Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f56_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A N ARG 251.A O no hydrogen 2.975 N/A SER 4.A N SER 2.A OG no hydrogen 2.994 N/A ASP 7.A N SER 4.A OG no hydrogen 2.963 N/A PHE 8.A N SER 4.A O no hydrogen 3.065 N/A ARG 9.A N MET 5.A O no hydrogen 2.807 N/A ARG 9.A NH1 ALA 265.A O no hydrogen 2.863 N/A ARG 9.A NH1 ALA 267.A O no hydrogen 2.715 N/A ARG 9.A NH2 ALA 267.A O no hydrogen 2.923 N/A LYS 10.A N ALA 6.A O no hydrogen 3.039 N/A PHE 11.A N ASP 7.A O no hydrogen 3.391 N/A PHE 12.A N PHE 8.A O no hydrogen 2.821 N/A ALA 13.A N ARG 9.A O no hydrogen 2.856 N/A LYS 14.A N PHE 11.A O no hydrogen 3.038 N/A ALA 15.A N PHE 12.A O no hydrogen 3.456 N/A LYS 16.A N ASP 208.A OD1 no hydrogen 2.904 N/A HIS 17.A N ASP 208.A OD2 no hydrogen 2.950 N/A HIS 17.A NE2 GLU 203.A OE1 no hydrogen 2.719 N/A ILE 18.A N ARG 99.A O no hydrogen 2.841 N/A VAL 19.A N LEU 209.A O no hydrogen 3.040 N/A ILE 20.A N VAL 101.A O no hydrogen 2.839 N/A ILE 21.A N LEU 211.A O no hydrogen 2.803 N/A SER 22.A N ILE 103.A O no hydrogen 2.926 N/A SER 22.A OG THR 104.A OG1 no hydrogen 2.837 N/A SER 22.A OG HIS 111.A NE2 no hydrogen 2.730 N/A GLY 23.A N VAL 213.A O no hydrogen 2.926 N/A GLY 25.A N GLY 214.A O no hydrogen 2.765 N/A VAL 26.A N GLY 23.A O no hydrogen 3.076 N/A SER 27.A N ALA 24.A O no hydrogen 3.160 N/A SER 27.A OG HIS 83.A NE2 no hydrogen 2.934 N/A SER 27.A OG ASP 108.A OD2 no hydrogen 2.613 N/A ALA 28.A N GLY 25.A O no hydrogen 3.385 N/A SER 30.A N SER 27.A O no hydrogen 2.941 N/A SER 30.A OG GLU 78.A O no hydrogen 2.753 N/A GLY 31.A N ALA 28.A O no hydrogen 2.945 N/A GLY 37.A N THR 34.A OG1 no hydrogen 2.979 N/A GLY 40.A N GLY 37.A O no hydrogen 2.732 N/A TRP 42.A N TRP 45.A O no hydrogen 2.741 N/A TRP 42.A NE1 GLY 153.A O no hydrogen 2.971 N/A ARG 43.A N PRO 155.A O no hydrogen 2.793 N/A ARG 43.A NE ALA 154.A O no hydrogen 2.744 N/A ARG 43.A NH1 GLU 65.A OE1 no hydrogen 2.918 N/A ARG 43.A NH2 GLU 65.A OE2 no hydrogen 2.882 N/A ARG 43.A NH2 ALA 154.A O no hydrogen 2.967 N/A TRP 45.A N TRP 42.A O no hydrogen 2.981 N/A GLN 46.A N ASP 49.A OD1.B no hydrogen 2.898 N/A GLN 48.A N GLN 48.A OE1 no hydrogen 2.995 N/A GLN 48.A NE2 GLN 46.A OE1 no hydrogen 3.276 N/A ASP 49.A N GLN 46.A O no hydrogen 2.991 N/A LEU 50.A N ALA 47.A O no hydrogen 2.930 N/A ALA 51.A N ALA 47.A O no hydrogen 2.685 N/A THR 52.A N LEU 50.A O no hydrogen 2.877 N/A LEU 54.A N THR 52.A OG1 no hydrogen 3.028 N/A PHE 56.A N THR 52.A O no hydrogen 3.188 N/A ALA 57.A N PRO 53.A O no hydrogen 2.786 N/A HIS 58.A N LEU 54.A O no hydrogen 3.164 N/A ASN 59.A N ALA 55.A O no hydrogen 2.787 N/A ARG 62.A NE ASP 161.A OD1.A no hydrogen 2.904 N/A ARG 62.A NE ASP 161.A OD1.B no hydrogen 3.212 N/A ARG 62.A NH2 ASP 161.A OD1.A no hydrogen 3.415 N/A ARG 62.A NH2 ASP 161.A OD1.B no hydrogen 3.332 N/A ARG 62.A NH2 ASP 161.A OD2.A no hydrogen 2.708 N/A ARG 62.A NH2 ASP 161.A OD2.B no hydrogen 2.869 N/A VAL 63.A N ASN 59.A O no hydrogen 3.182 N/A TRP 64.A N PRO 60.A O no hydrogen 2.877 N/A TRP 64.A NE1 LEU 181.A O no hydrogen 2.832 N/A GLU 65.A N SER 61.A O no hydrogen 2.842 N/A PHE 66.A N ARG 62.A O no hydrogen 3.098 N/A TYR 67.A N VAL 63.A O no hydrogen 3.064 N/A HIS 68.A N TRP 64.A O no hydrogen 2.760 N/A TYR 69.A N GLU 65.A O no hydrogen 2.927 N/A ARG 70.A N PHE 66.A O no hydrogen 3.054 N/A ARG 71.A N TYR 67.A O no hydrogen 2.873 N/A ARG 71.A NH1 LEU 126.A O no hydrogen 3.169 N/A ARG 71.A NH1 ASN 140.A O no hydrogen 2.787 N/A ARG 71.A NH2 ASN 140.A O no hydrogen 3.243 N/A ARG 71.A NH2 ASN 140.A OD1 no hydrogen 2.798 N/A ARG 71.A NH2 LYS 142.A O no hydrogen 2.830 N/A GLU 72.A N HIS 68.A O no hydrogen 2.960 N/A VAL 73.A N TYR 69.A O no hydrogen 2.971 N/A MET 74.A N ARG 70.A O no hydrogen 2.980 N/A GLY 75.A N ARG 71.A O no hydrogen 3.073 N/A SER 76.A OG VAL 73.A O no hydrogen 3.203 N/A LYS 77.A N MET 74.A O no hydrogen 3.029 N/A LYS 77.A NZ GLY 31.A O no hydrogen 2.827 N/A ASN 80.A N HIS 83.A ND1 no hydrogen 2.982 N/A ASN 80.A ND2 VAL 26.A O no hydrogen 2.926 N/A ASN 80.A ND2 SER 30.A OG no hydrogen 3.014 N/A GLY 82.A N ASN 80.A OD1 no hydrogen 2.767 N/A HIS 83.A N ASN 80.A OD1 no hydrogen 3.192 N/A HIS 83.A NE2 SER 27.A OG no hydrogen 2.934 N/A ARG 84.A N ASN 80.A O no hydrogen 2.906 N/A ARG 84.A NH1 ALA 114.A O no hydrogen 3.065 N/A ALA 85.A N ALA 81.A O no hydrogen 2.907 N/A ILE 86.A N GLY 82.A O no hydrogen 3.139 N/A ALA 87.A N HIS 83.A O no hydrogen 3.052 N/A GLU 88.A N ARG 84.A O no hydrogen 2.770 N/A CYS 89.A N ALA 85.A O no hydrogen 2.915 N/A GLU 90.A N ILE 86.A O no hydrogen 3.170 N/A THR 91.A N ALA 87.A O no hydrogen 3.047 N/A THR 91.A OG1 ALA 87.A O no hydrogen 3.254 N/A ARG 92.A N GLU 88.A O no hydrogen 2.899 N/A ARG 92.A NH2 LEU 266.A O no hydrogen 2.718 N/A LEU 93.A N CYS 89.A O no hydrogen 2.910 N/A GLY 94.A N GLU 90.A O no hydrogen 2.912 N/A LYS 95.A N THR 91.A O no hydrogen 3.328 N/A LYS 95.A N ARG 92.A O no hydrogen 3.302 N/A GLN 96.A N LEU 93.A O no hydrogen 2.865 N/A GLY 97.A N GLY 94.A O no hydrogen 3.054 N/A ARG 98.A N LEU 93.A O no hydrogen 2.959 N/A ARG 98.A NE ALA 15.A O no hydrogen 2.834 N/A ARG 98.A NH1 GLN 96.A OE1 no hydrogen 2.815 N/A ARG 98.A NH2 PHE 12.A O no hydrogen 2.814 N/A ARG 98.A NH2 ALA 15.A O no hydrogen 2.891 N/A ARG 99.A N LYS 16.A O no hydrogen 2.883 N/A ARG 99.A NE GLU 203.A OE1 no hydrogen 2.972 N/A ARG 99.A NH2 GLU 203.A OE2 no hydrogen 2.786 N/A VAL 101.A N ILE 18.A O no hydrogen 2.902 N/A VAL 102.A N ASN 118.A O no hydrogen 2.917 N/A ILE 103.A N ILE 20.A O no hydrogen 2.748 N/A THR 104.A N LEU 120.A O no hydrogen 2.892 N/A THR 104.A OG1 SER 22.A OG no hydrogen 2.837 N/A GLN 105.A N SER 22.A O no hydrogen 2.900 N/A ASN 106.A N THR 104.A OG1 no hydrogen 2.920 N/A ASN 106.A ND2 GLY 23.A O no hydrogen 3.073 N/A LEU 110.A N ASP 108.A OD1 no hydrogen 2.871 N/A HIS 111.A NE2 SER 22.A OG no hydrogen 2.730 N/A LYS 113.A N GLU 109.A O no hydrogen 3.022 N/A LYS 113.A NZ GLY 75.A O no hydrogen 3.552 N/A LYS 113.A NZ LYS 77.A O no hydrogen 3.280 N/A ALA 114.A N LEU 110.A O no hydrogen 2.861 N/A GLY 115.A N ARG 112.A O no hydrogen 3.202 N/A THR 116.A N HIS 111.A O no hydrogen 3.053 N/A LYS 117.A N GLU 90.A OE1 no hydrogen 3.154 N/A ASN 118.A N GLU 90.A OE2 no hydrogen 2.717 N/A ASN 118.A ND2 VAL 100.A O no hydrogen 3.012 N/A LEU 120.A N VAL 102.A O no hydrogen 2.790 N/A ILE 122.A N THR 104.A O no hydrogen 3.061 N/A HIS 123.A ND1 GLN 105.A O no hydrogen 3.135 N/A GLY 124.A N GLU 121.A O no hydrogen 3.297 N/A SER 125.A N HIS 184.A O no hydrogen 3.033 N/A SER 125.A OG GLU 109.A OE1 no hydrogen 2.666 N/A LEU 126.A N ILE 107.A O no hydrogen 2.905 N/A PHE 127.A N SER 125.A OG no hydrogen 2.906 N/A LYS 128.A N SER 125.A O no hydrogen 3.273 N/A THR 129.A N ALA 138.A O no hydrogen 2.881 N/A THR 129.A OG1 ALA 138.A O no hydrogen 3.550 N/A ARG 130.A N ARG 182.A O no hydrogen 2.823 N/A ARG 130.A NH1 HIS 184.A ND1 no hydrogen 2.879 N/A CYS 131.A N VAL 136.A O no hydrogen 3.010 N/A THR 132.A N LEU 180.A O no hydrogen 2.966 N/A THR 132.A OG1 LEU 180.A O no hydrogen 2.566 N/A GLY 135.A N CYS 131.A O no hydrogen 2.928 N/A ALA 138.A N THR 129.A O no hydrogen 3.036 N/A ASN 140.A N PHE 127.A O no hydrogen 2.727 N/A TYR 141.A OH GLU 109.A OE2 no hydrogen 2.635 N/A LYS 142.A N ASN 140.A OD1 no hydrogen 2.953 N/A SER 143.A OG GLU 72.A OE1 no hydrogen 2.529 N/A SER 143.A OG GLU 72.A OE2 no hydrogen 3.490 N/A CYS 146.A SG LYS 168.A O no hydrogen 3.440 N/A LEU 149.A N CYS 146.A O no hydrogen 3.224 N/A SER 150.A N PRO 147.A O no hydrogen 3.011 N/A LYS 152.A N LEU 149.A O no hydrogen 2.857 N/A GLY 153.A N GLU 65.A OE2 no hydrogen 2.976 N/A THR 159.A N GLU 156.A O no hydrogen 3.036 N/A THR 159.A OG1 GLU 156.A O no hydrogen 2.671 N/A ALA 162.A N GLU 65.A OE1 no hydrogen 2.751 N/A ILE 164.A N SER 61.A OG no hydrogen 2.964 N/A LYS 168.A N PRO 165.A O no hydrogen 2.778 N/A LEU 169.A N VAL 166.A O no hydrogen 3.257 N/A ARG 171.A NE GLY 178.A O no hydrogen 2.791 N/A ARG 171.A NH1 VAL 166.A O no hydrogen 2.815 N/A ARG 171.A NH2 GLY 178.A O no hydrogen 2.862 N/A CYS 172.A N GLY 179.A O no hydrogen 2.747 N/A CYS 177.A N GLU 174.A O no hydrogen 2.609 N/A GLY 178.A N CYS 172.A O no hydrogen 3.030 N/A LEU 181.A N PRO 170.A O no hydrogen 2.866 N/A ARG 182.A N ARG 130.A O no hydrogen 2.847 N/A ARG 182.A NE PRO 183.A O no hydrogen 3.105 N/A ARG 182.A NH1 VAL 185.A O no hydrogen 2.694 N/A ARG 182.A NH1 GLU 190.A OE1 no hydrogen 3.567 N/A ARG 182.A NH1 GLU 190.A OE2 no hydrogen 2.931 N/A ARG 182.A NH2 GLU 190.A OE1 no hydrogen 2.748 N/A HIS 184.A N LYS 128.A O no hydrogen 2.943 N/A VAL 186.A N HIS 123.A O no hydrogen 2.864 N/A TRP 187.A N GLU 190.A OE2 no hydrogen 3.017 N/A TRP 187.A NE1 TYR 67.A OH no hydrogen 2.925 N/A PHE 188.A N ALA 51.A O no hydrogen 2.962 N/A GLU 190.A N TRP 187.A O no hydrogen 2.958 N/A ILE 196.A N ASP 193.A OD2 no hydrogen 2.869 N/A LEU 197.A N ASP 193.A O no hydrogen 2.864 N/A GLU 198.A N PRO 194.A O no hydrogen 2.965 N/A GLU 199.A N ALA 195.A O no hydrogen 3.125 N/A VAL 200.A N ILE 196.A O no hydrogen 2.866 N/A ASP 201.A N LEU 197.A O no hydrogen 2.876 N/A ARG 202.A N GLU 198.A O no hydrogen 3.131 N/A ARG 202.A NH1 GLU 199.A OE1 no hydrogen 3.236 N/A GLU 203.A N GLU 199.A O no hydrogen 3.043 N/A LEU 204.A N VAL 200.A O no hydrogen 2.915 N/A ALA 205.A N ASP 201.A O no hydrogen 3.010 N/A CYS 207.A N GLU 203.A O no hydrogen 2.967 N/A CYS 207.A SG LEU 204.A O no hydrogen 3.711 N/A CYS 207.A SG LEU 209.A O no hydrogen 3.909 N/A ASP 208.A N HIS 17.A O no hydrogen 2.862 N/A CYS 210.A N PRO 235.A O no hydrogen 3.106 N/A CYS 210.A SG VAL 19.A O no hydrogen 3.707 N/A CYS 210.A SG LEU 211.A O no hydrogen 3.780 N/A LEU 211.A N VAL 19.A O no hydrogen 2.861 N/A VAL 212.A N ALA 237.A O no hydrogen 2.941 N/A VAL 213.A N ILE 21.A O no hydrogen 2.783 N/A GLY 214.A N PHE 239.A O no hydrogen 2.881 N/A THR 215.A OG1 GLN 105.A OE1 no hydrogen 2.950 N/A SER 217.A N THR 215.A OG1 no hydrogen 3.338 N/A ALA 223.A N VAL 219.A O no hydrogen 2.790 N/A MET 224.A N PRO 221.A O no hydrogen 2.882 N/A PHE 225.A N ALA 222.A O no hydrogen 3.092 N/A GLN 228.A N MET 224.A O no hydrogen 2.955 N/A VAL 229.A N PHE 225.A O no hydrogen 3.216 N/A ALA 230.A N ALA 226.A O no hydrogen 2.898 N/A ALA 231.A N PRO 227.A O no hydrogen 2.847 N/A ARG 232.A N VAL 229.A O no hydrogen 3.040 N/A ARG 232.A NH1 LEU 204.A O no hydrogen 2.757 N/A ARG 232.A NH1 CYS 207.A O no hydrogen 2.827 N/A GLY 233.A N ALA 230.A O no hydrogen 2.901 N/A ALA 237.A N CYS 210.A O no hydrogen 2.850 N/A GLU 238.A N PHE 252.A O no hydrogen 2.827 N/A PHE 239.A N VAL 212.A O no hydrogen 2.889 N/A ASN 240.A N PHE 254.A O no hydrogen 3.441 N/A GLU 242.A N ASN 240.A OD1 no hydrogen 2.981 N/A THR 244.A N THR 247.A OG1 no hydrogen 2.754 N/A THR 244.A OG1 GLU 238.A OE2 no hydrogen 2.778 N/A THR 244.A OG1 THR 247.A OG1 no hydrogen 3.398 N/A ALA 246.A N THR 244.A OG1 no hydrogen 3.132 N/A THR 247.A N THR 244.A O no hydrogen 3.038 N/A THR 247.A OG1 GLU 238.A OE1 no hydrogen 2.658 N/A THR 247.A OG1 GLU 238.A OE2 no hydrogen 3.438 N/A THR 247.A OG1 THR 244.A O no hydrogen 3.208 N/A THR 247.A OG1 THR 244.A OG1 no hydrogen 3.398 N/A ARG 249.A N ALA 246.A O no hydrogen 2.899 N/A PHE 250.A N THR 247.A O no hydrogen 3.130 N/A ARG 251.A NH2 GLY 233.A O no hydrogen 2.876 N/A PHE 252.A N VAL 236.A O no hydrogen 2.984 N/A HIS 253.A N SER 2.A O no hydrogen 2.903 N/A HIS 253.A ND1 GLU 238.A OE1 no hydrogen 2.750 N/A PHE 254.A N GLU 238.A O no hydrogen 2.787 N/A GLY 256.A N ASN 240.A O no hydrogen 3.013 N/A CYS 258.A SG.A GLY 25.A O no hydrogen 3.797 N/A CYS 258.A SG.B PHE 239.A O no hydrogen 3.627 N/A GLY 259.A N GLU 29.A OE2 no hydrogen 2.948 N/A THR 260.A N PRO 257.A O no hydrogen 3.018 N/A THR 261.A N PRO 257.A O no hydrogen 3.124 N/A THR 261.A OG1 PRO 257.A O no hydrogen 3.426 N/A LEU 262.A N CYS 258.A O no hydrogen 2.809 N/A ALA 265.A N THR 261.A O no hydrogen 2.903 N/A LEU 266.A N LEU 262.A O no hydrogen 2.815 N/A