Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ry9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A N THR 2.A OG1 no hydrogen 3.242 N/A SER 5.A OG THR 2.A OG1 no hydrogen 3.316 N/A ILE 6.A N THR 2.A O no hydrogen 3.165 N/A LEU 7.A N MET 3.A O no hydrogen 3.091 N/A GLU 8.A N ILE 4.A O no hydrogen 3.015 N/A ALA 9.A N SER 5.A O no hydrogen 2.903 N/A ILE 10.A N ILE 6.A O no hydrogen 2.881 N/A ALA 17.A N ASP 97.A OD1 no hydrogen 2.863 N/A GLY 18.A N ASP 97.A OD2 no hydrogen 2.713 N/A TYR 19.A N ASP 97.A OD2 no hydrogen 3.015 N/A TYR 19.A OH ASP 25.A OD1 no hydrogen 2.544 N/A THR 22.A N ASP 20.A OD1 no hydrogen 3.284 N/A THR 22.A OG1 ASP 20.A OD1 no hydrogen 2.718 N/A THR 22.A OG1 ASP 20.A OD2 no hydrogen 3.259 N/A THR 27.A OG1 GLN 107.A O no hydrogen 2.630 N/A ASN 28.A ND2 LEU 211.A O no hydrogen 2.678 N/A ARG 29.A N THR 26.A OG1 no hydrogen 3.095 N/A ARG 29.A NH1 ASP 20.A O no hydrogen 3.300 N/A ARG 29.A NH1 LEU 23.A O no hydrogen 3.027 N/A ARG 29.A NH1 PRO 24.A O no hydrogen 3.027 N/A ARG 29.A NH2 ASP 20.A O no hydrogen 2.981 N/A LEU 30.A N THR 26.A O no hydrogen 2.849 N/A LEU 31.A N THR 27.A O no hydrogen 2.959 N/A SER 32.A N ASN 28.A O no hydrogen 2.983 N/A SER 32.A OG ASN 28.A O no hydrogen 2.714 N/A SER 33.A N ARG 29.A O no hydrogen 2.824 N/A LEU 34.A N LEU 30.A O no hydrogen 2.799 N/A ASN 35.A N LEU 31.A O no hydrogen 2.817 N/A ASN 35.A ND2 GLU 214.A O no hydrogen 3.103 N/A ARG 36.A N SER 32.A O no hydrogen 2.841 N/A ARG 36.A NE ALA 17.A O no hydrogen 3.121 N/A LEU 37.A N SER 33.A O no hydrogen 2.871 N/A GLY 38.A N LEU 34.A O no hydrogen 2.777 N/A GLY 39.A N ASN 35.A O no hydrogen 2.808 N/A ARG 40.A N ARG 36.A O no hydrogen 3.021 N/A ARG 40.A NH1 TYR 16.A O no hydrogen 2.911 N/A GLN 41.A N LEU 37.A O no hydrogen 2.842 N/A GLN 41.A NE2 PHE 94.A O no hydrogen 3.655 N/A MET 42.A N GLY 38.A O no hydrogen 2.939 N/A ILE 43.A N GLY 39.A O no hydrogen 3.128 N/A SER 44.A N ARG 40.A O no hydrogen 3.226 N/A ALA 45.A N GLN 41.A O no hydrogen 2.731 N/A VAL 46.A N MET 42.A O no hydrogen 2.992 N/A LYS 47.A N ILE 43.A O no hydrogen 3.356 N/A TRP 48.A N SER 44.A O no hydrogen 2.850 N/A ALA 49.A N ALA 45.A O no hydrogen 2.762 N/A LYS 50.A N VAL 46.A O no hydrogen 3.006 N/A ALA 51.A N TRP 48.A O no hydrogen 2.982 N/A LEU 52.A N ALA 49.A O no hydrogen 3.029 N/A PHE 55.A N PRO 53.A O no hydrogen 2.801 N/A ARG 56.A N LEU 52.A O no hydrogen 2.959 N/A ASN 57.A N GLY 54.A O no hydrogen 2.830 N/A LEU 58.A N PHE 55.A O no hydrogen 3.257 N/A ASP 61.A N HIS 59.A ND1 no hydrogen 3.210 N/A ASP 62.A N HIS 59.A O no hydrogen 2.882 N/A GLN 63.A N HIS 59.A O no hydrogen 3.170 N/A GLN 63.A NE2 ARG 56.A O no hydrogen 3.090 N/A GLN 63.A NE2 LEU 58.A O no hydrogen 2.884 N/A MET 64.A N LEU 60.A O no hydrogen 3.028 N/A THR 65.A N ASP 61.A O no hydrogen 3.115 N/A THR 65.A OG1 ASP 61.A O no hydrogen 2.661 N/A LEU 66.A N ASP 62.A O no hydrogen 3.083 N/A LEU 67.A N GLN 63.A O no hydrogen 3.227 N/A GLN 68.A N MET 64.A O no hydrogen 2.937 N/A TYR 69.A N THR 65.A O no hydrogen 2.836 N/A SER 70.A N LEU 66.A O no hydrogen 2.901 N/A SER 70.A OG LEU 66.A O no hydrogen 2.739 N/A LEU 74.A N SER 70.A O no hydrogen 3.008 N/A MET 75.A N TRP 71.A O no hydrogen 3.203 N/A ALA 76.A N MET 72.A O no hydrogen 3.025 N/A PHE 77.A N SER 73.A O no hydrogen 3.012 N/A SER 78.A N LEU 74.A O no hydrogen 3.013 N/A SER 78.A OG LEU 74.A O no hydrogen 3.075 N/A SER 78.A OG TYR 134.A OH no hydrogen 3.206 N/A LEU 79.A N MET 75.A O no hydrogen 2.937 N/A GLY 80.A N ALA 76.A O no hydrogen 2.910 N/A TRP 81.A N PHE 77.A O no hydrogen 3.047 N/A ARG 82.A N SER 78.A O no hydrogen 2.925 N/A ARG 82.A NE TYR 93.A O no hydrogen 3.061 N/A ARG 82.A NH2 TYR 93.A O no hydrogen 3.541 N/A ARG 82.A NH2 PHE 94.A O no hydrogen 2.881 N/A SER 83.A N LEU 79.A O no hydrogen 2.937 N/A SER 83.A OG LEU 79.A O no hydrogen 2.933 N/A TYR 84.A N GLY 80.A O no hydrogen 3.075 N/A GLN 85.A N TRP 81.A O no hydrogen 2.895 N/A HIS 86.A N ARG 82.A O no hydrogen 2.937 N/A MET 91.A N GLY 89.A O no hydrogen 2.680 N/A LEU 92.A N PHE 100.A O no hydrogen 2.898 N/A TYR 93.A N SER 83.A OG no hydrogen 2.786 N/A ALA 95.A N LEU 98.A O no hydrogen 3.109 N/A LEU 98.A N ALA 95.A O no hydrogen 2.996 N/A PHE 100.A N LEU 92.A O no hydrogen 2.791 N/A ASN 101.A ND2 GLU 103.A OE1 no hydrogen 3.172 N/A ARG 104.A N ASN 101.A OD1 no hydrogen 3.167 N/A ARG 104.A NE ASP 25.A OD2 no hydrogen 2.754 N/A ARG 104.A NH1 ILE 99.A O no hydrogen 2.797 N/A ARG 104.A NH2 ASP 25.A OD1 no hydrogen 3.059 N/A ARG 104.A NH2 ASP 25.A OD2 no hydrogen 3.457 N/A MET 105.A N ASN 101.A O no hydrogen 2.986 N/A GLN 106.A N GLU 102.A O no hydrogen 2.992 N/A GLN 106.A NE2 GLU 102.A OE2 no hydrogen 3.397 N/A GLN 107.A N GLU 103.A O no hydrogen 2.885 N/A GLN 107.A NE2 ASP 25.A O no hydrogen 3.364 N/A SER 108.A N ARG 104.A O no hydrogen 2.993 N/A SER 108.A OG MET 105.A O no hydrogen 2.638 N/A SER 109.A N GLN 106.A O no hydrogen 3.264 N/A SER 109.A OG SER 108.A O no hydrogen 2.575 N/A MET 110.A N SER 108.A OG no hydrogen 3.077 N/A TYR 111.A OH GLU 102.A OE1 no hydrogen 2.855 N/A TYR 111.A OH GLU 102.A OE2 no hydrogen 3.016 N/A GLU 112.A N GLU 112.A OE2 no hydrogen 2.679 N/A CYS 114.A N MET 110.A O no hydrogen 3.000 N/A CYS 114.A SG MET 110.A O no hydrogen 3.486 N/A LYS 115.A N TYR 111.A O no hydrogen 3.049 N/A LYS 115.A NZ ASN 90.A OD1 no hydrogen 2.556 N/A LYS 115.A NZ GLU 102.A OE1 no hydrogen 2.887 N/A LYS 115.A NZ TYR 111.A OH no hydrogen 2.656 N/A GLY 116.A N GLU 112.A O no hydrogen 3.033 N/A MET 117.A N LEU 113.A O no hydrogen 3.015 N/A HIS 118.A N CYS 114.A O no hydrogen 2.881 N/A LYS 119.A N LYS 115.A O no hydrogen 3.068 N/A ILE 120.A N MET 117.A O no hydrogen 3.115 N/A SER 121.A OG.A HIS 118.A ND1 no hydrogen 3.168 N/A SER 121.A OG.A HIS 118.A O no hydrogen 2.634 N/A SER 121.A OG.B GLY 80.A O no hydrogen 2.904 N/A SER 121.A OG.B HIS 118.A O no hydrogen 3.536 N/A LEU 122.A N HIS 118.A O no hydrogen 3.151 N/A GLU 123.A N LYS 119.A O no hydrogen 2.995 N/A PHE 124.A N ILE 120.A O no hydrogen 2.952 N/A VAL 125.A N SER 121.A O no hydrogen 2.989 N/A ARG 126.A N LEU 122.A O no hydrogen 2.976 N/A ARG 126.A NE GLU 123.A OE2 no hydrogen 3.099 N/A ARG 126.A NH2 GLU 123.A OE1 no hydrogen 2.806 N/A LEU 127.A N GLU 123.A O no hydrogen 2.965 N/A GLN 128.A N VAL 125.A O no hydrogen 3.134 N/A GLN 128.A NE2 VAL 125.A O no hydrogen 2.800 N/A VAL 129.A N PHE 124.A O no hydrogen 3.202 N/A SER 130.A N GLU 133.A OE1 no hydrogen 2.929 N/A GLU 133.A N SER 130.A OG no hydrogen 3.049 N/A TYR 134.A N SER 130.A O no hydrogen 2.932 N/A TYR 134.A OH SER 78.A OG no hydrogen 3.206 N/A LEU 135.A N TYR 131.A O no hydrogen 2.940 N/A CYS 136.A N GLU 132.A O no hydrogen 3.157 N/A CYS 136.A SG GLU 132.A O no hydrogen 3.334 N/A MET 137.A N GLU 133.A O no hydrogen 2.814 N/A LYS 138.A N TYR 134.A O no hydrogen 2.899 N/A LYS 138.A NZ GLU 11.A OE1 no hydrogen 2.853 N/A VAL 139.A N LEU 135.A O no hydrogen 3.337 N/A LEU 140.A N CYS 136.A O no hydrogen 3.116 N/A LEU 141.A N MET 137.A O no hydrogen 3.018 N/A LEU 142.A N LYS 138.A O no hydrogen 3.274 N/A LEU 143.A N VAL 139.A O no hydrogen 3.186 N/A LEU 143.A N LEU 140.A O no hydrogen 3.075 N/A SER 144.A N LEU 141.A O no hydrogen 3.270 N/A SER 144.A OG LEU 140.A O no hydrogen 2.626 N/A VAL 146.A N LYS 236.A O no hydrogen 2.947 N/A LYS 148.A N MET 234.A O no hydrogen 2.737 N/A GLY 150.A N PRO 147.A O no hydrogen 2.980 N/A LEU 151.A N GLN 154.A OE1 no hydrogen 3.048 N/A LYS 152.A N ASP 62.A OD1 no hydrogen 2.865 N/A SER 153.A N ASP 62.A OD2 no hydrogen 2.706 N/A GLN 154.A NE2 ASP 158.A OD1 no hydrogen 3.496 N/A PHE 157.A N SER 153.A O no hydrogen 2.917 N/A ASP 158.A N GLN 154.A O no hydrogen 2.969 N/A GLU 159.A N ALA 155.A O no hydrogen 3.210 N/A ILE 160.A N ALA 156.A O no hydrogen 2.911 N/A ARG 161.A N PHE 157.A O no hydrogen 2.749 N/A ARG 161.A NE LEU 143.A O no hydrogen 2.918 N/A ARG 161.A NH2 SER 144.A OG no hydrogen 3.071 N/A MET 162.A N ASP 158.A O no hydrogen 2.972 N/A SER 163.A N GLU 159.A O no hydrogen 3.017 N/A SER 163.A OG.A ILE 160.A O no hydrogen 2.744 N/A SER 163.A OG.B GLU 159.A O no hydrogen 2.774 N/A TYR 164.A N ILE 160.A O no hydrogen 3.158 N/A TYR 164.A OH PRO 53.A O no hydrogen 2.725 N/A ILE 165.A N ARG 161.A O no hydrogen 2.985 N/A LYS 166.A N MET 162.A O no hydrogen 2.850 N/A GLU 167.A N SER 163.A O no hydrogen 2.822 N/A LEU 168.A N TYR 164.A O no hydrogen 2.898 N/A GLY 169.A N ILE 165.A O no hydrogen 3.042 N/A LYS 170.A N LYS 166.A O no hydrogen 2.951 N/A LYS 170.A NZ GLU 167.A OE1 no hydrogen 2.623 N/A ALA 171.A N GLU 167.A O no hydrogen 3.024 N/A ILE 172.A N LEU 168.A O no hydrogen 2.914 N/A VAL 173.A N GLY 169.A O no hydrogen 2.941 N/A LYS 174.A N LYS 170.A O no hydrogen 2.998 N/A LYS 174.A NZ GLU 132.A OE1 no hydrogen 3.140 N/A LYS 174.A NZ GLU 132.A OE2 no hydrogen 2.854 N/A ARG 175.A NH1 GLN 128.A O no hydrogen 3.294 N/A ARG 179.A NE GLU 133.A OE1 no hydrogen 3.456 N/A ARG 179.A NE GLU 133.A OE2 no hydrogen 2.740 N/A ARG 179.A NH1 LEU 127.A O no hydrogen 2.730 N/A ARG 179.A NH2 LEU 127.A O no hydrogen 2.778 N/A ARG 179.A NH2 GLU 133.A OE1 no hydrogen 2.898 N/A PHE 180.A N ASN 176.A O no hydrogen 3.060 N/A TYR 181.A N TRP 177.A O no hydrogen 2.909 N/A GLN 182.A N GLN 178.A O no hydrogen 2.988 N/A GLN 182.A NE2 GLN 178.A O no hydrogen 3.328 N/A LEU 183.A N ARG 179.A O no hydrogen 2.807 N/A THR 184.A N PHE 180.A O no hydrogen 3.005 N/A THR 184.A OG1 PHE 180.A O no hydrogen 2.817 N/A THR 184.A OG1 TYR 181.A O no hydrogen 3.078 N/A THR 184.A OG1 HIS 241.A NE2 no hydrogen 2.886 N/A LYS 185.A N TYR 181.A O no hydrogen 3.047 N/A LEU 186.A N GLN 182.A O no hydrogen 3.094 N/A LEU 187.A N LEU 183.A O no hydrogen 3.037 N/A ASP 188.A N THR 184.A O no hydrogen 2.956 N/A SER 189.A N LYS 185.A O no hydrogen 3.053 N/A SER 189.A OG LEU 186.A O no hydrogen 2.651 N/A MET 190.A N LEU 187.A O no hydrogen 3.187 N/A HIS 191.A N ASP 188.A O no hydrogen 3.245 N/A VAL 194.A N MET 190.A O no hydrogen 2.750 N/A GLY 195.A N HIS 191.A O no hydrogen 2.962 N/A GLY 196.A N ASP 192.A O no hydrogen 3.256 N/A LEU 197.A N LEU 193.A O no hydrogen 2.987 N/A LEU 198.A N VAL 194.A O no hydrogen 2.869 N/A GLN 199.A N GLY 195.A O no hydrogen 3.055 N/A PHE 200.A N GLY 196.A O no hydrogen 3.350 N/A CYS 201.A N LEU 197.A O no hydrogen 2.900 N/A PHE 202.A N LEU 198.A O no hydrogen 2.944 N/A TYR 203.A N GLN 199.A O no hydrogen 3.168 N/A THR 204.A N PHE 200.A O no hydrogen 2.909 N/A THR 204.A OG1 PHE 200.A O no hydrogen 3.491 N/A THR 204.A OG1 CYS 201.A O no hydrogen 2.930 N/A PHE 205.A N CYS 201.A O no hydrogen 2.916 N/A VAL 206.A N PHE 202.A O no hydrogen 3.034 N/A VAL 206.A N TYR 203.A O no hydrogen 3.239 N/A GLU 207.A N TYR 203.A O no hydrogen 2.813 N/A SER 208.A OG VAL 213.A O no hydrogen 3.543 N/A LYS 209.A NZ SER 208.A OG no hydrogen 3.260 N/A LEU 211.A N GLU 207.A O no hydrogen 2.842 N/A SER 212.A OG LYS 209.A O no hydrogen 2.914 N/A VAL 213.A N SER 208.A O no hydrogen 2.938 N/A GLU 214.A N SER 32.A OG no hydrogen 2.886 N/A VAL 220.A N PRO 216.A O no hydrogen 2.963 N/A GLU 221.A N GLU 217.A O no hydrogen 2.918 N/A ILE 222.A N MET 218.A O no hydrogen 3.327 N/A ILE 223.A N LEU 219.A O no hydrogen 2.811 N/A SER 224.A N VAL 220.A O no hydrogen 2.942 N/A SER 224.A OG VAL 220.A O no hydrogen 2.945 N/A SER 224.A OG GLU 221.A O no hydrogen 3.178 N/A ASN 225.A N ILE 222.A O no hydrogen 3.174 N/A GLN 226.A N ILE 222.A O no hydrogen 2.760 N/A GLN 226.A NE2 GLN 68.A OE1 no hydrogen 2.992 N/A LEU 227.A N ILE 223.A O no hydrogen 2.728 N/A LYS 229.A N ASN 225.A O no hydrogen 3.474 N/A LYS 229.A NZ GLN 68.A OE1 no hydrogen 3.048 N/A VAL 230.A N GLN 226.A O no hydrogen 2.844 N/A MET 231.A N LEU 227.A O no hydrogen 3.019 N/A ALA 232.A N PRO 228.A O no hydrogen 2.858 N/A GLY 233.A N VAL 230.A O no hydrogen 3.039 N/A MET 234.A N LYS 229.A O no hydrogen 2.796 N/A LYS 236.A N VAL 146.A O no hydrogen 2.770 N/A LEU 238.A N SER 144.A O no hydrogen 2.807 N/A PHE 240.A N ASP 188.A OD1 no hydrogen 2.822 N/A HIS 241.A N ASP 188.A OD2 no hydrogen 2.691 N/A HIS 241.A NE2 TYR 181.A O no hydrogen 3.127 N/A HIS 241.A NE2 THR 184.A OG1 no hydrogen 2.886 N/A