Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2wnn_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A NE2 VAL 159.A O no hydrogen 2.965 N/A ALA 5.A N HIS 2.A O no hydrogen 3.309 N/A THR 6.A N HIS 3.A O no hydrogen 3.473 N/A LEU 8.A N ALA 5.A O no hydrogen 2.850 N/A ARG 9.A N THR 6.A O no hydrogen 3.023 N/A ARG 9.A NE ASP 205.A OD2 no hydrogen 3.161 N/A VAL 11.A N ASP 43.A OD2 no hydrogen 2.803 N/A ALA 13.A N GLY 44.A O no hydrogen 3.177 N/A ALA 14.A N GLY 209.A O no hydrogen 2.772 N/A LEU 15.A N TYR 46.A O no hydrogen 3.218 N/A THR 17.A OG1 GLY 52.A O no hydrogen 2.669 N/A ASP 20.A N ALA 24.A O no hydrogen 2.767 N/A GLN 22.A N ASP 20.A OD1 no hydrogen 2.734 N/A GLN 23.A N ASP 20.A O no hydrogen 2.802 N/A GLN 23.A NE2 CYS 272.A O no hydrogen 3.150 N/A ALA 24.A N ASP 20.A OD1 no hydrogen 3.208 N/A ASP 26.A N PRO 18.A O no hydrogen 2.999 N/A LYS 27.A NZ GLN 64.A OE1 no hydrogen 3.331 N/A SER 29.A N ASP 26.A OD1 no hydrogen 2.969 N/A SER 29.A OG ASP 26.A OD2 no hydrogen 2.665 N/A LEU 30.A N ASP 26.A O no hydrogen 3.032 N/A ARG 31.A N LYS 27.A O no hydrogen 3.168 N/A ARG 31.A N ALA 28.A O no hydrogen 3.042 N/A ARG 31.A NH1 GLU 71.A OE1 no hydrogen 2.612 N/A ARG 31.A NH1 GLU 72.A OE2 no hydrogen 2.939 N/A ARG 31.A NH2 GLU 71.A OE1 no hydrogen 2.794 N/A ARG 32.A N ALA 28.A O no hydrogen 3.282 N/A LEU 33.A N SER 29.A O no hydrogen 3.177 N/A VAL 34.A N LEU 30.A O no hydrogen 3.413 N/A GLN 35.A N ARG 31.A O no hydrogen 3.249 N/A PHE 36.A N ARG 32.A O no hydrogen 2.594 N/A ASN 37.A N LEU 33.A O no hydrogen 2.797 N/A ASN 37.A ND2 LEU 33.A O no hydrogen 2.996 N/A ASN 37.A ND2 ASN 213.A OD1 no hydrogen 3.338 N/A ILE 38.A N VAL 34.A O no hydrogen 2.902 N/A GLN 39.A N GLN 35.A O no hydrogen 2.966 N/A GLN 40.A N ASN 37.A O no hydrogen 3.135 N/A GLN 40.A NE2 TYR 212.A O no hydrogen 3.044 N/A GLY 41.A N ILE 38.A O no hydrogen 3.213 N/A ASP 43.A N VAL 11.A O no hydrogen 2.967 N/A LEU 45.A N LYS 78.A O no hydrogen 2.866 N/A TYR 46.A N ALA 13.A O no hydrogen 2.824 N/A TYR 46.A OH HIS 82.A ND1 no hydrogen 3.364 N/A TYR 46.A OH SER 107.A OG no hydrogen 2.446 N/A VAL 47.A N ILE 80.A O no hydrogen 2.844 N/A SER 50.A OG TYR 140.A OH no hydrogen 2.683 N/A GLU 53.A N SER 50.A O no hydrogen 2.957 N/A ALA 54.A N GLY 49.A O no hydrogen 3.150 N/A VAL 56.A N GLU 53.A O no hydrogen 3.102 N/A GLN 57.A N ALA 54.A O no hydrogen 3.242 N/A SER 58.A N GLU 61.A OE1 no hydrogen 2.918 N/A GLU 61.A N SER 58.A OG no hydrogen 3.129 N/A ARG 62.A N SER 58.A O no hydrogen 2.961 N/A ARG 62.A NH1 GLY 84.A O no hydrogen 3.112 N/A ARG 62.A NH2 HIS 82.A O no hydrogen 3.003 N/A ARG 62.A NH2 GLY 84.A O no hydrogen 2.926 N/A GLU 63.A N LEU 59.A O no hydrogen 2.828 N/A GLN 64.A N SER 60.A O no hydrogen 2.864 N/A GLN 64.A NE2 SER 60.A O no hydrogen 3.494 N/A GLN 64.A NE2 SER 60.A OG no hydrogen 3.047 N/A VAL 65.A N GLU 61.A O no hydrogen 2.988 N/A LEU 66.A N ARG 62.A O no hydrogen 3.073 N/A GLU 67.A N GLU 63.A O no hydrogen 2.886 N/A ILE 68.A N GLN 64.A O no hydrogen 2.948 N/A VAL 69.A N VAL 65.A O no hydrogen 2.907 N/A ALA 70.A N LEU 66.A O no hydrogen 3.087 N/A GLU 71.A N GLU 67.A O no hydrogen 3.034 N/A ALA 73.A N VAL 69.A O no hydrogen 2.915 N/A LYS 74.A N ALA 70.A O no hydrogen 3.014 N/A LYS 76.A N ALA 73.A O no hydrogen 2.911 N/A ILE 77.A N ALA 73.A O no hydrogen 3.295 N/A LYS 78.A N ASP 43.A O no hydrogen 3.202 N/A LEU 79.A N ASP 104.A OD2 no hydrogen 2.809 N/A ILE 80.A N LEU 45.A O no hydrogen 2.919 N/A ALA 81.A N ALA 105.A O no hydrogen 2.805 N/A HIS 82.A N VAL 47.A O no hydrogen 2.839 N/A VAL 83.A N SER 107.A O no hydrogen 2.756 N/A CYS 85.A N SER 91.A OG no hydrogen 2.811 N/A CYS 85.A SG VAL 83.A O no hydrogen 3.676 N/A THR 88.A OG1 HIS 124.A ND1 no hydrogen 2.930 N/A GLU 90.A N SER 87.A OG no hydrogen 3.045 N/A SER 91.A N SER 87.A O no hydrogen 3.172 N/A SER 91.A OG SER 87.A O no hydrogen 2.813 N/A GLN 92.A N THR 88.A O no hydrogen 2.825 N/A GLN 92.A NE2 ALA 127.A O no hydrogen 3.269 N/A GLN 93.A N ALA 89.A O no hydrogen 2.965 N/A LEU 94.A N GLU 90.A O no hydrogen 3.160 N/A ALA 95.A N SER 91.A O no hydrogen 2.988 N/A ALA 96.A N GLN 92.A O no hydrogen 2.982 N/A SER 97.A N GLN 93.A O no hydrogen 3.091 N/A SER 97.A OG GLU 63.A OE2 no hydrogen 2.559 N/A SER 97.A OG GLN 93.A O no hydrogen 3.236 N/A ALA 98.A N LEU 94.A O no hydrogen 2.770 N/A LYS 99.A N ALA 95.A O no hydrogen 3.037 N/A ARG 100.A N ALA 96.A O no hydrogen 2.984 N/A ARG 100.A NH2 SER 97.A OG no hydrogen 3.031 N/A TYR 101.A N SER 97.A O no hydrogen 2.963 N/A GLY 102.A N LYS 99.A O no hydrogen 3.171 N/A PHE 103.A N ALA 98.A O no hydrogen 3.083 N/A ASP 104.A N LEU 79.A O no hydrogen 2.975 N/A ALA 105.A N LEU 79.A O no hydrogen 3.300 N/A VAL 106.A N PRO 136.A O no hydrogen 3.002 N/A SER 107.A N ALA 81.A O no hydrogen 2.691 N/A SER 107.A OG TYR 46.A OH no hydrogen 2.446 N/A SER 107.A OG VAL 138.A O no hydrogen 2.544 N/A ALA 108.A N VAL 138.A O no hydrogen 3.331 N/A THR 110.A N TYR 140.A O no hydrogen 3.250 N/A TYR 114.A N PHE 112.A O no hydrogen 2.938 N/A SER 117.A N GLU 120.A OE1 no hydrogen 2.897 N/A GLU 120.A N SER 117.A OG no hydrogen 3.061 N/A HIS 121.A N SER 117.A O no hydrogen 2.953 N/A HIS 121.A NE2 PRO 111.A O no hydrogen 3.351 N/A CYS 122.A N PHE 118.A O no hydrogen 2.917 N/A CYS 122.A SG PHE 118.A O no hydrogen 3.470 N/A ASP 123.A N GLU 119.A O no hydrogen 2.950 N/A HIS 124.A N GLU 120.A O no hydrogen 2.940 N/A HIS 124.A ND1 THR 88.A OG1 no hydrogen 2.930 N/A TYR 125.A N HIS 121.A O no hydrogen 3.143 N/A TYR 125.A OH ALA 108.A O no hydrogen 2.714 N/A ARG 126.A N CYS 122.A O no hydrogen 2.959 N/A ARG 126.A NH1 ASP 123.A OD1 no hydrogen 2.794 N/A ALA 127.A N ASP 123.A O no hydrogen 2.975 N/A ILE 128.A N HIS 124.A O no hydrogen 3.220 N/A ILE 129.A N TYR 125.A O no hydrogen 2.917 N/A ASP 130.A N ARG 126.A O no hydrogen 2.867 N/A SER 131.A N ALA 127.A O no hydrogen 3.128 N/A SER 131.A OG ALA 127.A O no hydrogen 3.503 N/A ALA 132.A N ILE 128.A O no hydrogen 2.846 N/A ASP 133.A N ASP 130.A O no hydrogen 3.254 N/A LEU 135.A N ALA 132.A O no hydrogen 3.155 N/A MET 137.A N GLY 163.A O no hydrogen 2.996 N/A VAL 138.A N VAL 106.A O no hydrogen 2.849 N/A VAL 139.A N ALA 166.A O no hydrogen 3.118 N/A TYR 140.A N ALA 108.A O no hydrogen 3.234 N/A TYR 140.A OH SER 50.A OG no hydrogen 2.683 N/A LEU 145.A N ILE 142.A O no hydrogen 3.077 N/A SER 146.A N ILE 142.A O no hydrogen 2.917 N/A SER 146.A OG ILE 142.A O no hydrogen 3.111 N/A GLY 147.A N PRO 143.A O no hydrogen 3.123 N/A VAL 148.A N SER 146.A OG no hydrogen 3.085 N/A THR 151.A N GLN 154.A OE1 no hydrogen 2.963 N/A GLN 154.A N THR 151.A OG1 no hydrogen 3.131 N/A ILE 155.A N THR 151.A O no hydrogen 3.056 N/A ASN 156.A N LEU 152.A O no hydrogen 2.877 N/A THR 157.A N ASP 153.A O no hydrogen 3.026 N/A THR 157.A OG1 ASP 153.A O no hydrogen 3.519 N/A LEU 158.A N GLN 154.A O no hydrogen 2.894 N/A VAL 159.A N ILE 155.A O no hydrogen 2.907 N/A THR 160.A N ASN 156.A O no hydrogen 3.297 N/A THR 160.A OG1 ASN 156.A O no hydrogen 2.881 N/A THR 160.A OG1 THR 157.A O no hydrogen 3.362 N/A LEU 161.A N LEU 158.A O no hydrogen 3.288 N/A VAL 164.A N LEU 161.A O no hydrogen 2.984 N/A GLY 165.A N MET 137.A O no hydrogen 3.126 N/A ALA 166.A N MET 137.A O no hydrogen 3.323 N/A LEU 167.A N VAL 187.A O no hydrogen 2.998 N/A GLN 168.A NE2 ASN 141.A OD1 no hydrogen 3.060 N/A THR 169.A N ASN 141.A O no hydrogen 2.927 N/A ASP 172.A N SER 170.A OG no hydrogen 3.143 N/A GLN 175.A N ASP 172.A OD1 no hydrogen 3.197 N/A MET 176.A N ASP 172.A O no hydrogen 3.073 N/A GLU 177.A N LEU 173.A O no hydrogen 3.138 N/A GLN 178.A N TYR 174.A O no hydrogen 2.815 N/A ILE 179.A N GLN 175.A O no hydrogen 2.971 N/A ARG 180.A N MET 176.A O no hydrogen 3.200 N/A ARG 180.A NE GLY 203.A O no hydrogen 2.788 N/A ARG 180.A NH1 HIS 183.A O no hydrogen 3.021 N/A ARG 180.A NH1 LEU 186.A O no hydrogen 2.742 N/A ARG 180.A NH2 LEU 186.A O no hydrogen 3.141 N/A ARG 180.A NH2 GLY 203.A O no hydrogen 2.817 N/A ARG 181.A N GLU 177.A O no hydrogen 2.884 N/A ARG 181.A NE GLU 177.A OE1 no hydrogen 3.324 N/A ARG 181.A NE GLU 177.A OE2 no hydrogen 2.683 N/A ARG 181.A NH2 GLU 177.A OE1 no hydrogen 2.785 N/A GLU 182.A N GLN 178.A O no hydrogen 2.902 N/A HIS 183.A N ILE 179.A O no hydrogen 2.930 N/A HIS 183.A N ARG 180.A O no hydrogen 3.270 N/A LEU 186.A N HIS 183.A O no hydrogen 3.210 N/A LEU 188.A N ASP 205.A OD1 no hydrogen 2.875 N/A TYR 189.A N LEU 167.A O no hydrogen 2.941 N/A TYR 189.A OH LEU 8.A O no hydrogen 2.593 N/A ASN 190.A N GLY 206.A O no hydrogen 2.911 N/A ASN 190.A ND2 TYR 192.A O no hydrogen 2.755 N/A GLY 191.A N GLN 168.A O no hydrogen 2.846 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.796 N/A ILE 195.A N TYR 192.A O no hydrogen 3.149 N/A PHE 196.A N ASP 193.A O no hydrogen 2.848 N/A ALA 197.A N GLN 238.A OE1 no hydrogen 2.602 N/A GLY 199.A N ILE 195.A O no hydrogen 2.593 N/A LEU 200.A N PHE 196.A O no hydrogen 2.722 N/A LEU 201.A N ALA 197.A O no hydrogen 3.004 N/A ALA 202.A N SER 198.A O no hydrogen 3.074 N/A GLY 203.A N GLY 199.A O no hydrogen 3.079 N/A GLY 203.A N LEU 200.A O no hydrogen 3.021 N/A ALA 204.A N GLY 199.A O no hydrogen 3.037 N/A GLY 207.A N GLY 10.A O no hydrogen 3.080 N/A ILE 208.A N ASN 190.A O no hydrogen 3.121 N/A GLY 209.A N MET 12.A O no hydrogen 3.430 N/A THR 211.A N ASP 193.A OD2 no hydrogen 3.336 N/A THR 211.A OG1 ASP 193.A OD2 no hydrogen 2.688 N/A THR 211.A OG1 TYR 219.A OH no hydrogen 2.663 N/A ASN 213.A N SER 210.A O no hydrogen 3.387 N/A ASN 213.A ND2 ALA 14.A O no hydrogen 2.677 N/A ASN 213.A ND2 SER 210.A O no hydrogen 3.154 N/A ILE 214.A N THR 211.A O no hydrogen 3.184 N/A MET 215.A N THR 211.A O no hydrogen 3.303 N/A MET 215.A N TYR 212.A O no hydrogen 3.357 N/A GLY 216.A N GLN 40.A OE1 no hydrogen 3.211 N/A ARG 218.A N MET 215.A O no hydrogen 3.210 N/A TYR 219.A OH THR 211.A OG1 no hydrogen 2.663 N/A GLN 220.A N GLY 216.A O no hydrogen 3.343 N/A GLN 220.A NE2 GLY 41.A O no hydrogen 2.769 N/A GLN 220.A NE2 ASP 43.A OD1 no hydrogen 2.998 N/A GLY 221.A N TRP 217.A O no hydrogen 3.176 N/A ILE 222.A N TYR 219.A O no hydrogen 3.279 N/A LYS 224.A NZ GLU 228.A OE2 no hydrogen 2.674 N/A ALA 225.A N GLY 221.A O no hydrogen 3.260 N/A LEU 226.A N ILE 222.A O no hydrogen 3.212 N/A LYS 227.A N VAL 223.A O no hydrogen 3.238 N/A GLU 228.A N LYS 224.A O no hydrogen 2.894 N/A GLY 229.A N LEU 226.A O no hydrogen 3.142 N/A ASP 230.A N ALA 225.A O no hydrogen 2.628 N/A GLN 235.A N ILE 231.A O no hydrogen 3.253 N/A LYS 236.A N GLN 232.A O no hydrogen 3.163 N/A LYS 236.A NZ GLU 240.A OE2 no hydrogen 3.301 N/A LEU 237.A N THR 233.A O no hydrogen 2.995 N/A GLN 238.A N ALA 234.A O no hydrogen 3.137 N/A GLN 238.A NE2 ASP 193.A O no hydrogen 3.005 N/A THR 239.A N GLN 235.A O no hydrogen 2.757 N/A THR 239.A OG1 GLN 235.A O no hydrogen 2.764 N/A GLU 240.A N LYS 236.A O no hydrogen 2.972 N/A CYS 241.A N LEU 237.A O no hydrogen 2.955 N/A CYS 241.A SG LEU 237.A O no hydrogen 3.391 N/A ASN 242.A N GLN 238.A O no hydrogen 3.129 N/A LYS 243.A N THR 239.A O no hydrogen 3.059 N/A LYS 243.A NZ GLU 240.A OE1 no hydrogen 3.255 N/A LYS 243.A NZ GLU 240.A OE2 no hydrogen 2.801 N/A VAL 244.A N GLU 240.A O no hydrogen 3.214 N/A ILE 245.A N CYS 241.A O no hydrogen 2.693 N/A ASP 246.A N ASN 242.A O no hydrogen 2.913 N/A LEU 248.A N VAL 244.A O no hydrogen 3.007 N/A ILE 249.A N ILE 245.A O no hydrogen 2.845 N/A LYS 250.A N ASP 246.A O no hydrogen 3.262 N/A THR 251.A N LEU 247.A O no hydrogen 3.034 N/A THR 251.A OG1 LEU 247.A O no hydrogen 3.447 N/A THR 251.A OG1 LEU 248.A O no hydrogen 3.386 N/A THR 251.A OG1 GLY 252.A O no hydrogen 3.249 N/A GLY 252.A N LEU 248.A O no hydrogen 2.966 N/A ARG 255.A NE THR 251.A O no hydrogen 2.804 N/A ARG 255.A NH1 THR 251.A O no hydrogen 2.970 N/A ARG 255.A NH2 GLY 277.A O no hydrogen 2.979 N/A GLY 256.A N GLY 252.A O no hydrogen 2.652 N/A LEU 257.A N VAL 253.A O no hydrogen 3.036 N/A LYS 258.A N PHE 254.A O no hydrogen 2.879 N/A LYS 258.A NZ THR 17.A O no hydrogen 2.560 N/A LYS 258.A NZ GLU 53.A OE2 no hydrogen 2.773 N/A LYS 258.A NZ LEU 271.A O no hydrogen 2.997 N/A THR 259.A N ARG 255.A O no hydrogen 2.872 N/A THR 259.A OG1 ARG 255.A O no hydrogen 3.006 N/A VAL 260.A N GLY 256.A O no hydrogen 2.996 N/A LEU 261.A N LEU 257.A O no hydrogen 2.907 N/A HIS 262.A N LYS 258.A O no hydrogen 2.863 N/A TYR 263.A N THR 259.A O no hydrogen 3.173 N/A MET 264.A N VAL 260.A O no hydrogen 2.999 N/A ASP 265.A N HIS 262.A O no hydrogen 3.268 N/A VAL 266.A N LEU 261.A O no hydrogen 2.871 N/A VAL 267.A N LEU 261.A O no hydrogen 3.307 N/A SER 268.A N SER 29.A OG no hydrogen 3.078 N/A SER 268.A OG ASP 26.A OD2 no hydrogen 3.513 N/A SER 268.A OG SER 29.A OG no hydrogen 2.716 N/A CYS 272.A SG GLU 53.A OE2 no hydrogen 3.218 N/A ARG 273.A N GLU 53.A OE1 no hydrogen 3.038 N/A ARG 273.A NE GLN 23.A O no hydrogen 2.970 N/A ARG 273.A NH1 VAL 56.A O no hydrogen 2.752 N/A ARG 273.A NH1 GLU 61.A OE1 no hydrogen 2.958 N/A ARG 273.A NH1 GLU 61.A OE2 no hydrogen 3.556 N/A ARG 273.A NH2 GLN 23.A O no hydrogen 3.223 N/A ARG 273.A NH2 GLU 61.A OE2 no hydrogen 2.942 N/A LYS 274.A N GLN 23.A OE1 no hydrogen 2.890 N/A PHE 276.A N ARG 273.A O no hydrogen 2.852 N/A LYS 282.A N ASP 280.A OD1 no hydrogen 3.137 N/A TYR 283.A N ASP 280.A O no hydrogen 3.132 N/A LEU 284.A N GLU 281.A O no hydrogen 3.164 N/A GLU 286.A N TYR 283.A O no hydrogen 3.240 N/A LEU 287.A N TYR 283.A O no hydrogen 3.235 N/A LYS 288.A N LEU 284.A O no hydrogen 2.891 N/A ALA 289.A N PRO 285.A O no hydrogen 3.041 N/A LEU 290.A N GLU 286.A O no hydrogen 2.772 N/A ALA 291.A N LEU 287.A O no hydrogen 2.814 N/A GLN 292.A N LYS 288.A O no hydrogen 3.082 N/A GLN 293.A N ALA 289.A O no hydrogen 3.061 N/A LEU 294.A N LEU 290.A O no hydrogen 3.013 N/A MET 295.A N ALA 291.A O no hydrogen 3.017 N/A