Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1smb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N SER 1.A O no hydrogen 3.079 N/A PHE 6.A N ALA 2.A O no hydrogen 3.008 N/A HIS 7.A N SER 3.A O no hydrogen 3.008 N/A ASN 8.A N LYS 4.A O no hydrogen 2.959 N/A GLU 9.A N GLN 5.A O no hydrogen 2.941 N/A VAL 10.A N PHE 6.A O no hydrogen 3.013 N/A LEU 11.A N HIS 7.A O no hydrogen 3.022 N/A LYS 12.A N ASN 8.A O no hydrogen 2.903 N/A ALA 13.A N GLU 9.A O no hydrogen 3.059 N/A HIS 14.A N VAL 10.A O no hydrogen 2.991 N/A HIS 14.A ND1 VAL 10.A O no hydrogen 2.897 N/A HIS 14.A NE2 TYR 128.A OH no hydrogen 2.728 N/A ASN 15.A N LEU 11.A O no hydrogen 2.907 N/A ASN 15.A ND2 LEU 26.A O no hydrogen 3.114 N/A GLU 16.A N LYS 12.A O no hydrogen 2.958 N/A TYR 17.A N ALA 13.A O no hydrogen 3.060 N/A TYR 17.A OH ASP 76.A OD1 no hydrogen 2.652 N/A ARG 18.A N HIS 14.A O no hydrogen 2.879 N/A ARG 18.A NE PRO 24.A O no hydrogen 2.661 N/A ARG 18.A NH1 MET 102.A O.A no hydrogen 2.878 N/A ARG 18.A NH1 MET 102.A O.B no hydrogen 2.921 N/A ARG 18.A NH1 TRP 104.A O no hydrogen 2.903 N/A ARG 18.A NH2 PRO 24.A O no hydrogen 2.901 N/A ARG 18.A NH2 TRP 104.A O no hydrogen 3.109 N/A ARG 18.A NH2 LYS 105.A O no hydrogen 3.357 N/A GLN 19.A N ASN 15.A O no hydrogen 2.980 N/A LYS 20.A N GLU 16.A O no hydrogen 3.303 N/A HIS 21.A N ARG 18.A O no hydrogen 3.050 N/A HIS 21.A ND1 LEU 145.A O no hydrogen 2.608 N/A HIS 21.A NE2 TYR 79.A OH no hydrogen 2.645 N/A GLY 22.A N GLN 19.A O no hydrogen 3.132 N/A VAL 23.A N ARG 18.A O no hydrogen 3.105 N/A LEU 26.A N ASN 15.A OD1 no hydrogen 2.735 N/A LYS 27.A N.A LYS 108.A O.A no hydrogen 3.091 N/A LYS 27.A N.A LYS 108.A O.B no hydrogen 3.138 N/A LYS 27.A N.B LYS 108.A O.A no hydrogen 3.091 N/A LYS 27.A N.B LYS 108.A O.B no hydrogen 3.139 N/A ARG 33.A N.A LYS 29.A O no hydrogen 2.970 N/A ARG 33.A N.B LYS 29.A O no hydrogen 2.980 N/A ARG 33.A NH2.A ASN 30.A OD1 no hydrogen 2.844 N/A GLU 34.A N ASN 30.A O no hydrogen 2.980 N/A ALA 35.A N LEU 31.A O no hydrogen 2.901 N/A GLN 36.A N ASN 32.A O no hydrogen 2.809 N/A GLN 36.A NE2 GLU 40.A OE2 no hydrogen 3.054 N/A GLN 36.A NE2 LYS 114.A O no hydrogen 2.967 N/A GLN 37.A N.A ARG 33.A O.A no hydrogen 2.919 N/A GLN 37.A N.A ARG 33.A O.B no hydrogen 2.915 N/A GLN 37.A N.B ARG 33.A O.A no hydrogen 2.917 N/A GLN 37.A N.B ARG 33.A O.B no hydrogen 2.913 N/A TYR 38.A N GLU 34.A O no hydrogen 3.047 N/A TYR 38.A OH LYS 49.A O no hydrogen 2.720 N/A SER 39.A N ALA 35.A O no hydrogen 2.921 N/A SER 39.A OG GLN 36.A O no hydrogen 2.759 N/A GLU 40.A N GLN 36.A O no hydrogen 3.037 N/A ALA 41.A N GLN 37.A O.A no hydrogen 3.121 N/A ALA 41.A N GLN 37.A O.B no hydrogen 3.108 N/A LEU 42.A N TYR 38.A O no hydrogen 2.922 N/A ALA 43.A N SER 39.A O no hydrogen 2.886 N/A SER 44.A N.A GLU 40.A O no hydrogen 2.991 N/A SER 44.A N.B GLU 40.A O no hydrogen 2.987 N/A SER 44.A N.C GLU 40.A O no hydrogen 2.986 N/A SER 44.A OG.A GLU 40.A O no hydrogen 3.498 N/A SER 44.A OG.A ALA 41.A O no hydrogen 2.656 N/A SER 44.A OG.C GLU 40.A O no hydrogen 2.783 N/A THR 45.A N ALA 41.A O no hydrogen 3.257 N/A THR 45.A OG1 ALA 41.A O no hydrogen 3.449 N/A THR 45.A OG1 LEU 42.A O no hydrogen 3.382 N/A ARG 46.A N LEU 42.A O no hydrogen 2.681 N/A ARG 46.A NH1 ASP 119.A OD1 no hydrogen 2.782 N/A ILE 47.A N THR 45.A OG1 no hydrogen 3.186 N/A HIS 50.A ND1.A GLU 60.A OE1 no hydrogen 2.927 N/A HIS 50.A ND1.B GLU 60.A OE1 no hydrogen 2.876 N/A SER 51.A N GLU 60.A OE1 no hydrogen 3.081 N/A SER 51.A OG GLU 60.A OE2 no hydrogen 2.702 N/A SER 54.A N SER 51.A OG no hydrogen 3.121 N/A SER 54.A OG HIS 50.A ND1.A no hydrogen 3.242 N/A SER 54.A OG HIS 50.A ND1.B no hydrogen 3.333 N/A SER 55.A N.A SER 51.A O no hydrogen 2.907 N/A SER 55.A N.B SER 51.A O no hydrogen 2.901 N/A SER 55.A OG.A SER 51.A O no hydrogen 3.440 N/A SER 55.A OG.A PRO 52.A O no hydrogen 2.753 N/A SER 55.A OG.B SER 51.A O no hydrogen 2.951 N/A ARG 56.A N PRO 52.A O no hydrogen 2.884 N/A GLY 57.A N SER 54.A O no hydrogen 3.064 N/A GLN 58.A N GLU 53.A O no hydrogen 2.959 N/A GLY 59.A N TYR 128.A O no hydrogen 2.786 N/A ASN 61.A N ALA 126.A O no hydrogen 2.947 N/A ASN 61.A ND2 HIS 98.A O.A no hydrogen 3.165 N/A ASN 61.A ND2 HIS 98.A O.B no hydrogen 3.130 N/A ALA 63.A N VAL 124.A O no hydrogen 2.971 N/A ALA 65.A N SER 122.A O no hydrogen 3.295 N/A TYR 67.A OH GLU 73.A OE2.A no hydrogen 2.660 N/A GLN 69.A N SER 122.A OG no hydrogen 3.208 N/A GLN 69.A NE2 ALA 63.A O no hydrogen 3.250 N/A GLN 69.A NE2 SER 122.A OG no hydrogen 2.991 N/A THR 70.A N GLU 73.A OE1.A no hydrogen 2.888 N/A THR 70.A N GLU 73.A OE1.B no hydrogen 3.309 N/A THR 70.A OG1 GLU 73.A OE1.A no hydrogen 3.521 N/A LYS 72.A NZ ASP 76.A OD2 no hydrogen 2.881 N/A GLU 73.A N.A THR 70.A OG1 no hydrogen 3.279 N/A GLU 73.A N.B THR 70.A OG1 no hydrogen 3.262 N/A VAL 74.A N THR 70.A O no hydrogen 3.300 N/A ALA 75.A N GLY 71.A O no hydrogen 3.219 N/A ASP 76.A N LYS 72.A O no hydrogen 2.911 N/A ARG 77.A N GLU 73.A O.A no hydrogen 3.006 N/A ARG 77.A N GLU 73.A O.B no hydrogen 3.051 N/A ARG 77.A NH1 GLN 69.A OE1 no hydrogen 3.053 N/A ARG 77.A NH2 GLN 69.A OE1 no hydrogen 2.947 N/A TRP 78.A N VAL 74.A O no hydrogen 3.100 N/A TRP 78.A NE1 LEU 62.A O no hydrogen 2.999 N/A TYR 79.A N ALA 75.A O no hydrogen 2.920 N/A TYR 79.A OH HIS 21.A NE2 no hydrogen 2.645 N/A SER 80.A N ASP 76.A O no hydrogen 3.005 N/A SER 80.A OG ARG 77.A O no hydrogen 2.737 N/A ILE 82.A N TYR 79.A O no hydrogen 2.951 N/A LYS 83.A N SER 80.A O no hydrogen 3.202 N/A ASN 84.A N GLU 81.A O no hydrogen 2.929 N/A TYR 85.A N ILE 82.A O no hydrogen 3.032 N/A GLN 88.A N ASN 86.A OD1 no hydrogen 2.848 N/A GLN 89.A N ASN 86.A O no hydrogen 3.100 N/A GLY 91.A N TYR 85.A OH no hydrogen 3.165 N/A THR 93.A OG1 THR 96.A OG1 no hydrogen 2.554 N/A THR 96.A N THR 93.A O no hydrogen 3.202 N/A THR 96.A N THR 93.A OG1 no hydrogen 3.250 N/A THR 96.A OG1 THR 93.A O no hydrogen 3.352 N/A THR 96.A OG1 THR 93.A OG1 no hydrogen 2.554 N/A GLY 97.A N SER 94.A O no hydrogen 3.234 N/A HIS 98.A N.A GLU 81.A OE1 no hydrogen 2.928 N/A HIS 98.A N.B GLU 81.A OE1 no hydrogen 2.933 N/A HIS 98.A ND1.A GLU 81.A OE2 no hydrogen 2.885 N/A PHE 99.A N GLU 81.A OE1 no hydrogen 3.112 N/A THR 100.A N THR 96.A O no hydrogen 2.928 N/A THR 100.A OG1 THR 96.A O no hydrogen 3.245 N/A THR 100.A OG1 GLY 97.A O no hydrogen 3.465 N/A ALA 101.A N GLY 97.A O no hydrogen 3.179 N/A MET 102.A N.A HIS 98.A O.A no hydrogen 3.124 N/A MET 102.A N.A HIS 98.A O.B no hydrogen 3.188 N/A MET 102.A N.B HIS 98.A O.A no hydrogen 3.118 N/A MET 102.A N.B HIS 98.A O.B no hydrogen 3.182 N/A VAL 103.A N PHE 99.A O no hydrogen 3.179 N/A TRP 104.A N ALA 101.A O no hydrogen 3.482 N/A LYS 105.A N ASN 143.A O no hydrogen 2.927 N/A ASN 106.A N.A ASN 143.A OD1 no hydrogen 2.961 N/A ASN 106.A N.B ASN 143.A OD1 no hydrogen 2.954 N/A ASN 106.A ND2.A GLU 142.A OE2 no hydrogen 3.543 N/A ASN 106.A ND2.A ASN 143.A OD1 no hydrogen 2.752 N/A THR 107.A N TRP 104.A O no hydrogen 3.107 N/A THR 107.A OG1 PRO 130.A O no hydrogen 3.017 N/A LYS 108.A N.A PHE 129.A O.A no hydrogen 2.912 N/A LYS 108.A N.A PHE 129.A O.B no hydrogen 2.882 N/A LYS 108.A N.B PHE 129.A O.A no hydrogen 2.889 N/A LYS 108.A N.B PHE 129.A O.B no hydrogen 2.859 N/A LYS 109.A N PHE 129.A O.A no hydrogen 2.843 N/A LYS 109.A N PHE 129.A O.B no hydrogen 2.834 N/A MET 110.A N.A LYS 27.A O.A no hydrogen 2.969 N/A MET 110.A N.A LYS 27.A O.B no hydrogen 2.946 N/A MET 110.A N.B LYS 27.A O.A no hydrogen 2.956 N/A MET 110.A N.B LYS 27.A O.B no hydrogen 2.934 N/A GLY 111.A N ARG 127.A O no hydrogen 2.894 N/A VAL 112.A N ASN 32.A OD1 no hydrogen 2.834 N/A GLY 113.A N VAL 125.A O no hydrogen 2.872 N/A LYS 114.A N GLN 36.A OE1 no hydrogen 2.991 N/A LYS 114.A NZ ASP 68.A OD2 no hydrogen 2.892 N/A LYS 114.A NZ GLN 69.A O no hydrogen 2.744 N/A ALA 115.A N PHE 123.A O no hydrogen 3.048 N/A ALA 117.A N SER 121.A O no hydrogen 2.834 N/A GLY 120.A N ALA 117.A O no hydrogen 2.997 N/A SER 121.A N ASP 119.A OD2 no hydrogen 3.237 N/A SER 121.A OG ASP 119.A OD2 no hydrogen 2.746 N/A SER 122.A N ALA 65.A O no hydrogen 2.949 N/A SER 122.A OG TYR 67.A O no hydrogen 2.743 N/A PHE 123.A N ALA 115.A O no hydrogen 2.824 N/A VAL 124.A N ALA 63.A O no hydrogen 2.826 N/A VAL 125.A N GLY 113.A O no hydrogen 2.908 N/A ALA 126.A N ASN 61.A O no hydrogen 2.912 N/A ARG 127.A N GLY 111.A O no hydrogen 2.799 N/A ARG 127.A NE GLU 60.A OE2 no hydrogen 2.730 N/A ARG 127.A NH2 GLU 60.A OE2 no hydrogen 3.222 N/A TYR 128.A N GLY 59.A O no hydrogen 2.896 N/A TYR 128.A OH HIS 14.A NE2 no hydrogen 2.728 N/A PHE 129.A N.A LYS 109.A O no hydrogen 2.902 N/A PHE 129.A N.B LYS 109.A O no hydrogen 2.895 N/A ASN 133.A ND2 THR 100.A OG1 no hydrogen 2.608 N/A PHE 139.A N ASN 136.A O no hydrogen 3.244 N/A GLU 142.A N GLY 138.A O no hydrogen 3.130 N/A ASN 143.A N PHE 139.A O no hydrogen 2.943 N/A ASN 143.A ND2 PHE 139.A O no hydrogen 2.925 N/A VAL 144.A N PHE 140.A O no hydrogen 2.789 N/A