Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ols_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A NE2 SER 1.A OG no hydrogen 2.225 N/A LEU 5.A N SER 1.A O no hydrogen 2.944 N/A VAL 6.A N PRO 2.A O no hydrogen 2.922 N/A LEU 7.A N GLU 3.A O no hydrogen 3.020 N/A THR 8.A N GLN 4.A O no hydrogen 2.940 N/A THR 8.A OG1 GLN 4.A O no hydrogen 2.894 N/A LEU 9.A N LEU 5.A O no hydrogen 2.991 N/A LEU 10.A N VAL 6.A O no hydrogen 2.866 N/A GLU 11.A N LEU 7.A O no hydrogen 2.885 N/A ALA 12.A N LEU 9.A O no hydrogen 3.032 N/A GLU 13.A N LEU 10.A O no hydrogen 3.403 N/A ARG 21.A NH1 GLU 103.A OE2 no hydrogen 2.781 N/A ARG 21.A NH2 VAL 98.A O no hydrogen 2.839 N/A ARG 21.A NH2 GLU 103.A OE1 no hydrogen 2.637 N/A ARG 21.A NH2 GLU 103.A OE2 no hydrogen 3.368 N/A THR 27.A N SER 30.A OG no hydrogen 2.843 N/A THR 27.A OG1 SER 30.A OG no hydrogen 3.093 N/A SER 30.A N THR 27.A OG1 no hydrogen 2.798 N/A SER 30.A OG THR 27.A O no hydrogen 3.431 N/A SER 30.A OG THR 27.A OG1 no hydrogen 3.093 N/A MET 31.A N THR 27.A O no hydrogen 2.813 N/A MET 32.A N GLU 28.A O no hydrogen 3.025 N/A MET 33.A N ALA 29.A O no hydrogen 3.038 N/A SER 34.A N SER 30.A O no hydrogen 3.067 N/A SER 34.A OG SER 30.A O no hydrogen 3.301 N/A LEU 35.A N MET 31.A O no hydrogen 3.060 N/A THR 36.A N MET 32.A O no hydrogen 3.009 N/A THR 36.A OG1 MET 32.A O no hydrogen 2.533 N/A THR 36.A OG1 MET 33.A O no hydrogen 3.213 N/A LYS 37.A N MET 33.A O no hydrogen 2.893 N/A LYS 37.A NZ ASP 40.A OD2 no hydrogen 2.835 N/A LEU 38.A N SER 34.A O no hydrogen 3.022 N/A ALA 39.A N LEU 35.A O no hydrogen 2.821 N/A ASP 40.A N THR 36.A O no hydrogen 2.870 N/A LYS 41.A N LYS 37.A O no hydrogen 3.188 N/A GLU 42.A N LEU 38.A O no hydrogen 2.850 N/A LEU 43.A N ALA 39.A O no hydrogen 2.767 N/A VAL 44.A N ASP 40.A O no hydrogen 3.359 N/A HIS 45.A N LYS 41.A O no hydrogen 3.313 N/A MET 46.A N GLU 42.A O no hydrogen 2.833 N/A MET 46.A N LEU 43.A O no hydrogen 2.955 N/A ILE 47.A N LEU 43.A O no hydrogen 3.271 N/A TRP 49.A N HIS 45.A O no hydrogen 3.039 N/A ALA 50.A N MET 46.A O no hydrogen 2.826 N/A LYS 51.A N ILE 47.A O no hydrogen 3.078 N/A LYS 52.A N TRP 49.A O no hydrogen 2.910 N/A ILE 53.A N ALA 50.A O no hydrogen 3.014 N/A PHE 56.A N ILE 53.A O no hydrogen 2.992 N/A GLU 58.A N GLY 55.A O no hydrogen 2.766 N/A LEU 59.A N GLY 55.A O no hydrogen 3.231 N/A LEU 59.A N PHE 56.A O no hydrogen 3.159 N/A SER 60.A N SER 154.A OG no hydrogen 2.917 N/A ASP 63.A N SER 60.A O no hydrogen 2.784 N/A ASP 63.A N SER 60.A OG no hydrogen 3.070 N/A GLN 64.A N SER 60.A O no hydrogen 2.912 N/A GLN 64.A NE2 LEU 59.A O no hydrogen 2.839 N/A VAL 65.A N LEU 61.A O no hydrogen 3.022 N/A ARG 66.A N PHE 62.A O no hydrogen 3.077 N/A ARG 66.A NH1 TYR 148.A O no hydrogen 2.561 N/A ARG 66.A NH2 TYR 148.A O no hydrogen 3.246 N/A LEU 67.A N ASP 63.A O no hydrogen 3.007 N/A LEU 68.A N GLN 64.A O no hydrogen 2.922 N/A GLU 69.A N VAL 65.A O no hydrogen 2.790 N/A SER 70.A N ARG 66.A O no hydrogen 3.178 N/A SER 70.A N LEU 67.A O no hydrogen 3.126 N/A SER 70.A OG SER 145.A OG no hydrogen 2.727 N/A CYS 71.A N LEU 67.A O no hydrogen 3.005 N/A CYS 71.A N LEU 68.A O no hydrogen 3.320 N/A CYS 71.A SG LEU 67.A O no hydrogen 3.248 N/A CYS 71.A SG LEU 68.A O no hydrogen 4.008 N/A VAL 75.A N CYS 71.A O no hydrogen 2.860 N/A LEU 76.A N TRP 72.A O no hydrogen 2.830 N/A MET 77.A N MET 73.A O no hydrogen 2.794 N/A MET 78.A N GLU 74.A O no hydrogen 2.756 N/A GLY 79.A N VAL 75.A O no hydrogen 3.075 N/A LEU 80.A N LEU 76.A O no hydrogen 2.888 N/A MET 81.A N MET 77.A O no hydrogen 2.936 N/A TRP 82.A N MET 78.A O no hydrogen 2.982 N/A ARG 83.A N GLY 79.A O no hydrogen 2.945 N/A ARG 83.A NE ILE 92.A O no hydrogen 2.761 N/A ARG 83.A NE PHE 93.A O no hydrogen 3.277 N/A ARG 83.A NH2 PHE 93.A O no hydrogen 2.888 N/A SER 84.A N LEU 80.A O no hydrogen 2.926 N/A SER 84.A N MET 81.A O no hydrogen 2.937 N/A SER 84.A OG LEU 80.A O no hydrogen 2.687 N/A ILE 85.A N TRP 82.A O no hydrogen 3.178 N/A HIS 87.A N SER 84.A O no hydrogen 2.921 N/A LYS 90.A N HIS 87.A O no hydrogen 3.021 N/A LEU 91.A N LEU 99.A O no hydrogen 2.827 N/A ILE 92.A N SER 84.A OG no hydrogen 2.872 N/A PHE 93.A N LEU 91.A O no hydrogen 3.082 N/A ALA 94.A N LEU 97.A O no hydrogen 3.246 N/A LEU 97.A N ALA 94.A O no hydrogen 2.610 N/A LEU 99.A N LEU 91.A O no hydrogen 2.965 N/A ASP 100.A N GLU 103.A OE1 no hydrogen 3.076 N/A ARG 101.A N GLY 89.A O no hydrogen 3.008 N/A ARG 101.A NH1 ASP 115.A OD1 no hydrogen 3.423 N/A ARG 101.A NH1 ASP 115.A OD2 no hydrogen 2.982 N/A ARG 101.A NH2 ASP 102.A OD1 no hydrogen 3.030 N/A GLU 103.A N ASP 100.A O no hydrogen 2.894 N/A GLY 104.A N ARG 101.A O no hydrogen 3.006 N/A LYS 105.A N ASP 102.A O no hydrogen 2.965 N/A LYS 105.A NZ ASP 102.A OD1 no hydrogen 3.239 N/A CYS 106.A N GLU 103.A O no hydrogen 3.124 N/A VAL 107.A N GLY 104.A O no hydrogen 3.102 N/A GLU 108.A N.A GLU 28.A OE1 no hydrogen 2.584 N/A GLU 108.A N.B GLU 28.A OE1 no hydrogen 2.604 N/A ILE 110.A N VAL 107.A O no hydrogen 2.954 N/A PHE 114.A N ILE 110.A O no hydrogen 2.895 N/A ASP 115.A N LEU 111.A O no hydrogen 2.867 N/A MET 116.A N GLU 112.A O no hydrogen 3.082 N/A LEU 117.A N ILE 113.A O no hydrogen 2.915 N/A LEU 118.A N PHE 114.A O no hydrogen 2.676 N/A ALA 119.A N ASP 115.A O no hydrogen 2.765 N/A THR 120.A N MET 116.A O no hydrogen 2.856 N/A THR 120.A OG1 MET 116.A O no hydrogen 2.946 N/A THR 121.A N LEU 117.A O no hydrogen 2.938 N/A THR 121.A OG1 LEU 117.A O no hydrogen 2.866 N/A SER 122.A N LEU 118.A O no hydrogen 2.968 N/A SER 122.A OG LEU 118.A O no hydrogen 3.098 N/A ARG 123.A N ALA 119.A O no hydrogen 2.997 N/A PHE 124.A N THR 120.A O no hydrogen 2.963 N/A ARG 125.A N THR 121.A O no hydrogen 2.645 N/A ARG 125.A NE ILE 85.A O no hydrogen 2.673 N/A ARG 125.A NH2 ILE 85.A O no hydrogen 2.918 N/A GLU 126.A N SER 122.A O no hydrogen 2.684 N/A LEU 127.A N ARG 123.A O no hydrogen 3.052 N/A LYS 128.A N ARG 125.A O no hydrogen 2.859 N/A LEU 129.A N PHE 124.A O no hydrogen 3.105 N/A GLN 130.A N GLU 133.A OE1 no hydrogen 2.957 N/A GLN 130.A NE2 LYS 128.A O no hydrogen 2.870 N/A TYR 134.A N GLN 130.A O no hydrogen 2.871 N/A TYR 134.A OH GLU 13.A OE2 no hydrogen 3.000 N/A LEU 135.A N HIS 131.A O no hydrogen 2.872 N/A CYS 136.A N LYS 132.A O no hydrogen 3.265 N/A CYS 136.A SG LYS 132.A O no hydrogen 3.547 N/A VAL 137.A N GLU 133.A O no hydrogen 2.820 N/A LYS 138.A N TYR 134.A O no hydrogen 3.007 N/A LYS 138.A NZ GLU 13.A OE1 no hydrogen 2.865 N/A ALA 139.A N LEU 135.A O no hydrogen 3.241 N/A MET 140.A N CYS 136.A O no hydrogen 2.891 N/A ILE 141.A N VAL 137.A O no hydrogen 2.910 N/A LEU 142.A N LYS 138.A O no hydrogen 3.126 N/A LEU 143.A N ALA 139.A O no hydrogen 3.003 N/A ASN 144.A N MET 140.A O no hydrogen 2.654 N/A SER 145.A OG SER 70.A OG no hydrogen 2.727 N/A SER 145.A OG SER 146.A O no hydrogen 3.302 N/A SER 154.A OG ASP 63.A OD2 no hydrogen 2.501 N/A LYS 157.A N ASP 153.A O no hydrogen 2.999 N/A LEU 158.A N SER 154.A O no hydrogen 2.760 N/A ALA 159.A N SER 155.A O no hydrogen 3.032 N/A HIS 160.A N ARG 156.A O no hydrogen 2.892 N/A LEU 161.A N LYS 157.A O no hydrogen 3.138 N/A LEU 162.A N LEU 158.A O no hydrogen 2.956 N/A ASN 163.A N ALA 159.A O no hydrogen 2.794 N/A ASN 163.A ND2 ALA 159.A O no hydrogen 3.392 N/A ALA 164.A N HIS 160.A O no hydrogen 2.874 N/A VAL 165.A N LEU 161.A O no hydrogen 2.785 N/A THR 166.A N LEU 162.A O no hydrogen 2.764 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.620 N/A ASP 167.A N ASN 163.A O no hydrogen 2.850 N/A ALA 168.A N ALA 164.A O no hydrogen 2.867 N/A LEU 169.A N VAL 165.A O no hydrogen 2.982 N/A VAL 170.A N THR 166.A O no hydrogen 3.016 N/A TRP 171.A N ASP 167.A O no hydrogen 2.879 N/A VAL 172.A N ALA 168.A O no hydrogen 2.789 N/A ILE 173.A N LEU 169.A O no hydrogen 2.811 N/A ALA 174.A N VAL 170.A O no hydrogen 2.854 N/A LYS 175.A N VAL 172.A O no hydrogen 2.950 N/A SER 176.A N ILE 173.A O no hydrogen 3.053 N/A SER 176.A OG ILE 173.A O no hydrogen 2.819 N/A GLY 177.A N ALA 174.A O no hydrogen 3.129 N/A GLN 182.A N SER 179.A OG no hydrogen 3.092 N/A GLN 183.A N SER 179.A O no hydrogen 2.813 N/A GLN 183.A NE2 ILE 178.A O no hydrogen 3.142 N/A SER 184.A N SER 180.A O no hydrogen 3.112 N/A SER 184.A OG SER 180.A O no hydrogen 3.543 N/A MET 185.A N GLN 181.A O no hydrogen 2.917 N/A ARG 186.A N GLN 182.A O no hydrogen 2.953 N/A ARG 186.A NE GLU 133.A OE2 no hydrogen 2.635 N/A ARG 186.A NH1 LEU 127.A O no hydrogen 2.794 N/A ARG 186.A NH2 LEU 127.A O no hydrogen 2.847 N/A ARG 186.A NH2 LYS 128.A O no hydrogen 3.159 N/A ARG 186.A NH2 GLU 133.A OE1 no hydrogen 2.757 N/A ARG 186.A NH2 GLU 133.A OE2 no hydrogen 3.493 N/A LEU 187.A N GLN 183.A O no hydrogen 3.131 N/A ALA 188.A N SER 184.A O no hydrogen 2.941 N/A ASN 189.A N MET 185.A O no hydrogen 2.725 N/A LEU 190.A N ARG 186.A O no hydrogen 2.835 N/A LEU 191.A N LEU 187.A O no hydrogen 2.895 N/A MET 192.A N ALA 188.A O no hydrogen 2.840 N/A LEU 193.A N LEU 190.A O no hydrogen 3.115 N/A LEU 194.A N LEU 191.A O no hydrogen 3.033 N/A VAL 197.A N LEU 193.A O no hydrogen 3.022 N/A ARG 198.A N LEU 194.A O no hydrogen 2.858 N/A HIS 199.A N SER 195.A O no hydrogen 2.747 N/A ALA 200.A N HIS 196.A O no hydrogen 2.911 N/A SER 201.A N VAL 197.A O no hydrogen 3.007 N/A ASN 202.A N ARG 198.A O no hydrogen 2.981 N/A ASN 202.A N HIS 199.A O no hydrogen 2.987 N/A LYS 203.A N HIS 199.A O no hydrogen 3.148 N/A GLY 204.A N ALA 200.A O no hydrogen 2.789 N/A MET 205.A N SER 201.A O no hydrogen 2.939 N/A GLU 206.A N ASN 202.A O no hydrogen 3.219 N/A HIS 207.A N LYS 203.A O no hydrogen 2.854 N/A HIS 207.A NE2 GLU 108.A O.A no hydrogen 2.796 N/A HIS 207.A NE2 GLU 108.A O.B no hydrogen 2.758 N/A LEU 208.A N GLY 204.A O no hydrogen 2.919 N/A LEU 209.A N MET 205.A O no hydrogen 2.826 N/A ASN 210.A N GLU 206.A O no hydrogen 2.952 N/A MET 211.A N HIS 207.A O no hydrogen 2.878 N/A LYS 212.A N LEU 208.A O no hydrogen 2.867 N/A LYS 212.A NZ ASN 228.A OD1 no hydrogen 3.413 N/A CYS 213.A N LEU 209.A O no hydrogen 3.145 N/A CYS 213.A SG LEU 209.A O no hydrogen 3.938 N/A LYS 214.A N ASN 210.A O no hydrogen 2.987 N/A ASN 215.A N LYS 212.A O no hydrogen 3.117 N/A VAL 216.A N MET 211.A O no hydrogen 3.003 N/A LEU 223.A N ASP 40.A OD1 no hydrogen 3.059 N/A LEU 224.A N TYR 220.A O no hydrogen 3.135 N/A GLU 225.A N ASP 221.A O no hydrogen 2.683 N/A MET 226.A N LEU 222.A O no hydrogen 2.742 N/A LEU 227.A N LEU 223.A O no hydrogen 2.858 N/A ASN 228.A N LEU 224.A O no hydrogen 2.782 N/A