Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6q4a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N ARG 22.A O no hydrogen 2.938 N/A VAL 7.A N LYS 20.A O no hydrogen 2.801 N/A GLU 8.A N LYS 20.A O no hydrogen 3.321 N/A LYS 9.A NZ GLU 12.A OE2 no hydrogen 3.108 N/A ILE 10.A N VAL 18.A O no hydrogen 2.845 N/A GLY 11.A N VAL 18.A O no hydrogen 3.310 N/A GLY 13.A N GLY 16.A O no hydrogen 2.876 N/A TYR 15.A OH GLY 147.A O no hydrogen 2.813 N/A VAL 18.A N GLY 11.A O no hydrogen 2.886 N/A TYR 19.A N LEU 32.A O no hydrogen 2.880 N/A LYS 20.A N GLU 8.A O no hydrogen 2.994 N/A ALA 21.A N VAL 30.A O no hydrogen 2.914 N/A ARG 22.A N GLN 5.A O no hydrogen 2.990 N/A ARG 22.A NH2 GLY 27.A O no hydrogen 3.005 N/A ASN 23.A N GLU 28.A O no hydrogen 2.787 N/A LYS 24.A N ASN 3.A O no hydrogen 3.106 N/A THR 26.A N ASN 23.A OD1 no hydrogen 2.890 N/A GLY 27.A N ASN 23.A O no hydrogen 2.754 N/A GLU 28.A N THR 26.A OG1 no hydrogen 3.197 N/A VAL 29.A N GLU 28.A OE2 no hydrogen 2.770 N/A VAL 30.A N ALA 21.A O no hydrogen 2.882 N/A ALA 31.A N PHE 74.A O no hydrogen 2.827 N/A LEU 32.A N TYR 19.A O no hydrogen 2.778 N/A LYS 33.A N LEU 72.A O no hydrogen 2.823 N/A LYS 33.A NZ ASP 139.A OD1 no hydrogen 2.904 N/A LYS 33.A NZ ASP 139.A OD2 no hydrogen 3.363 N/A LYS 34.A N VAL 17.A O no hydrogen 2.984 N/A LYS 34.A NZ TYR 71.A OH no hydrogen 3.217 N/A ILE 35.A N LEU 70.A O no hydrogen 2.841 N/A ARG 36.A N TYR 15.A O no hydrogen 2.978 N/A ILE 43.A N PRO 39.A O no hydrogen 3.339 N/A ARG 44.A N SER 40.A O no hydrogen 3.305 N/A GLU 45.A N THR 41.A O no hydrogen 3.193 N/A ILE 46.A N.A ALA 42.A O no hydrogen 2.856 N/A ILE 46.A N.B ALA 42.A O no hydrogen 2.879 N/A SER 47.A N ILE 43.A O no hydrogen 2.950 N/A SER 47.A OG ILE 43.A O no hydrogen 2.774 N/A LEU 48.A N ARG 44.A O no hydrogen 3.174 N/A LEU 49.A N ILE 46.A O.A no hydrogen 3.058 N/A LEU 49.A N ILE 46.A O.B no hydrogen 2.938 N/A LYS 50.A N SER 47.A O no hydrogen 3.067 N/A GLU 51.A N LEU 48.A O no hydrogen 3.165 N/A LEU 52.A N LEU 49.A O no hydrogen 3.073 N/A ASN 53.A ND2 LYS 50.A O no hydrogen 3.197 N/A ASN 56.A N HIS 54.A ND1 no hydrogen 2.914 N/A ASN 56.A ND2 GLN 104.A OE1 no hydrogen 3.109 N/A ASN 56.A ND2 ILE 135.A O no hydrogen 2.878 N/A ILE 57.A N HIS 54.A O no hydrogen 3.003 N/A VAL 58.A N LEU 137.A O no hydrogen 2.929 N/A LYS 59.A N GLU 75.A OE2 no hydrogen 3.003 N/A LEU 61.A N VAL 73.A O no hydrogen 2.647 N/A ASP 62.A N VAL 73.A O no hydrogen 3.328 N/A ILE 64.A N TYR 71.A O no hydrogen 2.902 N/A THR 66.A N LYS 69.A O no hydrogen 3.133 N/A LYS 69.A N THR 66.A O no hydrogen 2.959 N/A TYR 71.A N ILE 64.A O no hydrogen 2.981 N/A LEU 72.A N LYS 33.A O no hydrogen 2.851 N/A VAL 73.A N ASP 62.A O no hydrogen 2.856 N/A PHE 74.A N ALA 31.A O no hydrogen 2.807 N/A GLU 75.A N LYS 59.A O no hydrogen 2.942 N/A ASP 80.A N GLN 79.A OE1 no hydrogen 3.052 N/A LEU 81.A N LEU 127.A O no hydrogen 2.819 N/A LYS 82.A NZ ASP 86.A OD2 no hydrogen 3.244 N/A LYS 83.A N ASP 80.A OD1 no hydrogen 2.789 N/A PHE 84.A N ASP 80.A O no hydrogen 3.035 N/A MET 85.A N LEU 81.A O no hydrogen 2.785 N/A ASP 86.A N LYS 82.A O no hydrogen 3.081 N/A ALA 87.A N LYS 83.A O no hydrogen 2.881 N/A SER 88.A N MET 85.A O no hydrogen 3.203 N/A SER 88.A OG PHE 84.A O no hydrogen 2.759 N/A ALA 89.A N ASP 86.A O no hydrogen 3.403 N/A THR 91.A N SER 88.A O no hydrogen 3.262 N/A THR 91.A OG1 SER 88.A O no hydrogen 3.125 N/A THR 91.A OG1 GLY 92.A O no hydrogen 3.399 N/A GLY 92.A N SER 88.A O no hydrogen 2.550 N/A LEU 97.A N PRO 94.A O no hydrogen 2.923 N/A ILE 98.A N PRO 94.A O no hydrogen 2.999 N/A LYS 99.A N LEU 95.A O no hydrogen 2.909 N/A LYS 99.A NZ PHE 279.A O no hydrogen 2.930 N/A LYS 99.A NZ ASP 282.A OD1 no hydrogen 2.720 N/A SER 100.A N PRO 96.A O no hydrogen 2.980 N/A TYR 101.A N LEU 97.A O no hydrogen 2.874 N/A LEU 102.A N ILE 98.A O no hydrogen 2.884 N/A PHE 103.A N LYS 99.A O no hydrogen 2.937 N/A GLN 104.A N SER 100.A O no hydrogen 2.957 N/A GLN 104.A NE2 SER 100.A O no hydrogen 3.460 N/A GLN 104.A NE2 SER 100.A OG no hydrogen 3.049 N/A GLN 104.A NE2 GLY 133.A O no hydrogen 2.888 N/A LEU 105.A N TYR 101.A O no hydrogen 2.886 N/A LEU 106.A N LEU 102.A O no hydrogen 2.909 N/A GLN 107.A N PHE 103.A O no hydrogen 3.027 N/A GLN 107.A NE2 PHE 103.A O no hydrogen 3.550 N/A GLY 108.A N GLN 104.A O no hydrogen 3.008 N/A LEU 109.A N LEU 105.A O no hydrogen 2.865 N/A ALA 110.A N LEU 106.A O no hydrogen 2.796 N/A PHE 111.A N GLN 107.A O no hydrogen 3.019 N/A CYS 112.A N GLY 108.A O no hydrogen 3.069 N/A CYS 112.A SG GLY 108.A O no hydrogen 3.560 N/A HIS 113.A N LEU 109.A O no hydrogen 2.769 N/A HIS 113.A NE2 ASP 179.A OD2 no hydrogen 2.841 N/A SER 114.A N ALA 110.A O no hydrogen 2.968 N/A SER 114.A OG ALA 110.A O no hydrogen 3.525 N/A SER 114.A OG PHE 111.A O no hydrogen 2.730 N/A HIS 115.A N PHE 111.A O no hydrogen 3.327 N/A HIS 115.A N CYS 112.A O no hydrogen 2.953 N/A ARG 116.A N HIS 113.A O no hydrogen 2.880 N/A VAL 117.A N CYS 112.A O no hydrogen 2.996 N/A HIS 119.A N ASP 179.A OD2 no hydrogen 2.845 N/A HIS 119.A NE2 ALA 138.A O no hydrogen 2.800 N/A ARG 120.A N.B ASP 179.A OD1 no hydrogen 2.816 N/A ARG 120.A N.C ASP 179.A OD1 no hydrogen 2.824 N/A ARG 120.A NE.B ARG 120.A O.B no hydrogen 2.897 N/A ASP 121.A N HIS 119.A ND1 no hydrogen 2.935 N/A LYS 123.A N ASN 126.A OD1 no hydrogen 3.090 N/A LYS 123.A NZ ASP 121.A OD2 no hydrogen 2.922 N/A ASN 126.A N LYS 123.A O no hydrogen 2.920 N/A ASN 126.A ND2 ASP 121.A O no hydrogen 2.970 N/A LEU 127.A N PRO 124.A O no hydrogen 3.098 N/A LEU 128.A N LYS 136.A O no hydrogen 2.867 N/A ILE 129.A N GLN 79.A O no hydrogen 2.886 N/A ASN 130.A N ALA 134.A O no hydrogen 3.221 N/A GLU 132.A N ASN 130.A OD1 no hydrogen 2.978 N/A ALA 134.A N ASN 130.A OD1 no hydrogen 3.103 N/A ILE 135.A N GLN 104.A OE1 no hydrogen 3.157 N/A LYS 136.A N LEU 128.A O no hydrogen 2.775 N/A LYS 136.A NZ GLU 75.A OE1 no hydrogen 2.781 N/A LYS 136.A NZ GLU 75.A OE2 no hydrogen 3.457 N/A LEU 137.A N ASN 56.A O no hydrogen 2.854 N/A ALA 138.A N ASN 126.A O no hydrogen 2.803 N/A GLY 141.A N LEU 118.A O no hydrogen 3.175 N/A LEU 142.A N ASP 139.A O no hydrogen 3.471 N/A ALA 145.A N LEU 142.A O no hydrogen 2.657 N/A PHE 146.A N LEU 142.A O no hydrogen 2.989 N/A GLY 147.A N ALA 143.A O no hydrogen 2.893 N/A THR 152.A N GLU 156.A O no hydrogen 3.134 N/A THR 152.A OG1 THR 154.A OG1 no hydrogen 3.238 N/A THR 154.A N THR 152.A OG1 no hydrogen 3.213 N/A THR 154.A OG1 GLU 12.A OE1 no hydrogen 3.491 N/A THR 154.A OG1 THR 152.A OG1 no hydrogen 3.238 N/A HIS 155.A N THR 152.A O no hydrogen 2.882 N/A GLU 156.A N THR 152.A OG1 no hydrogen 2.912 N/A VAL 158.A N VAL 150.A O no hydrogen 3.043 N/A TRP 161.A N THR 159.A OG1 no hydrogen 3.296 N/A TYR 162.A OH GLU 189.A OE1 no hydrogen 2.624 N/A ARG 163.A N LEU 160.A O no hydrogen 3.083 N/A GLU 166.A N GLU 166.A OE1 no hydrogen 2.700 N/A ILE 167.A N ALA 164.A O no hydrogen 3.047 N/A LEU 168.A N ALA 164.A O no hydrogen 3.235 N/A LEU 169.A N PRO 165.A O no hydrogen 2.854 N/A GLY 170.A N ILE 167.A O no hydrogen 3.038 N/A CYS 171.A N GLU 166.A O no hydrogen 2.912 N/A CYS 171.A SG.A TYR 173.A OH no hydrogen 3.607 N/A CYS 171.A SG.B TYR 173.A O no hydrogen 3.347 N/A ALA 177.A N SER 175.A OG no hydrogen 3.209 N/A VAL 178.A N SER 175.A O no hydrogen 3.015 N/A ASP 179.A N THR 176.A O no hydrogen 3.049 N/A TRP 181.A N ALA 177.A O no hydrogen 3.089 N/A SER 182.A N VAL 178.A O no hydrogen 3.239 N/A SER 182.A OG TYR 162.A O no hydrogen 2.699 N/A SER 182.A OG VAL 178.A O no hydrogen 3.190 N/A LEU 183.A N ASP 179.A O no hydrogen 2.958 N/A GLY 184.A N ILE 180.A O no hydrogen 2.860 N/A CYS 185.A N TRP 181.A O no hydrogen 3.006 N/A CYS 185.A SG TRP 181.A O no hydrogen 3.553 N/A ILE 186.A N SER 182.A O no hydrogen 3.032 N/A PHE 187.A N LEU 183.A O no hydrogen 2.864 N/A ALA 188.A N GLY 184.A O no hydrogen 3.030 N/A GLU 189.A N CYS 185.A O no hydrogen 3.096 N/A MET 190.A N ILE 186.A O no hydrogen 2.931 N/A VAL 191.A N PHE 187.A O no hydrogen 3.343 N/A THR 192.A N ALA 188.A O no hydrogen 2.935 N/A THR 192.A OG1 ALA 188.A O no hydrogen 3.043 N/A ARG 193.A N GLU 189.A O no hydrogen 2.897 N/A ARG 193.A NH2 ALA 89.A O no hydrogen 3.270 N/A ARG 194.A N THR 192.A OG1 no hydrogen 3.322 N/A GLY 199.A N PHE 197.A O no hydrogen 2.900 N/A GLY 199.A N GLN 205.A OE1 no hydrogen 2.877 N/A ASP 200.A N ASP 204.A OD2 no hydrogen 3.187 N/A ASP 204.A N SER 201.A OG no hydrogen 3.103 N/A GLN 205.A N SER 201.A O no hydrogen 2.881 N/A GLN 205.A NE2 TRP 161.A O no hydrogen 3.291 N/A GLN 205.A NE2 PHE 197.A O no hydrogen 2.952 N/A LEU 206.A N.A GLU 202.A O no hydrogen 2.940 N/A LEU 206.A N.B GLU 202.A O no hydrogen 3.008 N/A PHE 207.A N ILE 203.A O no hydrogen 2.870 N/A ARG 208.A N ASP 204.A O no hydrogen 2.919 N/A ARG 208.A NE ASP 204.A OD2 no hydrogen 3.011 N/A ILE 209.A N GLN 205.A O no hydrogen 3.104 N/A PHE 210.A N LEU 206.A O.A no hydrogen 2.994 N/A PHE 210.A N LEU 206.A O.B no hydrogen 2.819 N/A ARG 211.A N PHE 207.A O no hydrogen 2.856 N/A THR 212.A N ARG 208.A O no hydrogen 3.360 N/A THR 212.A N ILE 209.A O no hydrogen 3.163 N/A THR 212.A OG1 ARG 208.A O no hydrogen 3.495 N/A LEU 213.A N ILE 209.A O no hydrogen 2.839 N/A THR 215.A N TRP 237.A O no hydrogen 2.956 N/A THR 215.A OG1 PRO 235.A O no hydrogen 2.707 N/A VAL 220.A N ASP 217.A OD1 no hydrogen 3.020 N/A TRP 221.A N ASP 217.A O no hydrogen 2.860 N/A GLY 223.A N GLU 218.A OE1 no hydrogen 2.693 N/A VAL 224.A N TRP 221.A O no hydrogen 2.969 N/A THR 225.A N GLU 218.A OE2 no hydrogen 2.999 N/A THR 225.A OG1 GLU 218.A OE2 no hydrogen 2.641 N/A SER 226.A N GLY 223.A O no hydrogen 3.095 N/A MET 227.A N.A VAL 224.A O no hydrogen 3.099 N/A MET 227.A N.B VAL 224.A O no hydrogen 3.078 N/A ASP 229.A N LEU 169.A O no hydrogen 2.824 N/A TYR 230.A N MET 227.A O.A no hydrogen 3.061 N/A TYR 230.A N MET 227.A O.B no hydrogen 3.340 N/A LYS 231.A NZ.B ASP 229.A O no hydrogen 2.927 N/A PHE 234.A N LYS 231.A O no hydrogen 2.978 N/A LYS 236.A NZ PRO 232.A O no hydrogen 3.198 N/A LYS 236.A NZ PHE 234.A O no hydrogen 3.163 N/A TRP 237.A N THR 215.A OG1 no hydrogen 2.933 N/A ARG 239.A NH1 LEU 213.A O no hydrogen 2.965 N/A GLN 240.A N THR 212.A O no hydrogen 2.835 N/A LYS 244.A N ASP 241.A O no hydrogen 2.930 N/A VAL 245.A N PHE 242.A O no hydrogen 3.032 N/A VAL 246.A N PHE 242.A O no hydrogen 3.004 N/A LEU 249.A N VAL 246.A O no hydrogen 2.951 N/A GLY 253.A N ASP 250.A OD1 no hydrogen 2.911 N/A ARG 254.A N ASP 250.A O no hydrogen 2.837 N/A ARG 254.A NH1 LEU 249.A O no hydrogen 2.900 N/A ARG 254.A NH2 GLU 251.A OE1.A no hydrogen 2.710 N/A SER 255.A N GLU 251.A O no hydrogen 3.017 N/A LEU 256.A N ASP 252.A O no hydrogen 2.996 N/A LEU 257.A N GLY 253.A O no hydrogen 2.872 N/A SER 258.A N ARG 254.A O no hydrogen 2.933 N/A SER 258.A OG.B SER 255.A O no hydrogen 2.730 N/A GLN 259.A N SER 255.A O no hydrogen 3.164 N/A MET 260.A N LEU 256.A O no hydrogen 3.008 N/A LEU 261.A N LEU 257.A O no hydrogen 3.022 N/A LEU 261.A N SER 258.A O no hydrogen 3.386 N/A TYR 263.A OH GLY 214.A O no hydrogen 2.575 N/A ASN 266.A N ASP 264.A OD1 no hydrogen 3.005 N/A ASN 266.A ND2 ASP 264.A OD1 no hydrogen 2.880 N/A LYS 267.A N ASP 264.A O no hydrogen 2.836 N/A LYS 267.A NZ VAL 220.A O no hydrogen 3.298 N/A LYS 267.A NZ ASP 264.A OD2 no hydrogen 2.800 N/A ARG 268.A N ASP 264.A O no hydrogen 3.294 N/A ARG 268.A N PRO 265.A O no hydrogen 3.274 N/A ARG 268.A NE HIS 262.A O no hydrogen 2.891 N/A ARG 268.A NH1 GLU 166.A OE1 no hydrogen 3.467 N/A ARG 268.A NH1 GLU 166.A OE2 no hydrogen 2.887 N/A ARG 268.A NH1 ALA 177.A O no hydrogen 2.939 N/A ARG 268.A NH2 GLU 166.A OE1 no hydrogen 2.848 N/A ARG 268.A NH2 HIS 262.A O no hydrogen 3.325 N/A ARG 268.A NH2 TYR 263.A O no hydrogen 2.887 N/A ILE 269.A N GLN 259.A O no hydrogen 3.000 N/A ALA 273.A N SER 270.A OG no hydrogen 2.980 N/A ALA 274.A N SER 270.A O no hydrogen 2.870 N/A LEU 275.A N ALA 271.A O no hydrogen 3.116 N/A LEU 275.A N LYS 272.A O.B no hydrogen 3.254 N/A ALA 276.A N ALA 273.A O no hydrogen 3.023 N/A HIS 277.A N ALA 274.A O no hydrogen 3.021 N/A PHE 279.A N HIS 277.A ND1 no hydrogen 2.972 N/A PHE 280.A N HIS 277.A O no hydrogen 2.991 N/A GLN 281.A N.A PRO 278.A O no hydrogen 3.085 N/A GLN 281.A N.B PRO 278.A O no hydrogen 3.062 N/A VAL 283.A N PHE 280.A O no hydrogen 3.109 N/A