Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4as0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N LEU 2.A O no hydrogen 3.271 N/A GLN 7.A N ILE 24.A O no hydrogen 2.906 N/A GLY 9.A N SER 22.A O no hydrogen 2.839 N/A LEU 12.A N VAL 20.A O no hydrogen 2.741 N/A GLY 13.A N VAL 20.A O no hydrogen 3.388 N/A GLY 15.A N GLY 18.A O no hydrogen 2.905 N/A GLY 18.A N GLY 15.A O no hydrogen 2.894 N/A SER 19.A N HIS 36.A O no hydrogen 3.001 N/A VAL 20.A N GLY 13.A O no hydrogen 2.975 N/A TYR 21.A N ILE 34.A O no hydrogen 2.817 N/A SER 22.A N PRO 10.A O no hydrogen 2.941 N/A GLY 23.A N VAL 32.A O no hydrogen 2.985 N/A ILE 24.A N GLN 7.A O no hydrogen 3.072 N/A ARG 25.A N LEU 30.A O no hydrogen 2.863 N/A ARG 25.A NE ASP 28.A OD1 no hydrogen 3.176 N/A ARG 25.A NH2 ASP 28.A OD2 no hydrogen 2.831 N/A VAL 26.A N GLN 5.A O no hydrogen 3.113 N/A LEU 30.A N ASP 28.A OD1 no hydrogen 3.112 N/A VAL 32.A N GLY 23.A O no hydrogen 2.987 N/A ALA 33.A N LEU 88.A O no hydrogen 2.763 N/A ILE 34.A N TYR 21.A O no hydrogen 2.860 N/A LYS 35.A N LEU 86.A O no hydrogen 2.842 N/A LYS 35.A NZ GLU 57.A OE2 no hydrogen 2.486 N/A LYS 35.A NZ ASP 154.A OD1 no hydrogen 3.297 N/A HIS 36.A N SER 19.A O no hydrogen 2.857 N/A VAL 37.A N PHE 84.A O no hydrogen 3.065 N/A LYS 39.A N ASP 82.A O no hydrogen 2.828 N/A LYS 39.A NZ GLU 79.A OE2 no hydrogen 2.698 N/A LYS 39.A NZ ARG 80.A O no hydrogen 3.031 N/A LYS 39.A NZ PRO 81.A O no hydrogen 3.409 N/A ARG 41.A N GLU 38.A O no hydrogen 3.205 N/A ILE 42.A N LYS 39.A O no hydrogen 3.285 N/A SER 43.A OG ASP 44.A OD1 no hydrogen 3.243 N/A GLY 46.A N VAL 54.A O no hydrogen 2.787 N/A LEU 48.A N THR 52.A O no hydrogen 2.947 N/A GLY 51.A N LEU 48.A O no hydrogen 2.683 N/A THR 52.A N ASN 50.A OD1 no hydrogen 3.329 N/A THR 52.A OG1 ASN 50.A OD1 no hydrogen 2.690 N/A VAL 54.A N GLY 46.A O no hydrogen 3.055 N/A MET 56.A N ASP 44.A O no hydrogen 2.875 N/A VAL 58.A N PRO 55.A O no hydrogen 2.915 N/A VAL 59.A N PRO 55.A O no hydrogen 3.490 N/A LEU 60.A N MET 56.A O no hydrogen 2.835 N/A LEU 61.A N GLU 57.A O no hydrogen 2.849 N/A LYS 62.A N VAL 58.A O no hydrogen 3.003 N/A LYS 63.A N VAL 59.A O no hydrogen 3.056 N/A LYS 63.A NZ CYS 129.A O no hydrogen 3.248 N/A VAL 64.A N LEU 60.A O no hydrogen 3.138 N/A SER 65.A OG LEU 61.A O no hydrogen 2.518 N/A SER 66.A N VAL 64.A O no hydrogen 2.959 N/A PHE 68.A N SER 66.A O no hydrogen 2.807 N/A SER 69.A OG GLU 149.A OE1 no hydrogen 3.171 N/A ILE 72.A N LEU 152.A O no hydrogen 3.082 N/A ARG 73.A N GLU 89.A OE1 no hydrogen 3.058 N/A LEU 74.A N SER 65.A OG no hydrogen 3.197 N/A LEU 75.A N ILE 87.A O no hydrogen 2.813 N/A ASP 76.A N ILE 87.A O no hydrogen 3.415 N/A TRP 77.A N ASP 76.A OD1 no hydrogen 2.789 N/A PHE 78.A N VAL 85.A O no hydrogen 2.776 N/A ARG 80.A N SER 83.A O no hydrogen 2.796 N/A PHE 84.A N VAL 37.A O no hydrogen 2.948 N/A VAL 85.A N PHE 78.A O no hydrogen 2.836 N/A LEU 86.A N LYS 35.A O no hydrogen 2.831 N/A ILE 87.A N ASP 76.A O no hydrogen 2.817 N/A LEU 88.A N ALA 33.A O no hydrogen 2.890 N/A GLU 89.A N ARG 73.A O no hydrogen 3.124 N/A ARG 90.A NE VAL 32.A O no hydrogen 2.978 N/A ARG 90.A NH1 GLU 92.A OE2 no hydrogen 3.264 N/A ARG 90.A NH2 GLY 23.A O no hydrogen 2.936 N/A GLN 95.A N ILE 143.A O no hydrogen 3.222 N/A GLN 95.A NE2 ASP 99.A OD2 no hydrogen 2.675 N/A LEU 97.A N ILE 141.A O no hydrogen 2.949 N/A ASP 99.A N ASP 96.A OD1 no hydrogen 2.662 N/A PHE 100.A N ASP 96.A O no hydrogen 2.934 N/A ILE 101.A N LEU 97.A O no hydrogen 2.837 N/A THR 102.A N PHE 98.A O no hydrogen 2.876 N/A THR 102.A OG1 PHE 98.A O no hydrogen 2.965 N/A GLU 103.A N ASP 99.A O no hydrogen 2.954 N/A ARG 104.A N PHE 100.A O no hydrogen 2.966 N/A ARG 104.A NH1 HIS 271.A O no hydrogen 3.030 N/A ARG 104.A NH2 HIS 271.A O no hydrogen 2.872 N/A GLY 105.A N ILE 101.A O no hydrogen 2.765 N/A LEU 107.A N MET 203.A O no hydrogen 2.880 N/A ALA 112.A N GLN 108.A O no hydrogen 3.042 N/A ARG 113.A N GLU 109.A O no hydrogen 2.839 N/A ARG 113.A NE TRP 257.A O no hydrogen 2.776 N/A ARG 113.A NH2 TRP 257.A O no hydrogen 3.433 N/A SER 114.A N GLU 110.A O no hydrogen 3.290 N/A SER 114.A OG THR 267.A OG1 no hydrogen 2.783 N/A PHE 115.A N LEU 111.A O no hydrogen 3.000 N/A PHE 116.A N ALA 112.A O no hydrogen 2.832 N/A TRP 117.A N ARG 113.A O no hydrogen 3.014 N/A GLN 118.A N SER 114.A O no hydrogen 3.020 N/A GLN 118.A NE2 GLY 148.A O no hydrogen 2.982 N/A VAL 119.A N PHE 115.A O no hydrogen 2.968 N/A LEU 120.A N PHE 116.A O no hydrogen 2.791 N/A GLU 121.A N TRP 117.A O no hydrogen 2.929 N/A ALA 122.A N GLN 118.A O no hydrogen 3.032 N/A VAL 123.A N VAL 119.A O no hydrogen 2.933 N/A ARG 124.A N LEU 120.A O no hydrogen 3.015 N/A ARG 124.A NH1 GLN 253.A OE1 no hydrogen 3.064 N/A HIS 125.A N GLU 121.A O no hydrogen 3.083 N/A HIS 125.A NE2 VAL 64.A O no hydrogen 2.987 N/A CYS 126.A N ALA 122.A O no hydrogen 3.123 N/A CYS 126.A SG ALA 122.A O no hydrogen 3.530 N/A HIS 127.A N VAL 123.A O no hydrogen 2.891 N/A ASN 128.A N ARG 124.A O no hydrogen 2.903 N/A CYS 129.A N HIS 125.A O no hydrogen 3.014 N/A CYS 129.A SG LYS 63.A O no hydrogen 3.443 N/A CYS 129.A SG HIS 125.A O no hydrogen 3.399 N/A GLY 130.A N HIS 127.A O no hydrogen 3.005 N/A VAL 131.A N CYS 126.A O no hydrogen 2.865 N/A LEU 132.A N ALA 159.A O no hydrogen 2.895 N/A HIS 133.A NE2 ILE 153.A O no hydrogen 2.819 N/A ARG 134.A NE SER 157.A O no hydrogen 2.808 N/A ARG 134.A NH1 ASP 168.A OD2 no hydrogen 3.264 N/A ARG 134.A NH1 TYR 186.A OH no hydrogen 2.979 N/A ARG 134.A NH2 SER 157.A O no hydrogen 3.047 N/A ARG 134.A NH2 GLY 158.A O no hydrogen 3.041 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 2.963 N/A LYS 137.A NZ THR 172.A OG1 no hydrogen 2.728 N/A ASP 138.A N TYR 175.A OH no hydrogen 3.438 N/A ASN 140.A N LYS 137.A O no hydrogen 3.015 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.834 N/A ASN 140.A ND2 ASP 135.A OD2 no hydrogen 3.059 N/A ILE 141.A N ASP 138.A O no hydrogen 3.314 N/A LEU 142.A N LYS 151.A O no hydrogen 2.810 N/A ILE 143.A N GLN 95.A O no hydrogen 2.875 N/A ASP 144.A N GLU 149.A O no hydrogen 2.763 N/A LEU 145.A N PRO 93.A O no hydrogen 3.246 N/A ARG 147.A N ASP 144.A OD1 no hydrogen 3.244 N/A GLY 148.A N ASP 144.A O no hydrogen 2.818 N/A LEU 150.A N GLN 118.A OE1 no hydrogen 2.925 N/A LYS 151.A N LEU 142.A O no hydrogen 2.788 N/A LYS 151.A NZ SER 69.A O no hydrogen 2.670 N/A LEU 152.A N GLY 70.A O no hydrogen 2.950 N/A ILE 153.A N ASN 140.A O no hydrogen 2.932 N/A GLY 156.A N ASP 154.A OD1 no hydrogen 3.124 N/A SER 157.A OG ASP 170.A O no hydrogen 3.303 N/A GLY 158.A N PHE 155.A O no hydrogen 3.168 N/A ALA 159.A N LEU 132.A O no hydrogen 2.904 N/A LEU 161.A N GLY 130.A O no hydrogen 2.724 N/A LYS 162.A N TYR 166.A OH no hydrogen 3.038 N/A LYS 162.A NZ VAL 165.A O no hydrogen 3.217 N/A TYR 166.A N TYR 186.A O no hydrogen 2.761 N/A TYR 166.A OH LEU 160.A O no hydrogen 2.640 N/A THR 172.A N ASP 135.A OD1 no hydrogen 3.010 N/A THR 172.A OG1 ASP 135.A OD1 no hydrogen 2.766 N/A ARG 173.A NE ASP 213.A OD1 no hydrogen 3.147 N/A ARG 173.A NH2 ASP 213.A OD2 no hydrogen 3.139 N/A TYR 175.A N THR 172.A O no hydrogen 3.152 N/A SER 176.A N ARG 173.A O no hydrogen 2.841 N/A SER 176.A OG ARG 173.A O no hydrogen 2.568 N/A GLU 179.A N GLU 179.A OE1 no hydrogen 2.766 N/A TRP 180.A N PRO 177.A O no hydrogen 3.087 N/A ILE 181.A N PRO 177.A O no hydrogen 3.270 N/A ARG 182.A N PRO 178.A O no hydrogen 2.720 N/A TYR 183.A N GLU 179.A O no hydrogen 3.028 N/A HIS 184.A N TRP 180.A O no hydrogen 2.888 N/A ARG 185.A N GLU 179.A O no hydrogen 3.388 N/A TYR 186.A N TYR 166.A O no hydrogen 3.144 N/A TYR 186.A OH ASP 168.A O no hydrogen 2.649 N/A ARG 189.A NH1 ASP 163.A OD1 no hydrogen 2.631 N/A ALA 191.A N HIS 187.A O no hydrogen 3.105 N/A ALA 192.A N GLY 188.A O no hydrogen 2.961 N/A VAL 193.A N ARG 189.A O no hydrogen 2.979 N/A TRP 194.A N SER 190.A O no hydrogen 3.190 N/A SER 195.A N ALA 191.A O no hydrogen 3.159 N/A SER 195.A OG ALA 192.A O no hydrogen 2.970 N/A LEU 196.A N ALA 192.A O no hydrogen 3.035 N/A GLY 197.A N VAL 193.A O no hydrogen 3.050 N/A ILE 198.A N TRP 194.A O no hydrogen 3.025 N/A LEU 199.A N SER 195.A O no hydrogen 2.954 N/A LEU 200.A N LEU 196.A O no hydrogen 2.805 N/A TYR 201.A N GLY 197.A O no hydrogen 3.041 N/A TYR 201.A OH PHE 222.A O no hydrogen 2.663 N/A ASP 202.A N ILE 198.A O no hydrogen 2.979 N/A MET 203.A N LEU 199.A O no hydrogen 2.945 N/A VAL 204.A N LEU 200.A O no hydrogen 3.069 N/A CYS 205.A N TYR 201.A O no hydrogen 2.828 N/A GLY 206.A N ASP 202.A O no hydrogen 2.880 N/A ILE 208.A N ASP 207.A OD1 no hydrogen 2.816 N/A GLU 211.A N GLU 215.A OE1 no hydrogen 2.761 N/A HIS 212.A N GLU 215.A OE1 no hydrogen 2.747 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.874 N/A GLU 215.A N HIS 212.A O no hydrogen 2.899 N/A ILE 216.A N HIS 212.A O no hydrogen 3.105 N/A ILE 217.A N ASP 213.A O no hydrogen 2.999 N/A GLY 218.A N GLU 215.A O no hydrogen 3.239 N/A GLY 219.A N GLU 215.A O no hydrogen 3.266 N/A ARG 224.A NE TYR 201.A OH no hydrogen 3.389 N/A SER 228.A N GLU 109.A OE2 no hydrogen 2.772 N/A SER 228.A OG GLU 109.A OE1 no hydrogen 2.602 N/A SER 228.A OG GLU 109.A OE2 no hydrogen 3.450 N/A CYS 231.A N SER 228.A OG no hydrogen 3.242 N/A GLN 232.A N SER 228.A O no hydrogen 2.943 N/A GLN 232.A NE2 VAL 227.A O no hydrogen 3.430 N/A HIS 233.A N SER 229.A O no hydrogen 3.046 N/A HIS 233.A ND1 HIS 255.A NE2 no hydrogen 2.824 N/A LEU 234.A N GLU 230.A O no hydrogen 3.126 N/A ILE 235.A N CYS 231.A O no hydrogen 3.048 N/A ARG 236.A N GLN 232.A O no hydrogen 2.922 N/A ARG 236.A NH1 GLN 232.A OE1 no hydrogen 2.692 N/A ARG 236.A NH2 VAL 221.A O no hydrogen 2.950 N/A TRP 237.A N HIS 233.A O no hydrogen 2.980 N/A CYS 238.A N LEU 234.A O no hydrogen 3.015 N/A CYS 238.A SG LEU 234.A O no hydrogen 3.400 N/A LEU 239.A N ILE 235.A O no hydrogen 3.018 N/A ALA 240.A N TRP 237.A O no hydrogen 3.083 N/A ASP 245.A N ARG 242.A O no hydrogen 2.967 N/A ARG 246.A N PRO 243.A O no hydrogen 3.050 N/A ARG 246.A NE ALA 240.A O no hydrogen 2.741 N/A ARG 246.A NH1 GLU 179.A OE2 no hydrogen 2.843 N/A ARG 246.A NH1 SER 190.A O no hydrogen 3.018 N/A ARG 246.A NH2 GLU 179.A OE1 no hydrogen 2.870 N/A ARG 246.A NH2 ALA 240.A O no hydrogen 3.175 N/A ARG 246.A NH2 LEU 241.A O no hydrogen 3.285 N/A THR 248.A N GLU 251.A OE1 no hydrogen 2.861 N/A THR 248.A OG1 GLU 251.A OE1 no hydrogen 3.184 N/A GLU 251.A N THR 248.A OG1 no hydrogen 2.986 N/A ILE 252.A N THR 248.A O no hydrogen 2.902 N/A GLN 253.A N PHE 249.A O no hydrogen 2.867 N/A GLN 253.A NE2 GLU 121.A OE2 no hydrogen 2.796 N/A ASN 254.A N GLU 250.A O no hydrogen 2.875 N/A HIS 255.A N ILE 252.A O no hydrogen 3.002 N/A HIS 255.A NE2 HIS 233.A ND1 no hydrogen 2.824 N/A TRP 257.A N HIS 255.A ND1 no hydrogen 2.986 N/A TRP 257.A NE1 GLU 109.A OE1 no hydrogen 2.880 N/A MET 258.A N HIS 255.A O no hydrogen 2.925 N/A GLN 259.A N PRO 256.A O no hydrogen 3.412 N/A GLN 259.A NE2 GLN 253.A O no hydrogen 3.221 N/A GLN 259.A NE2 HIS 255.A O no hydrogen 2.752 N/A LEU 263.A N GLU 266.A OE1 no hydrogen 2.980 N/A THR 267.A N LEU 263.A O no hydrogen 2.875 N/A THR 267.A OG1 SER 114.A OG no hydrogen 2.783 N/A THR 267.A OG1 LEU 263.A O no hydrogen 2.932 N/A ALA 268.A N PRO 264.A O no hydrogen 2.866 N/A GLU 269.A N GLN 265.A O no hydrogen 2.966 N/A ILE 270.A N GLU 266.A O no hydrogen 2.967 N/A HIS 271.A N THR 267.A O no hydrogen 2.960 N/A HIS 271.A NE2 GLU 110.A OE1 no hydrogen 2.956 N/A LEU 272.A N ALA 268.A O no hydrogen 3.019 N/A HIS 273.A N ALA 268.A O no hydrogen 2.676 N/A HIS 273.A NE2 ASN 146.A O no hydrogen 3.114 N/A