Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rll_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N ILE 1.A O no hydrogen 3.026 N/A LEU 6.A N PHE 2.A O no hydrogen 3.090 N/A GLU 7.A N LEU 3.A O no hydrogen 2.969 N/A ALA 8.A N ASN 4.A O no hydrogen 2.992 N/A ILE 9.A N VAL 5.A O no hydrogen 3.043 N/A GLU 10.A N GLU 7.A O no hydrogen 3.398 N/A ALA 16.A N ASP 96.A OD1 no hydrogen 2.884 N/A GLY 17.A N ASP 96.A OD2 no hydrogen 2.594 N/A HIS 18.A N ASP 96.A OD2 no hydrogen 3.282 N/A HIS 18.A ND1 SER 32.A OG no hydrogen 2.660 N/A ASN 20.A ND2 ASP 96.A O no hydrogen 2.848 N/A ASN 21.A N ASP 19.A OD2 no hydrogen 2.860 N/A ASN 21.A ND2 ASP 19.A OD2 no hydrogen 3.414 N/A ALA 28.A N SER 25.A OG no hydrogen 3.014 N/A LEU 29.A N SER 25.A O no hydrogen 2.957 N/A LEU 30.A N PHE 26.A O no hydrogen 2.883 N/A SER 31.A N ALA 27.A O no hydrogen 2.938 N/A SER 31.A OG ALA 27.A O no hydrogen 2.957 N/A SER 31.A OG ASP 211.A OD1 no hydrogen 3.515 N/A SER 32.A N ALA 28.A O no hydrogen 3.129 N/A SER 32.A OG HIS 18.A ND1 no hydrogen 2.660 N/A SER 32.A OG ALA 28.A O no hydrogen 3.255 N/A LEU 33.A N LEU 29.A O no hydrogen 2.926 N/A ASN 34.A N LEU 30.A O no hydrogen 2.930 N/A ASN 34.A ND2 ASP 211.A O no hydrogen 2.945 N/A GLU 35.A N SER 31.A O no hydrogen 2.980 N/A LEU 36.A N SER 32.A O no hydrogen 2.818 N/A GLY 37.A N LEU 33.A O no hydrogen 2.918 N/A GLU 38.A N ASN 34.A O no hydrogen 2.992 N/A ARG 39.A N GLU 35.A O no hydrogen 2.908 N/A ARG 39.A NE GLU 35.A OE1 no hydrogen 2.881 N/A ARG 39.A NH1 CYS 15.A O no hydrogen 2.711 N/A GLN 40.A N LEU 36.A O no hydrogen 2.808 N/A LEU 41.A N GLY 37.A O no hydrogen 2.935 N/A VAL 44.A N GLN 40.A O no hydrogen 2.908 N/A VAL 45.A N LEU 41.A O no hydrogen 2.960 N/A LYS 46.A N VAL 42.A O no hydrogen 3.396 N/A TRP 47.A N HIS 43.A O no hydrogen 2.857 N/A ALA 48.A N VAL 44.A O no hydrogen 2.847 N/A LYS 49.A N VAL 45.A O no hydrogen 3.052 N/A ALA 50.A N TRP 47.A O no hydrogen 2.975 N/A LEU 51.A N ALA 48.A O no hydrogen 3.106 N/A PHE 54.A N LEU 51.A O no hydrogen 3.143 N/A ASN 56.A N GLY 53.A O no hydrogen 2.964 N/A LEU 57.A N PHE 54.A O no hydrogen 3.185 N/A ASP 60.A N HIS 58.A ND1 no hydrogen 2.891 N/A GLN 62.A N HIS 58.A O no hydrogen 2.965 N/A MET 63.A N VAL 59.A O no hydrogen 3.500 N/A ALA 64.A N ASP 60.A O no hydrogen 3.088 N/A VAL 65.A N ASP 61.A O no hydrogen 2.927 N/A ILE 66.A N GLN 62.A O no hydrogen 3.225 N/A GLN 67.A N MET 63.A O no hydrogen 3.071 N/A TYR 68.A N ALA 64.A O no hydrogen 2.864 N/A SER 69.A N VAL 65.A O no hydrogen 2.844 N/A SER 69.A OG VAL 65.A O no hydrogen 3.278 N/A SER 69.A OG LEU 140.A O no hydrogen 3.162 N/A SER 69.A OG LEU 141.A O no hydrogen 3.097 N/A LEU 73.A N SER 69.A O no hydrogen 2.888 N/A MET 74.A N TRP 70.A O no hydrogen 3.166 N/A VAL 75.A N MET 71.A O no hydrogen 2.926 N/A PHE 76.A N GLY 72.A O no hydrogen 3.037 N/A ALA 77.A N LEU 73.A O no hydrogen 2.982 N/A MET 78.A N MET 74.A O no hydrogen 2.774 N/A GLY 79.A N VAL 75.A O no hydrogen 2.911 N/A TRP 80.A N PHE 76.A O no hydrogen 3.128 N/A ARG 81.A N ALA 77.A O no hydrogen 3.006 N/A ARG 81.A NE TYR 92.A O no hydrogen 3.114 N/A ARG 81.A NH2 PHE 93.A O no hydrogen 2.993 N/A SER 82.A N MET 78.A O no hydrogen 2.956 N/A SER 82.A OG MET 78.A O no hydrogen 2.827 N/A PHE 83.A N GLY 79.A O no hydrogen 3.071 N/A THR 84.A N TRP 80.A O no hydrogen 2.904 N/A THR 84.A OG1 TRP 80.A O no hydrogen 3.289 N/A THR 84.A OG1 ARG 81.A O no hydrogen 3.307 N/A THR 84.A OG1 ASN 85.A OD1 no hydrogen 3.211 N/A ASN 85.A N ARG 81.A O no hydrogen 2.725 N/A VAL 86.A N SER 82.A O no hydrogen 3.099 N/A SER 88.A N SER 82.A O no hydrogen 2.870 N/A SER 88.A OG SER 120.A OG no hydrogen 2.622 N/A ARG 89.A N VAL 86.A O no hydrogen 2.885 N/A LEU 91.A N PHE 99.A O no hydrogen 3.014 N/A TYR 92.A N SER 82.A OG no hydrogen 2.928 N/A PHE 93.A N LEU 91.A O no hydrogen 3.143 N/A ALA 94.A N LEU 97.A O no hydrogen 3.194 N/A LEU 97.A N ALA 94.A O no hydrogen 2.903 N/A PHE 99.A N LEU 91.A O no hydrogen 2.837 N/A ARG 103.A N ASN 100.A OD1 no hydrogen 2.911 N/A ARG 103.A NE VAL 98.A O no hydrogen 3.296 N/A ARG 103.A NH1 ASN 20.A OD1 no hydrogen 3.459 N/A ARG 103.A NH1 ASP 24.A OD2 no hydrogen 2.841 N/A ARG 103.A NH2 ASN 20.A OD1 no hydrogen 3.228 N/A ARG 103.A NH2 VAL 98.A O no hydrogen 2.831 N/A MET 104.A N ASN 100.A O no hydrogen 3.017 N/A HIS 105.A N GLU 101.A O no hydrogen 2.990 N/A LYS 106.A N TYR 102.A O no hydrogen 2.864 N/A SER 107.A N ARG 103.A O no hydrogen 2.943 N/A SER 107.A OG ARG 103.A O no hydrogen 3.114 N/A SER 107.A OG MET 104.A O no hydrogen 2.886 N/A ARG 108.A N HIS 105.A O no hydrogen 3.088 N/A MET 109.A N SER 107.A OG no hydrogen 3.213 N/A TYR 110.A OH GLU 101.A OE1 no hydrogen 3.338 N/A TYR 110.A OH GLU 101.A OE2 no hydrogen 2.614 N/A SER 111.A OG GLN 112.A OE1 no hydrogen 2.932 N/A SER 111.A OG GLU 193.A OE2 no hydrogen 3.557 N/A GLN 112.A N GLN 112.A OE1 no hydrogen 2.757 N/A GLN 112.A NE2 GLU 193.A O no hydrogen 3.405 N/A CYS 113.A N MET 109.A O no hydrogen 2.913 N/A CYS 113.A SG MET 109.A O no hydrogen 3.358 N/A VAL 114.A N TYR 110.A O no hydrogen 2.943 N/A ARG 115.A N SER 111.A O no hydrogen 3.204 N/A ARG 115.A NH1 GLU 193.A OE1 no hydrogen 2.414 N/A MET 116.A N GLN 112.A O no hydrogen 3.064 N/A ARG 117.A N CYS 113.A O no hydrogen 2.824 N/A ARG 117.A NH2 GLU 101.A OE1 no hydrogen 2.616 N/A HIS 118.A N VAL 114.A O no hydrogen 3.002 N/A LEU 119.A N ARG 115.A O no hydrogen 3.040 N/A SER 120.A N MET 116.A O no hydrogen 2.895 N/A SER 120.A OG GLY 79.A O no hydrogen 3.038 N/A SER 120.A OG SER 88.A OG no hydrogen 2.622 N/A GLN 121.A N ARG 117.A O no hydrogen 2.940 N/A GLN 121.A NE2 ARG 117.A O no hydrogen 3.369 N/A GLU 122.A N HIS 118.A O no hydrogen 3.019 N/A PHE 123.A N LEU 119.A O no hydrogen 3.382 N/A PHE 123.A N SER 120.A O no hydrogen 3.273 N/A GLY 124.A N GLN 121.A O no hydrogen 2.932 N/A TRP 125.A N GLN 121.A O no hydrogen 2.877 N/A LEU 126.A N GLU 122.A O no hydrogen 2.905 N/A GLN 127.A N GLY 124.A O no hydrogen 2.988 N/A ILE 128.A N PHE 123.A O no hydrogen 3.003 N/A THR 129.A N GLU 132.A OE1 no hydrogen 2.957 N/A GLU 132.A N THR 129.A OG1 no hydrogen 3.024 N/A PHE 133.A N THR 129.A O no hydrogen 2.864 N/A LEU 134.A N PRO 130.A O no hydrogen 2.968 N/A CYS 135.A N GLN 131.A O no hydrogen 3.076 N/A CYS 135.A SG TYR 163.A O no hydrogen 3.913 N/A MET 136.A N GLU 132.A O no hydrogen 2.861 N/A LYS 137.A N PHE 133.A O no hydrogen 2.899 N/A LYS 137.A NZ GLU 10.A OE1 no hydrogen 2.901 N/A ALA 138.A N LEU 134.A O no hydrogen 3.102 N/A LEU 139.A N CYS 135.A O no hydrogen 3.014 N/A LEU 140.A N MET 136.A O no hydrogen 3.008 N/A LEU 141.A N ALA 138.A O no hydrogen 3.079 N/A PHE 142.A N LEU 139.A O no hydrogen 2.858 N/A SER 143.A N LEU 140.A O no hydrogen 3.325 N/A SER 143.A OG LEU 139.A O no hydrogen 2.827 N/A ILE 145.A N LYS 233.A O no hydrogen 3.227 N/A VAL 147.A N LYS 231.A O no hydrogen 2.766 N/A GLY 149.A N PRO 146.A O no hydrogen 2.932 N/A LEU 150.A N GLN 153.A OE1 no hydrogen 2.744 N/A LYS 151.A N ASP 61.A OD1 no hydrogen 2.809 N/A LYS 151.A NZ ASP 60.A OD1 no hydrogen 2.498 N/A ASN 152.A N ASP 61.A OD2 no hydrogen 2.844 N/A GLN 153.A NE2 ASP 157.A OD1 no hydrogen 2.882 N/A PHE 156.A N ASN 152.A O no hydrogen 3.461 N/A ASP 157.A N GLN 153.A O no hydrogen 2.846 N/A GLU 158.A N LYS 154.A O no hydrogen 3.029 N/A LEU 159.A N PHE 155.A O no hydrogen 3.005 N/A ARG 160.A N PHE 156.A O no hydrogen 2.848 N/A ARG 160.A NH1 PHE 142.A O no hydrogen 2.835 N/A ARG 160.A NH1 SER 143.A OG no hydrogen 3.218 N/A MET 161.A N ASP 157.A O no hydrogen 3.084 N/A ASN 162.A N GLU 158.A O no hydrogen 3.061 N/A TYR 163.A N LEU 159.A O no hydrogen 3.055 N/A TYR 163.A OH PRO 52.A O no hydrogen 2.727 N/A ILE 164.A N ARG 160.A O no hydrogen 3.018 N/A LYS 165.A N MET 161.A O no hydrogen 2.977 N/A LYS 165.A NZ ASP 168.A OD1 no hydrogen 2.848 N/A GLU 166.A N ASN 162.A O no hydrogen 3.056 N/A LEU 167.A N TYR 163.A O no hydrogen 3.136 N/A ASP 168.A N ILE 164.A O no hydrogen 2.962 N/A ARG 169.A N LYS 165.A O no hydrogen 3.051 N/A ILE 170.A N GLU 166.A O no hydrogen 3.065 N/A ILE 171.A N LEU 167.A O no hydrogen 3.048 N/A ALA 172.A N ASP 168.A O no hydrogen 2.930 N/A ARG 176.A NE GLU 132.A OE2 no hydrogen 2.887 N/A ARG 176.A NH1 LEU 126.A O no hydrogen 2.935 N/A ARG 176.A NH1 GLN 179.A OE1 no hydrogen 3.091 N/A ARG 176.A NH2 LEU 126.A O no hydrogen 2.978 N/A ARG 176.A NH2 GLN 127.A O no hydrogen 3.261 N/A ARG 176.A NH2 GLU 132.A OE1 no hydrogen 2.782 N/A ARG 176.A NH2 GLU 132.A OE2 no hydrogen 3.362 N/A PHE 177.A N CYS 173.A O no hydrogen 2.950 N/A TYR 178.A N SER 174.A O no hydrogen 2.990 N/A GLN 179.A N ARG 175.A O no hydrogen 3.052 N/A LEU 180.A N ARG 176.A O no hydrogen 2.949 N/A THR 181.A N PHE 177.A O no hydrogen 2.967 N/A THR 181.A OG1 PHE 177.A O no hydrogen 2.741 N/A THR 181.A OG1 TYR 178.A O no hydrogen 2.915 N/A THR 181.A OG1 HIS 238.A NE2 no hydrogen 2.821 N/A LYS 182.A N TYR 178.A O no hydrogen 2.967 N/A LEU 183.A N GLN 179.A O no hydrogen 2.855 N/A LEU 184.A N LEU 180.A O no hydrogen 2.895 N/A ASP 185.A N THR 181.A O no hydrogen 2.933 N/A SER 186.A N LYS 182.A O no hydrogen 3.157 N/A SER 186.A N LEU 183.A O no hydrogen 2.985 N/A SER 186.A OG LEU 183.A O no hydrogen 2.515 N/A VAL 187.A N LEU 184.A O no hydrogen 3.167 N/A GLN 188.A N ASP 185.A O no hydrogen 3.283 N/A ALA 191.A N VAL 187.A O no hydrogen 2.912 N/A ARG 192.A N GLN 188.A O no hydrogen 2.912 N/A GLU 193.A N PRO 189.A O no hydrogen 3.187 N/A LEU 194.A N ILE 190.A O no hydrogen 3.185 N/A HIS 195.A N ALA 191.A O no hydrogen 2.811 N/A GLN 196.A N ARG 192.A O no hydrogen 3.013 N/A PHE 197.A N GLU 193.A O no hydrogen 3.045 N/A ALA 198.A N LEU 194.A O no hydrogen 2.817 N/A PHE 199.A N HIS 195.A O no hydrogen 2.854 N/A ASP 200.A N GLN 196.A O no hydrogen 2.889 N/A LEU 201.A N PHE 197.A O no hydrogen 2.911 N/A LEU 202.A N ALA 198.A O no hydrogen 2.958 N/A ILE 203.A N PHE 199.A O no hydrogen 3.117 N/A LYS 204.A N ASP 200.A O no hydrogen 3.203 N/A SER 205.A N LEU 202.A O no hydrogen 3.034 N/A SER 205.A OG LEU 202.A O no hydrogen 2.825 N/A MET 207.A N LYS 204.A O no hydrogen 2.847 N/A VAL 208.A N SER 205.A O no hydrogen 3.422 N/A VAL 210.A N SER 205.A O no hydrogen 3.440 N/A MET 215.A N GLU 38.A OE2 no hydrogen 2.818 N/A MET 216.A N GLU 38.A OE1 no hydrogen 2.866 N/A ALA 217.A N PRO 213.A O no hydrogen 2.959 N/A GLU 218.A N GLU 214.A O no hydrogen 3.210 N/A ILE 219.A N MET 215.A O no hydrogen 2.984 N/A ILE 220.A N MET 216.A O no hydrogen 2.872 N/A SER 221.A N ALA 217.A O no hydrogen 3.154 N/A SER 221.A N GLU 218.A O no hydrogen 3.200 N/A SER 221.A OG ALA 217.A O no hydrogen 2.930 N/A SER 221.A OG GLU 218.A O no hydrogen 3.110 N/A VAL 222.A N GLU 218.A O no hydrogen 2.830 N/A GLN 223.A N ILE 219.A O no hydrogen 2.822 N/A GLN 223.A NE2 GLN 67.A OE1 no hydrogen 2.627 N/A VAL 224.A N ILE 219.A O no hydrogen 2.975 N/A LYS 226.A N GLN 223.A O no hydrogen 2.970 N/A LYS 226.A NZ GLN 223.A OE1 no hydrogen 3.117 N/A LEU 228.A N VAL 224.A O no hydrogen 2.896 N/A SER 229.A N PRO 225.A O no hydrogen 2.800 N/A SER 229.A OG PRO 225.A O no hydrogen 2.832 N/A SER 229.A OG LYS 226.A O no hydrogen 3.450 N/A GLY 230.A N ILE 227.A O no hydrogen 3.100 N/A LYS 231.A N LYS 226.A O no hydrogen 2.734 N/A VAL 232.A N LYS 226.A O no hydrogen 2.986 N/A LYS 233.A N ILE 145.A O no hydrogen 2.950 N/A ILE 235.A N SER 143.A O no hydrogen 2.777 N/A PHE 237.A N ASP 185.A OD1 no hydrogen 2.941 N/A PHE 237.A N ASP 185.A OD2 no hydrogen 3.239 N/A HIS 238.A N ASP 185.A OD2 no hydrogen 2.900 N/A HIS 238.A NE2 THR 181.A OG1 no hydrogen 2.821 N/A