Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r6d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH GLU 188.A OE1 no hydrogen 2.590 N/A ILE 6.A N HIS 28.A O no hydrogen 3.079 N/A THR 7.A N VAL 71.A O no hydrogen 3.102 N/A THR 7.A OG1 ALA 65.A O no hydrogen 2.779 N/A ILE 8.A N THR 30.A O no hydrogen 2.777 N/A LEU 9.A N PHE 73.A O no hydrogen 2.824 N/A GLY 13.A N GLY 10.A O no hydrogen 3.015 N/A GLN 17.A N GLY 13.A O no hydrogen 2.833 N/A GLN 17.A NE2 ALA 12.A O no hydrogen 2.900 N/A GLN 17.A NE2 ARG 39.A O no hydrogen 3.424 N/A THR 19.A N ALA 16.A O no hydrogen 2.903 N/A THR 19.A OG1 ALA 16.A O no hydrogen 2.789 N/A ALA 20.A N GLN 17.A O no hydrogen 3.020 N/A THR 21.A OG1.A LEU 18.A O no hydrogen 3.203 N/A LEU 22.A N LEU 18.A O no hydrogen 2.868 N/A LEU 23.A N THR 19.A O no hydrogen 2.952 N/A THR 24.A N ALA 20.A O no hydrogen 2.957 N/A THR 24.A OG1 ALA 20.A O no hydrogen 3.162 N/A TYR 25.A N THR 21.A O.A no hydrogen 2.888 N/A TYR 25.A N THR 21.A O.B no hydrogen 2.914 N/A THR 26.A N LEU 22.A O no hydrogen 3.133 N/A THR 26.A OG1 LEU 22.A O no hydrogen 2.653 N/A ILE 29.A N ARG 49.A O no hydrogen 2.807 N/A THR 30.A N ILE 6.A O no hydrogen 2.885 N/A LEU 31.A N THR 51.A O no hydrogen 2.790 N/A TYR 32.A N ILE 8.A O no hydrogen 3.146 N/A TYR 32.A OH SER 56.A O no hydrogen 2.685 N/A GLY 33.A N ILE 53.A O no hydrogen 3.135 N/A THR 38.A N GLN 35.A O no hydrogen 3.138 N/A THR 38.A OG1 GLN 35.A O no hydrogen 3.280 N/A ARG 39.A N GLN 35.A O no hydrogen 3.075 N/A ARG 39.A NH1 ARG 34.A O no hydrogen 2.872 N/A ILE 40.A N LEU 36.A O no hydrogen 3.166 N/A GLU 43.A N GLU 43.A OE1 no hydrogen 2.717 N/A ILE 44.A N PRO 41.A O no hydrogen 3.028 N/A ILE 45.A N PRO 41.A O no hydrogen 3.049 N/A ASP 46.A N PRO 42.A O no hydrogen 2.803 N/A HIS 47.A N ILE 44.A O no hydrogen 3.005 N/A ARG 49.A N HIS 47.A ND1 no hydrogen 2.937 N/A ARG 49.A NH2 LEU 23.A O no hydrogen 2.819 N/A VAL 50.A N HIS 47.A O no hydrogen 3.063 N/A THR 51.A N ILE 29.A O no hydrogen 2.904 N/A ILE 53.A N LEU 31.A O no hydrogen 2.904 N/A GLY 55.A N GLY 33.A O no hydrogen 3.137 N/A SER 56.A N ASN 59.A OD1 no hydrogen 2.907 N/A SER 56.A OG ASN 59.A OD1 no hydrogen 3.244 N/A GLN 58.A N SER 56.A OG no hydrogen 2.931 N/A ASN 59.A N SER 56.A O no hydrogen 3.135 N/A LEU 62.A N TYR 32.A OH no hydrogen 3.226 N/A GLU 63.A N PRO 60.A O no hydrogen 2.872 N/A GLN 64.A N GLY 61.A O no hydrogen 2.975 N/A VAL 66.A N LEU 62.A O no hydrogen 3.083 N/A THR 67.A N.A GLN 64.A O no hydrogen 3.205 N/A THR 67.A N.B GLN 64.A O no hydrogen 3.186 N/A THR 67.A OG1.A GLU 63.A O no hydrogen 2.798 N/A THR 67.A OG1.B GLU 63.A O no hydrogen 2.605 N/A THR 67.A OG1.B GLN 64.A O no hydrogen 3.455 N/A ALA 69.A N VAL 66.A O no hydrogen 3.041 N/A GLU 70.A N TYR 5.A O no hydrogen 2.823 N/A VAL 71.A N TYR 5.A O no hydrogen 3.321 N/A VAL 72.A N ARG 94.A O no hydrogen 2.971 N/A PHE 73.A N THR 7.A O no hydrogen 2.895 N/A VAL 74.A N ILE 96.A O no hydrogen 2.786 N/A GLY 75.A N LEU 9.A O no hydrogen 2.972 N/A SER 80.A OG SER 78.A OG no hydrogen 3.135 N/A ASP 81.A N SER 78.A OG no hydrogen 2.905 N/A SER 83.A N SER 80.A O no hydrogen 2.913 N/A SER 83.A OG SER 80.A O no hydrogen 3.209 N/A ILE 84.A N ASP 81.A O no hydrogen 2.953 N/A LYS 86.A N.A ALA 82.A O no hydrogen 2.898 N/A LYS 86.A N.B ALA 82.A O no hydrogen 2.916 N/A ALA 87.A N SER 83.A O no hydrogen 2.969 N/A LEU 88.A N ILE 84.A O no hydrogen 2.919 N/A SER 89.A N.A VAL 85.A O no hydrogen 2.865 N/A SER 89.A N.B VAL 85.A O no hydrogen 2.888 N/A SER 89.A OG.B LYS 86.A O.A no hydrogen 2.952 N/A SER 89.A OG.B LYS 86.A O.B no hydrogen 2.993 N/A ARG 90.A N LYS 86.A O.A no hydrogen 3.010 N/A ARG 90.A N LYS 86.A O.B no hydrogen 3.009 N/A ARG 90.A NH1 GLU 63.A OE2 no hydrogen 3.339 N/A ILE 92.A N LEU 88.A O no hydrogen 2.900 N/A ARG 93.A NH1.A ASN 137.A O no hydrogen 3.342 N/A ARG 93.A NH1.A ASN 137.A OD1 no hydrogen 3.333 N/A ARG 93.A NH2.A ASN 137.A O no hydrogen 2.703 N/A ARG 94.A NE GLU 188.A OE1 no hydrogen 3.256 N/A ARG 94.A NH1 ASN 139.A O no hydrogen 2.919 N/A ARG 94.A NH1 THR 141.A OG1 no hydrogen 2.895 N/A ARG 94.A NH2 THR 141.A OG1 no hydrogen 2.878 N/A VAL 95.A N ASN 139.A O no hydrogen 3.114 N/A ILE 96.A N VAL 72.A O no hydrogen 2.878 N/A GLY 97.A N THR 141.A O no hydrogen 2.923 N/A VAL 98.A N VAL 74.A O no hydrogen 3.031 N/A SER 99.A N LEU 143.A O no hydrogen 2.875 N/A SER 99.A OG GLU 126.A OE1 no hydrogen 3.248 N/A GLY 101.A N GLU 105.A OE2 no hydrogen 3.034 N/A SER 103.A N GLU 105.A OE1 no hydrogen 2.822 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.766 N/A GLU 111.A N PRO 107.A O no hydrogen 2.864 N/A LYS 112.A N VAL 108.A O no hydrogen 2.943 N/A LYS 112.A NZ ASP 116.A OD2 no hydrogen 3.072 N/A TRP 113.A N ALA 109.A O no hydrogen 2.941 N/A THR 114.A N LEU 110.A O no hydrogen 2.912 N/A THR 114.A OG1 LEU 110.A O no hydrogen 2.828 N/A PHE 115.A N GLU 111.A O no hydrogen 3.053 N/A ASP 116.A N LYS 112.A O no hydrogen 2.875 N/A ASN 117.A N THR 114.A O no hydrogen 3.077 N/A ASN 117.A ND2 TRP 113.A O no hydrogen 2.871 N/A TYR 122.A N PRO 119.A O no hydrogen 3.006 N/A VAL 123.A N PRO 119.A O no hydrogen 3.222 N/A GLN 124.A N ILE 120.A O no hydrogen 2.855 N/A GLY 125.A N SER 121.A O no hydrogen 2.974 N/A GLU 126.A N TYR 122.A O no hydrogen 2.961 N/A ARG 127.A N VAL 123.A O no hydrogen 2.899 N/A GLN 128.A N GLN 124.A O no hydrogen 2.949 N/A ALA 129.A N GLY 125.A O no hydrogen 2.934 N/A ARG 130.A N GLU 126.A O no hydrogen 2.987 N/A ARG 130.A NE ASN 131.A OD1 no hydrogen 2.980 N/A ARG 130.A NH1 LEU 102.A O no hydrogen 3.022 N/A ARG 130.A NH2 ASN 131.A OD1 no hydrogen 2.897 N/A ASN 131.A N ARG 127.A O no hydrogen 2.939 N/A VAL 132.A N GLN 128.A O no hydrogen 2.944 N/A LEU 133.A N ALA 129.A O no hydrogen 3.047 N/A ARG 134.A N ARG 130.A O no hydrogen 2.902 N/A GLU 135.A N ASN 131.A O no hydrogen 2.996 N/A SER 136.A N LEU 133.A O no hydrogen 3.107 N/A SER 136.A OG LEU 133.A O no hydrogen 2.732 N/A LEU 138.A N SER 136.A OG no hydrogen 3.026 N/A ASN 139.A N ARG 93.A O.A no hydrogen 2.766 N/A ASN 139.A N ARG 93.A O.B no hydrogen 2.758 N/A THR 141.A N VAL 95.A O no hydrogen 2.850 N/A THR 141.A OG1 PHE 191.A O no hydrogen 2.645 N/A ILE 142.A N THR 194.A O no hydrogen 2.927 N/A LEU 143.A N GLY 97.A O no hydrogen 2.821 N/A ARG 144.A N ILE 196.A O no hydrogen 2.846 N/A ARG 144.A NE SER 195.A OG no hydrogen 2.887 N/A ARG 144.A NH1 GLU 105.A OE2 no hydrogen 2.987 N/A ARG 144.A NH2 SER 195.A O no hydrogen 2.881 N/A LEU 145.A N SER 99.A O no hydrogen 3.004 N/A THR 146.A OG1 ASP 167.A O no hydrogen 2.865 N/A TRP 147.A N THR 146.A OG1 no hydrogen 2.788 N/A TRP 147.A NE1 THR 114.A OG1 no hydrogen 2.963 N/A TYR 149.A N VAL 170.A O no hydrogen 3.330 N/A TYR 149.A OH GLU 200.A OE1 no hydrogen 2.514 N/A ASN 150.A ND2 GLN 14.A OE1 no hydrogen 2.914 N/A ASP 151.A N GLU 173.A OE1 no hydrogen 2.896 N/A GLU 153.A N ASP 151.A OD1 no hydrogen 2.940 N/A TYR 156.A OH ASP 181.A OD2 no hydrogen 2.596 N/A GLU 157.A N GLY 199.A O no hydrogen 2.865 N/A ILE 159.A N GLY 197.A O no hydrogen 2.830 N/A ALA 163.A N PRO 160.A O no hydrogen 3.090 N/A PHE 165.A N GLU 105.A O no hydrogen 2.885 N/A ALA 168.A N THR 203.A O no hydrogen 2.857 N/A GLN 169.A NE2 GLU 200.A OE1 no hydrogen 3.236 N/A VAL 170.A N TRP 147.A O no hydrogen 2.971 N/A ARG 172.A N TYR 149.A O no hydrogen 2.816 N/A ARG 172.A NH1 ASN 150.A OD1 no hydrogen 2.933 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 2.821 N/A ALA 174.A N SER 171.A OG no hydrogen 2.886 N/A VAL 175.A N SER 171.A O no hydrogen 3.066 N/A VAL 176.A N ARG 172.A O no hydrogen 2.942 N/A LYS 177.A N.A GLU 173.A O no hydrogen 3.061 N/A LYS 177.A N.B GLU 173.A O no hydrogen 3.060 N/A LYS 177.A NZ.B THR 154.A O no hydrogen 2.777 N/A ALA 178.A N ALA 174.A O no hydrogen 3.019 N/A ILE 179.A N VAL 175.A O no hydrogen 2.924 N/A PHE 180.A N VAL 176.A O no hydrogen 2.900 N/A ASP 181.A N LYS 177.A O.A no hydrogen 2.864 N/A ASP 181.A N LYS 177.A O.B no hydrogen 2.890 N/A ILE 182.A N ALA 178.A O no hydrogen 2.925 N/A LEU 183.A N ILE 179.A O no hydrogen 2.998 N/A HIS 184.A N ASP 181.A O no hydrogen 3.094 N/A HIS 184.A ND1 PHE 180.A O no hydrogen 2.765 N/A ALA 185.A N ILE 182.A O no hydrogen 3.216 N/A THR 189.A N.A ASP 187.A OD1 no hydrogen 3.011 N/A THR 189.A N.B ASP 187.A OD1 no hydrogen 3.000 N/A THR 189.A OG1.A ASP 187.A OD1 no hydrogen 2.789 N/A THR 189.A OG1.B ASP 187.A OD1 no hydrogen 2.845 N/A PHE 191.A N GLU 188.A O no hydrogen 2.865 N/A HIS 192.A N THR 189.A O.A no hydrogen 3.139 N/A HIS 192.A N THR 189.A O.B no hydrogen 3.096 N/A ARG 193.A NH1 SER 136.A O no hydrogen 2.813 N/A ARG 193.A NH1 LEU 138.A O no hydrogen 2.790 N/A ARG 193.A NH2 SER 136.A O no hydrogen 3.232 N/A THR 194.A N TYR 140.A O no hydrogen 3.294 N/A THR 194.A OG1 PRO 190.A O no hydrogen 2.890 N/A SER 195.A N GLU 161.A OE2 no hydrogen 2.932 N/A ILE 196.A N ILE 142.A O no hydrogen 2.803 N/A GLY 197.A N ILE 159.A O no hydrogen 2.835 N/A VAL 198.A N ARG 144.A O no hydrogen 3.030 N/A GLY 199.A N GLU 157.A O no hydrogen 3.088 N/A GLU 200.A N GLN 169.A O no hydrogen 2.983 N/A THR 203.A OG1 GLU 200.A O no hydrogen 2.751 N/A TYR 205.A N THR 203.A O no hydrogen 2.799 N/A SER 208.A N GLN 169.A OE1 no hydrogen 2.806 N/A SER 208.A OG GLN 169.A OE1 no hydrogen 3.250 N/A