Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3p9t_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ ALA 36.A O no hydrogen 3.048 N/A GLN 5.A N GLU 2.A O no hydrogen 2.869 N/A ALA 6.A N ASP 3.A O no hydrogen 3.190 N/A GLY 10.A N THR 7.A OG1 no hydrogen 2.987 N/A ILE 11.A N THR 7.A O no hydrogen 2.994 N/A LEU 12.A N ARG 8.A O no hydrogen 2.889 N/A ASP 13.A N GLU 9.A O no hydrogen 2.814 N/A ALA 14.A N GLY 10.A O no hydrogen 3.051 N/A ALA 15.A N ILE 11.A O no hydrogen 2.905 N/A GLU 16.A N LEU 12.A O no hydrogen 2.944 N/A ALA 17.A N ASP 13.A O no hydrogen 3.336 N/A CYS 18.A N ALA 14.A O no hydrogen 3.064 N/A CYS 18.A SG ALA 14.A O no hydrogen 3.417 N/A CYS 18.A SG MET 31.A O no hydrogen 3.869 N/A PHE 19.A N ALA 15.A O no hydrogen 2.837 N/A HIS 20.A N GLU 16.A O no hydrogen 2.858 N/A HIS 20.A NE2 THR 104.A OG1 no hydrogen 3.052 N/A GLU 21.A N ALA 17.A O no hydrogen 2.979 N/A GLU 21.A N CYS 18.A O no hydrogen 3.020 N/A HIS 22.A N CYS 18.A O no hydrogen 2.738 N/A GLY 23.A N PHE 19.A O no hydrogen 2.822 N/A THR 27.A N VAL 24.A O no hydrogen 3.327 N/A THR 27.A OG1 GLY 23.A O no hydrogen 2.708 N/A THR 28.A OG1 GLU 30.A OE1 no hydrogen 3.492 N/A GLU 30.A N GLU 30.A OE1 no hydrogen 2.880 N/A MET 31.A N THR 28.A OG1 no hydrogen 2.896 N/A ILE 32.A N THR 28.A O no hydrogen 3.032 N/A GLY 33.A N LEU 29.A O no hydrogen 2.822 N/A ALA 34.A N GLU 30.A O no hydrogen 2.958 N/A ARG 35.A N MET 31.A O no hydrogen 2.858 N/A ARG 35.A NH1 GLU 21.A OE1 no hydrogen 3.364 N/A ALA 36.A N ILE 32.A O no hydrogen 3.103 N/A GLY 37.A N ALA 34.A O no hydrogen 3.000 N/A TYR 38.A N GLY 33.A O no hydrogen 2.957 N/A THR 39.A OG1 ASP 3.A OD1 no hydrogen 2.833 N/A ARG 40.A NH1 GLU 30.A OE2 no hydrogen 2.699 N/A ALA 42.A N THR 39.A O no hydrogen 3.049 N/A VAL 43.A N ARG 40.A O no hydrogen 2.797 N/A TYR 44.A N ARG 40.A O no hydrogen 3.175 N/A TRP 45.A N GLY 41.A O no hydrogen 3.097 N/A HIS 46.A N VAL 43.A O no hydrogen 2.890 N/A HIS 46.A NE2 ALA 6.A O no hydrogen 2.679 N/A PHE 47.A N VAL 43.A O no hydrogen 2.856 N/A LYS 48.A N GLU 52.A OE1 no hydrogen 2.693 N/A LYS 50.A NZ VAL 24.A O no hydrogen 2.985 N/A LYS 50.A NZ THR 27.A O no hydrogen 2.688 N/A SER 51.A OG ASN 49.A OD1 no hydrogen 3.405 N/A GLU 52.A N ASN 49.A OD1 no hydrogen 2.983 N/A VAL 53.A N ASN 49.A O no hydrogen 3.275 N/A LEU 54.A N LYS 50.A O no hydrogen 2.903 N/A ALA 55.A N SER 51.A O no hydrogen 2.899 N/A ALA 56.A N GLU 52.A O no hydrogen 3.127 N/A ALA 56.A N VAL 53.A O no hydrogen 3.132 N/A ILE 57.A N VAL 53.A O no hydrogen 2.991 N/A VAL 58.A N LEU 54.A O no hydrogen 2.964 N/A GLU 59.A N ALA 55.A O no hydrogen 2.821 N/A ARG 60.A N ALA 56.A O no hydrogen 3.176 N/A ARG 60.A NH1 GLU 9.A OE2 no hydrogen 2.886 N/A ARG 60.A NH1 ASP 13.A OD1 no hydrogen 2.964 N/A ARG 60.A NH2 ASP 13.A OD1 no hydrogen 2.928 N/A ARG 60.A NH2 GLU 16.A OE2 no hydrogen 3.085 N/A VAL 61.A N VAL 58.A O no hydrogen 3.020 N/A HIS 62.A N VAL 58.A O no hydrogen 2.866 N/A HIS 62.A NE2 ASP 130.A OD2 no hydrogen 2.989 N/A LEU 63.A N GLU 59.A O no hydrogen 2.820 N/A PHE 65.A N HIS 62.A O no hydrogen 3.260 N/A MET 66.A N HIS 62.A O no hydrogen 2.982 N/A GLN 67.A N LEU 63.A O no hydrogen 3.013 N/A GLU 68.A N PRO 64.A O no hydrogen 3.083 N/A LEU 69.A N PHE 65.A O no hydrogen 3.114 N/A GLU 70.A N MET 66.A O no hydrogen 2.805 N/A ARG 71.A N GLN 67.A O no hydrogen 3.128 N/A ARG 71.A NH1 GLU 68.A OE2 no hydrogen 3.109 N/A ARG 71.A NH2 PRO 212.A O no hydrogen 1.919 N/A THR 72.A N LEU 69.A O no hydrogen 3.294 N/A THR 72.A OG1 LEU 69.A O no hydrogen 2.819 N/A SER 73.A N GLU 70.A O no hydrogen 3.361 N/A SER 73.A OG GLU 70.A O no hydrogen 3.190 N/A THR 74.A N ARG 71.A O no hydrogen 3.116 N/A GLN 76.A N THR 74.A OG1 no hydrogen 2.986 N/A GLN 76.A NE2 ASP 75.A OD1 no hydrogen 3.002 N/A ARG 77.A N THR 74.A O no hydrogen 3.446 N/A ARG 77.A NE ASP 83.A OD2 no hydrogen 2.797 N/A ARG 77.A NH2 ASP 83.A OD1 no hydrogen 2.836 N/A ARG 77.A NH2 ASP 83.A OD2 no hydrogen 3.455 N/A THR 79.A OG1 ASP 83.A OD1 no hydrogen 3.089 N/A ASP 83.A N THR 79.A O no hydrogen 2.899 N/A LEU 84.A N PRO 80.A O no hydrogen 2.939 N/A ARG 85.A N VAL 81.A O no hydrogen 3.050 N/A ARG 85.A NE ASP 190.A OD1 no hydrogen 2.868 N/A ARG 85.A NH1 THR 206.A O no hydrogen 3.116 N/A ARG 85.A NH2 ASP 190.A OD1 no hydrogen 3.198 N/A ARG 85.A NH2 ASP 190.A OD2 no hydrogen 3.131 N/A ARG 85.A NH2 THR 206.A O no hydrogen 2.943 N/A ALA 86.A N HIS 82.A O no hydrogen 2.879 N/A VAL 87.A N ASP 83.A O no hydrogen 2.986 N/A MET 88.A N LEU 84.A O no hydrogen 2.995 N/A ILE 89.A N ARG 85.A O no hydrogen 2.883 N/A HIS 90.A N ALA 86.A O no hydrogen 3.289 N/A HIS 90.A NE2 PRO 208.A O no hydrogen 2.722 N/A SER 91.A N VAL 87.A O no hydrogen 2.890 N/A SER 91.A OG VAL 87.A O no hydrogen 2.865 N/A PHE 92.A N MET 88.A O no hydrogen 2.861 N/A ILE 93.A N ILE 89.A O no hydrogen 2.955 N/A GLU 94.A N HIS 90.A O no hydrogen 2.897 N/A LEU 95.A N SER 91.A O no hydrogen 2.847 N/A SER 96.A N PHE 92.A O no hydrogen 2.885 N/A GLU 97.A N ILE 93.A O no hydrogen 2.924 N/A GLU 97.A N GLU 94.A O no hydrogen 3.171 N/A ASP 98.A N GLU 94.A O no hydrogen 2.830 N/A LEU 101.A N ASP 98.A OD1 no hydrogen 3.206 N/A ARG 102.A N ASP 98.A O no hydrogen 2.849 N/A ARG 102.A NH1 LEU 95.A O no hydrogen 3.177 N/A LYS 103.A N GLU 99.A O no hydrogen 2.670 N/A THR 104.A N ARG 100.A O no hydrogen 3.047 N/A THR 104.A OG1 GLU 16.A OE1 no hydrogen 2.705 N/A THR 104.A OG1 HIS 20.A NE2 no hydrogen 3.052 N/A MET 105.A N.A LEU 101.A O no hydrogen 2.969 N/A MET 105.A N.B LEU 101.A O no hydrogen 2.972 N/A GLU 106.A N ARG 102.A O no hydrogen 2.824 N/A ILE 107.A N LYS 103.A O no hydrogen 2.955 N/A MET 108.A N THR 104.A O no hydrogen 3.255 N/A LEU 109.A N MET 105.A O.A no hydrogen 2.971 N/A LEU 109.A N MET 105.A O.B no hydrogen 2.916 N/A ARG 110.A N GLU 106.A O no hydrogen 3.001 N/A SER 111.A N ILE 107.A O no hydrogen 3.440 N/A SER 111.A OG THR 121.A OG1 no hydrogen 3.306 N/A THR 117.A N SER 114.A O no hydrogen 3.452 N/A ARG 118.A NH2 SER 114.A O no hydrogen 3.020 N/A VAL 119.A N THR 117.A OG1 no hydrogen 3.288 N/A LEU 120.A N ASP 112.A OD1 no hydrogen 2.790 N/A THR 121.A N ASP 112.A OD2 no hydrogen 3.049 N/A THR 121.A OG1 SER 111.A OG no hydrogen 3.306 N/A THR 121.A OG1 ASP 112.A OD2 no hydrogen 2.541 N/A GLU 122.A N ARG 118.A O no hydrogen 3.158 N/A GLN 124.A N LEU 120.A O no hydrogen 2.887 N/A GLN 125.A N THR 121.A O no hydrogen 2.815 N/A ALA 126.A N GLU 122.A O no hydrogen 3.085 N/A GLY 127.A N MET 123.A O no hydrogen 2.790 N/A PHE 128.A N GLN 124.A O no hydrogen 2.743 N/A ARG 129.A N GLN 125.A O no hydrogen 3.026 N/A ASP 130.A N ALA 126.A O no hydrogen 3.109 N/A ALA 131.A N GLY 127.A O no hydrogen 3.050 N/A LEU 132.A N PHE 128.A O no hydrogen 2.918 N/A ASP 133.A N ARG 129.A O no hydrogen 3.024 N/A ARG 134.A N ASP 130.A O no hydrogen 3.231 N/A ARG 134.A NH1 ASP 130.A O no hydrogen 2.783 N/A MET 135.A N ALA 131.A O no hydrogen 2.914 N/A GLU 136.A N LEU 132.A O no hydrogen 2.843 N/A ARG 137.A N ASP 133.A O no hydrogen 3.023 N/A ALA 138.A N ARG 134.A O no hydrogen 3.199 N/A LEU 139.A N MET 135.A O no hydrogen 3.060 N/A ARG 140.A N GLU 136.A O no hydrogen 2.808 N/A ARG 141.A N ARG 137.A O no hydrogen 2.982 N/A ARG 141.A NE ARG 77.A O no hydrogen 3.089 N/A ARG 141.A NH2 ARG 77.A O no hydrogen 2.708 N/A ALA 142.A N ALA 138.A O no hydrogen 2.997 N/A ARG 143.A N LEU 139.A O no hydrogen 3.212 N/A ASP 144.A N ARG 140.A O no hydrogen 3.337 N/A LEU 145.A N ARG 141.A O no hydrogen 3.322 N/A GLY 146.A N ARG 143.A O no hydrogen 2.758 N/A GLN 147.A N ALA 142.A O no hydrogen 2.850 N/A GLN 147.A NE2 ASP 78.A O no hydrogen 3.014 N/A ARG 149.A N TYR 196.A O no hydrogen 2.932 N/A ARG 149.A NH1 ALA 194.A O no hydrogen 2.596 N/A ARG 149.A NH2 ASP 199.A OD2 no hydrogen 2.904 N/A GLY 151.A N GLU 150.A OE1 no hydrogen 3.173 N/A ALA 152.A N ARG 149.A O no hydrogen 3.174 N/A LYS 155.A N ASP 153.A OD1 no hydrogen 3.258 N/A LYS 155.A NZ GLU 136.A OE1 no hydrogen 2.766 N/A LYS 155.A NZ GLU 136.A OE2 no hydrogen 3.360 N/A ALA 157.A N ASP 153.A O no hydrogen 2.952 N/A ALA 158.A N PRO 154.A O no hydrogen 2.979 N/A ARG 159.A N LYS 155.A O no hydrogen 3.057 N/A MET 160.A N ILE 156.A O no hydrogen 2.915 N/A LEU 161.A N ALA 157.A O no hydrogen 2.986 N/A HIS 162.A N ALA 158.A O no hydrogen 3.016 N/A ALA 163.A N ARG 159.A O no hydrogen 2.998 N/A THR 164.A N MET 160.A O no hydrogen 2.892 N/A THR 164.A OG1 MET 160.A O no hydrogen 3.355 N/A THR 164.A OG1 LEU 161.A O no hydrogen 3.400 N/A THR 164.A OG1 THR 192.A OG1 no hydrogen 2.908 N/A VAL 165.A N LEU 161.A O no hydrogen 2.953 N/A LEU 166.A N HIS 162.A O no hydrogen 2.746 N/A GLY 167.A N ALA 163.A O no hydrogen 3.006 N/A VAL 168.A N THR 164.A O no hydrogen 3.135 N/A LEU 169.A N VAL 165.A O no hydrogen 2.921 N/A HIS 170.A N LEU 166.A O no hydrogen 3.018 N/A GLY 171.A N GLY 167.A O no hydrogen 2.925 N/A ALA 172.A N VAL 168.A O no hydrogen 2.947 N/A MET 173.A N LEU 169.A O no hydrogen 3.147 N/A VAL 174.A N HIS 170.A O no hydrogen 2.975 N/A GLU 175.A N GLY 171.A O no hydrogen 2.851 N/A GLU 177.A N GLU 175.A OE2 no hydrogen 3.117 N/A LEU 178.A N GLU 175.A O no hydrogen 2.939 N/A MET 179.A N GLU 175.A O no hydrogen 2.956 N/A ASP 180.A N ASP 184.A OD2 no hydrogen 2.632 N/A LYS 182.A NZ GLU 97.A OE2 no hydrogen 3.153 N/A ARG 183.A N ASP 180.A OD2 no hydrogen 3.072 N/A ARG 183.A NE ASP 184.A OD1 no hydrogen 3.106 N/A ARG 183.A NH2 LEU 178.A O no hydrogen 3.569 N/A ARG 183.A NH2 ASP 184.A OD1 no hydrogen 3.517 N/A ARG 183.A NH2 ASP 184.A OD2 no hydrogen 2.787 N/A ASP 184.A N ASP 180.A O no hydrogen 2.747 N/A GLY 185.A N LEU 181.A O no hydrogen 2.819 N/A MET 186.A N LYS 182.A O no hydrogen 3.094 N/A LEU 187.A N ARG 183.A O no hydrogen 3.043 N/A ALA 188.A N ASP 184.A O no hydrogen 2.783 N/A LEU 189.A N GLY 185.A O no hydrogen 2.911 N/A ASP 190.A N MET 186.A O no hydrogen 2.989 N/A MET 191.A N LEU 187.A O no hydrogen 2.943 N/A THR 192.A N ALA 188.A O no hydrogen 2.944 N/A THR 192.A OG1 THR 164.A OG1 no hydrogen 2.908 N/A THR 192.A OG1 ALA 188.A O no hydrogen 2.759 N/A LEU 193.A N LEU 189.A O no hydrogen 2.886 N/A ALA 194.A N ASP 190.A O no hydrogen 2.887 N/A ALA 195.A N THR 192.A O no hydrogen 3.112 N/A TYR 196.A N LEU 193.A O no hydrogen 3.136 N/A VAL 197.A N LEU 193.A O no hydrogen 2.799 N/A LYS 198.A N GLN 147.A O no hydrogen 2.990 N/A LYS 198.A NZ LEU 148.A O no hydrogen 3.537 N/A VAL 201.A N LYS 198.A O no hydrogen 3.441 N/A GLY 205.A N ASP 190.A OD2 no hydrogen 2.806 N/A THR 206.A N VAL 203.A O no hydrogen 3.401 N/A THR 206.A OG1 VAL 203.A O no hydrogen 2.615 N/A