Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2xkg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N VAL 2.A O no hydrogen 2.945 N/A ALA 6.A N ASN 3.A OD1 no hydrogen 3.177 N/A VAL 7.A N ASN 3.A O no hydrogen 3.093 N/A VAL 8.A N TRP 4.A O no hydrogen 2.766 N/A ASP 9.A N ALA 5.A O no hydrogen 2.969 N/A ASP 10.A N ALA 6.A O no hydrogen 3.052 N/A PHE 11.A N VAL 7.A O no hydrogen 2.798 N/A TYR 12.A N VAL 8.A O no hydrogen 2.984 N/A TYR 12.A OH THR 49.A OG1 no hydrogen 2.616 N/A GLN 13.A N ASP 9.A O no hydrogen 3.041 N/A GLU 14.A N ASP 10.A O no hydrogen 2.886 N/A LEU 15.A N PHE 11.A O no hydrogen 2.804 N/A PHE 16.A N TYR 12.A O no hydrogen 2.916 N/A LYS 17.A N GLN 13.A O no hydrogen 2.998 N/A LYS 17.A NZ GLU 14.A OE1 no hydrogen 3.531 N/A ALA 18.A N GLU 14.A O no hydrogen 3.089 N/A HIS 19.A N LEU 15.A O no hydrogen 2.866 N/A GLU 21.A N GLU 21.A OE1 no hydrogen 2.750 N/A TYR 22.A N HIS 19.A O no hydrogen 2.990 N/A TYR 22.A OH ASN 82.A OD1 no hydrogen 2.882 N/A GLN 23.A N PRO 20.A O no hydrogen 3.048 N/A GLN 23.A NE2 PHE 28.A O no hydrogen 2.957 N/A GLN 23.A NE2 VAL 31.A O no hydrogen 2.891 N/A ASN 24.A N GLU 21.A O no hydrogen 3.087 N/A LYS 25.A N TYR 22.A O no hydrogen 3.185 N/A LYS 25.A NZ ARG 73.A O no hydrogen 2.960 N/A PHE 26.A N GLN 23.A O no hydrogen 3.060 N/A LYS 29.A N PHE 26.A O no hydrogen 3.084 N/A VAL 31.A N PHE 28.A O no hydrogen 3.180 N/A SER 35.A N ALA 32.A O no hydrogen 2.888 N/A SER 35.A OG.B ALA 32.A O no hydrogen 2.664 N/A LEU 36.A N LEU 33.A O no hydrogen 3.306 N/A GLY 38.A N SER 35.A O no hydrogen 2.905 N/A ASN 39.A N LEU 36.A O no hydrogen 2.939 N/A TYR 42.A N ASN 39.A OD1 no hydrogen 2.806 N/A TYR 42.A OH ASP 9.A OD1 no hydrogen 2.697 N/A LYS 43.A N ASN 39.A O no hydrogen 2.907 N/A THR 44.A N ALA 40.A O no hydrogen 3.132 N/A THR 44.A OG1 ALA 40.A O no hydrogen 3.567 N/A GLN 45.A N ALA 41.A O no hydrogen 3.045 N/A GLN 45.A NE2 TYR 12.A OH no hydrogen 3.329 N/A GLN 45.A NE2 THR 49.A OG1 no hydrogen 3.337 N/A ALA 46.A N TYR 42.A O no hydrogen 2.768 N/A GLY 47.A N LYS 43.A O no hydrogen 3.067 N/A LYS 48.A N THR 44.A O no hydrogen 3.086 N/A THR 49.A N GLN 45.A O no hydrogen 2.961 N/A THR 49.A OG1 TYR 12.A OH no hydrogen 2.616 N/A THR 49.A OG1 GLN 45.A O no hydrogen 3.180 N/A VAL 50.A N ALA 46.A O no hydrogen 2.900 N/A ASP 51.A N GLY 47.A O no hydrogen 2.861 N/A TYR 52.A N LYS 48.A O no hydrogen 2.886 N/A ILE 53.A N THR 49.A O no hydrogen 2.997 N/A ASN 54.A N VAL 50.A O no hydrogen 2.979 N/A ALA 55.A N ASP 51.A O no hydrogen 2.850 N/A ALA 56.A N TYR 52.A O no hydrogen 2.749 N/A ILE 57.A N ILE 53.A O no hydrogen 2.938 N/A GLY 58.A N ASN 54.A O no hydrogen 2.860 N/A GLY 59.A N ALA 55.A O no hydrogen 2.861 N/A SER 60.A N ALA 55.A O no hydrogen 2.930 N/A ALA 61.A N ALA 55.A O no hydrogen 3.222 N/A GLY 65.A N ASP 62.A OD1 no hydrogen 2.995 N/A LEU 66.A N ASP 62.A O no hydrogen 2.964 N/A ALA 67.A N ALA 63.A O no hydrogen 2.897 N/A SER 68.A N ALA 64.A O no hydrogen 2.909 N/A ARG 69.A N GLY 65.A O no hydrogen 3.026 N/A ARG 69.A NH1 GLY 65.A O no hydrogen 3.045 N/A HIS 70.A N LEU 66.A O no hydrogen 3.012 N/A HIS 70.A ND1 LEU 66.A O no hydrogen 2.838 N/A LYS 71.A N ALA 67.A O no hydrogen 2.887 N/A LYS 71.A NZ HIS 109.A O no hydrogen 3.096 N/A GLY 72.A N SER 68.A O no hydrogen 2.943 N/A ARG 73.A N HIS 70.A O no hydrogen 2.824 N/A ASN 74.A N LYS 71.A O no hydrogen 2.946 N/A VAL 75.A N HIS 70.A O no hydrogen 2.914 N/A GLY 76.A N GLU 79.A OE1 no hydrogen 2.928 N/A SER 77.A OG.A LEU 110.A O no hydrogen 2.817 N/A GLU 79.A N GLU 79.A OE1 no hydrogen 2.813 N/A PHE 80.A N GLY 76.A O no hydrogen 3.058 N/A HIS 81.A N SER 77.A O no hydrogen 2.861 N/A ASN 82.A N ALA 78.A O no hydrogen 3.051 N/A ALA 83.A N GLU 79.A O no hydrogen 2.778 N/A LYS 84.A N PHE 80.A O no hydrogen 2.869 N/A LYS 84.A NZ ASP 104.A OD1 no hydrogen 2.883 N/A LYS 84.A NZ ASP 104.A OD2 no hydrogen 3.484 N/A ALA 85.A N HIS 81.A O no hydrogen 3.296 N/A CYS 86.A N ASN 82.A O no hydrogen 3.082 N/A CYS 86.A SG ASN 82.A O no hydrogen 3.466 N/A ALA 87.A N ALA 83.A O no hydrogen 2.811 N/A ALA 88.A N LYS 84.A O no hydrogen 2.978 N/A LYS 89.A N ALA 85.A O no hydrogen 3.249 N/A ALA 90.A N CYS 86.A O no hydrogen 3.004 N/A CYS 91.A N ALA 87.A O no hydrogen 2.837 N/A CYS 91.A SG ALA 87.A O no hydrogen 3.279 N/A CYS 91.A SG PRO 97.A O no hydrogen 3.368 N/A SER 92.A N ALA 88.A O no hydrogen 3.011 N/A SER 92.A OG.B ALA 88.A O no hydrogen 3.145 N/A ALA 93.A N LYS 89.A O no hydrogen 3.002 N/A HIS 94.A N CYS 91.A O no hydrogen 3.038 N/A HIS 94.A NE2 ASP 10.A OD2 no hydrogen 2.456 N/A GLY 95.A N SER 92.A O no hydrogen 3.126 N/A ALA 96.A N CYS 91.A O no hydrogen 2.951 N/A GLY 100.A N ASP 98.A OD1.B no hydrogen 2.909 N/A GLY 100.A N ASP 98.A OD2.A no hydrogen 2.955 N/A ILE 103.A N LEU 99.A O no hydrogen 2.943 N/A ASP 104.A N GLY 100.A O no hydrogen 2.796 N/A ASP 105.A N HIS 101.A O no hydrogen 3.018 N/A ILE 106.A N ALA 102.A O no hydrogen 3.273 N/A LEU 107.A N ILE 103.A O no hydrogen 2.891 N/A SER 108.A N ASP 104.A O no hydrogen 2.906 N/A SER 108.A N ASP 105.A O no hydrogen 3.304 N/A SER 108.A OG ASP 105.A O no hydrogen 2.692 N/A HIS 109.A N ILE 106.A O no hydrogen 2.924 N/A LEU 110.A N LEU 107.A O no hydrogen 2.989 N/A