Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ubr_S.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 1.A N GLN 62.A OE1 no hydrogen 2.741 N/A SER 8.A OG ASP 43.A OD1 no hydrogen 2.524 N/A VAL 9.A N SER 41.A O no hydrogen 2.797 N/A VAL 10.A N ILE 71.A O no hydrogen 2.874 N/A TYR 11.A N TYR 44.A O no hydrogen 2.947 N/A TYR 11.A OH GLU 75.A OE2 no hydrogen 2.636 N/A LEU 12.A N VAL 73.A O no hydrogen 2.889 N/A ASN 14.A N GLU 75.A O no hydrogen 2.815 N/A ASN 14.A ND2 GLY 76.A O no hydrogen 3.350 N/A ALA 15.A N GLY 77.A O no hydrogen 2.911 N/A THR 18.A OG1 GLU 16.A OE1 no hydrogen 2.579 N/A CYS 20.A SG TYR 111.A O no hydrogen 3.759 N/A SER 21.A N GLU 75.A OE1 no hydrogen 3.007 N/A SER 21.A OG GLU 75.A OE2 no hydrogen 2.512 N/A GLU 22.A N THR 18.A O no hydrogen 2.926 N/A SER 23.A N GLY 19.A O no hydrogen 2.864 N/A SER 23.A OG CYS 20.A O no hydrogen 2.680 N/A SER 23.A OG TYR 111.A OH no hydrogen 2.658 N/A VAL 24.A N CYS 20.A O no hydrogen 3.261 N/A VAL 24.A N SER 21.A O no hydrogen 3.082 N/A LEU 25.A N SER 21.A O no hydrogen 3.352 N/A ARG 26.A N SER 23.A O no hydrogen 2.929 N/A ARG 26.A NH1 GLU 22.A OE2 no hydrogen 2.847 N/A ARG 26.A NH2 GLU 22.A OE2 no hydrogen 3.052 N/A ALA 27.A N VAL 24.A O no hydrogen 2.981 N/A LEU 35.A N TYR 31.A O no hydrogen 2.988 N/A ILE 36.A N ILE 32.A O no hydrogen 2.924 N/A LEU 37.A N ASP 33.A O no hydrogen 2.864 N/A ASP 38.A N THR 34.A O no hydrogen 2.746 N/A THR 39.A N THR 34.A O no hydrogen 3.063 N/A THR 39.A OG1 THR 34.A O no hydrogen 3.503 N/A LEU 40.A N LEU 35.A O no hydrogen 2.928 N/A SER 41.A N PRO 7.A O no hydrogen 2.775 N/A SER 41.A OG LEU 1.A O no hydrogen 3.326 N/A SER 41.A OG ASP 43.A OD2 no hydrogen 2.725 N/A ASP 43.A N VAL 9.A O no hydrogen 2.865 N/A TYR 44.A OH GLU 46.A OE2 no hydrogen 2.539 N/A THR 47.A N HIS 45.A ND1 no hydrogen 3.177 N/A ILE 48.A N HIS 45.A O no hydrogen 3.184 N/A MET 49.A N HIS 45.A O no hydrogen 2.904 N/A ALA 56.A N ALA 52.A O no hydrogen 3.171 N/A GLU 57.A N GLY 53.A O no hydrogen 2.869 N/A ALA 58.A N ASP 54.A O no hydrogen 2.844 N/A ALA 59.A N ALA 55.A O no hydrogen 3.004 N/A LEU 60.A N ALA 56.A O no hydrogen 2.922 N/A GLU 61.A N GLU 57.A O no hydrogen 3.050 N/A GLN 62.A N ALA 58.A O no hydrogen 2.937 N/A ALA 63.A N ALA 59.A O no hydrogen 3.051 N/A VAL 64.A N LEU 60.A O no hydrogen 2.878 N/A ASN 65.A N GLU 61.A O no hydrogen 2.924 N/A SER 66.A N ALA 63.A O no hydrogen 3.269 N/A HIS 68.A N SER 66.A OG no hydrogen 2.738 N/A GLY 69.A N SER 66.A O no hydrogen 3.104 N/A ILE 71.A N SER 8.A O no hydrogen 2.823 N/A ALA 72.A N ALA 107.A O no hydrogen 2.995 N/A VAL 73.A N VAL 10.A O no hydrogen 2.922 N/A VAL 74.A N ILE 109.A O no hydrogen 2.924 N/A GLU 75.A N LEU 12.A O no hydrogen 2.883 N/A GLY 77.A N ALA 15.A O no hydrogen 2.961 N/A ILE 78.A N LYS 131.A O no hydrogen 2.857 N/A THR 80.A N GLY 129.A O no hydrogen 2.848 N/A THR 80.A OG1 GLY 129.A O no hydrogen 2.666 N/A ALA 81.A N THR 128.A O no hydrogen 2.960 N/A GLY 84.A N ALA 81.A O no hydrogen 3.014 N/A ILE 85.A N ALA 82.A O no hydrogen 3.392 N/A GLY 87.A N GLY 84.A O no hydrogen 3.373 N/A VAL 89.A N HIS 92.A O no hydrogen 2.853 N/A HIS 92.A N VAL 89.A O no hydrogen 2.931 N/A MET 94.A N GLY 87.A O no hydrogen 2.877 N/A ASP 96.A N THR 93.A OG1 no hydrogen 2.973 N/A ILE 97.A N THR 93.A O no hydrogen 2.961 N/A CYS 98.A N MET 94.A O no hydrogen 2.885 N/A CYS 98.A SG ASN 14.A OD1 no hydrogen 3.240 N/A CYS 98.A SG MET 94.A O no hydrogen 3.488 N/A SER 99.A N LEU 95.A O no hydrogen 2.806 N/A SER 99.A OG LEU 95.A O no hydrogen 2.673 N/A ARG 100.A N ASP 96.A O no hydrogen 2.928 N/A ARG 100.A N ILE 97.A O no hydrogen 3.204 N/A ILE 101.A N ILE 97.A O no hydrogen 2.894 N/A LEU 102.A N CYS 98.A O no hydrogen 2.960 N/A LYS 104.A N ILE 101.A O no hydrogen 2.865 N/A LYS 104.A NZ ASN 65.A OD1 no hydrogen 3.332 N/A ALA 105.A N LEU 102.A O no hydrogen 3.069 N/A GLN 106.A N PHE 70.A O no hydrogen 2.846 N/A ILE 109.A N ALA 72.A O no hydrogen 2.813 N/A ALA 110.A N ILE 145.A O no hydrogen 2.828 N/A TYR 111.A N VAL 74.A O no hydrogen 2.778 N/A TYR 111.A OH SER 23.A OG no hydrogen 2.658 N/A GLY 112.A N ILE 147.A O no hydrogen 2.852 N/A THR 113.A N GLY 149.A O no hydrogen 2.924 N/A THR 113.A OG1 CYS 252.A O no hydrogen 2.699 N/A THR 116.A N GLY 112.A O no hydrogen 2.814 N/A THR 116.A OG1 GLY 112.A O no hydrogen 3.363 N/A THR 116.A OG1 THR 113.A O no hydrogen 3.333 N/A PHE 117.A N THR 113.A O no hydrogen 2.772 N/A GLY 118.A N CYS 114.A O no hydrogen 2.840 N/A GLN 121.A NE2 GLY 118.A O no hydrogen 2.900 N/A ALA 122.A N GLY 119.A O no hydrogen 2.809 N/A ALA 123.A N VAL 120.A O no hydrogen 3.157 N/A LYS 124.A N ASP 259.A OD2 no hydrogen 2.850 N/A ASN 126.A N ALA 123.A O no hydrogen 2.696 N/A GLY 129.A N ASN 126.A O no hydrogen 3.134 N/A LYS 131.A N ILE 78.A O no hydrogen 2.894 N/A VAL 133.A N ALA 115.A O no hydrogen 2.859 N/A ASN 134.A ND2 ALA 144.A O no hydrogen 3.070 N/A ALA 136.A N GLY 132.A O no hydrogen 2.914 N/A LEU 137.A N VAL 133.A O no hydrogen 2.912 N/A LEU 140.A N LEU 137.A O no hydrogen 2.803 N/A GLY 141.A N LYS 138.A O no hydrogen 2.934 N/A ALA 144.A N ASN 134.A OD1 no hydrogen 2.615 N/A ILE 145.A N VAL 108.A O no hydrogen 2.818 N/A ASN 146.A N ASN 177.A O no hydrogen 2.898 N/A ASN 146.A ND2 LEU 176.A O no hydrogen 2.923 N/A ILE 147.A N ALA 110.A O no hydrogen 2.931 N/A GLY 149.A N THR 113.A OG1 no hydrogen 2.857 N/A ASN 153.A ND2 LYS 235.A O no hydrogen 2.828 N/A TYR 155.A N ASN 153.A OD1 no hydrogen 3.132 N/A ASN 156.A N ASN 153.A O no hydrogen 2.882 N/A VAL 158.A N PRO 154.A O no hydrogen 3.025 N/A GLY 159.A N TYR 155.A O no hydrogen 2.929 N/A THR 160.A N ASN 156.A O no hydrogen 3.149 N/A THR 160.A OG1 ASN 156.A O no hydrogen 2.838 N/A ILE 161.A N LEU 157.A O no hydrogen 2.925 N/A VAL 162.A N VAL 158.A O no hydrogen 2.819 N/A TYR 163.A N GLY 159.A O no hydrogen 3.018 N/A TYR 164.A N THR 160.A O no hydrogen 2.942 N/A LEU 165.A N ILE 161.A O no hydrogen 2.804 N/A LYS 166.A N VAL 162.A O no hydrogen 2.939 N/A ASN 167.A N TYR 163.A O no hydrogen 2.690 N/A ASN 167.A ND2 TYR 163.A O no hydrogen 3.081 N/A LYS 168.A N TYR 164.A O no hydrogen 2.694 N/A LYS 168.A NZ LEU 165.A O no hydrogen 2.774 N/A ASP 174.A N ARG 178.A O no hydrogen 2.741 N/A LEU 176.A N ASP 174.A OD1 no hydrogen 2.774 N/A ASN 177.A N ASP 174.A O no hydrogen 2.829 N/A ASN 177.A ND2 ALA 144.A O no hydrogen 2.753 N/A ARG 178.A N ASP 174.A OD1 no hydrogen 2.807 N/A ARG 178.A NE ASP 174.A OD2 no hydrogen 2.837 N/A ARG 178.A NH1 SER 253.A O no hydrogen 3.101 N/A ARG 178.A NH1 GLU 254.A OE2 no hydrogen 2.922 N/A ARG 178.A NH2 ASP 174.A OD2 no hydrogen 3.011 N/A THR 180.A N GLU 172.A O no hydrogen 2.919 N/A THR 180.A OG1 GLU 172.A O no hydrogen 3.539 N/A THR 180.A OG1 GLU 172.A OE1 no hydrogen 2.733 N/A PHE 182.A N PRO 179.A O no hydrogen 3.101 N/A PHE 183.A N PRO 179.A O no hydrogen 2.960 N/A THR 186.A N GLU 189.A OE2 no hydrogen 2.880 N/A THR 186.A OG1 GLU 189.A OE2 no hydrogen 3.483 N/A VAL 187.A N THR 227.A O no hydrogen 2.788 N/A HIS 188.A N GLY 224.A O no hydrogen 3.199 N/A GLU 189.A N THR 186.A OG1 no hydrogen 2.940 N/A GLN 190.A N VAL 187.A O no hydrogen 3.110 N/A CYS 191.A N HIS 188.A O no hydrogen 3.020 N/A ARG 193.A NH1 TRP 215.A O no hydrogen 2.878 N/A LEU 194.A N CYS 191.A O no hydrogen 3.129 N/A HIS 196.A N ARG 193.A O no hydrogen 2.762 N/A HIS 196.A ND1 GLU 201.A OE1 no hydrogen 2.576 N/A PHE 197.A N ARG 193.A O no hydrogen 3.142 N/A ASP 198.A N LEU 194.A O no hydrogen 2.861 N/A ALA 199.A N PRO 195.A O no hydrogen 3.132 N/A GLY 200.A N PHE 197.A O no hydrogen 2.952 N/A GLU 201.A N HIS 196.A O no hydrogen 2.801 N/A ALA 203.A N CYS 216.A O no hydrogen 2.859 N/A GLU 207.A N GLU 207.A OE2 no hydrogen 2.661 N/A SER 208.A N SER 205.A O no hydrogen 3.358 N/A SER 208.A OG SER 205.A O no hydrogen 2.722 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.687 N/A ALA 211.A N SER 208.A OG no hydrogen 2.991 N/A ARG 212.A N SER 208.A O no hydrogen 3.036 N/A ARG 212.A NE GLU 209.A OE1 no hydrogen 3.163 N/A LYS 213.A N GLU 209.A O no hydrogen 2.875 N/A GLY 214.A N ALA 211.A O no hydrogen 2.932 N/A TRP 215.A N GLU 210.A O no hydrogen 2.936 N/A CYS 216.A N GLU 201.A O no hydrogen 3.119 N/A LEU 220.A N LEU 217.A O no hydrogen 2.951 N/A GLY 221.A N TYR 218.A O no hydrogen 2.970 N/A CYS 222.A N LEU 217.A O no hydrogen 3.139 N/A LYS 223.A N CYS 249.A O no hydrogen 2.918 N/A LYS 223.A NZ GLY 221.A O no hydrogen 2.696 N/A LYS 223.A NZ MET 261.A O no hydrogen 2.889 N/A LYS 223.A NZ PRO 263.A O no hydrogen 3.489 N/A LYS 223.A NZ GLN 266.A O no hydrogen 3.170 N/A VAL 226.A N LYS 223.A O no hydrogen 2.964 N/A THR 227.A N GLY 224.A O no hydrogen 3.305 N/A THR 227.A OG1 LYS 223.A O no hydrogen 2.708 N/A MET 228.A N GLU 254.A OE2 no hydrogen 2.853 N/A ASN 229.A N GLN 185.A O no hydrogen 3.347 N/A LYS 233.A N ASN 230.A O no hydrogen 3.102 N/A LYS 233.A NZ ASN 230.A OD1 no hydrogen 3.000 N/A ILE 234.A N ASN 230.A O no hydrogen 3.038 N/A LYS 235.A N CYS 231.A O no hydrogen 2.855 N/A PHE 236.A N ASN 240.A O no hydrogen 2.730 N/A THR 239.A N PHE 236.A O no hydrogen 2.880 N/A ASN 240.A N PHE 236.A O no hydrogen 3.118 N/A TRP 241.A N ASN 240.A OD1 no hydrogen 2.873 N/A ALA 245.A N TRP 241.A O no hydrogen 3.136 N/A ALA 245.A N PRO 242.A O no hydrogen 3.001 N/A GLY 246.A N VAL 243.A O no hydrogen 2.891 N/A HIS 247.A N PRO 242.A O no hydrogen 3.125 N/A HIS 247.A ND1 PRO 248.A O no hydrogen 2.765 N/A HIS 247.A NE2 TYR 265.A OH no hydrogen 2.661 N/A SER 253.A OG MET 228.A O no hydrogen 2.717 N/A GLU 254.A N GLY 251.A O no hydrogen 3.020 N/A ASP 259.A N ASP 256.A O no hydrogen 2.999 N/A ALA 260.A N ASP 256.A O no hydrogen 2.842 N/A MET 261.A N PHE 257.A O no hydrogen 2.896 N/A THR 262.A OG1 TRP 258.A O no hydrogen 2.735 N/A THR 262.A OG1 ASP 259.A O no hydrogen 3.262 N/A TYR 265.A OH HIS 247.A NE2 no hydrogen 2.661 N/A GLN 266.A N PRO 263.A O no hydrogen 3.229 N/A