Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pw0_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N.B ASN 1.A OD1.B no hydrogen 2.701 N/A ASN 1.A ND2.B GLY 24.A O no hydrogen 3.365 N/A ASP 2.A N THR 5.A OG1 no hydrogen 3.234 N/A HIS 3.A N ASN 50.A OD1 no hydrogen 2.743 N/A THR 5.A N ASP 2.A O no hydrogen 3.204 N/A THR 5.A N ASP 2.A OD1 no hydrogen 2.976 N/A THR 5.A OG1 ASN 1.A OD1.A no hydrogen 3.382 N/A THR 5.A OG1 ASP 2.A OD1 no hydrogen 2.747 N/A ALA 6.A N ASP 2.A O no hydrogen 2.902 N/A THR 8.A N ASP 178.A OD2 no hydrogen 2.947 N/A THR 8.A OG1 ASP 178.A O no hydrogen 3.517 N/A THR 8.A OG1 ASP 178.A OD2 no hydrogen 3.495 N/A GLN 9.A N TYR 20.A O no hydrogen 2.754 N/A ILE 11.A N TYR 18.A O no hydrogen 2.939 N/A VAL 13.A N THR 16.A O no hydrogen 2.797 N/A ASN 14.A ND2.A GLU 85.A OE1.A no hydrogen 3.096 N/A ASN 14.A ND2.A GLU 85.A OE1.B no hydrogen 3.428 N/A ASN 14.A ND2.B GLU 85.A OE1.A no hydrogen 2.735 N/A THR 16.A N VAL 13.A O no hydrogen 2.912 N/A ARG 17.A N SER 70.A OG no hydrogen 2.883 N/A ARG 17.A NE.B LEU 68.A O no hydrogen 3.053 N/A ARG 17.A NH2.B LEU 68.A O no hydrogen 2.930 N/A TYR 18.A N ILE 11.A O no hydrogen 2.854 N/A TYR 18.A OH GLU 85.A OE2.A no hydrogen 2.681 N/A ALA 19.A N SER 69.A OG no hydrogen 2.886 N/A TYR 20.A N GLN 9.A O no hydrogen 2.916 N/A ARG 21.A N ILE 60.A O no hydrogen 2.845 N/A ARG 21.A NE THR 8.A OG1 no hydrogen 2.986 N/A ARG 21.A NH1 ASP 42.A OD1.A no hydrogen 3.204 N/A ARG 21.A NH1 ASP 42.A OD1.B no hydrogen 2.441 N/A ARG 21.A NH1 ASP 42.A OD2.B no hydrogen 3.168 N/A ARG 21.A NH2 THR 8.A OG1 no hydrogen 3.348 N/A ARG 21.A NH2 ASP 42.A OD1.A no hydrogen 2.930 N/A ARG 21.A NH2 ASP 42.A OD2.B no hydrogen 2.658 N/A LEU 23.A N LEU 58.A O no hydrogen 2.784 N/A GLY 24.A N ASN 1.A O no hydrogen 3.158 N/A SER 27.A N GLN 57.A OE1 no hydrogen 3.265 N/A LEU 31.A N GLN 57.A O no hydrogen 2.854 N/A ILE 32.A N ASP 96.A O no hydrogen 2.848 N/A CYS 33.A N ILE 59.A O no hydrogen 2.932 N/A PHE 34.A N LEU 98.A O no hydrogen 2.791 N/A GLN 35.A NE2 THR 40.A O no hydrogen 2.945 N/A HIS 36.A N GLN 35.A OE1 no hydrogen 2.912 N/A HIS 36.A ND1 PHE 37.A O no hydrogen 2.808 N/A THR 38.A N GLN 191.A OE1 no hydrogen 2.809 N/A THR 38.A OG1 PHE 37.A O no hydrogen 2.680 N/A GLY 39.A N HIS 36.A O no hydrogen 3.035 N/A THR 40.A N ASN 43.A OD1 no hydrogen 2.840 N/A THR 40.A OG1 ASN 43.A OD1 no hydrogen 3.229 N/A LEU 41.A N ASP 180.A OD2 no hydrogen 2.965 N/A ASN 43.A N THR 40.A O no hydrogen 3.081 N/A LEU 47.A N ASP 45.A OD1 no hydrogen 2.992 N/A ILE 48.A N ASP 45.A O no hydrogen 2.929 N/A THR 49.A N ASP 45.A O no hydrogen 2.953 N/A THR 49.A OG1 HIS 3.A ND1 no hydrogen 2.837 N/A THR 49.A OG1 ASP 45.A O no hydrogen 3.463 N/A THR 49.A OG1 PRO 46.A O no hydrogen 3.565 N/A ASN 50.A N PRO 46.A O no hydrogen 2.776 N/A GLY 51.A N LEU 47.A O no hydrogen 2.976 N/A LEU 52.A N ILE 48.A O no hydrogen 2.898 N/A SER 53.A N THR 49.A O no hydrogen 3.029 N/A SER 53.A OG THR 49.A O no hydrogen 2.775 N/A SER 53.A OG ASN 50.A O no hydrogen 3.259 N/A LYS 54.A NZ ASN 50.A O no hydrogen 3.151 N/A GLY 55.A N LEU 52.A O no hydrogen 3.440 N/A ARG 56.A NE LEU 52.A O no hydrogen 2.881 N/A ARG 56.A NH1 ASP 267.A OD1.A no hydrogen 2.611 N/A ARG 56.A NH1 ASP 267.A OD1.B no hydrogen 3.292 N/A ARG 56.A NH2 ASP 267.A OD1.A no hydrogen 3.338 N/A ARG 56.A NH2 ASP 267.A OD1.B no hydrogen 3.259 N/A ARG 56.A NH2 ASP 267.A OD2.A no hydrogen 3.090 N/A GLN 57.A N SER 27.A OG no hydrogen 2.918 N/A GLN 57.A NE2 SER 22.A OG no hydrogen 2.984 N/A LEU 58.A N LEU 23.A O no hydrogen 2.956 N/A ILE 59.A N LEU 31.A O no hydrogen 2.897 N/A ILE 60.A N ARG 21.A O no hydrogen 3.068 N/A ASP 62.A N ALA 19.A O no hydrogen 2.903 N/A LYS 64.A N ASN 63.A OD1 no hydrogen 2.821 N/A LYS 64.A NZ ASP 82.A OD1 no hydrogen 3.266 N/A GLY 65.A N SER 70.A O no hydrogen 2.864 N/A VAL 66.A N ASN 63.A O no hydrogen 2.971 N/A GLY 67.A N ALA 183.A O.A no hydrogen 3.269 N/A LEU 68.A N ASP 180.A OD1 no hydrogen 2.941 N/A SER 69.A N VAL 66.A O no hydrogen 3.007 N/A SER 69.A OG ASP 62.A O no hydrogen 2.693 N/A SER 70.A N ARG 17.A O no hydrogen 2.825 N/A THR 73.A N GLN 186.A OE1 no hydrogen 2.904 N/A THR 73.A OG1 LYS 64.A O no hydrogen 2.875 N/A THR 73.A OG1 GLN 186.A OE1 no hydrogen 3.456 N/A ASN 76.A ND2 ASP 75.A OD1 no hydrogen 2.881 N/A ALA 79.A N ASN 76.A OD1 no hydrogen 2.860 N/A THR 80.A OG1 VAL 77.A O no hydrogen 2.839 N/A ALA 81.A N ALA 78.A O no hydrogen 3.041 N/A ASP 82.A N ALA 79.A O no hydrogen 2.889 N/A LEU 84.A N THR 80.A O no hydrogen 2.984 N/A GLU 85.A N ALA 81.A O no hydrogen 3.026 N/A PHE 86.A N ASP 82.A O no hydrogen 3.133 N/A ILE 87.A N ALA 83.A O no hydrogen 2.916 N/A THR 88.A N LEU 84.A O no hydrogen 2.918 N/A THR 88.A OG1.A LEU 84.A O no hydrogen 2.648 N/A THR 88.A OG1.A GLU 85.A O no hydrogen 3.161 N/A THR 88.A OG1.B LEU 84.A O no hydrogen 2.611 N/A ALA 89.A N GLU 85.A O no hydrogen 2.974 N/A LEU 90.A N PHE 86.A O no hydrogen 3.195 N/A LEU 90.A N ILE 87.A O no hydrogen 3.139 N/A GLY 91.A N THR 88.A O no hydrogen 2.903 N/A ILE 92.A N ILE 87.A O no hydrogen 3.317 N/A ASP 96.A N PRO 30.A O no hydrogen 2.898 N/A VAL 97.A N LYS 118.A O no hydrogen 2.969 N/A LEU 98.A N ILE 32.A O no hydrogen 2.906 N/A GLY 99.A N ILE 120.A O no hydrogen 2.839 N/A PHE 100.A N PHE 34.A O no hydrogen 3.024 N/A SER 101.A N VAL 122.A O no hydrogen 2.923 N/A SER 101.A OG HIS 248.A NE2 no hydrogen 3.376 N/A GLY 103.A N PHE 100.A O no hydrogen 2.917 N/A PHE 105.A N SER 101.A O no hydrogen 3.274 N/A PHE 105.A N LEU 102.A O no hydrogen 2.951 N/A ILE 106.A N LEU 102.A O no hydrogen 3.138 N/A VAL 107.A N GLY 103.A O no hydrogen 3.018 N/A GLN 108.A NE2 GLY 104.A O no hydrogen 3.023 N/A GLN 108.A NE2 ALA 125.A O no hydrogen 3.087 N/A TYR 109.A N PHE 105.A O no hydrogen 3.062 N/A HIS 111.A N GLN 108.A O no hydrogen 3.143 N/A ILE 112.A N TYR 109.A O no hydrogen 2.966 N/A ARG 117.A N PHE 95.A O no hydrogen 2.907 N/A ARG 117.A NE ASP 96.A OD1 no hydrogen 2.902 N/A ARG 117.A NH2 ASP 96.A OD1 no hydrogen 3.508 N/A ARG 117.A NH2 ASP 96.A OD2 no hydrogen 2.712 N/A ARG 117.A NH2 LEU 266.A O no hydrogen 3.116 N/A LYS 118.A N ASP 96.A OD1 no hydrogen 2.864 N/A LYS 118.A NZ PHE 265.A O no hydrogen 2.809 N/A LYS 118.A NZ LEU 266.A O no hydrogen 3.031 N/A LYS 118.A NZ TYR 269.A O no hydrogen 2.711 N/A ILE 119.A N PRO 213.A O no hydrogen 3.011 N/A ILE 120.A N VAL 97.A O no hydrogen 2.796 N/A ILE 121.A N PHE 215.A O no hydrogen 2.868 N/A VAL 122.A N GLY 99.A O no hydrogen 2.862 N/A GLY 123.A N VAL 217.A O no hydrogen 3.031 N/A GLN 127.A NE2 SER 204.A OG no hydrogen 3.067 N/A GLY 128.A N TRP 198.A O no hydrogen 2.850 N/A LEU 132.A N VAL 129.A O no hydrogen 3.284 N/A HIS 133.A N LYS 130.A O no hydrogen 2.938 N/A HIS 133.A NE2 GLY 199.A O no hydrogen 3.166 N/A THR 134.A N VAL 131.A O no hydrogen 3.322 N/A THR 134.A OG1 VAL 131.A O no hydrogen 3.138 N/A PHE 135.A N LEU 132.A O no hydrogen 3.068 N/A LEU 138.A N THR 134.A O no hydrogen 3.049 N/A ILE 139.A N PHE 135.A O no hydrogen 3.036 N/A ALA 140.A N PRO 136.A O no hydrogen 2.882 N/A ARG 141.A N ASP 137.A O no hydrogen 3.068 N/A ARG 141.A NH1.A GLU 223.A OE2.A no hydrogen 2.749 N/A ALA 142.A N LEU 138.A O no hydrogen 2.980 N/A LEU 144.A N ALA 142.A O no hydrogen 3.015 N/A LYS 147.A NZ GLU 148.A OE2 no hydrogen 2.711 N/A ARG 149.A N GLU 145.A O no hydrogen 2.788 N/A ARG 149.A NE.A ALA 142.A O no hydrogen 3.186 N/A ARG 149.A NE.A LEU 144.A O no hydrogen 3.169 N/A ARG 149.A NE.B LEU 144.A O no hydrogen 3.229 N/A PHE 150.A N PRO 146.A O no hydrogen 2.947 N/A LEU 151.A N LYS 147.A O no hydrogen 2.953 N/A PHE 152.A N GLU 148.A O no hydrogen 2.816 N/A ILE 153.A N ARG 149.A O no hydrogen 2.971 N/A PHE 154.A N PHE 150.A O no hydrogen 2.969 N/A PHE 155.A N LEU 151.A O no hydrogen 2.933 N/A GLU 156.A N SER 161.A OG no hydrogen 2.853 N/A GLN 157.A N GLU 156.A OE2 no hydrogen 2.795 N/A SER 158.A OG ASP 245.A OD2 no hydrogen 2.649 N/A HIS 160.A NE2 TYR 254.A OH no hydrogen 3.154 N/A SER 161.A N SER 158.A OG no hydrogen 2.954 N/A SER 161.A OG ASP 245.A O no hydrogen 3.549 N/A SER 161.A OG GLN 253.A OE1 no hydrogen 2.731 N/A ARG 162.A N SER 158.A O no hydrogen 2.877 N/A ARG 162.A NH2 GLU 148.A OE2 no hydrogen 2.589 N/A SER 163.A N GLU 159.A O no hydrogen 2.842 N/A SER 163.A OG.A GLU 159.A O no hydrogen 3.104 N/A SER 163.A OG.B GLU 159.A O no hydrogen 3.343 N/A SER 163.A OG.B HIS 160.A O no hydrogen 2.945 N/A LYS 164.A N HIS 160.A O no hydrogen 3.313 N/A GLY 165.A N SER 161.A O no hydrogen 2.939 N/A LEU 166.A N ARG 162.A O no hydrogen 2.899 N/A ALA 167.A N SER 163.A O no hydrogen 3.007 N/A THR 168.A N LYS 164.A O no hydrogen 3.057 N/A THR 168.A OG1 LYS 164.A O no hydrogen 2.884 N/A THR 168.A OG1 TYR 252.A O no hydrogen 3.194 N/A LEU 169.A N GLY 165.A O no hydrogen 3.032 N/A GLY 170.A N LEU 166.A O no hydrogen 3.101 N/A ARG 171.A N ALA 167.A O no hydrogen 2.982 N/A ARG 171.A NE ASP 45.A OD1 no hydrogen 2.833 N/A ARG 171.A NE ASP 45.A OD2 no hydrogen 3.385 N/A ARG 171.A NH2 ASP 45.A OD2 no hydrogen 2.678 N/A ARG 171.A NH2 TYR 252.A O no hydrogen 2.942 N/A LEU 172.A N THR 168.A O no hydrogen 2.968 N/A TYR 173.A N GLY 170.A O no hydrogen 2.983 N/A GLU 174.A N ARG 171.A O no hydrogen 3.173 N/A ARG 175.A NE THR 177.A O no hydrogen 2.962 N/A ARG 175.A NE ASP 178.A O no hydrogen 3.407 N/A ARG 175.A NH1 HIS 3.A O no hydrogen 2.809 N/A ARG 175.A NH1 ALA 6.A O no hydrogen 2.785 N/A ARG 175.A NH2 ALA 6.A O no hydrogen 2.994 N/A ARG 175.A NH2 ASP 178.A O no hydrogen 2.910 N/A THR 176.A OG1 THR 177.A OG1 no hydrogen 2.797 N/A THR 177.A OG1 THR 176.A OG1 no hydrogen 2.797 N/A ARG 179.A NH1.A LEU 172.A O no hydrogen 2.806 N/A ARG 179.A NH1.A ARG 175.A O no hydrogen 2.419 N/A ARG 179.A NH2.A LEU 172.A O no hydrogen 2.770 N/A ASP 180.A N ASP 42.A OD2.A no hydrogen 2.536 N/A ASP 180.A N ASP 42.A OD2.B no hydrogen 3.338 N/A SER 184.A OG ALA 183.A O.A no hydrogen 2.699 N/A GLN 186.A NE2 THR 73.A O no hydrogen 2.969 N/A ALA 187.A N SER 184.A OG no hydrogen 3.253 N/A ILE 188.A N SER 184.A O.A no hydrogen 3.020 N/A ILE 188.A N SER 184.A O.B no hydrogen 3.023 N/A GLY 189.A N ALA 185.A O no hydrogen 2.993 N/A ALA 190.A N GLN 186.A O no hydrogen 3.036 N/A GLN 191.A N ALA 187.A O no hydrogen 2.918 N/A LEU 192.A N ILE 188.A O no hydrogen 2.896 N/A THR 193.A N GLY 189.A O no hydrogen 3.090 N/A THR 193.A OG1 GLY 189.A O no hydrogen 2.927 N/A ALA 194.A N ALA 190.A O no hydrogen 2.925 N/A ILE 195.A N GLN 191.A O no hydrogen 2.873 N/A THR 196.A N LEU 192.A O no hydrogen 3.087 N/A THR 196.A OG1 LEU 192.A O no hydrogen 2.847 N/A ASN 197.A N THR 193.A O no hydrogen 2.950 N/A TRP 198.A N ALA 194.A O no hydrogen 2.939 N/A TRP 198.A NE1 ALA 125.A O no hydrogen 3.108 N/A GLY 199.A N THR 196.A O no hydrogen 3.063 N/A LYS 200.A N THR 196.A O no hydrogen 2.906 N/A LYS 201.A N ASN 197.A O no hydrogen 2.950 N/A SER 204.A N GLN 127.A OE1 no hydrogen 2.853 N/A THR 208.A OG1.B GLN 234.A O no hydrogen 2.759 N/A SER 209.A N GLU 206.A O no hydrogen 3.015 N/A SER 209.A OG GLU 206.A O no hydrogen 2.608 N/A ILE 210.A N ILE 207.A O no hydrogen 3.010 N/A HIS 212.A NE2 PRO 114.A O no hydrogen 2.881 N/A VAL 214.A N ASP 237.A O no hydrogen 2.945 N/A PHE 215.A N ILE 119.A O no hydrogen 2.800 N/A VAL 216.A N ILE 239.A O no hydrogen 2.813 N/A VAL 217.A N ILE 121.A O no hydrogen 2.854 N/A GLN 218.A N SER 241.A O no hydrogen 3.099 N/A GLN 218.A NE2 ASP 222.A OD2 no hydrogen 2.806 N/A GLY 219.A N GLN 218.A OE1 no hydrogen 2.731 N/A SER 220.A OG ALA 246.A O no hydrogen 3.121 N/A ASN 221.A N ALA 246.A O no hydrogen 2.861 N/A ASN 221.A ND2 GLU 156.A OE1 no hydrogen 3.121 N/A ASN 221.A ND2 GLU 223.A OE1.B no hydrogen 3.038 N/A ASP 222.A N THR 225.A OG1 no hydrogen 2.924 N/A THR 225.A OG1 GLY 219.A O no hydrogen 2.708 N/A TYR 226.A N ASP 224.A OD1 no hydrogen 2.925 N/A ASN 227.A N ASP 224.A O no hydrogen 2.874 N/A SER 228.A N THR 225.A O no hydrogen 2.908 N/A GLU 230.A N TYR 226.A O no hydrogen 2.858 N/A LEU 231.A N ASN 227.A O no hydrogen 3.025 N/A PHE 232.A N SER 228.A O no hydrogen 3.024 N/A LYS 233.A N TYR 229.A O no hydrogen 2.825 N/A GLN 234.A N GLU 230.A O no hydrogen 2.956 N/A GLN 234.A NE2.A GLU 230.A OE1.A no hydrogen 2.972 N/A LEU 235.A N LEU 231.A O no hydrogen 2.903 N/A ILE 239.A N VAL 214.A O no hydrogen 2.823 N/A SER 241.A N VAL 216.A O no hydrogen 2.866 N/A SER 241.A OG.A GLN 261.A OE1 no hydrogen 2.837 N/A TYR 243.A N GLN 218.A O no hydrogen 2.895 N/A TYR 243.A OH GLN 261.A OE1 no hydrogen 2.771 N/A ALA 246.A N SER 220.A OG no hydrogen 2.976 N/A HIS 248.A ND1 ASP 222.A OD2 no hydrogen 2.710 N/A GLY 249.A N PHE 154.A O no hydrogen 2.826 N/A TYR 252.A N GLY 249.A O no hydrogen 2.855 N/A TYR 252.A OH ASN 43.A O no hydrogen 2.698 N/A GLN 253.A N GLY 249.A O no hydrogen 3.126 N/A GLN 253.A NE2 ASP 245.A O no hydrogen 2.825 N/A GLN 253.A NE2 TYR 254.A OH no hydrogen 3.125 N/A TYR 254.A N SER 250.A O no hydrogen 3.124 N/A TYR 254.A OH HIS 160.A NE2 no hydrogen 3.154 N/A TYR 254.A OH PRO 244.A O no hydrogen 2.693 N/A PHE 258.A N TYR 254.A O no hydrogen 2.971 N/A VAL 259.A N PRO 255.A O no hydrogen 2.918 N/A SER 260.A N GLU 256.A O no hydrogen 2.930 N/A GLN 261.A N LEU 257.A O no hydrogen 2.946 N/A THR 262.A N PHE 258.A O no hydrogen 2.864 N/A THR 262.A OG1.A PHE 258.A O no hydrogen 2.828 N/A THR 262.A OG1.B PHE 258.A O no hydrogen 2.744 N/A GLU 263.A N VAL 259.A O no hydrogen 2.807 N/A TYR 264.A N SER 260.A O no hydrogen 3.354 N/A PHE 265.A N GLN 261.A O no hydrogen 3.050 N/A LEU 266.A N THR 262.A O no hydrogen 2.868 N/A ASP 267.A N GLU 263.A O no hydrogen 2.913 N/A SER 268.A N TYR 264.A O no hydrogen 2.773 N/A TYR 269.A N PHE 265.A O no hydrogen 3.259 N/A TYR 269.A OH ASP 237.A OD1 no hydrogen 2.614 N/A