Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rby_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 1.A ND1 no hydrogen 2.707 N/A ALA 4.A N VAL 27.A O no hydrogen 2.805 N/A LEU 6.A N SER 25.A O no hydrogen 2.920 N/A LYS 7.A N GLN 131.A O no hydrogen 2.827 N/A LYS 7.A NZ ARG 8.A O no hydrogen 2.933 N/A ARG 8.A N THR 23.A O no hydrogen 2.975 N/A LEU 9.A N MET 129.A O no hydrogen 2.780 N/A PHE 11.A N ASN 18.A O no hydrogen 2.955 N/A GLN 12.A N ARG 127.A O no hydrogen 2.846 N/A ASN 18.A N PHE 11.A O no hydrogen 3.152 N/A ARG 20.A NH1 LYS 41.A O no hydrogen 3.351 N/A ARG 20.A NH1 GLU 46.A OE2 no hydrogen 2.595 N/A THR 21.A N GLU 19.A OE2 no hydrogen 2.960 N/A THR 21.A OG1 GLU 19.A OE2 no hydrogen 2.504 N/A THR 21.A OG1 THR 23.A OG1 no hydrogen 2.658 N/A PHE 22.A N PRO 38.A O no hydrogen 2.936 N/A THR 23.A OG1 THR 21.A OG1 no hydrogen 2.658 N/A LEU 24.A N LEU 36.A O no hydrogen 3.393 N/A SER 25.A N LEU 6.A O no hydrogen 2.759 N/A SER 25.A OG SER 35.A OG no hydrogen 2.813 N/A SER 26.A N ILE 34.A O no hydrogen 2.883 N/A VAL 27.A N ALA 4.A O no hydrogen 2.822 N/A SER 28.A N HIS 32.A O no hydrogen 2.745 N/A SER 28.A OG HIS 32.A O no hydrogen 3.314 N/A SER 28.A OG GLU 242.A OE1 no hydrogen 2.727 N/A THR 29.A N SER 156.A OG no hydrogen 2.969 N/A ASP 30.A N GLU 242.A OE2 no hydrogen 2.937 N/A GLY 31.A N SER 28.A O no hydrogen 2.861 N/A HIS 32.A N SER 28.A OG no hydrogen 2.841 N/A TYR 33.A N GLY 57.A O no hydrogen 2.908 N/A TYR 33.A OH THR 61.A OG1 no hydrogen 2.858 N/A ILE 34.A N SER 26.A O no hydrogen 3.079 N/A SER 35.A N PHE 55.A O no hydrogen 2.774 N/A SER 35.A OG SER 25.A OG no hydrogen 2.813 N/A LEU 36.A N LEU 24.A O no hydrogen 3.365 N/A ARG 37.A NE SER 35.A OG no hydrogen 2.956 N/A ARG 37.A NH2 SER 35.A OG no hydrogen 3.134 N/A PHE 39.A N PRO 50.A O no hydrogen 3.204 N/A VAL 40.A N ARG 20.A O no hydrogen 2.932 N/A SER 43.A N GLU 46.A OE2 no hydrogen 2.932 N/A GLU 46.A N SER 43.A O no hydrogen 2.959 N/A PHE 51.A N PHE 49.A O no hydrogen 2.680 N/A GLU 52.A N ARG 37.A O no hydrogen 2.917 N/A TRP 53.A NE1 ASP 81.A OD1 no hydrogen 2.922 N/A PHE 55.A N SER 35.A O no hydrogen 3.153 N/A ALA 56.A N LEU 80.A O no hydrogen 3.244 N/A GLY 57.A N TYR 33.A O no hydrogen 2.859 N/A THR 58.A OG1 GLU 60.A OE1 no hydrogen 3.020 N/A THR 58.A OG1 GLU 60.A OE2 no hydrogen 2.742 N/A ASN 59.A N HIS 32.A ND1 no hydrogen 2.907 N/A ASN 59.A ND2 ASP 30.A O no hydrogen 2.986 N/A GLU 60.A N GLU 60.A OE1 no hydrogen 2.770 N/A THR 61.A N THR 58.A O no hydrogen 2.983 N/A THR 61.A OG1 TYR 33.A OH no hydrogen 2.858 N/A THR 61.A OG1 THR 58.A O no hydrogen 2.795 N/A VAL 62.A N ASN 59.A O no hydrogen 3.338 N/A LYS 63.A N ASP 75.A O no hydrogen 3.002 N/A LYS 63.A NZ GLU 95.A OE2 no hydrogen 2.678 N/A ASN 65.A N THR 73.A O no hydrogen 2.884 N/A ASN 65.A ND2 ALA 64.A O no hydrogen 3.548 N/A GLN 67.A N VAL 71.A O no hydrogen 2.975 N/A GLY 68.A N ASP 66.A OD1 no hydrogen 2.723 N/A ASN 69.A N ASN 69.A OD1 no hydrogen 2.515 N/A VAL 72.A N TRP 100.A O no hydrogen 2.898 N/A THR 73.A N ASN 65.A O no hydrogen 2.767 N/A THR 73.A OG1 ASN 65.A O no hydrogen 3.333 N/A GLN 74.A N THR 98.A O no hydrogen 2.892 N/A ASP 75.A N LYS 63.A O no hydrogen 3.060 N/A PHE 76.A N VAL 96.A O no hydrogen 2.813 N/A ASN 77.A N THR 61.A O no hydrogen 2.901 N/A TRP 79.A N ALA 56.A O no hydrogen 3.006 N/A LEU 80.A N ALA 56.A O no hydrogen 2.962 N/A THR 82.A N ALA 54.A O no hydrogen 3.249 N/A ASN 83.A N ASP 81.A OD1 no hydrogen 2.849 N/A TYR 85.A N ASP 81.A O no hydrogen 2.833 N/A TYR 85.A OH GLN 183.A O no hydrogen 2.817 N/A LEU 86.A N THR 82.A O no hydrogen 2.777 N/A ASN 87.A N VAL 84.A O no hydrogen 3.338 N/A VAL 88.A N ASN 83.A O no hydrogen 2.922 N/A ARG 93.A NE THR 91.A O no hydrogen 3.338 N/A ARG 93.A NE HIS 92.A O no hydrogen 2.903 N/A VAL 96.A N PHE 76.A O no hydrogen 2.800 N/A THR 98.A N GLN 74.A O no hydrogen 2.883 N/A THR 98.A OG1 GLN 74.A O no hydrogen 2.824 N/A THR 99.A N THR 111.A O no hydrogen 2.873 N/A TRP 100.A N VAL 72.A O no hydrogen 2.740 N/A TRP 100.A NE1 THR 98.A OG1 no hydrogen 2.776 N/A LYS 101.A N GLU 109.A O no hydrogen 2.873 N/A ASN 102.A N GLY 70.A O no hydrogen 3.034 N/A TRP 103.A N CYS 107.A O no hydrogen 2.915 N/A GLY 106.A N TRP 103.A O no hydrogen 2.932 N/A CYS 107.A SG GLN 131.A OE1 no hydrogen 3.252 N/A VAL 108.A N TRP 130.A O no hydrogen 2.904 N/A GLU 109.A N LYS 101.A O no hydrogen 2.893 N/A GLU 110.A N GLU 128.A O no hydrogen 2.737 N/A THR 111.A N THR 99.A O no hydrogen 2.833 N/A THR 111.A OG1 THR 99.A O no hydrogen 3.535 N/A GLY 112.A N PHE 126.A O no hydrogen 3.195 N/A VAL 114.A N VAL 124.A O no hydrogen 2.847 N/A GLY 118.A N TYR 115.A O no hydrogen 3.251 N/A LYS 121.A N GLY 118.A O no hydrogen 2.980 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 3.153 N/A VAL 124.A N VAL 114.A O no hydrogen 2.957 N/A PHE 126.A N GLY 112.A O no hydrogen 2.703 N/A ARG 127.A N GLN 12.A O no hydrogen 2.949 N/A ARG 127.A NH2 GLU 109.A OE1 no hydrogen 2.727 N/A GLU 128.A N GLU 110.A O no hydrogen 2.757 N/A MET 129.A N LEU 10.A O no hydrogen 3.062 N/A TRP 130.A N VAL 108.A O no hydrogen 2.928 N/A TRP 130.A NE1 GLU 110.A OE1 no hydrogen 2.853 N/A GLN 131.A N LYS 7.A O no hydrogen 2.828 N/A GLN 131.A NE2 PRO 132.A O no hydrogen 2.947 N/A VAL 133.A N LEU 5.A O no hydrogen 2.997 N/A ASP 134.A N VAL 141.A O no hydrogen 3.111 N/A SER 136.A N ASP 134.A OD1 no hydrogen 2.794 N/A SER 136.A OG ASP 134.A OD1 no hydrogen 2.500 N/A SER 136.A OG ASP 134.A OD2 no hydrogen 3.419 N/A ARG 137.A N ASP 134.A O no hydrogen 3.112 N/A VAL 143.A N PRO 132.A O no hydrogen 3.246 N/A SER 144.A OG GLU 148.A O no hydrogen 2.914 N/A ASN 146.A N GLU 148.A OE1 no hydrogen 2.682 N/A GLU 148.A N GLU 148.A OE1 no hydrogen 2.715 N/A ARG 155.A NE GLY 174.A O no hydrogen 2.693 N/A ARG 155.A NH2 GLY 174.A O no hydrogen 2.994 N/A SER 156.A N HIS 244.A O no hydrogen 2.858 N/A SER 156.A OG THR 29.A OG1 no hydrogen 3.190 N/A SER 156.A OG GLU 242.A OE2 no hydrogen 2.909 N/A ILE 157.A N VAL 172.A O no hydrogen 2.843 N/A VAL 158.A N GLU 242.A O no hydrogen 3.056 N/A LEU 159.A N VAL 170.A O no hydrogen 2.912 N/A LYS 160.A N GLU 239.A O no hydrogen 2.780 N/A VAL 161.A N GLY 168.A O no hydrogen 2.910 N/A THR 162.A N ASN 237.A O no hydrogen 2.955 N/A THR 162.A OG1 ASN 237.A O no hydrogen 3.362 N/A ALA 165.A N ASP 163.A OD1 no hydrogen 2.726 N/A TYR 166.A OH GLU 214.A OE1 no hydrogen 2.586 N/A TYR 166.A OH GLU 214.A OE2 no hydrogen 3.087 N/A ASP 167.A N SER 182.A O no hydrogen 2.880 N/A LEU 169.A N PHE 180.A O no hydrogen 3.181 N/A VAL 170.A N LEU 159.A O no hydrogen 2.877 N/A ILE 171.A N GLN 178.A O no hydrogen 2.754 N/A VAL 172.A N ILE 157.A O no hydrogen 2.594 N/A ILE 173.A N TRP 176.A O no hydrogen 2.954 N/A GLY 174.A N ARG 155.A O no hydrogen 2.940 N/A ARG 175.A N PRO 135.A O no hydrogen 2.783 N/A ARG 175.A NH1 SER 136.A O no hydrogen 2.945 N/A TRP 176.A N ILE 173.A O no hydrogen 2.854 N/A TRP 176.A NE1 ARG 137.A O no hydrogen 2.900 N/A ILE 177.A N LEU 197.A O no hydrogen 2.872 N/A GLN 178.A N ILE 171.A O no hydrogen 3.100 N/A GLN 178.A NE2 LEU 24.A O no hydrogen 3.026 N/A GLN 178.A NE2 SER 26.A OG no hydrogen 2.838 N/A GLY 179.A N ILE 195.A O no hydrogen 3.019 N/A PHE 180.A N LEU 169.A O no hydrogen 2.872 N/A LEU 181.A N ASN 193.A O no hydrogen 2.888 N/A SER 182.A N ASP 167.A O no hydrogen 2.673 N/A SER 182.A OG ASP 167.A O no hydrogen 3.561 N/A GLN 183.A N GLY 191.A O no hydrogen 2.999 N/A GLN 183.A NE2 GLU 214.A OE2 no hydrogen 2.837 N/A LYS 184.A N ALA 165.A O no hydrogen 2.853 N/A LYS 184.A NZ ASP 167.A OD2 no hydrogen 3.052 N/A GLU 190.A N THR 188.A OG1 no hydrogen 2.917 N/A GLY 191.A N THR 188.A O no hydrogen 2.695 N/A LEU 192.A N ILE 189.A O no hydrogen 3.341 N/A ASN 193.A N LEU 181.A O no hydrogen 2.875 N/A ASN 193.A ND2 LEU 181.A O no hydrogen 3.023 N/A PHE 194.A N TYR 211.A O no hydrogen 2.818 N/A ILE 195.A N GLY 179.A O no hydrogen 3.159 N/A ARG 196.A N LEU 209.A O no hydrogen 3.029 N/A ARG 196.A NH1 PHE 22.A O no hydrogen 2.535 N/A ARG 196.A NH2 GLN 178.A OE1 no hydrogen 2.566 N/A LEU 197.A N ILE 177.A O no hydrogen 2.792 N/A LEU 198.A N GLU 206.A O no hydrogen 2.844 N/A GLU 199.A N ARG 175.A O no hydrogen 3.004 N/A LYS 200.A N LYS 204.A O no hydrogen 2.821 N/A ASP 201.A N GLU 138.A OE2 no hydrogen 2.636 N/A GLY 203.A N LYS 200.A O no hydrogen 2.648 N/A GLU 206.A N LEU 198.A O no hydrogen 2.727 N/A LEU 208.A N ARG 196.A O no hydrogen 2.874 N/A TYR 211.A N PHE 194.A O no hydrogen 2.974 N/A TYR 211.A OH SER 48.A O no hydrogen 2.784 N/A GLU 214.A N ASN 193.A OD1 no hydrogen 2.716 N/A LYS 217.A N GLU 214.A O no hydrogen 2.779 N/A LYS 217.A NZ GLU 214.A OE1 no hydrogen 2.946 N/A ILE 218.A N VAL 215.A O no hydrogen 3.001 N/A GLN 220.A NE2 ILE 218.A O no hydrogen 3.190 N/A TYR 222.A OH PRO 219.A O no hydrogen 2.811 N/A LYS 226.A N SER 229.A OG no hydrogen 2.765 N/A GLY 228.A N VAL 240.A O no hydrogen 2.771 N/A SER 229.A N LYS 226.A O no hydrogen 2.914 N/A SER 229.A OG LYS 226.A O no hydrogen 2.737 N/A VAL 231.A N TRP 238.A O no hydrogen 2.734 N/A THR 232.A OG1 ASN 237.A OD1 no hydrogen 2.528 N/A SER 233.A N LEU 236.A O no hydrogen 2.872 N/A SER 233.A OG ASN 216.A O no hydrogen 2.769 N/A LEU 236.A N SER 233.A O no hydrogen 3.123 N/A TRP 238.A N VAL 231.A O no hydrogen 2.704 N/A TRP 238.A NE1 LYS 217.A O no hydrogen 2.889 N/A GLU 239.A N LYS 160.A O no hydrogen 2.724 N/A VAL 240.A N SER 229.A O no hydrogen 2.933 N/A ILE 241.A N VAL 158.A O no hydrogen 2.927 N/A GLU 242.A N VAL 158.A O no hydrogen 3.386 N/A TYR 243.A OH TYR 222.A O no hydrogen 2.964 N/A HIS 244.A N SER 156.A O no hydrogen 2.873 N/A HIS 244.A NE2 ASP 30.A OD1 no hydrogen 2.669 N/A