Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3s0o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ARG 22.A O no hydrogen 3.107 N/A VAL 7.A N LYS 20.A O no hydrogen 2.859 N/A GLU 8.A N LYS 20.A O no hydrogen 3.411 N/A GLY 11.A N VAL 18.A O no hydrogen 3.165 N/A GLY 13.A N GLY 16.A O no hydrogen 2.946 N/A VAL 18.A N GLY 11.A O no hydrogen 3.307 N/A TYR 19.A N LEU 32.A O no hydrogen 2.723 N/A LYS 20.A N GLU 8.A O no hydrogen 3.383 N/A ALA 21.A N VAL 30.A O no hydrogen 2.880 N/A ARG 22.A NH1 GLN 5.A OE1 no hydrogen 3.052 N/A ASN 23.A N GLU 28.A O no hydrogen 3.196 N/A THR 26.A N ASN 23.A OD1 no hydrogen 3.240 N/A GLY 27.A N ASN 23.A O no hydrogen 2.456 N/A VAL 30.A N ALA 21.A O no hydrogen 2.858 N/A ALA 31.A N PHE 77.A O no hydrogen 2.924 N/A LEU 32.A N TYR 19.A O no hydrogen 2.707 N/A LYS 33.A N LEU 75.A O no hydrogen 2.817 N/A LYS 33.A NZ ASP 142.A OD1 no hydrogen 2.729 N/A LYS 34.A N VAL 17.A O no hydrogen 3.018 N/A ILE 35.A N LEU 73.A O no hydrogen 2.673 N/A ARG 36.A N TYR 15.A O no hydrogen 3.015 N/A THR 44.A OG1 GLU 48.A OE1 no hydrogen 3.430 N/A GLU 48.A N THR 44.A O no hydrogen 2.750 N/A ILE 49.A N ALA 45.A O no hydrogen 2.615 N/A SER 50.A N ILE 46.A O no hydrogen 2.922 N/A SER 50.A OG ILE 46.A O no hydrogen 2.563 N/A LEU 51.A N ARG 47.A O no hydrogen 3.198 N/A LEU 51.A N GLU 48.A O no hydrogen 2.916 N/A LEU 52.A N ILE 49.A O no hydrogen 2.605 N/A LYS 53.A N SER 50.A O no hydrogen 3.263 N/A LYS 53.A NZ LEU 64.A O no hydrogen 3.104 N/A GLU 54.A N LEU 51.A O no hydrogen 3.088 N/A LEU 55.A N LEU 52.A O no hydrogen 3.010 N/A ASN 59.A ND2 GLN 107.A OE1 no hydrogen 3.016 N/A ASN 59.A ND2 ILE 138.A O no hydrogen 2.834 N/A ILE 60.A N HIS 57.A O no hydrogen 3.103 N/A VAL 61.A N LEU 140.A O no hydrogen 2.904 N/A LYS 62.A N GLU 78.A OE2 no hydrogen 2.775 N/A LEU 64.A N VAL 76.A O no hydrogen 2.720 N/A ASP 65.A N VAL 76.A O no hydrogen 3.178 N/A ILE 67.A N TYR 74.A O no hydrogen 2.766 N/A LYS 72.A N THR 69.A O no hydrogen 2.745 N/A TYR 74.A N ILE 67.A O no hydrogen 2.903 N/A LEU 75.A N LYS 33.A O no hydrogen 2.868 N/A VAL 76.A N ASP 65.A O no hydrogen 2.728 N/A PHE 77.A N ALA 31.A O no hydrogen 2.887 N/A GLU 78.A N LYS 62.A O no hydrogen 3.056 N/A GLN 82.A N ILE 132.A O no hydrogen 3.394 N/A LEU 84.A N LEU 130.A O no hydrogen 2.854 N/A LYS 85.A N PRO 127.A O no hydrogen 3.393 N/A LYS 86.A N ASP 83.A OD1 no hydrogen 2.543 N/A PHE 87.A N ASP 83.A O no hydrogen 3.088 N/A MET 88.A N LEU 84.A O no hydrogen 2.750 N/A ASP 89.A N LYS 85.A O no hydrogen 3.020 N/A ALA 90.A N LYS 86.A O no hydrogen 2.797 N/A SER 91.A N MET 88.A O no hydrogen 3.053 N/A SER 91.A OG PHE 87.A O no hydrogen 2.756 N/A THR 94.A OG1 GLY 95.A O no hydrogen 3.331 N/A GLY 95.A N SER 91.A O no hydrogen 2.395 N/A LEU 100.A N PRO 97.A O no hydrogen 2.933 N/A ILE 101.A N PRO 97.A O no hydrogen 2.958 N/A LYS 102.A N LEU 98.A O no hydrogen 2.734 N/A LYS 102.A NZ PHE 280.A O no hydrogen 3.109 N/A LYS 102.A NZ ASP 283.A OD1 no hydrogen 2.541 N/A LYS 102.A NZ ASP 283.A OD2 no hydrogen 3.553 N/A SER 103.A N PRO 99.A O no hydrogen 3.007 N/A TYR 104.A N LEU 100.A O no hydrogen 2.883 N/A LEU 105.A N ILE 101.A O no hydrogen 3.010 N/A PHE 106.A N LYS 102.A O no hydrogen 2.996 N/A GLN 107.A N SER 103.A O no hydrogen 2.969 N/A GLN 107.A NE2 SER 103.A O no hydrogen 3.599 N/A GLN 107.A NE2 SER 103.A OG no hydrogen 2.959 N/A GLN 107.A NE2 GLY 136.A O no hydrogen 2.910 N/A LEU 108.A N TYR 104.A O no hydrogen 2.851 N/A LEU 109.A N LEU 105.A O no hydrogen 2.901 N/A GLN 110.A N PHE 106.A O no hydrogen 3.092 N/A GLY 111.A N GLN 107.A O no hydrogen 2.869 N/A LEU 112.A N LEU 108.A O no hydrogen 2.824 N/A ALA 113.A N LEU 109.A O no hydrogen 2.661 N/A PHE 114.A N GLN 110.A O no hydrogen 2.978 N/A CYS 115.A N GLY 111.A O no hydrogen 3.029 N/A CYS 115.A SG GLY 111.A O no hydrogen 3.586 N/A HIS 116.A N LEU 112.A O no hydrogen 2.771 N/A HIS 116.A NE2 ASP 180.A OD2 no hydrogen 2.795 N/A SER 117.A N ALA 113.A O no hydrogen 3.042 N/A SER 117.A OG ALA 113.A O no hydrogen 3.335 N/A SER 117.A OG PHE 114.A O no hydrogen 2.744 N/A SER 117.A OG HIS 118.A ND1 no hydrogen 3.154 N/A HIS 118.A N CYS 115.A O no hydrogen 3.063 N/A HIS 118.A ND1 PHE 114.A O no hydrogen 2.907 N/A HIS 118.A ND1 SER 117.A OG no hydrogen 3.154 N/A ARG 119.A N HIS 116.A O no hydrogen 3.057 N/A VAL 120.A N CYS 115.A O no hydrogen 2.724 N/A HIS 122.A N ASP 180.A OD2 no hydrogen 2.827 N/A ARG 123.A N ASP 180.A OD1 no hydrogen 2.786 N/A LYS 126.A N ASN 129.A OD1 no hydrogen 3.178 N/A LYS 126.A NZ ASP 124.A OD2 no hydrogen 3.210 N/A ASN 129.A N LYS 126.A O no hydrogen 2.794 N/A ASN 129.A ND2 ASP 124.A O no hydrogen 2.878 N/A LEU 130.A N PRO 127.A O no hydrogen 3.210 N/A LEU 131.A N LYS 139.A O no hydrogen 2.814 N/A ILE 132.A N GLN 82.A O no hydrogen 2.945 N/A ASN 133.A N ALA 137.A O no hydrogen 3.226 N/A THR 134.A N HIS 81.A ND1 no hydrogen 3.049 N/A GLY 136.A N ASN 133.A O no hydrogen 3.370 N/A ALA 137.A N ASN 133.A OD1 no hydrogen 3.013 N/A ILE 138.A N GLN 107.A OE1 no hydrogen 2.995 N/A LYS 139.A N LEU 131.A O no hydrogen 2.664 N/A LYS 139.A NZ GLU 78.A OE1 no hydrogen 3.355 N/A LYS 139.A NZ GLU 78.A OE2 no hydrogen 3.171 N/A LEU 140.A N ASN 59.A O no hydrogen 2.765 N/A ALA 141.A N ASN 129.A O no hydrogen 2.886 N/A ARG 145.A NH2 ARG 119.A O no hydrogen 3.022 N/A TYR 163.A OH GLU 190.A OE1 no hydrogen 2.527 N/A TYR 163.A OH GLU 190.A OE2 no hydrogen 3.381 N/A ARG 164.A N LEU 161.A O no hydrogen 3.100 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.517 N/A ILE 168.A N ALA 165.A O no hydrogen 3.119 N/A LEU 169.A N ALA 165.A O no hydrogen 3.301 N/A LEU 170.A N PRO 166.A O no hydrogen 2.903 N/A GLY 171.A N ILE 168.A O no hydrogen 2.927 N/A CYS 172.A N GLU 167.A O no hydrogen 2.800 N/A CYS 172.A SG.A TYR 174.A O no hydrogen 3.608 N/A CYS 172.A SG.B TYR 174.A O no hydrogen 3.102 N/A ALA 178.A N SER 176.A OG no hydrogen 3.055 N/A VAL 179.A N SER 176.A O no hydrogen 2.885 N/A ASP 180.A N THR 177.A O no hydrogen 3.084 N/A TRP 182.A N ALA 178.A O no hydrogen 3.192 N/A SER 183.A N VAL 179.A O no hydrogen 3.324 N/A SER 183.A OG TYR 163.A O no hydrogen 2.586 N/A SER 183.A OG VAL 179.A O no hydrogen 3.175 N/A LEU 184.A N ASP 180.A O no hydrogen 3.052 N/A GLY 185.A N ILE 181.A O no hydrogen 2.876 N/A CYS 186.A N TRP 182.A O no hydrogen 2.958 N/A CYS 186.A SG TRP 182.A O no hydrogen 3.411 N/A ILE 187.A N SER 183.A O no hydrogen 2.973 N/A PHE 188.A N LEU 184.A O no hydrogen 2.753 N/A ALA 189.A N GLY 185.A O no hydrogen 2.942 N/A GLU 190.A N CYS 186.A O no hydrogen 3.072 N/A MET 191.A N ILE 187.A O no hydrogen 2.916 N/A VAL 192.A N PHE 188.A O no hydrogen 3.216 N/A THR 193.A N ALA 189.A O no hydrogen 2.867 N/A THR 193.A OG1 ALA 189.A O no hydrogen 3.266 N/A ARG 194.A N GLU 190.A O no hydrogen 2.775 N/A ARG 194.A NE ALA 92.A O no hydrogen 3.488 N/A ARG 194.A NH2 ALA 92.A O no hydrogen 3.328 N/A ARG 195.A N THR 193.A OG1 no hydrogen 3.299 N/A GLY 200.A N PHE 198.A O no hydrogen 3.049 N/A GLY 200.A N GLN 206.A OE1 no hydrogen 2.902 N/A ASP 201.A N ASP 205.A OD2 no hydrogen 2.969 N/A ASP 205.A N SER 202.A OG no hydrogen 2.975 N/A GLN 206.A N SER 202.A O no hydrogen 2.725 N/A GLN 206.A NE2 PHE 198.A O no hydrogen 2.956 N/A LEU 207.A N GLU 203.A O no hydrogen 2.936 N/A PHE 208.A N ILE 204.A O no hydrogen 2.851 N/A ARG 209.A N ASP 205.A O no hydrogen 2.982 N/A ARG 209.A NE ASP 205.A OD2 no hydrogen 2.970 N/A ILE 210.A N GLN 206.A O no hydrogen 3.182 N/A PHE 211.A N LEU 207.A O no hydrogen 2.936 N/A ARG 212.A N PHE 208.A O no hydrogen 2.784 N/A THR 213.A N ARG 209.A O no hydrogen 3.250 N/A THR 213.A N ILE 210.A O no hydrogen 3.134 N/A THR 213.A OG1 ARG 209.A O no hydrogen 3.456 N/A LEU 214.A N ILE 210.A O no hydrogen 2.789 N/A GLY 215.A N PHE 211.A O no hydrogen 2.683 N/A THR 216.A N TRP 238.A O no hydrogen 2.772 N/A THR 216.A OG1 PRO 236.A O no hydrogen 2.692 N/A VAL 220.A N ASP 218.A OD1 no hydrogen 2.957 N/A VAL 221.A N ASP 218.A OD1 no hydrogen 3.160 N/A TRP 222.A N ASP 218.A O no hydrogen 2.922 N/A GLY 224.A N GLU 219.A OE1 no hydrogen 2.767 N/A GLY 224.A N GLU 219.A OE2 no hydrogen 3.197 N/A VAL 225.A N TRP 222.A O no hydrogen 2.969 N/A THR 226.A N GLU 219.A OE2 no hydrogen 3.040 N/A THR 226.A OG1 GLU 219.A OE2 no hydrogen 2.596 N/A SER 227.A N GLY 224.A O no hydrogen 3.090 N/A MET 228.A N VAL 225.A O no hydrogen 3.113 N/A ASP 230.A N LEU 170.A O no hydrogen 2.973 N/A TYR 231.A N MET 228.A O no hydrogen 3.086 N/A PHE 235.A N LYS 232.A O no hydrogen 2.928 N/A TRP 238.A N THR 216.A OG1 no hydrogen 2.856 N/A ARG 240.A NH1 LEU 214.A O no hydrogen 3.245 N/A GLN 241.A N THR 213.A O no hydrogen 2.997 N/A SER 244.A N ASP 242.A OD1 no hydrogen 3.053 N/A SER 244.A OG ASP 242.A OD1 no hydrogen 2.736 N/A LYS 245.A N ASP 242.A O no hydrogen 3.255 N/A VAL 246.A N PHE 243.A O no hydrogen 3.020 N/A LEU 250.A N VAL 247.A O no hydrogen 2.794 N/A GLY 254.A N ASP 251.A OD1 no hydrogen 3.036 N/A ARG 255.A N ASP 251.A O no hydrogen 2.908 N/A SER 256.A N GLU 252.A O no hydrogen 2.818 N/A SER 256.A OG HIS 278.A NE2 no hydrogen 3.280 N/A LEU 257.A N ASP 253.A O no hydrogen 2.944 N/A LEU 258.A N GLY 254.A O no hydrogen 2.891 N/A SER 259.A N ARG 255.A O no hydrogen 2.926 N/A SER 259.A OG ARG 255.A O no hydrogen 3.476 N/A SER 259.A OG SER 256.A O no hydrogen 2.862 N/A GLN 260.A N SER 256.A O no hydrogen 3.232 N/A MET 261.A N LEU 257.A O no hydrogen 3.069 N/A MET 261.A N LEU 258.A O no hydrogen 2.872 N/A LEU 262.A N LEU 258.A O no hydrogen 2.909 N/A LEU 262.A N SER 259.A O no hydrogen 3.228 N/A HIS 263.A ND1 LYS 268.A O no hydrogen 3.115 N/A TYR 264.A OH GLY 215.A O no hydrogen 2.775 N/A ASN 267.A N ASP 265.A OD1 no hydrogen 3.043 N/A LYS 268.A N ASP 265.A O no hydrogen 2.761 N/A LYS 268.A NZ VAL 221.A O no hydrogen 3.560 N/A LYS 268.A NZ ASP 265.A OD2 no hydrogen 2.707 N/A ARG 269.A N ASP 265.A O no hydrogen 3.046 N/A ARG 269.A NE HIS 263.A O no hydrogen 2.849 N/A ARG 269.A NH1 GLU 167.A OE1 no hydrogen 3.448 N/A ARG 269.A NH1 GLU 167.A OE2 no hydrogen 2.851 N/A ARG 269.A NH1 ALA 178.A O no hydrogen 2.988 N/A ARG 269.A NH2 GLU 167.A OE1 no hydrogen 2.954 N/A ARG 269.A NH2 HIS 263.A O no hydrogen 3.136 N/A ARG 269.A NH2 TYR 264.A O no hydrogen 2.927 N/A ILE 270.A N GLN 260.A O no hydrogen 3.131 N/A ALA 274.A N SER 271.A OG no hydrogen 3.188 N/A ALA 275.A N SER 271.A O no hydrogen 2.939 N/A LEU 276.A N ALA 272.A O no hydrogen 3.117 N/A LEU 276.A N LYS 273.A O no hydrogen 3.251 N/A ALA 277.A N ALA 274.A O no hydrogen 3.013 N/A HIS 278.A N ALA 275.A O no hydrogen 3.008 N/A HIS 278.A NE2 SER 256.A OG no hydrogen 3.280 N/A PHE 280.A N HIS 278.A ND1 no hydrogen 2.897 N/A PHE 281.A N HIS 278.A O no hydrogen 2.951 N/A GLN 282.A N PRO 279.A O no hydrogen 3.111 N/A VAL 284.A N PHE 281.A O no hydrogen 3.181 N/A