Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4apu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 7.A N PRO 3.A O no hydrogen 3.156 N/A LEU 8.A N PRO 4.A O no hydrogen 2.913 N/A LEU 9.A N LEU 5.A O no hydrogen 2.901 N/A MET 10.A N ILE 6.A O no hydrogen 2.945 N/A SER 11.A N ASN 7.A O no hydrogen 3.127 N/A SER 11.A OG LEU 8.A O no hydrogen 2.884 N/A ILE 12.A N LEU 8.A O no hydrogen 3.018 N/A ILE 12.A N LEU 9.A O no hydrogen 3.296 N/A VAL 16.A N ASP 15.A OD1 no hydrogen 2.825 N/A ALA 19.A N ASP 99.A OD1 no hydrogen 2.782 N/A GLY 20.A N ASP 99.A OD2 no hydrogen 2.829 N/A HIS 21.A N ASP 99.A OD2 no hydrogen 3.344 N/A HIS 21.A ND1 SER 35.A OG no hydrogen 2.783 N/A THR 24.A OG1 ASP 22.A OD1 no hydrogen 2.814 N/A THR 28.A N SER 31.A OG no hydrogen 3.308 N/A THR 28.A OG1 SER 31.A OG no hydrogen 3.406 N/A SER 31.A N THR 28.A OG1 no hydrogen 3.280 N/A SER 31.A OG THR 28.A O no hydrogen 3.084 N/A SER 31.A OG THR 28.A OG1 no hydrogen 3.406 N/A LEU 32.A N THR 28.A O no hydrogen 3.111 N/A LEU 33.A N SER 29.A O no hydrogen 2.902 N/A THR 34.A N SER 30.A O no hydrogen 2.940 N/A THR 34.A OG1 SER 30.A O no hydrogen 3.127 N/A SER 35.A N SER 31.A O no hydrogen 3.020 N/A SER 35.A OG HIS 21.A ND1 no hydrogen 2.783 N/A LEU 36.A N LEU 32.A O no hydrogen 2.944 N/A ASN 37.A N LEU 33.A O no hydrogen 2.950 N/A ASN 37.A ND2 GLU 222.A O no hydrogen 2.737 N/A GLN 38.A N THR 34.A O no hydrogen 2.838 N/A LEU 39.A N SER 35.A O no hydrogen 2.830 N/A GLY 40.A N LEU 36.A O no hydrogen 2.843 N/A GLU 41.A N ASN 37.A O no hydrogen 2.973 N/A ARG 42.A N GLN 38.A O no hydrogen 3.248 N/A ARG 42.A NE GLN 38.A OE1 no hydrogen 2.998 N/A ARG 42.A NH1 TYR 18.A O no hydrogen 2.693 N/A GLN 43.A N LEU 39.A O no hydrogen 2.859 N/A GLN 43.A NE2 PHE 96.A O no hydrogen 3.649 N/A LEU 44.A N GLY 40.A O no hydrogen 2.801 N/A LEU 45.A N GLU 41.A O no hydrogen 3.313 N/A SER 46.A N ARG 42.A O no hydrogen 3.184 N/A VAL 47.A N GLN 43.A O no hydrogen 2.776 N/A VAL 48.A N LEU 44.A O no hydrogen 2.919 N/A LYS 49.A N LEU 45.A O no hydrogen 2.812 N/A TRP 50.A N SER 46.A O no hydrogen 2.891 N/A SER 51.A N VAL 47.A O no hydrogen 3.008 N/A SER 51.A OG VAL 48.A O no hydrogen 2.713 N/A LYS 52.A N LYS 49.A O no hydrogen 3.140 N/A SER 53.A N TRP 50.A O no hydrogen 3.051 N/A LEU 54.A N SER 51.A O no hydrogen 3.270 N/A PHE 57.A N LEU 54.A O no hydrogen 3.161 N/A ASN 59.A N GLY 56.A O no hydrogen 3.296 N/A LEU 60.A N PHE 57.A O no hydrogen 2.993 N/A HIS 61.A N SER 155.A OG no hydrogen 2.793 N/A ASP 63.A N HIS 61.A ND1 no hydrogen 2.968 N/A GLN 65.A N HIS 61.A O no hydrogen 3.054 N/A GLN 65.A NE2 LEU 60.A O no hydrogen 2.611 N/A ILE 66.A N ILE 62.A O no hydrogen 3.011 N/A THR 67.A N ASP 63.A O no hydrogen 2.988 N/A THR 67.A OG1 ASP 63.A O no hydrogen 2.820 N/A LEU 68.A N ASP 64.A O no hydrogen 2.794 N/A ILE 69.A N GLN 65.A O no hydrogen 3.109 N/A GLN 70.A N ILE 66.A O no hydrogen 2.850 N/A TYR 71.A N THR 67.A O no hydrogen 2.830 N/A SER 72.A N LEU 68.A O no hydrogen 3.046 N/A SER 72.A OG LEU 68.A O no hydrogen 2.680 N/A LEU 76.A N SER 72.A O no hydrogen 3.020 N/A MET 77.A N TRP 73.A O no hydrogen 3.028 N/A VAL 78.A N MET 74.A O no hydrogen 2.865 N/A PHE 79.A N SER 75.A O no hydrogen 2.920 N/A GLY 80.A N LEU 76.A O no hydrogen 2.918 N/A LEU 81.A N MET 77.A O no hydrogen 3.022 N/A GLY 82.A N VAL 78.A O no hydrogen 3.034 N/A TRP 83.A N PHE 79.A O no hydrogen 3.042 N/A ARG 84.A N GLY 80.A O no hydrogen 2.993 N/A ARG 84.A NE TYR 95.A O no hydrogen 3.144 N/A ARG 84.A NE PHE 96.A O no hydrogen 3.263 N/A ARG 84.A NH2 PHE 96.A O no hydrogen 2.802 N/A SER 85.A N LEU 81.A O no hydrogen 2.955 N/A SER 85.A OG LEU 81.A O no hydrogen 2.567 N/A TYR 86.A N GLY 82.A O no hydrogen 2.931 N/A TYR 86.A OH VAL 131.A O no hydrogen 2.819 N/A LYS 87.A N TRP 83.A O no hydrogen 2.784 N/A HIS 88.A N ARG 84.A O no hydrogen 2.874 N/A VAL 89.A N SER 85.A O no hydrogen 2.983 N/A GLY 91.A N SER 85.A O no hydrogen 2.833 N/A GLN 92.A N VAL 89.A O no hydrogen 2.952 N/A GLN 92.A NE2 SER 90.A O no hydrogen 2.862 N/A LEU 94.A N LEU 102.A O no hydrogen 2.902 N/A TYR 95.A N SER 85.A OG no hydrogen 2.857 N/A ALA 97.A N LEU 100.A O no hydrogen 3.020 N/A LEU 100.A N ALA 97.A O no hydrogen 2.904 N/A LEU 102.A N LEU 94.A O no hydrogen 2.922 N/A GLU 104.A N GLU 104.A OE1 no hydrogen 2.780 N/A ARG 106.A N ASN 103.A O no hydrogen 3.235 N/A ARG 106.A NE ASP 27.A OD2 no hydrogen 3.043 N/A ARG 106.A NH2 ASP 27.A OD1 no hydrogen 3.467 N/A ARG 106.A NH2 ASP 27.A OD2 no hydrogen 3.175 N/A MET 107.A N GLU 104.A O no hydrogen 3.165 N/A LYS 108.A NZ ASP 27.A O no hydrogen 2.793 N/A SER 111.A N GLU 109.A OE2 no hydrogen 3.044 N/A SER 111.A OG GLU 109.A OE2 no hydrogen 2.573 N/A TYR 113.A N GLU 109.A O no hydrogen 2.764 N/A SER 114.A N SER 110.A O no hydrogen 2.789 N/A SER 114.A OG SER 110.A O no hydrogen 2.446 N/A LEU 115.A N SER 111.A O no hydrogen 2.979 N/A CYS 116.A N PHE 112.A O no hydrogen 2.822 N/A CYS 116.A SG PHE 112.A O no hydrogen 3.362 N/A LEU 117.A N TYR 113.A O no hydrogen 2.960 N/A THR 118.A N SER 114.A O no hydrogen 3.096 N/A THR 118.A OG1 GLN 204.A OE1 no hydrogen 3.401 N/A MET 119.A N LEU 115.A O no hydrogen 3.015 N/A TRP 120.A N CYS 116.A O no hydrogen 2.814 N/A TRP 120.A NE1 GLY 91.A O no hydrogen 2.893 N/A GLN 121.A N THR 118.A O no hydrogen 3.216 N/A ILE 122.A N MET 119.A O no hydrogen 3.210 N/A GLN 124.A N TRP 120.A O no hydrogen 3.318 N/A GLU 125.A N GLN 121.A O no hydrogen 3.051 N/A PHE 126.A N ILE 122.A O no hydrogen 3.005 N/A VAL 127.A N PRO 123.A O no hydrogen 2.965 N/A LYS 128.A N GLN 124.A O no hydrogen 3.000 N/A LEU 129.A N GLU 125.A O no hydrogen 2.796 N/A VAL 131.A N PHE 126.A O no hydrogen 3.184 N/A SER 132.A N GLU 135.A OE1 no hydrogen 2.846 N/A GLU 135.A N SER 132.A OG no hydrogen 3.172 N/A PHE 136.A N SER 132.A O no hydrogen 3.042 N/A LEU 137.A N GLN 133.A O no hydrogen 3.010 N/A CYS 138.A N GLU 134.A O no hydrogen 3.416 N/A CYS 138.A SG GLU 134.A O no hydrogen 3.359 N/A MET 139.A N GLU 135.A O no hydrogen 2.922 N/A LYS 140.A N PHE 136.A O no hydrogen 2.792 N/A LYS 140.A NZ GLU 13.A OE1 no hydrogen 2.661 N/A VAL 141.A N LEU 137.A O no hydrogen 3.382 N/A LEU 142.A N CYS 138.A O no hydrogen 3.012 N/A LEU 143.A N MET 139.A O no hydrogen 2.928 N/A LEU 144.A N LYS 140.A O no hydrogen 3.224 N/A LEU 145.A N VAL 141.A O no hydrogen 3.227 N/A LEU 145.A N LEU 142.A O no hydrogen 3.157 N/A ASN 146.A N LEU 143.A O no hydrogen 3.193 N/A ILE 148.A N LYS 244.A O no hydrogen 3.045 N/A GLU 151.A N GLU 151.A OE2 no hydrogen 2.699 N/A GLY 152.A N PRO 149.A O no hydrogen 2.948 N/A LEU 153.A N GLN 156.A OE1 no hydrogen 2.809 N/A ARG 154.A N ASP 64.A OD1 no hydrogen 3.056 N/A SER 155.A N ASP 64.A OD2 no hydrogen 2.642 N/A SER 155.A OG ASP 64.A OD2 no hydrogen 3.352 N/A GLN 156.A NE2 GLU 160.A OE2 no hydrogen 2.546 N/A PHE 159.A N SER 155.A O no hydrogen 2.866 N/A GLU 160.A N GLN 156.A O no hydrogen 3.016 N/A GLU 161.A N THR 157.A O no hydrogen 3.020 N/A MET 162.A N GLN 158.A O no hydrogen 2.892 N/A ARG 163.A N PHE 159.A O no hydrogen 2.909 N/A ARG 163.A NH1 LEU 145.A O no hydrogen 3.047 N/A ARG 163.A NH1 ASN 146.A OD1 no hydrogen 2.798 N/A ARG 163.A NH2 ASN 146.A OD1 no hydrogen 3.499 N/A SER 164.A N GLU 160.A O no hydrogen 2.971 N/A SER 164.A OG GLU 160.A O no hydrogen 3.220 N/A SER 165.A N GLU 161.A O no hydrogen 3.024 N/A SER 165.A OG.A GLU 161.A O no hydrogen 3.370 N/A TYR 166.A N MET 162.A O no hydrogen 3.072 N/A TYR 166.A OH PRO 55.A O no hydrogen 2.665 N/A ILE 167.A N ARG 163.A O no hydrogen 2.977 N/A ARG 168.A N SER 164.A O no hydrogen 3.025 N/A GLU 169.A N SER 165.A O no hydrogen 3.044 N/A LEU 170.A N TYR 166.A O no hydrogen 2.984 N/A ILE 171.A N ILE 167.A O no hydrogen 3.071 N/A LYS 172.A N ARG 168.A O no hydrogen 2.850 N/A LYS 172.A NZ GLU 169.A OE1 no hydrogen 2.813 N/A ALA 173.A N GLU 169.A O no hydrogen 2.787 N/A ILE 174.A N LEU 170.A O no hydrogen 2.849 N/A GLY 175.A N ILE 171.A O no hydrogen 3.101 N/A LEU 176.A N ALA 173.A O no hydrogen 3.219 N/A GLN 178.A N ILE 174.A O no hydrogen 2.716 N/A LYS 179.A NZ GLY 175.A O no hydrogen 3.249 N/A LYS 179.A NZ LEU 176.A O no hydrogen 3.015 N/A SER 183.A OG GLN 178.A OE1 no hydrogen 3.381 N/A SER 184.A N GLY 180.A O no hydrogen 3.031 N/A SER 184.A OG GLN 178.A O no hydrogen 2.829 N/A SER 184.A OG GLY 180.A O no hydrogen 3.099 N/A SER 185.A N VAL 181.A O no hydrogen 2.896 N/A SER 185.A OG.A VAL 181.A O no hydrogen 2.645 N/A SER 185.A OG.A VAL 182.A O no hydrogen 2.734 N/A SER 185.A OG.B VAL 181.A O no hydrogen 2.463 N/A GLN 186.A N VAL 182.A O no hydrogen 2.910 N/A ARG 187.A N SER 183.A O no hydrogen 2.908 N/A ARG 187.A NE GLU 135.A OE2 no hydrogen 3.026 N/A ARG 187.A NH1 LEU 129.A O no hydrogen 2.680 N/A ARG 187.A NH2 LEU 129.A O no hydrogen 3.199 N/A ARG 187.A NH2 GLN 130.A O no hydrogen 3.362 N/A ARG 187.A NH2 GLU 135.A OE1 no hydrogen 2.797 N/A ARG 187.A NH2 GLU 135.A OE2 no hydrogen 3.394 N/A PHE 188.A N SER 184.A O no hydrogen 2.940 N/A TYR 189.A N SER 185.A O no hydrogen 3.054 N/A GLN 190.A N GLN 186.A O no hydrogen 3.013 N/A LEU 191.A N ARG 187.A O no hydrogen 2.952 N/A THR 192.A N PHE 188.A O no hydrogen 2.999 N/A THR 192.A OG1 PHE 188.A O no hydrogen 2.668 N/A THR 192.A OG1 TYR 189.A O no hydrogen 3.245 N/A THR 192.A OG1 HIS 249.A NE2 no hydrogen 3.091 N/A LYS 193.A N TYR 189.A O no hydrogen 2.853 N/A LEU 194.A N GLN 190.A O no hydrogen 3.003 N/A LEU 195.A N LEU 191.A O no hydrogen 3.227 N/A ASP 196.A N THR 192.A O no hydrogen 3.008 N/A ASN 197.A N LYS 193.A O no hydrogen 2.860 N/A LEU 198.A N LEU 194.A O no hydrogen 3.259 N/A LEU 198.A N LEU 195.A O no hydrogen 3.135 N/A HIS 199.A N ASP 196.A O no hydrogen 3.325 N/A HIS 199.A NE2 LEU 246.A O no hydrogen 2.878 N/A VAL 202.A N LEU 198.A O no hydrogen 2.835 N/A LYS 203.A N HIS 199.A O no hydrogen 3.085 N/A GLN 204.A N LEU 201.A O no hydrogen 3.116 N/A LEU 205.A N LEU 201.A O no hydrogen 3.385 N/A HIS 206.A N VAL 202.A O no hydrogen 2.779 N/A LEU 207.A N LYS 203.A O no hydrogen 3.090 N/A TYR 208.A N GLN 204.A O no hydrogen 3.147 N/A CYS 209.A N LEU 205.A O no hydrogen 2.919 N/A LEU 210.A N HIS 206.A O no hydrogen 2.997 N/A ASN 211.A N LEU 207.A O no hydrogen 2.942 N/A THR 212.A N TYR 208.A O no hydrogen 2.884 N/A THR 212.A OG1 TYR 208.A O no hydrogen 2.641 N/A PHE 213.A N CYS 209.A O no hydrogen 2.822 N/A ILE 214.A N LEU 210.A O no hydrogen 2.903 N/A GLN 215.A N ASN 211.A O no hydrogen 3.065 N/A SER 216.A N PHE 213.A O no hydrogen 3.109 N/A SER 216.A OG PHE 213.A O no hydrogen 3.083 N/A LEU 219.A N GLN 215.A O no hydrogen 2.971 N/A VAL 221.A N SER 216.A O no hydrogen 2.902 N/A GLU 222.A N THR 34.A OG1 no hydrogen 3.133 N/A MET 226.A N GLU 41.A OE2 no hydrogen 2.845 N/A MET 227.A N GLU 41.A OE1 no hydrogen 2.801 N/A SER 228.A N PRO 224.A O no hydrogen 2.986 N/A SER 228.A OG PHE 223.A O no hydrogen 3.355 N/A SER 228.A OG PRO 224.A O no hydrogen 2.870 N/A GLU 229.A N GLU 225.A O no hydrogen 3.178 N/A GLU 229.A N MET 226.A O no hydrogen 3.208 N/A VAL 230.A N MET 226.A O no hydrogen 3.165 N/A ILE 231.A N MET 227.A O no hydrogen 3.048 N/A ALA 232.A N SER 228.A O no hydrogen 2.956 N/A ALA 233.A N GLU 229.A O no hydrogen 2.685 N/A GLN 234.A N VAL 230.A O no hydrogen 3.121 N/A GLN 234.A NE2 GLN 70.A OE1 no hydrogen 3.225 N/A LEU 235.A N ILE 231.A O no hydrogen 2.918 N/A ILE 238.A N GLN 234.A O no hydrogen 2.887 N/A LEU 239.A N LEU 235.A O no hydrogen 2.894 N/A ALA 240.A N PRO 236.A O no hydrogen 2.887 N/A GLY 241.A N ILE 238.A O no hydrogen 2.901 N/A MET 242.A N LYS 237.A O no hydrogen 3.030 N/A LYS 244.A N ILE 148.A O no hydrogen 2.645 N/A LEU 246.A N ASN 146.A O no hydrogen 2.692 N/A PHE 248.A N ASP 196.A OD1 no hydrogen 2.824 N/A HIS 249.A N ASP 196.A OD2 no hydrogen 2.874 N/A HIS 249.A NE2 THR 192.A OG1 no hydrogen 3.091 N/A