Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2bw4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASP 2.A OD2 no hydrogen 2.983 N/A SER 4.A OG ASP 2.A OD1 no hydrogen 3.366 N/A SER 4.A OG ASP 2.A OD2 no hydrogen 2.484 N/A THR 5.A N ASP 2.A O no hydrogen 3.005 N/A THR 5.A OG1 ASP 2.A O no hydrogen 2.693 N/A LEU 6.A N ILE 3.A O no hydrogen 3.050 N/A ARG 8.A NH1 GLU 34.A OE2 no hydrogen 2.896 N/A ARG 8.A NH1 GLU 76.A OE2 no hydrogen 2.868 N/A ARG 8.A NH2 GLU 76.A OE1 no hydrogen 2.937 N/A ARG 8.A NH2 GLU 76.A OE2 no hydrogen 3.558 N/A VAL 9.A N VAL 32.A O no hydrogen 3.001 N/A VAL 11.A N GLU 34.A O no hydrogen 2.901 N/A PHE 18.A N LYS 15.A O no hydrogen 3.179 N/A HIS 20.A ND1.A ALA 21.A O.A no hydrogen 2.869 N/A HIS 20.A ND1.B ALA 21.A O.A no hydrogen 2.548 N/A HIS 20.A ND1.B ALA 21.A O.B no hydrogen 3.077 N/A HIS 22.A ND1.A HIS 20.A O.A no hydrogen 2.819 N/A HIS 22.A ND1.A HIS 20.A O.B no hydrogen 2.848 N/A HIS 22.A ND1.B HIS 20.A O.A no hydrogen 2.902 N/A HIS 22.A ND1.B HIS 20.A O.B no hydrogen 2.937 N/A HIS 22.A NE2.A TYR 166.A OH no hydrogen 2.796 N/A HIS 22.A NE2.B TYR 166.A OH no hydrogen 2.695 N/A GLN 24.A NE2 TYR 166.A O no hydrogen 2.875 N/A ALA 26.A N ARG 153.A O no hydrogen 2.833 N/A THR 28.A OG1 GLY 29.A O no hydrogen 2.797 N/A ARG 31.A N ASP 73.A OD1 no hydrogen 3.016 N/A VAL 32.A N PRO 7.A O no hydrogen 2.905 N/A VAL 33.A N TYR 74.A O no hydrogen 2.789 N/A GLU 34.A N VAL 9.A O no hydrogen 2.822 N/A PHE 35.A N GLU 76.A O no hydrogen 2.884 N/A THR 36.A OG1.B ARG 78.A O no hydrogen 3.346 N/A MET 37.A N ARG 78.A O no hydrogen 2.951 N/A THR 38.A N ASN 59.A OD1 no hydrogen 2.900 N/A ILE 39.A N ILE 80.A O no hydrogen 2.861 N/A GLU 40.A N THR 57.A O no hydrogen 2.897 N/A GLU 41.A N ASN 85.A OD1 no hydrogen 2.961 N/A LYS 42.A N ALA 55.A O no hydrogen 3.043 N/A LYS 42.A NZ GLU 40.A OE1.A no hydrogen 2.880 N/A LYS 42.A NZ GLU 40.A OE2.B no hydrogen 3.235 N/A LYS 42.A NZ GLY 60.A O no hydrogen 2.945 N/A LEU 44.A N ILE 53.A O no hydrogen 2.935 N/A ILE 46.A N THR 51.A O no hydrogen 2.934 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.872 N/A GLY 50.A N ASP 47.A O no hydrogen 3.230 N/A THR 51.A N ASP 47.A OD1 no hydrogen 2.872 N/A THR 51.A OG1 ASP 47.A OD1 no hydrogen 3.169 N/A THR 51.A OG1 ASP 47.A OD2 no hydrogen 2.697 N/A ILE 53.A N LEU 44.A O no hydrogen 2.885 N/A ALA 55.A N LYS 42.A O no hydrogen 2.779 N/A MET 56.A N SER 142.A O no hydrogen 2.927 N/A THR 57.A N GLU 40.A O no hydrogen 2.994 N/A THR 57.A OG1 GLU 40.A O no hydrogen 2.784 N/A ASN 59.A N THR 38.A O no hydrogen 2.835 N/A GLY 60.A N THR 57.A OG1 no hydrogen 2.973 N/A SER 61.A OG PRO 63.A O no hydrogen 2.664 N/A GLY 64.A N ASN 145.A O no hydrogen 2.847 N/A MET 67.A N ALA 147.A O no hydrogen 3.166 N/A VAL 68.A N HIS 20.A NE2.A no hydrogen 2.835 N/A VAL 68.A N HIS 20.A NE2.B no hydrogen 2.933 N/A VAL 69.A N MET 149.A O no hydrogen 2.900 N/A HIS 70.A N ASP 73.A OD2 no hydrogen 2.826 N/A HIS 70.A NE2 GLN 24.A O no hydrogen 2.909 N/A GLU 71.A N LEU 151.A O no hydrogen 2.840 N/A ASN 72.A N ALA 120.A O no hydrogen 2.813 N/A ASP 73.A N HIS 70.A O no hydrogen 2.953 N/A TYR 74.A N ARG 31.A O no hydrogen 2.902 N/A VAL 75.A N PHE 118.A O no hydrogen 2.801 N/A GLU 76.A N VAL 33.A O no hydrogen 2.893 N/A LEU 77.A N LEU 116.A O no hydrogen 2.825 N/A ARG 78.A N PHE 35.A O no hydrogen 2.859 N/A ARG 78.A NE.A GLU 113.A OE2 no hydrogen 2.895 N/A ARG 78.A NH2.A GLU 113.A OE1 no hydrogen 2.890 N/A ARG 78.A NH2.A GLU 113.A OE2 no hydrogen 3.553 N/A LEU 79.A N THR 114.A O no hydrogen 2.818 N/A ILE 80.A N MET 37.A O no hydrogen 2.950 N/A ASN 81.A N GLU 112.A O no hydrogen 2.888 N/A ASN 81.A ND2 LEU 87.A O no hydrogen 2.976 N/A ASN 81.A ND2 VAL 108.A O no hydrogen 2.875 N/A ASN 85.A N PRO 82.A O no hydrogen 3.039 N/A ASN 85.A ND2 ILE 39.A O no hydrogen 2.949 N/A ASN 85.A ND2 ASN 81.A OD1 no hydrogen 2.826 N/A THR 86.A N GLU 41.A OE1 no hydrogen 2.814 N/A THR 86.A OG1.A GLU 41.A OE1 no hydrogen 3.179 N/A LEU 87.A N GLU 41.A OE2 no hydrogen 2.962 N/A HIS 89.A N VAL 108.A O no hydrogen 3.150 N/A HIS 89.A NE2 GLU 41.A OE2 no hydrogen 2.761 N/A ASN 90.A ND2 GLY 103.A O no hydrogen 3.030 N/A ASN 90.A ND2 ALA 131.A O no hydrogen 3.099 N/A ILE 91.A N THR 106.A OG1 no hydrogen 3.019 N/A ASP 92.A N HIS 129.A O no hydrogen 2.797 N/A PHE 93.A N GLY 101.A O no hydrogen 2.810 N/A HIS 94.A N VAL 127.A O no hydrogen 2.876 N/A ALA 96.A N PHE 93.A O no hydrogen 3.061 N/A GLY 102.A N ALA 99.A O no hydrogen 2.888 N/A GLY 103.A N LEU 100.A O.A no hydrogen 3.187 N/A ALA 104.A N ALA 99.A O no hydrogen 3.124 N/A LEU 105.A N GLY 102.A O no hydrogen 2.990 N/A THR 106.A N GLY 103.A O no hydrogen 3.521 N/A THR 106.A OG1 ILE 91.A O no hydrogen 3.249 N/A THR 106.A OG1 GLY 102.A O no hydrogen 2.844 N/A GLN 107.A NE2 GLY 103.A O no hydrogen 3.427 N/A VAL 108.A N HIS 89.A O no hydrogen 2.844 N/A ASN 109.A N GLU 112.A OE1 no hydrogen 2.862 N/A ASN 109.A ND2 GLU 112.A OE1 no hydrogen 3.100 N/A GLY 111.A N ASN 81.A O no hydrogen 2.781 N/A GLU 112.A N ASN 109.A O no hydrogen 3.021 N/A THR 114.A N LEU 79.A O no hydrogen 2.966 N/A LEU 116.A N LEU 77.A O no hydrogen 2.918 N/A ARG 117.A NH1 GLU 76.A OE1 no hydrogen 2.935 N/A PHE 118.A N VAL 75.A O no hydrogen 2.928 N/A LYS 119.A NZ.A TYR 74.A OH no hydrogen 3.563 N/A ALA 120.A N ASP 73.A O no hydrogen 2.877 N/A GLY 124.A N VAL 150.A O no hydrogen 2.807 N/A VAL 125.A N GLY 262.A O no hydrogen 2.808 N/A PHE 126.A N ILE 148.A O no hydrogen 2.796 N/A TYR 128.A N GLY 146.A O no hydrogen 3.078 N/A TYR 128.A OH PRO 65.A O.A no hydrogen 2.688 N/A TYR 128.A OH PRO 65.A O.B no hydrogen 2.762 N/A HIS 129.A N ASP 92.A O no hydrogen 2.912 N/A HIS 129.A ND1 CYS 130.A O no hydrogen 2.770 N/A CYS 130.A N MET 144.A O no hydrogen 3.030 N/A CYS 130.A SG HIS 89.A ND1 no hydrogen 3.825 N/A CYS 130.A SG ASN 90.A O no hydrogen 3.520 N/A CYS 130.A SG ASN 90.A OD1 no hydrogen 3.554 N/A CYS 130.A SG HIS 139.A ND1 no hydrogen 3.448 N/A ALA 131.A N ASN 90.A OD1 no hydrogen 2.718 N/A MET 135.A N PRO 132.A O no hydrogen 2.883 N/A HIS 139.A N MET 135.A O no hydrogen 3.292 N/A VAL 140.A N VAL 136.A O no hydrogen 3.103 N/A THR 141.A N PRO 137.A O no hydrogen 2.863 N/A THR 141.A OG1 PRO 137.A O no hydrogen 2.805 N/A SER 142.A N HIS 139.A O no hydrogen 3.166 N/A SER 142.A OG TRP 138.A O no hydrogen 2.731 N/A GLY 143.A N VAL 140.A O no hydrogen 3.060 N/A MET 144.A N HIS 139.A O no hydrogen 3.182 N/A ASN 145.A N GLY 143.A O no hydrogen 2.952 N/A ASN 145.A ND2 VAL 140.A O no hydrogen 2.991 N/A ASN 145.A ND2 GLN 175.A OE1 no hydrogen 2.801 N/A GLY 146.A N TYR 128.A O no hydrogen 2.869 N/A ILE 148.A N PHE 126.A O no hydrogen 2.822 N/A MET 149.A N MET 67.A O no hydrogen 2.714 N/A VAL 150.A N GLY 124.A O no hydrogen 2.723 N/A LEU 151.A N VAL 69.A O no hydrogen 2.838 N/A ARG 153.A NH1 THR 28.A O no hydrogen 3.156 N/A ARG 153.A NH2 THR 28.A O no hydrogen 2.818 N/A GLY 155.A N PRO 152.A O no hydrogen 2.982 N/A LYS 157.A NZ.A ASP 154.A OD1 no hydrogen 2.973 N/A LYS 157.A NZ.B ASP 154.A O no hydrogen 3.405 N/A LYS 157.A NZ.B ASP 154.A OD1 no hydrogen 2.324 N/A ASP 158.A N GLN 162.A O no hydrogen 2.810 N/A GLU 159.A N GLU 159.A OE1 no hydrogen 2.751 N/A LYS 160.A N ASP 158.A OD1 no hydrogen 2.868 N/A GLY 161.A N ASP 158.A O no hydrogen 3.119 N/A GLN 162.A N ASP 158.A OD1 no hydrogen 3.005 N/A LEU 164.A N LEU 156.A O no hydrogen 2.948 N/A TYR 166.A N GLN 24.A OE1 no hydrogen 3.127 N/A TYR 166.A OH HIS 22.A NE2.A no hydrogen 2.796 N/A TYR 166.A OH HIS 22.A NE2.B no hydrogen 2.695 N/A ASP 167.A N ARG 234.A O no hydrogen 2.738 N/A LYS 168.A N ARG 234.A O no hydrogen 3.155 N/A LYS 168.A NZ TYR 170.A OH no hydrogen 3.025 N/A LYS 168.A NZ THR 228.A O no hydrogen 2.844 N/A TYR 170.A N LEU 236.A O no hydrogen 2.957 N/A TYR 170.A OH THR 228.A O no hydrogen 3.064 N/A TYR 171.A N PRO 17.A O no hydrogen 2.845 N/A TYR 171.A OH SER 240.A OG no hydrogen 2.692 N/A VAL 172.A N VAL 238.A O no hydrogen 2.793 N/A GLU 174.A N SER 240.A O no hydrogen 3.007 N/A GLN 175.A N VAL 213.A O no hydrogen 2.813 N/A GLN 175.A NE2 VAL 140.A O no hydrogen 3.391 N/A GLN 175.A NE2 ASP 176.A O no hydrogen 2.942 N/A ASP 176.A N ASP 176.A OD1 no hydrogen 2.685 N/A PHE 177.A N HIS 211.A O no hydrogen 2.880 N/A TYR 178.A OH ASP 176.A OD2 no hydrogen 2.582 N/A VAL 179.A N THR 210.A OG1 no hydrogen 2.941 N/A ASP 182.A N ASN 186.A O no hydrogen 2.806 N/A GLY 185.A N ASP 182.A O no hydrogen 2.938 N/A ASN 186.A N ASP 182.A OD1 no hydrogen 2.963 N/A LYS 188.A N.A PRO 180.A O no hydrogen 2.876 N/A LYS 188.A N.B PRO 180.A O no hydrogen 2.780 N/A LYS 188.A NZ.A ASP 199.A OD2.A no hydrogen 2.934 N/A LYS 188.A NZ.B ASP 199.A OD2.A no hydrogen 2.878 N/A TYR 190.A OH.A ASP 199.A OD2.A no hydrogen 2.600 N/A TYR 190.A OH.B ASP 199.A OD2.B no hydrogen 2.709 N/A THR 192.A OG1.B GLU 191.A OE1.A no hydrogen 1.246 N/A GLU 195.A N THR 192.A OG1.A no hydrogen 3.021 N/A ALA 196.A N THR 192.A O.A no hydrogen 3.064 N/A ALA 196.A N PRO 193.A O no hydrogen 3.086 N/A TYR 197.A N GLY 194.A O no hydrogen 3.272 N/A ALA 200.A N ALA 196.A O no hydrogen 2.821 N/A VAL 201.A N TYR 197.A O no hydrogen 2.892 N/A LYS 202.A N GLU 198.A O no hydrogen 2.855 N/A ALA 203.A N ASP 199.A O.A no hydrogen 2.787 N/A ALA 203.A N ASP 199.A O.B no hydrogen 3.131 N/A MET 204.A N ALA 200.A O no hydrogen 2.905 N/A ARG 205.A N VAL 201.A O no hydrogen 2.943 N/A THR 206.A N ALA 203.A O no hydrogen 3.230 N/A THR 206.A OG1 ALA 203.A O no hydrogen 2.745 N/A THR 206.A OG1 THR 208.A O no hydrogen 3.561 N/A LEU 207.A N MET 204.A O no hydrogen 2.880 N/A THR 208.A N THR 206.A OG1 no hydrogen 3.091 N/A THR 208.A OG1 THR 206.A O no hydrogen 3.186 N/A THR 210.A N PHE 177.A O no hydrogen 2.870 N/A THR 210.A OG1 PHE 177.A O no hydrogen 3.246 N/A THR 210.A OG1 HIS 211.A ND1 no hydrogen 2.781 N/A HIS 211.A N PHE 177.A O no hydrogen 3.484 N/A HIS 211.A ND1 THR 210.A OG1 no hydrogen 2.781 N/A HIS 211.A NE2 ASP 47.A OD2 no hydrogen 2.819 N/A ILE 212.A N LEU 308.A O no hydrogen 2.951 N/A VAL 213.A N GLN 175.A O no hydrogen 2.931 N/A ASN 215.A N GLY 173.A O no hydrogen 3.073 N/A ASN 215.A ND2 PRO 16.A O no hydrogen 3.148 N/A VAL 218.A N ILE 46.A O no hydrogen 2.885 N/A ALA 220.A N ALA 217.A O no hydrogen 3.122 N/A THR 222.A OG1 GLY 219.A O no hydrogen 2.713 N/A HIS 225.A N THR 222.A O no hydrogen 2.992 N/A ALA 226.A N GLY 223.A O no hydrogen 3.069 N/A LEU 227.A N HIS 313.A O no hydrogen 2.872 N/A THR 228.A N TYR 170.A OH no hydrogen 3.004 N/A THR 228.A OG1 TYR 170.A OH no hydrogen 3.265 N/A ALA 229.A N LYS 315.A O no hydrogen 3.242 N/A ALA 230.A N GLU 233.A OE1.A no hydrogen 2.810 N/A ALA 230.A N GLU 233.A OE1.B no hydrogen 3.006 N/A VAL 231.A N THR 317.A O no hydrogen 2.838 N/A GLY 232.A N PHE 289.A O no hydrogen 2.777 N/A GLU 233.A N ALA 230.A O no hydrogen 2.984 N/A ARG 234.A N ASP 167.A OD2 no hydrogen 2.844 N/A ARG 234.A NE ASP 167.A OD2 no hydrogen 2.931 N/A ARG 234.A NH2 ASP 167.A OD1 no hydrogen 2.832 N/A VAL 235.A N TYR 287.A O no hydrogen 2.811 N/A LEU 236.A N LYS 168.A O no hydrogen 2.937 N/A VAL 237.A N ALA 285.A O no hydrogen 2.801 N/A VAL 238.A N TYR 170.A O no hydrogen 2.867 N/A HIS 239.A N GLY 283.A O no hydrogen 2.903 N/A HIS 239.A ND1 TYR 297.A OH no hydrogen 2.644 N/A HIS 239.A NE2 GLU 174.A OE1 no hydrogen 2.787 N/A SER 240.A N VAL 172.A O no hydrogen 3.069 N/A SER 240.A OG TYR 171.A OH no hydrogen 2.692 N/A GLN 241.A N THR 281.A O no hydrogen 3.095 N/A GLN 241.A NE2 ASP 176.A OD1 no hydrogen 2.997 N/A ASN 243.A N GLN 241.A OE1 no hydrogen 2.902 N/A ASN 243.A ND2 ASP 176.A OD2 no hydrogen 2.894 N/A ARG 244.A N GLN 241.A OE1 no hydrogen 3.044 N/A ARG 244.A NH1.A GLU 304.A OE1 no hydrogen 2.982 N/A ARG 244.A NH2.A GLU 304.A OE2 no hydrogen 2.774 N/A THR 246.A N ILE 277.A O no hydrogen 2.951 N/A THR 246.A OG1 GLU 174.A OE1 no hydrogen 2.674 N/A THR 246.A OG1 GLU 174.A OE2 no hydrogen 3.268 N/A ARG 247.A NH1 ASN 299.A OD1 no hydrogen 2.981 N/A ARG 247.A NH1 GLU 304.A OE1 no hydrogen 3.365 N/A HIS 249.A N VAL 298.A O no hydrogen 2.879 N/A HIS 249.A ND1 THR 274.A OG1 no hydrogen 2.746 N/A ILE 251.A N ALA 296.A O.A no hydrogen 2.762 N/A ILE 251.A N ALA 296.A O.B no hydrogen 2.706 N/A GLY 253.A N LEU 250.A O no hydrogen 2.912 N/A GLY 255.A N GLN 272.A O no hydrogen 2.857 N/A TYR 257.A N PHE 286.A O no hydrogen 3.165 N/A VAL 258.A N ASP 269.A O no hydrogen 2.765 N/A TRP 259.A N ALA 284.A O no hydrogen 2.841 N/A TRP 259.A NE1 ASN 266.A O no hydrogen 3.047 N/A GLY 262.A N TRP 259.A O no hydrogen 2.942 N/A LYS 263.A NZ VAL 125.A O no hydrogen 2.657 N/A LYS 263.A NZ THR 261.A O no hydrogen 2.761 N/A PHE 264.A N PRO 123.A O no hydrogen 3.336 N/A ARG 265.A NH2.A GLU 71.A OE2 no hydrogen 2.681 N/A ARG 265.A NH2.A THR 121.A O no hydrogen 3.506 N/A ASN 266.A N LYS 263.A O no hydrogen 3.164 N/A ASN 266.A ND2 LYS 263.A O no hydrogen 2.981 N/A ASP 269.A N VAL 258.A O no hydrogen 2.797 N/A ASP 271.A N ASP 256.A O no hydrogen 3.030 N/A GLN 272.A N GLY 255.A O no hydrogen 2.858 N/A GLN 272.A NE2 LEU 270.A O no hydrogen 2.928 N/A THR 274.A OG1 HIS 249.A ND1 no hydrogen 2.746 N/A TRP 275.A N.A PRO 248.A O no hydrogen 3.321 N/A ILE 277.A N THR 246.A O no hydrogen 2.903 N/A GLY 279.A N ASP 245.A OD1 no hydrogen 2.834 N/A GLY 280.A N GLN 241.A O no hydrogen 2.762 N/A THR 281.A N GLN 241.A O no hydrogen 3.244 N/A THR 281.A OG1 PRO 278.A O no hydrogen 2.723 N/A GLY 283.A N HIS 239.A O no hydrogen 2.859 N/A ALA 284.A N TRP 259.A O no hydrogen 3.038 N/A ALA 285.A N VAL 237.A O no hydrogen 2.991 N/A PHE 286.A N TYR 257.A O no hydrogen 2.786 N/A TYR 287.A N VAL 235.A O no hydrogen 2.907 N/A THR 288.A N ASP 256.A OD2 no hydrogen 3.083 N/A PHE 289.A N GLU 233.A O no hydrogen 3.064 N/A GLY 293.A N VAL 316.A O no hydrogen 2.845 N/A TYR 295.A N PHE 314.A O no hydrogen 2.907 N/A TYR 295.A OH GLN 291.A O no hydrogen 2.639 N/A TYR 297.A N GLY 312.A O no hydrogen 2.815 N/A TYR 297.A OH HIS 239.A ND1 no hydrogen 2.644 N/A VAL 298.A N HIS 249.A O no hydrogen 2.902 N/A ASN 299.A N ALA 310.A O no hydrogen 3.107 N/A ASN 299.A ND2 GLU 174.A OE2 no hydrogen 2.874 N/A ASN 299.A ND2 GLU 304.A OE1 no hydrogen 2.930 N/A HIS 300.A N ARG 247.A O no hydrogen 2.822 N/A HIS 300.A ND1 HIS 300.A O no hydrogen 2.668 N/A ASN 301.A N ASN 299.A OD1 no hydrogen 2.844 N/A ILE 303.A N ASN 301.A OD1 no hydrogen 2.990 N/A GLU 304.A N ASN 301.A OD1 no hydrogen 3.185 N/A ALA 305.A N ASN 301.A O no hydrogen 2.896 N/A PHE 306.A N LEU 302.A O no hydrogen 2.879 N/A GLU 307.A N ILE 303.A O no hydrogen 2.876 N/A LEU 308.A N ILE 303.A O no hydrogen 3.084 N/A ALA 310.A N GLU 304.A O no hydrogen 2.988 N/A ALA 311.A N GLY 309.A O no hydrogen 2.934 N/A GLY 312.A N TYR 297.A O no hydrogen 2.825 N/A HIS 313.A N LEU 221.A O no hydrogen 2.839 N/A PHE 314.A N TYR 295.A O no hydrogen 2.913 N/A LYS 315.A N LEU 227.A O no hydrogen 2.826 N/A LYS 315.A NZ.A GLY 223.A O no hydrogen 3.045 N/A VAL 316.A N GLY 293.A O no hydrogen 2.892 N/A THR 317.A N ALA 229.A O no hydrogen 2.954 N/A THR 317.A OG1.B ALA 229.A O no hydrogen 3.570 N/A GLU 319.A N GLU 319.A OE1.A no hydrogen 2.811 N/A TRP 320.A NE1 MET 325.A O no hydrogen 2.944 N/A LEU 324.A N ASN 321.A OD1 no hydrogen 3.088 N/A MET 325.A N ASN 321.A O no hydrogen 3.222 N/A THR 326.A OG1 ASP 322.A OD1 no hydrogen 2.781 N/A