Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8p81_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N ASP 3.A OD1 no hydrogen 3.108 N/A ASP 3.A N ASP 3.A OD1 no hydrogen 2.508 N/A GLY 5.A N ILE 77.A O no hydrogen 2.840 N/A ARG 7.A NH2 ASP 31.A OD1 no hydrogen 2.710 N/A ARG 7.A NH2 ASP 31.A OD2 no hydrogen 3.338 N/A ARG 7.A NH2 ASP 33.A OD2 no hydrogen 3.099 N/A CYS 8.A SG ASP 10.A OD1 no hydrogen 3.199 N/A CYS 8.A SG THR 79.A O no hydrogen 3.912 N/A CYS 8.A SG ASP 80.A O no hydrogen 3.091 N/A VAL 9.A N THR 79.A O no hydrogen 2.551 N/A LYS 11.A N CYS 8.A O no hydrogen 3.168 N/A PHE 12.A N VAL 9.A O no hydrogen 2.894 N/A ASP 13.A N LYS 30.A O no hydrogen 2.918 N/A ILE 15.A N LYS 28.A O no hydrogen 2.639 N/A GLY 16.A N LYS 28.A O no hydrogen 3.411 N/A ILE 18.A N VAL 26.A O no hydrogen 2.883 N/A GLY 21.A N GLY 24.A O no hydrogen 2.795 N/A THR 22.A OG1 ASP 144.A OD2 no hydrogen 3.553 N/A THR 22.A OG1 ASP 162.A OD1 no hydrogen 2.631 N/A THR 22.A OG1 ASP 162.A OD2 no hydrogen 3.069 N/A TYR 23.A OH GLU 59.A OE1 no hydrogen 2.242 N/A VAL 26.A N GLY 19.A O no hydrogen 2.865 N/A TYR 27.A N LEU 40.A O no hydrogen 2.871 N/A LYS 28.A N GLY 16.A O no hydrogen 2.828 N/A LYS 28.A NZ TYR 100.A OH no hydrogen 3.492 N/A ALA 29.A N VAL 38.A O no hydrogen 3.091 N/A LYS 30.A N ASP 13.A O no hydrogen 3.130 N/A ASP 31.A N GLU 36.A O no hydrogen 3.075 N/A LYS 32.A N LYS 11.A O no hydrogen 3.052 N/A LYS 32.A NZ ASP 10.A O no hydrogen 3.130 N/A ASP 33.A N ASP 31.A OD1 no hydrogen 3.030 N/A GLY 35.A N ASP 31.A O no hydrogen 2.755 N/A GLU 36.A N THR 34.A OG1 no hydrogen 3.219 N/A VAL 38.A N ALA 29.A O no hydrogen 2.929 N/A ALA 39.A N PHE 98.A O no hydrogen 3.002 N/A LEU 40.A N TYR 27.A O no hydrogen 2.824 N/A LYS 41.A N LEU 96.A O no hydrogen 2.973 N/A LYS 41.A NZ GLU 59.A OE1 no hydrogen 3.057 N/A LYS 41.A NZ GLU 59.A OE2 no hydrogen 3.372 N/A LYS 41.A NZ ASP 162.A OD1 no hydrogen 2.653 N/A VAL 43.A N PHE 94.A O no hydrogen 2.921 N/A THR 55.A OG1 GLY 164.A O no hydrogen 2.257 N/A ILE 57.A N PRO 53.A O no hydrogen 2.931 N/A ARG 58.A N ILE 54.A O no hydrogen 2.684 N/A GLU 59.A N THR 55.A O no hydrogen 3.073 N/A ILE 60.A N ALA 56.A O no hydrogen 2.934 N/A LYS 61.A N ILE 57.A O no hydrogen 2.833 N/A ILE 62.A N ARG 58.A O no hydrogen 2.850 N/A LEU 63.A N GLU 59.A O no hydrogen 2.972 N/A ARG 64.A N ILE 60.A O no hydrogen 3.237 N/A GLN 65.A N ILE 62.A O no hydrogen 2.920 N/A SER 70.A N HIS 68.A ND1 no hydrogen 3.313 N/A SER 70.A OG GLN 127.A O no hydrogen 3.150 N/A SER 70.A OG ILE 158.A O no hydrogen 3.347 N/A VAL 72.A N LEU 160.A O no hydrogen 2.827 N/A ASN 73.A N GLU 99.A OE2 no hydrogen 3.138 N/A LYS 75.A N VAL 97.A O no hydrogen 2.753 N/A VAL 78.A N TYR 95.A O no hydrogen 3.119 N/A THR 79.A N ARG 7.A O no hydrogen 2.809 N/A ASP 80.A N ALA 93.A O no hydrogen 2.854 N/A LYS 88.A N ASP 86.A OD1 no hydrogen 3.413 N/A LYS 89.A N ASP 86.A O no hydrogen 2.849 N/A LYS 89.A NZ ASP 86.A OD2 no hydrogen 3.183 N/A ASP 90.A N PHE 87.A O no hydrogen 3.260 N/A LYS 91.A NZ LYS 88.A O no hydrogen 2.942 N/A PHE 94.A N VAL 43.A O no hydrogen 3.286 N/A TYR 95.A N VAL 78.A O no hydrogen 2.833 N/A TYR 95.A OH ASP 80.A OD1 no hydrogen 3.205 N/A TYR 95.A OH ASP 80.A OD2 no hydrogen 2.920 N/A LEU 96.A N LYS 41.A O no hydrogen 2.781 N/A VAL 97.A N GLU 76.A O no hydrogen 2.901 N/A PHE 98.A N ALA 39.A O no hydrogen 2.859 N/A GLU 99.A N ASN 73.A O no hydrogen 3.481 N/A ASP 102.A N ASN 153.A OD1 no hydrogen 3.022 N/A HIS 103.A N LEU 152.A O no hydrogen 2.675 N/A HIS 103.A NE2 ASN 154.A OD1 no hydrogen 2.787 N/A LEU 105.A N ILE 150.A O no hydrogen 2.869 N/A GLY 107.A N ASP 104.A OD2 no hydrogen 3.333 N/A LEU 108.A N ASP 104.A O no hydrogen 3.403 N/A LEU 109.A N LEU 105.A O no hydrogen 3.251 N/A GLU 110.A N MET 106.A O no hydrogen 3.154 N/A SER 111.A N GLY 107.A O no hydrogen 3.231 N/A SER 111.A OG LEU 108.A O no hydrogen 3.140 N/A SER 117.A N HIS 120.A ND1 no hydrogen 3.033 N/A ILE 121.A N SER 117.A O no hydrogen 3.205 N/A LYS 122.A N GLU 118.A O no hydrogen 2.888 N/A LYS 122.A NZ PHE 303.A O no hydrogen 3.073 N/A SER 123.A N ASP 119.A O no hydrogen 3.035 N/A PHE 124.A N HIS 120.A O no hydrogen 3.026 N/A MET 125.A N ILE 121.A O no hydrogen 2.943 N/A LYS 126.A N LYS 122.A O no hydrogen 3.284 N/A GLN 127.A N SER 123.A O no hydrogen 3.281 N/A GLN 127.A NE2 GLY 156.A O no hydrogen 2.864 N/A LEU 128.A N PHE 124.A O no hydrogen 3.097 N/A MET 129.A N MET 125.A O no hydrogen 3.074 N/A GLU 130.A N LYS 126.A O no hydrogen 2.970 N/A GLY 131.A N GLN 127.A O no hydrogen 3.117 N/A LEU 132.A N LEU 128.A O no hydrogen 3.011 N/A GLU 133.A N MET 129.A O no hydrogen 2.914 N/A TYR 134.A N GLU 130.A O no hydrogen 3.283 N/A CYS 135.A N GLY 131.A O no hydrogen 3.279 N/A CYS 135.A SG GLY 131.A O no hydrogen 3.182 N/A HIS 136.A N LEU 132.A O no hydrogen 3.009 N/A LYS 137.A N GLU 133.A O no hydrogen 2.872 N/A LYS 138.A N TYR 134.A O no hydrogen 3.157 N/A LYS 138.A NZ TYR 134.A OH no hydrogen 3.306 N/A ASN 139.A N HIS 136.A O no hydrogen 3.058 N/A PHE 140.A N CYS 135.A O no hydrogen 2.810 N/A LEU 141.A N ARG 167.A O no hydrogen 2.963 N/A HIS 142.A N ASP 202.A OD2 no hydrogen 2.813 N/A HIS 142.A NE2 ALA 161.A O no hydrogen 3.128 N/A ARG 143.A N ASP 202.A OD1 no hydrogen 2.950 N/A ARG 143.A NE LEU 165.A O no hydrogen 2.632 N/A ARG 143.A NH1 TYR 197.A OH no hydrogen 3.310 N/A ARG 143.A NH2 LEU 165.A O no hydrogen 3.106 N/A LYS 146.A NZ THR 182.A OG1 no hydrogen 2.819 N/A CYS 147.A SG TYR 185.A OH no hydrogen 3.383 N/A CYS 147.A SG GLU 212.A OE1 no hydrogen 3.333 N/A CYS 147.A SG GLU 212.A OE2 no hydrogen 3.377 N/A ASN 149.A N LYS 146.A O no hydrogen 3.169 N/A ASN 149.A ND2 ASP 144.A O no hydrogen 3.048 N/A ILE 150.A N CYS 147.A O no hydrogen 3.413 N/A LEU 151.A N LYS 159.A O no hydrogen 2.950 N/A LEU 152.A N HIS 103.A O no hydrogen 2.764 N/A ASN 153.A N GLN 157.A O no hydrogen 3.137 N/A GLY 156.A N ASN 153.A O no hydrogen 3.121 N/A ILE 158.A N GLN 127.A OE1 no hydrogen 2.595 N/A LYS 159.A N LEU 151.A O no hydrogen 3.018 N/A LYS 159.A NZ GLU 99.A OE2 no hydrogen 2.708 N/A LEU 160.A N SER 70.A O no hydrogen 2.941 N/A ALA 161.A N ASN 149.A O no hydrogen 3.074 N/A ALA 166.A N PHE 163.A O no hydrogen 3.265 N/A ARG 167.A N LEU 141.A O no hydrogen 3.400 N/A ARG 167.A NE LEU 168.A O no hydrogen 3.213 N/A TYR 169.A N ASN 139.A O no hydrogen 3.318 N/A TYR 169.A OH HIS 136.A O no hydrogen 2.984 N/A ASN 170.A N TYR 177.A OH no hydrogen 2.823 N/A GLU 172.A N ASN 170.A OD1 no hydrogen 3.233 N/A TYR 177.A N GLU 195.A O no hydrogen 2.592 N/A ASN 178.A ND2 LEU 190.A O no hydrogen 3.216 N/A ASN 178.A ND2 GLU 194.A O no hydrogen 2.801 N/A LYS 179.A NZ GLU 225.A OE2 no hydrogen 3.394 N/A VAL 180.A N ASN 178.A O no hydrogen 2.673 N/A ILE 181.A N ARG 143.A O no hydrogen 2.740 N/A THR 182.A OG1 ASP 144.A OD1 no hydrogen 3.124 N/A TRP 184.A NE1 ALA 222.A O no hydrogen 2.771 N/A TYR 185.A N THR 182.A O no hydrogen 3.014 N/A TYR 185.A OH GLU 212.A OE1 no hydrogen 2.954 N/A ARG 186.A N LEU 183.A O no hydrogen 3.364 N/A ARG 186.A NE ILE 181.A O no hydrogen 3.078 N/A ARG 186.A NH1 GLU 225.A OE2 no hydrogen 3.276 N/A ARG 186.A NH2 ILE 181.A O no hydrogen 3.334 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.624 N/A LEU 191.A N PRO 187.A O no hydrogen 3.397 N/A LEU 192.A N PRO 188.A O no hydrogen 3.013 N/A GLY 193.A N LEU 190.A O no hydrogen 3.176 N/A GLU 194.A N GLU 189.A O no hydrogen 3.004 N/A ARG 196.A N GLU 194.A OE2 no hydrogen 2.565 N/A ARG 196.A NH1 SER 174.A OG no hydrogen 2.864 N/A ALA 200.A N THR 198.A OG1 no hydrogen 3.351 N/A ILE 201.A N THR 198.A O no hydrogen 3.384 N/A ASP 202.A N PRO 199.A O no hydrogen 3.322 N/A TRP 204.A N ALA 200.A O no hydrogen 3.322 N/A SER 205.A N ILE 201.A O no hydrogen 3.463 N/A SER 205.A OG TYR 185.A O no hydrogen 2.826 N/A CYS 206.A N ASP 202.A O no hydrogen 3.011 N/A CYS 206.A SG ASP 202.A O no hydrogen 3.299 N/A GLY 207.A N VAL 203.A O no hydrogen 2.763 N/A CYS 208.A N TRP 204.A O no hydrogen 2.919 N/A CYS 208.A SG TRP 204.A O no hydrogen 3.585 N/A ILE 209.A N SER 205.A O no hydrogen 2.979 N/A LEU 210.A N CYS 206.A O no hydrogen 2.996 N/A GLY 211.A N GLY 207.A O no hydrogen 3.279 N/A GLU 212.A N CYS 208.A O no hydrogen 3.122 N/A LEU 213.A N ILE 209.A O no hydrogen 2.871 N/A LEU 213.A N LEU 210.A O no hydrogen 3.146 N/A THR 215.A N GLY 211.A O no hydrogen 3.280 N/A THR 215.A OG1 GLY 211.A O no hydrogen 3.109 N/A THR 215.A OG1 LYS 217.A O no hydrogen 2.925 N/A LYS 216.A N GLU 212.A O no hydrogen 2.745 N/A LYS 216.A NZ VAL 114.A O no hydrogen 2.678 N/A GLN 228.A N LEU 224.A O no hydrogen 2.944 N/A LEU 229.A N GLU 225.A O no hydrogen 3.051 N/A GLU 230.A N LEU 226.A O no hydrogen 3.003 N/A LEU 231.A N ALA 227.A O no hydrogen 3.082 N/A ILE 232.A N GLN 228.A O no hydrogen 3.147 N/A SER 233.A N LEU 229.A O no hydrogen 3.048 N/A SER 233.A OG LEU 229.A O no hydrogen 2.831 N/A ARG 234.A N GLU 230.A O no hydrogen 3.124 N/A CYS 236.A N ILE 232.A O no hydrogen 2.850 N/A CYS 236.A SG LEU 285.A O no hydrogen 3.785 N/A SER 238.A N TYR 262.A O no hydrogen 2.885 N/A SER 238.A OG LYS 260.A O no hydrogen 3.038 N/A CYS 240.A SG SER 238.A O no hydrogen 3.831 N/A VAL 247.A N TRP 244.A O no hydrogen 3.100 N/A LEU 250.A N VAL 247.A O no hydrogen 3.208 N/A TYR 252.A N LEU 192.A O no hydrogen 2.935 N/A MET 256.A N TYR 252.A O no hydrogen 2.930 N/A LYS 259.A N GLU 230.A OE1 no hydrogen 3.362 N/A LYS 259.A NZ GLU 230.A OE2 no hydrogen 3.206 N/A TYR 262.A N SER 238.A OG no hydrogen 2.624 N/A TYR 262.A OH GLU 230.A OE2 no hydrogen 2.808 N/A ARG 264.A NE ASP 282.A OD1 no hydrogen 2.822 N/A ARG 264.A NH1 CYS 236.A O no hydrogen 2.912 N/A ARG 264.A NH1 LEU 285.A O no hydrogen 3.206 N/A ARG 264.A NH2 ASP 282.A OD1 no hydrogen 2.975 N/A ARG 264.A NH2 LEU 285.A O no hydrogen 2.549 N/A ARG 265.A N LEU 235.A O no hydrogen 3.069 N/A ARG 265.A NH1 GLU 268.A OE2 no hydrogen 2.643 N/A ARG 265.A NH1 GLU 269.A OE1 no hydrogen 3.358 N/A ARG 267.A NE ASP 282.A OD2 no hydrogen 2.656 N/A ARG 267.A NH1 ASP 279.A OD1 no hydrogen 2.774 N/A ARG 267.A NH2 ASP 279.A OD1 no hydrogen 2.778 N/A GLU 269.A N ARG 265.A O no hydrogen 3.109 N/A PHE 270.A N LEU 266.A O no hydrogen 3.156 N/A SER 271.A OG GLU 268.A O no hydrogen 3.463 N/A ILE 273.A N PHE 270.A O no hydrogen 3.203 N/A LEU 278.A N PRO 274.A O no hydrogen 2.948 N/A ASP 279.A N SER 275.A O no hydrogen 3.229 N/A LEU 281.A N ALA 277.A O no hydrogen 2.843 N/A ASP 282.A N LEU 278.A O no hydrogen 2.836 N/A HIS 283.A N ASP 279.A O no hydrogen 3.411 N/A HIS 283.A NE2 LYS 291.A O no hydrogen 3.205 N/A MET 284.A N LEU 280.A O no hydrogen 3.021 N/A LEU 285.A N LEU 281.A O no hydrogen 3.151 N/A THR 286.A OG1 ASP 282.A O no hydrogen 3.333 N/A THR 286.A OG1 HIS 283.A O no hydrogen 2.942 N/A SER 290.A N ASP 288.A OD1 no hydrogen 3.064 N/A SER 290.A OG ASP 288.A OD1 no hydrogen 2.424 N/A ARG 292.A N PRO 289.A O no hydrogen 3.391 N/A ARG 292.A NE THR 286.A O no hydrogen 3.065 N/A ARG 292.A NH1 GLU 189.A OE2 no hydrogen 3.072 N/A ARG 292.A NH1 ALA 200.A O no hydrogen 2.442 N/A ARG 292.A NH2 GLU 189.A OE1 no hydrogen 2.972 N/A ARG 292.A NH2 GLU 189.A OE2 no hydrogen 3.301 N/A ARG 292.A NH2 THR 286.A O no hydrogen 3.133 N/A ARG 292.A NH2 LEU 287.A O no hydrogen 3.489 N/A THR 298.A N THR 294.A O no hydrogen 3.190 N/A THR 298.A OG1 ALA 295.A O no hydrogen 2.575 N/A GLN 300.A N GLN 297.A O no hydrogen 3.109 N/A SER 301.A N THR 298.A O no hydrogen 3.279 N/A LEU 304.A N SER 301.A O no hydrogen 3.020 N/A LYS 305.A N SER 301.A O no hydrogen 2.678 N/A