Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o4b_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A N LEU 4.A O no hydrogen 3.137 N/A SER 9.A N.A PHE 6.A O no hydrogen 3.181 N/A SER 9.A N.B PHE 6.A O no hydrogen 3.180 N/A SER 9.A OG.A PHE 6.A O no hydrogen 2.586 N/A PHE 10.A N LEU 17.A O no hydrogen 2.943 N/A ASP 12.A N TYR 15.A O no hydrogen 2.871 N/A TYR 15.A N ASP 12.A O no hydrogen 2.872 N/A LEU 16.A N MET 65.A O.A no hydrogen 2.810 N/A LEU 16.A N MET 65.A O.B no hydrogen 2.787 N/A LEU 17.A N PHE 10.A O no hydrogen 2.776 N/A LYS 18.A N ILE 63.A O no hydrogen 2.918 N/A LYS 18.A NZ GLU 25.A OE1 no hydrogen 2.551 N/A CYS 20.A N GLU 61.A O no hydrogen 2.814 N/A ARG 24.A N SER 22.A OG no hydrogen 3.414 N/A ARG 24.A NE GLU 90.A OE1 no hydrogen 2.951 N/A ARG 24.A NH1 ASN 215.A O no hydrogen 3.028 N/A ARG 24.A NH1 GLU 221.A OE1 no hydrogen 3.104 N/A ARG 24.A NH1 GLU 221.A OE2 no hydrogen 3.010 N/A ARG 24.A NH2 GLU 90.A OE2 no hydrogen 2.722 N/A ARG 24.A NH2 GLU 221.A OE1 no hydrogen 3.449 N/A ARG 26.A NE ASP 27.A OD1 no hydrogen 3.008 N/A ARG 26.A NH1 GLU 61.A OE1 no hydrogen 3.547 N/A ARG 26.A NH2 ASP 27.A OD1 no hydrogen 2.813 N/A ASP 27.A N HIS 23.A O no hydrogen 2.799 N/A PHE 28.A N ARG 24.A O no hydrogen 2.973 N/A TYR 29.A N GLU 25.A O no hydrogen 3.060 N/A LEU 30.A N ARG 26.A O no hydrogen 2.957 N/A HIS 31.A N ASP 27.A O no hydrogen 2.882 N/A ILE 32.A N PHE 28.A O no hydrogen 3.075 N/A LYS 33.A NZ ASP 34.A OD2 no hydrogen 3.364 N/A ASP 35.A N ILE 32.A O no hydrogen 2.914 N/A GLU 37.A N ASP 35.A OD1 no hydrogen 2.843 N/A TRP 38.A N ASP 35.A O no hydrogen 3.145 N/A THR 39.A N ASP 35.A O no hydrogen 3.110 N/A THR 39.A OG1 ASP 35.A O no hydrogen 3.395 N/A GLY 40.A N LYS 36.A O no hydrogen 3.124 N/A THR 41.A OG1 GLU 37.A O no hydrogen 2.671 N/A THR 41.A OG1 TRP 38.A O no hydrogen 3.375 N/A LYS 46.A N GLU 66.A OE1 no hydrogen 2.902 N/A TYR 48.A N ARG 64.A O no hydrogen 2.827 N/A GLU 51.A N PHE 62.A O no hydrogen 2.702 N/A HIS 53.A N LEU 60.A O no hydrogen 2.842 N/A HIS 53.A NE2 GLU 51.A OE1 no hydrogen 2.985 N/A GLY 56.A N GLU 54.A OE1 no hydrogen 2.733 N/A GLY 56.A N GLU 54.A OE2 no hydrogen 3.266 N/A LEU 60.A N HIS 53.A O no hydrogen 2.758 N/A PHE 62.A N GLU 51.A O no hydrogen 2.739 N/A ILE 63.A N LYS 18.A O no hydrogen 2.786 N/A ARG 64.A N GLY 49.A O no hydrogen 2.838 N/A ARG 64.A NE GLU 51.A OE1 no hydrogen 3.467 N/A ARG 64.A NE GLU 51.A OE2 no hydrogen 2.685 N/A ARG 64.A NH1 ASP 12.A OD2 no hydrogen 3.037 N/A ARG 64.A NH2 GLU 51.A OE1 no hydrogen 3.164 N/A MET 65.A N.A LEU 16.A O no hydrogen 2.867 N/A MET 65.A N.B LEU 16.A O no hydrogen 2.892 N/A GLU 66.A N LYS 46.A O no hydrogen 2.929 N/A ASN 67.A N GLN 14.A O no hydrogen 2.873 N/A ASN 67.A ND2 GLY 13.A O no hydrogen 3.114 N/A MET 69.A N ASN 67.A OD1 no hydrogen 2.974 N/A TYR 70.A N ASN 67.A O no hydrogen 3.233 N/A TYR 72.A N MET 69.A O no hydrogen 3.081 N/A LYS 73.A N ASP 195.A OD2 no hydrogen 2.819 N/A ARG 74.A N ASP 195.A OD1 no hydrogen 3.012 N/A ARG 74.A NH2 GLU 124.A OE1 no hydrogen 2.958 N/A PHE 76.A N TYR 194.A O no hydrogen 2.758 N/A VAL 77.A N GLU 119.A O no hydrogen 2.974 N/A LEU 78.A N PHE 192.A O no hydrogen 2.824 N/A ASP 79.A N GLY 117.A O no hydrogen 2.958 N/A LEU 80.A N VAL 190.A O no hydrogen 3.045 N/A LYS 81.A N ARG 114.A O no hydrogen 2.945 N/A LYS 81.A NZ SER 187.A O no hydrogen 3.301 N/A LYS 81.A NZ SER 187.A OG no hydrogen 3.094 N/A ILE 82.A N SER 188.A O.A no hydrogen 2.927 N/A ILE 82.A N SER 188.A O.B no hydrogen 2.873 N/A GLY 83.A N GLY 112.A O no hydrogen 2.723 N/A THR 84.A N ASP 227.A O no hydrogen 2.874 N/A THR 84.A OG1 ASP 227.A O no hydrogen 3.490 N/A GLN 85.A NE2 TRP 87.A O no hydrogen 3.045 N/A THR 86.A N ASP 103.A OD2 no hydrogen 2.886 N/A THR 86.A OG1 ASP 103.A OD1 no hydrogen 2.673 N/A THR 86.A OG1 ASP 103.A OD2 no hydrogen 3.543 N/A ASP 88.A N THR 91.A OG1 no hydrogen 2.870 N/A GLU 90.A N ASP 88.A OD1 no hydrogen 2.842 N/A THR 91.A N ASP 88.A O no hydrogen 3.021 N/A THR 91.A OG1 GLU 1.A OE2 no hydrogen 3.152 N/A THR 91.A OG1 ASP 88.A O no hydrogen 3.319 N/A THR 91.A OG1 ASP 88.A OD1 no hydrogen 3.564 N/A LYS 95.A N ALA 92.A O no hydrogen 3.026 N/A MET 96.A N SER 93.A O no hydrogen 3.216 N/A LYS 98.A NZ GLU 2.A OE1 no hydrogen 3.057 N/A ARG 99.A N LYS 95.A O no hydrogen 3.503 N/A ARG 99.A NH1 GLU 2.A OE2 no hydrogen 3.353 N/A LEU 100.A N MET 96.A O no hydrogen 2.999 N/A VAL 101.A N LYS 97.A O no hydrogen 3.090 N/A VAL 102.A N LYS 98.A O no hydrogen 2.884 N/A ASP 103.A N ARG 99.A O no hydrogen 2.828 N/A SER 104.A N VAL 101.A O no hydrogen 3.125 N/A SER 104.A OG LEU 100.A O no hydrogen 3.049 N/A SER 104.A OG VAL 101.A O no hydrogen 2.930 N/A THR 105.A N VAL 101.A O no hydrogen 2.902 N/A THR 105.A OG1 VAL 101.A O no hydrogen 3.061 N/A THR 105.A OG1 VAL 102.A O no hydrogen 3.478 N/A SER 106.A N VAL 102.A O no hydrogen 2.912 N/A SER 106.A OG VAL 102.A O no hydrogen 2.684 N/A SER 106.A OG ASP 103.A O no hydrogen 3.458 N/A THR 107.A OG1 VAL 113.A O no hydrogen 2.601 N/A THR 108.A N SER 106.A OG no hydrogen 3.176 N/A THR 108.A OG1 SER 106.A OG no hydrogen 3.340 N/A THR 109.A N ASP 103.A O no hydrogen 3.068 N/A THR 109.A OG1 ASP 103.A O no hydrogen 3.092 N/A SER 110.A OG THR 107.A O no hydrogen 3.528 N/A LEU 111.A N THR 107.A O no hydrogen 2.830 N/A GLY 112.A N THR 108.A O no hydrogen 2.795 N/A ARG 114.A N LYS 81.A O no hydrogen 2.959 N/A ARG 114.A NH1 ASP 103.A OD1 no hydrogen 2.967 N/A ARG 114.A NH1 THR 108.A OG1 no hydrogen 2.758 N/A SER 116.A N ASP 79.A O no hydrogen 2.791 N/A MET 118.A N TYR 130.A O no hydrogen 3.001 N/A GLU 119.A N VAL 77.A O no hydrogen 2.916 N/A ARG 120.A N ILE 128.A O no hydrogen 2.946 N/A ARG 120.A NE LEU 151.A O no hydrogen 2.994 N/A ARG 120.A NE ASN 154.A O no hydrogen 3.176 N/A ARG 120.A NH1 TYR 130.A OH no hydrogen 2.912 N/A ARG 120.A NH2 ASN 154.A O no hydrogen 2.774 N/A ASN 121.A ND2 PRO 75.A O no hydrogen 2.783 N/A ASN 121.A ND2 GLU 119.A OE1 no hydrogen 2.864 N/A ILE 128.A N ARG 120.A O no hydrogen 2.873 N/A TYR 130.A N MET 118.A O no hydrogen 2.779 N/A TYR 133.A N SER 131.A OG no hydrogen 3.115 N/A LEU 134.A N SER 131.A O no hydrogen 3.059 N/A CYS 135.A N ARG 132.A O no hydrogen 2.994 N/A CYS 135.A SG ARG 132.A O no hydrogen 3.246 N/A THR 136.A OG1 TYR 133.A O no hydrogen 3.408 N/A HIS 137.A N LEU 134.A O no hydrogen 3.291 N/A GLU 138.A N LEU 134.A O no hydrogen 2.809 N/A VAL 139.A N LEU 134.A O no hydrogen 2.988 N/A THR 141.A N SER 144.A OG no hydrogen 3.044 N/A THR 141.A OG1 SER 144.A OG no hydrogen 2.800 N/A ARG 142.A NH1 ASP 242.A OD2 no hydrogen 2.955 N/A ARG 142.A NH2 SER 238.A OG no hydrogen 3.121 N/A ARG 142.A NH2 ASP 242.A OD2 no hydrogen 2.757 N/A SER 144.A N THR 141.A OG1 no hydrogen 3.000 N/A SER 144.A OG THR 141.A O no hydrogen 3.201 N/A SER 144.A OG THR 141.A OG1 no hydrogen 2.800 N/A LEU 145.A N THR 141.A O no hydrogen 2.949 N/A LYS 146.A N ARG 142.A O no hydrogen 2.873 N/A LYS 146.A NZ GLU 246.A OE1 no hydrogen 3.450 N/A LYS 146.A NZ GLU 246.A OE2 no hydrogen 2.858 N/A GLU 147.A N ASP 143.A O no hydrogen 2.978 N/A TYR 148.A N SER 144.A O no hydrogen 2.907 N/A ILE 149.A N LEU 145.A O no hydrogen 2.927 N/A LYS 150.A N LYS 146.A O no hydrogen 2.961 N/A LYS 150.A NZ GLU 147.A OE2 no hydrogen 2.954 N/A LYS 150.A NZ GLU 246.A OE1 no hydrogen 2.743 N/A LEU 151.A N GLU 147.A O no hydrogen 3.008 N/A PHE 152.A N TYR 148.A O no hydrogen 3.056 N/A PHE 153.A N ILE 149.A O no hydrogen 3.216 N/A ASN 154.A N LEU 151.A O no hydrogen 3.024 N/A ASP 155.A N LYS 158.A O no hydrogen 3.022 N/A GLY 156.A N ASN 154.A OD1 no hydrogen 2.917 N/A LYS 157.A N ASP 155.A OD1 no hydrogen 2.761 N/A LYS 158.A N ASP 155.A OD1 no hydrogen 2.898 N/A ARG 160.A N PHE 153.A O no hydrogen 2.691 N/A ARG 160.A NE GLU 162.A OE2 no hydrogen 2.880 N/A ARG 160.A NH1 ASP 155.A OD2 no hydrogen 2.873 N/A ARG 160.A NH1 SER 196.A O no hydrogen 2.756 N/A ARG 160.A NH2 SER 196.A O no hydrogen 3.496 N/A ARG 160.A NH2 THR 198.A O no hydrogen 3.125 N/A LYS 161.A N TYR 159.A O no hydrogen 2.864 N/A LYS 161.A NZ PHE 247.A O no hydrogen 3.526 N/A LYS 161.A NZ LEU 250.A O no hydrogen 3.459 N/A GLU 162.A N GLU 162.A OE1 no hydrogen 2.735 N/A LEU 163.A N ARG 160.A O no hydrogen 3.057 N/A VAL 164.A N LYS 161.A O no hydrogen 3.324 N/A ILE 168.A N VAL 164.A O no hydrogen 3.048 N/A SER 169.A N PRO 165.A O no hydrogen 2.955 N/A GLN 170.A N TYR 166.A O no hydrogen 2.949 N/A GLN 170.A NE2 GLY 42.A O no hydrogen 2.850 N/A GLN 170.A NE2 CYS 207.A O no hydrogen 2.881 N/A LEU 171.A N PHE 167.A O no hydrogen 2.999 N/A ASP 172.A N ILE 168.A O no hydrogen 2.924 N/A LYS 173.A N SER 169.A O no hydrogen 3.142 N/A MET 174.A N GLN 170.A O no hydrogen 3.048 N/A ILE 175.A N LEU 171.A O no hydrogen 2.858 N/A GLU 176.A N ASP 172.A O no hydrogen 3.007 N/A VAL 177.A N LYS 173.A O no hydrogen 3.174 N/A MET 178.A N MET 174.A O no hydrogen 2.960 N/A LYS 179.A N ILE 175.A O no hydrogen 2.943 N/A LYS 179.A NZ GLU 176.A OE1 no hydrogen 3.057 N/A LYS 180.A N VAL 177.A O no hydrogen 3.326 N/A ARG 181.A N MET 178.A O no hydrogen 3.226 N/A LYS 184.A N TRP 216.A O no hydrogen 3.026 N/A LYS 184.A NZ CYS 223.A O no hydrogen 2.772 N/A LYS 184.A NZ VAL 225.A O no hydrogen 2.820 N/A MET 185.A N ASP 227.A OD2 no hydrogen 2.960 N/A PHE 186.A N HIS 214.A O no hydrogen 3.189 N/A SER 188.A OG.A ASP 211.A O no hydrogen 2.661 N/A SER 188.A OG.A ASN 215.A OD1 no hydrogen 3.433 N/A SER 189.A N ILE 210.A O no hydrogen 2.985 N/A SER 189.A OG ASP 79.A OD1 no hydrogen 2.635 N/A SER 189.A OG ASP 79.A OD2 no hydrogen 3.375 N/A VAL 190.A N LEU 80.A O no hydrogen 2.864 N/A LEU 191.A N LYS 208.A O no hydrogen 2.813 N/A PHE 192.A N LEU 78.A O no hydrogen 2.806 N/A VAL 193.A N ASN 206.A O no hydrogen 2.906 N/A TYR 194.A N PHE 76.A O no hydrogen 3.006 N/A TYR 194.A OH PHE 152.A O no hydrogen 2.790 N/A ASP 195.A N LYS 204.A O no hydrogen 3.021 N/A SER 196.A N ARG 74.A O no hydrogen 3.111 N/A THR 197.A N ASP 195.A OD1 no hydrogen 3.062 N/A THR 197.A OG1 ASP 195.A OD1 no hydrogen 2.710 N/A THR 197.A OG1 ASP 195.A OD2 no hydrogen 3.016 N/A THR 198.A N ASP 195.A O no hydrogen 2.782 N/A THR 198.A OG1 ASP 202.A O no hydrogen 3.081 N/A THR 199.A N ASP 202.A O no hydrogen 3.171 N/A GLU 201.A N THR 199.A OG1 no hydrogen 3.204 N/A ASP 202.A N THR 199.A O no hydrogen 3.233 N/A ASP 202.A N THR 199.A OG1 no hydrogen 3.013 N/A LYS 203.A NZ TYR 205.A OH no hydrogen 3.209 N/A LYS 204.A N THR 198.A OG1 no hydrogen 2.818 N/A LYS 204.A NZ ASP 195.A OD2 no hydrogen 2.845 N/A ASN 206.A N VAL 193.A O no hydrogen 2.929 N/A CYS 207.A N TYR 166.A OH no hydrogen 3.134 N/A CYS 207.A N ASN 206.A OD1 no hydrogen 3.058 N/A LYS 208.A N LEU 191.A O no hydrogen 3.046 N/A LYS 208.A NZ GLY 42.A O no hydrogen 2.901 N/A LYS 208.A NZ ASN 206.A OD1 no hydrogen 2.646 N/A MET 209.A N ILE 43.A O no hydrogen 2.828 N/A ILE 210.A N SER 189.A O no hydrogen 2.924 N/A PHE 212.A N GLU 25.A OE2 no hydrogen 2.843 N/A ASN 215.A N PHE 212.A O no hydrogen 3.299 N/A TRP 216.A N LYS 184.A O no hydrogen 2.773 N/A TRP 216.A NE1 ASP 88.A OD2 no hydrogen 2.972 N/A ILE 217.A N GLU 221.A OE2 no hydrogen 2.906 N/A LEU 218.A N GLU 182.A O no hydrogen 3.157 N/A GLU 220.A N ILE 217.A O no hydrogen 2.902 N/A GLU 221.A N ILE 217.A O no hydrogen 2.948 N/A CYS 223.A SG VAL 225.A O no hydrogen 4.000 N/A PHE 229.A N ASP 227.A OD1 no hydrogen 3.021 N/A GLY 232.A N GLY 228.A O no hydrogen 2.957 N/A LEU 233.A N PHE 229.A O no hydrogen 2.926 N/A ASN 234.A N LEU 230.A O no hydrogen 2.910 N/A ASN 235.A N PHE 231.A O no hydrogen 3.063 N/A ASN 235.A ND2 LEU 111.A O no hydrogen 3.067 N/A ASN 235.A ND2 PHE 231.A O no hydrogen 2.978 N/A LEU 236.A N GLY 232.A O no hydrogen 2.867 N/A LYS 237.A N LEU 233.A O no hydrogen 2.893 N/A LYS 237.A NZ ASP 172.A OD1 no hydrogen 2.749 N/A SER 238.A N ASN 234.A O no hydrogen 2.985 N/A ILE 239.A N ASN 235.A O no hydrogen 3.008 N/A LEU 240.A N LEU 236.A O no hydrogen 2.972 N/A GLU 241.A N LYS 237.A O no hydrogen 2.890 N/A ASP 242.A N SER 238.A O no hydrogen 3.033 N/A ILE 243.A N ILE 239.A O no hydrogen 2.924 N/A GLU 244.A N LEU 240.A O no hydrogen 2.866 N/A ASN 245.A N GLU 241.A O no hydrogen 3.025 N/A GLU 246.A N ASP 242.A O no hydrogen 2.889 N/A PHE 247.A N ILE 243.A O no hydrogen 2.763 N/A LYS 248.A N ASN 245.A O no hydrogen 3.230 N/A LYS 248.A NZ ASN 245.A OD1 no hydrogen 3.079 N/A SER 249.A OG GLU 246.A O no hydrogen 3.253 N/A LEU 250.A N PHE 247.A O no hydrogen 3.030 N/A