Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xjb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N ASP 4.A OD2 no hydrogen 2.300 N/A SER 5.A OG SER 5.A O no hydrogen 2.713 N/A SER 5.A OG ASP 80.A OD1 no hydrogen 3.109 N/A SER 5.A OG ASP 80.A OD2 no hydrogen 3.209 N/A TYR 7.A OH ASP 80.A OD1 no hydrogen 3.143 N/A CYS 9.A SG TYR 7.A O no hydrogen 3.929 N/A VAL 10.A N MET 18.A O no hydrogen 2.894 N/A LYS 11.A NZ GLY 15.A O no hydrogen 3.396 N/A LEU 12.A N HIS 16.A O no hydrogen 2.617 N/A ASN 13.A ND2 PRO 188.A O no hydrogen 2.884 N/A ASN 13.A ND2 ASP 212.A O no hydrogen 3.151 N/A GLY 15.A N LEU 12.A O no hydrogen 2.944 N/A HIS 16.A N ASP 14.A OD1 no hydrogen 3.012 N/A MET 18.A N VAL 10.A O no hydrogen 2.822 N/A VAL 20.A N GLN 8.A O no hydrogen 2.958 N/A GLY 22.A N VAL 269.A O no hydrogen 2.933 N/A PHE 23.A N HIS 50.A O no hydrogen 2.753 N/A GLY 24.A N ALA 271.A O no hydrogen 2.992 N/A THR 25.A N ASP 52.A O no hydrogen 3.244 N/A THR 25.A OG1 ASP 52.A O no hydrogen 2.782 N/A THR 25.A OG1 SER 53.A OG no hydrogen 3.320 N/A TYR 26.A OH GLU 226.A OE1 no hydrogen 2.455 N/A ALA 29.A N GLU 226.A OE2 no hydrogen 3.102 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.476 N/A VAL 31.A N PRO 28.A O no hydrogen 2.868 N/A LYS 33.A NZ TYR 57.A O no hydrogen 3.495 N/A LYS 35.A N PRO 32.A O no hydrogen 3.125 N/A ALA 36.A N LYS 33.A O no hydrogen 3.063 N/A LEU 37.A N SER 34.A O no hydrogen 3.028 N/A ALA 39.A N LYS 35.A O no hydrogen 3.058 N/A VAL 40.A N ALA 36.A O no hydrogen 2.982 N/A LYS 41.A N LEU 37.A O no hydrogen 3.155 N/A LEU 42.A N GLU 38.A O no hydrogen 2.984 N/A ALA 43.A N ALA 39.A O no hydrogen 2.831 N/A ILE 44.A N VAL 40.A O no hydrogen 2.916 N/A GLU 45.A N LYS 41.A O no hydrogen 3.022 N/A ALA 46.A N LEU 42.A O no hydrogen 2.743 N/A GLY 47.A N ILE 44.A O no hydrogen 3.018 N/A PHE 48.A N ALA 43.A O no hydrogen 2.935 N/A HIS 49.A ND1 ASP 80.A O no hydrogen 2.749 N/A HIS 50.A ND1 PRO 19.A O no hydrogen 3.049 N/A ILE 51.A N.A PHE 82.A O no hydrogen 2.751 N/A ILE 51.A N.B PHE 82.A O no hydrogen 2.743 N/A ASP 52.A N PHE 23.A O no hydrogen 2.858 N/A SER 53.A N THR 84.A O no hydrogen 2.830 N/A SER 53.A OG THR 25.A OG1 no hydrogen 3.320 N/A SER 53.A OG ASN 59.A OD1 no hydrogen 2.723 N/A ALA 54.A N SER 53.A OG no hydrogen 2.689 N/A TYR 57.A N ALA 54.A O no hydrogen 3.130 N/A ASN 58.A N HIS 55.A O no hydrogen 3.118 N/A ASN 59.A ND2 THR 25.A OG1 no hydrogen 3.272 N/A VAL 63.A N ASN 59.A O no hydrogen 2.793 N/A GLY 64.A N GLU 60.A O no hydrogen 2.785 N/A LEU 65.A N GLU 61.A O no hydrogen 3.043 N/A ALA 66.A N GLN 62.A O no hydrogen 3.006 N/A ILE 67.A N VAL 63.A O no hydrogen 3.095 N/A ARG 68.A N GLY 64.A O no hydrogen 2.864 N/A SER 69.A N LEU 65.A O no hydrogen 2.713 N/A LYS 70.A N ALA 66.A O no hydrogen 3.023 N/A ILE 71.A N ILE 67.A O no hydrogen 3.018 N/A ILE 71.A N ARG 68.A O no hydrogen 3.158 N/A ALA 72.A N ARG 68.A O no hydrogen 2.788 N/A ASP 73.A N SER 69.A O no hydrogen 3.065 N/A GLY 74.A N ILE 71.A O no hydrogen 2.933 N/A SER 75.A N ASP 73.A OD1 no hydrogen 2.906 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.335 N/A SER 75.A OG ASP 73.A OD2 no hydrogen 3.177 N/A VAL 76.A N LYS 70.A O no hydrogen 3.021 N/A ARG 78.A NH1 ARG 78.A O no hydrogen 2.957 N/A ARG 78.A NH1 ILE 81.A O no hydrogen 2.791 N/A ARG 78.A NH1 ASP 114.A OD1 no hydrogen 3.062 N/A ARG 78.A NH2 TYR 112.A O no hydrogen 2.885 N/A ARG 78.A NH2 ASP 114.A OD1 no hydrogen 2.839 N/A ASP 80.A N LYS 77.A O no hydrogen 2.952 N/A ILE 81.A N ARG 78.A O no hydrogen 3.024 N/A PHE 82.A N HIS 49.A O no hydrogen 2.742 N/A TYR 83.A N ASP 114.A OD1 no hydrogen 2.812 N/A TYR 83.A OH GLU 60.A OE2 no hydrogen 2.554 N/A THR 84.A N ILE 51.A O.A no hydrogen 2.890 N/A THR 84.A N ILE 51.A O.B no hydrogen 2.881 N/A SER 85.A N LEU 115.A O no hydrogen 2.926 N/A SER 85.A OG GLU 60.A OE2 no hydrogen 2.765 N/A LYS 86.A NZ ASP 52.A OD1 no hydrogen 2.665 N/A LYS 86.A NZ ASP 52.A OD2 no hydrogen 3.212 N/A LYS 86.A NZ SER 53.A O no hydrogen 2.761 N/A LYS 86.A NZ TYR 57.A OH no hydrogen 3.069 N/A LEU 87.A N LEU 117.A O no hydrogen 2.643 N/A TRP 88.A NE1 VAL 130.A O no hydrogen 2.704 N/A SER 89.A OG PHE 120.A O no hydrogen 3.368 N/A SER 89.A OG VAL 122.A O no hydrogen 2.818 N/A ASN 90.A ND2 GLY 127.A O no hydrogen 2.735 N/A ASN 90.A ND2 GLU 129.A O no hydrogen 3.611 N/A SER 91.A N TRP 88.A O no hydrogen 2.918 N/A HIS 92.A ND1 SER 123.A OG no hydrogen 2.761 N/A ARG 93.A NE ASP 142.A OD2 no hydrogen 2.855 N/A ARG 93.A NH2 ASP 142.A OD1 no hydrogen 3.073 N/A ARG 93.A NH2 ASP 142.A OD2 no hydrogen 3.339 N/A GLU 95.A N GLU 95.A OE1 no hydrogen 2.638 N/A LEU 96.A N ARG 93.A O no hydrogen 2.716 N/A VAL 97.A N PRO 94.A O no hydrogen 3.136 N/A ARG 98.A NE GLU 102.A OE2 no hydrogen 2.476 N/A ALA 100.A N LEU 96.A O no hydrogen 3.070 N/A ALA 100.A N VAL 97.A O no hydrogen 3.003 N/A LEU 101.A N VAL 97.A O no hydrogen 3.031 N/A GLU 102.A N ARG 98.A O no hydrogen 2.816 N/A ARG 103.A N.A PRO 99.A O no hydrogen 3.054 N/A ARG 103.A N.B PRO 99.A O no hydrogen 3.040 N/A SER 104.A N ALA 100.A O no hydrogen 3.067 N/A SER 104.A OG GLU 60.A OE1 no hydrogen 2.840 N/A SER 104.A OG ALA 100.A O no hydrogen 3.499 N/A LEU 105.A N LEU 101.A O no hydrogen 2.883 N/A LYS 106.A N GLU 102.A O no hydrogen 2.940 N/A ASN 107.A N ARG 103.A O.A no hydrogen 2.967 N/A ASN 107.A N ARG 103.A O.B no hydrogen 3.041 N/A LEU 108.A N SER 104.A O no hydrogen 2.832 N/A GLN 109.A N LEU 105.A O no hydrogen 2.659 N/A LEU 110.A N LEU 105.A O no hydrogen 3.310 N/A VAL 113.A N LEU 161.A O no hydrogen 2.876 N/A ASP 114.A N TYR 83.A O no hydrogen 2.778 N/A LEU 115.A N TYR 83.A O no hydrogen 3.197 N/A TYR 116.A N SER 164.A O no hydrogen 3.057 N/A LEU 117.A N SER 85.A O no hydrogen 3.094 N/A ILE 118.A N GLY 166.A O no hydrogen 3.089 N/A HIS 119.A N LEU 87.A O no hydrogen 3.101 N/A SER 123.A OG HIS 92.A ND1 no hydrogen 2.761 N/A VAL 124.A N SER 89.A O no hydrogen 3.050 N/A LYS 125.A N LEU 140.A O no hydrogen 2.811 N/A LYS 125.A NZ ASP 142.A OD1 no hydrogen 2.730 N/A ASP 134.A N LYS 138.A O no hydrogen 2.804 N/A ASN 136.A N ASP 134.A OD1 no hydrogen 2.764 N/A GLY 137.A N ASP 134.A O no hydrogen 3.045 N/A LYS 138.A N ASP 134.A OD1 no hydrogen 2.907 N/A LEU 140.A N PRO 132.A O no hydrogen 2.729 N/A ASP 142.A N SER 123.A O no hydrogen 2.995 N/A CYS 147.A N ASP 145.A OD1 no hydrogen 2.998 N/A CYS 147.A SG MET 177.A O no hydrogen 3.913 N/A ALA 148.A N ASP 145.A O no hydrogen 2.755 N/A THR 149.A N ASP 145.A O no hydrogen 3.056 N/A THR 149.A OG1 HIS 92.A O no hydrogen 2.542 N/A TRP 150.A N LEU 146.A O no hydrogen 2.798 N/A TRP 150.A NE1 TYR 186.A O no hydrogen 2.736 N/A GLU 151.A N CYS 147.A O no hydrogen 3.045 N/A ALA 152.A N ALA 148.A O no hydrogen 3.007 N/A MET 153.A N THR 149.A O no hydrogen 2.979 N/A GLU 154.A N TRP 150.A O no hydrogen 2.755 N/A LYS 155.A N GLU 151.A O no hydrogen 3.048 N/A CYS 156.A N ALA 152.A O no hydrogen 3.180 N/A CYS 156.A SG ALA 152.A O no hydrogen 3.324 N/A LYS 157.A N MET 153.A O no hydrogen 3.154 N/A LYS 157.A N GLU 154.A O no hydrogen 3.058 N/A LYS 157.A NZ ASP 14.A OD2 no hydrogen 3.369 N/A LYS 157.A NZ LYS 163.A O no hydrogen 2.815 N/A ASP 158.A N GLU 154.A O no hydrogen 2.983 N/A ALA 159.A N LYS 155.A O no hydrogen 2.962 N/A GLY 160.A N LYS 157.A O no hydrogen 2.708 N/A ALA 162.A N CYS 156.A O no hydrogen 3.402 N/A LYS 163.A N VAL 113.A O no hydrogen 2.983 N/A SER 164.A N ASP 114.A O no hydrogen 2.970 N/A SER 164.A OG ASP 14.A OD1 no hydrogen 3.449 N/A SER 164.A OG ASP 14.A OD2 no hydrogen 2.578 N/A GLY 166.A N TYR 116.A O no hydrogen 3.109 N/A VAL 167.A N CYS 190.A O no hydrogen 3.118 N/A SER 168.A OG ASN 169.A OD1 no hydrogen 3.275 N/A SER 168.A OG GLN 192.A O no hydrogen 2.716 N/A ASN 169.A N GLN 192.A O no hydrogen 2.867 N/A ASN 169.A ND2 TYR 218.A OH no hydrogen 2.673 N/A PHE 170.A N ASN 191.A OD1 no hydrogen 3.281 N/A ASN 171.A ND2 PRO 320.A O no hydrogen 3.151 N/A HIS 172.A N TYR 325.A O no hydrogen 2.770 N/A ARG 173.A NH2 ASN 318.A OD1 no hydrogen 2.989 N/A LEU 174.A N ASN 171.A OD1 no hydrogen 2.770 N/A LEU 175.A N ASN 171.A O no hydrogen 2.920 N/A GLU 176.A N HIS 172.A O no hydrogen 2.858 N/A MET 177.A N ARG 173.A O no hydrogen 2.897 N/A ILE 178.A N LEU 174.A O no hydrogen 3.096 N/A LEU 179.A N LEU 175.A O no hydrogen 2.898 N/A ASN 180.A N GLU 176.A O no hydrogen 2.729 N/A LYS 181.A N ILE 178.A O no hydrogen 3.221 N/A LYS 181.A NZ PRO 182.A O no hydrogen 3.048 N/A LEU 184.A N LYS 181.A O no hydrogen 3.184 N/A LYS 185.A N GLU 154.A OE2 no hydrogen 2.827 N/A LYS 185.A NZ ASP 158.A OD1 no hydrogen 3.283 N/A LYS 185.A NZ ASP 158.A OD2 no hydrogen 3.393 N/A TYR 186.A N GLU 154.A OE2 no hydrogen 2.822 N/A TYR 186.A OH ASP 158.A OD1 no hydrogen 2.435 N/A LYS 187.A NZ LYS 211.A O no hydrogen 2.897 N/A VAL 189.A N ILE 165.A O no hydrogen 2.947 N/A ASN 191.A N VAL 214.A O no hydrogen 2.991 N/A ASN 191.A ND2 PHE 170.A O no hydrogen 2.891 N/A GLN 192.A N VAL 167.A O no hydrogen 2.963 N/A GLN 192.A NE2 ASP 52.A OD2 no hydrogen 3.027 N/A VAL 193.A N VAL 216.A O no hydrogen 2.873 N/A CYS 195.A N TYR 218.A O no hydrogen 3.173 N/A CYS 195.A SG PHE 199.A O no hydrogen 3.891 N/A CYS 195.A SG ASN 200.A O no hydrogen 3.298 N/A CYS 195.A SG GLN 262.A OE1 no hydrogen 3.778 N/A HIS 196.A N PHE 199.A O no hydrogen 3.195 N/A TYR 198.A OH ASP 240.A OD2 no hydrogen 2.641 N/A PHE 199.A N HIS 196.A O no hydrogen 2.773 N/A ASN 200.A N ASN 302.A OD1 no hydrogen 2.836 N/A ARG 202.A N ASN 200.A OD1 no hydrogen 3.016 N/A ARG 202.A NH1 ASP 206.A OD2 no hydrogen 2.884 N/A LYS 203.A NZ GLU 324.A OE1 no hydrogen 3.338 N/A LYS 203.A NZ GLU 324.A OE2 no hydrogen 3.090 N/A LEU 205.A N GLN 201.A O no hydrogen 2.718 N/A ASP 206.A N ARG 202.A O no hydrogen 2.992 N/A PHE 207.A N LYS 203.A O no hydrogen 3.035 N/A CYS 208.A N LEU 204.A O no hydrogen 2.966 N/A CYS 208.A SG LEU 204.A O no hydrogen 3.353 N/A LYS 209.A N LEU 205.A O no hydrogen 2.960 N/A LYS 209.A NZ ARG 265.A O no hydrogen 2.721 N/A SER 210.A N ASP 206.A O no hydrogen 2.941 N/A SER 210.A OG PHE 207.A O no hydrogen 2.568 N/A LYS 211.A N CYS 208.A O no hydrogen 2.954 N/A ASP 212.A N LYS 209.A O no hydrogen 2.821 N/A ILE 213.A N CYS 208.A O no hydrogen 2.600 N/A VAL 214.A N VAL 189.A O no hydrogen 3.079 N/A VAL 216.A N ASN 191.A O no hydrogen 3.164 N/A ALA 217.A N VAL 268.A O no hydrogen 2.746 N/A TYR 218.A N VAL 193.A O no hydrogen 2.913 N/A GLY 222.A N SER 219.A O no hydrogen 3.103 N/A SER 223.A OG GLY 222.A O no hydrogen 2.600 N/A ARG 225.A N SER 223.A OG no hydrogen 3.018 N/A ARG 225.A NH1 SER 234.A O no hydrogen 3.277 N/A ARG 225.A NH1 PRO 235.A O no hydrogen 3.068 N/A ARG 225.A NH2 SER 234.A O no hydrogen 2.991 N/A GLU 226.A N HIS 224.A ND1 no hydrogen 2.855 N/A VAL 230.A N GLU 226.A O no hydrogen 2.809 N/A ASN 233.A N ASP 231.A OD1 no hydrogen 2.789 N/A SER 234.A N ASP 231.A O no hydrogen 2.811 N/A SER 234.A OG ASP 231.A O no hydrogen 2.705 N/A GLU 239.A N VAL 236.A O no hydrogen 2.981 N/A ASP 240.A N LEU 237.A O no hydrogen 2.819 N/A LEU 243.A N ASP 240.A OD1 no hydrogen 3.104 N/A CYS 244.A N ASP 240.A O no hydrogen 2.965 N/A CYS 244.A SG LEU 238.A O no hydrogen 3.537 N/A CYS 244.A SG ASP 240.A O no hydrogen 3.126 N/A ALA 245.A N PRO 241.A O no hydrogen 2.756 N/A LEU 246.A N VAL 242.A O no hydrogen 2.939 N/A ALA 247.A N LEU 243.A O no hydrogen 2.728 N/A LYS 248.A N CYS 244.A O no hydrogen 2.931 N/A LYS 249.A N ALA 245.A O no hydrogen 2.938 N/A LYS 249.A NZ GLU 294.A OE2 no hydrogen 2.985 N/A HIS 250.A N LEU 246.A O no hydrogen 2.928 N/A HIS 250.A NE2 GLU 294.A OE1 no hydrogen 2.870 N/A HIS 250.A NE2 GLU 294.A OE2 no hydrogen 2.738 N/A LYS 251.A N LYS 248.A O no hydrogen 3.156 N/A ARG 252.A N ALA 247.A O no hydrogen 2.846 N/A ARG 252.A NH1 GLN 284.A OE1 no hydrogen 3.249 N/A ARG 252.A NH1 GLU 287.A OE1 no hydrogen 3.103 N/A LEU 256.A N THR 253.A OG1 no hydrogen 3.137 N/A ILE 257.A N THR 253.A O no hydrogen 3.050 N/A ALA 258.A N PRO 254.A O no hydrogen 3.036 N/A LEU 259.A N ALA 255.A O no hydrogen 3.044 N/A ARG 260.A N LEU 256.A O no hydrogen 2.830 N/A ARG 260.A NH1 VAL 285.A O no hydrogen 2.834 N/A TYR 261.A N ILE 257.A O no hydrogen 2.907 N/A TYR 261.A OH ASP 299.A OD1 no hydrogen 2.717 N/A LEU 263.A N LEU 259.A O no hydrogen 3.219 N/A GLN 264.A N ARG 260.A O no hydrogen 3.002 N/A ARG 265.A N GLN 262.A O no hydrogen 2.979 N/A ARG 265.A NH1 ASN 200.A O no hydrogen 2.890 N/A ARG 265.A NH1 GLN 262.A OE1 no hydrogen 3.134 N/A ARG 265.A NH2 ASN 200.A O no hydrogen 2.915 N/A GLY 266.A N LEU 263.A O no hydrogen 3.260 N/A VAL 267.A N GLN 262.A O no hydrogen 2.917 N/A VAL 268.A N LEU 215.A O no hydrogen 3.189 N/A VAL 269.A N VAL 20.A O no hydrogen 3.003 N/A LEU 270.A N ALA 217.A O no hydrogen 2.973 N/A ALA 271.A N GLY 22.A O no hydrogen 2.854 N/A SER 273.A OG ASN 275.A O no hydrogen 3.347 N/A TYR 274.A OH THR 25.A O no hydrogen 2.496 N/A ASN 275.A N SER 273.A OG no hydrogen 3.067 N/A ILE 279.A N ASN 275.A O no hydrogen 2.873 N/A ARG 280.A N GLU 276.A O no hydrogen 3.164 N/A GLN 281.A N GLN 277.A O no hydrogen 2.902 N/A ASN 282.A N ARG 278.A O no hydrogen 2.963 N/A GLN 284.A N GLN 281.A O no hydrogen 2.922 N/A VAL 285.A N ASN 282.A O no hydrogen 3.157 N/A PHE 286.A N VAL 283.A O.A no hydrogen 3.385 N/A PHE 286.A N VAL 283.A O.B no hydrogen 3.530 N/A GLU 287.A N GLN 284.A O no hydrogen 2.839 N/A THR 291.A N GLU 294.A OE1 no hydrogen 2.943 N/A GLU 294.A N THR 291.A OG1 no hydrogen 3.227 N/A MET 295.A N THR 291.A O no hydrogen 2.889 N/A LYS 296.A N SER 292.A O no hydrogen 2.861 N/A ALA 297.A N GLU 293.A O no hydrogen 2.936 N/A ILE 298.A N GLU 294.A O no hydrogen 3.090 N/A ASP 299.A N MET 295.A O no hydrogen 2.838 N/A GLY 300.A N LYS 296.A O no hydrogen 3.010 N/A LEU 301.A N ILE 298.A O no hydrogen 2.934 N/A ASN 302.A N ASP 299.A O no hydrogen 3.323 N/A ARG 303.A N TYR 198.A O no hydrogen 3.084 N/A ARG 303.A NE LEU 301.A O no hydrogen 2.985 N/A VAL 305.A N TYR 198.A O no hydrogen 3.067 N/A TYR 307.A N GLU 194.A OE2 no hydrogen 2.612 N/A TYR 307.A OH PRO 235.A O no hydrogen 2.645 N/A LEU 308.A N GLU 194.A OE1 no hydrogen 2.987 N/A ASP 311.A N THR 309.A OG1 no hydrogen 3.264 N/A PHE 313.A N LEU 310.A O no hydrogen 2.936 N/A ALA 314.A N ASP 311.A O no hydrogen 2.961 N/A ASN 318.A ND2 PRO 121.A O no hydrogen 3.353 N/A TYR 319.A N PRO 316.A O no hydrogen 3.056 N/A TYR 319.A OH THR 309.A O no hydrogen 2.659 N/A