Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4e5w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 16.A N ASP 14.A OD1 no hydrogen 2.890 N/A THR 16.A OG1 ASP 14.A OD1 no hydrogen 2.680 N/A THR 16.A OG1 ASP 14.A OD2 no hydrogen 3.430 N/A HIS 17.A N.A ASP 14.A O no hydrogen 3.187 N/A HIS 17.A N.B ASP 14.A O no hydrogen 3.176 N/A PHE 18.A N ILE 86.A O no hydrogen 2.872 N/A GLU 19.A N TYR 42.A OH no hydrogen 2.942 N/A PHE 22.A N GLU 19.A O no hydrogen 3.096 N/A LEU 23.A N LYS 20.A O no hydrogen 3.137 N/A LYS 24.A N ARG 41.A O no hydrogen 2.985 N/A LYS 24.A NZ ARG 21.A O no hydrogen 3.443 N/A ARG 25.A NE GLU 38.A OE2 no hydrogen 3.260 N/A ARG 25.A NH2 ASP 28.A OD1 no hydrogen 3.039 N/A ILE 26.A N LEU 39.A O no hydrogen 2.784 N/A ARG 27.A N LEU 39.A O no hydrogen 3.407 N/A LEU 29.A N VAL 37.A O no hydrogen 2.760 N/A GLY 32.A N GLY 35.A O no hydrogen 2.737 N/A HIS 33.A NE2 ASP 177.A OD2 no hydrogen 2.792 N/A LYS 36.A N SER 57.A O no hydrogen 2.874 N/A VAL 37.A N GLY 30.A O no hydrogen 2.832 N/A GLU 38.A N VAL 55.A O no hydrogen 2.822 N/A LEU 39.A N ARG 27.A O no hydrogen 2.693 N/A CYS 40.A N VAL 53.A O no hydrogen 2.895 N/A ARG 41.A N LYS 24.A O no hydrogen 2.902 N/A ARG 41.A NH1 GLY 50.A O no hydrogen 2.599 N/A TYR 42.A N GLU 51.A O no hydrogen 2.888 N/A ASP 43.A N PHE 22.A O no hydrogen 2.833 N/A GLY 46.A N ASP 43.A O no hydrogen 3.023 N/A ASN 48.A N ASP 43.A OD2 no hydrogen 2.795 N/A THR 49.A N ASP 43.A OD1 no hydrogen 3.085 N/A THR 49.A OG1 ASP 47.A OD1 no hydrogen 2.608 N/A THR 49.A OG1 ASP 47.A OD2 no hydrogen 3.495 N/A GLY 50.A N ASP 43.A OD1 no hydrogen 2.924 N/A VAL 53.A N CYS 40.A O no hydrogen 2.795 N/A ALA 54.A N MET 96.A O no hydrogen 2.916 N/A VAL 55.A N GLU 38.A O no hydrogen 2.807 N/A LYS 56.A N LEU 94.A O no hydrogen 2.788 N/A LYS 56.A NZ GLU 68.A OE1 no hydrogen 3.131 N/A LYS 56.A NZ GLU 68.A OE2 no hydrogen 2.687 N/A LYS 56.A NZ ASP 161.A OD1 no hydrogen 2.787 N/A LYS 56.A NZ ASP 161.A OD2 no hydrogen 3.373 N/A SER 57.A N LYS 36.A O no hydrogen 2.961 N/A LYS 59.A N PHE 34.A O no hydrogen 2.968 N/A LYS 59.A NZ GLY 32.A O no hydrogen 3.025 N/A LYS 59.A NZ HIS 33.A O no hydrogen 2.921 N/A HIS 61.A ND1 ASP 64.A OD2 no hydrogen 2.932 N/A LEU 65.A N HIS 61.A O no hydrogen 3.161 N/A LYS 66.A N ILE 62.A O no hydrogen 2.844 N/A LYS 67.A N ALA 63.A O no hydrogen 3.017 N/A GLU 68.A N ASP 64.A O no hydrogen 3.032 N/A ILE 69.A N LEU 65.A O no hydrogen 2.926 N/A GLU 70.A N LYS 66.A O no hydrogen 3.056 N/A ILE 71.A N LYS 67.A O no hydrogen 3.020 N/A LEU 72.A N GLU 68.A O no hydrogen 2.953 N/A ARG 73.A N ILE 69.A O no hydrogen 2.884 N/A ARG 73.A NE GLU 70.A OE1 no hydrogen 2.981 N/A ARG 73.A NE GLU 70.A OE2 no hydrogen 3.338 N/A ARG 73.A NH1 GLU 70.A OE2 no hydrogen 2.676 N/A ASN 74.A N ILE 71.A O no hydrogen 3.130 N/A ASN 74.A ND2 GLU 70.A O no hydrogen 2.811 N/A ASN 74.A ND2 GLU 70.A OE2 no hydrogen 3.050 N/A LEU 75.A N LEU 72.A O no hydrogen 3.145 N/A TYR 76.A N TYR 133.A OH no hydrogen 2.792 N/A ASN 79.A N HIS 77.A ND1 no hydrogen 2.918 N/A ASN 79.A ND2 VAL 157.A O no hydrogen 2.902 N/A ILE 80.A N HIS 77.A O no hydrogen 3.106 N/A VAL 81.A N ILE 159.A O no hydrogen 2.958 N/A LYS 82.A N GLU 97.A OE2 no hydrogen 2.909 N/A LYS 84.A N ILE 95.A O no hydrogen 2.791 N/A LYS 84.A NZ GLU 51.A OE2 no hydrogen 3.154 N/A GLY 85.A N ILE 95.A O no hydrogen 3.109 N/A ILE 86.A N THR 16.A O no hydrogen 2.846 N/A CYS 87.A N LYS 93.A O no hydrogen 3.104 N/A CYS 87.A SG PHE 18.A O no hydrogen 3.375 N/A GLU 89.A N GLY 91.A O no hydrogen 3.088 N/A GLY 91.A N GLU 89.A OE2 no hydrogen 3.226 N/A LYS 93.A N CYS 87.A O no hydrogen 2.882 N/A LEU 94.A N LYS 56.A O no hydrogen 2.817 N/A ILE 95.A N GLY 85.A O no hydrogen 2.812 N/A MET 96.A N ALA 54.A O no hydrogen 2.823 N/A GLU 97.A N LYS 82.A O no hydrogen 3.069 N/A GLY 102.A N LEU 99.A O no hydrogen 2.938 N/A SER 103.A N GLU 106.A OE1 no hydrogen 3.183 N/A LEU 104.A N VAL 149.A O no hydrogen 2.810 N/A LYS 105.A NZ CYS 216.A O no hydrogen 3.531 N/A GLU 106.A N SER 103.A O no hydrogen 3.077 N/A TYR 107.A N SER 103.A O no hydrogen 2.815 N/A LEU 108.A N LEU 104.A O no hydrogen 2.941 N/A ASN 111.A N LEU 108.A O no hydrogen 3.066 N/A ASN 111.A ND2 TYR 107.A O no hydrogen 2.849 N/A LYS 114.A N ASN 111.A O no hydrogen 2.950 N/A LYS 114.A NZ GLU 154.A OE1 no hydrogen 2.840 N/A ILE 115.A N ASN 111.A O no hydrogen 3.133 N/A LYS 118.A NZ LEU 291.A O no hydrogen 2.721 N/A GLN 119.A N ASN 116.A OD1 no hydrogen 3.126 N/A GLN 120.A N ASN 116.A O no hydrogen 3.018 N/A GLN 120.A NE2 LEU 212.A O no hydrogen 2.825 N/A LEU 121.A N LEU 117.A O no hydrogen 2.862 N/A LYS 122.A N LYS 118.A O no hydrogen 3.128 N/A TYR 123.A N GLN 119.A O no hydrogen 3.056 N/A TYR 123.A OH GLU 154.A O no hydrogen 2.658 N/A ALA 124.A N GLN 120.A O no hydrogen 2.951 N/A VAL 125.A N LEU 121.A O no hydrogen 3.025 N/A GLN 126.A N LYS 122.A O no hydrogen 3.071 N/A GLN 126.A NE2 HIS 155.A O no hydrogen 2.998 N/A ILE 127.A N TYR 123.A O no hydrogen 2.892 N/A CYS 128.A N ALA 124.A O no hydrogen 3.016 N/A CYS 128.A SG ALA 124.A O no hydrogen 3.327 N/A LYS 129.A N VAL 125.A O no hydrogen 2.868 N/A GLY 130.A N GLN 126.A O no hydrogen 3.055 N/A MET 131.A N ILE 127.A O no hydrogen 2.936 N/A ASP 132.A N CYS 128.A O no hydrogen 2.818 N/A TYR 133.A N LYS 129.A O no hydrogen 3.002 N/A LEU 134.A N GLY 130.A O no hydrogen 3.099 N/A GLY 135.A N MET 131.A O no hydrogen 2.929 N/A SER 136.A N ASP 132.A O no hydrogen 2.932 N/A SER 136.A OG ASP 132.A O no hydrogen 3.493 N/A SER 136.A OG TYR 133.A O no hydrogen 2.673 N/A ARG 137.A N LEU 134.A O no hydrogen 3.027 N/A ARG 137.A NH2 TYR 133.A OH no hydrogen 3.369 N/A GLN 138.A N GLY 135.A O no hydrogen 2.957 N/A TYR 139.A N LEU 134.A O no hydrogen 3.261 N/A VAL 140.A N LYS 166.A O no hydrogen 2.834 N/A HIS 141.A N ASP 201.A OD2 no hydrogen 2.730 N/A HIS 141.A NE2 ASP 161.A O no hydrogen 2.668 N/A ARG 142.A N ASP 201.A OD1 no hydrogen 3.102 N/A ARG 142.A NH1 LEU 164.A O no hydrogen 2.736 N/A ASP 143.A N HIS 141.A ND1 no hydrogen 3.057 N/A ALA 146.A N GLU 211.A OE1 no hydrogen 2.855 N/A ARG 147.A NH2 ASP 143.A OD1 no hydrogen 3.041 N/A ASN 148.A N ALA 145.A O no hydrogen 2.906 N/A ASN 148.A ND2 ASP 143.A O no hydrogen 2.742 N/A VAL 149.A N ALA 146.A O no hydrogen 3.174 N/A LEU 150.A N LYS 158.A O no hydrogen 2.722 N/A VAL 151.A N GLY 102.A O no hydrogen 2.780 N/A GLU 152.A N GLN 156.A O no hydrogen 2.761 N/A SER 153.A N GLN 156.A O no hydrogen 3.201 N/A HIS 155.A N SER 153.A OG no hydrogen 3.056 N/A GLN 156.A N SER 153.A O no hydrogen 3.158 N/A GLN 156.A NE2 GLU 78.A O no hydrogen 2.771 N/A VAL 157.A N GLN 126.A OE1 no hydrogen 2.771 N/A LYS 158.A N LEU 150.A O no hydrogen 2.840 N/A LYS 158.A NZ GLU 97.A OE2 no hydrogen 2.790 N/A ILE 159.A N ASN 79.A O no hydrogen 2.828 N/A GLY 160.A N ASN 148.A O no hydrogen 2.725 N/A GLY 163.A N ASP 161.A OD2 no hydrogen 3.053 N/A THR 165.A N PHE 162.A O no hydrogen 3.181 N/A THR 165.A OG1 HIS 141.A O no hydrogen 3.524 N/A LYS 166.A N VAL 140.A O no hydrogen 2.979 N/A ILE 168.A N GLN 138.A O no hydrogen 2.751 N/A LYS 172.A N GLU 169.A O no hydrogen 3.109 N/A VAL 175.A N SER 194.A O no hydrogen 2.757 N/A LYS 176.A NZ THR 174.A O no hydrogen 2.887 N/A SER 181.A N ASP 178.A O no hydrogen 3.090 N/A SER 181.A OG ASP 178.A O no hydrogen 2.729 N/A VAL 183.A N SER 181.A O no hydrogen 2.775 N/A TRP 185.A N PRO 182.A O no hydrogen 3.000 N/A TRP 185.A NE1 GLU 211.A OE1 no hydrogen 2.881 N/A TYR 186.A N VAL 183.A O no hydrogen 3.103 N/A TYR 186.A OH ARG 142.A O no hydrogen 2.551 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.810 N/A CYS 190.A N ALA 187.A O no hydrogen 3.033 N/A CYS 190.A SG LYS 195.A O no hydrogen 3.541 N/A LEU 191.A N ALA 187.A O no hydrogen 3.224 N/A MET 192.A N PRO 188.A O no hydrogen 2.794 N/A GLN 193.A N GLU 189.A O no hydrogen 3.017 N/A SER 194.A N CYS 190.A O no hydrogen 3.232 N/A LYS 195.A N GLU 189.A O no hydrogen 3.394 N/A TYR 197.A N SER 200.A OG no hydrogen 2.984 N/A SER 200.A N TYR 197.A O no hydrogen 3.020 N/A SER 200.A OG GLU 189.A OE2 no hydrogen 2.582 N/A VAL 202.A N ILE 198.A O no hydrogen 3.190 N/A TRP 203.A N ALA 199.A O no hydrogen 3.179 N/A SER 204.A N SER 200.A O no hydrogen 3.181 N/A SER 204.A OG TRP 185.A O no hydrogen 2.838 N/A SER 204.A OG SER 200.A O no hydrogen 3.291 N/A PHE 205.A N ASP 201.A O no hydrogen 2.847 N/A GLY 206.A N VAL 202.A O no hydrogen 3.054 N/A VAL 207.A N TRP 203.A O no hydrogen 3.270 N/A THR 208.A N SER 204.A O no hydrogen 2.915 N/A THR 208.A OG1 SER 204.A O no hydrogen 2.892 N/A LEU 209.A N PHE 205.A O no hydrogen 2.747 N/A HIS 210.A N GLY 206.A O no hydrogen 3.095 N/A HIS 210.A NE2 PRO 253.A O no hydrogen 2.734 N/A GLU 211.A N VAL 207.A O no hydrogen 3.031 N/A LEU 212.A N THR 208.A O no hydrogen 2.982 N/A LEU 213.A N LEU 209.A O no hydrogen 3.020 N/A THR 214.A N HIS 210.A O no hydrogen 3.066 N/A THR 214.A N GLU 211.A O no hydrogen 3.212 N/A THR 214.A OG1 HIS 210.A O no hydrogen 3.356 N/A THR 214.A OG1 GLU 211.A O no hydrogen 3.155 N/A TYR 215.A N LEU 212.A O no hydrogen 3.081 N/A TYR 215.A OH ILE 115.A O no hydrogen 2.787 N/A CYS 216.A N GLU 211.A O no hydrogen 2.758 N/A CYS 216.A SG LEU 104.A O no hydrogen 3.652 N/A CYS 216.A SG GLU 211.A O no hydrogen 3.883 N/A ASP 217.A N THR 214.A O no hydrogen 3.210 N/A ASP 219.A N ASP 217.A OD2 no hydrogen 2.977 N/A SER 220.A N ASP 217.A O no hydrogen 3.083 N/A SER 221.A N SER 218.A O no hydrogen 3.324 N/A SER 221.A OG SER 218.A O no hydrogen 3.385 N/A ALA 224.A N SER 221.A OG no hydrogen 3.176 N/A LEU 225.A N SER 221.A O no hydrogen 2.941 N/A PHE 226.A N PRO 222.A O no hydrogen 2.996 N/A LEU 227.A N MET 223.A O no hydrogen 2.872 N/A LYS 228.A N ALA 224.A O no hydrogen 3.130 N/A MET 229.A N LEU 225.A O no hydrogen 3.123 N/A ILE 230.A N PHE 226.A O no hydrogen 2.872 N/A GLY 231.A N LEU 227.A O no hydrogen 2.782 N/A MET 237.A N HIS 234.A O no hydrogen 2.902 N/A THR 238.A N GLY 235.A O no hydrogen 3.039 N/A THR 238.A OG1 GLY 235.A O no hydrogen 2.777 N/A THR 240.A OG1 MET 237.A O no hydrogen 3.082 N/A ARG 241.A N MET 237.A O no hydrogen 3.097 N/A LEU 242.A N THR 238.A O no hydrogen 2.862 N/A VAL 243.A N VAL 239.A O no hydrogen 2.868 N/A ASN 244.A N THR 240.A O no hydrogen 2.925 N/A THR 245.A N ARG 241.A O no hydrogen 3.030 N/A THR 245.A OG1 ARG 241.A O no hydrogen 2.871 N/A LEU 246.A N LEU 242.A O no hydrogen 2.998 N/A LYS 247.A N VAL 243.A O no hydrogen 2.867 N/A GLU 248.A N ASN 244.A O no hydrogen 3.085 N/A GLY 249.A N LEU 246.A O no hydrogen 3.059 N/A LYS 250.A N THR 245.A O no hydrogen 3.217 N/A ARG 251.A NE TRP 270.A O no hydrogen 2.885 N/A ARG 251.A NH1 LEU 246.A O no hydrogen 2.946 N/A ARG 251.A NH1 LYS 250.A O no hydrogen 2.805 N/A ARG 251.A NH2 TRP 270.A O no hydrogen 2.983 N/A CYS 254.A SG PRO 255.A O no hydrogen 3.672 N/A CYS 254.A SG CYS 258.A O no hydrogen 3.318 N/A CYS 258.A N PRO 255.A O no hydrogen 3.189 N/A CYS 258.A SG PRO 259.A O no hydrogen 3.566 N/A GLU 261.A N GLU 261.A OE1 no hydrogen 2.882 N/A VAL 262.A N PRO 259.A O no hydrogen 2.983 N/A TYR 263.A N PRO 259.A O no hydrogen 3.118 N/A TYR 263.A OH LEU 252.A O no hydrogen 2.715 N/A GLN 264.A N ASP 260.A O no hydrogen 2.793 N/A GLN 264.A NE2 ASP 260.A OD1 no hydrogen 3.276 N/A LEU 265.A N VAL 262.A O no hydrogen 3.137 N/A MET 266.A N VAL 262.A O no hydrogen 3.157 N/A ARG 267.A N TYR 263.A O no hydrogen 2.850 N/A ARG 267.A NH1 TYR 263.A OH no hydrogen 3.100 N/A LYS 268.A N GLN 264.A O no hydrogen 3.240 N/A CYS 269.A N MET 266.A O no hydrogen 3.081 N/A CYS 269.A SG LEU 265.A O no hydrogen 3.683 N/A TRP 270.A N ARG 267.A O no hydrogen 2.963 N/A TRP 270.A NE1 TRP 203.A O no hydrogen 3.205 N/A ASN 276.A N GLN 273.A O no hydrogen 3.064 N/A ARG 277.A N PRO 274.A O no hydrogen 3.148 N/A ARG 277.A NE GLU 271.A O no hydrogen 2.775 N/A ARG 277.A NH1 GLU 189.A OE2 no hydrogen 2.823 N/A ARG 277.A NH1 ALA 199.A O no hydrogen 3.092 N/A ARG 277.A NH2 GLU 189.A OE1 no hydrogen 2.809 N/A ARG 277.A NH2 GLU 271.A O no hydrogen 3.284 N/A ARG 277.A NH2 PHE 272.A O no hydrogen 3.014 N/A THR 278.A N LYS 268.A O no hydrogen 3.082 N/A THR 278.A OG1 SER 279.A O no hydrogen 3.130 N/A THR 278.A OG1 ASN 282.A OD1 no hydrogen 2.881 N/A GLN 281.A NE2.A ASP 132.A OD2 no hydrogen 2.723 N/A ASN 282.A N SER 279.A OG no hydrogen 3.028 N/A LEU 283.A N SER 279.A O no hydrogen 3.143 N/A ILE 284.A N PHE 280.A O no hydrogen 2.983 N/A GLU 285.A N GLN 281.A O.A no hydrogen 3.230 N/A GLU 285.A N GLN 281.A O.B no hydrogen 3.251 N/A GLY 286.A N ASN 282.A O no hydrogen 2.993 N/A PHE 287.A N LEU 283.A O no hydrogen 2.902 N/A GLU 288.A N ILE 284.A O no hydrogen 2.920 N/A ALA 289.A N GLU 285.A O no hydrogen 3.015 N/A LEU 290.A N GLY 286.A O no hydrogen 3.240 N/A LEU 291.A N PHE 287.A O no hydrogen 2.860 N/A LYS 292.A N GLU 288.A O no hydrogen 3.041 N/A