYS 172.A O no hydrogen 2.838 N/A ASN 175.A ND2 ASP 170.A O no hydrogen 2.738 N/A VAL 176.A N ALA 173.A O no hydrogen 3.015 N/A LEU 177.A N ALA 186.A O no hydrogen 2.833 N/A LEU 178.A N GLY 130.A O no hydrogen 2.848 N/A SER 179.A N ARG 184.A O no hydrogen 2.951 N/A SER 179.A OG ASP 181.A OD1 no hydrogen 2.870 N/A GLY 182.A N SER 179.A O no hydrogen 2.929 N/A SER 183.A N ASP 181.A OD1 no hydrogen 3.065 N/A SER 183.A OG ASP 181.A OD1 no hydrogen 2.720 N/A SER 183.A OG ASP 181.A OD2 no hydrogen 3.298 N/A ARG 184.A N SER 179.A OG no hydrogen 3.159 N/A ALA 185.A N GLN 153.A OE1 no hydrogen 2.683 N/A ALA 186.A N LEU 177.A O no hydrogen 2.923 N/A LEU 187.A N ARG 106.A O no hydrogen 2.779 N/A CYS 188.A N ASN 175.A O no hydrogen 2.922 N/A GLY 191.A N ASP 189.A OD1 no hydrogen 2.982 N/A HIS 192.A ND1 ILE 198.A O no hydrogen 3.112 N/A ALA 193.A N PHE 190.A O no hydrogen 2.988 N/A LEU 194.A N LEU 167.A O no hydrogen 2.951 N/A LEU 196.A N ARG 165.A O no hydrogen 2.877 N/A THR 201.A N ASP 170.A OD1 no hydrogen 2.914 N/A THR 201.A OG1 ASP 170.A OD1 no hydrogen 2.957 N/A THR 203.A OG1 HIS 204.A ND1 no hydrogen 2.804 N/A THR 203.A OG1 HIS 236.A ND1 no hydrogen 2.697 N/A HIS 204.A N THR 201.A O no hydrogen 2.924 N/A HIS 204.A ND1 THR 203.A OG1 no hydrogen 2.804 N/A MET 205.A N GLU 202.A O no hydrogen 2.994 N/A GLU 208.A N GLU 208.A OE1 no hydrogen 2.767 N/A VAL 209.A N ALA 206.A O no hydrogen 3.032 N/A VAL 210.A N ALA 206.A O no hydrogen 3.319 N/A MET 211.A N PRO 207.A O no hydrogen 2.887 N/A GLY 212.A N VAL 209.A O no hydrogen 3.050 N/A LYS 213.A N GLU 208.A O no hydrogen 2.881 N/A CYS 215.A SG LYS 213.A O no hydrogen 3.405 N/A LYS 218.A N ASP 216.A OD1 no hydrogen 3.003 N/A LYS 218.A NZ PRO 280.A O no hydrogen 2.856 N/A LYS 218.A NZ ARG 283.A O no hydrogen 2.844 N/A VAL 219.A N ASP 216.A O no hydrogen 3.113 N/A ASP 220.A N ALA 217.A O no hydrogen 3.004 N/A ILE 221.A N LYS 218.A O no hydrogen 3.113 N/A TRP 222.A N LYS 218.A O no hydrogen 3.246 N/A SER 223.A N VAL 219.A O no hydrogen 3.152 N/A SER 223.A OG.A HIS 204.A O no hydrogen 2.882 N/A SER 223.A OG.A VAL 219.A O no hydrogen 2.848 N/A SER 223.A OG.B VAL 171.A O no hydrogen 2.466 N/A SER 223.A OG.B HIS 204.A O no hydrogen 3.550 N/A SER 224.A N ASP 220.A O no hydrogen 2.853 N/A SER 224.A OG ILE 221.A O no hydrogen 2.721 N/A CYS 225.A N ILE 221.A O no hydrogen 3.095 N/A CYS 225.A SG ILE 221.A O no hydrogen 3.702 N/A CYS 225.A SG ILE 272.A O no hydrogen 3.994 N/A CYS 226.A N TRP 222.A O no hydrogen 2.971 N/A CYS 226.A SG THR 203.A O no hydrogen 3.639 N/A CYS 226.A SG TRP 222.A O no hydrogen 3.663 N/A MET 227.A N SER 223.A O no hydrogen 2.892 N/A MET 228.A N SER 224.A O no hydrogen 2.952 N/A LEU 229.A N CYS 225.A O no hydrogen 3.132 N/A HIS 230.A N CYS 226.A O no hydrogen 3.009 N/A MET 231.A N MET 227.A O no hydrogen 2.882 N/A LEU 232.A N MET 228.A O no hydrogen 3.018 N/A ASN 233.A N LEU 229.A O no hydrogen 2.897 N/A ASN 233.A ND2 GLU 259.A O no hydrogen 2.911 N/A GLY 234.A N HIS 230.A O no hydrogen 2.847 N/A CYS 235.A SG HIS 236.A O no hydrogen 3.904 N/A CYS 235.A SG GLN 240.A OE1 no hydrogen 3.751 N/A HIS 236.A ND1 THR 203.A OG1 no hydrogen 2.697 N/A TRP 238.A N GLU 259.A OE2 no hydrogen 2.926 N/A THR 239.A OG1 HIS 236.A O no hydrogen 3.184 N/A ILE 250.A N LEU 246.A O no hydrogen 3.195 N/A ALA 251.A N CYS 247.A O no hydrogen 3.304 N/A SER 252.A N LEU 248.A O no hydrogen 2.953 N/A SER 252.A OG LEU 248.A O no hydrogen 3.028 N/A GLU 253.A N LYS 249.A O no hydrogen 2.922 N/A ILE 257.A N PRO 255.A O no hydrogen 2.695 N/A GLU 259.A N PRO 256.A O no hydrogen 3.057 N/A ILE 260.A N ILE 257.A O no hydrogen 3.122 N/A CYS 264.A N PRO 261.A O no hydrogen 3.181 N/A ALA 265.A N GLU 144.A OE1 no hydrogen 2.771 N/A THR 268.A OG1 GLU 144.A OE1 no hydrogen 2.621 N/A ALA 269.A N ALA 265.A O no hydrogen 3.112 N/A GLN 270.A N PRO 266.A O no hydrogen 2.824 N/A GLN 270.A NE2 GLU 274.A OE2 no hydrogen 3.137 N/A ALA 271.A N LEU 267.A O no hydrogen 2.889 N/A ILE 272.A N THR 268.A O no hydrogen 3.125 N/A GLN 273.A N ALA 269.A O no hydrogen 3.033 N/A GLU 274.A N GLN 270.A O no hydrogen 3.035 N/A GLY 275.A N ALA 271.A O no hydrogen 3.098 N/A LEU 276.A N GLN 273.A O no hydrogen 3.233 N/A LYS 278.A NZ ILE 250.A O no hydrogen 3.387 N/A LYS 278.A NZ ALA 251.A O no hydrogen 2.769 N/A LYS 278.A NZ GLU 253.A O no hydrogen 2.562 N/A HIS 282.A N GLU 279.A O no hydrogen 2.875 N/A ARG 283.A N GLU 279.A O no hydrogen 3.162 N/A ARG 283.A N PRO 280.A O no hydrogen 2.939 N/A ARG 283.A NE ARG 277.A O no hydrogen 2.822 N/A ARG 283.A NH1 GLU 208.A OE1 no hydrogen 3.555 N/A ARG 283.A NH1 GLU 208.A OE2 no hydrogen 2.636 N/A ARG 283.A NH1 LYS 218.A O no hydrogen 3.011 N/A ARG 283.A NH2 GLU 208.A OE1 no hydrogen 2.892 N/A ARG 283.A NH2 GLU 208.A OE2 no hydrogen 3.515 N/A ARG 283.A NH2 ARG 277.A O no hydrogen 2.899 N/A ALA 284.A N GLU 274.A O no hydrogen 2.989 N/A SER 285.A N GLU 288.A OE1 no hydrogen 3.205 N/A GLU 288.A N SER 285.A OG no hydrogen 3.301 N/A LEU 289.A N SER 285.A O no hydrogen 2.998 N/A ARG 290.A N ALA 286.A O no hydrogen 2.877 N/A ARG 290.A NE GLU 159.A OE1 no hydrogen 2.704 N/A ARG 290.A NE GLU 159.A OE2 no hydrogen 3.380 N/A ARG 290.A NH2 GLU 159.A OE2 no hydrogen 2.781 N/A ARG 291.A N MET 287.A O no hydrogen 3.068 N/A LYS 292.A N GLU 288.A O no hydrogen 3.094 N/A LYS 292.A NZ GLU 274.A OE1 no hydrogen 2.706 N/A LYS 292.A NZ GLU 274.A OE2 no hydrogen 2.795 N/A VAL 293.A N LEU 289.A O no hydrogen 2.780 N/A GLY 294.A N ARG 290.A O no hydrogen 2.953 N/A LYS 295.A N ARG 291.A O no hydrogen 3.021 N/A LYS 295.A NZ GLU 299.A OE2 no hydrogen 2.890 N/A ALA 296.A N LYS 292.A O no hydrogen 2.840 N/A LEU 297.A N VAL 293.A O no hydrogen 2.964 N/A GLN 298.A N GLY 294.A O no hydrogen 3.176 N/A GLU 299.A N LYS 295.A O no hydrogen 2.869 N/A VAL 300.A N ALA 296.A O no hydrogen 3.240 N/A VAL 300.A N LEU 297.A O no hydrogen 3.257 N/A GLY 301.A N GLN 298.A O no hydrogen 2.981 N/A GLY 302.A N LEU 297.A O no hydrogen 2.913 N/A LYS 304.A N ASP 145.A OD2 no hydrogen 2.810 N/A SER 305.A N ASP 145.A OD2 no hydrogen 2.780 N/A SER 305.A OG ASP 145.A OD1 no hydrogen 2.655 N/A SER 305.A OG ASP 145.A OD2 no hydrogen 2.875 N/A LYS 312.A N MET 139.A O no hydrogen 2.940 N/A ARG 315.A N ASN 233.A O no hydrogen 2.989 N/A ARG 315.A NH2 GLN 240.A OE1 no hydrogen 2.823 N/A ARG 315.A NH2 GLU 259.A OE1 no hydrogen 3.111 N/A