Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jr5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.A N GLU 5.A OE2 no hydrogen 2.878 N/A LEU 3.A N GLY 170.A O no hydrogen 2.989 N/A VAL 6.A N GLN 2.A O no hydrogen 2.954 N/A GLU 7.A N LEU 3.A O no hydrogen 2.815 N/A THR 8.A N PRO 4.A O no hydrogen 3.062 N/A THR 8.A OG1 PRO 4.A O no hydrogen 2.775 N/A ILE 9.A N GLU 5.A O no hydrogen 2.958 N/A ARG 10.A N VAL 6.A O no hydrogen 2.809 N/A ARG 10.A NE GLU 7.A OE1 no hydrogen 3.328 N/A ARG 10.A NE GLU 7.A OE2 no hydrogen 3.119 N/A ARG 10.A NH1 GLU 7.A OE2 no hydrogen 3.100 N/A ARG 10.A NH2 LEU 54.A O no hydrogen 3.005 N/A ARG 11.A N GLU 7.A O no hydrogen 3.039 N/A ARG 11.A NE GLU 7.A OE2 no hydrogen 2.846 N/A THR 12.A N THR 8.A O no hydrogen 3.102 N/A THR 12.A OG1 THR 8.A O no hydrogen 2.815 N/A THR 12.A OG1 ILE 9.A O no hydrogen 3.302 N/A THR 12.A OG1 THR 227.A OG1 no hydrogen 2.948 N/A LEU 13.A N ILE 9.A O no hydrogen 2.888 N/A LEU 13.A N ARG 10.A O no hydrogen 3.328 N/A LEU 14.A N ARG 10.A O no hydrogen 3.099 N/A LEU 16.A N LEU 13.A O no hydrogen 2.951 N/A ILE 17.A N LEU 14.A O no hydrogen 3.118 N/A VAL 18.A N LEU 14.A O no hydrogen 2.942 N/A GLY 19.A N VAL 51.A O no hydrogen 2.805 N/A LYS 20.A N ILE 17.A O no hydrogen 3.099 N/A LYS 20.A NZ LEU 16.A O no hydrogen 2.847 N/A LYS 20.A NZ SER 103.A OG no hydrogen 2.943 N/A THR 21.A OG1 THR 50.A OG1 no hydrogen 2.736 N/A ILE 22.A N GLN 49.A O no hydrogen 2.834 N/A GLU 23.A N CYS 98.A O no hydrogen 2.724 N/A ASP 24.A N CYS 98.A O no hydrogen 3.376 N/A VAL 25.A N ASP 24.A OD2 no hydrogen 2.811 N/A ARG 26.A N VAL 96.A O no hydrogen 2.839 N/A ARG 26.A NE ASP 24.A OD1 no hydrogen 3.057 N/A PHE 28.A N HIS 94.A O no hydrogen 2.758 N/A ILE 32.A N TRP 29.A O no hydrogen 3.268 N/A ILE 33.A N PRO 30.A O no hydrogen 2.906 N/A ARG 34.A N MET 116.A O no hydrogen 2.881 N/A ARG 34.A NE ASN 31.A O no hydrogen 2.862 N/A HIS 35.A ND1 VAL 118.A O no hydrogen 3.064 N/A ARG 37.A NH1 ASN 31.A O no hydrogen 3.228 N/A ARG 37.A NH1 ILE 33.A O no hydrogen 2.918 N/A GLU 40.A N ASP 38.A OD2 no hydrogen 2.942 N/A ALA 41.A N ASP 38.A O no hydrogen 2.990 N/A PHE 42.A N ASP 38.A O no hydrogen 3.219 N/A ALA 43.A N SER 39.A O no hydrogen 3.005 N/A ALA 44.A N GLU 40.A O no hydrogen 3.047 N/A ARG 45.A N ALA 41.A O no hydrogen 3.042 N/A ARG 45.A NE ASP 68.A OD2 no hydrogen 2.910 N/A ARG 45.A NH2 ASP 68.A OD1 no hydrogen 2.877 N/A ARG 45.A NH2 ASP 68.A OD2 no hydrogen 3.554 N/A MET 46.A N ALA 43.A O no hydrogen 3.222 N/A GLY 48.A N ILE 22.A O no hydrogen 2.837 N/A GLN 49.A N MET 46.A O no hydrogen 3.105 N/A GLN 49.A NE2 ARG 45.A O no hydrogen 2.778 N/A GLN 49.A NE2 ASP 68.A OD2 no hydrogen 2.932 N/A THR 50.A N ASP 66.A OD2 no hydrogen 2.872 N/A THR 50.A OG1 THR 21.A OG1 no hydrogen 2.736 N/A VAL 51.A N LYS 20.A O no hydrogen 2.886 N/A ARG 52.A N LEU 64.A O no hydrogen 2.758 N/A ARG 52.A NE ASP 66.A OD1 no hydrogen 2.924 N/A ARG 52.A NH2 ASP 66.A OD1 no hydrogen 3.047 N/A GLY 53.A N LEU 64.A O no hydrogen 3.281 N/A GLU 55.A N LYS 62.A O no hydrogen 2.889 N/A ARG 56.A NE GLU 7.A OE1 no hydrogen 2.976 N/A ARG 56.A NH1 GLU 136.A OE2 no hydrogen 3.108 N/A ARG 56.A NH2 GLY 58.A O no hydrogen 3.012 N/A ARG 56.A NH2 GLU 136.A OE2 no hydrogen 2.864 N/A ARG 57.A N PHE 60.A O no hydrogen 2.996 N/A ARG 57.A NH1 GLY 134.A O no hydrogen 2.962 N/A ARG 57.A NH1 GLU 136.A OE1 no hydrogen 2.979 N/A ARG 57.A NH2 GLY 134.A O no hydrogen 2.933 N/A GLY 58.A N GLU 136.A OE1 no hydrogen 2.768 N/A LYS 59.A NZ PHE 171.A O no hydrogen 2.926 N/A PHE 60.A N ARG 57.A O no hydrogen 2.902 N/A LEU 61.A N SER 72.A O no hydrogen 2.921 N/A LYS 62.A N GLU 55.A O no hydrogen 2.814 N/A LYS 62.A NZ ASP 125.A OD1 no hydrogen 3.052 N/A PHE 63.A N LEU 70.A O no hydrogen 2.796 N/A LEU 64.A N GLY 53.A O no hydrogen 2.941 N/A LEU 65.A N ASP 68.A O no hydrogen 2.893 N/A ASP 66.A N GLN 49.A OE1 no hydrogen 3.039 N/A ARG 67.A N GLN 49.A OE1 no hydrogen 2.978 N/A ASP 68.A N GLN 49.A OE1 no hydrogen 3.208 N/A ALA 69.A N TYR 119.A O no hydrogen 2.849 N/A LEU 70.A N PHE 63.A O no hydrogen 2.832 N/A ILE 71.A N HIS 117.A O no hydrogen 2.741 N/A SER 72.A N LEU 61.A O no hydrogen 2.893 N/A SER 72.A OG TYR 80.A OH no hydrogen 2.703 N/A HIS 73.A N THR 115.A O no hydrogen 2.977 N/A ARG 75.A N HIS 73.A ND1 no hydrogen 2.923 N/A GLY 78.A N LEU 74.A O no hydrogen 2.967 N/A ARG 79.A N ARG 108.A O no hydrogen 2.919 N/A ARG 79.A NE GLU 77.A O no hydrogen 3.200 N/A ARG 79.A NH1 THR 223.A O no hydrogen 2.858 N/A ARG 79.A NH2 GLU 77.A O no hydrogen 3.481 N/A ARG 79.A NH2 THR 223.A O no hydrogen 2.985 N/A ARG 79.A NH2 THR 223.A OG1 no hydrogen 3.330 N/A TYR 80.A OH SER 72.A OG no hydrogen 2.703 N/A ALA 81.A N ARG 106.A O no hydrogen 3.020 N/A ALA 83.A N GLU 104.A O no hydrogen 3.121 N/A ALA 85.A N GLY 102.A O no hydrogen 2.973 N/A LEU 86.A N SER 84.A OG no hydrogen 2.915 N/A GLU 87.A N SER 84.A O no hydrogen 3.354 N/A THR 93.A OG1 GLU 90.A O no hydrogen 2.707 N/A HIS 94.A N TYR 107.A O no hydrogen 2.928 N/A HIS 94.A NE2 ASP 109.A O no hydrogen 2.953 N/A VAL 96.A N ARG 26.A O no hydrogen 2.852 N/A PHE 97.A N LEU 105.A O no hydrogen 2.863 N/A CYS 98.A N ASP 24.A O no hydrogen 2.872 N/A CYS 98.A SG GLU 104.A OE1 no hydrogen 3.911 N/A PHE 99.A N SER 103.A O no hydrogen 2.915 N/A THR 100.A N THR 21.A O no hydrogen 2.929 N/A GLY 102.A N PHE 99.A O no hydrogen 3.210 N/A SER 103.A N ASP 101.A OD2 no hydrogen 2.989 N/A SER 103.A OG ASP 101.A OD1 no hydrogen 3.482 N/A SER 103.A OG ASP 101.A OD2 no hydrogen 2.678 N/A GLU 104.A N ALA 83.A O no hydrogen 2.863 N/A LEU 105.A N PHE 97.A O no hydrogen 2.839 N/A ARG 106.A N ALA 81.A O no hydrogen 2.816 N/A ARG 106.A NE GLU 104.A OE2 no hydrogen 2.910 N/A ARG 106.A NH2 SER 84.A O no hydrogen 2.907 N/A ARG 106.A NH2 GLU 104.A OE2 no hydrogen 3.266 N/A TYR 107.A N VAL 95.A O no hydrogen 2.877 N/A TYR 107.A OH ASP 109.A OD1 no hydrogen 2.746 N/A ARG 108.A N ARG 79.A O no hydrogen 2.935 N/A ARG 108.A NE PRO 91.A O no hydrogen 2.983 N/A ARG 108.A NH2 PRO 91.A O no hydrogen 3.134 N/A ASP 109.A N HIS 92.A O no hydrogen 3.069 N/A LYS 112.A N ASP 109.A O no hydrogen 3.119 N/A LYS 112.A N ASP 109.A OD2 no hydrogen 3.117 N/A GLY 114.A N ASP 109.A OD1 no hydrogen 2.903 N/A THR 115.A N HIS 73.A O no hydrogen 3.102 N/A MET 116.A N ILE 32.A O no hydrogen 2.914 N/A HIS 117.A N ILE 71.A O no hydrogen 2.888 N/A VAL 118.A N HIS 35.A O no hydrogen 2.794 N/A TYR 119.A N ALA 69.A O no hydrogen 3.220 N/A TYR 119.A OH PRO 128.A O no hydrogen 2.759 N/A LYS 121.A N ARG 67.A O no hydrogen 2.957 N/A LYS 121.A NZ LEU 65.A O no hydrogen 2.760 N/A LYS 121.A NZ ASP 66.A O no hydrogen 2.978 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.784 N/A GLU 123.A N ALA 120.A O no hydrogen 2.912 N/A ALA 124.A N ALA 120.A O no hydrogen 3.243 N/A ALA 124.A N LYS 121.A O no hydrogen 3.304 N/A ARG 126.A N GLU 123.A O no hydrogen 3.014 N/A ALA 131.A N ARG 127.A O no hydrogen 3.062 N/A LEU 133.A N LEU 130.A O no hydrogen 3.229 N/A GLY 134.A N GLN 165.A O no hydrogen 2.901 N/A SER 139.A N GLU 136.A O no hydrogen 3.087 N/A SER 139.A OG GLU 136.A O no hydrogen 2.812 N/A ALA 141.A N SER 139.A OG no hydrogen 3.200 N/A PHE 142.A N SER 139.A O no hydrogen 3.111 N/A VAL 146.A N SER 143.A OG no hydrogen 3.271 N/A LEU 147.A N SER 143.A O no hydrogen 3.205 N/A ALA 148.A N PRO 144.A O no hydrogen 2.843 N/A GLU 149.A N ALA 145.A O no hydrogen 2.939 N/A ARG 150.A NH1 THR 166.A OG1 no hydrogen 3.155 N/A ARG 150.A NH2 ASP 164.A OD1 no hydrogen 3.178 N/A ALA 151.A N LEU 147.A O no hydrogen 3.032 N/A VAL 152.A N ALA 148.A O no hydrogen 3.022 N/A LYS 153.A N ARG 150.A O no hydrogen 3.328 N/A LYS 153.A NZ GLU 149.A OE2 no hydrogen 3.265 N/A ARG 156.A N THR 154.A OG1 no hydrogen 3.010 N/A ARG 156.A NH1 ASP 164.A OD1 no hydrogen 2.916 N/A VAL 158.A N ARG 189.A O no hydrogen 2.766 N/A LYS 159.A N PRO 187.A O no hydrogen 3.257 N/A LYS 159.A NZ ASP 177.A OD1 no hydrogen 2.714 N/A LYS 159.A NZ ASP 177.A OD2 no hydrogen 3.490 N/A LYS 159.A NZ GLY 264.A O no hydrogen 3.306 N/A LYS 159.A NZ THR 265.A OG1 no hydrogen 2.924 N/A ALA 160.A N SER 157.A OG no hydrogen 3.140 N/A LEU 161.A N SER 157.A O no hydrogen 3.011 N/A LEU 162.A N VAL 158.A O no hydrogen 3.007 N/A LEU 163.A N LYS 159.A O no hydrogen 3.065 N/A ASP 164.A N LEU 161.A O no hydrogen 3.231 N/A GLN 165.A NE2 LEU 163.A O no hydrogen 3.055 N/A GLN 165.A NE2 PHE 171.A O no hydrogen 3.056 N/A THR 166.A N ASP 164.A OD2 no hydrogen 2.946 N/A THR 166.A OG1 ASP 164.A OD1 no hydrogen 3.372 N/A THR 166.A OG1 ASP 164.A OD2 no hydrogen 2.793 N/A VAL 167.A N ASP 164.A O no hydrogen 2.943 N/A ALA 169.A N PRO 135.A O no hydrogen 3.065 N/A GLY 170.A N GLN 165.A OE1 no hydrogen 2.861 N/A GLY 172.A N GLN 2.A OE1 no hydrogen 3.009 N/A TYR 175.A N GLN 2.A OE1 no hydrogen 3.144 N/A TYR 175.A OH GLU 5.A OE1 no hydrogen 2.562 N/A TYR 175.A OH SER 219.A OG no hydrogen 2.846 N/A VAL 176.A N GLY 172.A O no hydrogen 2.860 N/A ASP 177.A N CYS 173.A O no hydrogen 3.264 N/A GLU 178.A N ILE 174.A O no hydrogen 2.947 N/A SER 179.A N TYR 175.A O no hydrogen 2.945 N/A SER 179.A OG TYR 175.A O no hydrogen 2.802 N/A LEU 180.A N VAL 176.A O no hydrogen 3.060 N/A PHE 181.A N ASP 177.A O no hydrogen 3.054 N/A ARG 182.A N GLU 178.A O no hydrogen 3.023 N/A ARG 182.A NE GLU 205.A OE1 no hydrogen 3.084 N/A ARG 182.A NH1 GLU 212.A OE2 no hydrogen 3.082 N/A ARG 182.A NH2 GLU 212.A OE1 no hydrogen 2.924 N/A ARG 182.A NH2 GLU 212.A OE2 no hydrogen 3.327 N/A ALA 183.A N SER 179.A O no hydrogen 2.945 N/A GLY 184.A N PHE 181.A O no hydrogen 2.990 N/A ILE 185.A N LEU 180.A O no hydrogen 2.953 N/A LEU 186.A N ARG 273.A O no hydrogen 2.889 N/A ARG 189.A N LEU 186.A O no hydrogen 3.173 N/A ARG 189.A NE SER 193.A OG no hydrogen 3.132 N/A ARG 189.A NH1 GLU 198.A OE1 no hydrogen 2.949 N/A ARG 189.A NH1 ARG 273.A O no hydrogen 2.985 N/A ARG 189.A NH1 ARG 273.A OXT no hydrogen 3.524 N/A ARG 189.A NH2 SER 193.A O no hydrogen 3.092 N/A ARG 189.A NH2 SER 193.A OG no hydrogen 3.324 N/A ARG 189.A NH2 GLU 198.A OE1 no hydrogen 3.492 N/A ARG 189.A NH2 GLU 198.A OE2 no hydrogen 2.979 N/A ALA 191.A N ARG 156.A O no hydrogen 2.798 N/A ALA 192.A N THR 154.A O no hydrogen 3.064 N/A SER 193.A N PRO 190.A O no hydrogen 2.887 N/A SER 193.A OG PRO 190.A O no hydrogen 2.683 N/A LEU 194.A N ALA 191.A O no hydrogen 3.173 N/A SER 195.A N GLU 198.A OE2 no hydrogen 2.996 N/A SER 195.A OG GLU 198.A OE2 no hydrogen 3.536 N/A GLU 198.A N SER 195.A OG no hydrogen 3.098 N/A ILE 199.A N SER 195.A O no hydrogen 2.899 N/A GLU 200.A N SER 196.A O no hydrogen 2.992 N/A ARG 201.A N LYS 197.A O no hydrogen 2.969 N/A LEU 202.A N GLU 198.A O no hydrogen 2.826 N/A HIS 203.A N ILE 199.A O no hydrogen 2.949 N/A HIS 203.A NE2 PHE 142.A O no hydrogen 3.070 N/A GLU 204.A N GLU 200.A O no hydrogen 3.055 N/A GLU 205.A N ARG 201.A O no hydrogen 3.016 N/A MET 206.A N LEU 202.A O no hydrogen 2.848 N/A VAL 207.A N HIS 203.A O no hydrogen 3.043 N/A ALA 208.A N GLU 204.A O no hydrogen 3.018 N/A THR 209.A N GLU 205.A O no hydrogen 2.896 N/A THR 209.A OG1 GLU 205.A O no hydrogen 2.732 N/A ILE 210.A N MET 206.A O no hydrogen 3.099 N/A GLY 211.A N VAL 207.A O no hydrogen 3.002 N/A GLU 212.A N ALA 208.A O no hydrogen 2.913 N/A ALA 213.A N THR 209.A O no hydrogen 2.982 N/A VAL 214.A N ILE 210.A O no hydrogen 3.129 N/A MET 215.A N GLY 211.A O no hydrogen 3.156 N/A LYS 216.A N GLU 212.A O no hydrogen 3.087 N/A LYS 216.A N ALA 213.A O no hydrogen 3.234 N/A GLY 217.A N VAL 214.A O no hydrogen 3.158 N/A GLY 218.A N ALA 213.A O no hydrogen 2.936 N/A SER 219.A N GLU 5.A OE1 no hydrogen 2.800 N/A SER 219.A OG TYR 175.A OH no hydrogen 2.846 N/A THR 220.A N GLN 235.A OE1 no hydrogen 2.886 N/A THR 220.A OG1 TYR 224.A O no hydrogen 2.768 N/A THR 223.A OG1 GLU 77.A OE2 no hydrogen 2.623 N/A TYR 224.A OH GLY 217.A O no hydrogen 2.677 N/A ASN 226.A N GLU 230.A O no hydrogen 2.876 N/A ASN 226.A ND2 GLU 230.A OE2 no hydrogen 2.937 N/A THR 227.A N THR 12.A OG1 no hydrogen 3.170 N/A THR 227.A OG1 ILE 9.A O no hydrogen 3.297 N/A THR 227.A OG1 THR 12.A OG1 no hydrogen 2.948 N/A GLN 228.A N ASN 226.A OD1 no hydrogen 2.833 N/A GLN 228.A NE2 THR 12.A O no hydrogen 3.321 N/A GLY 229.A N ASN 226.A O no hydrogen 2.917 N/A GLU 230.A N ASN 226.A OD1 no hydrogen 2.956 N/A GLY 232.A N THR 220.A OG1 no hydrogen 2.921 N/A THR 233.A N LYS 216.A O no hydrogen 3.002 N/A THR 233.A OG1 LYS 216.A O no hydrogen 3.273 N/A PHE 234.A N GLY 218.A O no hydrogen 3.033 N/A GLN 235.A N GLN 235.A OE1 no hydrogen 2.714 N/A GLN 235.A NE2 GLY 232.A O no hydrogen 2.979 N/A HIS 236.A N THR 233.A O no hydrogen 3.234 N/A HIS 237.A N PHE 234.A O no hydrogen 2.765 N/A TYR 239.A N GLU 178.A OE2 no hydrogen 2.768 N/A VAL 240.A N GLU 178.A OE1 no hydrogen 2.863 N/A TYR 241.A N GLU 178.A OE1 no hydrogen 2.895 N/A ARG 243.A N VAL 240.A O no hydrogen 2.947 N/A ARG 243.A NH1 TYR 239.A O no hydrogen 3.065 N/A ARG 243.A NH1 PRO 247.A O no hydrogen 3.030 N/A ARG 243.A NH2 PRO 247.A O no hydrogen 2.985 N/A GLN 244.A N GLN 244.A OE1 no hydrogen 2.634 N/A GLY 245.A N ILE 255.A O no hydrogen 2.885 N/A ASN 246.A N ARG 243.A O no hydrogen 2.964 N/A ASN 246.A ND2 ARG 243.A O no hydrogen 3.312 N/A CYS 248.A N THR 253.A O no hydrogen 2.743 N/A LYS 249.A NZ LEU 238.A O no hydrogen 3.066 N/A ARG 250.A NH2 TYR 239.A OH no hydrogen 3.347 N/A CYS 251.A SG THR 253.A OG1 no hydrogen 3.182 N/A GLY 252.A N CYS 248.A O no hydrogen 2.934 N/A ILE 255.A N ASN 246.A O no hydrogen 2.883 N/A GLU 256.A N TYR 267.A O no hydrogen 2.950 N/A THR 258.A N THR 265.A O no hydrogen 3.032 N/A VAL 260.A N ARG 263.A O no hydrogen 2.978 N/A ARG 263.A N VAL 260.A O no hydrogen 2.909 N/A THR 265.A N THR 258.A O no hydrogen 2.792 N/A THR 265.A OG1 VAL 260.A O no hydrogen 3.547 N/A THR 265.A OG1 ARG 263.A O no hydrogen 2.866 N/A HIS 266.A N ASP 177.A OD2 no hydrogen 2.934 N/A HIS 266.A ND1 ASP 177.A OD2 no hydrogen 3.065 N/A TYR 267.A N GLU 256.A O no hydrogen 3.042 N/A CYS 268.A N GLN 272.A OE1 no hydrogen 2.856 N/A GLN 272.A N CYS 268.A O no hydrogen 3.159 N/A GLN 272.A NE2 ILE 185.A O no hydrogen 2.906 N/A ARG 273.A N GLY 184.A O no hydrogen 3.085 N/A ARG 273.A NE ARG 270.A O no hydrogen 3.182 N/A ARG 273.A NH2 ARG 270.A O no hydrogen 2.946 N/A