Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ffo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.854 N/A SER 3.A N ASP 28.A OD1 no hydrogen 2.666 N/A MET 4.A N CYS 100.A O no hydrogen 2.930 N/A ARG 5.A N TYR 26.A O no hydrogen 3.004 N/A ARG 5.A NH1 MET 4.A O no hydrogen 3.452 N/A ARG 5.A NH1 ASP 101.A OD1 no hydrogen 2.755 N/A ARG 5.A NH2 ASP 101.A OD1 no hydrogen 3.060 N/A ARG 5.A NH2 ASP 101.A OD2 no hydrogen 3.189 N/A TYR 6.A N SER 98.A O no hydrogen 2.992 N/A PHE 7.A N VAL 24.A O no hydrogen 2.756 N/A GLU 8.A N GLN 96.A O no hydrogen 2.870 N/A THR 9.A N ILE 22.A O no hydrogen 2.724 N/A ALA 10.A N LEU 94.A O no hydrogen 3.101 N/A VAL 11.A N ARG 20.A O no hydrogen 3.080 N/A SER 12.A N HIS 92.A O no hydrogen 3.014 N/A ARG 20.A N VAL 11.A O no hydrogen 3.177 N/A ARG 20.A NE ASP 36.A OD1 no hydrogen 3.088 N/A ARG 20.A NH2 ASP 36.A OD2 no hydrogen 3.144 N/A TYR 21.A N SER 37.A OG no hydrogen 2.666 N/A TYR 21.A OH GLU 8.A OE1 no hydrogen 2.878 N/A ILE 22.A N THR 9.A O no hydrogen 2.673 N/A SER 23.A N PHE 35.A O no hydrogen 2.692 N/A SER 23.A OG TYR 44.A OH no hydrogen 2.720 N/A VAL 24.A N PHE 7.A O no hydrogen 2.788 N/A GLY 25.A N VAL 33.A O no hydrogen 2.679 N/A TYR 26.A N ARG 5.A O no hydrogen 2.850 N/A VAL 27.A N LYS 30.A O no hydrogen 2.904 N/A ASP 28.A N SER 3.A O no hydrogen 2.933 N/A LYS 30.A N VAL 27.A O no hydrogen 3.128 N/A LYS 30.A NZ GLU 31.A O no hydrogen 2.667 N/A LYS 30.A NZ ARG 47.A O no hydrogen 3.135 N/A PHE 32.A N GLY 25.A O no hydrogen 2.964 N/A ARG 34.A N GLU 45.A O no hydrogen 3.367 N/A ARG 34.A NH1 GLU 31.A OE2 no hydrogen 2.634 N/A PHE 35.A N SER 23.A O no hydrogen 2.754 N/A SER 37.A N TYR 21.A O no hydrogen 2.815 N/A SER 37.A OG TYR 21.A O no hydrogen 3.458 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.941 N/A ALA 39.A N ASP 36.A O no hydrogen 3.267 N/A ARG 43.A NE TYR 44.A O no hydrogen 3.188 N/A TYR 44.A N THR 63.A OG1 no hydrogen 2.940 N/A TYR 44.A OH SER 23.A OG no hydrogen 2.720 N/A GLU 45.A N ARG 34.A O no hydrogen 3.083 N/A ARG 47.A N PHE 32.A O no hydrogen 2.642 N/A MET 51.A N ALA 48.A O no hydrogen 3.231 N/A GLU 52.A N PRO 49.A O no hydrogen 3.045 N/A GLU 54.A N MET 51.A O no hydrogen 3.320 N/A GLU 57.A N GLU 57.A OE1 no hydrogen 2.602 N/A TYR 58.A N GLY 55.A O no hydrogen 3.108 N/A TYR 58.A OH TYR 170.A OH no hydrogen 2.669 N/A GLU 60.A N PRO 56.A O no hydrogen 2.777 N/A ARG 61.A N GLU 57.A O no hydrogen 2.789 N/A GLU 62.A N TYR 58.A O no hydrogen 2.926 N/A THR 63.A N TRP 59.A O no hydrogen 2.814 N/A THR 63.A OG1 TRP 59.A O no hydrogen 3.174 N/A GLN 64.A N GLU 60.A O no hydrogen 3.077 N/A LYS 65.A N ARG 61.A O no hydrogen 3.228 N/A LYS 65.A NZ GLU 62.A OE2 no hydrogen 2.481 N/A LYS 65.A NZ GLU 162.A OE2 no hydrogen 3.427 N/A ALA 66.A N GLU 62.A O no hydrogen 2.811 N/A LYS 67.A N THR 63.A O no hydrogen 2.769 N/A GLY 68.A N GLN 64.A O no hydrogen 3.042 N/A GLN 69.A N LYS 65.A O no hydrogen 2.850 N/A GLN 69.A NE2 GLU 8.A OE1 no hydrogen 2.732 N/A GLU 70.A N ALA 66.A O no hydrogen 3.106 N/A TRP 72.A N GLY 68.A O no hydrogen 3.067 N/A PHE 73.A N GLN 69.A O no hydrogen 2.664 N/A ARG 74.A N GLU 70.A O no hydrogen 2.779 N/A VAL 75.A N GLN 71.A O no hydrogen 2.654 N/A SER 76.A N TRP 72.A O no hydrogen 2.947 N/A SER 76.A OG TRP 72.A O no hydrogen 2.749 N/A LEU 77.A N PHE 73.A O no hydrogen 2.652 N/A ARG 78.A N ARG 74.A O no hydrogen 3.170 N/A ASN 79.A N VAL 75.A O no hydrogen 2.962 N/A LEU 80.A N SER 76.A O no hydrogen 3.021 N/A LEU 81.A N LEU 77.A O no hydrogen 3.490 N/A TYR 83.A N ASN 79.A O no hydrogen 3.146 N/A TYR 84.A N LEU 80.A O no hydrogen 2.892 N/A TYR 84.A OH ASP 136.A OD2 no hydrogen 2.520 N/A ASN 85.A N GLY 82.A O no hydrogen 3.089 N/A GLN 86.A N LEU 81.A O no hydrogen 2.938 N/A GLN 86.A NE2 TYR 117.A OH no hydrogen 2.554 N/A HIS 92.A N SER 12.A O no hydrogen 3.350 N/A HIS 92.A N SER 12.A OG no hydrogen 3.072 N/A HIS 92.A ND1 GLU 118.A OE2 no hydrogen 2.715 N/A THR 93.A N GLU 118.A OE1 no hydrogen 3.049 N/A LEU 94.A N ALA 10.A O no hydrogen 3.176 N/A GLN 95.A N ALA 116.A O no hydrogen 2.884 N/A GLN 96.A N GLU 8.A O no hydrogen 2.781 N/A MET 97.A N GLN 114.A O no hydrogen 2.947 N/A GLY 99.A N TYR 112.A O no hydrogen 2.950 N/A CYS 100.A N MET 4.A O no hydrogen 2.910 N/A ASP 101.A N ARG 110.A O no hydrogen 3.070 N/A LEU 102.A N HIS 2.A O no hydrogen 2.855 N/A GLY 103.A N ARG 107.A O no hydrogen 2.892 N/A TRP 106.A N GLY 103.A O no hydrogen 3.082 N/A ARG 107.A N ASP 105.A OD1 no hydrogen 2.939 N/A LEU 109.A N ASP 101.A O no hydrogen 2.827 N/A TYR 112.A N GLY 99.A O no hydrogen 2.703 N/A TYR 112.A OH ASP 101.A OD2 no hydrogen 2.724 N/A GLN 114.A N MET 97.A O no hydrogen 2.890 N/A PHE 115.A N ILE 123.A O no hydrogen 2.732 N/A ALA 116.A N GLN 95.A O no hydrogen 2.911 N/A TYR 117.A N ARG 120.A O no hydrogen 2.984 N/A GLU 118.A N THR 93.A O no hydrogen 2.688 N/A ARG 120.A N TYR 117.A O no hydrogen 2.918 N/A TYR 122.A N PHE 115.A O no hydrogen 2.757 N/A TYR 122.A OH THR 142.A OG1 no hydrogen 2.706 N/A ILE 123.A N PHE 115.A O no hydrogen 3.256 N/A ALA 124.A N THR 133.A O no hydrogen 3.054 N/A LEU 125.A N LEU 113.A O no hydrogen 2.704 N/A ASN 126.A N THR 131.A O no hydrogen 2.679 N/A ASN 126.A ND2 THR 131.A OG1 no hydrogen 3.053 N/A LEU 129.A N ASN 126.A O no hydrogen 2.965 N/A THR 131.A N ASP 128.A OD2 no hydrogen 3.068 N/A THR 131.A OG1 ASP 128.A OD1 no hydrogen 3.463 N/A THR 131.A OG1 ASP 128.A OD2 no hydrogen 2.633 N/A THR 133.A N ALA 124.A O no hydrogen 2.916 N/A THR 133.A OG1 ASN 126.A OD1 no hydrogen 2.759 N/A ALA 135.A N TYR 122.A O no hydrogen 2.852 N/A ALA 139.A N ASP 136.A OD1 no hydrogen 2.773 N/A GLN 140.A N ASP 136.A O no hydrogen 3.163 N/A GLN 140.A NE2 ALA 134.A O no hydrogen 3.257 N/A GLN 140.A NE2 ASP 136.A O no hydrogen 3.014 N/A ILE 141.A N ALA 138.A O no hydrogen 2.666 N/A THR 142.A OG1 TYR 122.A OH no hydrogen 2.706 N/A ARG 143.A N ALA 139.A O no hydrogen 2.900 N/A ARG 143.A NE GLN 140.A OE1 no hydrogen 3.321 N/A ARG 143.A NH1 GLU 147.A OE1 no hydrogen 3.491 N/A ARG 143.A NH2 GLN 140.A OE1 no hydrogen 2.604 N/A ARG 144.A N GLN 140.A O no hydrogen 3.066 N/A LYS 145.A N ILE 141.A O no hydrogen 3.077 N/A TRP 146.A N THR 142.A O no hydrogen 2.916 N/A GLU 147.A N ARG 143.A O no hydrogen 2.800 N/A GLN 148.A N ARG 144.A O no hydrogen 2.975 N/A SER 149.A N LYS 145.A O no hydrogen 3.122 N/A SER 149.A OG LYS 145.A O no hydrogen 2.959 N/A SER 149.A OG TRP 146.A O no hydrogen 3.121 N/A ALA 151.A N TRP 146.A O no hydrogen 2.965 N/A GLU 153.A N GLU 153.A OE2 no hydrogen 2.945 N/A HIS 154.A N ALA 151.A O no hydrogen 2.958 N/A TYR 155.A N ALA 151.A O no hydrogen 3.236 N/A LYS 156.A N ALA 152.A O no hydrogen 2.955 N/A LYS 156.A NZ GLU 160.A OE1 no hydrogen 2.451 N/A LYS 156.A NZ GLU 160.A OE2 no hydrogen 3.237 N/A ALA 157.A N GLU 153.A O no hydrogen 3.306 N/A TYR 158.A N HIS 154.A O no hydrogen 3.336 N/A LEU 159.A N TYR 155.A O no hydrogen 2.899 N/A GLU 160.A N LYS 156.A O no hydrogen 2.881 N/A GLY 161.A N ALA 157.A O no hydrogen 2.887 N/A CYS 163.A N TYR 158.A O no hydrogen 2.709 N/A GLU 165.A N GLY 161.A O no hydrogen 2.710 N/A TRP 166.A N GLU 162.A O no hydrogen 2.938 N/A LEU 167.A N CYS 163.A O no hydrogen 3.197 N/A HIS 168.A N VAL 164.A O no hydrogen 3.118 N/A ARG 169.A N GLU 165.A O no hydrogen 3.269 N/A TYR 170.A N TRP 166.A O no hydrogen 2.904 N/A LEU 171.A N LEU 167.A O no hydrogen 2.955 N/A LYS 172.A N HIS 168.A O no hydrogen 2.856 N/A LYS 172.A NZ HIS 168.A ND1 no hydrogen 3.325 N/A ASN 173.A N ARG 169.A O no hydrogen 3.424 N/A GLY 174.A N TYR 170.A O no hydrogen 2.661 N/A LEU 178.A N GLY 174.A O no hydrogen 2.968 N/A LEU 179.A N ASN 175.A O no hydrogen 2.895 N/A ARG 180.A N THR 177.A O no hydrogen 2.865 N/A ASP 182.A N TYR 208.A O no hydrogen 2.666 N/A SER 183.A OG GLY 264.A O no hydrogen 2.505 N/A LYS 185.A N LEU 205.A O no hydrogen 2.982 N/A LYS 185.A NZ GLY 206.A O no hydrogen 3.539 N/A HIS 187.A N TRP 203.A O no hydrogen 3.213 N/A THR 189.A N ARG 201.A O no hydrogen 2.821 N/A THR 189.A OG1 ARG 201.A O no hydrogen 3.404 N/A HIS 191.A N THR 199.A O no hydrogen 2.768 N/A ARG 193.A N HIS 191.A O no hydrogen 2.640 N/A SER 194.A N PRO 192.A O no hydrogen 2.043 N/A SER 194.A OG LYS 195.A O no hydrogen 3.025 N/A THR 199.A N HIS 191.A O no hydrogen 2.795 N/A LEU 200.A N VAL 246.A O no hydrogen 3.269 N/A ARG 201.A N THR 189.A O no hydrogen 2.888 N/A CYS 202.A N ALA 244.A O no hydrogen 2.592 N/A TRP 203.A N HIS 187.A O no hydrogen 2.738 N/A TRP 203.A NE1 THR 189.A OG1 no hydrogen 2.670 N/A ALA 204.A N LYS 242.A O no hydrogen 2.890 N/A LEU 205.A N LYS 185.A O no hydrogen 2.874 N/A PHE 207.A N PHE 240.A O no hydrogen 3.345 N/A TYR 208.A N ASP 182.A O no hydrogen 2.899 N/A THR 213.A N TYR 261.A O no hydrogen 3.131 N/A THR 215.A N ARG 259.A O no hydrogen 3.113 N/A TRP 216.A NE1 ALA 244.A O no hydrogen 3.305 N/A GLN 217.A N THR 257.A O no hydrogen 2.859 N/A LEU 223.A N TRP 216.A O no hydrogen 2.593 N/A GLU 228.A N SER 245.A O no hydrogen 2.989 N/A VAL 230.A N TRP 243.A O no hydrogen 3.479 N/A ARG 233.A N GLN 241.A O no hydrogen 2.983 N/A ALA 235.A N THR 239.A O no hydrogen 3.065 N/A THR 239.A N ASP 237.A OD1 no hydrogen 2.902 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 3.165 N/A PHE 240.A N PHE 207.A O no hydrogen 2.957 N/A GLN 241.A N ARG 233.A O no hydrogen 2.641 N/A LYS 242.A N ALA 204.A O no hydrogen 3.057 N/A LYS 242.A NZ VAL 230.A O no hydrogen 2.813 N/A ALA 244.A N CYS 202.A O no hydrogen 3.088 N/A SER 245.A N GLU 228.A O no hydrogen 2.875 N/A VAL 246.A N LEU 200.A O no hydrogen 3.169 N/A VAL 248.A N VAL 198.A O no hydrogen 2.617 N/A LEU 250.A N GLY 196.A O no hydrogen 3.054 N/A LYS 252.A N PRO 249.A O no hydrogen 2.839 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.902 N/A GLN 254.A NE2 TRP 273.A O no hydrogen 3.433 N/A ASN 255.A N LYS 252.A O no hydrogen 3.108 N/A TYR 256.A N GLU 253.A O no hydrogen 2.904 N/A THR 257.A N GLN 217.A O no hydrogen 2.856 N/A THR 257.A OG1 LEU 271.A O no hydrogen 3.491 N/A CYS 258.A N LEU 271.A O no hydrogen 2.814 N/A CYS 258.A SG THR 215.A O no hydrogen 3.552 N/A CYS 258.A SG ARG 259.A O no hydrogen 3.933 N/A ARG 259.A N THR 215.A O no hydrogen 3.011 N/A ARG 259.A NE TYR 261.A OH no hydrogen 3.246 N/A ARG 259.A NH1 THR 270.A OG1 no hydrogen 3.008 N/A VAL 260.A N LEU 269.A O no hydrogen 2.869 N/A TYR 261.A N THR 213.A O no hydrogen 2.969 N/A HIS 262.A ND1 ASP 211.A O no hydrogen 2.770 N/A HIS 262.A NE2 TYR 208.A O no hydrogen 3.241 N/A LEU 265.A N HIS 262.A O no hydrogen 3.245 N/A LEU 269.A N VAL 260.A O no hydrogen 3.004 N/A THR 270.A OG1 PRO 268.A O no hydrogen 3.492 N/A LEU 271.A N CYS 258.A O no hydrogen 2.954 N/A