Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rb8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 5.A N PHE 80.A O no hydrogen 3.022 N/A CYS 5.A SG HIS 27.A NE2 no hydrogen 3.385 N/A LEU 6.A N ALA 25.A O no hydrogen 2.667 N/A ILE 7.A N ILE 82.A O no hydrogen 2.712 N/A PHE 8.A N HIS 27.A O no hydrogen 2.982 N/A ALA 9.A N CYS 84.A O no hydrogen 2.913 N/A GLY 10.A N PHE 29.A O no hydrogen 3.004 N/A VAL 15.A N THR 12.A O no hydrogen 2.919 N/A THR 17.A OG1 ASN 14.A O no hydrogen 2.849 N/A LYS 18.A NZ GLU 157.A OE1 no hydrogen 3.513 N/A LYS 18.A NZ GLU 157.A OE2 no hydrogen 2.972 N/A LYS 18.A NZ ASP 161.A OD1 no hydrogen 3.082 N/A LEU 19.A N ALA 16.A O no hydrogen 2.770 N/A LEU 22.A N LEU 19.A O no hydrogen 3.073 N/A GLY 23.A N VAL 20.A O no hydrogen 2.760 N/A ALA 25.A N LEU 22.A O no hydrogen 3.072 N/A VAL 26.A N GLY 23.A O no hydrogen 2.830 N/A HIS 27.A N LEU 6.A O no hydrogen 2.668 N/A CYS 28.A N ASN 44.A O no hydrogen 2.846 N/A PHE 29.A N PHE 8.A O no hydrogen 3.100 N/A ASP 30.A N THR 46.A O no hydrogen 3.115 N/A THR 31.A N ASP 30.A OD2 no hydrogen 2.605 N/A THR 31.A OG1 ASP 30.A OD2 no hydrogen 3.459 N/A THR 31.A OG1 SER 91.A OG no hydrogen 2.496 N/A CYS 32.A SG ASP 33.A OD1 no hydrogen 3.593 N/A LYS 34.A NZ GLY 53.A O no hydrogen 3.031 N/A ASN 35.A ND2 ASN 14.A OD1 no hydrogen 3.084 N/A VAL 36.A N ASP 33.A O no hydrogen 2.888 N/A VAL 37.A N HIS 40.A ND1 no hydrogen 3.267 N/A ARG 41.A N ASP 38.A O no hydrogen 3.353 N/A ASN 44.A N VAL 26.A O no hydrogen 3.076 N/A ASN 44.A ND2 GLU 24.A OE2 no hydrogen 3.296 N/A THR 46.A N CYS 28.A O no hydrogen 3.102 N/A THR 48.A N ASP 30.A O no hydrogen 3.165 N/A THR 48.A OG1 ASP 30.A O no hydrogen 3.381 N/A THR 48.A OG1 THR 51.A OG1 no hydrogen 3.398 N/A LYS 49.A N GLN 68.A OE1 no hydrogen 2.989 N/A THR 51.A OG1 THR 31.A O no hydrogen 2.918 N/A THR 51.A OG1 THR 48.A O no hydrogen 3.327 N/A THR 51.A OG1 THR 48.A OG1 no hydrogen 3.398 N/A GLY 53.A N THR 31.A O no hydrogen 3.193 N/A ARG 58.A NE SER 93.A O no hydrogen 3.291 N/A ARG 58.A NE SER 93.A OG no hydrogen 3.239 N/A ARG 58.A NH2 SER 93.A O no hydrogen 3.029 N/A ARG 58.A NH2 THR 131.A OG1 no hydrogen 3.240 N/A VAL 60.A N ASN 57.A OD1 no hydrogen 2.801 N/A ILE 61.A N ASN 57.A O no hydrogen 3.165 N/A ILE 61.A N ARG 58.A O no hydrogen 3.074 N/A LEU 62.A N ARG 58.A O no hydrogen 2.834 N/A VAL 65.A N ILE 61.A O no hydrogen 3.023 N/A VAL 65.A N LEU 62.A O no hydrogen 3.041 N/A ARG 66.A N LEU 62.A O no hydrogen 2.791 N/A ARG 66.A NH1 ARG 66.A O no hydrogen 2.955 N/A GLN 68.A N VAL 65.A O no hydrogen 2.921 N/A GLN 68.A NE2 LYS 49.A O no hydrogen 3.177 N/A GLN 68.A NE2 LEU 64.A O no hydrogen 2.973 N/A ILE 69.A N ARG 66.A O no hydrogen 3.221 N/A LEU 72.A N GLN 68.A O no hydrogen 3.332 N/A THR 74.A N LEU 72.A O no hydrogen 2.734 N/A THR 74.A OG1 LEU 72.A O no hydrogen 2.584 N/A ASP 79.A N VAL 2.A O no hydrogen 3.284 N/A TYR 81.A N SER 109.A O no hydrogen 3.011 N/A TYR 81.A OH PRO 76.A O no hydrogen 3.373 N/A ILE 82.A N CYS 5.A O no hydrogen 2.926 N/A VAL 83.A N VAL 111.A O no hydrogen 3.022 N/A CYS 84.A N ILE 7.A O no hydrogen 2.872 N/A CYS 84.A SG PHE 113.A O no hydrogen 3.738 N/A TYR 85.A N PHE 113.A O no hydrogen 3.136 N/A LEU 87.A N VAL 115.A O no hydrogen 3.076 N/A GLY 88.A N SER 86.A OG no hydrogen 2.979 N/A SER 91.A OG THR 31.A OG1 no hydrogen 2.496 N/A SER 93.A OG GLY 89.A O no hydrogen 2.532 N/A VAL 94.A N SER 91.A O no hydrogen 3.101 N/A LEU 95.A N SER 91.A O no hydrogen 2.825 N/A GLY 96.A N GLY 92.A O no hydrogen 2.936 N/A LEU 98.A N VAL 94.A O no hydrogen 2.989 N/A ILE 99.A N LEU 95.A O no hydrogen 2.836 N/A THR 100.A N GLY 96.A O no hydrogen 2.623 N/A THR 100.A OG1 GLY 96.A O no hydrogen 2.961 N/A GLY 101.A N PRO 97.A O no hydrogen 2.842 N/A GLN 102.A N LEU 98.A O no hydrogen 3.340 N/A LEU 103.A N ILE 99.A O no hydrogen 3.025 N/A ALA 104.A N THR 100.A O no hydrogen 3.101 N/A ASP 105.A N GLY 101.A O no hydrogen 3.284 N/A ARG 106.A N GLN 102.A O no hydrogen 2.916 N/A ARG 106.A NH1 ILE 75.A O no hydrogen 3.397 N/A ARG 106.A NH1 PRO 76.A O no hydrogen 3.270 N/A ARG 106.A NH1 TYR 81.A OH no hydrogen 2.733 N/A ARG 106.A NH2 ILE 75.A O no hydrogen 3.021 N/A LYS 107.A N ALA 104.A O no hydrogen 3.090 N/A ALA 108.A N LEU 103.A O no hydrogen 3.024 N/A VAL 111.A N TYR 81.A O no hydrogen 3.183 N/A SER 112.A N VAL 144.A O no hydrogen 2.943 N/A PHE 113.A N VAL 83.A O no hydrogen 2.669 N/A VAL 114.A N ASN 146.A O no hydrogen 2.996 N/A VAL 115.A N TYR 85.A O no hydrogen 3.451 N/A GLY 116.A N VAL 148.A O no hydrogen 2.851 N/A ASP 121.A N SER 119.A OG no hydrogen 3.107 N/A ASN 122.A N SER 119.A OG no hydrogen 3.209 N/A ASN 122.A ND2 GLY 88.A O no hydrogen 3.422 N/A LEU 123.A N SER 119.A O no hydrogen 2.849 N/A GLY 124.A N THR 120.A O no hydrogen 2.954 N/A ASN 125.A N ASP 121.A O no hydrogen 2.811 N/A ASN 125.A ND2 GLY 56.A O no hydrogen 3.197 N/A ASN 125.A ND2 GLY 88.A O no hydrogen 2.819 N/A ASP 126.A N ASN 122.A O no hydrogen 2.809 N/A ILE 127.A N LEU 123.A O no hydrogen 3.112 N/A ASP 128.A N GLY 124.A O no hydrogen 3.175 N/A THR 129.A N ASN 125.A O no hydrogen 2.993 N/A THR 129.A N ASP 126.A O no hydrogen 3.212 N/A THR 129.A OG1 LEU 87.A O no hydrogen 3.300 N/A THR 129.A OG1 ASN 125.A O no hydrogen 2.829 N/A THR 131.A N ASP 128.A O no hydrogen 2.856 N/A THR 131.A OG1 ASP 128.A O no hydrogen 2.718 N/A LEU 132.A N THR 129.A O no hydrogen 2.892 N/A ALA 134.A N LYS 130.A O no hydrogen 3.020 N/A ILE 135.A N THR 131.A O no hydrogen 3.054 N/A ALA 136.A N LEU 132.A O no hydrogen 3.088 N/A VAL 137.A N GLU 133.A O no hydrogen 3.185 N/A ASN 138.A N ALA 134.A O no hydrogen 2.923 N/A LYS 139.A N ILE 135.A O no hydrogen 2.839 N/A LYS 139.A NZ ASP 105.A OD1 no hydrogen 3.022 N/A LYS 139.A NZ ASP 105.A OD2 no hydrogen 2.870 N/A HIS 140.A N VAL 137.A O no hydrogen 3.296 N/A LEU 141.A N ALA 136.A O no hydrogen 3.042 N/A ILE 143.A N GLN 202.A O no hydrogen 3.037 N/A VAL 145.A N CYS 204.A O no hydrogen 2.864 N/A ASN 146.A N SER 112.A O no hydrogen 2.683 N/A ASN 146.A ND2 LEU 206.A O no hydrogen 2.851 N/A VAL 148.A N VAL 114.A O no hydrogen 2.774 N/A ASN 150.A N GLY 116.A O no hydrogen 2.836 N/A ARG 154.A N THR 151.A O no hydrogen 2.994 N/A ARG 154.A NE SER 158.A OG no hydrogen 3.056 N/A ARG 154.A NH1 GLU 162.A OE2 no hydrogen 3.234 N/A ARG 154.A NH2 GLU 162.A OE2 no hydrogen 2.431 N/A TYR 156.A OH GLU 118.A OE2 no hydrogen 2.749 N/A SER 158.A N SER 155.A OG no hydrogen 2.990 N/A ILE 159.A N SER 155.A O no hydrogen 2.948 N/A ASN 160.A N TYR 156.A O no hydrogen 2.695 N/A ASP 161.A N GLU 157.A O no hydrogen 2.976 N/A GLU 162.A N SER 158.A O no hydrogen 3.206 N/A GLU 162.A N ILE 159.A O no hydrogen 3.288 N/A ILE 163.A N ILE 159.A O no hydrogen 3.297 N/A ALA 164.A N ASN 160.A O no hydrogen 3.035 N/A GLU 165.A N ASP 161.A O no hydrogen 3.386 N/A LYS 166.A N GLU 162.A O no hydrogen 2.923 N/A LYS 166.A NZ ASN 146.A OD1 no hydrogen 2.968 N/A LYS 166.A NZ GLU 162.A OE1 no hydrogen 3.491 N/A ILE 167.A N ILE 163.A O no hydrogen 2.934 N/A ARG 168.A N ALA 164.A O no hydrogen 3.082 N/A ARG 168.A NH1 ASP 21.A OD1 no hydrogen 3.440 N/A ARG 168.A NH1 ASP 21.A OD2 no hydrogen 2.859 N/A ARG 168.A NH2 ASP 21.A OD1 no hydrogen 2.653 N/A LYS 169.A N GLU 165.A O no hydrogen 3.205 N/A LYS 169.A NZ ASP 256.A OD1 no hydrogen 3.162 N/A VAL 170.A N LYS 166.A O no hydrogen 3.228 N/A VAL 170.A N ILE 167.A O no hydrogen 2.854 N/A VAL 171.A N ILE 167.A O no hydrogen 2.866 N/A LEU 172.A N ARG 168.A O no hydrogen 2.754 N/A LEU 173.A N LYS 169.A O no hydrogen 3.049 N/A VAL 174.A N VAL 170.A O no hydrogen 2.923 N/A ASN 175.A N LEU 172.A O no hydrogen 2.848 N/A GLN 176.A NE2 ASP 79.A OD2 no hydrogen 3.037 N/A ASN 177.A N ASN 175.A OD1 no hydrogen 2.787 N/A HIS 178.A NE2 LEU 172.A O no hydrogen 3.073 N/A GLY 179.A N ILE 247.A O no hydrogen 3.064 N/A ARG 180.A NH1 GLU 234.A OE1 no hydrogen 3.391 N/A ARG 180.A NH2 GLU 234.A OE1 no hydrogen 3.436 N/A ARG 180.A NH2 GLU 234.A OE2 no hydrogen 3.338 N/A ASP 182.A N ASP 185.A OD2 no hydrogen 3.179 N/A HIS 184.A N ASP 182.A OD1 no hydrogen 3.304 N/A HIS 184.A ND1 ASP 182.A OD1 no hydrogen 3.352 N/A ALA 187.A N VAL 183.A O no hydrogen 3.290 N/A ASN 188.A N HIS 184.A O no hydrogen 3.124 N/A TRP 189.A N ASP 185.A O no hydrogen 2.972 N/A TRP 189.A N VAL 186.A O no hydrogen 3.190 N/A TRP 189.A NE1 SER 223.A O no hydrogen 3.098 N/A VAL 190.A N VAL 186.A O no hydrogen 3.256 N/A ARG 191.A N ALA 187.A O no hydrogen 2.750 N/A ARG 191.A NE ASP 194.A OD2 no hydrogen 2.817 N/A ARG 191.A NH1 ALA 108.A O no hydrogen 3.170 N/A ARG 191.A NH2 ASP 194.A OD1 no hydrogen 3.449 N/A ARG 191.A NH2 ASP 194.A OD2 no hydrogen 3.281 N/A THR 193.A OG1 ASP 194.A OD1 no hydrogen 3.544 N/A ASP 194.A N ARG 191.A O no hydrogen 3.080 N/A HIS 196.A N PHE 192.A O no hydrogen 2.950 N/A HIS 196.A ND1 TYR 198.A OH no hydrogen 3.023 N/A TYR 198.A OH HIS 196.A ND1 no hydrogen 3.023 N/A LEU 199.A N HIS 196.A O no hydrogen 3.190 N/A VAL 203.A N GLU 133.A OE1 no hydrogen 2.874 N/A CYS 204.A N ILE 143.A O no hydrogen 2.885 N/A CYS 204.A SG GLN 202.A O no hydrogen 3.685 N/A GLU 205.A N ASN 264.A O no hydrogen 2.612 N/A LEU 206.A N VAL 145.A O no hydrogen 2.861 N/A HIS 207.A N VAL 262.A O no hydrogen 2.793 N/A HIS 207.A NE2 ASN 264.A OD1 no hydrogen 2.861 N/A GLU 209.A N HIS 260.A O no hydrogen 3.065 N/A ARG 212.A N GLN 258.A OE1 no hydrogen 3.265 N/A ARG 212.A NE GLU 216.A OE2 no hydrogen 3.076 N/A ARG 212.A NH2 GLU 216.A OE2 no hydrogen 3.141 N/A ASP 214.A N THR 211.A OG1 no hydrogen 3.034 N/A ALA 215.A N THR 211.A O no hydrogen 3.041 N/A GLU 216.A N ARG 212.A O no hydrogen 3.051 N/A ASN 217.A N LYS 213.A O no hydrogen 3.300 N/A VAL 218.A N ALA 215.A O no hydrogen 3.000 N/A ILE 222.A N ILE 263.A O no hydrogen 2.898 N/A SER 223.A N ILE 263.A O no hydrogen 3.335 N/A SER 223.A OG TRP 189.A O no hydrogen 2.606 N/A GLN 224.A N TYR 242.A O no hydrogen 2.829 N/A SER 226.A N LYS 244.A O no hydrogen 2.923 N/A SER 226.A OG HIS 260.A ND1 no hydrogen 2.703 N/A LEU 227.A N ILE 259.A O no hydrogen 2.841 N/A TYR 228.A N GLY 246.A O no hydrogen 3.040 N/A LEU 229.A N ASP 257.A O no hydrogen 2.985 N/A SER 232.A OG ASP 230.A OD1 no hydrogen 2.627 N/A LYS 233.A N ASP 230.A O no hydrogen 2.947 N/A LYS 233.A NZ ASP 257.A OD2 no hydrogen 3.372 N/A GLU 234.A N PRO 231.A O no hydrogen 3.090 N/A ILE 241.A N ILE 222.A O no hydrogen 2.926 N/A TYR 242.A N ILE 222.A O no hydrogen 3.114 N/A ARG 243.A NH1 PHE 237.A O no hydrogen 2.523 N/A ARG 243.A NH2 PHE 237.A O no hydrogen 3.480 N/A ARG 243.A NH2 GLY 238.A O no hydrogen 3.425 N/A GLY 246.A N SER 226.A O no hydrogen 2.900 N/A ILE 247.A N GLY 179.A O no hydrogen 3.011 N/A ASP 251.A N LYS 248.A O no hydrogen 2.893 N/A ASP 253.A N ASP 251.A OD1 no hydrogen 3.043 N/A VAL 254.A N ASP 251.A O no hydrogen 3.235 N/A THR 255.A OG1 ASP 256.A OD1 no hydrogen 3.375 N/A ILE 259.A N LEU 227.A O no hydrogen 3.000 N/A HIS 260.A N GLU 209.A O no hydrogen 2.732 N/A HIS 260.A ND1 SER 226.A OG no hydrogen 2.703 N/A PHE 261.A N LEU 225.A O no hydrogen 2.879 N/A VAL 262.A N HIS 207.A O no hydrogen 2.908 N/A ILE 263.A N SER 223.A O no hydrogen 2.915 N/A ASN 264.A N GLU 205.A O no hydrogen 2.872 N/A ASN 264.A ND2 PRO 219.A O no hydrogen 2.756 N/A SER 265.A OG GLN 202.A OE1 no hydrogen 2.815 N/A VAL 268.A N SER 265.A O no hydrogen 3.137 N/A ILE 271.A N GLY 267.A O no hydrogen 3.362 N/A LYS 272.A NZ ASP 276.A OD1 no hydrogen 3.219 N/A LYS 272.A NZ ASP 276.A OD2 no hydrogen 3.056 N/A THR 273.A N GLU 270.A O no hydrogen 2.853 N/A THR 273.A OG1 GLU 270.A O no hydrogen 3.508 N/A ILE 274.A N ILE 271.A O no hydrogen 3.050 N/A ASP 276.A N LYS 272.A O no hydrogen 2.853 N/A SER 277.A N THR 273.A O no hydrogen 2.904 N/A SER 277.A OG THR 273.A O no hydrogen 3.365 N/A LYS 278.A N ILE 274.A O no hydrogen 3.152 N/A LEU 279.A N THR 275.A O no hydrogen 3.054 N/A GLU 280.A N ASP 276.A O no hydrogen 3.029 N/A ARG 282.A N LEU 279.A O no hydrogen 2.906 N/A ARG 282.A NE GLU 280.A OE1 no hydrogen 3.263 N/A ARG 282.A NH2 GLU 280.A OE1 no hydrogen 3.340 N/A ARG 282.A NH2 GLU 280.A OE2 no hydrogen 2.978 N/A GLN 283.A N GLU 280.A O no hydrogen 3.461 N/A GLN 283.A NE2 GLU 280.A O no hydrogen 3.158 N/A GLN 284.A NE2 THR 120.A OG1 no hydrogen 3.290 N/A SER 285.A N THR 281.A O no hydrogen 3.216 N/A LYS 286.A N GLN 283.A O no hydrogen 3.407 N/A ARG 290.A NH1 ASN 291.A O no hydrogen 3.186 N/A ASP 295.A N ASP 298.A OD1 no hydrogen 2.813 N/A ASP 297.A N ASP 295.A OD2 no hydrogen 2.998 N/A ASP 298.A N ASP 295.A O no hydrogen 2.950 N/A ASP 303.A N ASP 301.A OD1 no hydrogen 2.618 N/A GLY 304.A N ASP 301.A O no hydrogen 3.279 N/A