Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kwy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N ALA 1.A O no hydrogen 3.271 N/A LYS 5.A N ALA 1.A O no hydrogen 3.240 N/A LEU 6.A N ILE 2.A O no hydrogen 2.992 N/A ALA 7.A N GLU 3.A O no hydrogen 3.062 N/A ASN 8.A N VAL 4.A O no hydrogen 2.995 N/A MET 9.A N LYS 5.A O no hydrogen 2.901 N/A GLU 10.A N LEU 6.A O no hydrogen 2.991 N/A ALA 11.A N ALA 7.A O no hydrogen 3.163 N/A GLU 12.A N ASN 8.A O no hydrogen 2.825 N/A ILE 13.A N MET 9.A O no hydrogen 2.881 N/A ASN 14.A N GLU 10.A O no hydrogen 2.928 N/A THR 15.A N ALA 11.A O no hydrogen 2.952 N/A THR 15.A OG1 ALA 11.A O no hydrogen 2.699 N/A LEU 16.A N GLU 12.A O no hydrogen 2.921 N/A LYS 17.A N ILE 13.A O no hydrogen 2.824 N/A SER 18.A N ASN 14.A O no hydrogen 3.059 N/A SER 18.A OG ASN 14.A O no hydrogen 3.047 N/A LYS 19.A N THR 15.A O no hydrogen 2.967 N/A LEU 20.A N LEU 16.A O no hydrogen 2.880 N/A GLU 21.A N LYS 17.A O no hydrogen 3.021 N/A LEU 22.A N SER 18.A O no hydrogen 3.100 N/A THR 23.A N LYS 19.A O no hydrogen 2.884 N/A THR 23.A OG1 LYS 19.A O no hydrogen 3.038 N/A ASN 24.A N LEU 20.A O no hydrogen 2.974 N/A LYS 25.A N GLU 21.A O no hydrogen 3.004 N/A LEU 26.A N LEU 22.A O no hydrogen 2.900 N/A HIS 27.A N THR 23.A O no hydrogen 2.990 N/A ALA 28.A N ASN 24.A O no hydrogen 2.934 N/A PHE 29.A N LYS 25.A O no hydrogen 2.953 N/A SER 30.A N LEU 26.A O no hydrogen 2.885 N/A SER 30.A OG LEU 26.A O no hydrogen 3.320 N/A SER 30.A OG HIS 27.A O no hydrogen 2.607 N/A MET 31.A N HIS 27.A O no hydrogen 2.900 N/A MET 31.A N ALA 28.A O no hydrogen 3.063 N/A GLY 32.A N PHE 29.A O no hydrogen 3.034 N/A LYS 33.A N ALA 28.A O no hydrogen 2.911 N/A LYS 33.A NZ LYS 34.A O no hydrogen 3.476 N/A LYS 33.A NZ LYS 37.A O no hydrogen 2.755 N/A LYS 33.A NZ ALA 149.A OXT no hydrogen 2.715 N/A LYS 34.A NZ GLY 32.A O no hydrogen 2.851 N/A LYS 37.A N LYS 34.A O no hydrogen 2.897 N/A LYS 38.A NZ ILE 65.A O no hydrogen 2.763 N/A LYS 38.A NZ GLU 71.A OE2 no hydrogen 3.079 N/A LYS 38.A NZ GLU 146.A OE1 no hydrogen 3.312 N/A LYS 38.A NZ GLU 146.A OE2 no hydrogen 2.862 N/A PHE 39.A N PHE 147.A O no hydrogen 2.998 N/A VAL 41.A N CYS 145.A O no hydrogen 3.045 N/A THR 42.A OG1 ALA 143.A O no hydrogen 2.613 N/A ASN 43.A ND2 GLU 45.A OE1 no hydrogen 2.897 N/A HIS 44.A N THR 42.A OG1 no hydrogen 2.925 N/A GLU 45.A N ASN 43.A OD1 no hydrogen 2.924 N/A ARG 46.A NH1 SER 82.A O no hydrogen 3.043 N/A ARG 46.A NH1 SER 82.A OG no hydrogen 3.117 N/A ARG 46.A NH1 THR 142.A OG1 no hydrogen 3.296 N/A ARG 46.A NH2 SER 82.A OG no hydrogen 3.139 N/A ARG 46.A NH2 HIS 141.A ND1 no hydrogen 3.208 N/A MET 47.A N HIS 141.A O no hydrogen 2.967 N/A PHE 49.A N CYS 137.A O no hydrogen 3.025 N/A LYS 51.A N PRO 48.A O no hydrogen 3.105 N/A VAL 52.A N PRO 48.A O no hydrogen 3.206 N/A LYS 53.A N PHE 49.A O no hydrogen 2.940 N/A ALA 54.A N SER 50.A O no hydrogen 3.149 N/A LEU 55.A N LYS 51.A O no hydrogen 2.915 N/A CYS 56.A N VAL 52.A O no hydrogen 2.928 N/A CYS 56.A SG VAL 52.A O no hydrogen 3.483 N/A CYS 56.A SG VAL 144.A O no hydrogen 3.912 N/A SER 57.A N LYS 53.A O no hydrogen 2.846 N/A GLU 58.A N ALA 54.A O no hydrogen 2.910 N/A LEU 59.A N LEU 55.A O no hydrogen 3.198 N/A LEU 59.A N CYS 56.A O no hydrogen 3.012 N/A ARG 60.A N SER 57.A O no hydrogen 2.921 N/A GLY 61.A N CYS 56.A O no hydrogen 2.891 N/A THR 62.A N GLU 146.A O no hydrogen 3.093 N/A THR 62.A OG1 VAL 63.A O no hydrogen 3.202 N/A ALA 64.A N VAL 144.A O no hydrogen 2.923 N/A ILE 65.A N GLU 146.A OE2 no hydrogen 2.821 N/A ARG 67.A N GLU 71.A OE2 no hydrogen 2.790 N/A GLU 71.A N ASN 68.A OD1 no hydrogen 2.896 N/A ASN 72.A N ASN 68.A O no hydrogen 3.010 N/A ASN 72.A ND2 GLY 130.A O no hydrogen 2.774 N/A LYS 73.A N ALA 69.A O no hydrogen 2.963 N/A ALA 74.A N GLU 70.A O no hydrogen 2.957 N/A ILE 75.A N GLU 71.A O no hydrogen 2.858 N/A GLN 76.A N ASN 72.A O no hydrogen 2.934 N/A GLU 77.A N LYS 73.A O no hydrogen 2.898 N/A VAL 78.A N ALA 74.A O no hydrogen 3.078 N/A ALA 79.A N ILE 75.A O no hydrogen 2.874 N/A LYS 80.A N GLN 76.A O no hydrogen 3.056 N/A THR 81.A OG1 ALA 79.A O no hydrogen 3.563 N/A THR 81.A OG1 THR 142.A OG1 no hydrogen 3.046 N/A SER 82.A OG HIS 141.A ND1 no hydrogen 2.640 N/A ALA 83.A N ILE 126.A O no hydrogen 3.120 N/A PHE 84.A N THR 142.A O no hydrogen 3.348 N/A LEU 85.A N VAL 124.A O no hydrogen 2.867 N/A GLY 86.A N ALA 64.A O no hydrogen 2.744 N/A THR 88.A N MET 97.A O no hydrogen 3.114 N/A THR 88.A OG1 GLU 90.A OE1 no hydrogen 3.111 N/A ASP 89.A N ASP 122.A O no hydrogen 2.930 N/A GLY 94.A N ASP 89.A OD2 no hydrogen 2.815 N/A GLN 95.A N THR 92.A O no hydrogen 2.951 N/A GLN 95.A NE2 PHE 96.A O no hydrogen 2.905 N/A MET 97.A N THR 88.A O no hydrogen 2.867 N/A TYR 98.A N GLY 102.A O no hydrogen 2.841 N/A TYR 98.A OH THR 105.A OG1 no hydrogen 3.108 N/A VAL 99.A N GLY 86.A O no hydrogen 2.948 N/A GLY 101.A N TYR 98.A O no hydrogen 2.872 N/A LEU 104.A N PHE 96.A O no hydrogen 3.017 N/A THR 105.A N TYR 98.A OH no hydrogen 2.978 N/A THR 105.A OG1 TYR 98.A OH no hydrogen 3.108 N/A ASN 108.A ND2 GLY 130.A O no hydrogen 2.821 N/A LYS 110.A N TRP 132.A O no hydrogen 2.888 N/A LYS 111.A NZ ASP 112.A OD1 no hydrogen 2.729 N/A GLU 113.A N LYS 110.A O no hydrogen 3.121 N/A ASN 115.A N ASP 134.A OD2 no hydrogen 3.074 N/A ASP 116.A N ASP 134.A OD1 no hydrogen 2.625 N/A HIS 117.A N GLU 121.A OE2 no hydrogen 3.152 N/A GLY 120.A N HIS 117.A O no hydrogen 2.914 N/A GLU 121.A N ASP 116.A OD2 no hydrogen 2.742 N/A CYS 123.A N ILE 135.A O no hydrogen 2.963 N/A THR 125.A N ASN 133.A O no hydrogen 2.980 N/A THR 125.A OG1 ASN 133.A O no hydrogen 3.309 N/A ILE 126.A N ALA 83.A O no hydrogen 2.886 N/A VAL 127.A N LEU 131.A O no hydrogen 2.813 N/A TRP 132.A N ASN 108.A O no hydrogen 2.820 N/A TRP 132.A NE1 ASN 72.A OD1 no hydrogen 2.810 N/A ASN 133.A N THR 125.A O no hydrogen 3.046 N/A ILE 135.A N CYS 123.A O no hydrogen 2.781 N/A GLN 138.A N SER 136.A OG no hydrogen 2.935 N/A ALA 139.A N SER 136.A O no hydrogen 3.135 N/A HIS 141.A N MET 47.A O no hydrogen 3.097 N/A HIS 141.A ND1 SER 82.A OG no hydrogen 2.640 N/A THR 142.A N SER 82.A O no hydrogen 2.969 N/A THR 142.A OG1 THR 81.A OG1 no hydrogen 3.046 N/A THR 142.A OG1 SER 82.A O no hydrogen 3.094 N/A ALA 143.A N GLU 45.A O no hydrogen 2.915 N/A CYS 145.A N VAL 41.A O no hydrogen 2.876 N/A GLU 146.A N THR 62.A O no hydrogen 2.703 N/A PHE 147.A N PHE 39.A O no hydrogen 2.910 N/A