Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1he3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N ASP 68.A OD2 no hydrogen 2.809 N/A LYS 4.A N ASP 68.A OD2 no hydrogen 2.946 N/A LYS 4.A NZ GLY 66.A O no hydrogen 3.353 N/A ILE 5.A N GLU 28.A O no hydrogen 2.976 N/A ALA 6.A N ALA 69.A O no hydrogen 3.130 N/A ILE 7.A N THR 30.A O no hydrogen 2.882 N/A PHE 8.A N ILE 71.A O no hydrogen 2.887 N/A GLY 12.A N GLY 9.A O no hydrogen 3.251 N/A LEU 16.A N GLY 12.A O no hydrogen 2.814 N/A THR 17.A OG1 GLN 21.A OE1 no hydrogen 3.024 N/A THR 17.A OG1 HIS 178.A ND1 no hydrogen 2.718 N/A THR 18.A N THR 14.A O no hydrogen 2.951 N/A THR 18.A OG1 THR 14.A O no hydrogen 2.817 N/A LEU 19.A N GLY 15.A O no hydrogen 2.793 N/A ALA 20.A N LEU 16.A O no hydrogen 2.991 N/A GLN 21.A N THR 17.A O no hydrogen 2.850 N/A ALA 22.A N THR 18.A O no hydrogen 2.801 N/A VAL 23.A N LEU 19.A O no hydrogen 2.944 N/A GLN 24.A N ALA 20.A O no hydrogen 2.895 N/A GLN 24.A NE2 GLN 24.A O no hydrogen 3.305 N/A ALA 25.A N GLN 21.A O no hydrogen 2.828 N/A GLY 26.A N VAL 23.A O no hydrogen 3.055 N/A TYR 27.A N ALA 22.A O no hydrogen 3.073 N/A GLU 28.A N LYS 3.A O no hydrogen 2.881 N/A THR 30.A N ILE 5.A O no hydrogen 2.840 N/A VAL 31.A N HIS 48.A O no hydrogen 2.986 N/A VAL 33.A N VAL 50.A O no hydrogen 2.896 N/A SER 37.A N ASP 35.A OD1 no hydrogen 2.899 N/A SER 37.A OG ASP 35.A OD1 no hydrogen 2.632 N/A SER 37.A OG ASP 35.A OD2 no hydrogen 3.498 N/A ARG 38.A N ASP 35.A O no hydrogen 3.090 N/A LEU 39.A N SER 36.A O no hydrogen 3.073 N/A ARG 45.A NH1 SER 41.A O no hydrogen 2.833 N/A HIS 48.A N VAL 29.A O no hydrogen 3.076 N/A HIS 48.A NE2 GLU 28.A OE2 no hydrogen 2.792 N/A VAL 50.A N VAL 31.A O no hydrogen 2.790 N/A GLY 52.A N VAL 33.A O no hydrogen 2.875 N/A ASP 53.A N ASP 59.A OD2 no hydrogen 2.837 N/A LEU 55.A N ASP 53.A OD1 no hydrogen 2.836 N/A GLN 56.A N ASP 53.A O no hydrogen 3.013 N/A VAL 60.A N GLN 56.A O no hydrogen 3.097 N/A ASP 61.A N ALA 57.A O no hydrogen 2.774 N/A LYS 62.A N ALA 58.A O no hydrogen 3.103 N/A THR 63.A N ASP 59.A O no hydrogen 3.192 N/A THR 63.A N VAL 60.A O no hydrogen 3.032 N/A THR 63.A OG1 ASP 59.A O no hydrogen 2.840 N/A VAL 64.A N VAL 60.A O no hydrogen 2.924 N/A ALA 65.A N ASP 61.A O no hydrogen 2.990 N/A GLN 67.A N VAL 64.A O no hydrogen 3.097 N/A GLN 67.A NE2 THR 30.A OG1 no hydrogen 3.109 N/A GLN 67.A NE2 THR 63.A O no hydrogen 2.869 N/A ASP 68.A N LYS 4.A O no hydrogen 2.770 N/A VAL 70.A N LYS 104.A O no hydrogen 2.919 N/A ILE 71.A N ALA 6.A O no hydrogen 2.851 N/A VAL 72.A N VAL 106.A O no hydrogen 2.858 N/A LEU 73.A N PHE 8.A O no hydrogen 2.813 N/A THR 76.A OG1 ASP 79.A O no hydrogen 2.648 N/A ARG 77.A NH2 THR 11.A O no hydrogen 3.046 N/A ASP 79.A N THR 76.A O no hydrogen 2.800 N/A SER 81.A N ASP 79.A OD1 no hydrogen 2.943 N/A SER 81.A OG ASP 79.A OD1 no hydrogen 2.975 N/A VAL 85.A N THR 83.A OG1 no hydrogen 3.197 N/A SER 87.A N ASP 130.A OD2 no hydrogen 2.958 N/A SER 87.A OG THR 84.A O no hydrogen 3.391 N/A SER 87.A OG ASP 130.A OD1 no hydrogen 2.496 N/A SER 87.A OG ASP 130.A OD2 no hydrogen 3.521 N/A GLU 88.A N THR 84.A O no hydrogen 2.833 N/A GLY 89.A N VAL 85.A O no hydrogen 2.834 N/A ALA 90.A N MET 86.A O no hydrogen 2.814 N/A ARG 91.A N SER 87.A O no hydrogen 2.869 N/A ARG 91.A NE GLU 88.A OE2 no hydrogen 3.118 N/A ASN 92.A N GLU 88.A O no hydrogen 3.007 N/A ASN 92.A ND2 VAL 54.A O no hydrogen 2.871 N/A ILE 93.A N GLY 89.A O no hydrogen 2.848 N/A VAL 94.A N ALA 90.A O no hydrogen 2.850 N/A ALA 95.A N ARG 91.A O no hydrogen 3.068 N/A ALA 96.A N ASN 92.A O no hydrogen 2.951 N/A MET 97.A N ILE 93.A O no hydrogen 2.828 N/A LYS 98.A N VAL 94.A O no hydrogen 2.956 N/A LYS 98.A NZ SER 141.A O.A no hydrogen 2.728 N/A LYS 98.A NZ SER 141.A O.B no hydrogen 3.072 N/A ALA 99.A N ALA 95.A O no hydrogen 2.895 N/A HIS 100.A N MET 97.A O no hydrogen 3.139 N/A HIS 100.A NE2 ASP 61.A OD2 no hydrogen 2.665 N/A VAL 102.A N MET 97.A O no hydrogen 2.924 N/A LYS 104.A NZ CYS 187.A O no hydrogen 2.840 N/A LYS 104.A NZ THR 190.A O no hydrogen 2.999 N/A LYS 104.A NZ ASP 194.A OD1 no hydrogen 3.062 N/A VAL 105.A N LYS 144.A O no hydrogen 2.835 N/A VAL 106.A N VAL 70.A O no hydrogen 2.856 N/A ALA 107.A N VAL 146.A O no hydrogen 3.032 N/A CYS 108.A N VAL 72.A O no hydrogen 2.919 N/A CYS 108.A SG THR 109.A O no hydrogen 3.711 N/A CYS 108.A SG VAL 148.A O no hydrogen 4.035 N/A THR 109.A N VAL 148.A O no hydrogen 2.836 N/A ALA 111.A N PRO 150.A O no hydrogen 2.778 N/A PHE 112.A N SER 110.A OG no hydrogen 2.963 N/A LEU 113.A N SER 110.A O no hydrogen 3.051 N/A LEU 114.A N ALA 111.A O no hydrogen 2.815 N/A TRP 115.A N ALA 111.A O no hydrogen 2.953 N/A TRP 115.A NE1 GLY 168.A O no hydrogen 2.743 N/A THR 118.A N ASP 116.A OD1 no hydrogen 3.215 N/A THR 118.A OG1 ASP 116.A OD1 no hydrogen 3.466 N/A LYS 119.A N ASP 116.A O no hydrogen 3.005 N/A LEU 124.A N PRO 121.A O no hydrogen 2.914 N/A GLN 125.A N PRO 122.A O no hydrogen 3.081 N/A GLN 125.A NE2 GLN 125.A O no hydrogen 3.455 N/A GLN 125.A NE2 ASP 129.A OD1 no hydrogen 3.052 N/A THR 128.A N LEU 124.A O no hydrogen 3.001 N/A THR 128.A OG1 LEU 124.A O no hydrogen 2.802 N/A ASP 129.A N GLN 125.A O no hydrogen 2.790 N/A ASP 130.A N ALA 126.A O no hydrogen 3.225 N/A HIS 131.A N VAL 127.A O no hydrogen 2.831 N/A ILE 132.A N THR 128.A O no hydrogen 2.854 N/A ARG 133.A N ASP 129.A O no hydrogen 3.035 N/A ARG 133.A NE ASP 130.A OD1 no hydrogen 2.855 N/A ARG 133.A NH2 THR 83.A O no hydrogen 2.893 N/A ARG 133.A NH2 ASP 130.A OD1 no hydrogen 3.357 N/A MET 134.A N ASP 130.A O no hydrogen 2.799 N/A HIS 135.A N HIS 131.A O no hydrogen 2.801 N/A HIS 135.A ND1 TYR 145.A OH no hydrogen 2.626 N/A LYS 136.A N ILE 132.A O no hydrogen 2.966 N/A LYS 136.A NZ GLU 140.A OE1 no hydrogen 3.411 N/A LYS 136.A NZ GLU 140.A OE2 no hydrogen 2.630 N/A VAL 137.A N ARG 133.A O no hydrogen 3.021 N/A LEU 138.A N MET 134.A O no hydrogen 2.995 N/A ARG 139.A N HIS 135.A O no hydrogen 2.780 N/A GLU 140.A N LYS 136.A O no hydrogen 2.923 N/A SER 141.A N LEU 138.A O no hydrogen 3.328 N/A SER 141.A OG LEU 138.A O no hydrogen 2.771 N/A LEU 143.A N.A SER 141.A OG no hydrogen 3.124 N/A LEU 143.A N.B SER 141.A OG no hydrogen 3.121 N/A LYS 144.A N ASP 103.A O no hydrogen 2.845 N/A LYS 144.A N ASP 103.A OD1.B no hydrogen 3.080 N/A LYS 144.A NZ ASP 103.A OD2.A no hydrogen 2.837 N/A TYR 145.A OH HIS 135.A ND1 no hydrogen 2.626 N/A VAL 146.A N VAL 105.A O no hydrogen 2.930 N/A ALA 147.A N HIS 196.A O no hydrogen 3.084 N/A VAL 148.A N ALA 107.A O no hydrogen 2.907 N/A MET 149.A N THR 198.A O no hydrogen 2.793 N/A HIS 152.A N ARG 173.A O no hydrogen 3.249 N/A GLY 154.A N ILE 175.A O no hydrogen 2.854 N/A GLN 156.A N GLN 156.A OE1 no hydrogen 2.773 N/A THR 159.A N ASP 179.A OD1 no hydrogen 2.800 N/A THR 159.A OG1 ASP 179.A OD1 no hydrogen 3.355 N/A THR 159.A OG1 ASP 179.A OD2 no hydrogen 2.711 N/A GLY 160.A N ASP 179.A OD1 no hydrogen 2.874 N/A ALA 161.A N THR 159.A OG1 no hydrogen 2.995 N/A TYR 162.A OH HIS 182.A ND1 no hydrogen 2.664 N/A THR 163.A N SER 201.A O no hydrogen 2.857 N/A THR 165.A N TYR 199.A O no hydrogen 3.000 N/A THR 165.A OG1 ASP 167.A OD1 no hydrogen 3.514 N/A THR 165.A OG1 ARG 169.A O no hydrogen 2.568 N/A ARG 169.A N ASP 167.A OD1 no hydrogen 3.028 N/A ARG 169.A NH1 ASP 167.A OD2 no hydrogen 3.554 N/A SER 172.A N SER 201.A OG no hydrogen 3.339 N/A SER 172.A OG HIS 202.A O no hydrogen 2.626 N/A VAL 174.A N SER 172.A OG no hydrogen 2.921 N/A ILE 175.A N HIS 152.A O no hydrogen 2.940 N/A SER 176.A N TYR 204.A OH no hydrogen 2.860 N/A SER 176.A OG.A PRO 157.A O no hydrogen 3.302 N/A SER 176.A OG.A TYR 204.A OH no hydrogen 3.353 N/A SER 176.A OG.B GLN 156.A O no hydrogen 2.521 N/A LYS 177.A N GLY 154.A O no hydrogen 2.781 N/A LYS 177.A NZ ASP 155.A OD1.A no hydrogen 3.229 N/A HIS 178.A N SER 176.A OG.B no hydrogen 2.935 N/A HIS 178.A ND1 THR 17.A OG1 no hydrogen 2.718 N/A ASP 179.A N SER 176.A OG.A no hydrogen 2.960 N/A LEU 180.A N SER 176.A O no hydrogen 2.790 N/A GLY 181.A N LYS 177.A O no hydrogen 2.997 N/A HIS 182.A N HIS 178.A O no hydrogen 2.926 N/A HIS 182.A ND1 TYR 162.A OH no hydrogen 2.664 N/A PHE 183.A N ASP 179.A O no hydrogen 2.877 N/A MET 184.A N LEU 180.A O no hydrogen 2.911 N/A LEU 185.A N GLY 181.A O no hydrogen 3.039 N/A ARG 186.A N HIS 182.A O no hydrogen 2.844 N/A ARG 186.A NH1 GLU 192.A OE1 no hydrogen 3.272 N/A CYS 187.A N PHE 183.A O no hydrogen 2.969 N/A CYS 187.A SG PHE 183.A O no hydrogen 3.419 N/A LEU 188.A N LEU 185.A O no hydrogen 2.905 N/A THR 189.A N ARG 186.A O no hydrogen 2.965 N/A THR 189.A OG1 ARG 186.A O no hydrogen 3.008 N/A THR 190.A OG1 GLU 192.A OE1 no hydrogen 2.978 N/A GLU 192.A N THR 190.A OG1 no hydrogen 3.061 N/A ASP 194.A N ASP 191.A O no hydrogen 2.999 N/A GLY 195.A N TYR 145.A O no hydrogen 2.855 N/A HIS 196.A N TYR 193.A O no hydrogen 2.936 N/A THR 198.A N ALA 147.A O no hydrogen 2.853 N/A THR 198.A OG1 ALA 147.A O no hydrogen 2.880 N/A TYR 199.A N THR 165.A O no hydrogen 2.832 N/A TYR 199.A OH SER 172.A O no hydrogen 2.711 N/A SER 201.A N THR 163.A O no hydrogen 2.932 N/A SER 201.A OG SER 172.A O no hydrogen 3.287 N/A HIS 202.A N VAL 174.A O no hydrogen 3.057 N/A GLN 203.A NE2 PRO 171.A O no hydrogen 3.202 N/A TYR 204.A OH SER 176.A OG.A no hydrogen 3.353 N/A TYR 204.A OH ASP 179.A OD2 no hydrogen 2.603 N/A