Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k1r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N GLN 51.A O no hydrogen 2.756 N/A THR 8.A N LYS 12.A O no hydrogen 2.797 N/A GLY 10.A N ASP 141.A O no hydrogen 3.091 N/A GLY 11.A N THR 8.A O no hydrogen 2.977 N/A LYS 12.A N THR 8.A OG1 no hydrogen 2.944 N/A LEU 14.A N ALA 6.A O no hydrogen 2.890 N/A ARG 15.A N GLU 121.A OE2 no hydrogen 2.853 N/A ARG 15.A NE GLU 121.A OE2 no hydrogen 2.789 N/A ARG 15.A NH2 GLU 121.A OE1 no hydrogen 3.081 N/A ARG 15.A NH2 GLU 121.A OE2 no hydrogen 3.439 N/A THR 16.A OG1 GLY 172.A O no hydrogen 3.551 N/A ILE 17.A N HIS 173.A O no hydrogen 2.754 N/A TYR 18.A N PHE 54.A O no hydrogen 2.818 N/A LEU 19.A N ARG 175.A O no hydrogen 2.928 N/A LYS 21.A N ILE 177.A O no hydrogen 2.882 N/A LEU 23.A N PRO 20.A O no hydrogen 2.972 N/A LYS 24.A NZ GLU 176.A OE2 no hydrogen 2.872 N/A LYS 25.A NZ ASP 29.A OD2 no hydrogen 2.651 N/A VAL 26.A N LEU 22.A O no hydrogen 2.944 N/A PHE 27.A N LEU 23.A O no hydrogen 2.861 N/A LEU 28.A N LYS 24.A O no hydrogen 3.145 N/A ASP 29.A N LYS 25.A O no hydrogen 2.931 N/A VAL 30.A N VAL 26.A O no hydrogen 2.873 N/A VAL 31.A N PHE 27.A O no hydrogen 3.049 N/A LYS 32.A N ASP 29.A O no hydrogen 3.373 N/A ASN 34.A ND2 THR 41.A OG1 no hydrogen 2.957 N/A THR 35.A N VAL 31.A O no hydrogen 3.102 N/A THR 35.A OG1 VAL 31.A O no hydrogen 3.356 N/A LYS 36.A N LYS 32.A O no hydrogen 2.858 N/A LYS 37.A N PRO 33.A O no hydrogen 3.327 N/A LYS 37.A N ASN 34.A O no hydrogen 2.951 N/A ASN 38.A N THR 35.A O no hydrogen 2.934 N/A LEU 39.A N ASN 34.A O no hydrogen 2.883 N/A GLU 40.A N THR 67.A O no hydrogen 3.047 N/A THR 41.A N THR 96.A OG1 no hydrogen 3.001 N/A CYS 42.A N GLN 64.A OE1 no hydrogen 2.888 N/A CYS 42.A SG GLN 64.A OE1 no hydrogen 3.494 N/A GLY 43.A N ILE 94.A O no hydrogen 2.819 N/A ILE 44.A N VAL 60.A O no hydrogen 2.702 N/A LEU 45.A N GLY 92.A O no hydrogen 2.871 N/A CYS 46.A N HIS 58.A O no hydrogen 2.920 N/A GLY 47.A N LEU 89.A O no hydrogen 2.918 N/A LYS 48.A N PHE 55.A O no hydrogen 3.048 N/A LYS 48.A NZ ASN 87.A O no hydrogen 2.897 N/A ARG 50.A N ALA 53.A O no hydrogen 2.860 N/A ARG 50.A NH1 LEU 49.A O no hydrogen 2.917 N/A ASN 52.A ND2 PHE 2.A O no hydrogen 3.050 N/A ALA 53.A N ARG 50.A O no hydrogen 3.204 N/A PHE 54.A N THR 16.A O no hydrogen 2.787 N/A PHE 55.A N LYS 48.A O no hydrogen 2.854 N/A ILE 56.A N TYR 18.A O no hydrogen 2.935 N/A THR 57.A N CYS 46.A O no hydrogen 2.908 N/A THR 57.A OG1 HIS 58.A ND1 no hydrogen 2.813 N/A HIS 58.A N CYS 46.A O no hydrogen 3.042 N/A HIS 58.A ND1 THR 57.A OG1 no hydrogen 2.813 N/A LEU 59.A N GLN 182.A O no hydrogen 2.841 N/A VAL 60.A N ILE 44.A O no hydrogen 2.944 N/A ILE 61.A N VAL 184.A O no hydrogen 2.838 N/A GLN 64.A NE2 CYS 42.A O no hydrogen 2.921 N/A GLN 64.A NE2 PRO 62.A O no hydrogen 2.924 N/A GLU 65.A N GLY 72.A O no hydrogen 2.953 N/A THR 67.A N THR 70.A O no hydrogen 2.925 N/A THR 67.A OG1 THR 70.A OG1 no hydrogen 2.744 N/A SER 68.A OG ASP 69.A OD1 no hydrogen 2.642 N/A ASP 69.A N THR 67.A OG1 no hydrogen 2.958 N/A THR 70.A N THR 67.A OG1 no hydrogen 2.983 N/A THR 70.A OG1 THR 67.A OG1 no hydrogen 2.744 N/A CYS 71.A SG GLU 40.A OE1 no hydrogen 3.672 N/A GLY 72.A N GLU 65.A O no hydrogen 2.948 N/A THR 73.A OG1 GLU 76.A OE2 no hydrogen 2.608 N/A THR 74.A N LEU 63.A O no hydrogen 3.060 N/A SER 78.A N ASP 75.A OD1 no hydrogen 2.994 N/A LEU 79.A N ASP 75.A O no hydrogen 3.467 N/A PHE 80.A N GLU 76.A O no hydrogen 2.769 N/A GLU 81.A N ALA 77.A O no hydrogen 2.914 N/A PHE 82.A N SER 78.A O no hydrogen 3.298 N/A GLN 83.A N LEU 79.A O no hydrogen 3.031 N/A GLN 83.A NE2 LEU 88.A O no hydrogen 3.185 N/A GLN 83.A NE2 THR 90.A OG1 no hydrogen 2.849 N/A ASP 84.A N PHE 80.A O no hydrogen 2.764 N/A LYS 85.A N GLU 81.A O no hydrogen 3.018 N/A HIS 86.A N PHE 82.A O no hydrogen 3.020 N/A HIS 86.A ND1 HIS 86.A O no hydrogen 2.564 N/A ASN 87.A N ASP 84.A O no hydrogen 3.300 N/A LEU 88.A N GLN 83.A O no hydrogen 2.964 N/A LEU 89.A N GLY 47.A O no hydrogen 2.856 N/A LEU 91.A N LEU 45.A O no hydrogen 2.761 N/A TRP 93.A N ILE 123.A O no hydrogen 3.013 N/A TRP 93.A NE1 HIS 112.A ND1 no hydrogen 2.982 N/A ILE 94.A N GLY 43.A O no hydrogen 2.923 N/A HIS 95.A N ILE 125.A O no hydrogen 3.070 N/A HIS 95.A NE2 HIS 97.A NE2 no hydrogen 3.152 N/A THR 96.A N THR 41.A O no hydrogen 3.091 N/A HIS 97.A N MET 127.A O no hydrogen 2.737 N/A HIS 97.A ND1 THR 101.A O no hydrogen 2.787 N/A THR 99.A N GLN 100.A OE1 no hydrogen 3.138 N/A GLN 100.A N GLN 100.A OE1 no hydrogen 2.729 N/A GLN 100.A NE2 GLU 40.A OE2 no hydrogen 3.480 N/A GLN 100.A NE2 SER 68.A O no hydrogen 3.187 N/A CYS 102.A SG VAL 126.A O no hydrogen 3.608 N/A MET 104.A N TYR 165.A OH no hydrogen 3.089 N/A SER 105.A N ASP 108.A OD2 no hydrogen 3.001 N/A SER 106.A OG HIS 158.A O no hydrogen 3.036 N/A ASP 108.A N SER 105.A OG no hydrogen 3.103 N/A LEU 109.A N SER 105.A O no hydrogen 2.919 N/A HIS 110.A N SER 106.A O no hydrogen 3.041 N/A THR 111.A N VAL 107.A O no hydrogen 2.915 N/A THR 111.A OG1 VAL 107.A O no hydrogen 3.211 N/A HIS 112.A N ASP 108.A O no hydrogen 2.827 N/A HIS 112.A NE2 ALA 122.A O no hydrogen 2.890 N/A CYS 113.A N LEU 109.A O no hydrogen 3.012 N/A CYS 113.A SG LEU 145.A O no hydrogen 3.812 N/A SER 114.A N THR 111.A O no hydrogen 3.239 N/A GLN 116.A N HIS 112.A O no hydrogen 2.854 N/A GLN 116.A NE2 LEU 139.A O no hydrogen 2.949 N/A LEU 117.A N CYS 113.A O no hydrogen 2.844 N/A MET 118.A N SER 114.A O no hydrogen 3.226 N/A MET 118.A N TYR 115.A O no hydrogen 3.175 N/A LEU 119.A N TYR 115.A O no hydrogen 2.956 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.779 N/A ALA 122.A N LEU 119.A O no hydrogen 2.882 N/A ILE 123.A N LEU 91.A O no hydrogen 3.302 N/A ALA 124.A N PHE 137.A O no hydrogen 2.883 N/A ILE 125.A N TRP 93.A O no hydrogen 2.825 N/A VAL 126.A N GLY 135.A O no hydrogen 2.882 N/A MET 127.A N HIS 95.A O no hydrogen 2.983 N/A ALA 128.A N THR 133.A O no hydrogen 2.880 N/A SER 130.A OG PRO 98.A O no hydrogen 3.343 N/A LYS 131.A N ALA 128.A O no hydrogen 2.974 N/A ASN 132.A N PRO 129.A O no hydrogen 3.149 N/A THR 133.A N ALA 128.A O no hydrogen 3.295 N/A GLY 135.A N VAL 126.A O no hydrogen 3.000 N/A PHE 137.A N ALA 124.A O no hydrogen 2.800 N/A ARG 138.A N THR 166.A O no hydrogen 2.967 N/A ARG 138.A NH1 GLU 9.A OE1 no hydrogen 2.797 N/A ARG 138.A NH1 GLU 9.A OE2 no hydrogen 3.350 N/A ARG 138.A NH1 LEU 139.A O no hydrogen 2.932 N/A ARG 138.A NH2 GLU 9.A OE1 no hydrogen 3.430 N/A ARG 138.A NH2 GLU 9.A OE2 no hydrogen 2.742 N/A LEU 139.A N GLN 116.A OE1 no hydrogen 2.752 N/A LEU 140.A N VAL 164.A O no hydrogen 2.888 N/A ASP 141.A N GLU 9.A OE1 no hydrogen 2.876 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.677 N/A LEU 145.A N LEU 140.A O no hydrogen 3.062 N/A GLN 146.A N PRO 142.A O no hydrogen 2.960 N/A THR 147.A N GLU 143.A O no hydrogen 3.091 N/A THR 147.A OG1 GLU 143.A O no hydrogen 3.145 N/A ILE 148.A N GLY 144.A O no hydrogen 3.071 N/A VAL 149.A N LEU 145.A O no hydrogen 2.881 N/A LYS 150.A N GLN 146.A O no hydrogen 3.046 N/A CYS 151.A N ILE 148.A O no hydrogen 3.220 N/A CYS 151.A SG HIS 110.A NE2 no hydrogen 3.676 N/A CYS 151.A SG HIS 158.A NE2 no hydrogen 3.436 N/A CYS 151.A SG HIS 160.A NE2 no hydrogen 3.595 N/A ARG 152.A NH1 VAL 149.A O no hydrogen 2.918 N/A ARG 152.A NH1 CYS 151.A O no hydrogen 2.992 N/A LYS 153.A NZ PRO 159.A O no hydrogen 2.850 N/A HIS 158.A N SER 106.A OG no hydrogen 3.392 N/A HIS 158.A ND1 GLY 155.A O no hydrogen 2.937 N/A LYS 163.A NZ TYR 165.A O no hydrogen 2.424 N/A THR 166.A N ARG 138.A O no hydrogen 2.921 N/A THR 166.A OG1 MET 167.A O no hydrogen 3.022 N/A VAL 168.A N ILE 136.A O no hydrogen 2.849 N/A HIS 173.A N ALA 169.A O no hydrogen 2.960 N/A HIS 173.A NE2 GLU 121.A O no hydrogen 2.904 N/A VAL 174.A N ALA 169.A O no hydrogen 3.075 N/A ARG 175.A N ILE 17.A O no hydrogen 3.034 N/A ILE 177.A N LEU 19.A O no hydrogen 2.907 N/A GLN 182.A N THR 57.A O no hydrogen 2.995 N/A VAL 184.A N LEU 59.A O no hydrogen 2.800 N/A LEU 186.A N ILE 61.A O no hydrogen 2.855 N/A ARG 187.A N ASP 185.A OD1 no hydrogen 3.094 N/A ARG 187.A NE ASP 185.A OD1 no hydrogen 2.951 N/A ARG 187.A NE ASP 185.A OD2 no hydrogen 3.423 N/A ARG 187.A NH2 ASP 185.A OD2 no hydrogen 2.945 N/A