Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6bnl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N CYS 99.A O no hydrogen 2.876 N/A ARG 6.A N TRP 26.A O no hydrogen 2.954 N/A CYS 7.A N ALA 97.A O no hydrogen 2.696 N/A CYS 7.A SG ALA 97.A O no hydrogen 3.649 N/A LEU 8.A N VAL 24.A O no hydrogen 2.746 N/A GLN 9.A N LEU 95.A O no hydrogen 2.798 N/A GLN 9.A NE2 SER 11.A OG no hydrogen 2.775 N/A MET 10.A N ASP 22.A O no hydrogen 2.804 N/A SER 11.A N ILE 93.A O no hydrogen 2.786 N/A SER 11.A OG THR 21.A OG1 no hydrogen 2.745 N/A SER 12.A N ARG 20.A O no hydrogen 2.828 N/A SER 12.A OG GLU 92.A OE1 no hydrogen 3.045 N/A PHE 13.A N ILE 91.A O no hydrogen 2.768 N/A ALA 14.A N TRP 18.A O no hydrogen 3.175 N/A SER 17.A N ASN 15.A OD1 no hydrogen 3.218 N/A SER 17.A OG ASN 15.A OD1 no hydrogen 3.262 N/A TRP 18.A N ASN 15.A OD1 no hydrogen 2.796 N/A SER 19.A OG SER 12.A O no hydrogen 3.405 N/A ARG 20.A N SER 12.A O no hydrogen 3.055 N/A ARG 20.A NE ASP 22.A OD1 no hydrogen 2.808 N/A ARG 20.A NH2 ASP 22.A OD2 no hydrogen 3.054 N/A THR 21.A N ASN 37.A OD1 no hydrogen 2.899 N/A THR 21.A OG1 SER 11.A OG no hydrogen 2.745 N/A ASP 22.A N MET 10.A O no hydrogen 2.992 N/A SER 23.A N TRP 35.A O no hydrogen 2.930 N/A VAL 24.A N LEU 8.A O no hydrogen 2.980 N/A VAL 25.A N HIS 33.A O no hydrogen 3.061 N/A TRP 26.A N ARG 6.A O no hydrogen 2.931 N/A LEU 27.A N LEU 30.A O no hydrogen 2.910 N/A GLY 28.A N THR 4.A O no hydrogen 2.943 N/A LEU 30.A N LEU 27.A O no hydrogen 3.136 N/A GLN 31.A N GLU 229.A OE2 no hydrogen 3.301 N/A GLN 31.A NE2 HIS 33.A O no hydrogen 3.065 N/A THR 32.A N VAL 25.A O no hydrogen 2.841 N/A THR 32.A OG1 VAL 25.A O no hydrogen 3.165 N/A THR 32.A OG1 HIS 33.A ND1 no hydrogen 3.031 N/A HIS 33.A N VAL 25.A O no hydrogen 3.391 N/A HIS 33.A ND1 THR 32.A OG1 no hydrogen 3.031 N/A ARG 34.A N SER 43.A O no hydrogen 3.036 N/A TRP 35.A N SER 23.A O no hydrogen 2.927 N/A TRP 35.A NE1 SER 39.A O no hydrogen 2.929 N/A SER 36.A OG ASP 38.A OD2 no hydrogen 3.055 N/A ASN 37.A N ASP 22.A OD2 no hydrogen 2.936 N/A ASP 38.A N SER 36.A OG no hydrogen 3.368 N/A SER 39.A N SER 36.A O no hydrogen 2.888 N/A SER 39.A OG THR 41.A O no hydrogen 2.696 N/A THR 41.A N SER 39.A OG no hydrogen 3.328 N/A ILE 42.A N GLN 62.A OE1 no hydrogen 2.861 N/A SER 43.A N ARG 34.A O no hydrogen 2.822 N/A THR 45.A N THR 32.A O no hydrogen 2.958 N/A THR 45.A OG1 GLN 31.A O no hydrogen 2.802 N/A LYS 46.A N SER 49.A OG no hydrogen 3.056 N/A LYS 46.A NZ GLN 31.A O no hydrogen 2.921 N/A LYS 46.A NZ GLU 229.A OE1 no hydrogen 2.895 N/A LYS 46.A NZ GLU 229.A OE2 no hydrogen 2.961 N/A TRP 48.A NE1 ASP 177.A OD2 no hydrogen 2.965 N/A SER 49.A N LYS 46.A O no hydrogen 3.352 N/A SER 49.A OG THR 32.A O no hydrogen 2.634 N/A SER 49.A OG LYS 46.A O no hydrogen 3.030 N/A GLN 50.A NE2 LEU 53.A O no hydrogen 2.887 N/A GLN 50.A NE2 ASN 55.A OD1 no hydrogen 3.106 N/A GLY 51.A N TRP 48.A O no hydrogen 2.992 N/A LEU 53.A N GLN 50.A O no hydrogen 3.265 N/A SER 54.A N GLN 57.A OE1 no hydrogen 3.303 N/A SER 54.A OG GLN 57.A OE1 no hydrogen 3.154 N/A GLN 57.A N SER 54.A OG no hydrogen 3.108 N/A TRP 58.A N SER 54.A O no hydrogen 2.771 N/A GLU 59.A N ASN 55.A O no hydrogen 3.021 N/A LYS 60.A N GLN 56.A O no hydrogen 2.932 N/A LEU 61.A N GLN 57.A O no hydrogen 3.221 N/A GLN 62.A N TRP 58.A O no hydrogen 2.840 N/A HIS 63.A N GLU 59.A O no hydrogen 2.939 N/A MET 64.A N LYS 60.A O no hydrogen 3.275 N/A PHE 65.A N LEU 61.A O no hydrogen 3.106 N/A GLN 66.A N GLN 62.A O no hydrogen 2.953 N/A GLN 66.A NE2 ALA 40.A O no hydrogen 2.731 N/A VAL 67.A N HIS 63.A O no hydrogen 3.167 N/A TYR 68.A N MET 64.A O no hydrogen 2.926 N/A TYR 68.A OH GLN 9.A OE1 no hydrogen 2.647 N/A ARG 69.A N PHE 65.A O no hydrogen 2.824 N/A ARG 69.A NH1 SER 36.A O no hydrogen 3.018 N/A ARG 69.A NH1 SER 39.A O no hydrogen 3.168 N/A ARG 69.A NH2 SER 39.A O no hydrogen 2.988 N/A VAL 70.A N GLN 66.A O no hydrogen 3.492 N/A SER 71.A N VAL 67.A O no hydrogen 3.026 N/A SER 71.A OG VAL 67.A O no hydrogen 2.669 N/A PHE 72.A N TYR 68.A O no hydrogen 2.746 N/A THR 73.A N ARG 69.A O no hydrogen 3.387 N/A THR 73.A OG1 ARG 69.A O no hydrogen 2.696 N/A ARG 74.A N VAL 70.A O no hydrogen 3.392 N/A ASP 75.A N SER 71.A O no hydrogen 2.976 N/A ILE 76.A N PHE 72.A O no hydrogen 2.866 N/A GLN 77.A N THR 73.A O no hydrogen 3.146 N/A GLU 78.A N ARG 74.A O no hydrogen 2.818 N/A LEU 79.A N ASP 75.A O no hydrogen 2.854 N/A VAL 80.A N ILE 76.A O no hydrogen 2.892 N/A LYS 81.A N GLN 77.A O no hydrogen 3.145 N/A LYS 81.A NZ GLU 78.A OE1 no hydrogen 2.807 N/A MET 82.A N GLU 78.A O no hydrogen 3.066 N/A MET 83.A N LEU 79.A O no hydrogen 3.085 N/A MET 83.A N VAL 80.A O no hydrogen 3.313 N/A SER 84.A N VAL 80.A O no hydrogen 3.094 N/A SER 84.A OG VAL 80.A O no hydrogen 3.259 N/A LYS 86.A N MET 83.A O no hydrogen 3.019 N/A ILE 91.A N PHE 13.A O no hydrogen 2.866 N/A GLU 92.A N GLN 116.A OE1 no hydrogen 3.051 N/A ILE 93.A N SER 11.A O no hydrogen 2.798 N/A GLN 94.A N ALA 114.A O no hydrogen 3.076 N/A LEU 95.A N GLN 9.A O no hydrogen 2.834 N/A SER 96.A N HIS 112.A O no hydrogen 2.872 N/A ALA 97.A N CYS 7.A O no hydrogen 3.012 N/A GLY 98.A N PHE 110.A O no hydrogen 3.021 N/A CYS 99.A N PHE 5.A O no hydrogen 3.065 N/A GLU 100.A N GLU 108.A O no hydrogen 2.865 N/A MET 101.A N TYR 3.A O no hydrogen 3.227 N/A TYR 102.A N ALA 106.A O no hydrogen 2.972 N/A GLU 108.A N GLU 100.A O no hydrogen 3.210 N/A SER 109.A OG LEU 159.A O no hydrogen 2.644 N/A PHE 110.A N GLY 98.A O no hydrogen 2.897 N/A HIS 112.A N SER 96.A O no hydrogen 2.817 N/A VAL 113.A N VAL 121.A O no hydrogen 2.693 N/A ALA 114.A N GLN 94.A O no hydrogen 2.848 N/A PHE 115.A N LYS 118.A O no hydrogen 2.779 N/A GLN 116.A N GLU 92.A O no hydrogen 2.975 N/A GLN 116.A NE2 PRO 90.A O no hydrogen 3.001 N/A LYS 118.A N PHE 115.A O no hydrogen 3.145 N/A VAL 120.A N VAL 113.A O no hydrogen 2.962 N/A VAL 121.A N VAL 113.A O no hydrogen 3.147 N/A ARG 122.A N GLN 129.A O no hydrogen 2.955 N/A ARG 122.A NE GLN 129.A OE1 no hydrogen 2.973 N/A ARG 122.A NH2 GLN 129.A OE1 no hydrogen 3.074 N/A PHE 123.A N LEU 111.A O no hydrogen 2.977 N/A TRP 124.A N SER 127.A O no hydrogen 2.885 N/A TRP 128.A N ASN 146.A OD1 no hydrogen 2.759 N/A GLN 129.A N ARG 122.A O no hydrogen 2.934 N/A VAL 131.A N VAL 120.A O no hydrogen 2.973 N/A ALA 134.A N VAL 131.A O no hydrogen 3.109 N/A LEU 138.A N PRO 135.A O no hydrogen 3.449 N/A ASP 139.A N SER 136.A O no hydrogen 3.126 N/A LEU 140.A N TRP 137.A O no hydrogen 3.409 N/A ILE 142.A N LEU 138.A O no hydrogen 3.021 N/A LYS 143.A N ASP 139.A O no hydrogen 3.026 N/A VAL 144.A N LEU 140.A O no hydrogen 3.122 N/A LEU 145.A N PRO 141.A O no hydrogen 2.883 N/A ASN 146.A N ILE 142.A O no hydrogen 2.903 N/A ASN 146.A ND2 TRP 128.A O no hydrogen 2.904 N/A ALA 147.A N VAL 144.A O no hydrogen 3.199 N/A ASP 148.A N LEU 145.A O no hydrogen 3.318 N/A GLN 149.A N ALA 147.A O no hydrogen 3.160 N/A THR 151.A N ASP 148.A OD1 no hydrogen 3.122 N/A THR 151.A OG1 ASP 148.A OD2 no hydrogen 2.795 N/A SER 152.A N ASP 148.A O no hydrogen 3.266 N/A SER 152.A OG THR 126.A O no hydrogen 2.688 N/A ALA 153.A N GLN 149.A O no hydrogen 2.969 N/A THR 154.A N GLY 150.A O no hydrogen 3.364 N/A THR 154.A OG1 GLY 150.A O no hydrogen 2.865 N/A VAL 155.A N THR 151.A O no hydrogen 2.931 N/A GLN 156.A N SER 152.A O no hydrogen 2.916 N/A GLN 156.A NE2 SER 152.A O no hydrogen 3.467 N/A GLN 156.A NE2 SER 152.A OG no hydrogen 3.102 N/A MET 157.A N ALA 153.A O no hydrogen 3.037 N/A LEU 158.A N THR 154.A O no hydrogen 2.951 N/A LEU 159.A N VAL 155.A O no hydrogen 2.959 N/A ASN 160.A N GLN 156.A O no hydrogen 2.873 N/A ASP 161.A N MET 157.A O no hydrogen 2.825 N/A THR 162.A N MET 157.A O no hydrogen 3.166 N/A CYS 163.A N LEU 158.A O no hydrogen 2.802 N/A LEU 165.A N ASP 161.A O no hydrogen 3.245 N/A PHE 166.A N THR 162.A O no hydrogen 2.865 N/A VAL 167.A N CYS 163.A O no hydrogen 3.010 N/A ARG 168.A N PRO 164.A O no hydrogen 3.122 N/A GLY 169.A N LEU 165.A O no hydrogen 3.507 N/A LEU 170.A N PHE 166.A O no hydrogen 2.967 N/A LEU 171.A N VAL 167.A O no hydrogen 2.804 N/A GLU 172.A N ARG 168.A O no hydrogen 3.251 N/A ALA 173.A N GLY 169.A O no hydrogen 3.016 N/A GLY 174.A N LEU 170.A O no hydrogen 2.805 N/A LYS 175.A N GLU 172.A O no hydrogen 3.195 N/A LEU 178.A N GLY 174.A O no hydrogen 3.076 N/A GLU 179.A N LYS 175.A O no hydrogen 2.881 N/A GLU 182.A N TYR 200.A O no hydrogen 2.810 N/A VAL 185.A N SER 197.A O no hydrogen 2.826 N/A TRP 187.A N HIS 195.A O no hydrogen 2.934 N/A SER 189.A N VAL 193.A O no hydrogen 3.205 N/A SER 189.A OG LEU 188.A O no hydrogen 2.729 N/A CYS 194.A N ALA 235.A O no hydrogen 2.797 N/A HIS 195.A N TRP 187.A O no hydrogen 2.906 N/A HIS 195.A ND1 TRP 187.A O no hydrogen 2.859 N/A VAL 196.A N LEU 233.A O no hydrogen 2.923 N/A SER 197.A N VAL 185.A O no hydrogen 2.850 N/A GLY 198.A N TRP 231.A O no hydrogen 2.886 N/A TYR 200.A N GLU 182.A O no hydrogen 3.266 N/A TYR 200.A OH ASP 29.A OD1 no hydrogen 2.756 N/A TRP 205.A N LYS 243.A O no hydrogen 2.914 N/A MET 207.A N ARG 241.A O no hydrogen 2.856 N/A TRP 208.A NE1 ALA 235.A O no hydrogen 3.237 N/A MET 209.A N ALA 239.A O no hydrogen 2.860 N/A ARG 210.A N GLN 213.A O no hydrogen 2.831 N/A GLN 213.A N ARG 210.A O no hydrogen 3.348 N/A GLN 215.A N TRP 208.A O no hydrogen 3.069 N/A HIS 219.A N THR 236.A O no hydrogen 3.173 N/A GLY 221.A N GLN 234.A O no hydrogen 2.796 N/A LEU 224.A N TYR 232.A O no hydrogen 2.853 N/A ASN 226.A N THR 230.A O no hydrogen 2.854 N/A ASN 226.A ND2 SER 197.A OG no hydrogen 3.390 N/A THR 230.A OG1 ASP 228.A OD1 no hydrogen 2.699 N/A TRP 231.A N PHE 199.A O no hydrogen 2.811 N/A TRP 231.A NE1 ASP 29.A OD2 no hydrogen 2.772 N/A TYR 232.A N LEU 224.A O no hydrogen 2.821 N/A LEU 233.A N VAL 196.A O no hydrogen 2.873 N/A GLN 234.A NE2 TYR 232.A OH no hydrogen 2.779 N/A ALA 235.A N CYS 194.A O no hydrogen 3.085 N/A THR 236.A N HIS 219.A O no hydrogen 3.171 N/A THR 236.A OG1 HIS 219.A O no hydrogen 3.145 N/A ALA 239.A N MET 209.A O no hydrogen 3.184 N/A CYS 240.A N LEU 254.A O no hydrogen 2.803 N/A ARG 241.A N MET 207.A O no hydrogen 2.857 N/A VAL 242.A N ILE 252.A O no hydrogen 2.824 N/A LYS 243.A N TRP 205.A O no hydrogen 2.762 N/A HIS 244.A ND1 SER 246.A OG no hydrogen 2.804 N/A HIS 244.A NE2 PRO 201.A O no hydrogen 2.860 N/A SER 245.A OG GLN 181.A OE1 no hydrogen 2.708 N/A SER 246.A N HIS 244.A ND1 no hydrogen 3.005 N/A SER 246.A OG GLU 182.A O no hydrogen 3.319 N/A SER 246.A OG HIS 244.A ND1 no hydrogen 2.804 N/A LEU 247.A N HIS 244.A O no hydrogen 3.081 N/A GLN 250.A N LEU 247.A O no hydrogen 3.264 N/A ILE 252.A N VAL 242.A O no hydrogen 3.013 N/A LEU 254.A N CYS 240.A O no hydrogen 2.878 N/A