Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5ltr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASN 1.A O no hydrogen 2.979 N/A LEU 5.A N ASN 1.A O no hydrogen 3.041 N/A ALA 7.A N SER 108.A O no hydrogen 2.872 N/A THR 8.A N SER 108.A O no hydrogen 3.296 N/A THR 8.A OG1 HIS 109.A ND1 no hydrogen 2.707 N/A HIS 9.A N GLY 28.A O no hydrogen 2.995 N/A GLU 10.A N ILE 110.A O no hydrogen 2.866 N/A LEU 11.A N GLY 26.A O no hydrogen 3.056 N/A HIS 12.A N GLY 112.A O no hydrogen 2.965 N/A HIS 12.A ND1 GLU 113.A OE1 no hydrogen 2.684 N/A HIS 12.A NE2 ASP 23.A OD2 no hydrogen 2.630 N/A ILE 13.A N MET 24.A O no hydrogen 3.018 N/A PHE 14.A N ALA 114.A O no hydrogen 3.001 N/A GLY 15.A N PHE 22.A O no hydrogen 3.114 N/A SER 16.A N VAL 116.A O no hydrogen 3.136 N/A ILE 17.A N VAL 20.A O.A no hydrogen 3.065 N/A ILE 17.A N VAL 20.A O.B no hydrogen 3.054 N/A ASN 18.A N.A GLY 118.A O no hydrogen 2.754 N/A ASN 18.A N.B GLY 118.A O no hydrogen 2.866 N/A ASN 18.A ND2.A PHE 121.A O no hydrogen 2.990 N/A ASN 18.A ND2.B PHE 121.A O no hydrogen 2.555 N/A VAL 20.A N.A ILE 17.A O no hydrogen 3.354 N/A VAL 20.A N.B ILE 17.A O no hydrogen 2.576 N/A PHE 22.A N GLY 15.A O no hydrogen 2.875 N/A MET 24.A N ILE 13.A O no hydrogen 2.842 N/A VAL 25.A N LYS 42.A O no hydrogen 3.047 N/A GLY 26.A N LEU 11.A O no hydrogen 3.157 N/A GLN 27.A NE2 GLU 10.A OE1 no hydrogen 3.245 N/A GLY 28.A N HIS 9.A O no hydrogen 2.768 N/A THR 29.A N GLU 38.A O no hydrogen 2.923 N/A GLY 30.A N ALA 7.A O no hydrogen 3.197 N/A ASN 31.A N TYR 36.A O no hydrogen 2.881 N/A ASN 33.A N ASN 31.A OD1 no hydrogen 2.922 N/A ASP 34.A N ASN 31.A O no hydrogen 3.201 N/A GLY 35.A N.A ASN 31.A O no hydrogen 2.930 N/A GLY 35.A N.B ASN 31.A O no hydrogen 2.940 N/A TYR 36.A N ASP 34.A OD1 no hydrogen 3.181 N/A TYR 36.A OH GLU 38.A OE1.A no hydrogen 2.671 N/A TYR 36.A OH GLU 38.A OE1.B no hydrogen 2.627 N/A GLU 37.A N GLU 208.A O no hydrogen 2.967 N/A GLU 38.A N THR 29.A O no hydrogen 2.881 N/A LEU 39.A N PHE 206.A O no hydrogen 2.924 N/A ASN 40.A N GLN 27.A O no hydrogen 3.031 N/A ASN 40.A ND2 GLU 203.A OE2 no hydrogen 2.842 N/A ASN 40.A ND2 ASN 205.A OD1 no hydrogen 2.937 N/A LEU 41.A N LEU 204.A O no hydrogen 2.974 N/A LYS 42.A N VAL 25.A O no hydrogen 2.929 N/A LYS 42.A NZ ASN 40.A OD1 no hydrogen 2.891 N/A LYS 42.A NZ GLU 203.A OE2 no hydrogen 3.262 N/A SER 43.A N THR 202.A O no hydrogen 2.770 N/A SER 43.A OG GLY 46.A O no hydrogen 2.612 N/A THR 44.A N ASP 23.A O no hydrogen 2.877 N/A THR 44.A OG1 ASP 23.A O no hydrogen 3.392 N/A THR 44.A OG1 ASP 23.A OD1 no hydrogen 2.680 N/A LYS 45.A N SER 43.A OG no hydrogen 3.114 N/A LEU 48.A N LYS 201.A O no hydrogen 2.766 N/A SER 51.A N VAL 127.A O no hydrogen 2.844 N/A TRP 53.A N SER 51.A OG no hydrogen 3.192 N/A ILE 54.A N SER 51.A O no hydrogen 2.992 N/A LEU 55.A N PRO 52.A O no hydrogen 3.024 N/A VAL 56.A N TRP 53.A O no hydrogen 2.945 N/A ILE 59.A N LEU 55.A O no hydrogen 2.963 N/A GLN 62.A N GLN 62.A OE1 no hydrogen 2.792 N/A GLN 62.A NE2 TYR 105.A OH no hydrogen 2.939 N/A TYR 63.A N PHE 60.A O no hydrogen 3.054 N/A TYR 63.A OH HIS 9.A ND1 no hydrogen 2.773 N/A LEU 64.A N HIS 61.A O no hydrogen 2.926 N/A TYR 66.A N GLY 69.A O no hydrogen 2.850 N/A TYR 66.A OH TYR 143.A OH no hydrogen 2.700 N/A GLY 69.A N TYR 66.A O no hydrogen 3.510 N/A SER 71.A N GLN 74.A OE1 no hydrogen 3.257 N/A SER 71.A OG LEU 64.A O no hydrogen 2.646 N/A GLN 74.A N SER 71.A OG no hydrogen 3.201 N/A GLN 74.A NE2 PRO 32.A O no hydrogen 3.079 N/A GLN 74.A NE2 GLN 62.A O no hydrogen 3.075 N/A ALA 75.A N SER 71.A O no hydrogen 2.934 N/A ALA 76.A N PRO 72.A O no hydrogen 3.010 N/A MET 77.A N PHE 73.A O no hydrogen 3.160 N/A VAL 78.A N GLN 74.A O no hydrogen 2.871 N/A ASP 79.A N ALA 75.A O no hydrogen 3.032 N/A GLY 80.A N MET 77.A O no hydrogen 3.010 N/A SER 81.A N ASP 79.A OD1 no hydrogen 2.948 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 2.635 N/A SER 81.A OG ASP 79.A OD2 no hydrogen 3.563 N/A GLY 82.A N ALA 76.A O no hydrogen 2.886 N/A GLN 84.A N THR 174.A O no hydrogen 2.905 N/A VAL 85.A N TYR 101.A O no hydrogen 3.516 N/A HIS 86.A N THR 172.A O no hydrogen 2.979 N/A HIS 86.A NE2.A THR 88.A OG1 no hydrogen 2.990 N/A ARG 87.A N VAL 99.A O no hydrogen 2.827 N/A ARG 87.A NE THR 171.A OG1 no hydrogen 2.976 N/A ARG 87.A NH1 HIS 58.A ND1 no hydrogen 3.098 N/A ARG 87.A NH1 TYR 101.A OH no hydrogen 2.856 N/A THR 88.A N ARG 170.A O no hydrogen 2.932 N/A THR 88.A OG1 HIS 86.A NE2.A no hydrogen 2.990 N/A MET 89.A N LEU 97.A O no hydrogen 2.803 N/A GLN 90.A N THR 168.A O no hydrogen 2.885 N/A PHE 91.A N ALA 95.A O no hydrogen 2.897 N/A GLU 92.A N ARG 166.A O no hydrogen 2.903 N/A GLY 94.A N PHE 91.A O no hydrogen 2.899 N/A ALA 95.A N ASP 93.A OD1 no hydrogen 3.362 N/A SER 96.A N THR 119.A O no hydrogen 2.940 N/A LEU 97.A N MET 89.A O no hydrogen 2.899 N/A THR 98.A N LYS 117.A O no hydrogen 2.922 N/A VAL 99.A N ARG 87.A O no hydrogen 2.952 N/A ASN 100.A N GLN 115.A O no hydrogen 3.058 N/A ASN 100.A ND2 GLN 115.A OE1 no hydrogen 2.967 N/A TYR 101.A N VAL 85.A O no hydrogen 2.865 N/A TYR 101.A OH HIS 58.A O no hydrogen 2.573 N/A ARG 102.A N GLU 113.A O no hydrogen 3.018 N/A ARG 102.A NH2 TYR 101.A O no hydrogen 2.815 N/A THR 104.A N LYS 111.A O no hydrogen 2.916 N/A GLU 106.A N HIS 109.A O no hydrogen 2.902 N/A HIS 109.A N GLU 106.A O no hydrogen 2.965 N/A HIS 109.A ND1 THR 8.A OG1 no hydrogen 2.707 N/A HIS 109.A NE2 GLU 10.A OE1 no hydrogen 2.775 N/A ILE 110.A N THR 8.A O no hydrogen 3.007 N/A LYS 111.A N THR 104.A O no hydrogen 2.866 N/A LYS 111.A NZ GLU 106.A OE1 no hydrogen 2.857 N/A LYS 111.A NZ GLU 106.A OE2 no hydrogen 3.059 N/A GLY 112.A N GLU 10.A O no hydrogen 2.913 N/A GLU 113.A N ARG 102.A O no hydrogen 2.883 N/A ALA 114.A N HIS 12.A O no hydrogen 2.894 N/A GLN 115.A N ASN 100.A O no hydrogen 2.946 N/A VAL 116.A N PHE 14.A O no hydrogen 2.806 N/A LYS 117.A N THR 98.A O no hydrogen 2.881 N/A LYS 117.A NZ THR 119.A OG1.A no hydrogen 3.353 N/A GLY 118.A N SER 16.A O no hydrogen 2.885 N/A THR 119.A N SER 96.A O no hydrogen 2.889 N/A PHE 121.A N ASN 18.A OD1.A no hydrogen 3.133 N/A PHE 121.A N ASN 18.A OD1.B no hydrogen 2.939 N/A GLY 125.A N PRO 122.A O no hydrogen 2.847 N/A THR 129.A N GLY 125.A O no hydrogen 3.059 N/A THR 129.A OG1 GLY 125.A O no hydrogen 2.818 N/A THR 129.A OG1 SER 131.A OG no hydrogen 2.869 N/A ASN 130.A N.A VAL 127.A O no hydrogen 3.276 N/A ASN 130.A N.B VAL 127.A O no hydrogen 3.270 N/A SER 131.A N PRO 126.A O no hydrogen 2.899 N/A SER 131.A OG THR 129.A O no hydrogen 3.279 N/A SER 131.A OG THR 129.A OG1 no hydrogen 2.869 N/A THR 133.A N THR 158.A O no hydrogen 2.855 N/A THR 133.A OG1 THR 158.A O no hydrogen 3.177 N/A ASP 136.A N SER 156.A O no hydrogen 2.911 N/A CYS 138.A N ARG 193.A O no hydrogen 3.032 N/A CYS 138.A SG LYS 154.A O no hydrogen 3.512 N/A SER 140.A N VAL 191.A O no hydrogen 2.808 N/A LYS 141.A N THR 152.A O no hydrogen 2.978 N/A TYR 143.A N GLN 187.A OE1 no hydrogen 2.839 N/A LYS 147.A N ASN 145.A OD1 no hydrogen 2.969 N/A THR 148.A N ASN 145.A O no hydrogen 3.426 N/A THR 148.A OG1 ASN 145.A OD1 no hydrogen 2.751 N/A ILE 149.A N TYR 173.A O no hydrogen 3.062 N/A ILE 150.A N THR 142.A O no hydrogen 2.901 N/A SER 151.A N THR 171.A O no hydrogen 2.848 N/A THR 152.A N LYS 141.A O no hydrogen 2.997 N/A PHE 153.A N ALA 169.A O no hydrogen 3.228 N/A TRP 155.A N SER 167.A O no hydrogen 2.872 N/A SER 156.A OG.A TYR 157.A O no hydrogen 3.540 N/A SER 156.A OG.B ASP 136.A OD2 no hydrogen 2.618 N/A TYR 157.A N TYR 165.A O no hydrogen 2.910 N/A TYR 157.A OH TRP 53.A O no hydrogen 3.041 N/A TYR 157.A OH VAL 56.A O no hydrogen 2.682 N/A THR 158.A N ALA 134.A O no hydrogen 2.877 N/A THR 159.A N LYS 163.A O no hydrogen 2.930 N/A THR 159.A OG1 ASN 161.A OD1 no hydrogen 2.631 N/A THR 159.A OG1 LYS 163.A O no hydrogen 3.264 N/A GLY 160.A N SER 131.A O no hydrogen 2.942 N/A GLY 162.A N THR 159.A O no hydrogen 3.009 N/A LYS 163.A N THR 159.A OG1 no hydrogen 3.085 N/A ARG 164.A NE ASP 136.A OD2 no hydrogen 3.162 N/A ARG 164.A NH1 ASP 136.A OD1 no hydrogen 2.973 N/A ARG 164.A NH1 ASP 136.A OD2 no hydrogen 3.548 N/A TYR 165.A N TYR 157.A O no hydrogen 2.827 N/A TYR 165.A OH ASP 93.A OD1 no hydrogen 3.047 N/A TYR 165.A OH ASP 93.A OD2 no hydrogen 2.886 N/A ARG 166.A N GLU 92.A OE1.A no hydrogen 2.908 N/A ARG 166.A N GLU 92.A OE1.B no hydrogen 2.845 N/A SER 167.A N TRP 155.A O no hydrogen 2.985 N/A THR 168.A N GLN 90.A O no hydrogen 2.894 N/A THR 168.A OG1 GLN 90.A O no hydrogen 3.520 N/A ALA 169.A N PHE 153.A O no hydrogen 2.883 N/A ARG 170.A N THR 88.A O no hydrogen 2.979 N/A THR 171.A N SER 151.A O no hydrogen 2.815 N/A THR 172.A N HIS 86.A O no hydrogen 2.804 N/A TYR 173.A N ILE 149.A O no hydrogen 2.819 N/A THR 174.A N GLN 84.A O no hydrogen 2.942 N/A PHE 175.A N LYS 147.A O no hydrogen 2.826 N/A ALA 176.A N GLY 82.A O no hydrogen 3.236 N/A MET 179.A N ASP 146.A O no hydrogen 2.752 N/A TYR 183.A N ALA 180.A O no hydrogen 3.160 N/A TYR 183.A OH MET 70.A O no hydrogen 2.674 N/A LYS 185.A N ALA 181.A O no hydrogen 3.046 N/A ASN 186.A N ASN 182.A O no hydrogen 3.083 N/A ASN 186.A ND2.A ASN 182.A O no hydrogen 2.977 N/A GLN 187.A NE2 TYR 143.A O no hydrogen 3.164 N/A GLN 187.A NE2 LEU 184.A O no hydrogen 2.922 N/A TYR 190.A N PHE 213.A O no hydrogen 2.909 N/A VAL 191.A N SER 140.A O no hydrogen 2.961 N/A PHE 192.A N LYS 211.A O no hydrogen 2.932 N/A ARG 193.A N CYS 138.A O no hydrogen 2.928 N/A ARG 193.A NE GLN 210.A OE1 no hydrogen 2.759 N/A ARG 193.A NH2 GLN 210.A OE1 no hydrogen 3.394 N/A LYS 194.A N TRP 209.A O no hydrogen 3.003 N/A LYS 194.A NZ ALA 135.A O no hydrogen 2.882 N/A GLU 196.A N LYS 207.A O no hydrogen 2.934 N/A LYS 198.A N ASN 205.A O no hydrogen 2.943 N/A SER 200.A N GLU 203.A O no hydrogen 2.828 N/A SER 200.A OG GLU 203.A O no hydrogen 3.484 N/A THR 202.A N SER 200.A OG no hydrogen 3.157 N/A GLU 203.A N SER 200.A OG no hydrogen 3.038 N/A LEU 204.A N LEU 41.A O no hydrogen 2.889 N/A ASN 205.A N LYS 198.A O no hydrogen 2.844 N/A PHE 206.A N LEU 39.A O no hydrogen 2.827 N/A LYS 207.A N GLU 196.A O no hydrogen 2.997 N/A GLU 208.A N GLU 37.A O no hydrogen 2.922 N/A TRP 209.A N LYS 194.A O no hydrogen 2.901 N/A GLN 210.A NE2 GLY 35.A O.A no hydrogen 3.290 N/A GLN 210.A NE2 GLY 35.A O.B no hydrogen 2.904 N/A LYS 211.A N PHE 192.A O no hydrogen 2.845 N/A PHE 213.A N TYR 190.A O no hydrogen 2.818 N/A