Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j63_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 2.A SG GLU 58.A OE1 no hydrogen 3.232 N/A ILE 6.A N VAL 74.A O no hydrogen 2.636 N/A LYS 7.A NZ GLU 77.A OE1 no hydrogen 2.837 N/A ARG 8.A N GLU 77.A OE2 no hydrogen 2.568 N/A ARG 8.A NH1 ARG 8.A O no hydrogen 3.427 N/A ASP 10.A N LYS 7.A O no hydrogen 3.122 N/A ILE 11.A N ARG 8.A O no hydrogen 2.991 N/A VAL 12.A N GLU 29.A O no hydrogen 2.958 N/A LYS 14.A N LEU 27.A O no hydrogen 2.852 N/A TRP 15.A N LEU 27.A O no hydrogen 3.362 N/A LEU 17.A N VAL 25.A O no hydrogen 2.498 N/A GLY 18.A N VAL 25.A O no hydrogen 3.386 N/A GLY 20.A N GLY 23.A O no hydrogen 2.530 N/A LYS 24.A N ALA 43.A O no hydrogen 3.152 N/A VAL 25.A N GLY 18.A O no hydrogen 3.113 N/A PHE 26.A N VAL 41.A O no hydrogen 2.815 N/A LEU 27.A N TRP 15.A O no hydrogen 2.749 N/A ALA 28.A N VAL 39.A O no hydrogen 2.742 N/A GLU 29.A N VAL 12.A O no hydrogen 2.909 N/A CYS 30.A N MET 37.A O no hydrogen 2.890 N/A HIS 31.A N ASP 10.A O no hydrogen 2.910 N/A ASN 32.A ND2 ASP 10.A OD1 no hydrogen 3.447 N/A LYS 36.A NZ LEU 34.A O no hydrogen 3.167 N/A VAL 39.A N ALA 28.A O no hydrogen 2.673 N/A ALA 40.A N PHE 85.A O no hydrogen 2.846 N/A VAL 41.A N PHE 26.A O no hydrogen 2.954 N/A LYS 42.A N MET 83.A O no hydrogen 3.109 N/A ALA 43.A N LYS 24.A O no hydrogen 3.014 N/A LYS 45.A N PHE 22.A O no hydrogen 2.867 N/A GLU 46.A N LEU 44.A O no hydrogen 2.745 N/A ALA 49.A N ALA 47.A O no hydrogen 3.497 N/A GLN 51.A N SER 48.A O no hydrogen 3.277 N/A GLN 54.A NE2 ARG 50.A O no hydrogen 3.301 N/A GLU 56.A N ASP 52.A O no hydrogen 3.110 N/A ALA 57.A N PHE 53.A O no hydrogen 3.090 N/A LEU 59.A N ARG 55.A O no hydrogen 3.268 N/A LEU 60.A N GLU 56.A O no hydrogen 2.994 N/A THR 61.A N ALA 57.A O no hydrogen 3.171 N/A THR 61.A OG1 ALA 57.A O no hydrogen 3.262 N/A THR 61.A OG1 GLU 58.A O no hydrogen 2.626 N/A MET 62.A N GLU 58.A O no hydrogen 3.362 N/A MET 62.A N LEU 59.A O no hydrogen 3.067 N/A LEU 63.A N LEU 59.A O no hydrogen 3.043 N/A GLN 64.A N MET 62.A O no hydrogen 3.192 N/A GLN 64.A N TYR 135.A OH no hydrogen 3.071 N/A HIS 67.A N HIS 65.A ND1 no hydrogen 2.960 N/A ILE 68.A N HIS 65.A O no hydrogen 3.227 N/A VAL 69.A N ILE 161.A O no hydrogen 3.090 N/A ARG 70.A N GLU 86.A OE2 no hydrogen 3.338 N/A PHE 72.A N VAL 84.A O no hydrogen 2.918 N/A VAL 74.A N HIS 4.A O no hydrogen 2.979 N/A CYS 75.A N LEU 82.A O no hydrogen 3.134 N/A CYS 75.A SG ILE 6.A O no hydrogen 3.238 N/A LEU 82.A N CYS 75.A O no hydrogen 3.367 N/A MET 83.A N LYS 42.A O no hydrogen 3.344 N/A VAL 84.A N GLY 73.A O no hydrogen 2.850 N/A PHE 85.A N ALA 40.A O no hydrogen 2.878 N/A HIS 90.A N VAL 153.A O no hydrogen 2.964 N/A HIS 90.A NE2 ASP 111.A OD2 no hydrogen 3.135 N/A GLY 91.A N MET 88.A O no hydrogen 3.193 N/A LEU 93.A N CYS 151.A O no hydrogen 2.540 N/A ASN 94.A ND2 THR 148.A OG1 no hydrogen 3.065 N/A ASN 94.A ND2 GLY 219.A O no hydrogen 3.126 N/A ARG 95.A N ASP 92.A OD2 no hydrogen 2.992 N/A PHE 96.A N ASP 92.A O no hydrogen 3.263 N/A LEU 97.A N LEU 93.A O no hydrogen 2.891 N/A ARG 98.A N ASN 94.A O no hydrogen 3.113 N/A ARG 98.A NE ASN 94.A OD1 no hydrogen 3.107 N/A SER 99.A OG ARG 95.A O no hydrogen 3.053 N/A SER 99.A OG PHE 96.A O no hydrogen 3.152 N/A SER 99.A OG HIS 100.A ND1 no hydrogen 2.933 N/A HIS 100.A N LEU 97.A O no hydrogen 3.286 N/A HIS 100.A ND1 PHE 96.A O no hydrogen 2.981 N/A LEU 117.A N HIS 100.A O no hydrogen 3.314 N/A GLY 118.A N GLN 121.A OE1 no hydrogen 3.266 N/A GLN 121.A N GLY 118.A O no hydrogen 2.971 N/A LEU 122.A N GLY 118.A O no hydrogen 2.962 N/A LEU 123.A N LEU 119.A O no hydrogen 3.068 N/A ALA 124.A N GLY 120.A O no hydrogen 3.127 N/A VAL 125.A N GLN 121.A O no hydrogen 2.902 N/A ALA 126.A N LEU 122.A O no hydrogen 3.012 N/A SER 127.A N LEU 123.A O no hydrogen 2.940 N/A GLN 128.A N ALA 124.A O no hydrogen 3.303 N/A GLN 128.A NE2 ALA 124.A O no hydrogen 3.447 N/A GLN 128.A NE2 LEU 157.A O no hydrogen 3.142 N/A VAL 129.A N VAL 125.A O no hydrogen 3.252 N/A ALA 130.A N ALA 126.A O no hydrogen 2.968 N/A ALA 131.A N SER 127.A O no hydrogen 2.918 N/A GLY 132.A N GLN 128.A O no hydrogen 3.089 N/A MET 133.A N VAL 129.A O no hydrogen 2.997 N/A VAL 134.A N ALA 130.A O no hydrogen 2.886 N/A LEU 136.A N GLY 132.A O no hydrogen 3.173 N/A ALA 137.A N MET 133.A O no hydrogen 2.819 N/A GLY 138.A N VAL 134.A O no hydrogen 2.900 N/A LEU 139.A N TYR 135.A O no hydrogen 3.108 N/A LEU 139.A N LEU 136.A O no hydrogen 3.259 N/A HIS 140.A N ALA 137.A O no hydrogen 3.227 N/A PHE 141.A N LEU 136.A O no hydrogen 2.741 N/A HIS 143.A N ASP 204.A OD2 no hydrogen 2.927 N/A HIS 143.A NE2 GLY 162.A O no hydrogen 2.992 N/A ARG 144.A N ASP 204.A OD1 no hydrogen 3.373 N/A ASP 145.A N HIS 143.A ND1 no hydrogen 3.327 N/A THR 148.A N GLU 214.A OE2 no hydrogen 3.270 N/A THR 148.A OG1 GLU 214.A OE1 no hydrogen 3.218 N/A THR 148.A OG1 GLU 214.A OE2 no hydrogen 3.184 N/A ARG 149.A NE TYR 175.A OH no hydrogen 2.869 N/A ARG 149.A NH2 TYR 175.A OH no hydrogen 3.118 N/A ASN 150.A N ALA 147.A O no hydrogen 3.119 N/A ASN 150.A ND2 ASP 145.A O no hydrogen 2.470 N/A CYS 151.A N THR 148.A O no hydrogen 2.963 N/A CYS 151.A SG ALA 147.A O no hydrogen 3.426 N/A LEU 152.A N LYS 160.A O no hydrogen 2.781 N/A VAL 153.A N GLY 91.A O no hydrogen 2.906 N/A GLY 154.A N VAL 158.A O no hydrogen 2.839 N/A VAL 158.A N GLY 154.A O no hydrogen 3.449 N/A VAL 159.A N GLN 128.A OE1 no hydrogen 2.848 N/A LYS 160.A N LEU 152.A O no hydrogen 2.869 N/A LYS 160.A NZ GLU 86.A OE1 no hydrogen 3.348 N/A LYS 160.A NZ GLU 86.A OE2 no hydrogen 2.659 N/A ILE 161.A N HIS 67.A O no hydrogen 2.926 N/A GLY 162.A N ASN 150.A O no hydrogen 2.883 N/A SER 167.A OG ASN 150.A OD1 no hydrogen 2.488 N/A ARG 168.A NH1 MET 183.A O no hydrogen 3.320 N/A ASP 169.A N MET 166.A O no hydrogen 2.618 N/A TYR 171.A OH ASP 92.A OD1 no hydrogen 3.372 N/A ASP 174.A N TYR 171.A O no hydrogen 2.818 N/A TYR 175.A N SER 172.A O no hydrogen 3.145 N/A TYR 175.A OH ASP 145.A OD1 no hydrogen 3.305 N/A TYR 175.A OH ASP 145.A OD2 no hydrogen 2.728 N/A TYR 176.A N LEU 184.A O no hydrogen 2.754 N/A ARG 177.A NH2 GLY 180.A O no hydrogen 3.492 N/A VAL 178.A N THR 182.A O no hydrogen 2.753 N/A LEU 184.A N TYR 176.A O no hydrogen 2.802 N/A ARG 187.A NH1 PRO 222.A O no hydrogen 3.247 N/A ARG 187.A NH1 LEU 226.A O no hydrogen 3.235 N/A ARG 187.A NH2 LEU 226.A O no hydrogen 2.926 N/A TRP 188.A N PRO 185.A O no hydrogen 2.784 N/A TRP 188.A NE1 GLU 214.A OE2 no hydrogen 3.236 N/A MET 189.A N ILE 186.A O no hydrogen 3.272 N/A GLU 192.A N GLU 192.A OE1 no hydrogen 2.668 N/A SER 193.A N PRO 190.A O no hydrogen 3.021 N/A SER 193.A OG LYS 198.A O no hydrogen 2.785 N/A ILE 194.A N PRO 190.A O no hydrogen 3.275 N/A LEU 195.A N PRO 191.A O no hydrogen 3.020 N/A LYS 198.A N GLU 192.A O no hydrogen 3.276 N/A THR 200.A N SER 203.A OG no hydrogen 2.912 N/A THR 200.A OG1 GLU 202.A OE1 no hydrogen 3.081 N/A SER 203.A N THR 200.A O no hydrogen 3.023 N/A SER 203.A OG THR 200.A O no hydrogen 2.329 N/A ASP 204.A N THR 200.A O no hydrogen 3.330 N/A ASP 204.A N THR 201.A O no hydrogen 3.159 N/A VAL 205.A N THR 201.A O no hydrogen 3.210 N/A TRP 206.A N GLU 202.A O no hydrogen 3.399 N/A SER 207.A N SER 203.A O no hydrogen 3.148 N/A SER 207.A OG TRP 188.A O no hydrogen 2.979 N/A SER 207.A OG SER 203.A O no hydrogen 3.251 N/A PHE 208.A N ASP 204.A O no hydrogen 2.781 N/A GLY 209.A N VAL 205.A O no hydrogen 3.160 N/A VAL 210.A N TRP 206.A O no hydrogen 3.225 N/A VAL 211.A N SER 207.A O no hydrogen 2.822 N/A LEU 212.A N PHE 208.A O no hydrogen 2.458 N/A TRP 213.A N GLY 209.A O no hydrogen 2.840 N/A TRP 213.A NE1 GLU 242.A O no hydrogen 2.462 N/A GLU 214.A N VAL 210.A O no hydrogen 2.949 N/A ILE 215.A N VAL 211.A O no hydrogen 3.137 N/A PHE 216.A N TRP 213.A O no hydrogen 2.825 N/A THR 217.A N GLU 214.A O no hydrogen 2.983 N/A THR 217.A OG1 THR 217.A O no hydrogen 2.259 N/A TYR 218.A N ILE 215.A O no hydrogen 3.327 N/A TYR 218.A OH LEU 117.A O no hydrogen 3.260 N/A GLY 219.A N GLU 214.A O no hydrogen 3.125 N/A LYS 220.A N THR 217.A O no hydrogen 3.441 N/A LEU 226.A N TRP 223.A O no hydrogen 2.980 N/A SER 227.A N GLU 230.A OE1 no hydrogen 3.400 N/A SER 227.A OG THR 229.A OG1 no hydrogen 3.339 N/A THR 229.A OG1 SER 227.A OG no hydrogen 3.339 N/A ALA 231.A N SER 227.A O no hydrogen 2.818 N/A ILE 232.A N ASN 228.A O no hydrogen 3.197 N/A ASP 233.A N THR 229.A O no hydrogen 3.048 N/A CYS 234.A N GLU 230.A O no hydrogen 3.114 N/A CYS 234.A SG GLU 230.A O no hydrogen 3.615 N/A ILE 235.A N ALA 231.A O no hydrogen 3.080 N/A THR 236.A N ILE 232.A O no hydrogen 2.847 N/A THR 236.A OG1 ILE 232.A O no hydrogen 2.795 N/A GLN 237.A N ASP 233.A O no hydrogen 2.870 N/A GLY 238.A N CYS 234.A O no hydrogen 2.927 N/A ARG 239.A N CYS 234.A O no hydrogen 2.714 N/A ARG 243.A NH1 CYS 247.A O no hydrogen 2.727 N/A CYS 247.A SG PRO 248.A O no hydrogen 3.309 N/A VAL 251.A N PRO 248.A O no hydrogen 2.928 N/A TYR 252.A N PRO 248.A O no hydrogen 3.003 N/A TYR 252.A OH LEU 241.A O no hydrogen 2.345 N/A ALA 253.A N PRO 249.A O no hydrogen 2.947 N/A ILE 254.A N VAL 251.A O no hydrogen 2.943 N/A MET 255.A N VAL 251.A O no hydrogen 3.355 N/A ARG 256.A N TYR 252.A O no hydrogen 3.192 N/A GLY 257.A N ALA 253.A O no hydrogen 3.403 N/A CYS 258.A N MET 255.A O no hydrogen 2.840 N/A CYS 258.A SG ILE 254.A O no hydrogen 3.460 N/A TRP 259.A N ARG 256.A O no hydrogen 2.898 N/A ARG 261.A NH1 THR 236.A O no hydrogen 2.844 N/A ARG 261.A NH2 THR 236.A O no hydrogen 2.536 N/A GLN 265.A N GLU 262.A O no hydrogen 2.904 N/A ARG 266.A N PRO 263.A O no hydrogen 3.370 N/A ARG 266.A NE GLN 260.A O no hydrogen 2.849 N/A ARG 266.A NH1 GLU 192.A OE2 no hydrogen 2.775 N/A ARG 266.A NH1 GLU 202.A O no hydrogen 2.672 N/A ARG 266.A NH2 GLU 192.A OE1 no hydrogen 2.790 N/A ARG 266.A NH2 GLU 192.A OE2 no hydrogen 3.131 N/A ARG 266.A NH2 GLN 260.A O no hydrogen 3.434 N/A HIS 267.A N GLY 257.A O no hydrogen 3.277 N/A ASP 271.A N SER 268.A OG no hydrogen 3.252 N/A VAL 272.A N SER 268.A O no hydrogen 3.154 N/A HIS 273.A N ILE 269.A O no hydrogen 2.974 N/A ALA 274.A N LYS 270.A O no hydrogen 3.088 N/A ARG 275.A N ASP 271.A O no hydrogen 3.201 N/A LEU 276.A N VAL 272.A O no hydrogen 3.021 N/A GLN 277.A N HIS 273.A O no hydrogen 2.748 N/A ALA 278.A N ALA 274.A O no hydrogen 3.189 N/A LEU 279.A N ARG 275.A O no hydrogen 3.143 N/A ALA 280.A N LEU 276.A O no hydrogen 2.952 N/A GLN 281.A N GLN 277.A O no hydrogen 3.038 N/A TYR 286.A N PRO 283.A O no hydrogen 2.871 N/A LEU 287.A N PRO 283.A O no hydrogen 3.172 N/A ASP 288.A N PRO 284.A O no hydrogen 2.757 N/A LEU 290.A N LEU 287.A O no hydrogen 3.337 N/A GLY 291.A N VAL 289.A O no hydrogen 3.338 N/A