Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q5s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N TYR 43.A O no hydrogen 2.730 N/A TYR 4.A OH ASP 45.A OD1 no hydrogen 2.615 N/A SER 5.A N GLU 8.A OE1 no hydrogen 3.270 N/A SER 5.A OG GLU 8.A OE1 no hydrogen 3.201 N/A GLU 8.A N SER 5.A OG no hydrogen 3.264 N/A VAL 9.A N SER 5.A O no hydrogen 2.915 N/A SER 10.A N ILE 6.A O no hydrogen 2.830 N/A SER 10.A OG VAL 15.A O no hydrogen 2.687 N/A LYS 11.A N GLY 7.A O no hydrogen 2.876 N/A LEU 12.A N GLU 8.A O no hydrogen 2.884 N/A ALA 13.A N VAL 9.A O no hydrogen 2.781 N/A VAL 15.A N SER 10.A O no hydrogen 3.070 N/A ALA 19.A N SER 16.A OG no hydrogen 2.947 N/A LEU 20.A N SER 16.A O no hydrogen 2.992 N/A ARG 21.A N ILE 17.A O no hydrogen 2.884 N/A TYR 22.A N LYS 18.A O no hydrogen 2.948 N/A TYR 23.A N ALA 19.A O no hydrogen 2.755 N/A ASP 24.A N LEU 20.A O no hydrogen 2.835 N/A ASP 24.A N ARG 21.A O no hydrogen 3.149 N/A LYS 25.A N ARG 21.A O no hydrogen 2.974 N/A ILE 26.A N TYR 22.A O no hydrogen 2.967 N/A ASP 27.A N ASP 24.A O no hydrogen 2.858 N/A LEU 28.A N TYR 23.A O no hydrogen 2.842 N/A PHE 29.A N TYR 23.A O no hydrogen 2.826 N/A LYS 30.A NZ ASP 24.A O no hydrogen 2.944 N/A LYS 30.A NZ ASP 24.A OD2 no hydrogen 2.534 N/A LYS 30.A NZ ASP 27.A OD1 no hydrogen 3.029 N/A TYR 33.A N TYR 42.A O no hydrogen 2.978 N/A ASP 35.A N TYR 40.A O no hydrogen 3.170 N/A ASP 37.A N ASP 35.A OD1 no hydrogen 2.679 N/A THR 38.A N ASP 35.A OD1 no hydrogen 3.269 N/A THR 38.A OG1 ASP 35.A OD2 no hydrogen 2.675 N/A ARG 41.A NE ASP 24.A OD1 no hydrogen 2.881 N/A TYR 42.A N TYR 33.A O no hydrogen 3.043 N/A TYR 43.A N TYR 4.A O no hydrogen 2.721 N/A THR 44.A N GLN 47.A OE1 no hydrogen 2.867 N/A THR 44.A OG1 SER 46.A OG no hydrogen 3.251 N/A SER 46.A OG THR 44.A OG1 no hydrogen 3.251 N/A GLN 47.A N THR 44.A O no hydrogen 3.168 N/A GLN 47.A N THR 44.A OG1 no hydrogen 3.122 N/A LEU 48.A N ASP 45.A O no hydrogen 3.168 N/A HIS 50.A N GLN 47.A O no hydrogen 3.001 N/A LEU 51.A N LEU 48.A O no hydrogen 2.986 N/A ASP 52.A N ILE 49.A O no hydrogen 3.091 N/A ILE 54.A N HIS 50.A O no hydrogen 3.157 N/A LYS 55.A N LEU 51.A O no hydrogen 2.777 N/A LYS 55.A NZ ALA 13.A O no hydrogen 3.190 N/A SER 56.A N ASP 52.A O no hydrogen 3.088 N/A SER 56.A OG ASP 52.A O no hydrogen 3.161 N/A LEU 57.A N LEU 53.A O no hydrogen 2.780 N/A LYS 58.A N ILE 54.A O no hydrogen 2.917 N/A TYR 59.A N LYS 55.A O no hydrogen 3.009 N/A ILE 60.A N SER 56.A O no hydrogen 3.036 N/A GLY 61.A N LEU 57.A O no hydrogen 3.011 N/A THR 62.A N LEU 57.A O no hydrogen 3.004 N/A THR 62.A OG1 LEU 57.A O no hydrogen 3.546 N/A MET 67.A N PRO 63.A O no hydrogen 3.090 N/A LYS 68.A N LEU 64.A O no hydrogen 2.918 N/A LYS 68.A NZ ILE 26.A O no hydrogen 2.915 N/A LYS 68.A NZ GLU 65.A OE2 no hydrogen 2.943 N/A LYS 69.A N GLU 65.A O no hydrogen 3.230 N/A LYS 69.A N GLU 66.A O no hydrogen 2.954 N/A ALA 70.A N GLU 66.A O no hydrogen 2.915 N/A GLN 71.A N MET 67.A O no hydrogen 2.837 N/A GLN 71.A NE2 LYS 68.A O no hydrogen 3.518 N/A ASP 72.A N LYS 69.A O no hydrogen 3.301 N/A LEU 73.A N ALA 70.A O no hydrogen 3.150 N/A LEU 78.A N GLU 74.A O no hydrogen 2.968 N/A PHE 79.A N MET 75.A O no hydrogen 2.975 N/A PHE 81.A N GLU 77.A O no hydrogen 3.500 N/A TYR 82.A N LEU 78.A O no hydrogen 2.926 N/A THR 83.A N PHE 79.A O no hydrogen 3.074 N/A THR 83.A OG1 ALA 80.A O no hydrogen 2.364 N/A GLU 84.A N ALA 80.A O no hydrogen 2.957 N/A GLN 85.A N PHE 81.A O no hydrogen 2.900 N/A GLU 86.A N TYR 82.A O no hydrogen 2.912 N/A ARG 87.A N THR 83.A O no hydrogen 3.109 N/A ARG 87.A NH1 GLU 84.A OE2 no hydrogen 2.899 N/A GLN 88.A N GLU 84.A O no hydrogen 3.249 N/A ILE 89.A N GLN 85.A O no hydrogen 2.988 N/A ARG 90.A N GLU 86.A O no hydrogen 2.991 N/A GLU 91.A N ARG 87.A O no hydrogen 2.781 N/A LYS 92.A N GLN 88.A O no hydrogen 2.982 N/A LEU 93.A N ILE 89.A O no hydrogen 2.882 N/A ASP 94.A N ARG 90.A O no hydrogen 2.877 N/A PHE 95.A N GLU 91.A O no hydrogen 2.974 N/A LEU 96.A N LYS 92.A O no hydrogen 2.761 N/A SER 97.A N LEU 93.A O no hydrogen 2.906 N/A SER 97.A OG LEU 93.A O no hydrogen 2.885 N/A SER 97.A OG ASP 94.A O no hydrogen 3.109 N/A ALA 98.A N ASP 94.A O no hydrogen 2.977 N/A LEU 99.A N PHE 95.A O no hydrogen 2.895 N/A GLU 100.A N LEU 96.A O no hydrogen 2.716 N/A GLN 101.A N SER 97.A O no hydrogen 3.093 N/A THR 102.A N ALA 98.A O no hydrogen 2.965 N/A THR 102.A OG1 ALA 98.A O no hydrogen 3.172 N/A ILE 103.A N LEU 99.A O no hydrogen 3.177 N/A SER 104.A N GLU 100.A O no hydrogen 3.147 N/A SER 104.A OG GLU 100.A O no hydrogen 3.227 N/A LEU 105.A N GLN 101.A O no hydrogen 3.069 N/A LEU 105.A N THR 102.A O no hydrogen 2.919 N/A VAL 106.A N THR 102.A O no hydrogen 2.807 N/A LYS 107.A N ILE 103.A O no hydrogen 2.734 N/A LYS 108.A N SER 104.A O no hydrogen 2.923 N/A ARG 109.A N LEU 105.A O no hydrogen 2.793 N/A MET 110.A N VAL 106.A O no hydrogen 2.903 N/A LYS 111.A N LYS 107.A O no hydrogen 2.793 N/A LYS 111.A N LYS 108.A O no hydrogen 3.217 N/A ARG 112.A N LYS 108.A O no hydrogen 3.185 N/A ARG 112.A NH1 GLU 269.A OE1 no hydrogen 3.084 N/A ARG 112.A NH1 GLU 269.A OE2 no hydrogen 2.840 N/A GLN 113.A NE2 GLU 269.A OE2 no hydrogen 3.123 N/A MET 114.A N LYS 111.A O no hydrogen 2.800 N/A GLY 120.A N ALA 219.A O no hydrogen 2.987 N/A PHE 123.A N CYS 217.A O no hydrogen 2.882 N/A LEU 125.A N TYR 215.A O no hydrogen 2.818 N/A GLU 127.A N GLY 213.A O no hydrogen 3.027 N/A GLU 128.A N GLU 127.A OE1 no hydrogen 3.145 N/A ILE 130.A N ILE 210.A O no hydrogen 3.041 N/A ARG 131.A NH1 ASN 195.A OD1 no hydrogen 3.000 N/A ARG 131.A NH2 THR 194.A O no hydrogen 3.069 N/A ILE 132.A N THR 208.A O no hydrogen 2.831 N/A ILE 133.A N THR 190.A O no hydrogen 3.008 N/A GLN 134.A N GLU 206.A O no hydrogen 2.897 N/A THR 135.A N ILE 188.A O no hydrogen 2.928 N/A THR 135.A OG1 ASP 204.A O no hydrogen 2.888 N/A ALA 137.A N ARG 186.A O no hydrogen 3.056 N/A GLY 141.A N ASN 144.A OD1 no hydrogen 3.196 N/A ASN 144.A N GLY 141.A O no hydrogen 3.069 N/A LEU 146.A N SER 149.A OG no hydrogen 2.942 N/A SER 149.A N LEU 146.A O no hydrogen 3.317 N/A SER 149.A OG LEU 146.A O no hydrogen 3.173 N/A TYR 150.A N ASN 147.A O no hydrogen 2.685 N/A TYR 150.A OH GLY 169.A O no hydrogen 2.537 N/A SER 151.A N ALA 148.A O no hydrogen 3.439 N/A SER 151.A OG ALA 148.A O no hydrogen 3.454 N/A LYS 154.A N TYR 150.A O no hydrogen 2.836 N/A LYS 154.A NZ ASN 165.A O no hydrogen 3.042 N/A LYS 154.A NZ TYR 168.A OH no hydrogen 3.399 N/A LYS 155.A N SER 151.A O no hydrogen 2.786 N/A PHE 156.A N LYS 152.A O no hydrogen 3.154 N/A ILE 157.A N LEU 153.A O no hydrogen 2.994 N/A GLU 158.A N LYS 154.A O no hydrogen 2.725 N/A SER 159.A N LYS 155.A O no hydrogen 2.890 N/A SER 159.A OG PHE 156.A O no hydrogen 3.073 N/A ALA 160.A N PHE 156.A O no hydrogen 3.076 N/A ASP 161.A N ILE 157.A O no hydrogen 2.779 N/A ASN 165.A ND2 ASN 165.A O no hydrogen 2.439 N/A TYR 168.A N ILE 253.A O no hydrogen 2.879 N/A GLY 169.A N PHE 189.A O no hydrogen 2.886 N/A ALA 170.A N GLU 251.A O no hydrogen 3.049 N/A THR 171.A N HIS 187.A O no hydrogen 2.862 N/A THR 171.A OG1 ASP 248.A OD2 no hydrogen 2.846 N/A PHE 172.A N VAL 249.A O no hydrogen 3.031 N/A GLN 175.A NE2 SER 173.A OG no hydrogen 2.908 N/A TYR 177.A OH SER 173.A O no hydrogen 2.493 N/A THR 178.A N GLU 182.A OE1 no hydrogen 2.828 N/A THR 178.A OG1 GLU 182.A OE1 no hydrogen 3.489 N/A THR 178.A OG1 GLU 182.A OE2 no hydrogen 3.116 N/A SER 179.A OG ASP 181.A OD1 no hydrogen 2.729 N/A GLU 182.A N SER 179.A O no hydrogen 2.917 N/A MET 183.A N ILE 180.A O no hydrogen 2.913 N/A THR 184.A OG1 MET 183.A O no hydrogen 3.203 N/A TYR 185.A N LEU 140.A O no hydrogen 2.728 N/A TYR 185.A OH GLU 251.A OE1 no hydrogen 2.611 N/A TYR 185.A OH GLU 251.A OE2 no hydrogen 3.084 N/A ARG 186.A N THR 171.A O no hydrogen 2.766 N/A ARG 186.A NH1 ASP 248.A OD1 no hydrogen 2.101 N/A HIS 187.A NE2 GLU 136.A OE2 no hydrogen 2.166 N/A ILE 188.A N THR 135.A O no hydrogen 3.105 N/A PHE 189.A N GLY 169.A O no hydrogen 2.783 N/A THR 190.A N ILE 133.A O no hydrogen 2.840 N/A VAL 192.A N ARG 131.A O no hydrogen 2.989 N/A LEU 193.A N ASP 161.A OD1 no hydrogen 3.043 N/A LYS 196.A NZ THR 194.A OG1 no hydrogen 3.377 N/A THR 202.A OG1 ASP 204.A OD2 no hydrogen 2.531 N/A MET 205.A N THR 202.A O no hydrogen 3.310 N/A GLU 206.A N GLN 134.A O no hydrogen 3.146 N/A THR 208.A N ILE 132.A O no hydrogen 3.003 N/A ILE 210.A N ILE 130.A O no hydrogen 2.923 N/A LYS 212.A NZ GLU 128.A OE1 no hydrogen 3.205 N/A GLY 213.A N GLU 127.A O no hydrogen 3.372 N/A TYR 215.A N LEU 125.A O no hydrogen 2.883 N/A TYR 215.A OH PRO 211.A O no hydrogen 2.720 N/A ALA 216.A N ILE 272.A O no hydrogen 2.819 N/A CYS 217.A N PHE 123.A O no hydrogen 2.618 N/A CYS 217.A SG PHE 123.A O no hydrogen 3.859 N/A CYS 217.A SG TYR 215.A O no hydrogen 3.278 N/A ILE 218.A N MET 270.A O no hydrogen 3.048 N/A TYR 220.A N VAL 268.A O no hydrogen 2.974 N/A PHE 222.A N TYR 266.A O no hydrogen 3.008 N/A SER 223.A OG HIS 226.A ND1 no hydrogen 2.965 N/A GLU 225.A N GLU 225.A OE1 no hydrogen 2.793 N/A TYR 227.A N SER 223.A O no hydrogen 3.195 N/A TYR 227.A N PRO 224.A O no hydrogen 3.017 N/A TYR 227.A OH GLU 251.A OE1 no hydrogen 2.816 N/A TYR 227.A OH GLU 251.A OE2 no hydrogen 2.823 N/A ASN 230.A N HIS 226.A O no hydrogen 2.971 N/A LEU 231.A N TYR 227.A O no hydrogen 3.359 N/A GLN 232.A N PHE 228.A O no hydrogen 2.938 N/A LYS 233.A N LEU 229.A O no hydrogen 2.704 N/A LYS 233.A NZ GLY 120.A O no hydrogen 3.332 N/A LYS 233.A NZ ASN 230.A OD1 no hydrogen 2.929 N/A LEU 234.A N ASN 230.A O no hydrogen 3.067 N/A LEU 234.A N LEU 231.A O no hydrogen 2.804 N/A ILE 235.A N LEU 231.A O no hydrogen 3.027 N/A LYS 236.A N GLN 232.A O no hydrogen 2.870 N/A LYS 236.A NZ ASP 240.A OD1 no hydrogen 3.427 N/A LYS 236.A NZ ASP 240.A OD2 no hydrogen 3.340 N/A TYR 237.A N LYS 233.A O no hydrogen 2.922 N/A ILE 238.A N LEU 234.A O no hydrogen 3.092 N/A ALA 239.A N ILE 235.A O no hydrogen 2.886 N/A ASP 240.A N LYS 236.A O no hydrogen 2.793 N/A ARG 241.A N TYR 237.A O no hydrogen 3.205 N/A GLN 242.A N ILE 238.A O no hydrogen 2.803 N/A GLN 242.A N ALA 239.A O no hydrogen 3.139 N/A VAL 246.A N ARG 273.A O no hydrogen 2.762 N/A SER 247.A OG ASP 248.A O no hydrogen 3.051 N/A VAL 249.A N PHE 172.A O no hydrogen 2.803 N/A TYR 250.A N LYS 271.A O no hydrogen 2.874 N/A GLU 251.A N ALA 170.A O no hydrogen 2.861 N/A LEU 252.A N GLU 269.A O no hydrogen 2.838 N/A ILE 253.A N TYR 168.A O no hydrogen 2.790 N/A ILE 254.A N ARG 267.A O no hydrogen 2.832 N/A ILE 256.A N GLU 265.A O no hydrogen 3.088 N/A HIS 257.A NE2 GLN 263.A O no hydrogen 2.880 N/A SER 259.A N HIS 257.A ND1 no hydrogen 3.222 N/A LYS 261.A N SER 259.A OG no hydrogen 3.086 N/A GLU 265.A N HIS 257.A NE2 no hydrogen 3.160 N/A ARG 267.A N ILE 254.A O no hydrogen 2.682 N/A VAL 268.A N TYR 220.A O no hydrogen 2.918 N/A GLU 269.A N LEU 252.A O no hydrogen 2.889 N/A MET 270.A N ILE 218.A O no hydrogen 2.989 N/A LYS 271.A N TYR 250.A O no hydrogen 2.767 N/A ILE 272.A N ALA 216.A O no hydrogen 2.857 N/A ARG 273.A N SER 247.A OG no hydrogen 2.961 N/A ILE 274.A N ARG 214.A O no hydrogen 2.799 N/A