Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8w3x_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 1.A N ASP 1.A OD1 no hydrogen 2.713 N/A ASP 1.A N ALA 72.A O no hydrogen 3.252 N/A THR 2.A N ALA 72.A O no hydrogen 2.887 N/A THR 2.A OG1 ALA 72.A O no hydrogen 3.271 N/A PHE 7.A N PHE 85.A O no hydrogen 2.838 N/A PHE 9.A N ASP 88.A OD1 no hydrogen 2.913 N/A GLU 11.A N SER 8.A O no hydrogen 3.268 N/A LEU 12.A N SER 8.A O no hydrogen 3.320 N/A LYS 13.A N PHE 9.A O no hydrogen 2.856 N/A ASN 14.A N TYR 10.A O no hydrogen 2.935 N/A VAL 15.A N GLU 11.A O no hydrogen 3.007 N/A THR 16.A OG1 LEU 12.A O no hydrogen 2.807 N/A THR 16.A OG1 LYS 13.A O no hydrogen 3.206 N/A ASN 17.A N ASN 14.A O no hydrogen 3.369 N/A ASN 18.A N LYS 13.A O no hydrogen 2.839 N/A PHE 19.A N THR 16.A OG1 no hydrogen 3.180 N/A ASP 20.A N THR 16.A O no hydrogen 3.156 N/A ARG 22.A N ASP 20.A OD1 no hydrogen 3.247 N/A ARG 22.A NE ASP 20.A OD1 no hydrogen 3.027 N/A ARG 22.A NH2 ASP 20.A OD2 no hydrogen 2.789 N/A ILE 24.A N LYS 30.A O no hydrogen 3.366 N/A VAL 26.A N PRO 23.A O no hydrogen 3.070 N/A GLY 27.A N ILE 24.A O no hydrogen 3.093 N/A GLY 28.A N PRO 23.A O no hydrogen 3.046 N/A ASN 29.A N ASP 20.A O no hydrogen 3.201 N/A LYS 30.A N ARG 22.A O no hydrogen 3.024 N/A LYS 30.A NZ GLU 33.A OE1 no hydrogen 2.758 N/A MET 31.A N VAL 39.A O no hydrogen 2.798 N/A GLY 32.A N VAL 39.A O no hydrogen 3.396 N/A GLY 34.A N GLY 37.A O no hydrogen 2.884 N/A VAL 38.A N LYS 53.A O no hydrogen 3.119 N/A VAL 39.A N GLY 32.A O no hydrogen 2.908 N/A TYR 40.A N VAL 51.A O no hydrogen 2.816 N/A LYS 41.A N ASN 29.A O no hydrogen 2.796 N/A LYS 41.A NZ TYR 98.A OH no hydrogen 3.254 N/A GLY 42.A N VAL 49.A O no hydrogen 3.007 N/A TYR 43.A OH ASN 46.A O no hydrogen 3.335 N/A VAL 44.A N THR 47.A O no hydrogen 2.911 N/A THR 47.A N VAL 44.A O no hydrogen 2.970 N/A THR 47.A OG1 ASN 45.A O no hydrogen 3.150 N/A VAL 49.A N GLY 42.A O no hydrogen 3.116 N/A ALA 50.A N TYR 96.A O no hydrogen 3.051 N/A VAL 51.A N TYR 40.A O no hydrogen 2.801 N/A LYS 52.A N LEU 94.A O no hydrogen 2.787 N/A LYS 53.A N VAL 38.A O no hydrogen 2.904 N/A LYS 53.A NZ ASP 91.A OD2 no hydrogen 2.744 N/A LEU 54.A N LEU 92.A O no hydrogen 2.906 N/A ALA 55.A N PHE 36.A O no hydrogen 3.223 N/A GLU 59.A N THR 56.A OG1 no hydrogen 3.203 N/A LEU 60.A N THR 56.A O no hydrogen 3.126 N/A LYS 61.A N THR 57.A O no hydrogen 3.004 N/A LYS 61.A NZ ASP 65.A OD1 no hydrogen 3.504 N/A GLN 62.A N GLU 58.A O no hydrogen 3.118 N/A GLN 62.A NE2 GLU 58.A O no hydrogen 3.627 N/A GLN 63.A N GLU 59.A O no hydrogen 3.108 N/A PHE 64.A N LEU 60.A O no hydrogen 3.030 N/A ASP 65.A N LYS 61.A O no hydrogen 2.937 N/A GLN 66.A N GLN 62.A O no hydrogen 2.844 N/A GLN 66.A NE2 ALA 167.A O no hydrogen 2.846 N/A GLU 67.A N GLN 63.A O no hydrogen 2.897 N/A ILE 68.A N PHE 64.A O no hydrogen 3.242 N/A LYS 69.A N ASP 65.A O no hydrogen 2.962 N/A VAL 70.A N GLN 66.A O no hydrogen 2.833 N/A MET 71.A N GLU 67.A O no hydrogen 2.938 N/A ALA 72.A N ILE 68.A O no hydrogen 2.877 N/A LYS 73.A N LYS 69.A O no hydrogen 3.360 N/A LYS 73.A N VAL 70.A O no hydrogen 3.207 N/A CYS 74.A N VAL 70.A O no hydrogen 2.839 N/A CYS 74.A SG HIS 141.A ND1 no hydrogen 3.873 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 2.940 N/A ASN 78.A ND2 ALA 159.A O no hydrogen 2.929 N/A LEU 79.A N HIS 76.A O no hydrogen 3.068 N/A VAL 80.A N ILE 161.A O no hydrogen 2.883 N/A LEU 83.A N VAL 95.A O no hydrogen 2.793 N/A GLY 84.A N VAL 95.A O no hydrogen 3.281 N/A PHE 85.A N HIS 5.A O no hydrogen 3.060 N/A SER 86.A N CYS 93.A O no hydrogen 2.856 N/A SER 86.A OG PHE 7.A O no hydrogen 3.244 N/A SER 86.A OG ASP 88.A OD1 no hydrogen 3.240 N/A CYS 93.A N SER 86.A O no hydrogen 2.936 N/A CYS 93.A SG ASP 91.A O no hydrogen 3.805 N/A LEU 94.A N LYS 52.A O no hydrogen 2.887 N/A VAL 95.A N GLY 84.A O no hydrogen 2.902 N/A TYR 96.A N ALA 50.A O no hydrogen 2.895 N/A TYR 96.A OH GLU 67.A OE1 no hydrogen 2.840 N/A VAL 97.A N GLU 81.A O no hydrogen 3.081 N/A ASN 101.A N LEU 153.A O no hydrogen 3.077 N/A ASN 101.A ND2 ASP 154.A O no hydrogen 2.909 N/A GLY 102.A N MET 99.A O no hydrogen 3.126 N/A LEU 104.A N ILE 151.A O no hydrogen 2.790 N/A LEU 105.A N SER 148.A O no hydrogen 3.207 N/A ASP 106.A N SER 103.A OG no hydrogen 3.207 N/A ARG 107.A N SER 103.A O no hydrogen 2.982 N/A ARG 107.A NE THR 114.A OG1 no hydrogen 2.826 N/A ARG 107.A NH1 ASN 101.A O no hydrogen 2.967 N/A ARG 107.A NH2 LEU 111.A O no hydrogen 2.995 N/A ARG 107.A NH2 THR 114.A OG1 no hydrogen 3.376 N/A LEU 108.A N LEU 104.A O no hydrogen 2.825 N/A SER 109.A N LEU 105.A O no hydrogen 3.073 N/A SER 109.A OG LEU 105.A O no hydrogen 3.406 N/A SER 109.A OG ASP 106.A O no hydrogen 3.099 N/A CYS 110.A N ARG 107.A O no hydrogen 3.187 N/A CYS 110.A SG ARG 107.A O no hydrogen 3.826 N/A LEU 111.A N ASP 106.A O no hydrogen 2.972 N/A GLY 113.A N CYS 110.A O no hydrogen 3.067 N/A THR 114.A OG1 LEU 111.A O no hydrogen 3.393 N/A TRP 119.A N ASP 246.A OD1 no hydrogen 2.777 N/A TRP 119.A NE1 SER 251.A OG no hydrogen 2.671 N/A HIS 120.A N ASP 246.A OD2 no hydrogen 2.996 N/A MET 121.A N SER 118.A OG no hydrogen 3.062 N/A ARG 122.A N SER 118.A O no hydrogen 2.968 N/A ARG 122.A NE LEU 117.A O no hydrogen 2.917 N/A ARG 122.A NH1 ILE 206.A O no hydrogen 2.819 N/A ARG 122.A NH1 ASP 241.A OD2 no hydrogen 2.893 N/A ARG 122.A NH2 LEU 117.A O no hydrogen 2.937 N/A ARG 122.A NH2 ASP 241.A OD2 no hydrogen 3.073 N/A CYS 123.A N TRP 119.A O no hydrogen 2.888 N/A CYS 123.A SG TRP 119.A O no hydrogen 3.482 N/A LYS 124.A N HIS 120.A O no hydrogen 3.303 N/A LYS 124.A NZ ALA 156.A O no hydrogen 2.977 N/A LYS 124.A NZ THR 158.A OG1 no hydrogen 3.337 N/A ILE 125.A N MET 121.A O no hydrogen 2.944 N/A ALA 126.A N ARG 122.A O no hydrogen 2.924 N/A GLN 127.A N CYS 123.A O no hydrogen 3.051 N/A GLY 128.A N LYS 124.A O no hydrogen 2.891 N/A ALA 129.A N ILE 125.A O no hydrogen 2.901 N/A ALA 130.A N ALA 126.A O no hydrogen 3.032 N/A ASN 131.A N GLN 127.A O no hydrogen 2.955 N/A GLY 132.A N GLY 128.A O no hydrogen 2.995 N/A ILE 133.A N ALA 129.A O no hydrogen 2.985 N/A ASN 134.A N ALA 130.A O no hydrogen 2.879 N/A ASN 134.A ND2 GLU 138.A OE2 no hydrogen 3.086 N/A PHE 135.A N ASN 131.A O no hydrogen 3.050 N/A LEU 136.A N GLY 132.A O no hydrogen 3.093 N/A HIS 137.A N ILE 133.A O no hydrogen 2.898 N/A HIS 137.A NE2 ASP 195.A OD2 no hydrogen 2.901 N/A GLU 138.A N ASN 134.A O no hydrogen 2.837 N/A ASN 139.A N PHE 135.A O no hydrogen 3.032 N/A HIS 140.A N HIS 137.A O no hydrogen 3.134 N/A HIS 141.A N LEU 136.A O no hydrogen 2.964 N/A HIS 141.A ND1 ASN 139.A O no hydrogen 2.819 N/A ILE 142.A N ARG 168.A O no hydrogen 2.855 N/A HIS 143.A N ASP 195.A OD2 no hydrogen 2.847 N/A HIS 143.A NE2 SER 162.A O no hydrogen 2.867 N/A ARG 144.A N ASP 195.A OD1 no hydrogen 3.001 N/A ARG 144.A NE LEU 166.A O no hydrogen 2.821 N/A ARG 144.A NH2 LEU 166.A O no hydrogen 3.095 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 2.935 N/A LYS 147.A NZ THR 177.A OG1 no hydrogen 2.868 N/A SER 148.A OG TYR 180.A OH no hydrogen 3.367 N/A SER 148.A OG GLU 205.A OE1 no hydrogen 3.153 N/A SER 148.A OG GLU 205.A OE2 no hydrogen 2.838 N/A ASN 150.A N LYS 147.A O no hydrogen 2.930 N/A ASN 150.A ND2 ASP 145.A O no hydrogen 2.868 N/A ASN 150.A ND2 ASP 145.A OD2 no hydrogen 3.412 N/A ILE 151.A N SER 148.A O no hydrogen 3.276 N/A LEU 152.A N LYS 160.A O no hydrogen 2.787 N/A LEU 153.A N GLY 102.A O no hydrogen 2.820 N/A ASP 154.A N THR 158.A O no hydrogen 3.214 N/A ALA 156.A N ASP 154.A OD1 no hydrogen 2.883 N/A PHE 157.A N ASP 154.A O no hydrogen 2.888 N/A THR 158.A N ASP 154.A OD1 no hydrogen 2.907 N/A LYS 160.A N LEU 152.A O no hydrogen 2.849 N/A LYS 160.A NZ GLU 77.A O no hydrogen 2.788 N/A ILE 161.A N ASN 78.A O no hydrogen 2.906 N/A SER 162.A N ASN 150.A O no hydrogen 2.908 N/A PHE 164.A N GLU 67.A OE2 no hydrogen 2.752 N/A GLY 165.A N ASP 163.A OD1 no hydrogen 3.382 N/A ALA 167.A N PHE 164.A O no hydrogen 3.147 N/A ARG 168.A N ILE 142.A O no hydrogen 2.908 N/A SER 170.A N HIS 140.A O no hydrogen 2.862 N/A THR 177.A OG1 ASP 145.A OD1 no hydrogen 2.795 N/A TYR 180.A N THR 177.A O no hydrogen 2.952 N/A TYR 180.A OH SER 148.A OG no hydrogen 3.367 N/A TYR 180.A OH GLU 205.A OE1 no hydrogen 2.969 N/A TYR 180.A OH GLU 205.A OE2 no hydrogen 3.160 N/A MET 181.A N THR 178.A O no hydrogen 3.213 N/A GLU 184.A N GLU 184.A OE1 no hydrogen 2.888 N/A LEU 186.A N ALA 182.A O no hydrogen 3.082 N/A ARG 187.A N GLU 184.A O no hydrogen 3.207 N/A GLY 188.A N ALA 185.A O no hydrogen 3.129 N/A GLU 189.A N GLU 184.A O no hydrogen 2.944 N/A ILE 190.A N VAL 171.A O no hydrogen 2.738 N/A LYS 193.A N THR 191.A OG1 no hydrogen 3.151 N/A SER 194.A N THR 191.A O no hydrogen 3.028 N/A SER 194.A OG GLU 184.A OE2 no hydrogen 2.672 N/A TYR 197.A N LYS 193.A O no hydrogen 3.319 N/A TYR 197.A OH GLU 265.A OE2 no hydrogen 3.201 N/A SER 198.A N SER 194.A O no hydrogen 3.116 N/A SER 198.A OG TYR 180.A O no hydrogen 2.680 N/A SER 198.A OG SER 194.A O no hydrogen 3.269 N/A PHE 199.A N ASP 195.A O no hydrogen 2.925 N/A GLY 200.A N ILE 196.A O no hydrogen 3.009 N/A VAL 201.A N TYR 197.A O no hydrogen 3.264 N/A VAL 202.A N SER 198.A O no hydrogen 3.086 N/A LEU 203.A N PHE 199.A O no hydrogen 2.906 N/A LEU 204.A N GLY 200.A O no hydrogen 3.098 N/A GLU 205.A N VAL 201.A O no hydrogen 2.977 N/A ILE 206.A N VAL 202.A O no hydrogen 2.905 N/A ILE 207.A N LEU 203.A O no hydrogen 2.981 N/A THR 208.A N LEU 204.A O no hydrogen 2.996 N/A THR 208.A OG1 LEU 204.A O no hydrogen 2.763 N/A GLY 209.A N GLU 205.A O no hydrogen 2.753 N/A LEU 210.A N THR 208.A OG1 no hydrogen 3.053 N/A ASP 214.A N GLN 220.A O no hydrogen 3.012 N/A HIS 216.A N ASP 214.A OD1 no hydrogen 2.958 N/A ARG 217.A N ASP 214.A O no hydrogen 3.143 N/A ARG 217.A NE PRO 219.A O no hydrogen 2.868 N/A ARG 217.A NH1 PRO 211.A O no hydrogen 2.921 N/A ARG 217.A NH2 PRO 211.A O no hydrogen 2.992 N/A ARG 217.A NH2 GLN 220.A O no hydrogen 2.865 N/A GLN 220.A NE2 GLU 215.A O no hydrogen 3.257 N/A LEU 222.A N ALA 212.A O no hydrogen 2.879 N/A ASP 224.A N LEU 221.A O no hydrogen 3.070 N/A ILE 225.A N LEU 222.A O no hydrogen 2.955 N/A LYS 226.A N LEU 223.A O no hydrogen 3.301 N/A LYS 226.A NZ SER 260.A O no hydrogen 3.052 N/A GLU 227.A N ASP 224.A O no hydrogen 3.244 N/A GLU 228.A N ASP 224.A O no hydrogen 3.381 N/A ILE 229.A N ILE 225.A O no hydrogen 2.978 N/A GLU 230.A N LYS 226.A O no hydrogen 2.890 N/A ASP 231.A N GLU 227.A O no hydrogen 2.883 N/A GLU 232.A N ILE 229.A O no hydrogen 3.085 N/A GLU 233.A N GLU 228.A O no hydrogen 2.923 N/A LYS 234.A N GLU 228.A O no hydrogen 3.202 N/A THR 235.A N ASP 238.A OD2 no hydrogen 2.864 N/A ASP 238.A N THR 235.A O no hydrogen 3.082 N/A ASP 238.A N THR 235.A OG1 no hydrogen 3.324 N/A TYR 239.A N ILE 236.A O no hydrogen 2.907 N/A TYR 239.A OH GLU 228.A OE2 no hydrogen 2.525 N/A ASP 241.A N ILE 207.A O no hydrogen 2.878 N/A LYS 243.A N ASP 241.A OD1 no hydrogen 2.980 N/A LYS 243.A NZ ASP 241.A OD1 no hydrogen 2.787 N/A LYS 243.A NZ ASP 241.A OD2 no hydrogen 3.482 N/A SER 249.A OG GLU 237.A OE1 no hydrogen 3.039 N/A SER 251.A N ASP 248.A OD2 no hydrogen 3.011 N/A SER 251.A OG ASP 248.A OD1 no hydrogen 2.647 N/A VAL 252.A N ASP 248.A O no hydrogen 3.136 N/A GLU 253.A N SER 249.A O no hydrogen 2.874 N/A ALA 254.A N THR 250.A O no hydrogen 3.026 N/A MET 255.A N SER 251.A O no hydrogen 2.943 N/A TYR 256.A N VAL 252.A O no hydrogen 2.864 N/A SER 257.A N GLU 253.A O no hydrogen 2.886 N/A VAL 258.A N ALA 254.A O no hydrogen 3.208 N/A ALA 259.A N MET 255.A O no hydrogen 2.976 N/A SER 260.A N TYR 256.A O no hydrogen 2.804 N/A SER 260.A OG GLU 230.A OE2 no hydrogen 3.566 N/A GLN 261.A N SER 257.A O no hydrogen 3.087 N/A GLN 261.A NE2 SER 257.A O no hydrogen 3.149 N/A GLN 261.A NE2 SER 257.A OG no hydrogen 3.267 N/A CYS 262.A N VAL 258.A O no hydrogen 2.959 N/A CYS 262.A SG VAL 258.A O no hydrogen 3.330 N/A LEU 263.A N ALA 259.A O no hydrogen 3.005 N/A HIS 264.A N GLN 261.A O no hydrogen 3.381 N/A LYS 267.A NZ GLU 189.A OE1 no hydrogen 2.963 N/A LYS 267.A NZ GLU 189.A OE2 no hydrogen 3.558 N/A LYS 269.A N LYS 266.A O no hydrogen 3.078 N/A ARG 270.A N LYS 267.A O no hydrogen 3.361 N/A ARG 270.A NE HIS 264.A O no hydrogen 2.772 N/A ARG 270.A NH1 GLU 184.A OE1 no hydrogen 3.519 N/A ARG 270.A NH1 GLU 184.A OE2 no hydrogen 2.710 N/A ARG 270.A NH1 LYS 193.A O no hydrogen 2.938 N/A ARG 270.A NH2 GLU 184.A OE1 no hydrogen 2.870 N/A ARG 270.A NH2 HIS 264.A O no hydrogen 3.311 N/A ARG 270.A NH2 GLU 265.A O no hydrogen 3.289 N/A LYS 274.A NZ GLN 277.A OE1 no hydrogen 2.871 N/A LYS 275.A N ASP 272.A OD1 no hydrogen 3.078 N/A VAL 276.A N ASP 272.A O no hydrogen 3.145 N/A GLN 277.A N ILE 273.A O no hydrogen 2.928 N/A GLN 277.A NE2 ASN 131.A OD1 no hydrogen 2.826 N/A GLN 278.A N LYS 274.A O no hydrogen 3.095 N/A LEU 279.A N LYS 275.A O no hydrogen 2.926 N/A LEU 280.A N VAL 276.A O no hydrogen 2.938 N/A GLN 281.A N GLN 277.A O no hydrogen 2.956 N/A GLU 282.A N GLN 278.A O no hydrogen 2.967 N/A MET 283.A N LEU 279.A O no hydrogen 3.078 N/A THR 284.A N GLN 281.A O no hydrogen 3.255 N/A THR 284.A OG1 GLN 127.A OE1 no hydrogen 2.911 N/A THR 284.A OG1 GLN 281.A O no hydrogen 3.494 N/A ALA 285.A N GLU 282.A O no hydrogen 3.373 N/A