Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5aoc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 5.A N GLU 2.A O no hydrogen 3.222 N/A LEU 6.A N VAL 3.A O no hydrogen 3.290 N/A TYR 8.A OH ASP 81.A OD2 no hydrogen 2.449 N/A ALA 15.A N MET 12.A O no hydrogen 3.051 N/A GLU 16.A N ILE 32.A O no hydrogen 2.938 N/A LYS 18.A N LEU 30.A O no hydrogen 3.053 N/A TYR 20.A N LEU 28.A O no hydrogen 2.907 N/A TYR 20.A OH ASP 81.A O no hydrogen 2.566 N/A LYS 21.A NZ ASP 98.A OD1 no hydrogen 2.751 N/A LYS 21.A NZ SER 101.A OG no hydrogen 3.190 N/A LYS 22.A NZ ASP 27.A OD1 no hydrogen 3.093 N/A VAL 23.A N VAL 26.A O no hydrogen 3.135 N/A VAL 26.A N VAL 23.A O no hydrogen 2.720 N/A LEU 28.A N LYS 21.A O no hydrogen 2.776 N/A LEU 30.A N LYS 18.A O no hydrogen 2.658 N/A TYR 31.A N ALA 79.A O no hydrogen 2.921 N/A ILE 32.A N GLU 16.A O no hydrogen 2.712 N/A TYR 33.A N ALA 77.A O no hydrogen 2.741 N/A TYR 33.A OH PRO 13.A O no hydrogen 3.346 N/A LYS 34.A NZ GLU 16.A OE2 no hydrogen 2.814 N/A TRP 38.A N PRO 35.A O no hydrogen 3.001 N/A TRP 38.A NE1 LEU 113.A O no hydrogen 2.799 N/A LYS 39.A N ASP 42.A OD2 no hydrogen 2.814 N/A ASP 42.A N LYS 39.A O no hydrogen 3.006 N/A ARG 43.A NE.B VAL 115.A O no hydrogen 3.405 N/A ARG 43.A NH2.B VAL 115.A O no hydrogen 3.044 N/A ARG 44.A N GLY 114.A O no hydrogen 2.886 N/A ARG 44.A NE ASP 42.A OD2 no hydrogen 2.831 N/A ARG 44.A NH1 GLY 74.A O no hydrogen 2.821 N/A ARG 44.A NH2 ASP 37.A OD2 no hydrogen 3.191 N/A ARG 44.A NH2 ASP 42.A OD2 no hydrogen 3.120 N/A SER 45.A OG PHE 272.A O no hydrogen 2.722 N/A ALA 46.A N LYS 119.A O no hydrogen 2.838 N/A ILE 47.A N VAL 76.A O no hydrogen 2.997 N/A VAL 48.A N VAL 121.A O no hydrogen 2.844 N/A PHE 49.A N MET 78.A O no hydrogen 2.736 N/A PHE 50.A N SER 123.A O no hydrogen 2.767 N/A GLY 52.A N GLN 62.A OE1 no hydrogen 2.879 N/A GLN 56.A N GLY 53.A O no hydrogen 3.020 N/A SER 57.A N GLY 53.A O no hydrogen 3.062 N/A SER 59.A OG ARG 7.A O no hydrogen 2.587 N/A ALA 61.A N SER 59.A OG no hydrogen 3.220 N/A GLN 62.A N SER 59.A O no hydrogen 3.059 N/A GLN 62.A NE2 ASN 247.A OD1 no hydrogen 2.853 N/A PHE 63.A N PRO 60.A O no hydrogen 3.138 N/A ARG 64.A N ALA 61.A O no hydrogen 3.195 N/A GLN 66.A N GLN 66.A OE1 no hydrogen 2.758 N/A CYS 67.A N PHE 63.A O no hydrogen 2.951 N/A CYS 67.A SG PHE 63.A O no hydrogen 3.446 N/A GLU 68.A N ARG 64.A O no hydrogen 3.034 N/A TYR 69.A N PRO 65.A O no hydrogen 2.958 N/A TYR 69.A OH ASP 264.A OD2 no hydrogen 2.504 N/A PHE 70.A N GLN 66.A O no hydrogen 3.018 N/A ALA 71.A N CYS 67.A O no hydrogen 2.798 N/A GLY 72.A N GLU 68.A O no hydrogen 2.997 N/A ARG 73.A N TYR 69.A O no hydrogen 3.140 N/A ARG 73.A N PHE 70.A O no hydrogen 3.116 N/A ARG 73.A NE ASP 264.A OD1 no hydrogen 3.428 N/A ARG 73.A NE ASP 264.A OD2 no hydrogen 2.609 N/A ARG 73.A NH1 ALA 274.A O no hydrogen 3.352 N/A ARG 73.A NH2 ASP 264.A OD1 no hydrogen 2.808 N/A ARG 73.A NH2 ALA 274.A O no hydrogen 2.934 N/A GLY 74.A N ALA 71.A O no hydrogen 2.933 N/A MET 75.A N PHE 70.A O no hydrogen 3.033 N/A VAL 76.A N SER 45.A O no hydrogen 3.058 N/A ALA 77.A N TYR 33.A O no hydrogen 2.966 N/A MET 78.A N ILE 47.A O no hydrogen 2.820 N/A ALA 79.A N TYR 31.A O no hydrogen 3.105 N/A ALA 80.A N PHE 49.A O no hydrogen 2.941 N/A ASP 81.A N LYS 29.A O no hydrogen 2.921 N/A TYR 82.A N ASP 81.A OD1 no hydrogen 2.898 N/A TYR 82.A OH PHE 51.A O no hydrogen 2.571 N/A ARG 83.A N ASP 98.A OD2 no hydrogen 2.940 N/A ARG 83.A NE ASP 98.A OD1 no hydrogen 3.334 N/A ARG 83.A NE ASP 98.A OD2 no hydrogen 2.875 N/A ARG 83.A NH1 ASP 24.A OD2 no hydrogen 2.941 N/A ARG 83.A NH2 ASP 98.A OD1 no hydrogen 2.744 N/A VAL 84.A N HIS 88.A ND1 no hydrogen 3.189 N/A GLY 85.A N TRP 55.A O no hydrogen 2.860 N/A SER 86.A N GLN 56.A O no hydrogen 2.916 N/A SER 86.A OG GLN 56.A O no hydrogen 2.633 N/A ARG 87.A NH1 GLY 58.A O no hydrogen 3.426 N/A ARG 87.A NH2 GLY 58.A O no hydrogen 2.760 N/A HIS 88.A N VAL 84.A O no hydrogen 2.943 N/A ASN 89.A N GLY 85.A O no hydrogen 2.949 N/A LYS 91.A N ASP 94.A OD2 no hydrogen 2.822 N/A LYS 91.A NZ.A GLU 181.A O no hydrogen 2.568 N/A ALA 93.A N LEU 183.A O no hydrogen 2.993 N/A ASP 94.A N LYS 91.A O no hydrogen 2.888 N/A CYS 95.A N LYS 91.A O no hydrogen 3.364 N/A CYS 95.A SG ARG 83.A O no hydrogen 3.164 N/A CYS 95.A SG LYS 91.A O no hydrogen 3.675 N/A VAL 96.A N VAL 92.A O no hydrogen 2.976 N/A ALA 97.A N ALA 93.A O no hydrogen 3.038 N/A ASP 98.A N ASP 94.A O no hydrogen 2.955 N/A ALA 99.A N CYS 95.A O no hydrogen 2.957 N/A LYS 100.A N VAL 96.A O no hydrogen 3.041 N/A LYS 100.A NZ VAL 138.A O no hydrogen 2.673 N/A LYS 100.A NZ ASP 140.A OD1 no hydrogen 2.776 N/A SER 101.A N ALA 97.A O no hydrogen 2.908 N/A SER 101.A OG ALA 97.A O no hydrogen 2.906 N/A SER 101.A OG GLU 146.A OE1 no hydrogen 2.536 N/A SER 101.A OG GLU 146.A OE2 no hydrogen 3.220 N/A ALA 102.A N ASP 98.A O no hydrogen 2.987 N/A ILE 103.A N ALA 99.A O no hydrogen 3.141 N/A ARG 104.A N LYS 100.A O no hydrogen 2.897 N/A ARG 104.A NE.A GLU 146.A OE2 no hydrogen 2.625 N/A ARG 104.A NE.B ASP 147.A O no hydrogen 3.238 N/A ARG 104.A NE.B ILE 150.A O no hydrogen 2.704 N/A ARG 104.A NH1.A ASP 140.A OD2 no hydrogen 3.537 N/A ARG 104.A NH1.A ILE 150.A O no hydrogen 2.972 N/A ARG 104.A NH1.B ASP 140.A OD2 no hydrogen 3.509 N/A ARG 104.A NH1.B GLU 146.A OE2 no hydrogen 2.716 N/A ARG 104.A NH2.A ASP 140.A OD2 no hydrogen 3.095 N/A ARG 104.A NH2.A GLU 146.A OE2 no hydrogen 2.744 N/A ARG 104.A NH2.B ASP 140.A OD2 no hydrogen 3.173 N/A ARG 104.A NH2.B ILE 150.A O no hydrogen 2.961 N/A TRP 105.A N SER 101.A O no hydrogen 2.808 N/A VAL 106.A N ALA 102.A O no hydrogen 2.890 N/A ARG 107.A N ILE 103.A O no hydrogen 2.945 N/A ARG 107.A NE PRO 117.A O no hydrogen 2.747 N/A ARG 107.A NH1 SER 151.A O no hydrogen 2.963 N/A ARG 107.A NH1 GLN 153.A O no hydrogen 2.676 N/A ARG 107.A NH2 PRO 117.A O no hydrogen 3.033 N/A ARG 107.A NH2 GLN 153.A O no hydrogen 2.946 N/A ARG 107.A NH2 ASN 155.A OD1 no hydrogen 2.840 N/A GLN 108.A N ARG 104.A O no hydrogen 2.829 N/A HIS 109.A N TRP 105.A O no hydrogen 2.845 N/A HIS 109.A ND1 GLU 112.A OE1 no hydrogen 2.811 N/A ALA 110.A N ARG 107.A O no hydrogen 3.290 N/A LEU 113.A N HIS 109.A O no hydrogen 3.075 N/A GLY 114.A N ALA 111.A O no hydrogen 3.068 N/A VAL 115.A N ALA 110.A O no hydrogen 2.802 N/A ASP 116.A N ARG 44.A O no hydrogen 2.728 N/A GLN 118.A N ASP 116.A OD1 no hydrogen 2.973 N/A LYS 119.A N ASP 116.A O no hydrogen 2.995 N/A LYS 119.A NZ GLY 271.A O no hydrogen 3.334 N/A ILE 120.A N ASN 155.A OD1 no hydrogen 2.933 N/A VAL 121.A N ALA 46.A O no hydrogen 2.786 N/A ALA 122.A N ALA 156.A O no hydrogen 2.981 N/A SER 123.A N VAL 48.A O no hydrogen 2.958 N/A SER 123.A OG ILE 158.A O no hydrogen 2.555 N/A GLY 125.A N PHE 50.A O no hydrogen 3.260 N/A SER 126.A N PHE 160.A O no hydrogen 2.867 N/A SER 126.A OG HIS 243.A NE2 no hydrogen 2.841 N/A GLY 128.A N GLY 125.A O no hydrogen 2.807 N/A HIS 130.A N SER 126.A O no hydrogen 2.870 N/A HIS 130.A NE2 VAL 190.A O no hydrogen 2.757 N/A LEU 131.A N ALA 127.A O no hydrogen 3.080 N/A ALA 132.A N GLY 128.A O no hydrogen 2.955 N/A ALA 133.A N GLY 129.A O no hydrogen 2.904 N/A CYS 134.A N HIS 130.A O no hydrogen 2.863 N/A CYS 134.A SG HIS 130.A NE2 no hydrogen 3.331 N/A CYS 134.A SG HIS 130.A O no hydrogen 3.379 N/A THR 135.A N LEU 131.A O no hydrogen 3.006 N/A THR 135.A OG1 ALA 132.A O no hydrogen 2.701 N/A VAL 136.A N ALA 132.A O no hydrogen 3.331 N/A VAL 136.A N ALA 133.A O no hydrogen 3.199 N/A MET 137.A N ALA 133.A O no hydrogen 3.099 N/A VAL 138.A N CYS 134.A O no hydrogen 3.094 N/A THR 149.A N ASP 147.A OD1 no hydrogen 3.231 N/A THR 149.A OG1 ASP 147.A OD1 no hydrogen 2.647 N/A THR 149.A OG1 ASP 147.A OD2 no hydrogen 3.457 N/A ILE 150.A N ASP 147.A O no hydrogen 2.960 N/A SER 152.A OG ASP 140.A OD1 no hydrogen 2.672 N/A SER 152.A OG ASP 140.A OD2 no hydrogen 3.392 N/A GLN 153.A N SER 151.A OG no hydrogen 3.046 N/A GLN 153.A NE2 VAL 136.A O no hydrogen 2.748 N/A ALA 154.A N THR 135.A O no hydrogen 3.135 N/A ASN 155.A N ILE 120.A O no hydrogen 2.771 N/A ASN 155.A ND2 GLN 118.A OE1 no hydrogen 2.962 N/A ALA 157.A N PRO 202.A O no hydrogen 3.113 N/A ILE 158.A N ALA 122.A O no hydrogen 2.987 N/A LEU 159.A N ILE 204.A O no hydrogen 2.923 N/A PHE 160.A N GLY 124.A O no hydrogen 2.939 N/A ASN 161.A N PHE 206.A O no hydrogen 2.747 N/A ASN 161.A ND2 ASN 161.A O no hydrogen 2.647 N/A VAL 163.A N SER 126.A O no hydrogen 3.483 N/A LEU 166.A N SER 191.A OG no hydrogen 2.889 N/A SER 167.A OG GLU 176.A OE1 no hydrogen 2.745 N/A ARG 168.A N GLU 176.A OE2 no hydrogen 3.045 N/A GLU 169.A N SER 167.A OG no hydrogen 3.204 N/A LEU 171.A N ARG 168.A O no hydrogen 3.256 N/A ARG 172.A NE.A ASP 174.A OD1 no hydrogen 2.855 N/A ARG 172.A NE.B ASP 174.A OD1 no hydrogen 3.317 N/A ARG 172.A NH2.B ASP 174.A OD2 no hydrogen 3.539 N/A GLN 173.A NE2 GLU 177.A OE2.B no hydrogen 3.392 N/A TRP 175.A N ARG 172.A O no hydrogen 2.783 N/A GLU 177.A N GLN 173.A O no hydrogen 3.030 N/A ARG 178.A N ASP 174.A O no hydrogen 2.821 N/A LEU 179.A N TRP 175.A O no hydrogen 2.876 N/A ARG 180.A N GLU 176.A O no hydrogen 2.940 N/A ARG 180.A NE GLU 177.A OE1.B no hydrogen 3.369 N/A GLU 181.A N GLU 177.A O no hydrogen 3.333 N/A GLU 181.A N ARG 178.A O no hydrogen 3.250 N/A ARG 182.A N ARG 178.A O no hydrogen 3.162 N/A LEU 183.A N LEU 179.A O no hydrogen 2.817 N/A GLY 184.A N ARG 180.A O no hydrogen 2.948 N/A LYS 188.A NZ.A GLU 169.A OE1 no hydrogen 3.236 N/A LYS 188.A NZ.A GLU 169.A OE2 no hydrogen 2.758 N/A LYS 188.A NZ.A GLU 186.A OE2.B no hydrogen 3.151 N/A LYS 188.A NZ.B GLU 186.A OE2.B no hydrogen 3.218 N/A ALA 189.A N GLU 186.A O no hydrogen 2.867 N/A VAL 190.A N PRO 187.A O no hydrogen 3.145 N/A SER 191.A N LYS 188.A O no hydrogen 3.251 N/A SER 191.A OG HIS 194.A ND1 no hydrogen 2.850 N/A TYR 193.A N LEU 164.A O no hydrogen 2.879 N/A HIS 194.A N SER 191.A O no hydrogen 3.042 N/A HIS 194.A ND1 SER 191.A OG no hydrogen 2.850 N/A HIS 194.A NE2 GLU 169.A O no hydrogen 2.739 N/A HIS 195.A N PRO 192.A O no hydrogen 2.992 N/A HIS 195.A NE2 LYS 188.A O no hydrogen 2.767 N/A ILE 196.A N TYR 193.A O no hydrogen 3.484 N/A LEU 200.A N ASN 231.A OD1 no hydrogen 2.946 N/A MET 203.A N ARG 232.A O no hydrogen 2.951 N/A ILE 204.A N ALA 157.A O no hydrogen 3.099 N/A ILE 205.A N GLU 234.A O no hydrogen 2.731 N/A PHE 206.A N LEU 159.A O no hydrogen 2.867 N/A HIS 207.A N VAL 236.A O no hydrogen 3.155 N/A HIS 207.A NE2 VAL 214.A O no hydrogen 2.813 N/A THR 209.A N PHE 238.A O no hydrogen 3.029 N/A THR 209.A OG1 GLU 239.A OE1.A no hydrogen 2.639 N/A ALA 210.A N ALA 241.A O no hydrogen 2.900 N/A THR 213.A N ASP 211.A OD1 no hydrogen 2.802 N/A VAL 214.A N ASP 211.A OD1 no hydrogen 2.769 N/A THR 218.A N PRO 215.A O no hydrogen 2.992 N/A THR 218.A OG1 PRO 215.A O no hydrogen 2.740 N/A ARG 220.A N PHE 216.A O no hydrogen 2.892 N/A ARG 220.A NE GLU 217.A OE1 no hydrogen 2.888 N/A ARG 220.A NE GLU 217.A OE2 no hydrogen 3.080 N/A ARG 220.A NH2 GLU 217.A OE2 no hydrogen 2.641 N/A LEU 221.A N GLU 217.A O no hydrogen 3.028 N/A PHE 222.A N THR 218.A O no hydrogen 3.011 N/A ALA 223.A N ILE 219.A O no hydrogen 2.890 N/A GLU 224.A N ARG 220.A O no hydrogen 2.833 N/A ALA 225.A N LEU 221.A O no hydrogen 3.001 N/A MET 226.A N PHE 222.A O no hydrogen 2.894 N/A LYS 227.A N ALA 223.A O no hydrogen 2.955 N/A LYS 227.A NZ CYS 233.A O no hydrogen 3.259 N/A LYS 228.A N GLU 224.A O no hydrogen 3.017 N/A ALA 229.A N ALA 225.A O no hydrogen 3.037 N/A GLY 230.A N LYS 227.A O no hydrogen 2.887 N/A ASN 231.A N MET 226.A O no hydrogen 3.057 N/A ASN 231.A ND2 ARG 197.A O no hydrogen 2.759 N/A ARG 232.A NH1.B GLU 234.A OE2 no hydrogen 3.303 N/A GLU 234.A N MET 203.A O no hydrogen 2.950 N/A VAL 236.A N ILE 205.A O no hydrogen 2.765 N/A PHE 238.A N HIS 207.A O no hydrogen 2.849 N/A GLY 240.A N THR 209.A OG1 no hydrogen 2.705 N/A ALA 241.A N PHE 238.A O no hydrogen 3.039 N/A HIS 243.A ND1 ASP 211.A OD2 no hydrogen 2.777 N/A HIS 243.A NE2 SER 126.A OG no hydrogen 2.841 N/A GLY 244.A N ASN 161.A OD1 no hydrogen 2.951 N/A PHE 245.A N ALA 242.A O no hydrogen 3.181 N/A ASN 247.A N GLY 244.A O no hydrogen 3.155 N/A ASN 247.A ND2 GLY 244.A O no hydrogen 2.867 N/A GLY 249.A N ASN 253.A OD1 no hydrogen 2.707 N/A ARG 250.A N ASN 247.A O no hydrogen 3.263 N/A ASN 253.A N ARG 250.A O no hydrogen 2.832 N/A LEU 254.A N GLY 251.A O no hydrogen 3.304 N/A GLN 257.A N ASN 253.A O no hydrogen 2.934 N/A LYS 258.A N LEU 254.A O no hydrogen 2.917 N/A THR 259.A N ALA 255.A O no hydrogen 2.871 N/A THR 259.A OG1 ALA 255.A O no hydrogen 3.189 N/A THR 259.A OG1 TYR 256.A O no hydrogen 3.113 N/A LEU 260.A N TYR 256.A O no hydrogen 3.256 N/A GLU 261.A N GLN 257.A O no hydrogen 2.953 N/A LEU 262.A N LYS 258.A O no hydrogen 3.035 N/A ALA 263.A N THR 259.A O no hydrogen 2.785 N/A ASP 264.A N LEU 260.A O no hydrogen 2.830 N/A GLU 265.A N GLU 261.A O no hydrogen 2.996 N/A PHE 266.A N LEU 262.A O no hydrogen 2.940 N/A LEU 267.A N ALA 263.A O no hydrogen 3.041 N/A VAL 268.A N ASP 264.A O no hydrogen 2.961 N/A GLU 269.A N GLU 265.A O no hydrogen 2.796 N/A ILE 270.A N PHE 266.A O no hydrogen 2.975 N/A GLY 271.A N VAL 268.A O no hydrogen 3.006 N/A PHE 272.A N LEU 267.A O no hydrogen 2.757 N/A LEU 273.A N LEU 267.A O no hydrogen 3.221 N/A