Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xfd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 5.A N HIS 1.A O no hydrogen 3.132 N/A MET 6.A N HIS 2.A O no hydrogen 2.945 N/A GLN 7.A N HIS 3.A O no hydrogen 2.846 N/A GLN 8.A N HIS 4.A O no hydrogen 3.040 N/A GLN 8.A NE2 ASP 12.A OD1 no hydrogen 2.872 N/A GLN 8.A NE2 ASP 12.A OD2 no hydrogen 3.534 N/A ILE 9.A N HIS 5.A O no hydrogen 2.886 N/A GLN 10.A N MET 6.A O no hydrogen 2.942 N/A GLN 10.A NE2 PHE 231.A O no hydrogen 2.981 N/A ARG 11.A N GLN 7.A O no hydrogen 2.990 N/A ASP 12.A N GLN 8.A O no hydrogen 2.857 N/A ILE 13.A N ILE 9.A O no hydrogen 2.988 N/A ALA 14.A N GLN 10.A O no hydrogen 2.932 N/A GLN 15.A N ARG 11.A O no hydrogen 2.927 N/A ALA 16.A N ASP 12.A O no hydrogen 2.925 N/A LEU 17.A N ILE 13.A O no hydrogen 2.980 N/A GLN 18.A N GLN 15.A O no hydrogen 3.044 N/A VAL 19.A N ALA 14.A O no hydrogen 2.959 N/A GLN 20.A N GLY 198.A O no hydrogen 2.987 N/A GLN 20.A NE2 GLN 18.A O no hydrogen 2.870 N/A GLN 24.A N ASP 28.A OD2 no hydrogen 2.673 N/A ASP 28.A N SER 25.A OG no hydrogen 3.357 N/A VAL 29.A N SER 25.A O no hydrogen 3.362 N/A GLN 30.A N GLU 26.A O no hydrogen 2.967 N/A GLN 30.A NE2 GLU 26.A OE2 no hydrogen 3.002 N/A ALA 31.A N ALA 27.A O no hydrogen 2.866 N/A GLN 32.A N ASP 28.A O no hydrogen 3.077 N/A GLN 32.A NE2.A GLN 20.A OE1 no hydrogen 2.805 N/A ILE 33.A N VAL 29.A O no hydrogen 3.106 N/A ALA 34.A N GLN 30.A O no hydrogen 2.971 N/A ARG 35.A N ALA 31.A O no hydrogen 2.879 N/A ARG 35.A NH2 GLN 20.A OE1 no hydrogen 3.087 N/A ARG 35.A NH2 GLN 32.A OE1.B no hydrogen 3.310 N/A ARG 36.A N GLN 32.A O no hydrogen 3.035 N/A ARG 36.A NE GLN 32.A OE1.A no hydrogen 3.045 N/A ARG 36.A NE GLN 32.A OE1.B no hydrogen 2.999 N/A ARG 36.A NH1 PRO 195.A O no hydrogen 2.827 N/A ARG 36.A NH1 SER 197.A O no hydrogen 2.887 N/A ARG 36.A NH2 GLN 32.A OE1.A no hydrogen 3.266 N/A ARG 36.A NH2 GLN 32.A OE1.B no hydrogen 3.245 N/A ARG 36.A NH2 SER 197.A O no hydrogen 3.222 N/A ILE 37.A N ILE 33.A O no hydrogen 2.982 N/A ALA 38.A N ALA 34.A O no hydrogen 2.939 N/A PHE 39.A N ARG 35.A O no hydrogen 2.846 N/A ILE 40.A N ARG 36.A O no hydrogen 3.050 N/A GLN 41.A N ILE 37.A O no hydrogen 3.039 N/A GLN 41.A NE2 ALA 72.A O no hydrogen 3.131 N/A GLN 41.A NE2 GLN 75.A OE1 no hydrogen 2.987 N/A GLN 42.A N ALA 38.A O no hydrogen 2.861 N/A GLN 42.A NE2 ASP 46.A OD1 no hydrogen 2.766 N/A CYS 43.A N PHE 39.A O no hydrogen 2.953 N/A CYS 43.A SG PHE 39.A O no hydrogen 3.359 N/A LEU 44.A N ILE 40.A O no hydrogen 3.196 N/A LYS 45.A N GLN 41.A O no hydrogen 2.933 N/A ASP 46.A N GLN 42.A O no hydrogen 2.840 N/A SER 47.A N CYS 43.A O no hydrogen 3.018 N/A SER 47.A N LEU 44.A O no hydrogen 3.223 N/A SER 47.A OG.A CYS 43.A O no hydrogen 3.229 N/A SER 47.A OG.B CYS 43.A O no hydrogen 2.983 N/A SER 47.A OG.B LEU 44.A O no hydrogen 3.008 N/A GLY 48.A N LYS 45.A O no hydrogen 3.039 N/A LEU 49.A N LEU 44.A O no hydrogen 3.061 N/A LYS 50.A NZ ASP 82.A OD2 no hydrogen 2.817 N/A THR 51.A OG1.A ARG 165.A O no hydrogen 2.937 N/A THR 51.A OG1.B ARG 165.A O no hydrogen 2.953 N/A LEU 52.A N ARG 86.A O no hydrogen 2.905 N/A VAL 53.A N LEU 168.A O no hydrogen 2.944 N/A LEU 54.A N ILE 88.A O no hydrogen 3.151 N/A GLY 55.A N GLN 158.A OE1 no hydrogen 2.909 N/A ILE 56.A N VAL 90.A O no hydrogen 2.829 N/A SER 57.A N SER 62.A OG no hydrogen 3.300 N/A SER 57.A OG SER 62.A OG no hydrogen 3.284 N/A GLY 59.A N SER 57.A OG no hydrogen 3.073 N/A SER 62.A OG SER 57.A OG no hydrogen 3.284 N/A SER 62.A OG GLY 59.A O no hydrogen 3.507 N/A LEU 63.A N GLY 59.A O no hydrogen 3.168 N/A THR 64.A N VAL 60.A O no hydrogen 2.877 N/A THR 64.A OG1 VAL 60.A O no hydrogen 2.855 N/A ALA 65.A N ASP 61.A O no hydrogen 2.943 N/A GLY 66.A N SER 62.A O no hydrogen 2.812 N/A LEU 67.A N LEU 63.A O no hydrogen 2.931 N/A LEU 68.A N THR 64.A O no hydrogen 2.982 N/A ALA 69.A N ALA 65.A O no hydrogen 2.896 N/A GLN 70.A N GLY 66.A O no hydrogen 2.902 N/A GLN 70.A NE2 GLU 74.A OE2 no hydrogen 2.895 N/A GLN 70.A NE2 ASP 113.A OD1 no hydrogen 2.889 N/A ARG 71.A N LEU 67.A O no hydrogen 3.095 N/A ARG 71.A NE GLU 74.A OE1 no hydrogen 2.838 N/A ARG 71.A NH2 GLU 74.A OE1 no hydrogen 3.279 N/A ARG 71.A NH2 GLU 74.A OE2 no hydrogen 2.903 N/A ALA 72.A N LEU 68.A O no hydrogen 2.923 N/A VAL 73.A N ALA 69.A O no hydrogen 3.083 N/A GLU 74.A N GLN 70.A O no hydrogen 3.057 N/A GLN 75.A N ARG 71.A O no hydrogen 3.019 N/A LEU 76.A N ALA 72.A O no hydrogen 3.046 N/A ARG 77.A N VAL 73.A O no hydrogen 2.850 N/A ARG 77.A NH1 TYR 85.A O no hydrogen 2.818 N/A ARG 77.A NH1 ASP 113.A OD2 no hydrogen 2.823 N/A ARG 77.A NH2 ASP 113.A OD1 no hydrogen 2.946 N/A GLU 78.A N GLU 74.A O no hydrogen 3.068 N/A GLN 79.A N GLN 75.A O no hydrogen 2.882 N/A THR 80.A N LEU 76.A O no hydrogen 2.871 N/A THR 80.A OG1 LEU 76.A O no hydrogen 2.669 N/A GLY 81.A N ARG 77.A O no hydrogen 2.834 N/A ASP 82.A N THR 80.A OG1 no hydrogen 2.986 N/A GLN 83.A NE2 GLY 81.A O no hydrogen 3.335 N/A ALA 84.A N ASP 82.A OD1 no hydrogen 2.984 N/A TYR 85.A N ASP 82.A O no hydrogen 3.497 N/A ARG 86.A N LYS 50.A O no hydrogen 3.084 N/A ARG 86.A NE GLN 83.A O no hydrogen 3.340 N/A PHE 87.A N ASP 113.A OD2 no hydrogen 2.972 N/A ILE 88.A N LEU 52.A O no hydrogen 2.814 N/A ALA 89.A N GLU 114.A O no hydrogen 2.868 N/A VAL 90.A N LEU 54.A O no hydrogen 2.850 N/A ARG 91.A N GLN 116.A O no hydrogen 2.784 N/A TYR 94.A N GLU 100.A OE2 no hydrogen 3.171 N/A GLN 98.A NE2 GLN 98.A O no hydrogen 3.428 N/A GLN 98.A NE2 ASP 102.A OD1 no hydrogen 2.842 N/A GLU 100.A N VAL 96.A O no hydrogen 3.006 N/A ALA 101.A N GLN 97.A O no hydrogen 3.023 N/A ASP 102.A N GLN 98.A O no hydrogen 2.741 N/A ALA 103.A N ASP 99.A O no hydrogen 2.599 N/A GLN 104.A N GLU 100.A O no hydrogen 2.912 N/A ALA 105.A N ALA 101.A O no hydrogen 2.992 N/A SER 106.A N ASP 102.A O no hydrogen 2.718 N/A SER 106.A OG.A ASP 102.A O no hydrogen 3.131 N/A LEU 107.A N ALA 103.A O no hydrogen 2.864 N/A ALA 108.A N GLN 104.A O no hydrogen 2.927 N/A THR 109.A N ALA 105.A O no hydrogen 3.078 N/A THR 109.A N SER 106.A O no hydrogen 2.987 N/A THR 109.A OG1 ALA 105.A O no hydrogen 2.958 N/A ILE 110.A N SER 106.A O no hydrogen 2.969 N/A ARG 111.A N LEU 107.A O no hydrogen 3.002 N/A ASP 113.A N GLN 70.A OE1 no hydrogen 2.984 N/A GLU 114.A N PHE 87.A O no hydrogen 3.179 N/A GLN 116.A N ALA 89.A O no hydrogen 2.923 N/A GLN 116.A NE2 GLU 114.A OE2.A no hydrogen 2.901 N/A VAL 118.A N ARG 91.A O no hydrogen 2.926 N/A GLY 121.A N ASN 119.A OD1 no hydrogen 2.891 N/A VAL 124.A N ILE 120.A O no hydrogen 2.911 N/A LYS 125.A N GLY 121.A O no hydrogen 2.902 N/A LYS 125.A NZ GLU 129.A OE2 no hydrogen 2.928 N/A ALA 126.A N PRO 122.A O no hydrogen 2.884 N/A LEU 127.A N SER 123.A O no hydrogen 3.055 N/A ALA 128.A N VAL 124.A O no hydrogen 2.922 N/A GLU 129.A N LYS 125.A O no hydrogen 3.094 N/A GLN 130.A N LEU 127.A O no hydrogen 2.918 N/A LEU 131.A N ALA 128.A O no hydrogen 3.097 N/A LEU 134.A N LEU 131.A O no hydrogen 2.969 N/A GLU 135.A N GLU 132.A O no hydrogen 2.913 N/A LEU 137.A N LEU 134.A O no hydrogen 3.426 N/A SER 142.A N GLU 138.A O no hydrogen 2.827 N/A ASP 143.A N PRO 139.A O no hydrogen 2.889 N/A PHE 144.A N ALA 140.A O no hydrogen 3.140 N/A VAL 145.A N LYS 141.A O no hydrogen 2.877 N/A ILE 146.A N SER 142.A O no hydrogen 2.811 N/A GLY 147.A N ASP 143.A O no hydrogen 2.821 N/A ASN 148.A N PHE 144.A O no hydrogen 3.009 N/A ILE 149.A N VAL 145.A O no hydrogen 2.994 N/A LYS 150.A N ILE 146.A O no hydrogen 2.956 N/A ALA 151.A N GLY 147.A O no hydrogen 3.004 N/A ARG 152.A N ASN 148.A O no hydrogen 2.968 N/A ARG 152.A NE LYS 185.A O no hydrogen 2.873 N/A ARG 152.A NH2 LYS 185.A O no hydrogen 2.893 N/A ILE 153.A N ILE 149.A O no hydrogen 2.808 N/A ARG 154.A N LYS 150.A O no hydrogen 2.947 N/A MET 155.A N ALA 151.A O no hydrogen 3.252 N/A VAL 156.A N ARG 152.A O no hydrogen 2.916 N/A ALA 157.A N ILE 153.A O no hydrogen 2.948 N/A GLN 158.A N ARG 154.A O no hydrogen 3.105 N/A GLN 158.A NE2 ARG 154.A O no hydrogen 3.126 N/A TYR 159.A N MET 155.A O no hydrogen 2.904 N/A TYR 159.A OH ASP 192.A OD1 no hydrogen 2.806 N/A ALA 160.A N VAL 156.A O no hydrogen 2.863 N/A ILE 161.A N ALA 157.A O no hydrogen 3.091 N/A ALA 162.A N GLN 158.A O no hydrogen 2.906 N/A GLY 163.A N TYR 159.A O no hydrogen 2.812 N/A ALA 164.A N ALA 160.A O no hydrogen 2.875 N/A ARG 165.A N ILE 161.A O no hydrogen 2.947 N/A ARG 165.A NH1 GLU 114.A OE1.A no hydrogen 3.517 N/A ARG 165.A NH1 GLU 114.A OE1.B no hydrogen 3.505 N/A ARG 165.A NH1 GLU 114.A OE2.B no hydrogen 2.781 N/A ARG 165.A NH2 GLU 114.A OE1.A no hydrogen 2.853 N/A ARG 165.A NH2 GLU 114.A OE1.B no hydrogen 2.972 N/A GLY 167.A N ALA 162.A O no hydrogen 2.700 N/A LEU 168.A N THR 51.A O no hydrogen 2.935 N/A VAL 169.A N ASP 192.A OD2 no hydrogen 2.809 N/A ILE 170.A N VAL 53.A O no hydrogen 2.957 N/A GLY 171.A N LEU 193.A O no hydrogen 2.942 N/A HIS 174.A NE2 ASP 61.A OD2 no hydrogen 2.902 N/A ALA 175.A N LEU 199.A O no hydrogen 2.845 N/A ALA 178.A N HIS 174.A O no hydrogen 2.839 N/A VAL 179.A N ALA 175.A O no hydrogen 2.952 N/A MET 180.A N GLU 177.A O no hydrogen 3.339 N/A GLY 181.A N ALA 178.A O no hydrogen 3.026 N/A PHE 182.A N GLU 177.A O no hydrogen 3.069 N/A PHE 183.A N GLY 181.A O no hydrogen 2.902 N/A THR 184.A N ASP 188.A OD1 no hydrogen 2.824 N/A THR 184.A OG1 ASN 148.A OD1 no hydrogen 2.746 N/A LYS 185.A NZ HIS 254.A ND1 no hydrogen 2.934 N/A GLY 187.A N THR 184.A O no hydrogen 2.914 N/A GLY 189.A N THR 184.A O no hydrogen 3.277 N/A ALA 190.A N GLY 187.A O no hydrogen 2.986 N/A CYS 191.A SG LEU 193.A O no hydrogen 3.354 N/A ASP 192.A N VAL 169.A O no hydrogen 2.868 N/A LEU 193.A N VAL 169.A O no hydrogen 3.375 N/A SER 197.A N ALA 194.A O no hydrogen 3.127 N/A SER 197.A OG.B ALA 194.A O no hydrogen 2.757 N/A LEU 199.A N LEU 196.A O no hydrogen 3.090 N/A ALA 200.A N GLN 203.A OE1 no hydrogen 2.775 N/A LYS 201.A N ASP 229.A OD1 no hydrogen 2.856 N/A LYS 201.A NZ ASP 61.A OD1 no hydrogen 2.779 N/A LYS 201.A NZ ASP 61.A OD2 no hydrogen 3.151 N/A HIS 202.A N ASP 229.A OD2 no hydrogen 2.933 N/A HIS 202.A ND1 ASP 229.A OD2 no hydrogen 2.950 N/A GLN 203.A N ALA 200.A O no hydrogen 2.995 N/A GLN 203.A NE2 GLN 20.A O no hydrogen 3.251 N/A GLN 203.A NE2 PRO 21.A O no hydrogen 3.038 N/A VAL 204.A N ALA 200.A O no hydrogen 3.018 N/A ARG 205.A N.A LYS 201.A O no hydrogen 3.078 N/A ARG 205.A N.B LYS 201.A O no hydrogen 3.066 N/A ARG 205.A NE.B VAL 218.A O no hydrogen 3.268 N/A ARG 205.A NH1.A VAL 218.A O no hydrogen 2.290 N/A ARG 205.A NH1.A LYS 220.A O no hydrogen 2.993 N/A ARG 205.A NH2.A LYS 220.A O no hydrogen 3.328 N/A ALA 206.A N HIS 202.A O no hydrogen 2.970 N/A LEU 207.A N GLN 203.A O no hydrogen 2.924 N/A ALA 208.A N VAL 204.A O no hydrogen 2.943 N/A ARG 209.A N ARG 205.A O.A no hydrogen 2.935 N/A ARG 209.A N ARG 205.A O.B no hydrogen 2.944 N/A ARG 209.A NE GLU 215.A OE1 no hydrogen 2.815 N/A ARG 209.A NE GLU 215.A OE2 no hydrogen 3.131 N/A ARG 209.A NH2 GLU 215.A OE1 no hydrogen 3.016 N/A ALA 210.A N ALA 206.A O no hydrogen 3.031 N/A LEU 211.A N LEU 207.A O no hydrogen 2.830 N/A LEU 211.A N ALA 208.A O no hydrogen 3.173 N/A GLY 212.A N ARG 209.A O no hydrogen 3.111 N/A ALA 213.A N ALA 208.A O no hydrogen 3.030 N/A LEU 217.A N PRO 214.A O no hydrogen 3.029 N/A VAL 218.A N PRO 214.A O no hydrogen 3.166 N/A GLU 219.A N GLU 215.A O no hydrogen 2.982 N/A LYS 220.A N LEU 217.A O no hydrogen 3.289 N/A THR 224.A N GLU 227.A OE1 no hydrogen 2.897 N/A GLU 227.A N THR 224.A OG1 no hydrogen 3.022 N/A ILE 228.A N THR 224.A O no hydrogen 2.964 N/A ASP 229.A N TYR 225.A O no hydrogen 2.873 N/A ALA 230.A N ALA 226.A O no hydrogen 3.028 N/A PHE 231.A N GLU 227.A O no hydrogen 2.868 N/A LEU 232.A N ILE 228.A O no hydrogen 2.927 N/A HIS 233.A N ASP 229.A O no hydrogen 2.938 N/A HIS 233.A NE2 GLN 20.A O no hydrogen 2.852 N/A GLY 234.A N PHE 231.A O no hydrogen 3.070 N/A GLN 235.A N ALA 230.A O no hydrogen 2.868 N/A ARG 238.A NH2 GLU 227.A OE2 no hydrogen 2.685 N/A ALA 242.A N ARG 238.A O no hydrogen 3.065 N/A ARG 243.A N GLU 239.A O no hydrogen 3.021 N/A ARG 243.A NE GLU 240.A OE1 no hydrogen 3.198 N/A ARG 243.A NH2 GLU 240.A OE1 no hydrogen 3.216 N/A VAL 244.A N GLU 240.A O no hydrogen 3.105 N/A ILE 245.A N ALA 241.A O no hydrogen 2.895 N/A VAL 246.A N ALA 242.A O no hydrogen 2.941 N/A ASP 247.A N.A ARG 243.A O no hydrogen 2.956 N/A ASP 247.A N.B ARG 243.A O no hydrogen 2.958 N/A THR 248.A N VAL 244.A O no hydrogen 2.890 N/A THR 248.A OG1 VAL 244.A O no hydrogen 2.694 N/A TYR 249.A N ILE 245.A O no hydrogen 2.858 N/A HIS 250.A N VAL 246.A O no hydrogen 2.973 N/A LYS 251.A N ASP 247.A O.A no hydrogen 3.125 N/A LYS 251.A N ASP 247.A O.B no hydrogen 2.941 N/A THR 252.A N THR 248.A O no hydrogen 3.024 N/A THR 252.A N TYR 249.A O no hydrogen 3.272 N/A THR 252.A OG1 THR 248.A O no hydrogen 2.817 N/A THR 252.A OG1 TYR 249.A O no hydrogen 3.341 N/A GLN 253.A N HIS 250.A O no hydrogen 3.328 N/A GLN 253.A NE2 GLU 257.A OE2.A no hydrogen 2.752 N/A GLN 253.A NE2 GLU 257.A OE2.B no hydrogen 3.132 N/A LYS 255.A N THR 252.A O no hydrogen 2.943 N/A LYS 255.A NZ GLY 181.A O no hydrogen 2.872 N/A LYS 255.A NZ PHE 183.A O no hydrogen 2.761 N/A ARG 256.A N GLN 253.A O no hydrogen 2.918 N/A ARG 256.A NH1 TYR 249.A O no hydrogen 2.778 N/A ARG 256.A NH1 GLN 253.A OE1 no hydrogen 2.891 N/A ARG 256.A NH2 ALA 178.A O no hydrogen 2.873 N/A ARG 256.A NH2 THR 252.A OG1 no hydrogen 2.896 N/A