Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ccu_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N ASN 1.A OD1 no hydrogen 2.518 N/A TYR 4.A N SER 11.A O no hydrogen 3.054 N/A CYS 5.A N TYR 175.A OH no hydrogen 3.344 N/A CYS 5.A SG THR 10.A OG1 no hydrogen 3.387 N/A PHE 6.A N LYS 9.A O no hydrogen 3.105 N/A SER 11.A N TYR 4.A O no hydrogen 2.710 N/A SER 11.A OG TYR 4.A O no hydrogen 3.525 N/A SER 12.A N ASP 15.A OD2 no hydrogen 2.557 N/A ASP 15.A N SER 12.A O no hydrogen 2.844 N/A LEU 16.A N ILE 13.A O no hydrogen 3.170 N/A LYS 17.A NZ GLU 18.A O no hydrogen 2.881 N/A VAL 19.A N VAL 82.A O no hydrogen 2.676 N/A ARG 21.A NE SER 83.A OG no hydrogen 2.780 N/A ARG 21.A NH1 PRO 88.A O no hydrogen 3.171 N/A ARG 21.A NH2 SER 83.A O no hydrogen 3.150 N/A ARG 21.A NH2 SER 83.A OG no hydrogen 2.912 N/A ARG 21.A NH2 PRO 88.A O no hydrogen 2.778 N/A ASN 23.A N PRO 20.A O no hydrogen 2.958 N/A ILE 24.A N ARG 21.A O no hydrogen 2.989 N/A THR 25.A N GLN 39.A O no hydrogen 2.955 N/A ILE 27.A N GLU 37.A O no hydrogen 2.725 N/A ARG 28.A N GLU 37.A O no hydrogen 3.449 N/A ARG 28.A NH1 GLU 37.A OE1 no hydrogen 2.722 N/A LEU 30.A N VAL 35.A O no hydrogen 2.792 N/A VAL 35.A N GLY 31.A O no hydrogen 3.027 N/A TYR 36.A N VAL 46.A O no hydrogen 2.841 N/A GLU 37.A N ARG 28.A O no hydrogen 2.700 N/A GLY 38.A N VAL 44.A O no hydrogen 2.645 N/A GLN 39.A N THR 25.A O no hydrogen 2.924 N/A VAL 40.A N LEU 42.A O no hydrogen 2.878 N/A LEU 42.A N VAL 40.A O no hydrogen 3.231 N/A VAL 44.A N GLY 38.A O no hydrogen 2.740 N/A ALA 45.A N LEU 93.A O no hydrogen 2.817 N/A VAL 46.A N TYR 36.A O no hydrogen 2.641 N/A LYS 47.A N ILE 91.A O no hydrogen 2.858 N/A THR 48.A N GLU 34.A O no hydrogen 3.108 N/A THR 48.A OG1 GLU 34.A O no hydrogen 2.786 N/A LEU 49.A N ARG 89.A O no hydrogen 2.943 N/A CYS 53.A SG PRO 50.A O no hydrogen 3.306 N/A CYS 53.A SG SER 54.A O no hydrogen 3.760 N/A SER 54.A N ASP 57.A OD2 no hydrogen 3.227 N/A ASP 57.A N SER 54.A OG no hydrogen 3.124 N/A GLU 58.A N SER 54.A O no hydrogen 3.033 N/A LEU 59.A N GLU 55.A O no hydrogen 2.974 N/A ASP 60.A N GLN 56.A O no hydrogen 2.920 N/A PHE 61.A N ASP 57.A O no hydrogen 2.996 N/A LEU 62.A N GLU 58.A O no hydrogen 2.965 N/A MET 63.A N LEU 59.A O no hydrogen 2.943 N/A GLU 64.A N ASP 60.A O no hydrogen 3.080 N/A ALA 65.A N PHE 61.A O no hydrogen 3.235 N/A LEU 66.A N LEU 62.A O no hydrogen 3.018 N/A ILE 67.A N MET 63.A O no hydrogen 2.844 N/A ILE 68.A N GLU 64.A O no hydrogen 3.014 N/A SER 69.A N ALA 65.A O no hydrogen 3.015 N/A SER 69.A OG ALA 65.A O no hydrogen 2.827 N/A LYS 70.A N LEU 66.A O no hydrogen 3.290 N/A LYS 70.A N ILE 67.A O no hydrogen 3.298 N/A PHE 71.A N ILE 68.A O no hydrogen 3.261 N/A ASN 72.A N TYR 136.A OH no hydrogen 2.922 N/A ASN 75.A N HIS 73.A ND1 no hydrogen 2.951 N/A ASN 75.A ND2 ALA 163.A O no hydrogen 3.056 N/A ILE 76.A N HIS 73.A O no hydrogen 3.234 N/A VAL 77.A N ILE 165.A O no hydrogen 3.119 N/A ARG 78.A N GLU 94.A OE1 no hydrogen 3.003 N/A ARG 78.A NH1 ASN 72.A OD1 no hydrogen 2.961 N/A CYS 79.A SG SER 69.A OG no hydrogen 3.410 N/A CYS 79.A SG GLY 81.A O no hydrogen 3.349 N/A CYS 79.A SG LEU 92.A O no hydrogen 3.496 N/A ILE 80.A N LEU 92.A O no hydrogen 2.796 N/A GLY 81.A N LEU 92.A O no hydrogen 3.447 N/A VAL 82.A N LYS 17.A O no hydrogen 2.825 N/A SER 83.A N PHE 90.A O no hydrogen 2.937 N/A LEU 84.A N GLU 18.A OE1 no hydrogen 2.984 N/A LEU 84.A N GLU 18.A OE2 no hydrogen 3.105 N/A GLN 85.A N GLU 18.A OE2 no hydrogen 3.033 N/A ARG 89.A NE GLU 58.A OE1 no hydrogen 3.228 N/A ARG 89.A NE GLU 58.A OE2 no hydrogen 3.475 N/A ARG 89.A NH1 LEU 84.A O no hydrogen 2.806 N/A ARG 89.A NH2 GLU 58.A OE1 no hydrogen 3.391 N/A ARG 89.A NH2 GLU 58.A OE2 no hydrogen 3.421 N/A PHE 90.A N SER 83.A O no hydrogen 2.852 N/A ILE 91.A N LYS 47.A O no hydrogen 2.744 N/A LEU 92.A N GLY 81.A O no hydrogen 2.848 N/A LEU 93.A N ALA 45.A O no hydrogen 2.829 N/A GLU 94.A N ARG 78.A O no hydrogen 2.835 N/A GLY 98.A N LEU 154.A O no hydrogen 2.777 N/A GLY 99.A N MET 96.A O no hydrogen 2.929 N/A LEU 101.A N CYS 152.A O no hydrogen 2.787 N/A LYS 102.A NZ GLY 217.A O no hydrogen 2.814 N/A SER 103.A N ASP 100.A OD2 no hydrogen 3.019 N/A SER 103.A OG ASP 100.A OD1 no hydrogen 2.623 N/A SER 103.A OG ASP 100.A OD2 no hydrogen 3.296 N/A PHE 104.A N ASP 100.A O no hydrogen 3.089 N/A LEU 105.A N LEU 101.A O no hydrogen 2.889 N/A ARG 106.A N LYS 102.A O no hydrogen 3.113 N/A GLU 107.A N SER 103.A O no hydrogen 2.796 N/A ARG 109.A NE LEU 216.A O no hydrogen 2.797 N/A ARG 109.A NH1 GLU 291.A OE2 no hydrogen 3.010 N/A ARG 109.A NH2 LEU 216.A O no hydrogen 3.107 N/A ARG 111.A N GLN 114.A O no hydrogen 2.891 N/A ARG 111.A NE GLU 291.A OE1 no hydrogen 3.153 N/A ARG 111.A NH2 GLU 291.A OE1 no hydrogen 3.508 N/A SER 117.A N GLN 114.A O no hydrogen 3.477 N/A SER 117.A OG THR 108.A O no hydrogen 2.792 N/A SER 117.A OG GLN 114.A O no hydrogen 3.475 N/A ALA 119.A N ASP 122.A OD2 no hydrogen 3.006 N/A LEU 123.A N ALA 119.A O no hydrogen 3.364 N/A LEU 124.A N MET 120.A O no hydrogen 2.942 N/A HIS 125.A N LEU 121.A O no hydrogen 2.942 N/A VAL 126.A N ASP 122.A O no hydrogen 3.131 N/A ALA 127.A N LEU 123.A O no hydrogen 2.886 N/A ARG 128.A N LEU 124.A O no hydrogen 2.849 N/A ARG 128.A NH1 ASP 129.A OD1 no hydrogen 2.672 N/A ASP 129.A N HIS 125.A O no hydrogen 2.903 N/A ILE 130.A N VAL 126.A O no hydrogen 3.076 N/A ALA 131.A N ALA 127.A O no hydrogen 2.971 N/A CYS 132.A N ARG 128.A O no hydrogen 2.904 N/A CYS 132.A SG HIS 73.A NE2 no hydrogen 3.652 N/A GLY 133.A N ASP 129.A O no hydrogen 3.134 N/A CYS 134.A N ILE 130.A O no hydrogen 2.801 N/A CYS 134.A SG ILE 130.A O no hydrogen 3.448 N/A GLN 135.A N ALA 131.A O no hydrogen 2.821 N/A TYR 136.A N CYS 132.A O no hydrogen 3.125 N/A LEU 137.A N GLY 133.A O no hydrogen 3.064 N/A GLU 138.A N CYS 134.A O no hydrogen 2.791 N/A GLU 139.A N GLN 135.A O no hydrogen 2.884 N/A ASN 140.A N TYR 136.A O no hydrogen 3.139 N/A ASN 140.A N LEU 137.A O no hydrogen 3.098 N/A HIS 141.A N GLU 138.A O no hydrogen 2.849 N/A PHE 142.A N LEU 137.A O no hydrogen 2.827 N/A HIS 144.A N ASP 202.A OD2 no hydrogen 2.879 N/A HIS 144.A NE2 ASP 167.A O no hydrogen 2.697 N/A ARG 145.A N ASP 202.A OD1 no hydrogen 3.045 N/A ASP 146.A N HIS 144.A ND1 no hydrogen 3.014 N/A ALA 149.A N GLU 212.A OE1 no hydrogen 2.922 N/A ASN 151.A N ALA 148.A O no hydrogen 2.808 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 2.757 N/A CYS 152.A N ALA 149.A O no hydrogen 3.205 N/A CYS 152.A SG ALA 148.A O no hydrogen 3.656 N/A LEU 153.A N LYS 164.A O no hydrogen 2.862 N/A LEU 154.A N GLY 99.A O no hydrogen 2.883 N/A THR 155.A N VAL 162.A O no hydrogen 3.010 N/A CYS 156.A SG GLY 158.A O no hydrogen 4.015 N/A ARG 161.A N GLY 158.A O no hydrogen 3.004 N/A ARG 161.A NE PRO 157.A O no hydrogen 3.249 N/A ARG 161.A NH1 ASP 122.A OD1 no hydrogen 2.786 N/A ARG 161.A NH2 PRO 157.A O no hydrogen 2.793 N/A VAL 162.A N THR 155.A OG1 no hydrogen 2.781 N/A ALA 163.A N ASP 129.A OD2 no hydrogen 2.941 N/A LYS 164.A N LEU 153.A O no hydrogen 2.933 N/A LYS 164.A NZ GLU 94.A OE1 no hydrogen 3.153 N/A LYS 164.A NZ GLU 94.A OE2 no hydrogen 2.810 N/A ILE 165.A N ASN 75.A O no hydrogen 2.898 N/A GLY 166.A N ASN 151.A O no hydrogen 2.825 N/A GLY 169.A N ASP 167.A OD1 no hydrogen 2.899 N/A ARG 172.A N PHE 168.A O no hydrogen 3.243 N/A ARG 172.A NE GLY 169.A O no hydrogen 3.227 N/A ARG 172.A NE ASP 173.A OD1 no hydrogen 2.620 N/A ARG 172.A NH1 ASP 60.A O no hydrogen 2.734 N/A ARG 172.A NH1 GLU 64.A OE2 no hydrogen 3.081 N/A ASP 173.A N GLY 169.A O no hydrogen 3.202 N/A ILE 174.A N MET 170.A O no hydrogen 3.326 N/A TYR 175.A N ALA 171.A O no hydrogen 3.131 N/A ARG 176.A N ARG 172.A O no hydrogen 3.000 N/A ARG 176.A NE ASP 173.A O no hydrogen 2.763 N/A MET 181.A N GLY 178.A O no hydrogen 3.289 N/A LEU 182.A N GLY 178.A O no hydrogen 3.159 N/A LEU 182.A N CYS 179.A O no hydrogen 3.106 N/A VAL 184.A N LEU 182.A O no hydrogen 2.723 N/A LYS 185.A NZ PRO 220.A O no hydrogen 3.498 N/A LYS 185.A NZ LYS 224.A O no hydrogen 3.079 N/A TRP 186.A N PRO 183.A O no hydrogen 2.857 N/A TRP 186.A NE1 GLU 212.A OE1 no hydrogen 2.835 N/A MET 187.A N VAL 184.A O no hydrogen 3.141 N/A GLU 190.A N GLU 190.A OE1 no hydrogen 2.840 N/A ALA 191.A N PRO 188.A O no hydrogen 3.009 N/A PHE 192.A N PRO 188.A O no hydrogen 3.258 N/A MET 193.A N PRO 189.A O no hydrogen 2.801 N/A GLU 194.A N GLU 190.A O no hydrogen 3.008 N/A GLY 195.A N ALA 191.A O no hydrogen 2.877 N/A ILE 196.A N GLU 190.A O no hydrogen 3.191 N/A THR 198.A N THR 201.A OG1 no hydrogen 2.764 N/A LYS 200.A N THR 198.A OG1 no hydrogen 2.999 N/A LYS 200.A NZ PRO 261.A O no hydrogen 3.019 N/A LYS 200.A NZ ARG 264.A O no hydrogen 2.644 N/A THR 201.A N THR 198.A O no hydrogen 2.809 N/A THR 201.A OG1 THR 198.A O no hydrogen 2.845 N/A ASP 202.A N SER 199.A O no hydrogen 3.268 N/A THR 203.A OG1 PRO 265.A O no hydrogen 2.933 N/A SER 205.A N THR 201.A O no hydrogen 3.238 N/A SER 205.A OG TRP 186.A O no hydrogen 2.637 N/A SER 205.A OG THR 201.A O no hydrogen 3.307 N/A PHE 206.A N ASP 202.A O no hydrogen 2.830 N/A GLY 207.A N THR 203.A O no hydrogen 3.144 N/A VAL 208.A N TRP 204.A O no hydrogen 3.260 N/A LEU 209.A N SER 205.A O no hydrogen 2.867 N/A LEU 210.A N PHE 206.A O no hydrogen 2.767 N/A TRP 211.A N GLY 207.A O no hydrogen 3.077 N/A TRP 211.A NE1 ASP 240.A O no hydrogen 2.860 N/A GLU 212.A N VAL 208.A O no hydrogen 2.939 N/A ILE 213.A N LEU 209.A O no hydrogen 2.867 N/A PHE 214.A N LEU 210.A O no hydrogen 3.021 N/A SER 215.A N TRP 211.A O no hydrogen 2.846 N/A SER 215.A OG TRP 211.A O no hydrogen 3.040 N/A SER 215.A OG GLU 212.A O no hydrogen 2.930 N/A LEU 216.A N ILE 213.A O no hydrogen 2.940 N/A GLY 217.A N GLU 212.A O no hydrogen 2.743 N/A TYR 218.A N SER 215.A OG no hydrogen 3.191 N/A SER 223.A OG PRO 222.A O no hydrogen 2.406 N/A LYS 224.A N TYR 221.A O no hydrogen 3.013 N/A SER 225.A N GLU 228.A OE1 no hydrogen 2.924 N/A GLN 227.A NE2 GLU 231.A OE2 no hydrogen 2.967 N/A GLU 228.A N SER 225.A OG no hydrogen 3.387 N/A VAL 229.A N SER 225.A O no hydrogen 2.916 N/A LEU 230.A N ASN 226.A O no hydrogen 2.836 N/A GLU 231.A N GLN 227.A O no hydrogen 2.999 N/A PHE 232.A N GLU 228.A O no hydrogen 2.826 N/A VAL 233.A N VAL 229.A O no hydrogen 2.787 N/A THR 234.A N LEU 230.A O no hydrogen 2.996 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.657 N/A SER 235.A N GLU 231.A O no hydrogen 3.068 N/A SER 235.A N PHE 232.A O no hydrogen 3.118 N/A SER 235.A OG GLU 231.A O no hydrogen 2.770 N/A GLY 236.A N VAL 233.A O no hydrogen 3.129 N/A GLY 237.A N PHE 232.A O no hydrogen 2.863 N/A ARG 238.A NE TRP 257.A O no hydrogen 2.842 N/A ARG 238.A NH1 VAL 233.A O no hydrogen 3.105 N/A ARG 238.A NH1 GLY 237.A O no hydrogen 2.788 N/A ARG 238.A NH2 TRP 257.A O no hydrogen 2.929 N/A ASN 244.A ND2 ALA 287.A O no hydrogen 3.085 N/A CYS 245.A N PRO 242.A O no hydrogen 2.974 N/A CYS 245.A SG PRO 246.A O no hydrogen 3.536 N/A VAL 249.A N PRO 246.A O no hydrogen 3.066 N/A TYR 250.A N PRO 246.A O no hydrogen 3.079 N/A TYR 250.A OH MET 239.A O no hydrogen 2.593 N/A ARG 251.A N GLY 247.A O no hydrogen 2.909 N/A ILE 252.A N VAL 249.A O no hydrogen 3.110 N/A MET 253.A N VAL 249.A O no hydrogen 3.299 N/A THR 254.A N TYR 250.A O no hydrogen 2.943 N/A THR 254.A OG1 TYR 250.A O no hydrogen 3.541 N/A THR 254.A OG1 ARG 251.A O no hydrogen 3.052 N/A GLN 255.A N ARG 251.A O no hydrogen 3.067 N/A CYS 256.A N ILE 252.A O no hydrogen 2.954 N/A CYS 256.A SG THR 203.A O no hydrogen 3.579 N/A CYS 256.A SG ILE 252.A O no hydrogen 3.384 N/A TRP 257.A N MET 253.A O no hydrogen 3.026 N/A GLN 258.A N GLN 255.A O no hydrogen 3.376 N/A GLN 258.A NE2 THR 254.A O no hydrogen 3.261 N/A GLU 262.A N GLU 262.A OE1 no hydrogen 2.927 N/A ASP 263.A N GLN 260.A O no hydrogen 2.931 N/A ARG 264.A N PRO 261.A O no hydrogen 3.241 N/A ARG 264.A NE LYS 200.A O no hydrogen 3.416 N/A ARG 264.A NH1 GLN 258.A O no hydrogen 2.808 N/A ARG 264.A NH2 GLU 190.A OE2 no hydrogen 2.617 N/A ARG 264.A NH2 LYS 200.A O no hydrogen 3.007 N/A PHE 267.A N GLU 138.A OE1 no hydrogen 3.106 N/A ILE 269.A N ASN 266.A OD1 no hydrogen 2.885 N/A ILE 270.A N ASN 266.A O no hydrogen 3.058 N/A LEU 271.A N PHE 267.A O no hydrogen 2.858 N/A GLU 272.A N ALA 268.A O no hydrogen 3.098 N/A ARG 273.A N ILE 269.A O no hydrogen 2.950 N/A ILE 274.A N ILE 270.A O no hydrogen 2.886 N/A GLU 275.A N LEU 271.A O no hydrogen 2.908 N/A TYR 276.A N GLU 272.A O no hydrogen 2.988 N/A CYS 277.A N ARG 273.A O no hydrogen 3.060 N/A CYS 277.A SG ARG 273.A O no hydrogen 3.431 N/A THR 278.A N ILE 274.A O no hydrogen 3.110 N/A THR 278.A OG1 GLU 275.A O no hydrogen 2.706 N/A THR 278.A OG1 GLU 275.A OE1 no hydrogen 3.417 N/A GLN 279.A N GLU 275.A O no hydrogen 3.238 N/A GLN 279.A N TYR 276.A O no hydrogen 3.122 N/A ASP 280.A N CYS 277.A O no hydrogen 3.296 N/A ASP 282.A N ASP 280.A OD1 no hydrogen 2.914 N/A VAL 283.A N ASP 280.A O no hydrogen 2.910 N/A ILE 284.A N ASP 280.A O no hydrogen 3.177 N/A ASN 285.A N PRO 281.A O no hydrogen 2.873 N/A THR 286.A N VAL 283.A O no hydrogen 3.159 N/A THR 286.A OG1 ASP 282.A O no hydrogen 2.724 N/A THR 286.A OG1 VAL 283.A O no hydrogen 3.192 N/A GLU 291.A N PRO 110.A O no hydrogen 2.982 N/A