Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rjy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 103.A O no hydrogen 3.013 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.935 N/A LEU 5.A N CYS 101.A O no hydrogen 2.931 N/A ARG 6.A N TYR 27.A O no hydrogen 2.891 N/A TYR 7.A N SER 99.A O no hydrogen 2.707 N/A PHE 8.A N VAL 25.A O no hydrogen 2.772 N/A VAL 9.A N VAL 97.A O no hydrogen 2.897 N/A THR 10.A N ILE 23.A O no hydrogen 2.768 N/A ALA 11.A N ILE 95.A O no hydrogen 2.937 N/A VAL 12.A N ARG 21.A O no hydrogen 2.920 N/A SER 13.A N HIS 93.A O no hydrogen 2.962 N/A SER 13.A OG HIS 93.A O no hydrogen 3.562 N/A ARG 14.A NE GLU 19.A O no hydrogen 3.065 N/A ARG 14.A NH1 ASP 39.A OD1 no hydrogen 3.443 N/A ARG 14.A NH2 GLU 19.A O no hydrogen 2.973 N/A ARG 14.A NH2 ASP 39.A OD1 no hydrogen 3.427 N/A LEU 17.A N ARG 14.A O no hydrogen 2.844 N/A ARG 21.A N VAL 12.A O no hydrogen 2.868 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 2.696 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.517 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.884 N/A PHE 22.A N SER 38.A OG no hydrogen 2.879 N/A ILE 23.A N THR 10.A O no hydrogen 2.846 N/A SER 24.A N PHE 36.A O no hydrogen 2.879 N/A SER 24.A OG TYR 45.A OH no hydrogen 2.639 N/A VAL 25.A N PHE 8.A O no hydrogen 2.823 N/A GLY 26.A N VAL 34.A O no hydrogen 2.847 N/A TYR 27.A N ARG 6.A O no hydrogen 2.630 N/A VAL 28.A N THR 31.A O no hydrogen 2.961 N/A ASP 29.A N SER 4.A O no hydrogen 2.999 N/A THR 31.A N VAL 28.A O no hydrogen 3.083 N/A PHE 33.A N GLY 26.A O no hydrogen 2.930 N/A ARG 35.A N GLU 46.A O no hydrogen 3.138 N/A ARG 35.A NE GLU 32.A OE2 no hydrogen 2.697 N/A ARG 35.A NH2 GLU 32.A OE1 no hydrogen 3.005 N/A ARG 35.A NH2 GLU 32.A OE2 no hydrogen 3.400 N/A PHE 36.A N SER 24.A O no hydrogen 2.807 N/A SER 38.A N PHE 22.A O no hydrogen 2.851 N/A SER 38.A OG PHE 22.A O no hydrogen 3.354 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 2.816 N/A TYR 45.A N THR 64.A OG1 no hydrogen 2.914 N/A TYR 45.A OH SER 24.A OG no hydrogen 2.639 N/A GLU 46.A N ARG 35.A O no hydrogen 2.927 N/A ARG 48.A N PHE 33.A O no hydrogen 2.788 N/A ARG 50.A NH1 GLU 53.A OE1 no hydrogen 3.393 N/A MET 52.A N ALA 49.A O no hydrogen 2.825 N/A GLU 53.A N ARG 50.A O no hydrogen 2.941 N/A GLU 55.A N MET 52.A O no hydrogen 2.958 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.565 N/A TYR 59.A N GLY 56.A O no hydrogen 2.857 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.634 N/A GLU 61.A N PRO 57.A O no hydrogen 3.311 N/A ARG 62.A N GLU 58.A O no hydrogen 3.083 N/A GLU 63.A N TYR 59.A O no hydrogen 2.886 N/A THR 64.A N TRP 60.A O no hydrogen 2.826 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.746 N/A GLN 65.A N GLU 61.A O no hydrogen 3.101 N/A LYS 66.A N ARG 62.A O no hydrogen 3.051 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 3.208 N/A ALA 67.A N GLU 63.A O no hydrogen 2.910 N/A LYS 68.A N THR 64.A O no hydrogen 2.886 N/A GLY 69.A N GLN 65.A O no hydrogen 2.926 N/A ASN 70.A N LYS 66.A O no hydrogen 3.031 N/A GLU 71.A N ALA 67.A O no hydrogen 2.792 N/A GLN 72.A N LYS 68.A O no hydrogen 3.231 N/A SER 73.A N GLY 69.A O no hydrogen 3.132 N/A SER 73.A OG GLY 69.A O no hydrogen 3.534 N/A PHE 74.A N ASN 70.A O no hydrogen 2.810 N/A ARG 75.A N GLU 71.A O no hydrogen 2.953 N/A ARG 75.A NE GLU 19.A OE1 no hydrogen 2.781 N/A VAL 76.A N GLN 72.A O no hydrogen 3.001 N/A ASP 77.A N SER 73.A O no hydrogen 2.735 N/A LEU 78.A N PHE 74.A O no hydrogen 2.894 N/A ARG 79.A N ARG 75.A O no hydrogen 3.499 N/A THR 80.A N VAL 76.A O no hydrogen 2.941 N/A THR 80.A OG1 VAL 76.A O no hydrogen 3.350 N/A LEU 81.A N ASP 77.A O no hydrogen 2.921 N/A LEU 82.A N LEU 78.A O no hydrogen 3.187 N/A GLY 83.A N ARG 79.A O no hydrogen 3.357 N/A TYR 84.A N THR 80.A O no hydrogen 3.058 N/A TYR 85.A N LEU 81.A O no hydrogen 3.051 N/A TYR 85.A OH ASP 137.A OD1 no hydrogen 2.644 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 3.254 N/A ASN 86.A N GLY 83.A O no hydrogen 3.030 N/A GLN 87.A N LEU 82.A O no hydrogen 2.871 N/A SER 92.A OG SER 13.A O no hydrogen 2.765 N/A HIS 93.A N SER 13.A OG no hydrogen 2.882 N/A HIS 93.A ND1 ASP 119.A OD2 no hydrogen 2.822 N/A THR 94.A N ASP 119.A OD1 no hydrogen 2.812 N/A ILE 95.A N ALA 11.A O no hydrogen 2.862 N/A GLN 96.A N ALA 117.A O no hydrogen 2.920 N/A VAL 97.A N VAL 9.A O no hydrogen 2.966 N/A ILE 98.A N GLN 115.A O no hydrogen 2.977 N/A SER 99.A N TYR 7.A O no hydrogen 2.909 N/A GLY 100.A N TYR 113.A O no hydrogen 3.225 N/A CYS 101.A N LEU 5.A O no hydrogen 2.895 N/A GLU 102.A N ARG 111.A O no hydrogen 2.922 N/A VAL 103.A N HIS 3.A O no hydrogen 2.793 N/A GLY 104.A N ARG 108.A O no hydrogen 2.773 N/A GLY 107.A N GLY 104.A O no hydrogen 3.095 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 2.779 N/A LEU 110.A N GLU 102.A O no hydrogen 2.585 N/A ARG 111.A N GLU 102.A O no hydrogen 3.359 N/A ARG 111.A NE GLU 102.A OE1 no hydrogen 2.910 N/A ARG 111.A NH2 GLU 102.A OE1 no hydrogen 2.687 N/A TYR 113.A N GLY 100.A O no hydrogen 2.690 N/A TYR 113.A OH GLU 102.A OE1 no hydrogen 3.102 N/A GLN 114.A NE2 SER 99.A OG no hydrogen 2.555 N/A GLN 114.A NE2 TYR 113.A O no hydrogen 3.426 N/A GLN 115.A N ILE 98.A O no hydrogen 3.028 N/A TYR 116.A N ILE 124.A O no hydrogen 2.737 N/A ALA 117.A N GLN 96.A O no hydrogen 2.866 N/A TYR 118.A N CYS 121.A O no hydrogen 2.843 N/A TYR 118.A OH GLN 87.A OE1 no hydrogen 2.669 N/A ASP 119.A N THR 94.A O no hydrogen 2.760 N/A CYS 121.A N TYR 118.A O no hydrogen 3.021 N/A CYS 121.A SG ASP 119.A O no hydrogen 3.876 N/A TYR 123.A N TYR 116.A O no hydrogen 2.838 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.593 N/A ALA 125.A N THR 134.A O no hydrogen 3.179 N/A LEU 126.A N GLN 114.A O no hydrogen 3.108 N/A ASN 127.A N THR 132.A O no hydrogen 2.979 N/A ASN 127.A ND2 THR 134.A OG1 no hydrogen 2.521 N/A LEU 130.A N ASN 127.A O no hydrogen 2.775 N/A LYS 131.A N ASP 129.A OD1 no hydrogen 2.565 N/A THR 132.A N ASP 129.A OD1 no hydrogen 3.028 N/A THR 132.A OG1 ASN 127.A OD1 no hydrogen 2.682 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 3.364 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 2.851 N/A THR 134.A N ALA 125.A O no hydrogen 2.936 N/A ALA 136.A N TYR 123.A O no hydrogen 2.866 N/A ALA 140.A N ASP 137.A OD2 no hydrogen 2.916 N/A LEU 141.A N ASP 137.A O no hydrogen 3.263 N/A LEU 141.A N MET 138.A O no hydrogen 3.194 N/A ILE 142.A N ALA 139.A O no hydrogen 3.026 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.593 N/A LYS 144.A N ALA 140.A O no hydrogen 2.877 N/A LYS 144.A NZ TRP 133.A O no hydrogen 2.938 N/A HIS 145.A N LEU 141.A O no hydrogen 2.994 N/A LYS 146.A N ILE 142.A O no hydrogen 3.279 N/A LYS 146.A NZ TYR 84.A OH no hydrogen 2.815 N/A TRP 147.A N THR 143.A O no hydrogen 2.954 N/A GLU 148.A N LYS 144.A O no hydrogen 2.896 N/A GLN 149.A N HIS 145.A O no hydrogen 3.173 N/A ALA 150.A N LYS 146.A O no hydrogen 2.988 N/A GLY 151.A N GLU 148.A O no hydrogen 3.422 N/A GLU 152.A N TRP 147.A O no hydrogen 2.878 N/A GLU 154.A N GLY 151.A O no hydrogen 2.972 N/A ARG 155.A N GLY 151.A O no hydrogen 3.257 N/A ARG 155.A NE GLU 152.A OE1 no hydrogen 2.727 N/A ARG 155.A NH2 GLU 152.A OE1 no hydrogen 3.317 N/A ARG 155.A NH2 GLU 152.A OE2 no hydrogen 2.746 N/A LEU 156.A N GLU 152.A O no hydrogen 3.017 N/A ARG 157.A N ALA 153.A O no hydrogen 3.002 N/A ARG 157.A NE GLU 161.A OE1 no hydrogen 3.033 N/A ARG 157.A NE GLU 161.A OE2 no hydrogen 3.408 N/A ALA 158.A N GLU 154.A O no hydrogen 3.193 N/A TYR 159.A N ARG 155.A O no hydrogen 3.229 N/A LEU 160.A N LEU 156.A O no hydrogen 2.726 N/A GLU 161.A N ARG 157.A O no hydrogen 3.037 N/A GLY 162.A N ALA 158.A O no hydrogen 3.022 N/A CYS 164.A N TYR 159.A O no hydrogen 2.704 N/A GLU 166.A N GLY 162.A O no hydrogen 2.894 N/A TRP 167.A N THR 163.A O no hydrogen 2.931 N/A LEU 168.A N CYS 164.A O no hydrogen 2.882 N/A ARG 169.A N VAL 165.A O no hydrogen 2.887 N/A ARG 170.A N GLU 166.A O no hydrogen 3.163 N/A TYR 171.A N TRP 167.A O no hydrogen 2.772 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.634 N/A LEU 172.A N LEU 168.A O no hydrogen 2.684 N/A LYS 173.A N ARG 169.A O no hydrogen 3.115 N/A ASN 174.A N ARG 170.A O no hydrogen 3.215 N/A ASN 174.A N TYR 171.A O no hydrogen 2.761 N/A GLY 175.A N TYR 171.A O no hydrogen 2.845 N/A ASN 176.A ND2 LEU 172.A O no hydrogen 3.643 N/A LEU 179.A N GLY 175.A O no hydrogen 2.660 N/A LEU 180.A N ASN 176.A O no hydrogen 2.904 N/A ARG 181.A N THR 178.A O no hydrogen 3.014 N/A ARG 181.A NE ASP 183.A OD2 no hydrogen 2.841 N/A ARG 181.A NH2 ASP 183.A OD2 no hydrogen 2.771 N/A THR 182.A OG1 ARG 181.A O no hydrogen 3.486 N/A ASP 183.A N TYR 209.A O no hydrogen 2.866 N/A SER 184.A OG GLY 265.A O no hydrogen 2.798 N/A LYS 186.A N LEU 206.A O no hydrogen 3.036 N/A HIS 188.A N TRP 204.A O no hydrogen 3.262 N/A THR 190.A N ARG 202.A O no hydrogen 2.801 N/A THR 190.A OG1 HIS 192.A NE2 no hydrogen 2.749 N/A THR 190.A OG1 ARG 202.A O no hydrogen 3.483 N/A HIS 191.A NE2 GLU 254.A OE2 no hydrogen 2.867 N/A HIS 192.A N THR 200.A O no hydrogen 2.945 N/A HIS 192.A NE2 THR 190.A OG1 no hydrogen 2.749 N/A VAL 199.A N VAL 249.A O no hydrogen 2.904 N/A THR 200.A N HIS 192.A O no hydrogen 2.738 N/A LEU 201.A N VAL 247.A O no hydrogen 2.964 N/A ARG 202.A N THR 190.A O no hydrogen 2.990 N/A ARG 202.A NH1 SER 246.A OG no hydrogen 3.365 N/A CYS 203.A N ALA 245.A O no hydrogen 2.738 N/A TRP 204.A N HIS 188.A O no hydrogen 2.927 N/A TRP 204.A NE1 THR 190.A OG1 no hydrogen 2.929 N/A ALA 205.A N LYS 243.A O no hydrogen 2.979 N/A LEU 206.A N LYS 186.A O no hydrogen 2.906 N/A PHE 208.A N PHE 241.A O no hydrogen 3.330 N/A TYR 209.A N ASP 183.A O no hydrogen 2.862 N/A THR 214.A N TYR 262.A O no hydrogen 3.012 N/A THR 216.A N HIS 260.A O no hydrogen 2.952 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 2.975 N/A GLN 218.A N THR 258.A O no hydrogen 2.849 N/A LEU 219.A N GLU 222.A O no hydrogen 2.800 N/A ASN 220.A N TYR 256.A O no hydrogen 3.253 N/A GLU 222.A N LEU 219.A O no hydrogen 3.003 N/A LEU 224.A N TRP 217.A O no hydrogen 2.734 N/A GLU 229.A N SER 246.A O no hydrogen 3.006 N/A VAL 231.A N TRP 244.A O no hydrogen 3.337 N/A ARG 234.A N GLN 242.A O no hydrogen 3.070 N/A ALA 236.A N THR 240.A O no hydrogen 2.914 N/A THR 240.A N ASP 238.A OD1 no hydrogen 2.933 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.741 N/A PHE 241.A N PHE 208.A O no hydrogen 2.782 N/A GLN 242.A N ARG 234.A O no hydrogen 2.853 N/A LYS 243.A N ALA 205.A O no hydrogen 3.110 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.750 N/A LYS 243.A NZ THR 233.A OG1 no hydrogen 3.221 N/A ALA 245.A N CYS 203.A O no hydrogen 3.082 N/A SER 246.A N GLU 229.A O no hydrogen 2.809 N/A VAL 247.A N LEU 201.A O no hydrogen 3.037 N/A VAL 249.A N VAL 199.A O no hydrogen 2.836 N/A LEU 251.A N ASP 197.A O no hydrogen 2.989 N/A GLY 252.A N GLU 254.A OE1 no hydrogen 3.040 N/A LYS 253.A N PRO 250.A O no hydrogen 2.956 N/A LYS 253.A NZ TYR 256.A OH no hydrogen 3.319 N/A GLU 254.A N GLU 254.A OE1 no hydrogen 2.748 N/A GLN 255.A NE2 TRP 274.A O no hydrogen 3.196 N/A TYR 256.A N LYS 253.A O no hydrogen 3.043 N/A TYR 257.A N GLU 254.A O no hydrogen 3.339 N/A THR 258.A N GLN 218.A O no hydrogen 3.072 N/A THR 258.A OG1 HIS 260.A NE2 no hydrogen 2.722 N/A CYS 259.A N LEU 272.A O no hydrogen 2.695 N/A CYS 259.A SG THR 216.A O no hydrogen 3.706 N/A HIS 260.A N THR 216.A O no hydrogen 2.801 N/A HIS 260.A NE2 THR 258.A OG1 no hydrogen 2.722 N/A VAL 261.A N LEU 270.A O no hydrogen 2.844 N/A TYR 262.A N THR 214.A O no hydrogen 2.857 N/A HIS 263.A NE2 TYR 209.A O no hydrogen 3.132 N/A LEU 266.A N HIS 263.A O no hydrogen 3.027 N/A LEU 270.A N VAL 261.A O no hydrogen 2.913 N/A LEU 272.A N CYS 259.A O no hydrogen 2.884 N/A