Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6xke_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N HIS 4.A ND1 no hydrogen 2.901 N/A ALA 1.A N VAL 45.A O no hydrogen 2.804 N/A ALA 1.A N GLY 46.A O no hydrogen 3.170 N/A ALA 1.A N TYR 48.A O no hydrogen 2.823 N/A ASN 3.A ND2 PRO 50.A O no hydrogen 3.059 N/A HIS 4.A NE2 THR 52.A O no hydrogen 2.634 N/A ILE 5.A N ALA 1.A O no hydrogen 3.132 N/A ARG 6.A N ASN 2.A O no hydrogen 3.017 N/A THR 7.A N ASN 3.A O no hydrogen 3.138 N/A THR 7.A OG1 ASN 3.A O no hydrogen 3.158 N/A VAL 8.A N HIS 4.A O no hydrogen 2.991 N/A LEU 9.A N ILE 5.A O no hydrogen 2.820 N/A LYS 10.A N ARG 6.A O no hydrogen 2.952 N/A LEU 11.A N THR 7.A O no hydrogen 3.130 N/A PHE 12.A N VAL 8.A O no hydrogen 2.947 N/A ARG 13.A N LEU 9.A O no hydrogen 2.932 N/A THR 14.A N LEU 11.A O no hydrogen 3.103 N/A THR 14.A OG1 LEU 11.A O no hydrogen 2.684 N/A ILE 15.A N PHE 12.A O no hydrogen 3.065 N/A ASP 16.A N TYR 67.A OH no hydrogen 2.827 N/A ASP 18.A N ASP 16.A OD1 no hydrogen 3.077 N/A SER 20.A N ASP 18.A OD1 no hydrogen 3.097 N/A SER 20.A OG ASP 18.A OD1 no hydrogen 2.635 N/A SER 20.A OG ASP 18.A OD2 no hydrogen 3.491 N/A LYS 21.A N ASP 18.A O no hydrogen 3.068 N/A LYS 21.A NZ LEU 17.A O no hydrogen 2.809 N/A LYS 21.A NZ GLU 70.A OE1 no hydrogen 2.796 N/A TYR 25.A OH GLU 70.A OE1 no hydrogen 2.590 N/A LEU 26.A N LYS 22.A O no hydrogen 2.994 N/A THR 27.A N SER 23.A O no hydrogen 2.902 N/A THR 27.A OG1 SER 23.A O no hydrogen 3.118 N/A ALA 28.A N PHE 24.A O no hydrogen 3.248 N/A ALA 29.A N TYR 25.A O no hydrogen 2.791 N/A LYS 30.A N LEU 26.A O no hydrogen 2.838 N/A LYS 30.A NZ ASP 19.A OD1 no hydrogen 3.095 N/A TYR 31.A N THR 27.A O no hydrogen 3.033 N/A GLY 32.A N ALA 28.A O no hydrogen 2.980 N/A ILE 33.A N ALA 29.A O no hydrogen 3.159 N/A GLN 34.A N LYS 30.A O no hydrogen 2.851 N/A GLN 34.A NE2 GLU 39.A OE2 no hydrogen 3.004 N/A THR 35.A N TYR 31.A O no hydrogen 2.899 N/A THR 35.A OG1 TYR 31.A O no hydrogen 2.765 N/A THR 35.A OG1 GLY 32.A O no hydrogen 3.416 N/A GLN 36.A N GLY 32.A O no hydrogen 2.865 N/A LEU 37.A N ILE 33.A O no hydrogen 2.976 N/A ARG 38.A N ILE 33.A O no hydrogen 2.974 N/A GLU 39.A N GLN 34.A O no hydrogen 2.930 N/A ILE 41.A N LEU 37.A O no hydrogen 3.002 N/A ILE 42.A N ARG 38.A O no hydrogen 2.908 N/A ARG 43.A N GLU 39.A O no hydrogen 3.010 N/A ILE 44.A N PRO 40.A O no hydrogen 3.137 N/A VAL 45.A N ILE 41.A O no hydrogen 2.881 N/A GLY 46.A N ILE 42.A O no hydrogen 2.876 N/A GLY 47.A N ILE 44.A O no hydrogen 3.070 N/A TYR 48.A N VAL 45.A O no hydrogen 3.132 N/A THR 52.A N LEU 49.A O no hydrogen 2.920 N/A THR 52.A OG1 LEU 49.A O no hydrogen 3.397 N/A LYS 53.A NZ SER 51.A O no hydrogen 3.019 N/A SER 55.A N LEU 114.A O no hydrogen 2.818 N/A CYS 58.A N SER 55.A OG no hydrogen 3.091 N/A CYS 58.A SG THR 110.A O no hydrogen 3.273 N/A VAL 59.A N SER 55.A O no hydrogen 3.248 N/A LYS 60.A N GLU 56.A O no hydrogen 2.770 N/A ASN 61.A N ALA 57.A O no hydrogen 2.912 N/A ASN 61.A ND2 GLU 65.A OE2 no hydrogen 3.226 N/A MET 62.A N CYS 58.A O no hydrogen 3.099 N/A ILE 63.A N VAL 59.A O no hydrogen 2.913 N/A SER 64.A N LYS 60.A O no hydrogen 2.992 N/A SER 64.A OG LYS 60.A O no hydrogen 3.253 N/A GLU 65.A N ASN 61.A O no hydrogen 3.035 N/A VAL 66.A N MET 62.A O no hydrogen 2.989 N/A TYR 67.A N ILE 63.A O no hydrogen 3.284 N/A TYR 67.A OH THR 14.A O no hydrogen 3.132 N/A GLU 68.A N SER 64.A O no hydrogen 3.370 N/A ILE 69.A N GLU 65.A O no hydrogen 2.831 N/A GLU 70.A N VAL 66.A O no hydrogen 2.822 N/A GLY 71.A N TYR 67.A O no hydrogen 2.926 N/A ASP 72.A N GLU 68.A O no hydrogen 3.079 N/A PHE 73.A N ILE 69.A O no hydrogen 3.034 N/A TYR 74.A N GLU 70.A O no hydrogen 2.802 N/A SER 75.A N GLY 71.A O no hydrogen 2.996 N/A SER 75.A OG ASP 72.A O no hydrogen 2.781 N/A LYS 76.A N ASP 72.A O no hydrogen 3.132 N/A LYS 76.A NZ ASP 72.A OD1 no hydrogen 3.133 N/A LYS 76.A NZ ASP 72.A OD2 no hydrogen 2.781 N/A PHE 77.A N PHE 73.A O no hydrogen 2.862 N/A SER 78.A N TYR 74.A O no hydrogen 2.956 N/A SER 78.A N SER 75.A O no hydrogen 3.276 N/A SER 78.A OG TYR 74.A O no hydrogen 2.766 N/A ALA 80.A N SER 75.A O no hydrogen 2.864 N/A CYS 81.A N SER 78.A O no hydrogen 3.049 N/A CYS 81.A SG GLU 82.A OE2 no hydrogen 3.843 N/A CYS 81.A SG HIS 84.A O no hydrogen 3.555 N/A TYR 87.A N PHE 77.A O no hydrogen 2.900 N/A SER 88.A N ALA 85.A O no hydrogen 2.932 N/A SER 88.A OG ALA 85.A O no hydrogen 2.893 N/A GLU 90.A N GLU 90.A OE1 no hydrogen 2.824 N/A CYS 91.A N SER 88.A OG no hydrogen 3.067 N/A CYS 91.A SG ALA 85.A O no hydrogen 3.109 N/A CYS 91.A SG SER 88.A OG no hydrogen 3.017 N/A LEU 92.A N SER 88.A O no hydrogen 2.986 N/A GLU 93.A N VAL 89.A O no hydrogen 2.811 N/A ASP 94.A N GLU 90.A O no hydrogen 2.722 N/A ALA 95.A N CYS 91.A O no hydrogen 3.046 N/A ALA 95.A N LEU 92.A O no hydrogen 3.148 N/A ARG 96.A N GLU 93.A O no hydrogen 3.295 N/A TYR 99.A N ALA 95.A O no hydrogen 3.177 N/A TYR 99.A OH ALA 29.A O no hydrogen 2.737 N/A LEU 100.A N ARG 96.A O no hydrogen 2.955 N/A THR 101.A N ASP 97.A O no hydrogen 2.938 N/A THR 101.A OG1 ASP 97.A O no hydrogen 3.082 N/A GLN 102.A N ASP 98.A O no hydrogen 2.901 N/A GLN 102.A NE2 ASP 72.A OD2 no hydrogen 3.372 N/A GLN 102.A NE2 ASP 98.A O no hydrogen 3.699 N/A GLN 102.A NE2 ASP 98.A OD2 no hydrogen 2.600 N/A LEU 103.A N TYR 99.A O no hydrogen 2.995 N/A VAL 104.A N LEU 100.A O no hydrogen 2.878 N/A GLU 105.A N THR 101.A O no hydrogen 3.042 N/A LEU 106.A N GLN 102.A O no hydrogen 2.973 N/A PHE 107.A N LEU 103.A O no hydrogen 2.866 N/A LYS 108.A N VAL 104.A O no hydrogen 3.024 N/A GLU 109.A N GLU 105.A O no hydrogen 3.061 N/A THR 110.A N LEU 106.A O no hydrogen 2.838 N/A THR 110.A OG1 LEU 106.A O no hydrogen 2.782 N/A LYS 111.A N PHE 107.A O no hydrogen 2.908 N/A LYS 112.A N GLU 109.A O no hydrogen 3.139 N/A LYS 112.A NZ GLU 109.A OE1 no hydrogen 3.437 N/A LYS 112.A NZ GLU 109.A OE2 no hydrogen 2.935 N/A CYS 113.A N THR 110.A O no hydrogen 2.967 N/A CYS 113.A SG THR 110.A O no hydrogen 3.413 N/A GLU 116.A N LYS 53.A O no hydrogen 3.042 N/A