Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4yuw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLU 5.A OE1 no hydrogen 3.297 N/A GLY 3.A N GLU 5.A OE2 no hydrogen 3.061 N/A SER 4.A OG ASP 34.A OD2 no hydrogen 3.036 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.725 N/A LEU 6.A N GLY 3.A O no hydrogen 3.327 N/A ILE 7.A N SER 4.A O no hydrogen 3.234 N/A SER 8.A N TRP 11.A O no hydrogen 2.940 N/A TRP 11.A N SER 8.A O no hydrogen 3.177 N/A PHE 12.A N LEU 26.A O no hydrogen 2.694 N/A ARG 13.A N LEU 6.A O no hydrogen 2.924 N/A ARG 13.A NE GLU 15.A OE2 no hydrogen 2.826 N/A ARG 13.A NH1 GLU 15.A OE2 no hydrogen 2.949 N/A GLU 14.A N MET 24.A O no hydrogen 2.913 N/A GLN 18.A N ASN 16.A OD1 no hydrogen 2.984 N/A GLN 18.A NE2 ASN 16.A OD1 no hydrogen 3.068 N/A TRP 19.A N ASN 16.A O no hydrogen 3.086 N/A TRP 19.A NE1 GLU 14.A O no hydrogen 2.996 N/A LEU 26.A N PHE 12.A O no hydrogen 2.950 N/A ARG 27.A NE ASP 48.A OD2 no hydrogen 2.991 N/A VAL 28.A N GLY 10.A O no hydrogen 2.657 N/A GLU 29.A N GLU 46.A O no hydrogen 2.705 N/A LYS 30.A N GLU 46.A O no hydrogen 3.234 N/A LEU 32.A N ILE 44.A O no hydrogen 2.805 N/A TYR 33.A N ILE 44.A O no hydrogen 3.174 N/A ALA 35.A N LEU 42.A O no hydrogen 3.057 N/A THR 37.A N GLN 40.A O no hydrogen 2.819 N/A THR 37.A OG1 ASP 120.A OD1 no hydrogen 3.416 N/A GLN 40.A NE2 ASP 120.A OD2 no hydrogen 2.779 N/A HIS 41.A N ASP 60.A OD1 no hydrogen 2.737 N/A HIS 41.A NE2 ASP 34.A OD1 no hydrogen 2.756 N/A LEU 42.A N ALA 35.A O no hydrogen 3.026 N/A THR 43.A N ALA 58.A O no hydrogen 2.947 N/A THR 43.A OG1 ASP 34.A OD1 no hydrogen 2.759 N/A ILE 44.A N TYR 33.A O no hydrogen 2.854 N/A PHE 45.A N VAL 56.A O no hydrogen 2.886 N/A GLU 46.A N LYS 30.A O no hydrogen 2.814 N/A SER 47.A N GLY 54.A O no hydrogen 3.005 N/A SER 47.A OG GLY 54.A O no hydrogen 2.686 N/A ASP 48.A N ARG 27.A O no hydrogen 3.226 N/A LYS 50.A N ASP 48.A OD1 no hydrogen 2.744 N/A GLY 51.A N ASP 48.A O no hydrogen 2.819 N/A THR 55.A N ASP 67.A OD2 no hydrogen 2.568 N/A THR 55.A OG1 GLU 46.A OE1 no hydrogen 2.805 N/A THR 55.A OG1 ASP 67.A OD2 no hydrogen 3.150 N/A VAL 56.A N PHE 45.A O no hydrogen 2.775 N/A MET 57.A N VAL 65.A O no hydrogen 2.935 N/A ALA 58.A N THR 43.A O no hydrogen 2.780 N/A LEU 59.A N CYS 62.A O no hydrogen 2.925 N/A ASP 60.A N HIS 41.A O no hydrogen 2.724 N/A CYS 62.A N LEU 59.A O no hydrogen 2.917 N/A CYS 62.A SG ASP 60.A O no hydrogen 3.744 N/A CYS 62.A SG ASP 171.A OD2 no hydrogen 3.627 N/A ILE 63.A N GLU 14.A OE2 no hydrogen 2.842 N/A GLN 64.A N MET 57.A O no hydrogen 2.694 N/A GLN 64.A NE2 CYS 62.A O no hydrogen 3.044 N/A VAL 65.A N MET 57.A O no hydrogen 3.479 N/A THR 66.A OG1 ASP 69.A OD1 no hydrogen 2.927 N/A ASP 67.A N THR 55.A O no hydrogen 3.135 N/A TYR 68.A N THR 66.A OG1 no hydrogen 3.210 N/A GLU 70.A N THR 66.A O no hydrogen 3.275 N/A VAL 72.A N ASP 69.A O no hydrogen 3.207 N/A TYR 73.A OH ASP 168.A OD1 no hydrogen 2.578 N/A HIS 74.A N GLU 70.A O no hydrogen 3.424 N/A HIS 74.A ND1 GLU 70.A OE2 no hydrogen 2.840 N/A GLU 75.A N PHE 71.A O no hydrogen 3.020 N/A VAL 76.A N VAL 72.A O no hydrogen 2.832 N/A LEU 77.A N TYR 73.A O no hydrogen 3.026 N/A GLY 78.A N HIS 74.A O no hydrogen 3.116 N/A HIS 79.A N GLU 75.A O no hydrogen 2.846 N/A HIS 79.A ND1 HIS 108.A NE2 no hydrogen 2.866 N/A HIS 79.A NE2 GLU 104.A OE1 no hydrogen 2.859 N/A THR 80.A N VAL 76.A O no hydrogen 2.889 N/A THR 80.A OG1 VAL 76.A O no hydrogen 2.650 N/A SER 81.A OG LEU 77.A O no hydrogen 2.767 N/A SER 81.A OG GLY 78.A O no hydrogen 3.150 N/A LEU 82.A N GLY 78.A O no hydrogen 3.211 N/A CYS 83.A N HIS 79.A O no hydrogen 2.861 N/A CYS 83.A SG ARG 260.A O no hydrogen 3.417 N/A SER 84.A N SER 81.A O no hydrogen 2.990 N/A SER 84.A OG THR 80.A O no hydrogen 2.728 N/A SER 84.A OG VAL 255.A O no hydrogen 3.465 N/A HIS 85.A N LEU 82.A O no hydrogen 3.078 N/A LYS 87.A N HIS 85.A ND1 no hydrogen 2.982 N/A GLU 89.A N ASP 163.A OD2 no hydrogen 2.838 N/A ARG 90.A N ASP 163.A OD2 no hydrogen 2.997 N/A ARG 90.A NE THR 161.A O no hydrogen 3.426 N/A VAL 91.A N HIS 113.A O no hydrogen 3.053 N/A LEU 92.A N VAL 164.A O no hydrogen 2.956 N/A ILE 93.A N ASP 115.A O no hydrogen 2.698 N/A ILE 94.A N ILE 166.A O no hydrogen 2.788 N/A GLY 95.A N VAL 117.A O no hydrogen 2.808 N/A GLY 96.A N ASP 168.A O no hydrogen 3.057 N/A GLY 97.A N ASP 118.A OD2 no hydrogen 2.753 N/A GLY 99.A N GLY 96.A O no hydrogen 2.936 N/A GLY 100.A N ASP 98.A OD1 no hydrogen 2.774 N/A ARG 103.A N GLY 99.A O no hydrogen 2.753 N/A ARG 103.A NE GLU 104.A OE2 no hydrogen 2.927 N/A ARG 103.A NH1 GLU 70.A OE1 no hydrogen 3.038 N/A ARG 103.A NH1 GLU 70.A OE2 no hydrogen 3.320 N/A ARG 103.A NH1 GLN 133.A O no hydrogen 2.934 N/A ARG 103.A NH2 GLU 70.A OE1 no hydrogen 3.554 N/A ARG 103.A NH2 GLU 70.A OE2 no hydrogen 2.922 N/A ARG 103.A NH2 GLU 104.A OE2 no hydrogen 2.864 N/A GLU 104.A N GLY 100.A O no hydrogen 3.285 N/A VAL 105.A N VAL 101.A O no hydrogen 2.854 N/A LEU 106.A N LEU 102.A O no hydrogen 2.893 N/A ARG 107.A N GLU 104.A O no hydrogen 3.060 N/A ARG 107.A NE GLU 104.A OE1 no hydrogen 2.716 N/A ARG 107.A NH2 GLU 104.A OE2 no hydrogen 3.190 N/A HIS 108.A N VAL 105.A O no hydrogen 3.033 N/A HIS 108.A NE2 HIS 79.A ND1 no hydrogen 2.866 N/A THR 110.A OG1 PRO 88.A O no hydrogen 2.826 N/A VAL 111.A N HIS 108.A O no hydrogen 3.320 N/A GLU 112.A N GLU 89.A O no hydrogen 2.730 N/A HIS 113.A N GLU 89.A O no hydrogen 3.124 N/A HIS 113.A NE2 ASP 115.A OD1 no hydrogen 2.689 N/A CYS 114.A N ARG 142.A O no hydrogen 2.846 N/A CYS 114.A SG VAL 91.A O no hydrogen 3.487 N/A CYS 114.A SG ASP 115.A O no hydrogen 3.616 N/A ASP 115.A N VAL 91.A O no hydrogen 2.904 N/A LEU 116.A N THR 144.A O no hydrogen 2.908 N/A VAL 117.A N ILE 93.A O no hydrogen 2.782 N/A ASP 118.A N ARG 146.A O no hydrogen 3.084 N/A ASP 120.A N ASP 118.A OD1 no hydrogen 2.805 N/A VAL 123.A N ASP 120.A O no hydrogen 2.966 N/A MET 124.A N ASP 120.A O no hydrogen 3.460 N/A GLU 125.A N GLY 121.A O no hydrogen 2.911 N/A GLN 126.A N GLU 122.A O no hydrogen 2.853 N/A GLN 126.A NE2 GLU 122.A OE2 no hydrogen 2.732 N/A SER 127.A N VAL 123.A O no hydrogen 2.800 N/A SER 127.A OG VAL 123.A O no hydrogen 2.768 N/A LYS 128.A N MET 124.A O no hydrogen 3.011 N/A GLN 129.A N GLU 125.A O no hydrogen 3.124 N/A HIS 130.A N GLN 126.A O no hydrogen 2.762 N/A PHE 131.A N SER 127.A O no hydrogen 2.874 N/A ILE 134.A N PHE 131.A O no hydrogen 2.952 N/A SER 135.A N PHE 131.A O no hydrogen 2.992 N/A SER 135.A OG SER 127.A O no hydrogen 3.005 N/A SER 135.A OG PHE 131.A O no hydrogen 3.059 N/A SER 137.A OG GLY 99.A O no hydrogen 2.672 N/A SER 137.A OG ILE 134.A O no hydrogen 3.350 N/A LEU 138.A N SER 135.A O no hydrogen 3.103 N/A ASP 140.A N SER 137.A O no hydrogen 2.890 N/A ARG 142.A N ASP 140.A OD1 no hydrogen 2.828 N/A ARG 142.A NH1 HIS 108.A O no hydrogen 3.266 N/A ARG 142.A NH1 VAL 111.A O no hydrogen 2.945 N/A ARG 142.A NH2 LEU 106.A O no hydrogen 2.777 N/A ALA 143.A N ASP 140.A O no hydrogen 2.920 N/A THR 144.A N CYS 114.A O no hydrogen 2.911 N/A ARG 146.A N LEU 116.A O no hydrogen 2.735 N/A GLY 148.A N ASP 118.A O no hydrogen 2.943 N/A LEU 151.A N ASP 149.A OD1 no hydrogen 3.058 N/A ALA 152.A N ASP 149.A OD2 no hydrogen 3.389 N/A PHE 153.A N ASP 149.A O no hydrogen 3.023 N/A VAL 154.A N GLY 150.A O no hydrogen 2.924 N/A ARG 155.A N LEU 151.A O no hydrogen 2.997 N/A GLN 156.A N ALA 152.A O no hydrogen 3.005 N/A GLN 156.A N PHE 153.A O no hydrogen 3.052 N/A GLN 156.A NE2 ALA 152.A O no hydrogen 3.092 N/A THR 157.A N VAL 154.A O no hydrogen 3.176 N/A THR 157.A OG1 PHE 153.A O no hydrogen 2.888 N/A ASN 160.A N ARG 190.A O no hydrogen 3.092 N/A THR 161.A N ILE 191.A O no hydrogen 2.758 N/A THR 161.A OG1 PRO 158.A O no hydrogen 2.745 N/A THR 161.A OG1 ASP 159.A O no hydrogen 3.548 N/A TYR 162.A N ILE 191.A O no hydrogen 3.013 N/A TYR 162.A OH ASP 115.A OD2 no hydrogen 2.580 N/A ASP 163.A N ARG 90.A O no hydrogen 2.872 N/A VAL 164.A N ARG 90.A O no hydrogen 3.436 N/A VAL 165.A N ILE 197.A O no hydrogen 2.965 N/A ILE 166.A N LEU 92.A O no hydrogen 2.816 N/A ILE 167.A N CYS 199.A O no hydrogen 2.855 N/A ASP 168.A N ILE 94.A O no hydrogen 2.803 N/A THR 169.A OG1 THR 170.A O no hydrogen 2.926 N/A ALA 173.A N GLN 18.A OE1 no hydrogen 3.273 N/A SER 177.A N GLY 174.A O no hydrogen 3.135 N/A LEU 179.A N ALA 176.A O no hydrogen 2.852 N/A PHE 180.A N SER 177.A O no hydrogen 3.207 N/A GLY 181.A N LYS 178.A O no hydrogen 3.023 N/A TYR 185.A N GLY 181.A O no hydrogen 3.263 N/A LYS 186.A N GLU 182.A O no hydrogen 2.987 N/A ASP 187.A N ALA 183.A O no hydrogen 3.279 N/A VAL 188.A N PHE 184.A O no hydrogen 2.866 N/A LEU 189.A N TYR 185.A O no hydrogen 2.879 N/A ARG 190.A N LYS 186.A O no hydrogen 3.142 N/A ARG 190.A NE ASP 187.A OD1 no hydrogen 2.967 N/A ARG 190.A NH1 THR 157.A O no hydrogen 2.832 N/A ARG 190.A NH1 ASP 159.A OD1 no hydrogen 2.757 N/A ARG 190.A NH2 THR 157.A O no hydrogen 3.037 N/A ARG 190.A NH2 ASP 187.A OD1 no hydrogen 3.083 N/A ILE 191.A N ASP 187.A O no hydrogen 2.942 N/A LEU 192.A N VAL 188.A O no hydrogen 3.093 N/A LEU 192.A N LEU 189.A O no hydrogen 3.294 N/A LYS 193.A N TYR 162.A O no hydrogen 2.957 N/A GLY 196.A N LYS 193.A O no hydrogen 2.813 N/A ILE 197.A N ASP 163.A O no hydrogen 3.066 N/A CYS 198.A N CYS 247.A O no hydrogen 2.916 N/A CYS 198.A SG VAL 165.A O no hydrogen 3.970 N/A CYS 199.A N VAL 165.A O no hydrogen 3.056 N/A CYS 199.A SG LEU 77.A O no hydrogen 3.616 N/A ASN 200.A N THR 244.A OG1 no hydrogen 3.121 N/A ASN 200.A ND2 TYR 185.A OH no hydrogen 2.997 N/A GLN 201.A NE2 THR 169.A O no hydrogen 3.245 N/A GLN 201.A NE2 THR 170.A O no hydrogen 3.488 N/A GLN 201.A NE2 GLU 203.A OE2 no hydrogen 3.067 N/A GLY 202.A N GLY 243.A O no hydrogen 2.764 N/A GLU 203.A N GLN 201.A OE1 no hydrogen 2.777 N/A SER 204.A N ASP 208.A OD2 no hydrogen 3.062 N/A TRP 206.A N SER 204.A OG no hydrogen 3.052 N/A LEU 207.A N SER 204.A OG no hydrogen 3.322 N/A ASP 208.A N SER 204.A O no hydrogen 2.860 N/A GLU 210.A N GLU 210.A OE2 no hydrogen 2.605 N/A ILE 212.A N ASP 208.A O no hydrogen 2.899 N/A GLU 213.A N LEU 209.A O no hydrogen 2.833 N/A LYS 214.A N GLU 210.A O no hydrogen 2.930 N/A MET 215.A N LEU 211.A O no hydrogen 2.883 N/A SER 216.A N ILE 212.A O no hydrogen 2.909 N/A ARG 217.A N GLU 213.A O no hydrogen 3.082 N/A PHE 218.A N LYS 214.A O no hydrogen 2.862 N/A ILE 219.A N MET 215.A O no hydrogen 2.882 N/A ARG 220.A N SER 216.A O no hydrogen 3.219 N/A GLU 221.A N ARG 217.A O no hydrogen 2.913 N/A THR 222.A N PHE 218.A O no hydrogen 2.748 N/A THR 222.A OG1 ILE 219.A O no hydrogen 3.207 N/A GLY 223.A N ARG 220.A O no hydrogen 3.029 N/A PHE 224.A N ILE 219.A O no hydrogen 3.191 N/A ALA 225.A N SER 248.A O no hydrogen 2.903 N/A SER 226.A N SER 248.A O no hydrogen 3.314 N/A GLN 228.A N VAL 246.A O no hydrogen 2.979 N/A GLN 228.A NE2 VAL 227.A O no hydrogen 3.162 N/A GLN 228.A NE2 ASN 293.A O no hydrogen 3.005 N/A TYR 229.A N ASN 293.A OD1 no hydrogen 2.743 N/A TYR 229.A OH GLU 203.A O no hydrogen 2.592 N/A ALA 230.A N THR 244.A O no hydrogen 2.865 N/A LEU 231.A N SER 282.A O no hydrogen 2.762 N/A MET 232.A N ILE 242.A O no hydrogen 2.992 N/A HIS 233.A N TYR 273.A OH no hydrogen 3.208 N/A VAL 234.A N GLY 240.A O no hydrogen 3.089 N/A THR 236.A N ASP 69.A OD2 no hydrogen 3.247 N/A THR 236.A OG1 ASP 69.A OD1 no hydrogen 3.268 N/A THR 236.A OG1 ASP 69.A OD2 no hydrogen 2.696 N/A TYR 237.A N VAL 234.A O no hydrogen 3.209 N/A TYR 237.A OH GLN 64.A O no hydrogen 2.654 N/A CYS 239.A SG GLN 22.A OE1 no hydrogen 3.516 N/A GLY 240.A N TYR 237.A O no hydrogen 2.722 N/A ILE 242.A N MET 232.A O no hydrogen 3.290 N/A GLY 243.A N GLU 203.A O no hydrogen 3.144 N/A THR 244.A N ALA 230.A O no hydrogen 3.006 N/A THR 244.A OG1 ASN 200.A O no hydrogen 2.661 N/A LEU 245.A N ASN 200.A OD1 no hydrogen 2.915 N/A VAL 246.A N GLN 228.A O no hydrogen 2.705 N/A CYS 247.A N CYS 198.A O no hydrogen 2.743 N/A CYS 247.A SG LEU 245.A O no hydrogen 3.801 N/A SER 248.A N SER 226.A O no hydrogen 2.883 N/A SER 248.A OG LYS 250.A O no hydrogen 2.713 N/A LYS 249.A N GLY 196.A O no hydrogen 3.011 N/A LYS 249.A NZ LEU 189.A O no hydrogen 2.656 N/A LYS 249.A NZ LEU 192.A O no hydrogen 2.907 N/A THR 256.A N ASP 254.A OD1 no hydrogen 2.988 N/A THR 256.A OG1 ASP 254.A OD1 no hydrogen 2.716 N/A LYS 257.A N ASP 254.A O no hydrogen 3.412 N/A LYS 257.A NZ THR 256.A OG1 no hydrogen 3.394 N/A LEU 259.A N CYS 83.A O no hydrogen 3.017 N/A ARG 260.A N CYS 83.A O no hydrogen 2.984 N/A ARG 260.A NE HIS 85.A O no hydrogen 2.629 N/A ARG 260.A NH2 LEU 82.A O no hydrogen 2.819 N/A GLU 263.A N GLU 263.A OE1 no hydrogen 2.828 N/A ASP 264.A N PRO 261.A O no hydrogen 3.133 N/A MET 265.A N VAL 262.A O no hydrogen 2.784 N/A ASP 270.A N PHE 267.A O no hydrogen 2.843 N/A LEU 271.A N ALA 268.A O no hydrogen 3.107 N/A LYS 272.A N GLU 75.A OE2 no hydrogen 2.844 N/A TYR 273.A N GLU 75.A OE1 no hydrogen 2.784 N/A TYR 274.A N GLU 75.A OE1 no hydrogen 2.823 N/A TYR 274.A OH HIS 279.A ND1 no hydrogen 2.734 N/A SER 276.A N GLU 263.A OE2 no hydrogen 2.892 N/A SER 276.A OG GLU 263.A OE1 no hydrogen 2.569 N/A MET 278.A N ASP 275.A OD1 no hydrogen 2.800 N/A HIS 279.A N ASP 275.A O no hydrogen 2.861 N/A HIS 279.A ND1 TYR 274.A OH no hydrogen 2.734 N/A HIS 279.A NE2 VAL 255.A O no hydrogen 2.685 N/A LYS 280.A N SER 276.A O no hydrogen 3.009 N/A LYS 280.A NZ GLU 277.A OE2 no hydrogen 2.895 N/A ALA 281.A N GLU 277.A O no hydrogen 3.011 N/A SER 282.A N MET 278.A O no hydrogen 2.889 N/A SER 282.A N HIS 279.A O no hydrogen 3.301 N/A SER 282.A OG HIS 279.A O no hydrogen 2.707 N/A PHE 283.A N LYS 280.A O no hydrogen 3.302 N/A ALA 284.A N ALA 281.A O no hydrogen 3.097 N/A ALA 289.A N PRO 286.A O no hydrogen 2.934 N/A ARG 290.A N ARG 287.A O no hydrogen 3.197 N/A ARG 290.A NH1 ARG 287.A O no hydrogen 3.479 N/A HIS 291.A NE2 GLU 213.A OE2 no hydrogen 2.684 N/A ILE 292.A N ALA 289.A O no hydrogen 3.007 N/A ASN 293.A N ARG 290.A O no hydrogen 2.906 N/A ASN 293.A ND2 TYR 229.A O no hydrogen 2.901 N/A ASN 293.A ND2 PHE 283.A O no hydrogen 3.162 N/A ASN 294.A N ARG 290.A O no hydrogen 3.037 N/A ASN 294.A ND2 ARG 290.A O no hydrogen 2.781 N/A