Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xdl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A OG1 LYS 1.A O no hydrogen 2.924 N/A VAL 6.A N TRP 2.A O no hydrogen 3.029 N/A ALA 7.A N LYS 3.A O no hydrogen 3.246 N/A ILE 8.A N THR 4.A O no hydrogen 2.813 N/A PHE 9.A N VAL 5.A O no hydrogen 2.901 N/A VAL 10.A N VAL 6.A O no hydrogen 2.959 N/A VAL 11.A N ALA 7.A O no hydrogen 3.140 N/A VAL 12.A N ILE 8.A O no hydrogen 2.909 N/A VAL 13.A N PHE 9.A O no hydrogen 2.947 N/A VAL 14.A N VAL 10.A O no hydrogen 2.852 N/A TYR 15.A N VAL 11.A O no hydrogen 2.833 N/A LEU 16.A N VAL 12.A O no hydrogen 2.908 N/A VAL 17.A N VAL 13.A O no hydrogen 3.033 N/A THR 18.A N VAL 14.A O no hydrogen 2.807 N/A THR 18.A OG1 VAL 14.A O no hydrogen 2.727 N/A GLY 19.A N TYR 15.A O no hydrogen 2.841 N/A GLY 20.A N LEU 16.A O no hydrogen 2.790 N/A LEU 21.A N VAL 17.A O no hydrogen 3.049 N/A VAL 22.A N THR 18.A O no hydrogen 3.045 N/A PHE 23.A N GLY 19.A O no hydrogen 2.838 N/A ARG 24.A N GLY 20.A O no hydrogen 2.979 N/A ALA 25.A N LEU 21.A O no hydrogen 3.135 N/A LEU 26.A N VAL 22.A O no hydrogen 3.027 N/A GLU 27.A N PHE 23.A O no hydrogen 2.789 N/A GLN 28.A N ARG 24.A O no hydrogen 2.834 N/A GLU 31.A N GLU 27.A O no hydrogen 2.943 N/A SER 32.A N GLN 28.A O no hydrogen 2.876 N/A SER 32.A OG GLN 28.A O no hydrogen 3.167 N/A SER 33.A N PRO 29.A O no hydrogen 3.057 N/A GLN 34.A N PHE 30.A O no hydrogen 2.897 N/A LYS 35.A N GLU 31.A O no hydrogen 3.138 N/A THR 37.A N SER 33.A O no hydrogen 3.083 N/A THR 37.A OG1 SER 33.A O no hydrogen 2.736 N/A ILE 38.A N GLN 34.A O no hydrogen 3.155 N/A LEU 40.A N ASN 36.A O no hydrogen 2.928 N/A GLU 41.A N THR 37.A O no hydrogen 2.880 N/A LYS 42.A N ILE 38.A O no hydrogen 2.978 N/A LYS 42.A NZ GLU 58.A OE2 no hydrogen 3.330 N/A ALA 43.A N ALA 39.A O no hydrogen 3.361 N/A GLU 44.A N LEU 40.A O no hydrogen 2.772 N/A PHE 45.A N GLU 41.A O no hydrogen 2.922 N/A LEU 46.A N LYS 42.A O no hydrogen 3.160 N/A ARG 47.A N ALA 43.A O no hydrogen 3.224 N/A ASP 48.A N GLU 44.A O no hydrogen 2.913 N/A HIS 49.A N PHE 45.A O no hydrogen 2.840 N/A HIS 49.A ND1 PHE 45.A O no hydrogen 2.899 N/A VAL 52.A N HIS 49.A O no hydrogen 3.347 N/A SER 53.A N GLU 56.A OE1 no hydrogen 2.949 N/A GLN 55.A NE2 THR 59.A OG1 no hydrogen 3.131 N/A GLU 56.A N SER 53.A OG no hydrogen 2.973 N/A LEU 57.A N SER 53.A O no hydrogen 3.144 N/A GLU 58.A N PRO 54.A O no hydrogen 3.229 N/A THR 59.A N GLN 55.A O no hydrogen 2.914 N/A THR 59.A OG1 GLN 55.A O no hydrogen 2.740 N/A LEU 60.A N GLU 56.A O no hydrogen 3.308 N/A ILE 61.A N LEU 57.A O no hydrogen 2.975 N/A GLN 62.A N GLU 58.A O no hydrogen 2.902 N/A GLN 62.A NE2 GLN 62.A O no hydrogen 3.482 N/A GLN 62.A NE2 ASP 66.A OD1 no hydrogen 3.306 N/A HIS 63.A N THR 59.A O no hydrogen 2.993 N/A ALA 64.A N LEU 60.A O no hydrogen 2.870 N/A LEU 65.A N ILE 61.A O no hydrogen 2.940 N/A ASP 66.A N GLN 62.A O no hydrogen 2.820 N/A ALA 67.A N HIS 63.A O no hydrogen 3.236 N/A ASP 68.A N ALA 64.A O no hydrogen 3.133 N/A ASN 69.A N LEU 65.A O no hydrogen 2.808 N/A ALA 70.A N ASP 66.A O no hydrogen 3.315 N/A GLY 71.A N ASP 68.A O no hydrogen 3.121 N/A VAL 72.A N ALA 67.A O no hydrogen 2.881 N/A SER 73.A OG ILE 75.A O no hydrogen 3.406 N/A ASN 80.A N ASN 77.A O no hydrogen 3.312 N/A SER 82.A N SER 79.A O no hydrogen 3.443 N/A SER 82.A OG SER 79.A O no hydrogen 3.081 N/A TRP 85.A N SER 83.A OG no hydrogen 3.228 N/A SER 89.A N ASP 86.A OD1 no hydrogen 3.502 N/A SER 89.A OG ASP 86.A OD2 no hydrogen 2.998 N/A ALA 90.A N ASP 86.A O no hydrogen 2.776 N/A PHE 91.A N LEU 87.A O no hydrogen 2.816 N/A PHE 92.A N GLY 88.A O no hydrogen 3.132 N/A PHE 93.A N SER 89.A O no hydrogen 3.008 N/A ALA 94.A N ALA 90.A O no hydrogen 3.058 N/A GLY 95.A N PHE 91.A O no hydrogen 3.086 N/A THR 96.A N PHE 92.A O no hydrogen 3.009 N/A THR 96.A OG1 PHE 92.A O no hydrogen 2.710 N/A VAL 97.A N PHE 93.A O no hydrogen 3.275 N/A VAL 97.A N ALA 94.A O no hydrogen 3.222 N/A ILE 98.A N ALA 94.A O no hydrogen 3.244 N/A THR 99.A N GLY 95.A O no hydrogen 3.048 N/A THR 99.A OG1 GLY 95.A O no hydrogen 2.724 N/A THR 99.A OG1 THR 96.A O no hydrogen 3.370 N/A THR 100.A N VAL 97.A O no hydrogen 3.142 N/A THR 100.A OG1 THR 99.A O no hydrogen 2.717 N/A ILE 101.A N THR 96.A O no hydrogen 3.145 N/A GLY 102.A N THR 96.A O no hydrogen 2.976 N/A TYR 103.A OH THR 206.A OG1 no hydrogen 3.102 N/A LYS 114.A N THR 110.A O no hydrogen 3.051 N/A LYS 114.A NZ PRO 108.A O no hydrogen 2.834 N/A ILE 115.A N GLU 111.A O no hydrogen 3.013 N/A PHE 116.A N GLY 112.A O no hydrogen 2.868 N/A CYS 117.A N GLY 113.A O no hydrogen 3.076 N/A ILE 118.A N LYS 114.A O no hydrogen 3.071 N/A LEU 119.A N ILE 115.A O no hydrogen 3.325 N/A TYR 120.A N PHE 116.A O no hydrogen 2.719 N/A ALA 121.A N CYS 117.A O no hydrogen 2.990 N/A ILE 122.A N ILE 118.A O no hydrogen 3.073 N/A PHE 123.A N LEU 119.A O no hydrogen 3.286 N/A GLY 124.A N TYR 120.A O no hydrogen 2.966 N/A ILE 125.A N ALA 121.A O no hydrogen 3.021 N/A PHE 128.A N GLY 124.A O no hydrogen 3.089 N/A GLY 129.A N ILE 125.A O no hydrogen 3.068 N/A PHE 130.A N PRO 126.A O no hydrogen 3.109 N/A LEU 132.A N PHE 128.A O no hydrogen 2.834 N/A ALA 133.A N GLY 129.A O no hydrogen 2.830 N/A GLY 134.A N PHE 130.A O no hydrogen 2.814 N/A ILE 135.A N LEU 131.A O no hydrogen 3.023 N/A GLY 136.A N LEU 132.A O no hydrogen 2.769 N/A ASP 137.A N ALA 133.A O no hydrogen 2.877 N/A GLN 138.A N GLY 134.A O no hydrogen 3.329 N/A LEU 139.A N ILE 135.A O no hydrogen 2.922 N/A GLY 140.A N GLY 136.A O no hydrogen 3.090 N/A THR 141.A N ASP 137.A O no hydrogen 3.167 N/A THR 141.A OG1 ASP 137.A O no hydrogen 2.738 N/A ILE 142.A N GLN 138.A O no hydrogen 3.425 N/A PHE 143.A N LEU 139.A O no hydrogen 2.879 N/A GLY 144.A N GLY 140.A O no hydrogen 2.912 N/A LYS 145.A N THR 141.A O no hydrogen 2.955 N/A SER 146.A N ILE 142.A O no hydrogen 3.059 N/A SER 146.A OG ILE 142.A O no hydrogen 2.729 N/A ILE 147.A N PHE 143.A O no hydrogen 2.975 N/A ALA 148.A N GLY 144.A O no hydrogen 3.114 N/A ARG 149.A N LYS 145.A O no hydrogen 3.221 N/A VAL 150.A N SER 146.A O no hydrogen 3.252 N/A GLU 151.A N ILE 147.A O no hydrogen 2.778 N/A LYS 152.A N ALA 148.A O no hydrogen 3.215 N/A PHE 154.A N VAL 150.A O no hydrogen 2.994 N/A GLN 158.A N ARG 155.A O no hydrogen 3.284 N/A VAL 159.A N PHE 154.A O no hydrogen 3.203 N/A ILE 164.A N SER 160.A O no hydrogen 3.082 N/A ARG 165.A N GLN 161.A O no hydrogen 2.951 N/A VAL 166.A N THR 162.A O no hydrogen 2.861 N/A ILE 167.A N LYS 163.A O no hydrogen 3.179 N/A SER 168.A N ILE 164.A O no hydrogen 2.956 N/A SER 168.A OG ILE 164.A O no hydrogen 2.729 N/A THR 169.A N ARG 165.A O no hydrogen 3.118 N/A THR 169.A OG1 ARG 165.A O no hydrogen 2.700 N/A ILE 170.A N VAL 166.A O no hydrogen 3.104 N/A LEU 171.A N ILE 167.A O no hydrogen 3.107 N/A PHE 172.A N SER 168.A O no hydrogen 2.933 N/A ILE 173.A N THR 169.A O no hydrogen 2.860 N/A LEU 174.A N ILE 170.A O no hydrogen 2.870 N/A ALA 175.A N LEU 171.A O no hydrogen 2.873 N/A GLY 176.A N PHE 172.A O no hydrogen 3.238 N/A CYS 177.A N ILE 173.A O no hydrogen 3.032 N/A CYS 177.A SG ILE 173.A O no hydrogen 3.164 N/A ILE 178.A N LEU 174.A O no hydrogen 3.246 N/A ILE 178.A N ALA 175.A O no hydrogen 3.305 N/A VAL 179.A N ALA 175.A O no hydrogen 3.117 N/A PHE 180.A N GLY 176.A O no hydrogen 2.878 N/A THR 182.A N CYS 177.A O no hydrogen 2.811 N/A THR 182.A OG1 CYS 177.A O no hydrogen 2.712 N/A ILE 183.A N ILE 178.A O no hydrogen 2.851 N/A ALA 185.A N VAL 181.A O no hydrogen 3.327 N/A VAL 186.A N THR 182.A O no hydrogen 3.106 N/A ILE 187.A N ILE 183.A O no hydrogen 3.166 N/A PHE 188.A N PRO 184.A O no hydrogen 2.812 N/A LYS 189.A N ALA 185.A O no hydrogen 2.868 N/A TYR 190.A N VAL 186.A O no hydrogen 3.331 N/A ILE 191.A N ILE 187.A O no hydrogen 2.915 N/A GLU 192.A N PHE 188.A O no hydrogen 2.862 N/A THR 195.A N GLU 198.A OE1 no hydrogen 2.797 N/A GLU 198.A N THR 195.A OG1 no hydrogen 3.380 N/A SER 199.A N THR 195.A O no hydrogen 3.038 N/A SER 199.A OG THR 195.A O no hydrogen 2.809 N/A ILE 200.A N ALA 196.A O no hydrogen 3.405 N/A TYR 201.A N LEU 197.A O no hydrogen 2.783 N/A TYR 201.A OH ASP 214.A OD2 no hydrogen 2.968 N/A PHE 202.A N GLU 198.A O no hydrogen 2.906 N/A VAL 203.A N SER 199.A O no hydrogen 3.156 N/A VAL 204.A N ILE 200.A O no hydrogen 2.875 N/A VAL 205.A N TYR 201.A O no hydrogen 2.866 N/A THR 206.A N PHE 202.A O no hydrogen 2.781 N/A THR 206.A OG1 TYR 103.A OH no hydrogen 3.102 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.686 N/A LEU 207.A N VAL 203.A O no hydrogen 2.874 N/A THR 208.A N VAL 204.A O no hydrogen 2.998 N/A THR 208.A OG1 VAL 204.A O no hydrogen 2.722 N/A THR 208.A OG1 VAL 205.A O no hydrogen 3.288 N/A THR 209.A N THR 206.A O no hydrogen 2.963 N/A THR 209.A OG1 THR 208.A O no hydrogen 2.675 N/A GLY 211.A N VAL 205.A O no hydrogen 2.911 N/A GLY 218.A N GLU 192.A OE2 no hydrogen 2.800 N/A ASN 220.A N TYR 225.A OH no hydrogen 3.428 N/A GLY 222.A N ASN 220.A OD1 no hydrogen 3.269 N/A TYR 225.A OH GLU 192.A OE1 no hydrogen 2.700 N/A TYR 225.A OH GLU 192.A OE2 no hydrogen 3.059 N/A TYR 229.A N ARG 226.A O no hydrogen 3.257 N/A TYR 229.A OH GLU 192.A OE2 no hydrogen 2.731 N/A LEU 232.A N TRP 228.A O no hydrogen 2.999 N/A VAL 233.A N TYR 229.A O no hydrogen 3.012 N/A TRP 234.A N LYS 230.A O no hydrogen 3.132 N/A PHE 235.A N PRO 231.A O no hydrogen 2.892 N/A TRP 236.A N LEU 232.A O no hydrogen 2.860 N/A TRP 236.A NE1 PHE 180.A O no hydrogen 2.984 N/A ILE 237.A N VAL 233.A O no hydrogen 2.952 N/A LEU 238.A N TRP 234.A O no hydrogen 2.858 N/A VAL 239.A N PHE 235.A O no hydrogen 2.922 N/A GLY 240.A N TRP 236.A O no hydrogen 2.772 N/A LEU 241.A N ILE 237.A O no hydrogen 2.872 N/A ALA 242.A N LEU 238.A O no hydrogen 3.071 N/A TYR 243.A N VAL 239.A O no hydrogen 2.999 N/A TYR 243.A OH PHE 172.A O no hydrogen 2.721 N/A PHE 244.A N GLY 240.A O no hydrogen 3.256 N/A ALA 245.A N LEU 241.A O no hydrogen 2.976 N/A ALA 246.A N ALA 242.A O no hydrogen 2.878 N/A VAL 247.A N TYR 243.A O no hydrogen 3.172 N/A LEU 248.A N PHE 244.A O no hydrogen 3.137 N/A SER 249.A N ALA 245.A O no hydrogen 2.815 N/A MET 250.A N ALA 246.A O no hydrogen 3.229 N/A ILE 251.A N VAL 247.A O no hydrogen 3.129 N/A GLY 252.A N LEU 248.A O no hydrogen 3.026 N/A ASP 253.A N SER 249.A O no hydrogen 2.866 N/A TRP 254.A N MET 250.A O no hydrogen 3.436 N/A LEU 255.A N ILE 251.A O no hydrogen 3.124 N/A ARG 256.A N GLY 252.A O no hydrogen 3.155 N/A LEU 258.A N TRP 254.A O no hydrogen 3.114 N/A SER 259.A N LEU 255.A O no hydrogen 2.976 N/A LYS 260.A N ARG 256.A O no hydrogen 3.181 N/A LYS 261.A N VAL 257.A O no hydrogen 3.124 N/A