Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5c3u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG HIS 4.A O no hydrogen 3.417 N/A VAL 5.A N GLN 31.A OE1 no hydrogen 2.902 N/A THR 7.A N GLU 147.A OE2 no hydrogen 3.165 N/A THR 7.A OG1 GLU 28.A OE2 no hydrogen 2.679 N/A LEU 10.A N LEU 25.A O no hydrogen 2.802 N/A ALA 12.A N VAL 23.A O no hydrogen 2.941 N/A THR 16.A N ALA 12.A O no hydrogen 2.877 N/A THR 16.A OG1.A ALA 12.A O no hydrogen 3.258 N/A THR 16.A OG1.A PRO 13.A O no hydrogen 2.605 N/A THR 16.A OG1.B HIS 11.A NE2 no hydrogen 3.122 N/A THR 16.A OG1.B ALA 12.A O no hydrogen 2.895 N/A LYS 17.A N PRO 13.A O no hydrogen 3.044 N/A GLU 18.A N ASN 14.A O no hydrogen 3.028 N/A LEU 19.A N LEU 15.A O no hydrogen 2.856 N/A CYS 21.A N THR 16.A O no hydrogen 3.302 N/A CYS 21.A SG ASN 22.A O no hydrogen 3.915 N/A CYS 21.A SG SER 287.A O no hydrogen 4.027 N/A CYS 21.A SG LYS 290.A O no hydrogen 3.450 N/A ASN 22.A N LYS 290.A O no hydrogen 3.008 N/A ASN 22.A ND2 LYS 290.A O no hydrogen 3.523 N/A VAL 23.A N THR 16.A OG1.B no hydrogen 3.068 N/A PHE 24.A N VAL 292.A O no hydrogen 2.839 N/A LEU 25.A N LEU 10.A O no hydrogen 2.688 N/A LYS 26.A N VAL 294.A O no hydrogen 2.902 N/A LYS 26.A NZ THR 7.A O no hydrogen 2.915 N/A LYS 26.A NZ THR 7.A OG1 no hydrogen 3.127 N/A LYS 26.A NZ GLU 147.A OE2 no hydrogen 2.779 N/A LYS 26.A NZ GLN 151.A OE1 no hydrogen 2.783 N/A MET 27.A N PRO 8.A O no hydrogen 2.996 N/A GLU 28.A N LYS 26.A O no hydrogen 3.198 N/A GLU 28.A N VAL 296.A O no hydrogen 2.935 N/A ILE 30.A N MET 27.A O no hydrogen 3.330 N/A GLN 31.A N GLU 28.A O no hydrogen 3.162 N/A GLN 31.A NE2 VAL 5.A O no hydrogen 3.015 N/A GLN 31.A NE2 GLU 28.A OE1 no hydrogen 3.016 N/A SER 33.A OG PRO 32.A O no hydrogen 2.664 N/A GLY 34.A N GLN 31.A O no hydrogen 2.867 N/A VAL 36.A N THR 297.A O no hydrogen 3.032 N/A LYS 37.A N SER 35.A OG no hydrogen 3.127 N/A MET 38.A N SER 35.A O no hydrogen 3.234 N/A ARG 39.A N VAL 36.A O no hydrogen 2.874 N/A ARG 39.A NE GLU 28.A OE1 no hydrogen 2.651 N/A ARG 39.A NH1 GLU 28.A OE1 no hydrogen 3.392 N/A ARG 39.A NH1 GLU 28.A OE2 no hydrogen 2.928 N/A ARG 39.A NH1 GLU 147.A OE1 no hydrogen 3.263 N/A ARG 39.A NH1 GLU 147.A OE2 no hydrogen 2.869 N/A ARG 39.A NH2 THR 143.A OG1 no hydrogen 3.025 N/A ARG 39.A NH2 GLU 147.A OE1 no hydrogen 2.797 N/A ILE 41.A N LYS 37.A O no hydrogen 2.710 N/A GLY 42.A N MET 38.A O no hydrogen 3.000 N/A ALA 43.A N ARG 39.A O no hydrogen 3.129 N/A PHE 44.A N GLY 40.A O no hydrogen 3.148 N/A CYS 45.A N ILE 41.A O no hydrogen 2.874 N/A CYS 45.A SG ILE 41.A O no hydrogen 3.427 N/A TYR 46.A N GLY 42.A O no hydrogen 2.960 N/A GLN 47.A N ALA 43.A O no hydrogen 3.116 N/A GLN 47.A NE2 THR 51.A OG1 no hydrogen 2.820 N/A ALA 48.A N PHE 44.A O no hydrogen 2.888 N/A VAL 49.A N CYS 45.A O no hydrogen 3.069 N/A GLN 50.A N TYR 46.A O no hydrogen 2.988 N/A THR 51.A N GLN 47.A O no hydrogen 2.940 N/A THR 51.A OG1 GLN 47.A O no hydrogen 3.248 N/A ARG 52.A N ALA 48.A O no hydrogen 2.792 N/A ARG 52.A NH2 ASN 125.A OD1 no hydrogen 2.815 N/A GLY 53.A N VAL 49.A O no hydrogen 2.888 N/A GLN 57.A N ASN 125.A O no hydrogen 3.126 N/A PHE 58.A N GLU 80.A O no hydrogen 2.780 N/A VAL 59.A N ILE 127.A O no hydrogen 2.899 N/A CYS 60.A N ILE 82.A O no hydrogen 2.994 N/A CYS 60.A SG VAL 129.A O no hydrogen 3.367 N/A GLY 61.A N TYR 128.A OH no hydrogen 2.899 N/A SER 62.A OG TYR 128.A OH no hydrogen 2.688 N/A ASN 65.A ND2 GLU 264.A OE1 no hydrogen 3.425 N/A ASN 65.A ND2 GLU 264.A OE2 no hydrogen 2.669 N/A THR 66.A OG1 SER 62.A O no hydrogen 2.980 N/A VAL 67.A N GLY 63.A O no hydrogen 3.052 N/A LEU 68.A N PRO 64.A O no hydrogen 3.171 N/A ALA 69.A N ASN 65.A O no hydrogen 3.081 N/A VAL 70.A N THR 66.A O no hydrogen 2.886 N/A SER 71.A N VAL 67.A O no hydrogen 2.901 N/A SER 71.A OG ILE 97.A O no hydrogen 3.563 N/A SER 71.A OG ASP 100.A OD2 no hydrogen 2.643 N/A SER 71.A OG SER 102.A OG no hydrogen 2.714 N/A TYR 72.A N LEU 68.A O no hydrogen 2.995 N/A CYS 73.A N ALA 69.A O no hydrogen 2.877 N/A CYS 73.A SG ALA 69.A O no hydrogen 3.243 N/A ALA 74.A N VAL 70.A O no hydrogen 2.854 N/A ARG 75.A N SER 71.A O no hydrogen 3.133 N/A ARG 75.A NE ASP 100.A OD1 no hydrogen 3.088 N/A GLN 76.A N TYR 72.A O no hydrogen 3.064 N/A LEU 77.A N CYS 73.A O no hydrogen 2.791 N/A GLY 78.A N ARG 75.A O no hydrogen 3.412 N/A VAL 79.A N ALA 74.A O no hydrogen 2.941 N/A ILE 82.A N PHE 58.A O no hydrogen 2.764 N/A ILE 83.A N HIS 103.A O no hydrogen 2.836 N/A VAL 84.A N CYS 60.A O no hydrogen 2.929 N/A VAL 85.A N ILE 105.A O no hydrogen 2.964 N/A LYS 87.A N GLY 108.A O no hydrogen 2.826 N/A THR 89.A N PRO 86.A O no hydrogen 3.190 N/A THR 89.A OG1 PRO 86.A O no hydrogen 2.822 N/A ILE 93.A N ASN 90.A OD1 no hydrogen 3.321 N/A CYS 94.A N ASN 90.A O no hydrogen 3.298 N/A CYS 94.A SG THR 89.A O no hydrogen 3.987 N/A CYS 94.A SG ASN 90.A O no hydrogen 3.713 N/A GLN 95.A N GLU 91.A O no hydrogen 2.861 N/A GLN 95.A NE2 GLN 95.A O no hydrogen 2.968 N/A GLN 95.A NE2 THR 99.A OG1 no hydrogen 2.984 N/A SER 96.A N ARG 92.A O no hydrogen 2.955 N/A SER 96.A OG ARG 92.A O no hydrogen 3.022 N/A ILE 97.A N ILE 93.A O no hydrogen 3.130 N/A ARG 98.A N CYS 94.A O no hydrogen 3.027 N/A THR 99.A N GLN 95.A O no hydrogen 2.841 N/A THR 99.A OG1 GLN 95.A O no hydrogen 2.942 N/A ASP 100.A N SER 96.A O no hydrogen 3.093 N/A GLY 101.A N ARG 98.A O no hydrogen 2.882 N/A SER 102.A N ILE 97.A O no hydrogen 3.249 N/A SER 102.A OG SER 71.A OG no hydrogen 2.714 N/A HIS 103.A N ALA 81.A O no hydrogen 2.905 N/A ILE 105.A N ILE 83.A O no hydrogen 2.845 N/A TYR 107.A N VAL 85.A O no hydrogen 2.768 N/A ALA 113.A N ASN 110.A OD1 no hydrogen 2.983 N/A ALA 114.A N ASN 110.A O no hydrogen 3.086 N/A GLU 115.A N TRP 111.A O no hydrogen 2.956 N/A VAL 116.A N THR 112.A O no hydrogen 2.990 N/A HIS 117.A N ALA 113.A O no hydrogen 2.999 N/A ALA 118.A N ALA 114.A O no hydrogen 2.770 N/A ARG 119.A N GLU 115.A O no hydrogen 2.946 N/A ARG 119.A NE GLU 115.A OE2 no hydrogen 3.098 N/A ARG 119.A NH1 GLU 115.A OE2 no hydrogen 3.061 N/A LYS 120.A N HIS 117.A O no hydrogen 3.019 N/A LEU 121.A N ALA 118.A O no hydrogen 2.925 N/A ASN 125.A ND2 ASN 55.A O no hydrogen 3.151 N/A GLY 126.A N ARG 123.A O no hydrogen 2.898 N/A ILE 127.A N GLN 57.A O no hydrogen 2.840 N/A TYR 128.A OH SER 62.A OG no hydrogen 2.688 N/A VAL 129.A N VAL 59.A O no hydrogen 2.931 N/A SER 131.A OG SER 132.A OG no hydrogen 2.931 N/A SER 132.A OG SER 131.A OG no hydrogen 2.931 N/A HIS 134.A N SER 132.A O no hydrogen 3.164 N/A LEU 136.A N HIS 134.A ND1 no hydrogen 2.984 N/A TRP 138.A N HIS 134.A O no hydrogen 3.151 N/A TRP 138.A NE1 SER 132.A O no hydrogen 2.877 N/A GLN 139.A N ALA 135.A O no hydrogen 3.078 N/A GLY 140.A N LEU 136.A O no hydrogen 2.935 N/A HIS 141.A N ILE 137.A O no hydrogen 2.887 N/A SER 142.A N TRP 138.A O no hydrogen 2.922 N/A SER 142.A N GLN 139.A O no hydrogen 3.204 N/A SER 142.A OG GLN 139.A O no hydrogen 2.617 N/A THR 143.A N GLY 140.A O no hydrogen 3.220 N/A THR 143.A OG1 GLY 140.A O no hydrogen 2.679 N/A ILE 144.A N HIS 141.A O no hydrogen 3.016 N/A VAL 145.A N SER 142.A O no hydrogen 3.029 N/A GLU 147.A N THR 143.A O no hydrogen 3.250 N/A LEU 148.A N ILE 144.A O no hydrogen 3.001 N/A LYS 149.A N VAL 145.A O no hydrogen 2.850 N/A LYS 149.A NZ ALA 180.A O no hydrogen 2.639 N/A THR 150.A N GLN 146.A O no hydrogen 3.453 N/A THR 150.A OG1 GLN 146.A O no hydrogen 3.512 N/A GLN 151.A N GLU 147.A O no hydrogen 2.923 N/A GLN 151.A NE2 THR 7.A O no hydrogen 2.929 N/A LEU 152.A N LEU 148.A O no hydrogen 2.809 N/A ASN 153.A N THR 150.A O no hydrogen 2.937 N/A ASP 154.A N LYS 149.A O no hydrogen 2.802 N/A ASN 155.A N LEU 152.A O no hydrogen 3.005 N/A ALA 158.A N ASP 291.A O no hydrogen 2.704 N/A ILE 160.A N PRO 186.A O no hydrogen 3.090 N/A ILE 161.A N VAL 293.A O no hydrogen 2.870 N/A CYS 162.A N ILE 188.A O no hydrogen 2.779 N/A CYS 162.A SG PRO 163.A O no hydrogen 3.551 N/A VAL 164.A N VAL 190.A O no hydrogen 2.792 N/A ASN 171.A N GLY 167.A O no hydrogen 2.888 N/A ASN 171.A ND2 SER 226.A OG no hydrogen 3.000 N/A GLY 172.A N GLY 168.A O no hydrogen 3.082 N/A VAL 173.A N LEU 169.A O no hydrogen 2.821 N/A ILE 174.A N LEU 170.A O no hydrogen 2.960 N/A MET 175.A N ASN 171.A O no hydrogen 2.904 N/A GLY 176.A N GLY 172.A O no hydrogen 2.760 N/A LEU 177.A N VAL 173.A O no hydrogen 2.839 N/A GLN 178.A N ILE 174.A O no hydrogen 2.999 N/A GLU 179.A N MET 175.A O no hydrogen 3.035 N/A ALA 180.A N GLY 176.A O no hydrogen 2.906 N/A ASP 181.A N GLN 178.A O no hydrogen 3.221 N/A TRP 182.A N LEU 177.A O no hydrogen 2.756 N/A VAL 185.A N TRP 182.A O no hydrogen 3.232 N/A VAL 187.A N PRO 237.A O no hydrogen 3.091 N/A ILE 188.A N ILE 160.A O no hydrogen 2.837 N/A ALA 189.A N VAL 239.A O no hydrogen 2.803 N/A VAL 190.A N CYS 162.A O no hydrogen 2.886 N/A GLU 191.A N PHE 241.A O no hydrogen 2.967 N/A THR 192.A OG1 THR 215.A OG1 no hydrogen 2.845 N/A HIS 193.A N VAL 243.A O no hydrogen 2.983 N/A SER 195.A N THR 192.A O no hydrogen 3.089 N/A ASN 196.A ND2 GLN 199.A OE1 no hydrogen 2.972 N/A PHE 198.A N GLU 191.A OE2 no hydrogen 2.881 N/A GLN 199.A N GLU 191.A OE1 no hydrogen 2.900 N/A ALA 200.A N ASN 196.A O no hydrogen 2.895 N/A SER 201.A N ALA 197.A O no hydrogen 2.802 N/A SER 201.A OG ALA 197.A O no hydrogen 2.697 N/A SER 201.A OG GLU 206.A O no hydrogen 3.404 N/A VAL 202.A N PHE 198.A O no hydrogen 2.950 N/A VAL 203.A N GLN 199.A O no hydrogen 3.159 N/A ALA 204.A N ALA 200.A O no hydrogen 2.998 N/A GLY 205.A N SER 201.A O no hydrogen 2.743 N/A VAL 208.A N SER 201.A OG no hydrogen 3.038 N/A MET 210.A N LYS 223.A O no hydrogen 2.793 N/A ASN 213.A ND2 GLY 194.A O no hydrogen 2.948 N/A THR 215.A N ASN 214.A OD1 no hydrogen 2.910 N/A THR 215.A OG1 THR 192.A OG1 no hydrogen 2.845 N/A THR 215.A OG1 ASP 245.A OD1 no hydrogen 2.634 N/A THR 215.A OG1 ASP 245.A OD2 no hydrogen 3.533 N/A ILE 216.A N ASP 245.A OD2 no hydrogen 3.018 N/A ALA 217.A N THR 215.A OG1 no hydrogen 3.102 N/A THR 218.A OG1 ILE 216.A O no hydrogen 3.541 N/A THR 218.A OG1 ASP 301.A OD2 no hydrogen 2.686 N/A SER 219.A N SER 266.A OG no hydrogen 3.257 N/A SER 219.A OG GLU 264.A OE1 no hydrogen 2.910 N/A LEU 220.A N ALA 217.A O no hydrogen 2.972 N/A ILE 221.A N THR 218.A O no hydrogen 3.301 N/A SER 222.A OG ALA 224.A O no hydrogen 2.621 N/A SER 226.A N GLY 166.A O no hydrogen 2.850 N/A SER 226.A OG SER 229.A OG no hydrogen 2.711 N/A SER 229.A N SER 226.A O no hydrogen 2.932 N/A SER 229.A N SER 226.A OG no hydrogen 3.203 N/A SER 229.A OG GLY 167.A O no hydrogen 3.391 N/A SER 229.A OG ASN 171.A OD1 no hydrogen 2.761 N/A SER 229.A OG SER 226.A OG no hydrogen 2.711 N/A GLU 231.A N SER 227.A O no hydrogen 3.196 N/A LEU 232.A N LYS 228.A O no hydrogen 2.894 N/A SER 233.A N SER 229.A O no hydrogen 2.965 N/A SER 233.A OG LEU 230.A O no hydrogen 2.725 N/A LEU 234.A N GLU 231.A O no hydrogen 3.239 N/A ASN 235.A N LEU 232.A O no hydrogen 3.108 N/A HIS 236.A NE2 VAL 185.A O no hydrogen 2.650 N/A VAL 239.A N VAL 187.A O no hydrogen 2.831 N/A PHE 241.A N ALA 189.A O no hydrogen 2.887 N/A VAL 243.A N GLU 191.A O no hydrogen 2.909 N/A MET 247.A N SER 244.A OG no hydrogen 3.087 N/A ALA 248.A N SER 244.A O no hydrogen 3.082 N/A ALA 249.A N ASP 245.A O no hydrogen 2.813 N/A ASP 250.A N ALA 246.A O no hydrogen 2.971 N/A ALA 251.A N MET 247.A O no hydrogen 3.027 N/A VAL 252.A N ALA 248.A O no hydrogen 3.102 N/A ARG 253.A N ALA 249.A O no hydrogen 3.069 N/A ARG 253.A NE ASP 250.A OD1 no hydrogen 3.112 N/A ARG 253.A NH2 ASP 250.A OD1 no hydrogen 2.957 N/A LEU 254.A N ASP 250.A O no hydrogen 2.872 N/A PHE 255.A N ALA 251.A O no hydrogen 2.840 N/A ALA 256.A N VAL 252.A O no hydrogen 3.008 N/A GLU 257.A N ARG 253.A O no hydrogen 3.051 N/A ASP 258.A N LEU 254.A O no hydrogen 2.847 N/A PHE 259.A N PHE 255.A O no hydrogen 2.857 N/A LYS 260.A N ALA 256.A O no hydrogen 3.056 N/A LYS 260.A NZ GLU 257.A O no hydrogen 2.751 N/A GLU 264.A N GLY 298.A O no hydrogen 3.074 N/A SER 266.A OG GLU 264.A OE1 no hydrogen 3.226 N/A GLY 268.A N GLU 264.A O no hydrogen 2.954 N/A ALA 269.A N ALA 265.A O no hydrogen 2.794 N/A LEU 271.A N ALA 267.A O no hydrogen 3.122 N/A SER 272.A N GLY 268.A O no hydrogen 2.909 N/A SER 272.A OG ALA 269.A O no hydrogen 2.841 N/A LEU 273.A N ALA 270.A O no hydrogen 3.329 N/A CYS 274.A N LEU 271.A O no hydrogen 2.953 N/A TYR 275.A N LEU 271.A O no hydrogen 3.113 N/A TYR 275.A OH ASP 258.A OD2 no hydrogen 2.849 N/A THR 276.A N SER 272.A O no hydrogen 2.952 N/A THR 276.A OG1 SER 272.A O no hydrogen 2.723 N/A HIS 277.A N CYS 274.A O no hydrogen 3.096 N/A LEU 278.A N THR 276.A OG1 no hydrogen 3.199 N/A ILE 279.A N LEU 273.A O no hydrogen 3.035 N/A ARG 280.A N HIS 277.A O no hydrogen 2.903 N/A ARG 280.A NH1 LEU 286.A O no hydrogen 2.776 N/A ARG 280.A NH2 LEU 19.A O no hydrogen 2.629 N/A ARG 280.A NH2 LEU 286.A O no hydrogen 3.476 N/A ASP 281.A N LEU 278.A O no hydrogen 2.994 N/A ILE 282.A N LEU 278.A O no hydrogen 3.157 N/A LEU 283.A N ILE 279.A O no hydrogen 2.860 N/A LEU 286.A N LEU 283.A O no hydrogen 3.349 N/A ALA 289.A N SER 287.A OG no hydrogen 3.246 N/A LYS 290.A N SER 287.A O no hydrogen 2.814 N/A LYS 290.A NZ SER 285.A O no hydrogen 3.241 N/A VAL 292.A N ASN 22.A O no hydrogen 2.726 N/A VAL 293.A N ALA 159.A O no hydrogen 3.012 N/A VAL 294.A N PHE 24.A O no hydrogen 2.832 N/A LEU 295.A N ILE 161.A O no hydrogen 3.046 N/A VAL 296.A N LYS 26.A O no hydrogen 2.858 N/A GLY 299.A N GLY 34.A O no hydrogen 2.896 N/A SER 300.A N ASN 65.A OD1 no hydrogen 2.783 N/A ASP 301.A N GLU 264.A OE2 no hydrogen 2.904 N/A SER 303.A OG HIS 306.A ND1 no hydrogen 2.643 N/A HIS 306.A N SER 303.A OG no hydrogen 3.229 N/A HIS 306.A ND1 SER 303.A OG no hydrogen 2.643 N/A LEU 307.A N SER 303.A O no hydrogen 3.150 N/A ASP 308.A N LEU 304.A O no hydrogen 2.931 N/A GLU 309.A N ALA 305.A O no hydrogen 3.040 N/A TYR 310.A N HIS 306.A O no hydrogen 2.779 N/A ARG 311.A N LEU 307.A O no hydrogen 3.095 N/A ARG 311.A NE LEU 307.A O no hydrogen 3.361 N/A ARG 311.A NH1 ASP 308.A OD1 no hydrogen 2.864 N/A LYS 312.A N ASP 308.A O no hydrogen 3.110 N/A LYS 313.A N GLU 309.A O no hydrogen 3.000 N/A TYR 314.A N TYR 310.A O no hydrogen 2.997 N/A