Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d52_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG THR 2.A O no hydrogen 3.447 N/A SER 1.A OG TYR 285.A O no hydrogen 2.714 N/A THR 2.A OG1 ALA 310.A OXT no hydrogen 2.677 N/A ALA 5.A N THR 2.A OG1 no hydrogen 3.016 N/A GLN 6.A N THR 2.A O no hydrogen 2.968 N/A GLN 7.A N GLY 4.A O no hydrogen 3.034 N/A GLN 7.A NE2.B PRO 3.A O no hydrogen 2.705 N/A VAL 8.A N ALA 5.A O no hydrogen 3.013 N/A LEU 9.A N GLN 28.A O no hydrogen 2.981 N/A ARG 11.A N GLN 281.A OE1 no hydrogen 2.761 N/A ARG 11.A NE GLN 259.A O no hydrogen 2.725 N/A ARG 11.A NH2 GLN 259.A O no hydrogen 2.971 N/A THR 12.A N LEU 9.A O no hydrogen 2.988 N/A THR 12.A OG1 GLY 13.A O no hydrogen 2.689 N/A THR 12.A OG1 GLN 28.A O no hydrogen 3.427 N/A ALA 15.A N TYR 26.A O no hydrogen 3.015 N/A VAL 17.A N ARG 24.A O no hydrogen 2.926 N/A ASN 18.A ND2 THR 20.A O no hydrogen 2.960 N/A ASN 18.A ND2 SER 267.A O no hydrogen 3.200 N/A SER 19.A N HIS 22.A O no hydrogen 3.008 N/A SER 19.A OG GLU 67.A OE1 no hydrogen 2.567 N/A THR 20.A OG1 SER 19.A O no hydrogen 3.084 N/A HIS 22.A N SER 19.A O no hydrogen 2.853 N/A HIS 22.A ND1 GLU 40.A OE1 no hydrogen 2.777 N/A LEU 23.A N TYR 39.A O no hydrogen 3.018 N/A ARG 24.A N VAL 17.A O no hydrogen 2.966 N/A ARG 24.A NH1 LEU 23.A O no hydrogen 2.858 N/A ARG 24.A NH1 GLU 40.A OE2 no hydrogen 2.782 N/A ARG 24.A NH2 GLU 40.A OE2 no hydrogen 2.903 N/A VAL 25.A N SER 37.A O no hydrogen 2.916 N/A TYR 26.A N ALA 15.A O no hydrogen 2.733 N/A TYR 26.A OH GLU 36.A OE2 no hydrogen 2.757 N/A PHE 27.A N ARG 35.A O no hydrogen 3.185 N/A GLN 28.A N THR 12.A OG1 no hydrogen 2.749 N/A GLN 28.A NE2 GLY 32.A O no hydrogen 2.991 N/A GLN 28.A NE2 LYS 56.A O no hydrogen 3.027 N/A ASP 29.A N SER 33.A O no hydrogen 2.834 N/A VAL 30.A N GLN 7.A O no hydrogen 2.901 N/A TYR 31.A N ASP 29.A OD1 no hydrogen 2.828 N/A GLY 32.A N ASP 29.A O no hydrogen 2.968 N/A SER 33.A N ASP 29.A OD1 no hydrogen 3.066 N/A ILE 34.A N GLY 53.A O no hydrogen 2.785 N/A ARG 35.A N PHE 27.A O no hydrogen 2.895 N/A ARG 35.A NE ASP 29.A OD2 no hydrogen 2.757 N/A ARG 35.A NH1 GLN 7.A OE1.A no hydrogen 2.885 N/A ARG 35.A NH1 GLY 46.A O no hydrogen 2.958 N/A ARG 35.A NH2 ASP 29.A OD2 no hydrogen 3.086 N/A GLU 36.A N ASN 50.A O no hydrogen 3.047 N/A SER 37.A N VAL 25.A O no hydrogen 2.851 N/A SER 37.A OG PRO 308.A O no hydrogen 2.682 N/A LEU 38.A N ALA 44.A O no hydrogen 2.925 N/A TYR 39.A N LEU 23.A O no hydrogen 2.898 N/A GLU 40.A N SER 42.A O no hydrogen 2.995 N/A ALA 44.A N LEU 38.A O no hydrogen 2.830 N/A GLY 46.A N GLU 36.A O no hydrogen 2.847 N/A THR 47.A N ASN 50.A OD1 no hydrogen 2.916 N/A THR 47.A OG1 ASN 50.A OD1 no hydrogen 2.989 N/A LYS 49.A N THR 47.A OG1 no hydrogen 3.111 N/A ASN 50.A N THR 47.A O no hydrogen 2.879 N/A ILE 52.A N ILE 34.A O no hydrogen 2.793 N/A ALA 55.A N GLY 32.A O no hydrogen 3.040 N/A LYS 56.A N LEU 76.A O no hydrogen 3.029 N/A LYS 56.A NZ ASN 80.A OD1 no hydrogen 2.700 N/A LYS 56.A NZ PRO 107.A O no hydrogen 2.923 N/A GLY 58.A N GLN 28.A OE1 no hydrogen 2.900 N/A SER 59.A N LYS 56.A O no hydrogen 2.972 N/A SER 59.A OG PRO 60.A O no hydrogen 2.725 N/A ALA 62.A N TYR 74.A O no hydrogen 2.978 N/A THR 64.A N ARG 72.A O no hydrogen 3.067 N/A SER 65.A OG GLU 67.A O no hydrogen 2.564 N/A LYS 66.A N HIS 70.A O no hydrogen 2.863 N/A LYS 66.A NZ THR 118.A O no hydrogen 2.833 N/A LYS 69.A N LYS 66.A O no hydrogen 3.036 N/A HIS 70.A N LYS 66.A O no hydrogen 3.283 N/A HIS 70.A ND1 ASP 88.A OD1 no hydrogen 2.869 N/A ILE 71.A N TYR 87.A O no hydrogen 2.911 N/A ARG 72.A N THR 64.A O no hydrogen 2.975 N/A ARG 72.A NH1 ILE 71.A O no hydrogen 2.885 N/A ARG 72.A NH1 TYR 87.A O no hydrogen 3.010 N/A ARG 72.A NH1 ASP 88.A OD1 no hydrogen 2.990 N/A ARG 72.A NH2 ASP 88.A OD1 no hydrogen 2.830 N/A VAL 73.A N PHE 85.A O no hydrogen 2.869 N/A TYR 74.A N ALA 62.A O no hydrogen 2.727 N/A TYR 74.A OH GLU 84.A OE2 no hydrogen 2.753 N/A THR 75.A N GLN 83.A O no hydrogen 3.269 N/A LEU 76.A N SER 59.A OG no hydrogen 2.892 N/A THR 77.A N THR 81.A O no hydrogen 2.978 N/A THR 77.A OG1 THR 81.A O no hydrogen 3.338 N/A THR 77.A OG1 THR 81.A OG1 no hydrogen 2.854 N/A ASN 80.A N THR 77.A O no hydrogen 2.997 N/A THR 81.A N THR 77.A OG1 no hydrogen 3.090 N/A THR 81.A OG1 THR 77.A OG1 no hydrogen 2.854 N/A LEU 82.A N PHE 103.A O no hydrogen 3.027 N/A GLN 83.A N THR 75.A O no hydrogen 2.931 N/A GLN 83.A NE2 ASN 54.A O no hydrogen 2.901 N/A GLN 83.A NE2 THR 75.A OG1 no hydrogen 2.929 N/A PHE 85.A N VAL 73.A O no hydrogen 2.863 N/A ALA 86.A N TYR 94.A O no hydrogen 2.827 N/A TYR 87.A N ILE 71.A O no hydrogen 2.839 N/A ASP 88.A N GLY 92.A O no hydrogen 3.317 N/A SER 89.A N LYS 69.A O no hydrogen 2.888 N/A SER 89.A OG LYS 69.A O no hydrogen 3.491 N/A THR 91.A N ASP 88.A O no hydrogen 2.928 N/A GLY 92.A N ASP 88.A O no hydrogen 2.982 N/A TYR 94.A N ALA 86.A O no hydrogen 2.795 N/A TYR 94.A OH ASP 88.A OD2 no hydrogen 2.510 N/A GLY 96.A N GLU 84.A O no hydrogen 2.755 N/A LEU 98.A N GLU 84.A OE1 no hydrogen 3.320 N/A GLY 100.A N GLY 97.A O no hydrogen 3.202 N/A ALA 101.A N LEU 98.A O no hydrogen 3.006 N/A LYS 102.A N GLY 99.A O no hydrogen 2.902 N/A VAL 105.A N ASN 80.A O no hydrogen 2.894 N/A ALA 106.A N GLN 128.A O no hydrogen 2.868 N/A TYR 108.A OH ASN 132.A OD1 no hydrogen 2.603 N/A SER 109.A N ALA 106.A O no hydrogen 2.994 N/A SER 109.A OG GLN 128.A O no hydrogen 3.444 N/A ALA 111.A N TYR 126.A O no hydrogen 2.978 N/A VAL 113.A N ARG 124.A O no hydrogen 2.920 N/A PHE 114.A N THR 64.A OG1 no hydrogen 3.102 N/A LEU 115.A N GLN 122.A O no hydrogen 2.880 N/A ALA 116.A N SER 163.A OG no hydrogen 2.982 N/A ALA 120.A N THR 118.A OG1 no hydrogen 3.126 N/A LEU 123.A N TRP 139.A O no hydrogen 2.941 N/A ARG 124.A N VAL 113.A O no hydrogen 2.934 N/A ARG 124.A NH1 LEU 123.A O no hydrogen 2.894 N/A ARG 124.A NH1 TRP 139.A O no hydrogen 3.230 N/A ARG 124.A NH1 ASN 140.A OD1 no hydrogen 2.903 N/A ARG 124.A NH2 ASN 140.A OD1 no hydrogen 2.847 N/A ILE 125.A N TYR 137.A O no hydrogen 2.815 N/A TYR 126.A N ALA 111.A O no hydrogen 2.796 N/A TYR 126.A OH GLU 136.A OE2 no hydrogen 2.631 N/A ALA 127.A N GLN 135.A O no hydrogen 3.053 N/A GLN 128.A N SER 109.A OG no hydrogen 2.791 N/A GLN 128.A NE2 ASN 132.A O no hydrogen 2.932 N/A GLN 128.A NE2 LEU 154.A O no hydrogen 3.022 N/A LYS 129.A N THR 133.A O no hydrogen 2.928 N/A LYS 129.A NZ GLN 135.A OE1 no hydrogen 3.547 N/A LYS 129.A NZ GLU 146.A OE1 no hydrogen 3.556 N/A LYS 129.A NZ GLU 146.A OE2 no hydrogen 2.522 N/A ASN 132.A N LYS 129.A O no hydrogen 2.836 N/A THR 133.A N ASP 131.A OD1 no hydrogen 2.988 N/A THR 133.A OG1 ASP 131.A OD1 no hydrogen 2.720 N/A ILE 134.A N GLY 151.A O no hydrogen 2.846 N/A GLN 135.A N ALA 127.A O no hydrogen 2.839 N/A GLN 135.A NE2 GLU 136.A O no hydrogen 3.017 N/A GLN 135.A NE2 GLY 147.A O no hydrogen 3.092 N/A GLU 136.A N THR 148.A O no hydrogen 3.028 N/A TYR 137.A N ILE 125.A O no hydrogen 2.696 N/A MET 138.A N LYS 145.A O no hydrogen 2.860 N/A TRP 139.A N LEU 123.A O no hydrogen 2.994 N/A LYS 145.A N MET 138.A O no hydrogen 3.123 N/A GLY 147.A N GLU 136.A O no hydrogen 2.703 N/A THR 148.A N GLU 136.A OE1 no hydrogen 2.936 N/A ASN 149.A ND2 THR 133.A OG1 no hydrogen 2.894 N/A ASN 149.A ND2 GLN 135.A OE1 no hydrogen 2.912 N/A LEU 150.A N ILE 134.A O no hydrogen 2.694 N/A GLY 151.A N ASN 149.A OD1 no hydrogen 2.949 N/A ALA 153.A N ASN 132.A O no hydrogen 3.017 N/A LEU 154.A N GLN 179.A O no hydrogen 2.915 N/A GLY 156.A N GLN 128.A OE1 no hydrogen 2.845 N/A THR 157.A N LEU 154.A O no hydrogen 2.967 N/A THR 157.A OG1 GLY 158.A O no hydrogen 2.703 N/A THR 157.A OG1 GLN 179.A O no hydrogen 3.513 N/A GLY 160.A N TRP 177.A O no hydrogen 2.867 N/A THR 162.A N ARG 175.A O no hydrogen 2.925 N/A THR 162.A OG1 SER 217.A OG no hydrogen 2.794 N/A SER 163.A OG SER 173.A O no hydrogen 2.847 N/A PHE 164.A N SER 173.A O no hydrogen 3.109 N/A THR 167.A N GLY 221.A O no hydrogen 2.985 N/A THR 167.A OG1 ASN 222.A OD1 no hydrogen 2.670 N/A ASP 168.A N ASP 168.A OD1 no hydrogen 2.629 N/A TYR 169.A N TYR 166.A O no hydrogen 3.105 N/A TYR 169.A OH HIS 193.A NE2 no hydrogen 3.248 N/A SER 173.A N PHE 164.A O no hydrogen 2.750 N/A SER 173.A OG ASP 191.A OD1 no hydrogen 2.909 N/A ILE 174.A N TYR 190.A O no hydrogen 2.898 N/A ARG 175.A N THR 162.A O no hydrogen 2.923 N/A ARG 175.A NH1 ILE 174.A O no hydrogen 2.923 N/A ARG 175.A NH1 TYR 190.A O no hydrogen 2.806 N/A ARG 175.A NH1 ASP 191.A OD1 no hydrogen 3.140 N/A ARG 175.A NH2 ASP 191.A OD1 no hydrogen 2.824 N/A ILE 176.A N ARG 188.A O no hydrogen 2.927 N/A TRP 177.A N GLY 160.A O no hydrogen 2.894 N/A TRP 177.A NE1 TYR 248.A OH no hydrogen 3.020 N/A PHE 178.A N VAL 186.A O no hydrogen 3.061 N/A GLN 179.A N THR 157.A OG1 no hydrogen 2.762 N/A GLN 179.A NE2 LEU 183.A O no hydrogen 3.205 N/A GLN 179.A NE2 ALA 207.A O no hydrogen 3.011 N/A GLN 179.A NE2 PRO 208.A O no hydrogen 2.916 N/A THR 180.A N LYS 184.A O no hydrogen 3.027 N/A THR 180.A OG1 ASP 182.A OD1 no hydrogen 2.614 N/A THR 180.A OG1 LYS 184.A O no hydrogen 3.453 N/A LEU 183.A N THR 180.A O no hydrogen 2.767 N/A LYS 184.A N ASP 182.A OD1 no hydrogen 3.143 N/A LEU 185.A N PHE 204.A O no hydrogen 2.922 N/A VAL 186.A N PHE 178.A O no hydrogen 2.828 N/A GLN 187.A N VAL 201.A O no hydrogen 2.789 N/A ARG 188.A N ILE 176.A O no hydrogen 2.837 N/A ARG 188.A NH1 LEU 150.A O no hydrogen 2.913 N/A ARG 188.A NH2 TYR 197.A O no hydrogen 2.961 N/A TYR 190.A N ILE 174.A O no hydrogen 2.836 N/A ASP 191.A N GLY 195.A O no hydrogen 3.061 N/A HIS 193.A N HIS 193.A ND1 no hydrogen 3.058 N/A LYS 194.A N ASP 191.A O no hydrogen 3.180 N/A GLY 195.A N ASP 191.A O no hydrogen 2.754 N/A TYR 197.A N ALA 189.A O no hydrogen 2.784 N/A TYR 197.A OH ASP 191.A OD2 no hydrogen 2.600 N/A VAL 201.A N GLN 187.A O no hydrogen 3.002 N/A ILE 203.A N LEU 185.A O no hydrogen 2.807 N/A PHE 204.A N LEU 185.A O no hydrogen 3.324 N/A ALA 207.A N LEU 183.A O no hydrogen 2.934 N/A ARG 210.A N GLN 179.A OE1 no hydrogen 2.902 N/A ARG 210.A NE PRO 155.A O no hydrogen 2.851 N/A THR 211.A N PRO 208.A O no hydrogen 3.164 N/A THR 211.A OG1 VAL 232.A O no hydrogen 2.482 N/A ALA 214.A N TYR 230.A O no hydrogen 2.904 N/A THR 216.A N ARG 228.A O no hydrogen 2.922 N/A THR 216.A OG1 SER 267.A OG no hydrogen 2.719 N/A SER 217.A OG THR 162.A OG1 no hydrogen 2.794 N/A PHE 218.A N TYR 226.A O no hydrogen 3.000 N/A GLY 221.A N SER 224.A O no hydrogen 2.959 N/A SER 223.A N ASP 168.A OD1 no hydrogen 2.783 N/A SER 223.A OG ASP 168.A OD2 no hydrogen 2.744 N/A SER 224.A OG ASN 222.A O no hydrogen 3.471 N/A TYR 226.A N PHE 218.A O no hydrogen 3.123 N/A MET 227.A N TRP 242.A O no hydrogen 2.955 N/A ARG 228.A N THR 216.A O no hydrogen 2.979 N/A ARG 228.A NH1 MET 227.A O no hydrogen 2.778 N/A ARG 228.A NH1 TRP 242.A O no hydrogen 3.061 N/A ARG 228.A NH1 ASP 243.A OD1 no hydrogen 2.912 N/A ARG 228.A NH2 ASP 243.A OD1 no hydrogen 2.774 N/A ILE 229.A N VAL 241.A O no hydrogen 2.996 N/A TYR 230.A N ALA 214.A O no hydrogen 2.719 N/A TYR 230.A OH GLN 240.A OE1 no hydrogen 2.644 N/A PHE 231.A N TRP 239.A O no hydrogen 3.074 N/A VAL 232.A N THR 211.A OG1 no hydrogen 3.062 N/A ASN 233.A N THR 237.A O no hydrogen 2.918 N/A SER 234.A N ASN 233.A OD1 no hydrogen 2.798 N/A ASN 236.A N ASN 233.A O no hydrogen 3.041 N/A THR 237.A N ASP 235.A OD1 no hydrogen 3.108 N/A THR 237.A OG1 ASP 235.A OD1 no hydrogen 2.659 N/A THR 237.A OG1 ASP 235.A OD2 no hydrogen 3.331 N/A THR 237.A OG1 THR 253.A OG1 no hydrogen 2.812 N/A ILE 238.A N THR 255.A O no hydrogen 2.880 N/A TRP 239.A N PHE 231.A O no hydrogen 2.807 N/A TRP 239.A NE1 ASP 235.A OD2 no hydrogen 3.003 N/A GLN 240.A N GLY 252.A O no hydrogen 2.831 N/A VAL 241.A N ILE 229.A O no hydrogen 2.794 N/A ASP 243.A N GLY 247.A O no hydrogen 3.151 N/A LYS 246.A N ASP 243.A O no hydrogen 3.047 N/A GLY 247.A N ASP 243.A O no hydrogen 2.827 N/A TYR 248.A OH GLN 187.A OE1 no hydrogen 2.583 N/A HIS 249.A NE2 ASP 243.A OD2 no hydrogen 2.573 N/A GLY 252.A N GLN 240.A O no hydrogen 3.009 N/A THR 253.A OG1 THR 237.A OG1 no hydrogen 2.812 N/A ILE 254.A N ILE 238.A O no hydrogen 2.757 N/A VAL 257.A N ASN 236.A O no hydrogen 3.021 N/A ILE 258.A N GLN 281.A O no hydrogen 2.792 N/A SER 261.A N ILE 258.A O no hydrogen 3.042 N/A SER 261.A OG GLU 262.A O no hydrogen 2.695 N/A SER 261.A OG GLN 281.A O no hydrogen 3.417 N/A ALA 264.A N TYR 279.A O no hydrogen 2.905 N/A ILE 266.A N ARG 277.A O no hydrogen 2.932 N/A SER 267.A OG THR 216.A OG1 no hydrogen 2.719 N/A SER 267.A OG SER 217.A O no hydrogen 3.466 N/A TRP 268.A N ASP 275.A O no hydrogen 2.990 N/A ASP 275.A N TRP 268.A O no hydrogen 2.725 N/A LEU 276.A N TRP 294.A O no hydrogen 2.893 N/A ARG 277.A N ILE 266.A O no hydrogen 2.938 N/A ARG 277.A NH1 ASP 275.A OD2 no hydrogen 2.804 N/A ARG 277.A NH1 LEU 276.A O no hydrogen 2.988 N/A ARG 277.A NH2 ASP 275.A OD2 no hydrogen 3.137 N/A LEU 278.A N TRP 292.A O no hydrogen 2.969 N/A TYR 279.A N ALA 264.A O no hydrogen 2.906 N/A TYR 279.A OH GLU 291.A OE2 no hydrogen 2.680 N/A PHE 280.A N SER 290.A O no hydrogen 3.195 N/A GLN 281.A N SER 261.A OG no hydrogen 2.837 N/A GLN 281.A NE2 LEU 9.A O no hydrogen 3.223 N/A GLN 281.A NE2 SER 287.A O no hydrogen 2.892 N/A THR 284.A N ASN 282.A OD1 no hydrogen 3.037 N/A THR 284.A OG1 ASN 282.A OD1 no hydrogen 2.611 N/A THR 284.A OG1 SER 290.A OG no hydrogen 3.226 N/A ILE 286.A N GLY 283.A O no hydrogen 2.905 N/A SER 287.A N TYR 285.A O no hydrogen 2.773 N/A SER 287.A OG ALA 5.A O no hydrogen 2.644 N/A ALA 288.A N THR 284.A O no hydrogen 3.030 N/A SER 290.A N PHE 280.A O no hydrogen 2.818 N/A SER 290.A OG ASN 282.A OD1 no hydrogen 3.254 N/A SER 290.A OG THR 284.A OG1 no hydrogen 3.226 N/A SER 290.A OG SER 305.A O no hydrogen 2.573 N/A GLU 291.A N ARG 304.A O no hydrogen 3.130 N/A TRP 292.A N LEU 278.A O no hydrogen 2.868 N/A TRP 292.A NE1 SER 300.A OG.B no hydrogen 2.666 N/A VAL 293.A N GLN 301.A O no hydrogen 2.760 N/A TRP 294.A N LEU 276.A O no hydrogen 3.122 N/A ASN 295.A ND2 ASP 275.A OD2 no hydrogen 2.858 N/A ARG 296.A NH1 ASN 272.A OD1 no hydrogen 3.210 N/A HIS 298.A N ASN 295.A OD1 no hydrogen 2.950 N/A GLY 299.A N ASN 295.A O no hydrogen 2.838 N/A GLN 301.A N VAL 293.A O no hydrogen 2.916 N/A GLN 301.A NE2 HIS 298.A O no hydrogen 2.793 N/A GLY 303.A N GLU 291.A O no hydrogen 2.868 N/A ARG 304.A N GLU 291.A OE1 no hydrogen 2.969 N/A ARG 304.A NE ALA 306.A O no hydrogen 2.876 N/A LEU 307.A N VAL 289.A O no hydrogen 2.821 N/A ALA 310.A N LEU 307.A O no hydrogen 2.993 N/A