Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ibe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N VAL 1.A O no hydrogen 2.817 N/A SER 3.A OG ASP 6.A OD2 no hydrogen 3.079 N/A ASP 6.A N SER 3.A OG no hydrogen 3.000 N/A LYS 7.A N SER 3.A O no hydrogen 2.842 N/A LYS 7.A NZ LEU 2.A O no hydrogen 3.526 N/A THR 8.A N ALA 4.A O no hydrogen 2.763 N/A THR 8.A OG1 ALA 4.A O no hydrogen 2.958 N/A ASN 9.A N ALA 5.A O no hydrogen 3.023 N/A VAL 10.A N ASP 6.A O no hydrogen 2.954 N/A LYS 11.A N LYS 7.A O no hydrogen 3.073 N/A ALA 12.A N THR 8.A O no hydrogen 3.040 N/A ALA 13.A N ASN 9.A O no hydrogen 2.699 N/A TRP 14.A N VAL 10.A O no hydrogen 2.841 N/A TRP 14.A NE1 THR 67.A OG1 no hydrogen 2.819 N/A SER 15.A N LYS 11.A O no hydrogen 3.096 N/A SER 15.A OG ALA 12.A O no hydrogen 2.678 N/A LYS 16.A N ALA 13.A O no hydrogen 3.036 N/A VAL 17.A N ALA 13.A O no hydrogen 3.321 N/A GLY 18.A N TRP 14.A O no hydrogen 3.092 N/A HIS 20.A N VAL 17.A O no hydrogen 2.910 N/A PHE 24.A N HIS 20.A O no hydrogen 2.595 N/A GLY 25.A N ALA 21.A O no hydrogen 2.705 N/A ALA 26.A N GLY 22.A O no hydrogen 2.880 N/A GLU 27.A N GLU 23.A O no hydrogen 3.062 N/A ALA 28.A N PHE 24.A O no hydrogen 2.910 N/A LEU 29.A N GLY 25.A O no hydrogen 3.066 N/A GLU 30.A N ALA 26.A O no hydrogen 3.140 N/A ARG 31.A N GLU 27.A O no hydrogen 2.899 N/A ARG 31.A NE GLU 27.A OE2 no hydrogen 2.894 N/A ARG 31.A NH2 GLU 27.A OE2 no hydrogen 2.623 N/A MET 32.A N ALA 28.A O no hydrogen 2.966 N/A PHE 33.A N LEU 29.A O no hydrogen 2.703 N/A LEU 34.A N GLU 30.A O no hydrogen 3.048 N/A GLY 35.A N ARG 31.A O no hydrogen 2.865 N/A PHE 36.A N MET 32.A O no hydrogen 2.855 N/A THR 39.A N PHE 36.A O no hydrogen 2.944 N/A THR 39.A OG1 MET 32.A O no hydrogen 3.426 N/A THR 39.A OG1 PHE 36.A O no hydrogen 2.603 N/A LYS 40.A N PRO 37.A O no hydrogen 3.083 N/A THR 41.A N THR 38.A O no hydrogen 3.365 N/A TYR 42.A N THR 39.A O no hydrogen 3.427 N/A PHE 43.A N LYS 40.A O no hydrogen 3.076 N/A HIS 45.A N HIS 45.A ND1 no hydrogen 2.712 N/A PHE 46.A N PHE 43.A O no hydrogen 2.932 N/A ASP 47.A N GLN 54.A OE1 no hydrogen 2.739 N/A SER 49.A N ASP 47.A OD1 no hydrogen 3.040 N/A SER 49.A OG ASP 47.A OD1 no hydrogen 3.355 N/A SER 49.A OG HIS 50.A O no hydrogen 3.517 N/A HIS 50.A ND1 GLU 30.A OE2 no hydrogen 2.880 N/A SER 52.A N SER 49.A O no hydrogen 2.953 N/A SER 52.A OG ASP 47.A O no hydrogen 2.231 N/A GLN 54.A NE2 HIS 45.A O no hydrogen 3.045 N/A VAL 55.A N SER 52.A OG no hydrogen 3.008 N/A LYS 56.A N SER 52.A O no hydrogen 3.227 N/A ALA 57.A N ALA 53.A O no hydrogen 2.860 N/A HIS 58.A N GLN 54.A O no hydrogen 2.682 N/A GLY 59.A N VAL 55.A O no hydrogen 2.687 N/A LYS 60.A N LYS 56.A O no hydrogen 3.051 N/A LYS 60.A NZ LYS 60.A O no hydrogen 3.421 N/A LYS 61.A N ALA 57.A O no hydrogen 3.320 N/A VAL 62.A N HIS 58.A O no hydrogen 2.932 N/A GLY 63.A N GLY 59.A O no hydrogen 2.930 N/A ASP 64.A N LYS 60.A O no hydrogen 2.763 N/A ALA 65.A N LYS 61.A O no hydrogen 2.979 N/A LEU 66.A N VAL 62.A O no hydrogen 3.035 N/A THR 67.A N GLY 63.A O no hydrogen 3.093 N/A THR 67.A OG1 GLY 63.A O no hydrogen 3.176 N/A LEU 68.A N ASP 64.A O no hydrogen 2.817 N/A ALA 69.A N ALA 65.A O no hydrogen 2.960 N/A VAL 70.A N LEU 66.A O no hydrogen 2.873 N/A GLY 71.A N THR 67.A O no hydrogen 3.222 N/A HIS 72.A N ALA 69.A O no hydrogen 2.896 N/A HIS 72.A ND1 LEU 68.A O no hydrogen 2.947 N/A ASP 75.A N HIS 72.A O no hydrogen 2.795 N/A ALA 79.A N ASP 75.A O no hydrogen 3.364 N/A LEU 80.A N LEU 76.A O no hydrogen 2.796 N/A SER 81.A OG PRO 77.A O no hydrogen 3.196 N/A SER 84.A N LEU 80.A O no hydrogen 3.097 N/A SER 84.A N SER 81.A O no hydrogen 3.121 N/A SER 84.A OG LEU 80.A O no hydrogen 3.309 N/A SER 84.A OG SER 81.A O no hydrogen 3.259 N/A SER 84.A OG VAL 135.A O no hydrogen 3.180 N/A ASN 85.A N SER 81.A O no hydrogen 3.434 N/A LEU 86.A N ASP 82.A O no hydrogen 3.469 N/A HIS 87.A N LEU 83.A O no hydrogen 3.063 N/A HIS 87.A ND1 LEU 83.A O no hydrogen 2.785 N/A ALA 88.A N SER 84.A O no hydrogen 3.022 N/A HIS 89.A N ASN 85.A O no hydrogen 2.791 N/A LYS 90.A N ASN 85.A O no hydrogen 3.443 N/A LEU 91.A N LEU 86.A O no hydrogen 2.586 N/A VAL 93.A N HIS 87.A O no hydrogen 3.107 N/A ASP 94.A N TYR 42.A OH no hydrogen 3.108 N/A VAL 96.A N ASP 94.A OD1 no hydrogen 3.051 N/A ASN 97.A N ASP 94.A O no hydrogen 2.868 N/A PHE 98.A N PRO 95.A O no hydrogen 3.061 N/A LEU 101.A N ASN 97.A O no hydrogen 3.083 N/A SER 102.A N PHE 98.A O no hydrogen 2.840 N/A SER 102.A OG PHE 98.A O no hydrogen 2.985 N/A HIS 103.A N LYS 99.A O no hydrogen 2.989 N/A CYS 104.A N LEU 100.A O no hydrogen 3.091 N/A CYS 104.A SG LEU 100.A O no hydrogen 3.418 N/A LEU 105.A N LEU 101.A O no hydrogen 2.805 N/A LEU 106.A N SER 102.A O no hydrogen 2.890 N/A SER 107.A N HIS 103.A O no hydrogen 2.963 N/A SER 107.A OG HIS 103.A O no hydrogen 2.935 N/A THR 108.A N CYS 104.A O no hydrogen 3.099 N/A THR 108.A OG1 CYS 104.A O no hydrogen 2.628 N/A LEU 109.A N LEU 105.A O no hydrogen 2.988 N/A ALA 110.A N LEU 106.A O no hydrogen 2.837 N/A VAL 111.A N SER 107.A O no hydrogen 3.053 N/A HIS 112.A N THR 108.A O no hydrogen 3.211 N/A HIS 112.A NE2 GLU 27.A OE1 no hydrogen 2.689 N/A LEU 113.A N LEU 109.A O no hydrogen 2.892 N/A PHE 117.A N LEU 113.A O no hydrogen 2.875 N/A THR 118.A N ASP 116.A O no hydrogen 2.888 N/A VAL 121.A N THR 118.A OG1 no hydrogen 3.406 N/A HIS 122.A N THR 118.A O no hydrogen 2.776 N/A ALA 123.A N PRO 119.A O no hydrogen 2.946 N/A SER 124.A N ALA 120.A O no hydrogen 3.231 N/A SER 124.A OG ASP 6.A OD1 no hydrogen 2.483 N/A SER 124.A OG ASN 9.A OD1 no hydrogen 2.935 N/A SER 124.A OG ALA 120.A O no hydrogen 3.486 N/A LEU 125.A N VAL 121.A O no hydrogen 2.948 N/A ASP 126.A N HIS 122.A O no hydrogen 2.960 N/A LYS 127.A N ALA 123.A O no hydrogen 3.186 N/A LYS 127.A NZ ALA 123.A O no hydrogen 2.924 N/A PHE 128.A N SER 124.A O no hydrogen 2.968 N/A LEU 129.A N LEU 125.A O no hydrogen 2.929 N/A SER 130.A N ASP 126.A O no hydrogen 2.910 N/A SER 130.A OG ASP 126.A O no hydrogen 3.542 N/A SER 131.A N LYS 127.A O no hydrogen 2.895 N/A SER 131.A OG LYS 127.A O no hydrogen 3.139 N/A VAL 132.A N PHE 128.A O no hydrogen 2.895 N/A SER 133.A N LEU 129.A O no hydrogen 2.872 N/A SER 133.A OG LEU 129.A O no hydrogen 2.798 N/A THR 134.A N SER 130.A O no hydrogen 3.053 N/A THR 134.A OG1 SER 130.A O no hydrogen 3.006 N/A VAL 135.A N SER 131.A O no hydrogen 3.123 N/A LEU 136.A N VAL 132.A O no hydrogen 3.153 N/A THR 137.A N THR 134.A O no hydrogen 3.342 N/A THR 137.A OG1 SER 133.A O no hydrogen 3.183 N/A THR 137.A OG1 THR 134.A O no hydrogen 3.264 N/A SER 138.A N VAL 135.A O no hydrogen 3.177 N/A SER 138.A OG VAL 135.A O no hydrogen 2.507 N/A LYS 139.A NZ SER 81.A O no hydrogen 2.974 N/A LYS 139.A NZ ASN 85.A OD1 no hydrogen 2.973 N/A TYR 140.A OH VAL 93.A O no hydrogen 2.348 N/A