Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ke7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ASP 64.A OD1 no hydrogen 2.824 N/A TYR 5.A N ASP 64.A OD2 no hydrogen 3.018 N/A TYR 5.A OH GLU 63.A OE1 no hydrogen 2.734 N/A LEU 8.A N GLY 59.A O no hydrogen 2.732 N/A GLY 10.A N GLU 12.A OE1 no hydrogen 3.059 N/A GLY 10.A N GLU 12.A OE2 no hydrogen 3.354 N/A ALA 11.A N LEU 8.A O no hydrogen 2.973 N/A GLU 12.A N GLU 12.A OE1 no hydrogen 2.796 N/A PHE 14.A N LEU 52.A O no hydrogen 2.895 N/A ALA 16.A N VAL 50.A O no hydrogen 3.043 N/A ASN 18.A N THR 49.A OG1 no hydrogen 2.839 N/A ASN 18.A ND2 TYR 48.A O no hydrogen 2.965 N/A GLY 19.A N GLY 47.A O no hydrogen 3.145 N/A GLY 22.A N THR 90.A O no hydrogen 2.830 N/A VAL 23.A N THR 49.A O no hydrogen 2.861 N/A LEU 24.A N PHE 92.A O no hydrogen 2.823 N/A LEU 25.A N CYS 51.A O no hydrogen 2.879 N/A VAL 26.A N THR 94.A O no hydrogen 2.892 N/A HIS 27.A ND1 GLY 28.A O no hydrogen 2.982 N/A THR 30.A N HIS 58.A NE2 no hydrogen 3.044 N/A THR 30.A OG1 PHE 29.A O no hydrogen 2.630 N/A GLY 31.A N GLY 28.A O no hydrogen 2.971 N/A HIS 34.A N THR 32.A OG1 no hydrogen 3.014 N/A HIS 34.A NE2 LYS 150.A O no hydrogen 2.927 N/A SER 35.A N THR 32.A O no hydrogen 3.112 N/A SER 35.A OG THR 32.A O no hydrogen 3.536 N/A SER 35.A OG GLU 151.A OE1 no hydrogen 3.271 N/A SER 35.A OG GLU 151.A OE2 no hydrogen 2.401 N/A MET 36.A N PRO 33.A O no hydrogen 2.941 N/A ARG 37.A N HIS 34.A O no hydrogen 3.443 N/A ARG 37.A NH1 GLU 12.A O no hydrogen 3.498 N/A ARG 37.A NH2 GLY 10.A O no hydrogen 3.125 N/A ARG 37.A NH2 GLU 12.A O no hydrogen 2.770 N/A ALA 40.A N MET 36.A O no hydrogen 3.033 N/A GLU 41.A N ARG 37.A O no hydrogen 2.845 N/A ALA 42.A N PRO 38.A O no hydrogen 3.123 N/A TYR 43.A N LEU 39.A O no hydrogen 2.864 N/A ALA 44.A N ALA 40.A O no hydrogen 3.061 N/A LYS 45.A N GLU 41.A O no hydrogen 3.058 N/A ALA 46.A N ALA 42.A O no hydrogen 3.117 N/A ALA 46.A N TYR 43.A O no hydrogen 3.261 N/A GLY 47.A N ALA 44.A O no hydrogen 2.984 N/A TYR 48.A N TYR 43.A O no hydrogen 3.077 N/A THR 49.A N VAL 21.A O no hydrogen 2.941 N/A THR 49.A OG1 GLY 19.A O no hydrogen 2.638 N/A VAL 50.A N ALA 16.A O no hydrogen 2.858 N/A CYS 51.A N VAL 23.A O no hydrogen 2.953 N/A CYS 51.A SG GLY 80.A O no hydrogen 3.833 N/A LEU 52.A N PHE 14.A O no hydrogen 2.817 N/A ARG 54.A NH1 GLU 3.A OE1 no hydrogen 3.347 N/A ARG 54.A NH1 GLU 3.A OE2 no hydrogen 2.857 N/A ARG 54.A NH1 HIS 58.A O no hydrogen 2.853 N/A ARG 54.A NH2 GLU 3.A OE1 no hydrogen 3.024 N/A LEU 55.A N HIS 27.A NE2 no hydrogen 3.101 N/A LYS 56.A N SER 76.A OG no hydrogen 2.961 N/A LYS 56.A NZ MET 1.A O no hydrogen 2.887 N/A GLY 57.A N GLU 3.A OE2 no hydrogen 2.857 N/A HIS 58.A N LEU 55.A O no hydrogen 3.004 N/A HIS 58.A ND1 LYS 56.A O no hydrogen 3.123 N/A THR 60.A N TYR 154.A OH no hydrogen 2.901 N/A THR 60.A OG1 ASP 64.A OD2 no hydrogen 2.772 N/A THR 60.A OG1 TYR 154.A OH no hydrogen 3.375 N/A HIS 61.A N THR 60.A OG1 no hydrogen 2.672 N/A GLU 63.A N HIS 61.A ND1 no hydrogen 2.932 N/A ASP 64.A N HIS 61.A O no hydrogen 2.899 N/A MET 65.A N HIS 61.A O no hydrogen 3.262 N/A GLU 66.A N TYR 62.A O no hydrogen 2.950 N/A ARG 67.A N ASP 64.A O no hydrogen 3.001 N/A ARG 67.A NH2 ASP 64.A OD1 no hydrogen 2.853 N/A THR 68.A N MET 65.A O no hydrogen 2.984 N/A THR 68.A OG1 MET 65.A O no hydrogen 2.761 N/A THR 69.A N ASP 72.A OD2 no hydrogen 2.865 N/A PHE 70.A N GLN 164.A OE1 no hydrogen 2.899 N/A HIS 71.A N THR 69.A OG1 no hydrogen 3.265 N/A ASP 72.A N THR 69.A O no hydrogen 3.038 N/A TRP 73.A NE1 THR 68.A OG1 no hydrogen 2.934 N/A VAL 74.A N PHE 70.A O no hydrogen 2.938 N/A ALA 75.A N HIS 71.A O no hydrogen 2.882 N/A SER 76.A N ASP 72.A O no hydrogen 3.067 N/A SER 76.A OG ASP 72.A O no hydrogen 3.254 N/A VAL 77.A N TRP 73.A O no hydrogen 3.312 N/A GLU 78.A N VAL 74.A O no hydrogen 2.842 N/A GLU 79.A N ALA 75.A O no hydrogen 2.947 N/A GLY 80.A N SER 76.A O no hydrogen 3.175 N/A TYR 81.A N VAL 77.A O no hydrogen 2.786 N/A TYR 81.A OH HIS 110.A ND1 no hydrogen 3.358 N/A TYR 81.A OH ASP 112.A OD1 no hydrogen 2.962 N/A TYR 81.A OH ASP 112.A OD2 no hydrogen 2.582 N/A GLY 82.A N GLU 78.A O no hydrogen 2.820 N/A TRP 83.A N GLU 79.A O no hydrogen 2.958 N/A LEU 84.A N GLY 80.A O no hydrogen 3.105 N/A LYS 85.A N TYR 81.A O no hydrogen 2.913 N/A LYS 85.A NZ TYR 81.A OH no hydrogen 3.270 N/A LYS 85.A NZ ASP 112.A OD2 no hydrogen 3.293 N/A GLN 86.A N GLY 82.A O no hydrogen 3.185 N/A ARG 87.A N LEU 84.A O no hydrogen 2.943 N/A ARG 87.A NE GLU 17.A OE2 no hydrogen 2.462 N/A ARG 87.A NH1 TRP 83.A O no hydrogen 2.928 N/A CYS 88.A SG GLY 19.A O no hydrogen 3.949 N/A GLN 89.A N PRO 20.A O no hydrogen 2.848 N/A THR 90.A N PRO 20.A O no hydrogen 3.331 N/A PHE 92.A N GLY 22.A O no hydrogen 2.878 N/A VAL 93.A N GLY 115.A O no hydrogen 3.194 N/A THR 94.A N LEU 24.A O no hydrogen 2.864 N/A THR 94.A OG1 VAL 117.A O no hydrogen 2.633 N/A GLY 95.A N VAL 117.A O no hydrogen 3.373 N/A LEU 96.A N VAL 26.A O no hydrogen 3.075 N/A SER 97.A N ILE 119.A O no hydrogen 2.978 N/A SER 97.A OG HIS 221.A NE2 no hydrogen 3.072 N/A GLY 99.A N LEU 96.A O no hydrogen 2.741 N/A THR 101.A N SER 97.A O no hydrogen 2.999 N/A THR 101.A OG1 SER 97.A O no hydrogen 3.308 N/A THR 101.A OG1 ALA 122.A O no hydrogen 2.566 N/A LEU 102.A N MET 98.A O no hydrogen 2.814 N/A THR 103.A N GLY 99.A O no hydrogen 2.971 N/A THR 103.A OG1 GLY 99.A O no hydrogen 2.838 N/A LEU 104.A N GLY 100.A O no hydrogen 3.098 N/A TYR 105.A N THR 101.A O no hydrogen 2.907 N/A LEU 106.A N LEU 102.A O no hydrogen 2.915 N/A ALA 107.A N THR 103.A O no hydrogen 3.139 N/A GLU 108.A N LEU 104.A O no hydrogen 2.968 N/A HIS 109.A N LEU 106.A O no hydrogen 3.083 N/A HIS 109.A ND1 TYR 105.A O no hydrogen 2.801 N/A HIS 110.A NE2 GLU 78.A OE1 no hydrogen 3.034 N/A HIS 110.A NE2 GLU 78.A OE2 no hydrogen 2.833 N/A ILE 113.A N HIS 110.A O no hydrogen 3.267 N/A CYS 114.A N ILE 91.A O no hydrogen 2.935 N/A CYS 114.A SG.A ASP 112.A O no hydrogen 3.548 N/A CYS 114.A SG.B HIS 243.A O no hydrogen 2.947 N/A ILE 116.A N PRO 182.A O no hydrogen 3.049 N/A VAL 117.A N VAL 93.A O no hydrogen 2.851 N/A ILE 119.A N GLY 95.A O no hydrogen 2.838 N/A ASN 120.A N PHE 186.A O no hydrogen 2.996 N/A ASN 120.A ND2 SER 188.A OG no hydrogen 3.090 N/A ASN 120.A ND2 HIS 221.A O no hydrogen 3.003 N/A VAL 123.A N ASN 198.A OD1 no hydrogen 2.673 N/A ASP 124.A N ASN 198.A OD1 no hydrogen 2.874 N/A ILE 128.A N ILE 125.A O no hydrogen 3.031 N/A ALA 130.A N PRO 126.A O no hydrogen 3.072 N/A GLY 131.A N ALA 127.A O no hydrogen 3.181 N/A MET 132.A N ILE 128.A O no hydrogen 2.858 N/A ARG 135.A NE GLU 66.A OE2 no hydrogen 2.759 N/A ARG 135.A NH2 GLU 66.A OE2 no hydrogen 3.493 N/A TYR 136.A OH GLU 66.A OE1 no hydrogen 2.598 N/A LEU 137.A N THR 157.A O no hydrogen 2.792 N/A SER 139.A N GLU 155.A O no hydrogen 2.932 N/A SER 139.A OG TYR 154.A O no hydrogen 2.835 N/A SER 139.A OG THR 157.A OG1 no hydrogen 3.218 N/A LYS 145.A N ASP 226.A OD2 no hydrogen 2.809 N/A LYS 145.A NZ ASN 218.A OD1 no hydrogen 2.849 N/A ASN 146.A N ASP 226.A OD1 no hydrogen 2.964 N/A ASP 148.A N ASN 146.A OD1 no hydrogen 2.885 N/A VAL 149.A N ASN 146.A O no hydrogen 3.340 N/A LEU 152.A N GLU 151.A OE1 no hydrogen 2.821 N/A TYR 154.A N THR 30.A O no hydrogen 3.105 N/A TYR 154.A OH GLY 57.A O no hydrogen 2.649 N/A TYR 154.A OH THR 60.A OG1 no hydrogen 3.375 N/A GLU 155.A N GLU 155.A OE1 no hydrogen 2.542 N/A LYS 156.A NZ ASP 138.A OD1 no hydrogen 2.518 N/A THR 157.A N LEU 137.A O no hydrogen 2.837 N/A THR 157.A OG1 SER 139.A OG no hydrogen 3.218 N/A THR 159.A N ARG 135.A O no hydrogen 3.022 N/A THR 159.A OG1 PRO 134.A O no hydrogen 3.131 N/A THR 159.A OG1 ARG 135.A O no hydrogen 3.491 N/A SER 161.A N PRO 158.A O no hydrogen 2.986 N/A SER 161.A OG MET 65.A O no hydrogen 3.531 N/A LEU 162.A N THR 159.A O no hydrogen 2.964 N/A LEU 163.A N THR 159.A O no hydrogen 3.412 N/A GLN 164.A N ALA 160.A O no hydrogen 3.362 N/A LEU 165.A N SER 161.A O no hydrogen 3.021 N/A ALA 166.A N LEU 162.A O no hydrogen 2.947 N/A ARG 167.A N LEU 163.A O no hydrogen 3.018 N/A LEU 168.A N GLN 164.A O no hydrogen 2.994 N/A MET 169.A N LEU 165.A O no hydrogen 2.797 N/A ALA 170.A N ALA 166.A O no hydrogen 2.912 N/A GLN 171.A N ARG 167.A O no hydrogen 2.996 N/A THR 172.A N LEU 168.A O no hydrogen 2.919 N/A THR 172.A OG1 LEU 168.A O no hydrogen 2.790 N/A LYS 173.A N MET 169.A O no hydrogen 2.832 N/A LYS 173.A NZ ASP 124.A OD2 no hydrogen 3.221 N/A ALA 174.A N ALA 170.A O no hydrogen 3.148 N/A LYS 175.A N THR 172.A O no hydrogen 3.296 N/A LYS 175.A NZ HIS 109.A NE2 no hydrogen 3.395 N/A LEU 176.A N LYS 173.A O no hydrogen 3.396 N/A ARG 178.A N LYS 175.A O no hydrogen 2.900 N/A ILE 179.A N LEU 176.A O no hydrogen 3.084 N/A CYS 181.A SG PRO 182.A O no hydrogen 3.830 N/A ALA 183.A N GLU 210.A O no hydrogen 2.870 N/A LEU 184.A N ILE 116.A O no hydrogen 3.021 N/A ILE 185.A N GLU 212.A O no hydrogen 2.904 N/A PHE 186.A N PRO 118.A O no hydrogen 2.995 N/A VAL 187.A N VAL 214.A O no hydrogen 3.079 N/A SER 188.A N ASN 120.A OD1 no hydrogen 2.789 N/A SER 188.A OG TYR 220.A O no hydrogen 2.791 N/A ASP 189.A N LEU 216.A O no hydrogen 3.044 N/A ASP 191.A N SER 188.A O no hydrogen 3.101 N/A HIS 192.A N ASP 143.A OD2 no hydrogen 2.972 N/A HIS 192.A ND1 ASP 143.A OD1 no hydrogen 2.733 N/A VAL 193.A N ASP 191.A OD1 no hydrogen 2.724 N/A VAL 194.A N ASP 191.A OD1 no hydrogen 2.774 N/A ASN 198.A N PRO 195.A O no hydrogen 2.953 N/A ASN 198.A ND2 ASP 124.A O no hydrogen 2.984 N/A ASN 198.A ND2 PRO 195.A O no hydrogen 2.851 N/A ALA 199.A N PRO 196.A O no hydrogen 2.935 N/A ASP 200.A N GLY 197.A O no hydrogen 2.975 N/A ILE 201.A N GLY 197.A O no hydrogen 3.095 N/A ILE 202.A N ASN 198.A O no hydrogen 3.059 N/A PHE 203.A N ALA 199.A O no hydrogen 2.903 N/A GLN 204.A N ASP 200.A O no hydrogen 2.967 N/A GLY 205.A N ILE 201.A O no hydrogen 2.869 N/A ILE 206.A N ILE 202.A O no hydrogen 3.016 N/A SER 207.A N ILE 179.A O no hydrogen 2.798 N/A SER 207.A OG ASP 177.A O no hydrogen 2.745 N/A SER 208.A OG ILE 179.A O no hydrogen 3.538 N/A SER 208.A OG CYS 181.A O no hydrogen 2.554 N/A LYS 211.A NZ PHE 203.A O no hydrogen 2.794 N/A GLU 212.A N ALA 183.A O no hydrogen 3.167 N/A VAL 214.A N ILE 185.A O no hydrogen 2.785 N/A ARG 215.A NH2 ASP 200.A OD1 no hydrogen 3.504 N/A LEU 216.A N VAL 187.A O no hydrogen 2.713 N/A ARG 217.A NE ASP 189.A OD2 no hydrogen 2.805 N/A ASN 218.A N ASP 228.A OD2 no hydrogen 2.900 N/A SER 219.A OG ASP 228.A OD2 no hydrogen 2.758 N/A TYR 220.A N ASP 226.A OD2 no hydrogen 2.850 N/A HIS 221.A N ASP 143.A OD2 no hydrogen 2.974 N/A HIS 221.A ND1 ASP 191.A OD2 no hydrogen 2.692 N/A VAL 222.A N ASP 143.A O no hydrogen 3.131 N/A ALA 223.A N HIS 221.A O no hydrogen 2.749 N/A THR 224.A OG1 SER 35.A O no hydrogen 2.804 N/A LEU 225.A N VAL 222.A O no hydrogen 3.165 N/A ASP 226.A N ALA 223.A O no hydrogen 3.073 N/A ASP 228.A N SER 219.A OG no hydrogen 3.103 N/A GLN 229.A N ASP 226.A O no hydrogen 3.080 N/A GLN 229.A NE2 THR 224.A O no hydrogen 2.915 N/A ILE 232.A N ASP 228.A O no hydrogen 3.134 N/A ILE 233.A N GLN 229.A O no hydrogen 2.994 N/A GLU 234.A N PRO 230.A O no hydrogen 2.900 N/A ARG 235.A N MET 231.A O no hydrogen 2.934 N/A SER 236.A N ILE 232.A O no hydrogen 2.957 N/A SER 236.A OG ILE 232.A O no hydrogen 2.750 N/A LEU 237.A N ILE 233.A O no hydrogen 2.959 N/A GLU 238.A N GLU 234.A O no hydrogen 3.121 N/A PHE 239.A N ARG 235.A O no hydrogen 3.025 N/A PHE 240.A N SER 236.A O no hydrogen 2.896 N/A ALA 241.A N LEU 237.A O no hydrogen 3.089 N/A LYS 242.A N GLU 238.A O no hydrogen 3.055 N/A HIS 243.A N PHE 239.A O no hydrogen 3.182 N/A GLY 245.A N THR 90.A OG1 no hydrogen 3.199 N/A