Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pgu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N SER 1.A OG no hydrogen 2.949 N/A ALA 5.A N ASP 85.A OD2 no hydrogen 2.890 N/A LYS 6.A NZ GLU 35.A OE1 no hydrogen 3.275 N/A LYS 6.A NZ GLU 35.A OE2 no hydrogen 3.131 N/A ARG 7.A N SER 4.A O no hydrogen 3.300 N/A ARG 7.A N SER 4.A OG no hydrogen 3.127 N/A LEU 8.A N ALA 5.A O no hydrogen 2.970 N/A ARG 12.A N ASP 267.A OD1 no hydrogen 2.783 N/A LEU 13.A N ASP 267.A OD2 no hydrogen 3.035 N/A GLY 14.A N THR 11.A OG1 no hydrogen 2.950 N/A THR 15.A N THR 11.A O no hydrogen 2.927 N/A THR 15.A OG1 THR 11.A O no hydrogen 2.874 N/A PHE 16.A N ARG 12.A O no hydrogen 2.913 N/A LEU 17.A N LEU 13.A O no hydrogen 2.996 N/A GLU 18.A N GLY 14.A O no hydrogen 2.905 N/A ASN 19.A N THR 15.A O no hydrogen 2.840 N/A ARG 20.A N PHE 16.A O no hydrogen 3.133 N/A ARG 20.A NE GLU 131.A OE1 no hydrogen 2.815 N/A ARG 20.A NH1 GLU 138.A OE1 no hydrogen 2.851 N/A ARG 20.A NH2 GLU 131.A OE1 no hydrogen 2.863 N/A ARG 20.A NH2 GLU 192.A OE1 no hydrogen 2.796 N/A VAL 21.A N LEU 17.A O no hydrogen 2.985 N/A ASN 22.A N GLU 18.A O no hydrogen 2.813 N/A ASN 22.A ND2 VAL 36.A O no hydrogen 2.772 N/A ASP 23.A N ASN 19.A O no hydrogen 2.915 N/A PHE 24.A N ARG 20.A O no hydrogen 3.031 N/A LEU 25.A N VAL 21.A O no hydrogen 2.893 N/A ARG 26.A N ASN 22.A O no hydrogen 2.809 N/A ARG 27.A N ASP 23.A O no hydrogen 2.964 N/A GLN 28.A N PHE 24.A O no hydrogen 3.034 N/A ASN 29.A N LEU 25.A O no hydrogen 2.912 N/A GLU 32.A N HIS 30.A ND1 no hydrogen 3.106 N/A SER 33.A N HIS 30.A O no hydrogen 3.210 N/A SER 33.A OG HIS 30.A O no hydrogen 3.492 N/A GLY 34.A N GLU 79.A OE2 no hydrogen 2.989 N/A VAL 36.A N ASN 22.A OD1 no hydrogen 2.914 N/A THR 37.A N.A PHE 78.A O no hydrogen 2.901 N/A THR 37.A N.B PHE 78.A O no hydrogen 2.927 N/A VAL 38.A N GLU 18.A OE1 no hydrogen 2.907 N/A ARG 39.A N PHE 76.A O no hydrogen 2.947 N/A ARG 39.A NE LEU 8.A O no hydrogen 2.882 N/A ARG 39.A NH1 GLU 18.A OE1 no hydrogen 2.762 N/A ARG 39.A NH1 VAL 38.A O no hydrogen 2.924 N/A ARG 39.A NH2 LYS 6.A O no hydrogen 2.977 N/A VAL 41.A N ALA 74.A O no hydrogen 2.934 N/A HIS 42.A ND1 CYS 272.A O no hydrogen 2.910 N/A HIS 42.A NE2 SER 44.A OG no hydrogen 2.705 N/A ALA 43.A N ILE 270.A O no hydrogen 2.977 N/A SER 44.A N THR 72.A O no hydrogen 3.021 N/A SER 44.A OG HIS 42.A NE2 no hydrogen 2.705 N/A LYS 46.A N TYR 70.A O no hydrogen 2.836 N/A LYS 46.A NZ ASP 276.A OD1 no hydrogen 2.782 N/A LYS 46.A NZ ASP 276.A OD2 no hydrogen 3.066 N/A VAL 48.A N PHE 68.A O no hydrogen 2.862 N/A VAL 50.A N GLU 66.A O no hydrogen 3.006 N/A LYS 51.A N TYR 218.A OH no hydrogen 2.873 N/A GLY 53.A N GLU 229.A OE1 no hydrogen 2.842 N/A MET 54.A N GLU 229.A OE2 no hydrogen 2.993 N/A LYS 55.A N LYS 51.A O no hydrogen 2.754 N/A LYS 55.A NZ ASP 60.A OD1 no hydrogen 2.847 N/A ALA 56.A N PRO 52.A O no hydrogen 2.823 N/A ARG 57.A N GLY 53.A O no hydrogen 3.072 N/A ARG 57.A NH2 ARG 57.A O no hydrogen 3.145 N/A ARG 57.A NH2 GLU 63.A OE2 no hydrogen 3.390 N/A PHE 58.A N MET 54.A O no hydrogen 2.912 N/A ASP 60.A N LYS 55.A O no hydrogen 2.934 N/A SER 61.A OG ARG 57.A O no hydrogen 3.130 N/A SER 61.A OG PHE 58.A O no hydrogen 3.189 N/A SER 61.A OG GLU 63.A OE2 no hydrogen 2.925 N/A GLY 62.A N VAL 59.A O no hydrogen 3.072 N/A GLU 63.A N PHE 58.A O no hydrogen 2.808 N/A PHE 68.A N VAL 48.A O no hydrogen 2.939 N/A TYR 70.A N LYS 46.A O no hydrogen 2.964 N/A ARG 71.A N GLU 95.A O no hydrogen 2.906 N/A ARG 71.A NE ASP 45.A OD1 no hydrogen 2.854 N/A ARG 71.A NH2 ASP 45.A OD2 no hydrogen 3.111 N/A THR 72.A N SER 44.A O no hydrogen 2.856 N/A THR 72.A OG1 VAL 93.A O no hydrogen 3.216 N/A LYS 73.A N VAL 93.A O no hydrogen 3.065 N/A LYS 73.A NZ GLU 95.A OE1 no hydrogen 3.451 N/A LYS 73.A NZ ASP 265.A OD2 no hydrogen 2.755 N/A ALA 74.A N HIS 42.A O no hydrogen 3.031 N/A LEU 75.A N MET 91.A O no hydrogen 2.921 N/A PHE 76.A N ARG 39.A O no hydrogen 2.961 N/A ALA 77.A N PHE 89.A O no hydrogen 2.873 N/A PHE 78.A N THR 37.A O.A no hydrogen 2.839 N/A PHE 78.A N THR 37.A O.B no hydrogen 2.830 N/A GLU 79.A N LEU 86.A O no hydrogen 2.897 N/A GLU 80.A N GLU 35.A O no hydrogen 2.996 N/A ILE 81.A N VAL 84.A O no hydrogen 2.824 N/A VAL 84.A N ILE 81.A O no hydrogen 3.134 N/A LEU 86.A N GLU 79.A O no hydrogen 2.961 N/A CYS 87.A N THR 302.A OG1 no hydrogen 2.895 N/A CYS 87.A SG ALA 77.A O no hydrogen 3.776 N/A PHE 88.A N ALA 77.A O no hydrogen 3.025 N/A GLY 90.A N ASP 114.A O no hydrogen 2.989 N/A MET 91.A N LEU 75.A O no hydrogen 2.944 N/A HIS 92.A N TYR 112.A O no hydrogen 2.936 N/A VAL 93.A N LYS 73.A O no hydrogen 3.006 N/A GLN 94.A N TYR 109.A O no hydrogen 2.858 N/A GLN 94.A NE2 SER 111.A OG no hydrogen 3.082 N/A GLN 94.A NE2 GLU 220.A O no hydrogen 2.937 N/A GLU 95.A N ARG 71.A O no hydrogen 2.819 N/A TYR 96.A N ARG 107.A O no hydrogen 2.897 N/A TYR 96.A OH GLN 94.A OE1 no hydrogen 2.604 N/A CYS 100.A N GLY 97.A O no hydrogen 3.193 N/A CYS 100.A SG PRO 69.A O no hydrogen 3.592 N/A CYS 100.A SG PRO 101.A O no hydrogen 3.684 N/A ASN 104.A N PRO 101.A O no hydrogen 3.118 N/A ASN 104.A ND2 TYR 218.A O no hydrogen 2.818 N/A GLN 105.A NE2 CYS 100.A O no hydrogen 2.802 N/A ARG 106.A N GLY 97.A O no hydrogen 3.221 N/A ARG 106.A NH1 GLY 144.A O no hydrogen 2.979 N/A ARG 106.A NH1 PRO 261.A O no hydrogen 3.456 N/A ARG 106.A NH2 PRO 261.A O no hydrogen 2.896 N/A ARG 107.A N TYR 96.A O no hydrogen 3.014 N/A ARG 107.A NE PRO 103.A O no hydrogen 2.791 N/A ARG 107.A NH1 HIS 149.A NE2 no hydrogen 2.993 N/A ARG 107.A NH2 PRO 103.A O no hydrogen 3.523 N/A VAL 108.A N THR 147.A O no hydrogen 2.984 N/A TYR 109.A N GLN 94.A O no hydrogen 2.876 N/A ILE 110.A N HIS 149.A O no hydrogen 3.022 N/A SER 111.A N HIS 92.A O no hydrogen 2.920 N/A TYR 112.A N HIS 92.A O no hydrogen 3.404 N/A ASP 114.A N GLY 90.A O no hydrogen 2.986 N/A SER 115.A N ASP 114.A OD1 no hydrogen 2.916 N/A VAL 116.A N PHE 88.A O no hydrogen 2.986 N/A HIS 117.A N GLN 170.A OE1 no hydrogen 2.749 N/A PHE 118.A N VAL 116.A O no hydrogen 2.801 N/A ARG 120.A N GLU 79.A OE1 no hydrogen 2.963 N/A ARG 120.A NH1 ASP 82.A OD2 no hydrogen 3.475 N/A LEU 124.A N PRO 121.A O no hydrogen 3.022 N/A ARG 125.A N LYS 122.A O no hydrogen 3.125 N/A VAL 128.A N LEU 124.A O no hydrogen 2.909 N/A TYR 129.A N ARG 125.A O no hydrogen 3.030 N/A HIS 130.A N THR 126.A O no hydrogen 2.919 N/A GLU 131.A N ALA 127.A O no hydrogen 2.904 N/A ILE 132.A N VAL 128.A O no hydrogen 2.987 N/A LEU 133.A N TYR 129.A O no hydrogen 3.136 N/A ILE 134.A N HIS 130.A O no hydrogen 2.826 N/A GLY 135.A N GLU 131.A O no hydrogen 2.926 N/A TYR 136.A N ILE 132.A O no hydrogen 2.952 N/A TYR 136.A OH GLU 95.A OE2 no hydrogen 2.608 N/A LEU 137.A N LEU 133.A O no hydrogen 3.039 N/A GLU 138.A N ILE 134.A O no hydrogen 2.779 N/A TYR 139.A N GLY 135.A O no hydrogen 2.844 N/A VAL 140.A N TYR 136.A O no hydrogen 2.992 N/A LYS 141.A N LEU 137.A O no hydrogen 2.965 N/A LYS 141.A NZ ILE 194.A O no hydrogen 2.843 N/A LYS 141.A NZ LEU 251.A O no hydrogen 3.569 N/A LYS 142.A N GLU 138.A O no hydrogen 2.999 N/A LEU 143.A N TYR 139.A O no hydrogen 3.091 N/A GLY 144.A N VAL 140.A O no hydrogen 3.019 N/A GLY 144.A N LYS 141.A O no hydrogen 3.040 N/A TYR 145.A N VAL 140.A O no hydrogen 3.018 N/A THR 146.A N ARG 106.A O no hydrogen 2.890 N/A THR 146.A OG1 ARG 106.A O no hydrogen 3.248 N/A THR 146.A OG1 THR 147.A OG1 no hydrogen 2.896 N/A THR 147.A OG1 THR 146.A OG1 no hydrogen 2.896 N/A GLY 148.A N ILE 249.A O no hydrogen 2.855 N/A HIS 149.A N VAL 108.A O no hydrogen 2.800 N/A ILE 150.A N PHE 247.A O no hydrogen 3.156 N/A ALA 152.A N VAL 245.A O no hydrogen 2.754 N/A CYS 153.A SG PRO 154.A O no hydrogen 3.507 N/A ASP 159.A N SER 156.A O no hydrogen 3.033 N/A TYR 161.A OH CYS 153.A O no hydrogen 2.542 N/A ILE 162.A N ASP 114.A OD2 no hydrogen 2.831 N/A PHE 163.A N ASP 114.A OD2 no hydrogen 2.932 N/A CYS 165.A N.A ASP 160.A OD2 no hydrogen 2.885 N/A CYS 165.A N.B ASP 160.A OD2 no hydrogen 2.929 N/A HIS 166.A ND1 ASP 160.A OD1 no hydrogen 2.830 N/A HIS 166.A NE2 ASP 114.A OD1 no hydrogen 2.775 N/A GLN 170.A N PRO 167.A O no hydrogen 3.090 N/A GLN 170.A NE2 SER 115.A O no hydrogen 3.134 N/A LYS 176.A NZ GLU 180.A OE2.A no hydrogen 2.813 N/A LEU 178.A N LYS 174.A O no hydrogen 2.989 N/A GLN 179.A N PRO 175.A O no hydrogen 2.967 N/A GLU 180.A N.A LYS 176.A O no hydrogen 3.073 N/A GLU 180.A N.B LYS 176.A O no hydrogen 3.057 N/A TRP 181.A N ARG 177.A O no hydrogen 2.913 N/A PHE 182.A N LEU 178.A O no hydrogen 2.914 N/A LYS 183.A N GLN 179.A O no hydrogen 2.956 N/A LYS 184.A N GLU 180.A O.A no hydrogen 2.799 N/A LYS 184.A N GLU 180.A O.B no hydrogen 2.992 N/A MET 185.A N TRP 181.A O no hydrogen 3.147 N/A LEU 186.A N PHE 182.A O no hydrogen 2.850 N/A ASP 187.A N LYS 183.A O no hydrogen 2.768 N/A LYS 188.A N LYS 184.A O no hydrogen 3.131 N/A LYS 188.A NZ GLU 131.A OE2 no hydrogen 2.561 N/A LYS 188.A NZ GLU 192.A OE2 no hydrogen 2.583 N/A ALA 189.A N MET 185.A O no hydrogen 3.076 N/A VAL 190.A N LEU 186.A O no hydrogen 2.743 N/A SER 191.A N.A ASP 187.A O no hydrogen 2.971 N/A SER 191.A N.B ASP 187.A O no hydrogen 2.979 N/A SER 191.A N.B LYS 188.A O no hydrogen 3.093 N/A SER 191.A OG.B LYS 188.A O no hydrogen 2.719 N/A GLU 192.A N LYS 188.A O no hydrogen 3.018 N/A ARG 193.A N VAL 190.A O no hydrogen 3.004 N/A ILE 194.A N ALA 189.A O no hydrogen 2.906 N/A VAL 195.A N ALA 189.A O no hydrogen 3.231 N/A HIS 196.A N ARG 250.A O no hydrogen 2.906 N/A TYR 198.A OH ASP 187.A OD1 no hydrogen 2.579 N/A LYS 199.A N VAL 248.A O no hydrogen 2.948 N/A LYS 199.A NZ GLU 207.A OE2 no hydrogen 3.061 N/A ILE 201.A N PHE 246.A O no hydrogen 2.992 N/A LYS 203.A N ASP 200.A OD1 no hydrogen 2.685 N/A GLN 204.A N ASP 200.A O no hydrogen 2.966 N/A GLN 204.A NE2 ASP 208.A OD1 no hydrogen 3.302 N/A GLN 204.A NE2 ASP 208.A OD2 no hydrogen 3.045 N/A ALA 205.A N ILE 201.A O no hydrogen 3.064 N/A THR 206.A N PHE 202.A O no hydrogen 3.081 N/A THR 206.A OG1 PHE 202.A O no hydrogen 2.691 N/A GLU 207.A N LYS 203.A O no hydrogen 3.022 N/A ASP 208.A N GLN 204.A O no hydrogen 2.855 N/A ARG 209.A N THR 206.A O no hydrogen 2.985 N/A LEU 210.A N ALA 205.A O no hydrogen 2.932 N/A THR 211.A N GLU 215.A OE1 no hydrogen 2.892 N/A THR 211.A OG1 GLU 215.A OE1 no hydrogen 3.531 N/A SER 212.A N GLU 215.A OE1 no hydrogen 3.005 N/A LYS 214.A NZ GLU 63.A OE1 no hydrogen 2.993 N/A GLU 215.A N SER 212.A O no hydrogen 3.024 N/A LEU 216.A N ALA 213.A O no hydrogen 3.208 N/A TYR 218.A N ASN 104.A OD1 no hydrogen 2.781 N/A GLU 220.A N GLN 94.A OE1 no hydrogen 3.258 N/A ASP 222.A N PHE 219.A O no hydrogen 3.402 N/A ASN 226.A N PHE 223.A O no hydrogen 3.126 N/A VAL 227.A N PHE 223.A O no hydrogen 3.102 N/A LEU 228.A N TRP 224.A O no hydrogen 2.890 N/A GLU 229.A N PRO 225.A O no hydrogen 3.255 N/A GLU 230.A N ASN 226.A O no hydrogen 3.226 N/A SER 231.A N VAL 227.A O no hydrogen 2.986 N/A ILE 232.A N LEU 228.A O no hydrogen 3.294 N/A TYR 236.A OH ALA 205.A O no hydrogen 3.143 N/A TYR 236.A OH LEU 210.A O no hydrogen 2.718 N/A ALA 237.A N GLN 233.A O no hydrogen 3.195 N/A THR 238.A N LYS 234.A O no hydrogen 3.145 N/A THR 238.A OG1 LYS 234.A O no hydrogen 3.030 N/A MET 239.A N LEU 235.A O no hydrogen 2.903 N/A GLU 240.A N TYR 236.A O no hydrogen 2.978 N/A LYS 241.A N ALA 237.A O no hydrogen 3.081 N/A HIS 242.A N THR 238.A O no hydrogen 3.226 N/A LYS 243.A N GLU 240.A O no hydrogen 3.317 N/A VAL 245.A N HIS 242.A O no hydrogen 3.299 N/A PHE 246.A N LYS 243.A O no hydrogen 3.197 N/A PHE 247.A N ILE 150.A O no hydrogen 2.833 N/A VAL 248.A N LYS 199.A O no hydrogen 2.745 N/A ILE 249.A N GLY 148.A O no hydrogen 2.803 N/A ARG 250.A N ASP 197.A O no hydrogen 2.875 N/A ARG 250.A NE ASP 197.A OD1 no hydrogen 2.959 N/A ARG 250.A NH2 ASP 197.A OD1 no hydrogen 3.379 N/A ARG 250.A NH2 ASP 197.A OD2 no hydrogen 2.751 N/A LEU 251.A N THR 146.A O no hydrogen 2.771 N/A ILE 252.A N THR 146.A O no hydrogen 3.385 N/A ALA 257.A N GLY 254.A O no hydrogen 3.159 N/A ASN 258.A N PRO 255.A O no hydrogen 3.006 N/A ASN 258.A ND2 PRO 255.A O no hydrogen 3.530 N/A ILE 263.A N SER 98.A OG no hydrogen 2.986 N/A ASP 267.A N ASP 265.A OD1 no hydrogen 2.890 N/A ILE 270.A N ALA 43.A O no hydrogen 2.903 N/A CYS 272.A SG GLN 312.A OE1 no hydrogen 3.520 N/A MET 275.A N CYS 272.A O no hydrogen 2.990 N/A ASP 276.A N ASP 273.A O no hydrogen 3.341 N/A ARG 278.A NH1 ASP 160.A O no hydrogen 3.423 N/A ARG 278.A NH1 TYR 161.A O no hydrogen 2.832 N/A LEU 282.A N ARG 278.A O no hydrogen 3.425 N/A THR 283.A N ASP 279.A O no hydrogen 2.914 N/A THR 283.A OG1 ASP 279.A O no hydrogen 2.944 N/A LEU 284.A N ALA 280.A O no hydrogen 2.948 N/A ALA 285.A N PHE 281.A O no hydrogen 2.816 N/A ARG 286.A N LEU 282.A O no hydrogen 2.857 N/A ASP 287.A N THR 283.A O no hydrogen 2.951 N/A LYS 288.A N LEU 284.A O no hydrogen 2.886 N/A LEU 290.A N ALA 285.A O no hydrogen 2.935 N/A PHE 292.A N HIS 164.A O no hydrogen 2.987 N/A PHE 292.A N CYS 165.A O.A no hydrogen 2.977 N/A PHE 292.A N CYS 165.A O.B no hydrogen 2.891 N/A ARG 297.A N SER 294.A OG no hydrogen 3.123 N/A ALA 298.A N SER 294.A O no hydrogen 2.969 N/A GLN 299.A N LEU 295.A O no hydrogen 2.912 N/A TRP 300.A N ARG 296.A O no hydrogen 3.063 N/A SER 301.A N ARG 297.A O no hydrogen 2.771 N/A SER 301.A OG GLU 291.A O no hydrogen 2.660 N/A SER 301.A OG ARG 297.A O no hydrogen 2.991 N/A THR 302.A N ALA 298.A O no hydrogen 2.774 N/A THR 302.A OG1 ALA 298.A O no hydrogen 2.688 N/A MET 303.A N GLN 299.A O no hydrogen 2.926 N/A CYS 304.A N TRP 300.A O no hydrogen 2.942 N/A CYS 304.A SG TRP 300.A O no hydrogen 3.394 N/A MET 305.A N SER 301.A O no hydrogen 2.851 N/A LEU 306.A N THR 302.A O no hydrogen 2.807 N/A VAL 307.A N MET 303.A O no hydrogen 2.965 N/A GLU 308.A N CYS 304.A O no hydrogen 3.017 N/A LEU 309.A N MET 305.A O no hydrogen 2.926 N/A HIS 310.A N LEU 306.A O no hydrogen 2.776 N/A HIS 310.A NE2 SER 4.A O no hydrogen 2.877 N/A THR 311.A N VAL 307.A O no hydrogen 2.871 N/A THR 311.A OG1 VAL 307.A O no hydrogen 2.641 N/A GLN 312.A NE2 PRO 271.A O no hydrogen 3.162 N/A