Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4ac1_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N GLY 250.A O no hydrogen 2.963 N/A ARG 4.A NH1 ALA 214.A O no hydrogen 2.848 N/A ARG 4.A NH1 GLY 250.A O no hydrogen 3.146 N/A ARG 4.A NH2 ALA 214.A O no hydrogen 3.315 N/A LEU 5.A N THR 34.A OG1 no hydrogen 2.888 N/A ILE 6.A N VAL 252.A O no hydrogen 2.946 N/A VAL 7.A N HIS 35.A O no hydrogen 3.104 N/A TYR 8.A N GLY 254.A O no hydrogen 3.101 N/A TYR 8.A OH ASP 123.A OD2 no hydrogen 2.646 N/A PHE 9.A N ILE 37.A O no hydrogen 2.848 N/A GLN 10.A N GLU 256.A OE1 no hydrogen 2.953 N/A GLN 10.A NE2 SER 40.A OG no hydrogen 2.707 N/A THR 11.A N GLU 256.A OE1 no hydrogen 2.864 N/A THR 11.A OG1 GLU 256.A OE2 no hydrogen 2.633 N/A THR 12.A OG1 HIS 13.A ND1 no hydrogen 2.744 N/A HIS 13.A ND1 THR 12.A OG1 no hydrogen 2.744 N/A ASP 14.A N ARG 18.A O no hydrogen 2.813 N/A SER 16.A N ASP 14.A OD1 no hydrogen 2.838 N/A ASN 17.A N ASP 14.A O no hydrogen 2.781 N/A ARG 18.A N ASP 14.A OD1 no hydrogen 2.925 N/A ILE 20.A N THR 12.A O no hydrogen 2.805 N/A SER 21.A OG GLU 67.A OE1 no hydrogen 3.418 N/A SER 21.A OG GLU 67.A OE2 no hydrogen 2.654 N/A MET 22.A N GLU 67.A OE1 no hydrogen 2.904 N/A LEU 23.A N SER 21.A OG no hydrogen 3.105 N/A LEU 25.A N MET 22.A O no hydrogen 3.239 N/A ILE 26.A N LEU 23.A O no hydrogen 2.872 N/A THR 27.A N LEU 23.A O no hydrogen 3.026 N/A THR 27.A OG1.A LEU 23.A O no hydrogen 3.263 N/A THR 27.A OG1.B LEU 23.A O no hydrogen 2.899 N/A GLU 28.A N PRO 24.A O no hydrogen 2.985 N/A LYS 29.A NZ GLU 28.A OE1 no hydrogen 2.758 N/A ALA 32.A N THR 276.A OG1 no hydrogen 2.894 N/A THR 34.A N LEU 5.A O no hydrogen 2.912 N/A THR 34.A OG1 LEU 5.A O no hydrogen 3.151 N/A THR 34.A OG1 HIS 35.A ND1 no hydrogen 2.707 N/A HIS 35.A N LEU 5.A O no hydrogen 3.229 N/A HIS 35.A ND1 THR 34.A OG1 no hydrogen 2.707 N/A LEU 36.A N LYS 77.A O no hydrogen 2.960 N/A ILE 37.A N VAL 7.A O no hydrogen 2.904 N/A VAL 38.A N MET 79.A O no hydrogen 2.851 N/A CYS 39.A N PHE 9.A O no hydrogen 3.166 N/A CYS 39.A SG ILE 37.A O no hydrogen 3.764 N/A SER 40.A N ASN 52.A OD1 no hydrogen 2.826 N/A PHE 41.A N MET 81.A O no hydrogen 2.854 N/A HIS 42.A N HIS 50.A O no hydrogen 2.770 N/A ILE 43.A N SER 89.A OG no hydrogen 2.946 N/A GLY 46.A N TYR 106.A OH no hydrogen 2.704 N/A GLY 47.A N ASN 44.A O no hydrogen 2.878 N/A HIS 50.A N HIS 42.A O no hydrogen 3.056 N/A HIS 50.A ND1 VAL 48.A O no hydrogen 2.864 N/A LEU 51.A N PHE 54.A O no hydrogen 2.746 N/A ASN 52.A N SER 40.A O no hydrogen 2.930 N/A ASN 52.A ND2 CYS 39.A O no hydrogen 2.920 N/A PHE 54.A N LEU 51.A O no hydrogen 3.317 N/A ASP 58.A N PRO 55.A O no hydrogen 2.971 N/A HIS 60.A N ASP 58.A OD1 no hydrogen 2.871 N/A PHE 61.A N ASP 58.A O no hydrogen 2.941 N/A TYR 62.A N PRO 59.A O no hydrogen 3.083 N/A TRP 65.A N PHE 61.A O no hydrogen 3.029 N/A TRP 65.A NE1 PRO 56.A O no hydrogen 3.006 N/A ASN 66.A N TYR 62.A O no hydrogen 3.099 N/A ASN 66.A ND2 TYR 62.A O no hydrogen 2.748 N/A GLU 67.A N THR 63.A O no hydrogen 2.936 N/A THR 68.A N LEU 64.A O no hydrogen 3.064 N/A THR 68.A OG1 TRP 65.A O no hydrogen 2.754 N/A MET 71.A N GLU 67.A O no hydrogen 3.008 N/A LYS 72.A N THR 68.A O no hydrogen 2.958 N/A LYS 72.A NZ GLN 118.A O no hydrogen 2.946 N/A GLN 73.A N ILE 69.A O no hydrogen 2.919 N/A ALA 74.A N THR 70.A O no hydrogen 3.104 N/A GLY 75.A N LYS 72.A O no hydrogen 2.908 N/A VAL 76.A N MET 71.A O no hydrogen 3.131 N/A LYS 77.A N THR 34.A O no hydrogen 2.929 N/A VAL 78.A N GLU 120.A OE1 no hydrogen 3.111 N/A MET 79.A N LEU 36.A O no hydrogen 2.902 N/A GLY 80.A N GLY 121.A O no hydrogen 3.015 N/A MET 81.A N VAL 38.A O no hydrogen 2.928 N/A VAL 82.A N ASP 123.A O no hydrogen 2.954 N/A GLY 83.A N PHE 41.A O no hydrogen 3.039 N/A GLY 84.A N ASP 125.A O no hydrogen 2.879 N/A THR 92.A OG1 GLN 93.A OE1 no hydrogen 3.111 N/A THR 94.A N ASN 91.A O no hydrogen 3.079 N/A THR 94.A OG1 GLY 88.A O no hydrogen 2.762 N/A ASP 96.A N ASN 91.A O no hydrogen 2.909 N/A SER 97.A N THR 94.A O no hydrogen 3.058 N/A SER 97.A OG THR 92.A O no hydrogen 3.532 N/A SER 97.A OG ASP 99.A O no hydrogen 3.389 N/A ASP 99.A N SER 97.A OG no hydrogen 2.987 N/A THR 102.A N ASP 99.A OD2 no hydrogen 2.958 N/A THR 102.A OG1 ASP 99.A OD2 no hydrogen 2.801 N/A PHE 103.A N ASP 99.A O no hydrogen 2.957 N/A GLU 104.A N SER 100.A O no hydrogen 2.849 N/A HIS 105.A N ALA 101.A O no hydrogen 2.911 N/A TYR 106.A N THR 102.A O no hydrogen 3.085 N/A TYR 107.A N PHE 103.A O no hydrogen 2.760 N/A TYR 107.A OH ASP 145.A OD2 no hydrogen 2.715 N/A GLY 108.A N GLU 104.A O no hydrogen 2.823 N/A GLN 109.A N HIS 105.A O no hydrogen 3.196 N/A GLN 109.A NE2 GLY 47.A O no hydrogen 2.909 N/A LEU 110.A N TYR 106.A O no hydrogen 3.149 N/A ARG 111.A N TYR 107.A O no hydrogen 2.850 N/A ARG 111.A NE ASP 112.A OD1 no hydrogen 3.357 N/A ARG 111.A NH2 ASP 112.A OD1 no hydrogen 3.261 N/A ASP 112.A N GLY 108.A O no hydrogen 2.826 N/A ALA 113.A N GLN 109.A O no hydrogen 2.977 N/A ILE 114.A N LEU 110.A O no hydrogen 3.022 N/A VAL 115.A N ARG 111.A O no hydrogen 3.065 N/A ASN 116.A N ASP 112.A O no hydrogen 2.820 N/A PHE 117.A N ALA 113.A O no hydrogen 2.936 N/A GLN 118.A N VAL 115.A O no hydrogen 3.227 N/A LEU 119.A N ILE 114.A O no hydrogen 3.053 N/A GLU 120.A N VAL 78.A O no hydrogen 2.784 N/A MET 122.A N LEU 151.A O no hydrogen 2.812 N/A ASP 123.A N GLY 80.A O no hydrogen 2.797 N/A LEU 124.A N THR 153.A O no hydrogen 2.828 N/A ASP 125.A N VAL 82.A O no hydrogen 3.102 N/A GLN 128.A NE2 GLY 84.A O no hydrogen 3.366 N/A MET 130.A N SER 168.A O no hydrogen 2.909 N/A SER 131.A N ASP 96.A OD2 no hydrogen 2.937 N/A SER 131.A OG ASP 96.A OD1 no hydrogen 2.719 N/A GLN 132.A NE2 ASP 136.A OD1 no hydrogen 3.299 N/A GLN 132.A NE2 SER 171.A O no hydrogen 3.294 N/A GLY 134.A N SER 131.A OG no hydrogen 2.912 N/A ILE 135.A N SER 131.A O no hydrogen 3.102 N/A ASP 136.A N GLN 132.A O no hydrogen 3.000 N/A ARG 137.A N GLN 133.A O no hydrogen 2.961 N/A ARG 137.A NH2 LEU 95.A O no hydrogen 3.437 N/A ARG 137.A NH2 SER 97.A O no hydrogen 3.018 N/A LEU 138.A N GLY 134.A O no hydrogen 2.981 N/A ILE 139.A N ILE 135.A O no hydrogen 3.067 N/A ALA 140.A N ASP 136.A O no hydrogen 2.970 N/A ARG 141.A N ARG 137.A O no hydrogen 2.843 N/A ARG 141.A NE ASP 145.A OD1 no hydrogen 3.431 N/A ARG 141.A NE ASP 145.A OD2 no hydrogen 2.942 N/A ARG 141.A NH1 GLU 104.A OE2 no hydrogen 2.685 N/A ARG 141.A NH2 GLU 104.A OE1 no hydrogen 3.022 N/A ARG 141.A NH2 GLU 104.A OE2 no hydrogen 3.501 N/A LEU 142.A N LEU 138.A O no hydrogen 2.964 N/A ARG 143.A N ILE 139.A O no hydrogen 2.934 N/A ARG 143.A NE.A ASP 182.A O no hydrogen 3.252 N/A ARG 143.A NH1.A GLY 147.A O no hydrogen 2.730 N/A ARG 143.A NH1.A PHE 150.A O no hydrogen 2.614 N/A ARG 143.A NH1.B ARG 143.A O no hydrogen 2.912 N/A ARG 143.A NH2.A PHE 150.A O no hydrogen 3.052 N/A ARG 143.A NH2.A ASP 182.A O no hydrogen 2.737 N/A ARG 143.A NH2.A ASP 184.A OD2 no hydrogen 3.059 N/A ALA 144.A N ALA 140.A O no hydrogen 2.866 N/A ASP 145.A N ARG 141.A O no hydrogen 2.886 N/A PHE 146.A N LEU 142.A O no hydrogen 2.894 N/A GLY 147.A N ARG 143.A O no hydrogen 3.128 N/A LEU 151.A N GLU 120.A O no hydrogen 3.041 N/A ILE 152.A N ASP 184.A OD2 no hydrogen 2.888 N/A THR 153.A N MET 122.A O no hydrogen 3.106 N/A THR 153.A OG1 ASP 123.A OD1 no hydrogen 2.692 N/A LEU 154.A N TRP 185.A O no hydrogen 3.441 N/A ALA 158.A N GLN 189.A O no hydrogen 2.998 N/A SER 159.A OG SER 165.A O no hydrogen 2.679 N/A SER 159.A OG PHE 194.A O no hydrogen 3.548 N/A ALA 160.A N VAL 157.A O no hydrogen 2.882 N/A LEU 161.A N ALA 158.A O no hydrogen 2.933 N/A GLU 162.A N SER 159.A O no hydrogen 3.042 N/A SER 164.A N SER 159.A O no hydrogen 3.010 N/A ASN 166.A ND2 PHE 170.A O no hydrogen 2.732 N/A SER 168.A N ASN 166.A OD1 no hydrogen 2.938 N/A SER 168.A OG VAL 126.A O no hydrogen 2.688 N/A SER 168.A OG ASN 166.A OD1 no hydrogen 3.375 N/A SER 168.A OG TYR 172.A OH no hydrogen 2.664 N/A PHE 170.A N SER 168.A O no hydrogen 2.887 N/A SER 171.A N GLN 132.A OE1 no hydrogen 2.871 N/A TYR 172.A OH SER 168.A OG no hydrogen 2.664 N/A THR 173.A OG1.A SER 171.A OG no hydrogen 3.004 N/A ALA 174.A N SER 171.A OG no hydrogen 3.031 N/A LEU 175.A N SER 171.A O no hydrogen 3.001 N/A GLN 176.A N TYR 172.A O no hydrogen 2.918 N/A GLN 177.A N THR 173.A O no hydrogen 3.066 N/A THR 178.A N ALA 174.A O no hydrogen 3.082 N/A THR 178.A OG1 ASP 136.A OD2 no hydrogen 3.564 N/A THR 178.A OG1 ALA 174.A O no hydrogen 3.192 N/A THR 178.A OG1 GLN 179.A OE1 no hydrogen 2.588 N/A GLN 179.A N LEU 175.A O no hydrogen 2.751 N/A ASP 182.A N GLN 179.A O no hydrogen 2.779 N/A ILE 183.A N GLY 180.A O no hydrogen 3.156 N/A ASP 184.A N ILE 152.A O no hydrogen 2.806 N/A TRP 185.A NE1 ASN 187.A OD1 no hydrogen 2.790 N/A TYR 186.A N LYS 215.A O no hydrogen 2.751 N/A TYR 186.A OH GLN 176.A OE1 no hydrogen 2.681 N/A ASN 187.A N LEU 154.A O no hydrogen 2.744 N/A ASN 187.A ND2 ASP 123.A OD1 no hydrogen 2.889 N/A ASN 187.A ND2 LEU 154.A O no hydrogen 3.668 N/A THR 188.A N VAL 217.A O no hydrogen 2.951 N/A THR 188.A OG1 TYR 186.A O no hydrogen 3.074 N/A GLN 189.A N PRO 156.A O no hydrogen 2.899 N/A GLN 189.A NE2 ALA 155.A O no hydrogen 2.880 N/A PHE 190.A N GLY 219.A O no hydrogen 3.389 N/A TYR 191.A OH GLN 189.A OE1 no hydrogen 3.375 N/A SER 192.A N ALA 227.A O no hydrogen 2.724 N/A PHE 194.A N TYR 191.A O no hydrogen 3.142 N/A SER 196.A N ASP 202.A OD2 no hydrogen 2.877 N/A ALA 198.A N SER 196.A OG no hydrogen 2.984 N/A THR 200.A OG1 ASP 204.A OD2 no hydrogen 3.247 N/A SER 201.A N ASP 199.A OD1 no hydrogen 2.993 N/A SER 201.A OG.A ASP 199.A OD1 no hydrogen 2.638 N/A SER 201.A OG.B ASP 199.A OD1 no hydrogen 3.475 N/A TYR 203.A OH VAL 216.A O no hydrogen 2.799 N/A ASP 204.A N THR 200.A O no hydrogen 2.907 N/A ARG 205.A N SER 201.A O no hydrogen 2.929 N/A ARG 205.A NH1 GLU 162.A OE2 no hydrogen 2.862 N/A ARG 205.A NH1 ASP 202.A OD1 no hydrogen 2.856 N/A ILE 206.A N ASP 202.A O no hydrogen 2.951 N/A VAL 207.A N TYR 203.A O no hydrogen 3.003 N/A ALA 208.A N ASP 204.A O no hydrogen 2.948 N/A ASN 209.A N ARG 205.A O no hydrogen 3.007 N/A ASN 209.A N ILE 206.A O no hydrogen 3.018 N/A ASN 209.A ND2 LEU 161.A O no hydrogen 2.939 N/A ASN 209.A ND2 ASP 163.A OD1 no hydrogen 3.052 N/A GLY 210.A N VAL 207.A O no hydrogen 3.075 N/A PHE 211.A N ILE 206.A O no hydrogen 3.439 N/A LYS 215.A N ALA 212.A O no hydrogen 2.772 N/A LYS 215.A NZ GLN 176.A OE1 no hydrogen 3.192 N/A LYS 215.A NZ GLY 180.A O no hydrogen 2.623 N/A LYS 215.A NZ ILE 183.A O no hydrogen 2.978 N/A VAL 216.A N PRO 213.A O no hydrogen 3.040 N/A VAL 217.A N TYR 186.A O no hydrogen 3.022 N/A ALA 218.A N GLY 251.A O no hydrogen 2.836 N/A GLY 219.A N THR 188.A O no hydrogen 2.718 N/A GLN 220.A N MET 253.A O no hydrogen 2.875 N/A GLN 220.A NE2 GLY 219.A O no hydrogen 3.019 N/A THR 222.A N TRP 255.A O no hydrogen 2.916 N/A THR 222.A OG1 TRP 255.A O no hydrogen 3.303 N/A THR 222.A OG1 GLU 256.A O no hydrogen 2.836 N/A THR 222.A OG1 SER 260.A OG no hydrogen 3.304 N/A GLU 225.A N THR 223.A OG1 no hydrogen 3.156 N/A SER 234.A N PRO 231.A O no hydrogen 2.971 N/A LEU 235.A N PRO 231.A O no hydrogen 3.154 N/A ASN 236.A N THR 232.A O no hydrogen 2.783 N/A ASN 237.A N SER 233.A O no hydrogen 3.133 N/A THR 238.A N SER 234.A O no hydrogen 3.183 N/A THR 238.A OG1 MET 197.A O no hydrogen 2.672 N/A THR 238.A OG1 SER 234.A O no hydrogen 3.405 N/A ILE 239.A N LEU 235.A O no hydrogen 2.910 N/A VAL 240.A N ASN 236.A O no hydrogen 2.911 N/A SER 241.A N ASN 237.A O no hydrogen 3.325 N/A SER 241.A OG.A ASN 237.A O no hydrogen 3.457 N/A LEU 242.A N THR 238.A O no hydrogen 2.912 N/A VAL 243.A N ILE 239.A O no hydrogen 2.861 N/A SER 244.A N VAL 240.A O no hydrogen 3.133 N/A SER 244.A OG SER 241.A O no hydrogen 2.680 N/A GLU 245.A N SER 241.A O no hydrogen 3.234 N/A GLU 245.A N LEU 242.A O no hydrogen 2.993 N/A TYR 246.A N LEU 242.A O no hydrogen 2.864 N/A TYR 246.A OH ASP 204.A OD1 no hydrogen 2.720 N/A GLY 247.A N VAL 243.A O no hydrogen 2.745 N/A VAL 252.A N ARG 4.A O no hydrogen 3.006 N/A MET 253.A N ALA 218.A O no hydrogen 3.143 N/A GLY 254.A N ILE 6.A O no hydrogen 2.945 N/A TRP 255.A N GLN 220.A O no hydrogen 2.910 N/A TYR 257.A N TYR 8.A O no hydrogen 2.888 N/A SER 260.A N TYR 257.A O no hydrogen 3.065 N/A SER 260.A OG GLU 256.A O no hydrogen 3.017 N/A SER 260.A OG TYR 257.A O no hydrogen 2.753 N/A LEU 261.A N THR 222.A O no hydrogen 2.964 N/A GLY 264.A N SER 260.A O no hydrogen 2.824 N/A GLU 267.A N GLY 263.A O no hydrogen 3.118 N/A GLU 267.A N GLY 264.A O no hydrogen 3.237 N/A GLU 270.A N GLU 267.A O no hydrogen 3.261 N/A GLN 273.A N TRP 269.A O no hydrogen 3.180 N/A GLN 273.A NE2 LYS 29.A O no hydrogen 2.794 N/A ILE 274.A N GLU 270.A O no hydrogen 2.944 N/A VAL 275.A N TRP 271.A O no hydrogen 2.880 N/A THR 276.A N ALA 272.A O no hydrogen 2.899 N/A THR 276.A OG1 ALA 272.A O no hydrogen 2.756 N/A VAL 277.A N GLN 273.A O no hydrogen 3.031 N/A ILE 278.A N ILE 274.A O no hydrogen 3.052 N/A LEU 279.A N VAL 275.A O no hydrogen 2.920 N/A ARG 280.A N THR 276.A O no hydrogen 2.760 N/A ARG 280.A NH2 ASP 1.A OD2 no hydrogen 2.611 N/A ARG 280.A NH2 PRO 3.A O no hydrogen 2.948 N/A LEU 283.A N ARG 280.A O no hydrogen 3.111 N/A