Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1zuw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N MET 1.A O no hydrogen 3.097 N/A ILE 6.A N ASN 30.A O no hydrogen 2.939 N/A GLY 7.A N MET 69.A O no hydrogen 2.901 N/A VAL 8.A N ILE 32.A O no hydrogen 2.916 N/A ILE 9.A N VAL 71.A O no hydrogen 2.939 N/A ASP 10.A N VAL 34.A O no hydrogen 2.941 N/A GLY 12.A N ASP 10.A OD2 no hydrogen 2.871 N/A GLY 15.A N ASP 10.A OD2 no hydrogen 2.861 N/A LEU 16.A N VAL 13.A O no hydrogen 2.982 N/A THR 17.A N GLY 14.A O no hydrogen 2.888 N/A THR 17.A OG1 GLY 14.A O no hydrogen 3.107 N/A THR 17.A OG1 THR 186.A O no hydrogen 2.746 N/A VAL 18.A N GLY 15.A O no hydrogen 2.915 N/A ALA 19.A N GLY 15.A O no hydrogen 2.915 N/A LYS 20.A N LEU 16.A O no hydrogen 2.829 N/A GLU 21.A N VAL 18.A O no hydrogen 3.056 N/A ILE 22.A N VAL 18.A O no hydrogen 3.069 N/A MET 23.A N ALA 19.A O no hydrogen 2.896 N/A ARG 24.A N LYS 20.A O no hydrogen 2.873 N/A ARG 24.A NE GLU 21.A OE1 no hydrogen 3.370 N/A ARG 24.A NE GLU 21.A OE2 no hydrogen 2.986 N/A ARG 24.A NH2 GLU 21.A OE1 no hydrogen 2.893 N/A GLN 25.A N GLU 21.A O no hydrogen 2.938 N/A GLN 25.A NE2 GLU 21.A OE1 no hydrogen 2.819 N/A GLN 25.A NE2 ASP 210.A O no hydrogen 3.005 N/A LEU 26.A N ILE 22.A O no hydrogen 2.798 N/A LYS 28.A NZ GLN 228.A O no hydrogen 3.099 N/A GLU 29.A N LEU 26.A O no hydrogen 3.077 N/A ASN 30.A ND2 GLU 3.A O no hydrogen 2.960 N/A ILE 32.A N ILE 6.A O no hydrogen 2.938 N/A TYR 33.A N GLN 236.A O no hydrogen 2.685 N/A TYR 33.A OH GLY 12.A O no hydrogen 2.668 N/A VAL 34.A N VAL 8.A O no hydrogen 2.832 N/A GLY 35.A N LEU 238.A O no hydrogen 2.749 N/A ASP 36.A N ASP 10.A O no hydrogen 2.866 N/A THR 37.A OG1 THR 239.A OG1 no hydrogen 2.651 N/A LYS 38.A N THR 240.A OG1 no hydrogen 2.941 N/A ARG 39.A N ASP 36.A O no hydrogen 2.871 N/A ARG 39.A NE ASP 36.A OD1 no hydrogen 2.756 N/A ARG 39.A NH1 GLU 56.A OE2 no hydrogen 3.175 N/A ARG 39.A NH2 GLU 56.A OE2 no hydrogen 2.896 N/A CYS 40.A N THR 37.A O no hydrogen 3.115 N/A TYR 42.A OH ASP 36.A OD1 no hydrogen 2.738 N/A ARG 45.A N TYR 42.A O no hydrogen 3.189 N/A ARG 45.A NE ARG 39.A O no hydrogen 2.924 N/A ARG 45.A NE PRO 41.A O no hydrogen 3.029 N/A ARG 45.A NH1 GLU 49.A OE1 no hydrogen 2.873 N/A ARG 45.A NH2 ARG 39.A O no hydrogen 2.957 N/A GLU 48.A N GLU 48.A OE2 no hydrogen 2.679 N/A GLU 49.A N PRO 46.A O no hydrogen 2.854 N/A VAL 50.A N PRO 46.A O no hydrogen 3.194 N/A LEU 51.A N GLU 47.A O no hydrogen 2.992 N/A GLN 52.A N GLU 48.A O no hydrogen 3.066 N/A GLN 52.A NE2 GLU 56.A OE1 no hydrogen 2.993 N/A TYR 53.A N GLU 49.A O no hydrogen 2.848 N/A THR 54.A N VAL 50.A O no hydrogen 2.897 N/A THR 54.A OG1 VAL 50.A O no hydrogen 2.788 N/A TRP 55.A N LEU 51.A O no hydrogen 3.245 N/A GLU 56.A N GLN 52.A O no hydrogen 3.094 N/A LEU 57.A N TYR 53.A O no hydrogen 2.921 N/A THR 58.A N THR 54.A O no hydrogen 2.954 N/A THR 58.A OG1 THR 54.A O no hydrogen 2.971 N/A ASN 59.A N TRP 55.A O no hydrogen 2.802 N/A TYR 60.A N GLU 56.A O no hydrogen 2.974 N/A LEU 61.A N LEU 57.A O no hydrogen 3.240 N/A LEU 62.A N THR 58.A O no hydrogen 2.944 N/A GLU 63.A N ASN 59.A O no hydrogen 2.878 N/A ASN 64.A N TYR 60.A O no hydrogen 3.071 N/A ASN 64.A ND2 TYR 60.A O no hydrogen 2.875 N/A HIS 65.A N LEU 61.A O no hydrogen 3.001 N/A LYS 68.A N PRO 5.A O no hydrogen 3.020 N/A LYS 68.A NZ LEU 2.A O no hydrogen 2.865 N/A LYS 68.A NZ GLU 29.A OE1 no hydrogen 2.729 N/A LYS 68.A NZ LEU 225.A O no hydrogen 2.699 N/A LEU 70.A N PRO 92.A O no hydrogen 2.969 N/A VAL 71.A N GLY 7.A O no hydrogen 2.793 N/A ILE 72.A N VAL 94.A O no hydrogen 2.871 N/A ALA 73.A N ILE 9.A O no hydrogen 2.855 N/A THR 76.A OG1 THR 118.A OG1 no hydrogen 2.695 N/A THR 76.A OG1 THR 121.A OG1 no hydrogen 3.257 N/A THR 78.A N CYS 74.A O no hydrogen 2.976 N/A THR 78.A OG1 CYS 74.A O no hydrogen 2.953 N/A ALA 79.A N ASN 75.A O no hydrogen 2.909 N/A ILE 80.A N THR 76.A O no hydrogen 3.143 N/A ALA 81.A N ALA 77.A O no hydrogen 2.673 N/A LEU 82.A N THR 78.A O no hydrogen 3.197 N/A ILE 85.A N ALA 81.A O no hydrogen 3.044 N/A GLN 86.A N LEU 82.A O no hydrogen 2.675 N/A GLN 86.A NE2 VAL 93.A O no hydrogen 2.831 N/A ARG 87.A N ASP 83.A O no hydrogen 2.802 N/A SER 88.A N ILE 85.A O no hydrogen 2.954 N/A VAL 89.A N ILE 85.A O no hydrogen 2.774 N/A VAL 94.A N LEU 70.A O no hydrogen 2.795 N/A VAL 96.A N THR 78.A OG1 no hydrogen 3.395 N/A ALA 101.A N ILE 97.A O no hydrogen 2.949 N/A ARG 102.A N GLN 98.A O no hydrogen 2.850 N/A ARG 102.A NE GLU 215.A OE1 no hydrogen 3.363 N/A ARG 102.A NE GLU 215.A OE2 no hydrogen 2.917 N/A ARG 102.A NH2 GLU 215.A OE1 no hydrogen 2.774 N/A ALA 103.A N PRO 99.A O no hydrogen 2.948 N/A ALA 104.A N GLY 100.A O no hydrogen 2.964 N/A ILE 105.A N ALA 101.A O no hydrogen 3.064 N/A LYS 106.A N ARG 102.A O no hydrogen 3.087 N/A VAL 107.A N ALA 103.A O no hydrogen 3.003 N/A THR 108.A N ALA 104.A O no hydrogen 2.878 N/A THR 108.A OG1 ASP 179.A OD1 no hydrogen 3.395 N/A THR 108.A OG1 ASP 179.A OD2 no hydrogen 2.771 N/A ASP 109.A N ASP 179.A OD1 no hydrogen 2.819 N/A ASN 110.A N ASP 179.A OD1 no hydrogen 2.849 N/A ASN 110.A ND2 HIS 112.A O no hydrogen 3.659 N/A GLN 111.A N THR 108.A OG1 no hydrogen 2.903 N/A HIS 112.A ND1 LYS 139.A O no hydrogen 3.185 N/A ILE 113.A N LYS 139.A O no hydrogen 2.881 N/A GLY 114.A N SER 180.A O no hydrogen 2.824 N/A VAL 115.A N GLU 141.A O no hydrogen 2.732 N/A ILE 116.A N ILE 182.A O no hydrogen 3.205 N/A GLY 117.A N LEU 143.A O no hydrogen 3.230 N/A THR 118.A OG1 THR 76.A OG1 no hydrogen 2.695 N/A THR 118.A OG1 THR 121.A OG1 no hydrogen 2.937 N/A ASN 120.A N GLY 43.A O no hydrogen 3.182 N/A ASN 120.A ND2 TYR 42.A O no hydrogen 2.919 N/A ASN 120.A ND2 ARG 45.A O no hydrogen 2.653 N/A THR 121.A N THR 118.A OG1 no hydrogen 3.185 N/A THR 121.A OG1 THR 76.A OG1 no hydrogen 3.257 N/A THR 121.A OG1 THR 118.A OG1 no hydrogen 2.937 N/A ILE 122.A N THR 118.A O no hydrogen 2.918 N/A LYS 123.A N GLU 119.A O no hydrogen 2.844 N/A SER 124.A N ASN 120.A O no hydrogen 3.047 N/A SER 124.A N THR 121.A O no hydrogen 3.348 N/A SER 124.A OG THR 121.A O no hydrogen 2.634 N/A ASN 125.A N ILE 122.A O no hydrogen 3.198 N/A ALA 126.A N SER 124.A OG no hydrogen 3.040 N/A TYR 127.A OH ASN 75.A OD1 no hydrogen 2.798 N/A GLU 129.A N ASN 125.A O no hydrogen 3.014 N/A ALA 130.A N ALA 126.A O no hydrogen 3.010 N/A LEU 131.A N TYR 127.A O no hydrogen 2.864 N/A LEU 132.A N GLU 128.A O no hydrogen 2.965 N/A ALA 133.A N GLU 129.A O no hydrogen 2.978 N/A LEU 134.A N LEU 131.A O no hydrogen 3.273 N/A ASN 135.A N LEU 131.A O no hydrogen 2.905 N/A ASP 137.A N ASN 135.A OD1 no hydrogen 3.064 N/A LEU 138.A N ASN 135.A O no hydrogen 3.279 N/A LYS 139.A N GLN 111.A O no hydrogen 2.964 N/A LYS 139.A NZ ASP 137.A O no hydrogen 2.973 N/A GLU 141.A N ILE 113.A O no hydrogen 2.807 N/A ASN 142.A ND2 GLU 128.A OE2 no hydrogen 3.218 N/A LEU 143.A N VAL 115.A O no hydrogen 2.890 N/A CYS 145.A N GLY 117.A O no hydrogen 3.027 N/A CYS 145.A SG LEU 143.A O no hydrogen 3.793 N/A CYS 145.A SG SER 169.A O no hydrogen 3.904 N/A LEU 148.A N CYS 145.A O no hydrogen 3.204 N/A PHE 151.A N LEU 147.A O no hydrogen 3.109 N/A VAL 152.A N LEU 148.A O no hydrogen 3.054 N/A GLU 153.A N VAL 149.A O no hydrogen 3.218 N/A GLU 153.A N PRO 150.A O no hydrogen 3.116 N/A SER 154.A N PHE 151.A O no hydrogen 3.157 N/A SER 154.A OG PHE 151.A O no hydrogen 2.540 N/A LYS 156.A NZ ASP 251.A O no hydrogen 3.525 N/A LYS 156.A NZ ASP 252.A OD1 no hydrogen 3.210 N/A ALA 162.A N LEU 158.A O no hydrogen 3.063 N/A ASP 163.A N ASP 159.A O no hydrogen 2.974 N/A GLU 164.A N GLN 160.A O no hydrogen 3.023 N/A ILE 165.A N THR 161.A O no hydrogen 3.026 N/A VAL 166.A N ALA 162.A O no hydrogen 2.891 N/A LYS 167.A N ASP 163.A O no hydrogen 3.009 N/A THR 168.A N GLU 164.A O no hydrogen 3.042 N/A THR 168.A OG1 GLU 164.A O no hydrogen 2.920 N/A SER 169.A N ILE 165.A O no hydrogen 2.911 N/A SER 169.A OG ILE 165.A O no hydrogen 2.733 N/A LEU 170.A N VAL 166.A O no hydrogen 2.679 N/A TYR 171.A N LYS 167.A O no hydrogen 3.012 N/A LEU 173.A N LEU 170.A O no hydrogen 2.884 N/A LYS 174.A N TYR 171.A O no hydrogen 3.130 N/A THR 176.A N LEU 173.A O no hydrogen 3.041 N/A THR 176.A OG1 LEU 173.A O no hydrogen 2.645 N/A ASP 179.A N HIS 112.A O no hydrogen 3.002 N/A SER 180.A OG ASP 179.A OD2 no hydrogen 2.866 N/A LEU 181.A N ASN 204.A O no hydrogen 2.735 N/A ILE 182.A N GLY 114.A O no hydrogen 2.875 N/A LEU 183.A N ILE 206.A O no hydrogen 2.891 N/A GLY 184.A N ILE 116.A O no hydrogen 2.739 N/A THR 186.A OG1 HIS 187.A ND1 no hydrogen 2.884 N/A HIS 187.A ND1 THR 186.A OG1 no hydrogen 2.884 N/A HIS 187.A NE2 GLU 153.A OE1 no hydrogen 2.825 N/A TYR 188.A N CYS 185.A O no hydrogen 3.247 N/A ILE 190.A N HIS 187.A O no hydrogen 3.088 N/A LEU 191.A N TYR 188.A O no hydrogen 2.804 N/A LYS 192.A N PRO 189.A O no hydrogen 2.826 N/A ILE 195.A N LEU 191.A O no hydrogen 2.931 N/A GLN 196.A N LYS 192.A O no hydrogen 2.854 N/A GLN 196.A NE2 GLN 196.A O no hydrogen 3.531 N/A GLN 196.A NE2 GLY 200.A O no hydrogen 2.866 N/A GLN 196.A NE2 VAL 203.A O no hydrogen 2.956 N/A ARG 197.A N GLU 193.A O no hydrogen 2.923 N/A ARG 197.A NE ASP 163.A OD2 no hydrogen 2.968 N/A ARG 197.A NH2 ASP 159.A O no hydrogen 3.560 N/A ARG 197.A NH2 ASP 163.A OD2 no hydrogen 2.768 N/A TYR 198.A N ALA 194.A O no hydrogen 2.914 N/A MET 199.A N ILE 195.A O no hydrogen 2.805 N/A GLY 200.A N GLN 196.A O no hydrogen 2.906 N/A VAL 203.A N GLY 200.A O no hydrogen 3.379 N/A ASN 204.A N ASP 179.A O no hydrogen 2.881 N/A ASN 204.A ND2 SER 180.A OG no hydrogen 3.390 N/A ILE 206.A N LEU 181.A O no hydrogen 2.892 N/A SER 208.A OG ASN 75.A OD1 no hydrogen 3.047 N/A SER 208.A OG LEU 183.A O no hydrogen 2.875 N/A GLU 211.A N SER 207.A O no hydrogen 3.351 N/A THR 212.A N SER 208.A O no hydrogen 2.868 N/A THR 212.A OG1 SER 208.A O no hydrogen 2.699 N/A ALA 213.A N GLY 209.A O no hydrogen 3.014 N/A ARG 214.A N ASP 210.A O no hydrogen 3.392 N/A GLU 215.A N GLU 211.A O no hydrogen 2.981 N/A VAL 216.A N THR 212.A O no hydrogen 2.830 N/A SER 217.A N ALA 213.A O no hydrogen 3.012 N/A THR 218.A N ARG 214.A O no hydrogen 3.013 N/A THR 218.A OG1 ARG 214.A O no hydrogen 3.021 N/A ILE 219.A N GLU 215.A O no hydrogen 3.045 N/A LEU 220.A N VAL 216.A O no hydrogen 2.924 N/A SER 221.A N SER 217.A O no hydrogen 3.023 N/A TYR 222.A N THR 218.A O no hydrogen 2.886 N/A LYS 223.A N ILE 219.A O no hydrogen 2.870 N/A GLY 224.A N SER 221.A O no hydrogen 3.087 N/A LEU 225.A N LEU 220.A O no hydrogen 2.872 N/A ASN 227.A N GLU 29.A OE2 no hydrogen 2.834 N/A ILE 231.A N SER 229.A OG no hydrogen 3.091 N/A ASP 234.A N ASN 30.A OD1 no hydrogen 2.745 N/A HIS 235.A NE2 GLU 29.A O no hydrogen 3.287 N/A GLN 236.A N ILE 31.A O no hydrogen 3.040 N/A LEU 238.A N TYR 33.A O no hydrogen 2.689 N/A THR 239.A N GLU 257.A O no hydrogen 3.213 N/A THR 239.A OG1 GLY 35.A O no hydrogen 3.493 N/A THR 239.A OG1 THR 37.A OG1 no hydrogen 2.651 N/A THR 240.A N GLY 35.A O no hydrogen 3.067 N/A THR 240.A OG1 ASP 36.A OD2 no hydrogen 2.514 N/A GLY 241.A N THR 239.A OG1 no hydrogen 3.141 N/A GLN 245.A N ALA 242.A O no hydrogen 3.205 N/A PHE 246.A N ALA 242.A O no hydrogen 3.312 N/A ALA 247.A N ARG 243.A O no hydrogen 3.186 N/A LYS 248.A N ASP 244.A O no hydrogen 3.029 N/A ILE 249.A N GLN 245.A O no hydrogen 2.888 N/A ALA 250.A N PHE 246.A O no hydrogen 2.937 N/A ASP 251.A N ALA 247.A O no hydrogen 3.065 N/A ASP 252.A N LYS 248.A O no hydrogen 3.032 N/A TRP 253.A N ILE 249.A O no hydrogen 3.101 N/A TRP 253.A NE1 VAL 152.A O no hydrogen 2.754 N/A PHE 254.A N ALA 250.A O no hydrogen 2.915 N/A GLU 257.A N PHE 237.A O no hydrogen 3.170 N/A CYS 258.A SG THR 239.A O no hydrogen 3.745 N/A CYS 258.A SG GLY 241.A O no hydrogen 2.947 N/A CYS 258.A SG ILE 259.A O no hydrogen 4.030 N/A ILE 259.A N THR 239.A O no hydrogen 2.931 N/A