Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wnq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 2.A ND1 no hydrogen 3.253 N/A HIS 1.A NE2 VAL 158.A O no hydrogen 2.963 N/A ALA 4.A N HIS 1.A O no hydrogen 2.924 N/A THR 5.A OG1 HIS 1.A O no hydrogen 3.442 N/A THR 5.A OG1 HIS 2.A O no hydrogen 2.619 N/A LEU 7.A N ALA 4.A O no hydrogen 2.669 N/A ARG 8.A N THR 5.A O no hydrogen 3.088 N/A ARG 8.A NE ASP 205.A OD2 no hydrogen 2.562 N/A VAL 10.A N ASP 42.A OD2 no hydrogen 2.865 N/A MET 11.A N GLY 207.A O no hydrogen 2.909 N/A ALA 12.A N GLY 43.A O no hydrogen 3.266 N/A ALA 13.A N GLY 209.A O no hydrogen 2.955 N/A LEU 14.A N TYR 45.A O no hydrogen 2.952 N/A THR 16.A N GLU 52.A OE1 no hydrogen 3.277 N/A THR 16.A OG1 GLY 51.A O no hydrogen 2.728 N/A ASP 19.A N ALA 23.A O no hydrogen 2.772 N/A GLN 21.A N ASP 19.A OD1 no hydrogen 2.648 N/A ALA 23.A N ASP 19.A OD1 no hydrogen 3.197 N/A ASP 25.A N PRO 17.A O no hydrogen 2.903 N/A SER 28.A N ASP 25.A OD1 no hydrogen 3.346 N/A SER 28.A OG ASP 25.A OD1 no hydrogen 3.421 N/A SER 28.A OG VAL 266.A O no hydrogen 3.113 N/A LEU 29.A N ASP 25.A O no hydrogen 3.176 N/A ARG 30.A N LYS 26.A O no hydrogen 3.271 N/A ARG 30.A NH1 GLU 70.A OE1 no hydrogen 2.484 N/A ARG 30.A NH1 GLU 71.A OE2 no hydrogen 2.836 N/A ARG 30.A NH2 GLU 70.A OE1 no hydrogen 3.180 N/A ARG 31.A N ALA 27.A O no hydrogen 2.731 N/A ARG 31.A NH1 ASP 265.A O no hydrogen 3.489 N/A ARG 31.A NH2 SER 268.A OG no hydrogen 2.616 N/A LEU 32.A N LEU 29.A O no hydrogen 3.241 N/A VAL 33.A N LEU 29.A O no hydrogen 3.218 N/A GLN 34.A N ARG 30.A O no hydrogen 3.289 N/A PHE 35.A N ARG 31.A O no hydrogen 3.269 N/A ASN 36.A N LEU 32.A O no hydrogen 2.941 N/A ASN 36.A ND2 LEU 32.A O no hydrogen 2.767 N/A ASN 36.A ND2 ASN 213.A OD1 no hydrogen 3.098 N/A ILE 37.A N VAL 33.A O no hydrogen 3.280 N/A ILE 37.A N GLN 34.A O no hydrogen 3.214 N/A GLN 39.A N ASN 36.A O no hydrogen 3.272 N/A GLN 39.A NE2 TYR 212.A O no hydrogen 3.268 N/A GLN 39.A NE2 ASN 213.A O no hydrogen 3.170 N/A ASP 42.A N VAL 10.A O no hydrogen 3.036 N/A LEU 44.A N LYS 77.A O no hydrogen 2.827 N/A TYR 45.A N ALA 12.A O no hydrogen 2.832 N/A TYR 45.A OH SER 106.A OG no hydrogen 3.132 N/A VAL 46.A N ILE 79.A O no hydrogen 2.742 N/A GLU 52.A N SER 49.A O no hydrogen 2.941 N/A ALA 53.A N GLY 48.A O no hydrogen 3.376 N/A VAL 55.A N GLU 52.A O no hydrogen 3.220 N/A GLN 56.A N ALA 53.A O no hydrogen 3.091 N/A GLN 56.A NE2 GLU 52.A O no hydrogen 3.476 N/A SER 57.A N GLU 60.A OE1 no hydrogen 2.857 N/A SER 57.A OG GLU 60.A OE1 no hydrogen 2.930 N/A ARG 61.A N SER 57.A O no hydrogen 3.129 N/A ARG 61.A NH1 GLY 83.A O no hydrogen 3.141 N/A ARG 61.A NH2 HIS 81.A O no hydrogen 3.138 N/A ARG 61.A NH2 GLY 83.A O no hydrogen 2.983 N/A GLU 62.A N LEU 58.A O no hydrogen 2.942 N/A GLN 63.A N SER 59.A O no hydrogen 3.064 N/A VAL 64.A N GLU 60.A O no hydrogen 3.169 N/A LEU 65.A N ARG 61.A O no hydrogen 3.059 N/A GLU 66.A N GLU 62.A O no hydrogen 2.858 N/A ILE 67.A N GLN 63.A O no hydrogen 3.233 N/A VAL 68.A N VAL 64.A O no hydrogen 3.225 N/A ALA 69.A N LEU 65.A O no hydrogen 3.068 N/A GLU 70.A N GLU 66.A O no hydrogen 3.032 N/A GLU 71.A N ILE 67.A O no hydrogen 3.086 N/A ALA 72.A N VAL 68.A O no hydrogen 2.955 N/A LYS 73.A N ALA 69.A O no hydrogen 3.272 N/A LYS 75.A N ALA 72.A O no hydrogen 2.722 N/A LYS 77.A N ASP 42.A O no hydrogen 3.077 N/A LYS 77.A NZ ASN 6.A O no hydrogen 3.333 N/A LEU 78.A N ASP 103.A OD2 no hydrogen 3.430 N/A ILE 79.A N LEU 44.A O no hydrogen 2.913 N/A ALA 80.A N ALA 104.A O no hydrogen 2.830 N/A HIS 81.A N VAL 46.A O no hydrogen 2.642 N/A VAL 82.A N SER 106.A O no hydrogen 2.768 N/A CYS 84.A N SER 90.A OG no hydrogen 2.845 N/A CYS 84.A SG VAL 82.A O no hydrogen 3.934 N/A CYS 84.A SG GLU 89.A OE1 no hydrogen 3.815 N/A THR 87.A OG1 HIS 123.A ND1 no hydrogen 2.744 N/A GLU 89.A N SER 86.A OG no hydrogen 3.057 N/A SER 90.A N SER 86.A O no hydrogen 3.214 N/A SER 90.A OG VAL 82.A O no hydrogen 3.536 N/A SER 90.A OG SER 86.A O no hydrogen 2.907 N/A GLN 91.A N THR 87.A O no hydrogen 2.965 N/A GLN 91.A NE2 ALA 126.A O no hydrogen 3.493 N/A GLN 91.A NE2 SER 130.A OG no hydrogen 3.052 N/A GLN 92.A N ALA 88.A O no hydrogen 3.084 N/A GLN 92.A NE2 GLU 62.A OE2 no hydrogen 3.401 N/A LEU 93.A N GLU 89.A O no hydrogen 3.025 N/A ALA 94.A N SER 90.A O no hydrogen 2.887 N/A ALA 95.A N GLN 91.A O no hydrogen 2.985 N/A SER 96.A N GLN 92.A O no hydrogen 3.120 N/A SER 96.A OG GLU 62.A OE2 no hydrogen 2.587 N/A SER 96.A OG GLN 92.A O no hydrogen 3.186 N/A ALA 97.A N LEU 93.A O no hydrogen 2.800 N/A LYS 98.A N ALA 94.A O no hydrogen 3.014 N/A ARG 99.A N ALA 95.A O no hydrogen 2.867 N/A ARG 99.A NH2 SER 96.A OG no hydrogen 2.874 N/A TYR 100.A N SER 96.A O no hydrogen 3.033 N/A GLY 101.A N LYS 98.A O no hydrogen 3.071 N/A PHE 102.A N ALA 97.A O no hydrogen 3.196 N/A ASP 103.A N LEU 78.A O no hydrogen 2.794 N/A ALA 104.A N LEU 78.A O no hydrogen 3.223 N/A VAL 105.A N PRO 135.A O no hydrogen 3.044 N/A SER 106.A N ALA 80.A O no hydrogen 2.899 N/A SER 106.A OG TYR 45.A OH no hydrogen 3.132 N/A SER 106.A OG VAL 137.A O no hydrogen 2.233 N/A ALA 107.A N VAL 137.A O no hydrogen 3.346 N/A TYR 113.A N PHE 111.A O no hydrogen 2.836 N/A SER 116.A N GLU 119.A OE1 no hydrogen 2.819 N/A GLU 119.A N SER 116.A OG no hydrogen 2.906 N/A HIS 120.A N SER 116.A O no hydrogen 2.857 N/A CYS 121.A N PHE 117.A O no hydrogen 2.983 N/A CYS 121.A SG PHE 117.A O no hydrogen 3.617 N/A ASP 122.A N GLU 118.A O no hydrogen 3.001 N/A HIS 123.A N GLU 119.A O no hydrogen 3.155 N/A HIS 123.A ND1 THR 87.A OG1 no hydrogen 2.744 N/A TYR 124.A N HIS 120.A O no hydrogen 3.069 N/A TYR 124.A OH ALA 107.A O no hydrogen 2.808 N/A ARG 125.A N CYS 121.A O no hydrogen 2.881 N/A ARG 125.A NH1 ASP 122.A OD1 no hydrogen 2.853 N/A ALA 126.A N ASP 122.A O no hydrogen 2.969 N/A ILE 127.A N HIS 123.A O no hydrogen 3.135 N/A ILE 128.A N TYR 124.A O no hydrogen 2.863 N/A ASP 129.A N ARG 125.A O no hydrogen 3.068 N/A SER 130.A N ALA 126.A O no hydrogen 3.101 N/A SER 130.A OG ALA 126.A O no hydrogen 3.417 N/A ALA 131.A N ILE 127.A O no hydrogen 3.026 N/A ASP 132.A N ILE 128.A O no hydrogen 3.339 N/A ASP 132.A N ASP 129.A O no hydrogen 3.247 N/A LEU 134.A N ALA 131.A O no hydrogen 3.224 N/A MET 136.A N GLY 162.A O no hydrogen 3.069 N/A VAL 137.A N VAL 105.A O no hydrogen 2.711 N/A VAL 138.A N ALA 165.A O no hydrogen 3.033 N/A TYR 139.A N ALA 107.A O no hydrogen 3.251 N/A ASN 140.A N LYS 167.A O no hydrogen 2.850 N/A SER 145.A N ILE 141.A O no hydrogen 2.884 N/A SER 145.A OG ILE 141.A O no hydrogen 2.632 N/A GLY 146.A N PRO 142.A O no hydrogen 3.028 N/A VAL 147.A N SER 145.A OG no hydrogen 2.961 N/A THR 150.A N GLN 153.A OE1 no hydrogen 2.784 N/A THR 150.A OG1 GLN 153.A OE1 no hydrogen 2.648 N/A GLN 153.A N THR 150.A OG1 no hydrogen 3.143 N/A ILE 154.A N THR 150.A O no hydrogen 2.970 N/A ASN 155.A N LEU 151.A O no hydrogen 2.877 N/A THR 156.A N ASP 152.A O no hydrogen 3.011 N/A THR 156.A OG1 ASP 152.A O no hydrogen 3.215 N/A LEU 157.A N GLN 153.A O no hydrogen 2.972 N/A VAL 158.A N ILE 154.A O no hydrogen 3.013 N/A THR 159.A N THR 156.A O no hydrogen 3.351 N/A THR 159.A OG1 ASN 155.A O no hydrogen 2.790 N/A THR 159.A OG1 THR 156.A O no hydrogen 3.078 N/A LEU 160.A N LEU 157.A O no hydrogen 3.304 N/A VAL 163.A N LEU 160.A O no hydrogen 2.912 N/A GLY 164.A N MET 136.A O no hydrogen 3.101 N/A LEU 166.A N VAL 187.A O no hydrogen 3.039 N/A LYS 167.A N VAL 138.A O no hydrogen 2.796 N/A GLN 168.A N TYR 189.A O no hydrogen 3.029 N/A THR 169.A N ASN 140.A O no hydrogen 2.770 N/A ASP 172.A N SER 170.A OG no hydrogen 3.238 N/A GLN 175.A N ASP 172.A OD1 no hydrogen 3.173 N/A MET 176.A N ASP 172.A O no hydrogen 3.022 N/A GLU 177.A N LEU 173.A O no hydrogen 3.191 N/A GLN 178.A N TYR 174.A O no hydrogen 3.004 N/A ILE 179.A N GLN 175.A O no hydrogen 3.046 N/A ARG 180.A N MET 176.A O no hydrogen 3.491 N/A ARG 180.A NE GLY 203.A O no hydrogen 3.140 N/A ARG 180.A NH1 HIS 183.A O no hydrogen 3.075 N/A ARG 180.A NH1 LEU 186.A O no hydrogen 2.906 N/A ARG 180.A NH2 LEU 186.A O no hydrogen 3.262 N/A ARG 180.A NH2 GLY 203.A O no hydrogen 2.980 N/A ARG 181.A N GLU 177.A O no hydrogen 2.856 N/A ARG 181.A NE GLU 177.A OE2 no hydrogen 3.232 N/A ARG 181.A NH2 GLU 177.A OE1 no hydrogen 2.918 N/A GLU 182.A N GLN 178.A O no hydrogen 3.083 N/A HIS 183.A N ILE 179.A O no hydrogen 2.943 N/A HIS 183.A N ARG 180.A O no hydrogen 3.279 N/A LEU 186.A N HIS 183.A O no hydrogen 3.288 N/A LEU 188.A N ASP 205.A OD1 no hydrogen 2.811 N/A TYR 189.A N LEU 166.A O no hydrogen 2.973 N/A TYR 189.A OH LEU 7.A O no hydrogen 2.394 N/A ASN 190.A N GLY 206.A O no hydrogen 2.948 N/A ASN 190.A ND2 TYR 192.A O no hydrogen 2.534 N/A GLY 191.A N GLN 168.A O no hydrogen 3.123 N/A ILE 195.A N TYR 192.A O no hydrogen 3.103 N/A PHE 196.A N ASP 193.A O no hydrogen 3.403 N/A ALA 197.A N GLN 238.A OE1 no hydrogen 2.664 N/A GLY 199.A N ILE 195.A O no hydrogen 2.675 N/A LEU 200.A N PHE 196.A O no hydrogen 2.786 N/A LEU 201.A N ALA 197.A O no hydrogen 3.146 N/A ALA 202.A N SER 198.A O no hydrogen 2.989 N/A GLY 203.A N GLY 199.A O no hydrogen 2.899 N/A GLY 203.A N LEU 200.A O no hydrogen 2.970 N/A ALA 204.A N GLY 199.A O no hydrogen 2.838 N/A GLY 207.A N GLY 9.A O no hydrogen 2.958 N/A ILE 208.A N ASN 190.A O no hydrogen 2.992 N/A GLY 209.A N MET 11.A O no hydrogen 3.338 N/A THR 211.A N ASP 193.A OD2 no hydrogen 3.026 N/A THR 211.A OG1 ASP 193.A OD2 no hydrogen 2.636 N/A THR 211.A OG1 TYR 219.A OH no hydrogen 2.827 N/A ASN 213.A N SER 210.A O no hydrogen 3.469 N/A ASN 213.A ND2 ALA 13.A O no hydrogen 2.883 N/A ASN 213.A ND2 SER 210.A O no hydrogen 2.984 N/A MET 215.A N THR 211.A O no hydrogen 3.212 N/A ARG 218.A N MET 215.A O no hydrogen 3.231 N/A TYR 219.A N GLY 216.A O no hydrogen 3.281 N/A TYR 219.A OH THR 211.A OG1 no hydrogen 2.827 N/A GLN 220.A NE2 GLY 40.A O no hydrogen 3.067 N/A GLN 220.A NE2 ASP 42.A OD2 no hydrogen 3.039 N/A GLY 221.A N TRP 217.A O no hydrogen 3.010 N/A ILE 222.A N ARG 218.A O no hydrogen 3.017 N/A VAL 223.A N TYR 219.A O no hydrogen 3.120 N/A LYS 224.A N GLN 220.A O no hydrogen 2.961 N/A LYS 224.A NZ GLU 228.A OE2 no hydrogen 2.531 N/A ALA 225.A N GLY 221.A O no hydrogen 2.730 N/A LEU 226.A N ILE 222.A O no hydrogen 2.782 N/A LYS 227.A N VAL 223.A O no hydrogen 2.850 N/A GLU 228.A N LYS 224.A O no hydrogen 2.723 N/A GLY 229.A N LEU 226.A O no hydrogen 2.931 N/A ASP 230.A N ALA 225.A O no hydrogen 2.646 N/A THR 233.A N ASP 230.A OD1 no hydrogen 3.369 N/A ALA 234.A N ASP 230.A O no hydrogen 3.487 N/A GLN 235.A N ILE 231.A O no hydrogen 2.986 N/A LYS 236.A N GLN 232.A O no hydrogen 2.966 N/A LEU 237.A N THR 233.A O no hydrogen 2.769 N/A GLN 238.A N ALA 234.A O no hydrogen 3.026 N/A GLN 238.A NE2 ASP 193.A O no hydrogen 3.065 N/A GLN 238.A NE2 GLN 238.A O no hydrogen 3.632 N/A THR 239.A N GLN 235.A O no hydrogen 3.001 N/A THR 239.A OG1 GLN 235.A O no hydrogen 3.308 N/A GLU 240.A N LYS 236.A O no hydrogen 3.047 N/A CYS 241.A N LEU 237.A O no hydrogen 2.822 N/A CYS 241.A SG LEU 237.A O no hydrogen 3.203 N/A ASN 242.A N GLN 238.A O no hydrogen 2.670 N/A ASN 242.A ND2 ASN 194.A O no hydrogen 3.312 N/A LYS 243.A N THR 239.A O no hydrogen 2.815 N/A VAL 244.A N GLU 240.A O no hydrogen 3.478 N/A ILE 245.A N CYS 241.A O no hydrogen 3.118 N/A ASP 246.A N ASN 242.A O no hydrogen 2.867 N/A LEU 248.A N VAL 244.A O no hydrogen 2.793 N/A ILE 249.A N ILE 245.A O no hydrogen 2.707 N/A LYS 250.A N ASP 246.A O no hydrogen 3.294 N/A THR 251.A N LEU 247.A O no hydrogen 2.899 N/A THR 251.A OG1 LEU 247.A O no hydrogen 3.479 N/A THR 251.A OG1 LEU 248.A O no hydrogen 3.376 N/A THR 251.A OG1 GLY 252.A O no hydrogen 2.953 N/A GLY 252.A N LEU 248.A O no hydrogen 3.059 N/A ARG 255.A NE THR 251.A O no hydrogen 3.152 N/A ARG 255.A NH1 THR 251.A O no hydrogen 2.814 N/A ARG 255.A NH2 GLY 277.A O no hydrogen 3.160 N/A GLY 256.A N GLY 252.A O no hydrogen 2.949 N/A LEU 257.A N VAL 253.A O no hydrogen 2.997 N/A LYS 258.A N PHE 254.A O no hydrogen 2.829 N/A LYS 258.A NZ THR 16.A O no hydrogen 3.075 N/A LYS 258.A NZ GLU 52.A OE2 no hydrogen 2.654 N/A LYS 258.A NZ LEU 271.A O no hydrogen 2.990 N/A THR 259.A N ARG 255.A O no hydrogen 2.604 N/A THR 259.A OG1 ARG 255.A O no hydrogen 3.050 N/A VAL 260.A N GLY 256.A O no hydrogen 2.851 N/A LEU 261.A N LEU 257.A O no hydrogen 3.233 N/A HIS 262.A N LYS 258.A O no hydrogen 2.814 N/A TYR 263.A N THR 259.A O no hydrogen 2.921 N/A MET 264.A N VAL 260.A O no hydrogen 2.958 N/A ASP 265.A N HIS 262.A O no hydrogen 3.196 N/A VAL 266.A N LEU 261.A O no hydrogen 2.644 N/A VAL 267.A N LEU 261.A O no hydrogen 3.285 N/A CYS 272.A SG GLU 52.A OE2 no hydrogen 3.558 N/A ARG 273.A NE GLN 22.A O no hydrogen 3.116 N/A ARG 273.A NH1 VAL 55.A O no hydrogen 3.093 N/A ARG 273.A NH1 GLU 60.A OE1 no hydrogen 3.113 N/A ARG 273.A NH1 GLU 60.A OE2 no hydrogen 3.047 N/A ARG 273.A NH2 GLN 22.A O no hydrogen 3.119 N/A ARG 273.A NH2 GLU 60.A OE2 no hydrogen 2.675 N/A PHE 276.A N ARG 273.A O no hydrogen 2.965 N/A LYS 282.A N ASP 280.A OD1 no hydrogen 3.208 N/A TYR 283.A N ASP 280.A O no hydrogen 3.380 N/A LEU 284.A N GLU 281.A O no hydrogen 3.255 N/A LEU 287.A N TYR 283.A O no hydrogen 3.000 N/A LYS 288.A N LEU 284.A O no hydrogen 2.752 N/A ALA 289.A N PRO 285.A O no hydrogen 2.800 N/A LEU 290.A N GLU 286.A O no hydrogen 2.808 N/A LEU 290.A N LEU 287.A O no hydrogen 3.016 N/A ALA 291.A N LEU 287.A O no hydrogen 2.909 N/A GLN 292.A N LYS 288.A O no hydrogen 3.357 N/A GLN 293.A N ALA 289.A O no hydrogen 3.286 N/A LEU 294.A N LEU 290.A O no hydrogen 3.134 N/A MET 295.A N ALA 291.A O no hydrogen 3.474 N/A GLN 296.A N GLN 292.A O no hydrogen 3.464 N/A ARG 298.A N LEU 294.A O no hydrogen 3.103 N/A ARG 298.A NH2 GLN 38.A O no hydrogen 2.832 N/A GLY 299.A N MET 295.A O no hydrogen 2.647 N/A