Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g9g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 1.A OG1 ILE 2.A O no hydrogen 3.538 N/A ASN 3.A N GLU 18.A O no hydrogen 2.798 N/A TYR 4.A OH GLU 6.A OE2 no hydrogen 2.640 N/A HIS 5.A N VAL 16.A O no hydrogen 2.970 N/A HIS 5.A NE2 GLU 18.A OE2 no hydrogen 2.678 N/A LEU 7.A N ILE 14.A O.A no hydrogen 2.735 N/A LEU 7.A N ILE 14.A O.B no hydrogen 2.860 N/A THR 9.A N GLY 12.A O no hydrogen 2.952 N/A THR 9.A OG1 GLY 12.A O no hydrogen 2.893 N/A SER 10.A N GLU 85.A OE2 no hydrogen 2.852 N/A SER 10.A OG GLU 85.A OE1 no hydrogen 2.707 N/A SER 10.A OG GLU 85.A OE2 no hydrogen 3.562 N/A HIS 11.A N THR 9.A OG1 no hydrogen 3.067 N/A GLY 12.A N THR 9.A O no hydrogen 3.054 N/A ARG 13.A N THR 65.A OG1 no hydrogen 2.969 N/A ILE 14.A N.A LEU 7.A O no hydrogen 2.766 N/A ILE 14.A N.B LEU 7.A O no hydrogen 2.787 N/A ALA 15.A N SER 64.A OG no hydrogen 2.920 N/A VAL 16.A N HIS 5.A O no hydrogen 2.776 N/A ARG 17.A N ALA 55.A O no hydrogen 3.196 N/A ARG 17.A NH1 ALA 55.A O no hydrogen 3.074 N/A ARG 17.A NH1 ASP 57.A OD1 no hydrogen 2.772 N/A ARG 17.A NH1 ASP 57.A OD2 no hydrogen 3.530 N/A ARG 17.A NH2 ASP 57.A OD1 no hydrogen 3.249 N/A ARG 17.A NH2 ASP 57.A OD2 no hydrogen 2.858 N/A GLU 18.A N ASN 3.A O no hydrogen 2.871 N/A SER 19.A N VAL 53.A O no hydrogen 2.887 N/A SER 19.A OG GLY 48.A O no hydrogen 2.850 N/A SER 19.A OG TRP 51.A O no hydrogen 2.831 N/A GLY 23.A N LYS 50.A O no hydrogen 2.832 N/A LEU 26.A N ARG 52.A O no hydrogen 2.855 N/A LEU 27.A N.A VAL 96.A O no hydrogen 2.856 N/A LEU 27.A N.B VAL 96.A O no hydrogen 2.850 N/A MET 28.A N ILE 54.A O no hydrogen 2.832 N/A ILE 29.A N PHE 98.A O no hydrogen 2.782 N/A HIS 30.A ND1 GLY 31.A O no hydrogen 2.822 N/A GLY 31.A N SER 34.A OG.B no hydrogen 2.979 N/A ASN 32.A ND2 ALA 146.A O no hydrogen 2.950 N/A SER 33.A N HIS 61.A NE2 no hydrogen 3.164 N/A SER 33.A OG ASN 32.A OD1 no hydrogen 2.773 N/A SER 34.A N.A GLY 31.A O no hydrogen 3.118 N/A SER 34.A N.B GLY 31.A O no hydrogen 3.131 N/A SER 34.A OG.A SER 35.A O no hydrogen 3.561 N/A SER 34.A OG.B HIS 30.A ND1 no hydrogen 3.365 N/A SER 34.A OG.B GLY 31.A O no hydrogen 3.022 N/A GLY 36.A N ASP 57.A OD1 no hydrogen 2.733 N/A ALA 37.A N SER 35.A OG no hydrogen 3.182 N/A ILE 38.A N SER 35.A O no hydrogen 3.059 N/A PHE 39.A N GLY 36.A O no hydrogen 3.033 N/A ALA 40.A N ALA 37.A O no hydrogen 3.194 N/A GLN 42.A N PHE 39.A O no hydrogen 2.935 N/A GLN 42.A NE2 PHE 250.A O no hydrogen 3.057 N/A GLN 42.A NE2 ASP 258.A OD1 no hydrogen 2.906 N/A LEU 43.A N PHE 39.A O no hydrogen 2.868 N/A GLU 44.A N ALA 40.A O no hydrogen 2.917 N/A GLY 48.A N GLN 42.A O no hydrogen 2.782 N/A LYS 49.A N GLY 45.A O no hydrogen 2.978 N/A LYS 49.A NZ GLU 46.A OE2 no hydrogen 3.500 N/A LYS 50.A N GLU 46.A O no hydrogen 3.350 N/A LYS 50.A N ILE 47.A O no hydrogen 3.240 N/A TRP 51.A N ILE 47.A O no hydrogen 2.879 N/A ARG 52.A N ALA 24.A O no hydrogen 3.254 N/A ARG 52.A NE GLU 18.A OE1 no hydrogen 2.897 N/A ARG 52.A NH2 GLU 18.A OE1 no hydrogen 2.966 N/A VAL 53.A N SER 19.A OG no hydrogen 2.953 N/A ILE 54.A N LEU 26.A O no hydrogen 2.789 N/A ALA 55.A N ARG 17.A O no hydrogen 2.808 N/A ASP 57.A N ALA 15.A O no hydrogen 2.880 N/A LEU 58.A N HIS 30.A NE2 no hydrogen 2.948 N/A GLY 60.A N THR 65.A O no hydrogen 2.930 N/A HIS 61.A N LEU 58.A O no hydrogen 2.917 N/A HIS 61.A ND1 PRO 59.A O no hydrogen 2.909 N/A LYS 63.A N ASP 57.A OD2 no hydrogen 2.783 N/A SER 64.A N HIS 61.A O no hydrogen 3.071 N/A SER 64.A OG ASP 57.A O no hydrogen 2.646 N/A THR 65.A N ARG 13.A O no hydrogen 2.954 N/A THR 65.A OG1 ASP 66.A O no hydrogen 3.174 N/A ALA 67.A N TYR 74.A OH no hydrogen 2.942 N/A ILE 68.A N HIS 11.A O no hydrogen 2.993 N/A ASP 71.A N ASP 69.A OD1 no hydrogen 3.008 N/A ARG 72.A N ASP 69.A O no hydrogen 2.967 N/A ARG 72.A NH1 SER 10.A OG no hydrogen 2.803 N/A ARG 72.A NH2 SER 10.A OG no hydrogen 3.168 N/A SER 73.A N ASP 69.A O no hydrogen 3.001 N/A SER 73.A OG ASP 69.A O no hydrogen 3.436 N/A TYR 74.A N PRO 70.A O no hydrogen 3.119 N/A TYR 74.A OH ASP 180.A OD2 no hydrogen 2.663 N/A SER 75.A N SER 73.A O no hydrogen 2.992 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.747 N/A GLY 78.A N SER 75.A OG no hydrogen 2.858 N/A TYR 79.A N SER 75.A O no hydrogen 2.835 N/A ALA 80.A N MET 76.A O no hydrogen 3.070 N/A ASP 81.A N.A GLU 77.A O no hydrogen 2.919 N/A ASP 81.A N.B GLU 77.A O no hydrogen 2.920 N/A ALA 82.A N GLY 78.A O no hydrogen 2.960 N/A MET 83.A N TYR 79.A O no hydrogen 2.864 N/A THR 84.A N ALA 80.A O no hydrogen 2.917 N/A THR 84.A OG1 ALA 80.A O no hydrogen 2.756 N/A GLU 85.A N ASP 81.A O.A no hydrogen 2.904 N/A GLU 85.A N ASP 81.A O.B no hydrogen 3.036 N/A VAL 86.A N ALA 82.A O no hydrogen 2.923 N/A MET 87.A N MET 83.A O no hydrogen 2.966 N/A GLN 88.A N THR 84.A O no hydrogen 2.982 N/A GLN 89.A N GLU 85.A O no hydrogen 2.959 N/A GLN 89.A NE2 GLU 8.A O no hydrogen 3.030 N/A LEU 90.A N VAL 86.A O no hydrogen 2.956 N/A GLY 91.A N GLN 88.A O no hydrogen 2.981 N/A ILE 92.A N MET 87.A O no hydrogen 3.017 N/A ALA 95.A N TYR 114.A OH no hydrogen 3.065 N/A VAL 96.A N PRO 25.A O no hydrogen 3.076 N/A VAL 97.A N GLY 119.A O no hydrogen 2.886 N/A PHE 98.A N LEU 27.A O.A no hydrogen 2.746 N/A PHE 98.A N LEU 27.A O.B no hydrogen 2.821 N/A GLY 99.A N MET 121.A O no hydrogen 2.844 N/A TRP 100.A N ILE 29.A O no hydrogen 2.913 N/A TRP 100.A NE1 HIS 247.A O no hydrogen 2.912 N/A SER 101.A N THR 123.A O no hydrogen 2.713 N/A SER 101.A OG GLY 124.A O no hydrogen 3.203 N/A SER 101.A OG HIS 247.A NE2 no hydrogen 2.943 N/A GLY 103.A N TRP 100.A O no hydrogen 2.795 N/A GLY 104.A N SER 101.A O no hydrogen 2.814 N/A HIS 105.A N SER 101.A O no hydrogen 3.152 N/A HIS 105.A ND1 GLN 199.A OE1 no hydrogen 2.756 N/A ILE 106.A N LEU 102.A O no hydrogen 2.898 N/A GLY 107.A N GLY 103.A O no hydrogen 2.875 N/A ILE 108.A N GLY 104.A O no hydrogen 2.978 N/A GLU 109.A N HIS 105.A O no hydrogen 3.095 N/A MET 110.A N ILE 106.A O no hydrogen 2.874 N/A MET 110.A N GLY 107.A O no hydrogen 3.075 N/A ILE 111.A N ILE 108.A O no hydrogen 3.199 N/A ARG 113.A N MET 110.A O no hydrogen 2.972 N/A ARG 113.A NE ASP 81.A OD1.A no hydrogen 2.752 N/A ARG 113.A NH1 GLU 109.A O no hydrogen 2.821 N/A ARG 113.A NH1 GLU 109.A OE1 no hydrogen 2.904 N/A TYR 114.A OH ILE 92.A O no hydrogen 2.742 N/A MET 117.A N TYR 114.A O no hydrogen 3.103 N/A ARG 118.A N ALA 95.A O no hydrogen 3.045 N/A ARG 118.A NE ASP 94.A O no hydrogen 2.829 N/A LEU 120.A N PRO 209.A O no hydrogen 2.999 N/A MET 121.A N VAL 97.A O no hydrogen 2.785 N/A ILE 122.A N ALA 211.A O no hydrogen 2.844 N/A THR 123.A N GLY 99.A O no hydrogen 3.081 N/A THR 123.A OG1 VAL 213.A O no hydrogen 2.769 N/A GLY 124.A N ASN 214.A OD1 no hydrogen 2.721 N/A THR 125.A OG1 SER 101.A O no hydrogen 2.819 N/A THR 125.A OG1 THR 123.A O no hydrogen 3.481 N/A ALA 129.A N GLU 132.A OE1 no hydrogen 2.935 N/A ARG 130.A NE.B GLY 192.A O no hydrogen 2.999 N/A ARG 130.A NH1.A SER 193.A O no hydrogen 3.056 N/A ARG 130.A NH2.B GLY 192.A O no hydrogen 3.237 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.877 N/A GLU 132.A N ALA 129.A O no hydrogen 2.871 N/A GLY 136.A N GLU 132.A O no hydrogen 2.992 N/A GLY 136.A N VAL 133.A O no hydrogen 3.225 N/A PHE 137.A N VAL 133.A O no hydrogen 3.030 N/A LYS 138.A N PHE 220.A O no hydrogen 2.741 N/A LYS 138.A NZ GLU 222.A OE1 no hydrogen 2.992 N/A LEU 145.A N ASP 142.A O no hydrogen 3.129 N/A ALA 146.A N MET 143.A O no hydrogen 2.989 N/A GLY 147.A N ALA 144.A O no hydrogen 3.472 N/A GLN 148.A N LEU 145.A O no hydrogen 3.025 N/A GLN 148.A NE2 ILE 150.A O no hydrogen 2.852 N/A SER 152.A N ASP 155.A OD2 no hydrogen 2.879 N/A ASP 155.A N SER 152.A OG no hydrogen 2.913 N/A VAL 156.A N SER 152.A O no hydrogen 2.946 N/A GLU 157.A N GLU 153.A O.A no hydrogen 3.188 N/A SER 158.A N ARG 154.A O no hydrogen 2.913 N/A SER 158.A OG ASP 142.A OD1 no hydrogen 2.623 N/A TYR 159.A N ASP 155.A O no hydrogen 2.858 N/A TYR 159.A OH ASN 32.A O no hydrogen 2.906 N/A ALA 160.A N VAL 156.A O no hydrogen 2.967 N/A ARG 161.A N GLU 157.A O no hydrogen 2.915 N/A ARG 161.A NE GLU 157.A OE2 no hydrogen 2.809 N/A ARG 161.A NH2 GLU 157.A OE2 no hydrogen 3.122 N/A SER 162.A N.A SER 158.A O no hydrogen 3.074 N/A SER 162.A N.B SER 158.A O no hydrogen 3.074 N/A SER 162.A OG.A SER 158.A O no hydrogen 2.928 N/A SER 162.A OG.A TYR 159.A O no hydrogen 3.122 N/A SER 162.A OG.B ASP 142.A OD2 no hydrogen 2.773 N/A THR 163.A N TYR 159.A O no hydrogen 2.978 N/A THR 163.A OG1 TYR 159.A O no hydrogen 2.683 N/A CYS 164.A N ALA 160.A O no hydrogen 2.984 N/A GLY 165.A N ARG 161.A O no hydrogen 3.004 N/A GLU 166.A N GLU 252.A OE2.A no hydrogen 3.390 N/A GLU 166.A N GLU 252.A OE2.B no hydrogen 3.259 N/A LEU 172.A N GLU 169.A O no hydrogen 2.951 N/A LEU 173.A N ALA 170.A O no hydrogen 2.956 N/A ILE 175.A N SER 171.A O no hydrogen 3.362 N/A VAL 176.A N LEU 172.A O no hydrogen 3.126 N/A ALA 177.A N LEU 173.A O no hydrogen 2.846 N/A ARG 178.A N ASP 174.A O no hydrogen 3.169 N/A ARG 178.A NE GLY 62.A O no hydrogen 2.873 N/A ARG 178.A NH1 ASP 66.A OD1 no hydrogen 2.917 N/A ARG 178.A NH1 ARG 178.A O no hydrogen 2.836 N/A ARG 178.A NH2 SER 64.A O no hydrogen 2.749 N/A ARG 178.A NH2 ASP 66.A OD1 no hydrogen 2.942 N/A THR 179.A N VAL 176.A O no hydrogen 3.307 N/A THR 179.A OG1 ILE 175.A O no hydrogen 3.397 N/A THR 179.A OG1 VAL 176.A O no hydrogen 3.233 N/A ASP 180.A N GLY 60.A O no hydrogen 2.945 N/A ARG 182.A N ASP 180.A OD1 no hydrogen 3.107 N/A ARG 182.A NE ASP 180.A OD1 no hydrogen 3.037 N/A ARG 182.A NE ASP 180.A OD2 no hydrogen 3.268 N/A ARG 182.A NH2 ASP 180.A OD2 no hydrogen 2.874 N/A ALA 183.A N ASP 180.A O no hydrogen 2.901 N/A ARG 184.A NE GLN 148.A O no hydrogen 2.817 N/A ARG 184.A NH1 SER 33.A OG no hydrogen 2.926 N/A ARG 184.A NH2 GLU 149.A O no hydrogen 2.876 N/A ARG 185.A N.A GLY 181.A O no hydrogen 3.352 N/A ARG 185.A N.B GLY 181.A O no hydrogen 3.363 N/A ARG 185.A NE.B GLU 149.A OE1 no hydrogen 2.883 N/A ARG 185.A NH2.B GLU 149.A OE1 no hydrogen 3.141 N/A ILE 186.A N ARG 182.A O no hydrogen 2.971 N/A MET 187.A N ALA 183.A O no hydrogen 3.075 N/A PHE 188.A N ARG 184.A O no hydrogen 3.109 N/A GLU 189.A N ARG 185.A O.A no hydrogen 3.113 N/A GLU 189.A N ARG 185.A O.B no hydrogen 3.031 N/A LYS 190.A N ILE 186.A O no hydrogen 2.962 N/A PHE 191.A N MET 187.A O no hydrogen 2.921 N/A GLY 192.A N PHE 188.A O no hydrogen 3.131 N/A SER 193.A N GLU 189.A O no hydrogen 3.044 N/A SER 193.A OG GLU 189.A O no hydrogen 3.212 N/A GLY 194.A N PHE 191.A O no hydrogen 3.239 N/A THR 195.A N LYS 190.A O no hydrogen 3.213 N/A THR 195.A OG1 GLU 77.A OE2 no hydrogen 2.575 N/A THR 195.A OG1 LYS 190.A O no hydrogen 3.352 N/A GLY 197.A N GLU 109.A OE2 no hydrogen 2.714 N/A ARG 200.A NE ASP 201.A OD1 no hydrogen 3.390 N/A ARG 200.A NH1 GLU 131.A OE2 no hydrogen 3.176 N/A ARG 200.A NH1 GLU 132.A OE2 no hydrogen 2.849 N/A ASP 201.A N ASN 198.A OD1 no hydrogen 3.077 N/A ILE 202.A N.A ASN 198.A O no hydrogen 2.942 N/A ILE 202.A N.B ASN 198.A O no hydrogen 2.958 N/A VAL 203.A N GLN 199.A O no hydrogen 3.116 N/A ALA 204.A N ARG 200.A O no hydrogen 3.180 N/A GLU 205.A N ASP 201.A O no hydrogen 3.034 N/A GLU 205.A N ILE 202.A O.B no hydrogen 3.245 N/A ALA 206.A N ILE 202.A O.A no hydrogen 3.097 N/A ALA 206.A N ILE 202.A O.B no hydrogen 2.901 N/A ILE 210.A N ASN 233.A O no hydrogen 2.939 N/A ALA 211.A N LEU 120.A O no hydrogen 2.799 N/A VAL 213.A N ILE 122.A O no hydrogen 3.186 N/A ASN 214.A N HIS 240.A O no hydrogen 2.940 N/A ARG 216.A N.A ILE 242.A O no hydrogen 2.867 N/A ARG 216.A N.B ILE 242.A O no hydrogen 2.858 N/A ARG 216.A NE.A ASP 243.A OD1 no hydrogen 2.580 N/A ARG 216.A NH2.A ASP 243.A OD1 no hydrogen 3.103 N/A ASP 217.A N ALA 245.A O no hydrogen 2.862 N/A GLU 222.A N GLY 136.A O no hydrogen 2.936 N/A VAL 226.A N GLU 222.A O no hydrogen 3.074 N/A SER 227.A N LEU 223.A O no hydrogen 2.927 N/A SER 227.A OG ASP 224.A O.A no hydrogen 2.967 N/A SER 227.A OG ASP 224.A O.B no hydrogen 2.662 N/A LYS 228.A N PHE 225.A O no hydrogen 2.961 N/A LYS 228.A NZ ASP 224.A OD2.A no hydrogen 2.822 N/A VAL 229.A N VAL 226.A O no hydrogen 3.180 N/A LYS 230.A NZ ALA 204.A O no hydrogen 3.403 N/A GLY 232.A N VAL 203.A O no hydrogen 2.907 N/A ASN 233.A ND2 GLN 207.A O no hydrogen 3.022 N/A TRP 235.A N ILE 210.A O no hydrogen 2.814 N/A TRP 235.A NE1 ASP 267.A OD2 no hydrogen 2.814 N/A GLY 237.A N LEU 234.A O no hydrogen 2.896 N/A HIS 240.A N VAL 212.A O no hydrogen 2.838 N/A ILE 242.A N ASN 214.A O no hydrogen 2.774 N/A GLY 246.A N GLU 252.A OE1.B no hydrogen 2.888 N/A GLY 246.A N GLU 252.A OE2.A no hydrogen 3.228 N/A GLY 246.A N GLU 252.A OE2.B no hydrogen 3.319 N/A HIS 247.A NE2 SER 101.A OG no hydrogen 2.943 N/A ALA 248.A N GLU 252.A OE1.B no hydrogen 2.971 N/A ARG 251.A N ALA 248.A O no hydrogen 2.993 N/A ARG 251.A NH1 CYS 164.A O no hydrogen 2.939 N/A ARG 251.A NH1 GLY 165.A O no hydrogen 3.175 N/A ARG 251.A NH1 PRO 167.A O no hydrogen 2.902 N/A ARG 251.A NH2 PRO 167.A O no hydrogen 2.868 N/A GLU 252.A N ALA 248.A O no hydrogen 3.046 N/A ALA 253.A N PRO 249.A O no hydrogen 2.866 N/A PHE 257.A N ALA 253.A O no hydrogen 2.974 N/A ASP 258.A N PRO 254.A O no hydrogen 2.754 N/A ALA 259.A N ALA 255.A O no hydrogen 3.022 N/A TYR 260.A N GLU 256.A O.A no hydrogen 3.446 N/A TYR 260.A N GLU 256.A O.B no hydrogen 3.383 N/A LEU 261.A N PHE 257.A O no hydrogen 2.951 N/A ALA 262.A N ASP 258.A O no hydrogen 2.803 N/A ARG 263.A N ALA 259.A O no hydrogen 3.121 N/A ARG 263.A NE GLU 236.A OE2 no hydrogen 2.737 N/A ARG 263.A NH1 GLU 236.A OE1 no hydrogen 2.985 N/A ARG 263.A NH1 GLU 236.A OE2 no hydrogen 3.537 N/A PHE 264.A N TYR 260.A O no hydrogen 2.906 N/A ILE 265.A N LEU 261.A O no hydrogen 2.895 N/A ARG 266.A N ALA 262.A O no hydrogen 2.956 N/A ARG 266.A NE ASP 267.A OD1 no hydrogen 2.873 N/A ARG 266.A NH1 ASP 267.A OD1 no hydrogen 2.928 N/A ASP 267.A N ARG 263.A O no hydrogen 2.853 N/A CYS 268.A N PHE 264.A O no hydrogen 2.891 N/A CYS 268.A SG ARG 118.A O no hydrogen 3.402 N/A CYS 268.A SG PHE 264.A O no hydrogen 3.353 N/A THR 269.A N ARG 266.A O no hydrogen 3.307 N/A THR 269.A OG1 ILE 265.A O no hydrogen 2.721 N/A GLN 270.A N ARG 266.A O no hydrogen 2.793 N/A GLU 272.A N GLU 272.A OE1 no hydrogen 2.525 N/A HIS 273.A NE2 HIS 275.A ND1 no hydrogen 3.166 N/A HIS 275.A ND1 HIS 273.A NE2 no hydrogen 3.166 N/A