Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N GLY 1.A O no hydrogen 2.993 N/A PHE 5.A N GLU 2.A O no hydrogen 3.072 N/A THR 6.A OG1 GLU 3.A O no hydrogen 3.345 N/A VAL 9.A N GLY 32.A O no hydrogen 2.878 N/A ILE 11.A N GLY 30.A O no hydrogen 2.863 N/A LEU 12.A N LEU 113.A O no hydrogen 2.956 N/A VAL 13.A N GLY 28.A O no hydrogen 2.835 N/A GLU 14.A N ASN 115.A O no hydrogen 2.959 N/A LEU 15.A N VAL 26.A O no hydrogen 2.844 N/A ASP 16.A N ILE 117.A O no hydrogen 2.977 N/A GLY 17.A N PHE 24.A O no hydrogen 2.665 N/A ASP 18.A N LEU 119.A O no hydrogen 3.020 N/A VAL 19.A N HIS 22.A O no hydrogen 2.993 N/A ASN 20.A N GLY 121.A O no hydrogen 2.981 N/A ASN 20.A ND2 PHE 124.A O no hydrogen 2.902 N/A GLY 21.A N ASP 18.A OD1 no hydrogen 2.881 N/A HIS 22.A N VAL 19.A O no hydrogen 2.816 N/A PHE 24.A N GLY 17.A O no hydrogen 2.982 N/A SER 25.A OG ASP 16.A OD1 no hydrogen 2.663 N/A VAL 26.A N LEU 15.A O no hydrogen 2.939 N/A SER 27.A N ILE 44.A O no hydrogen 2.978 N/A SER 27.A OG GLU 14.A OE1 no hydrogen 2.686 N/A SER 27.A OG GLU 14.A OE2 no hydrogen 3.209 N/A GLY 28.A N VAL 13.A O no hydrogen 2.730 N/A GLU 29.A N LYS 42.A O no hydrogen 3.064 N/A GLY 30.A N ILE 11.A O no hydrogen 2.976 N/A GLU 31.A N THR 40.A O no hydrogen 2.941 N/A GLY 32.A N VAL 9.A O no hydrogen 2.848 N/A ASP 33.A N LYS 38.A O no hydrogen 2.854 N/A THR 35.A OG1 THR 6.A O no hydrogen 3.352 N/A TYR 36.A N ASP 33.A O no hydrogen 2.939 N/A GLY 37.A N ALA 34.A O no hydrogen 3.078 N/A LYS 38.A N ASP 33.A O no hydrogen 3.147 N/A LEU 39.A N GLU 216.A O no hydrogen 2.864 N/A THR 40.A N GLU 31.A O no hydrogen 2.999 N/A THR 40.A OG1.B GLU 31.A O no hydrogen 3.298 N/A LEU 41.A N LEU 214.A O no hydrogen 2.892 N/A LYS 42.A N GLU 29.A O no hydrogen 2.950 N/A LYS 42.A NZ ASP 204.A OD2 no hydrogen 2.739 N/A LYS 42.A NZ GLU 207.A OE1 no hydrogen 2.710 N/A PHE 43.A N MET 212.A O no hydrogen 2.806 N/A ILE 44.A N SER 27.A O no hydrogen 2.757 N/A CYS 45.A N ASP 210.A O no hydrogen 2.815 N/A CYS 45.A SG SER 25.A O no hydrogen 3.532 N/A CYS 45.A SG THR 47.A OG1 no hydrogen 3.052 N/A CYS 45.A SG GLY 48.A O no hydrogen 3.005 N/A THR 46.A N SER 25.A O no hydrogen 2.881 N/A THR 46.A OG1 SER 25.A O no hydrogen 3.338 N/A LEU 50.A N ASP 210.A OD2 no hydrogen 2.752 N/A TRP 54.A NE1 ASP 210.A OD1 no hydrogen 2.959 N/A THR 56.A N PRO 53.A O no hydrogen 2.961 N/A THR 56.A OG1 PRO 53.A O no hydrogen 2.752 N/A THR 56.A OG1 TYR 100.A OH no hydrogen 2.876 N/A LEU 57.A N TRP 54.A O no hydrogen 2.915 N/A VAL 58.A N PRO 55.A O no hydrogen 3.382 N/A THR 59.A OG1 HIS 175.A NE2 no hydrogen 2.726 N/A LEU 61.A N LEU 57.A O no hydrogen 2.917 N/A PHE 65.A N VAL 62.A O no hydrogen 2.917 N/A SER 66.A N GLN 63.A O no hydrogen 3.149 N/A SER 66.A OG GLN 63.A O no hydrogen 2.777 N/A ARG 67.A N VAL 218.A O no hydrogen 2.898 N/A TYR 68.A OH HIS 193.A NE2 no hydrogen 2.640 N/A MET 72.A N PRO 69.A O no hydrogen 2.739 N/A LYS 73.A N ASP 70.A O no hydrogen 3.251 N/A LYS 73.A NZ ASP 70.A O no hydrogen 3.303 N/A GLN 74.A N GLN 74.A OE1 no hydrogen 2.822 N/A HIS 75.A N MET 72.A O no hydrogen 2.885 N/A ASP 76.A N LYS 73.A O no hydrogen 3.446 N/A LYS 79.A N ASP 76.A OD1 no hydrogen 3.119 N/A LYS 79.A NZ CYS 64.A O no hydrogen 2.995 N/A LYS 79.A NZ SER 66.A O no hydrogen 2.740 N/A LYS 79.A NZ ASP 76.A OD2 no hydrogen 2.840 N/A SER 80.A N ASP 76.A O no hydrogen 3.333 N/A SER 80.A OG PHE 77.A O no hydrogen 2.743 N/A ALA 81.A N PHE 77.A O no hydrogen 3.146 N/A MET 82.A N LYS 79.A O no hydrogen 3.000 N/A GLU 84.A N GLU 84.A OE2 no hydrogen 2.808 N/A GLY 85.A N ALA 81.A O no hydrogen 2.771 N/A TYR 86.A N VAL 106.A O no hydrogen 2.961 N/A VAL 87.A N THR 180.A O no hydrogen 2.779 N/A GLN 88.A N ALA 104.A O no hydrogen 2.886 N/A GLU 89.A N GLN 178.A O no hydrogen 2.869 N/A ARG 90.A N THR 102.A O no hydrogen 3.006 N/A ARG 90.A NE GLN 177.A OE1 no hydrogen 2.864 N/A ARG 90.A NH1 THR 59.A O no hydrogen 2.802 N/A ARG 90.A NH2 GLN 177.A OE1 no hydrogen 2.819 N/A THR 91.A N TYR 176.A O no hydrogen 2.961 N/A ILE 92.A N TYR 100.A O no hydrogen 2.735 N/A SER 93.A N ASP 174.A O no hydrogen 2.894 N/A PHE 94.A N GLY 98.A O no hydrogen 2.966 N/A LYS 95.A N LEU 172.A O no hydrogen 2.916 N/A ASP 97.A N PHE 94.A O no hydrogen 2.932 N/A GLY 98.A N ASP 97.A OD1 no hydrogen 2.831 N/A ASN 99.A N ILE 122.A O no hydrogen 3.025 N/A TYR 100.A N ILE 92.A O no hydrogen 2.877 N/A TYR 100.A OH THR 56.A OG1 no hydrogen 2.876 N/A LYS 101.A N LYS 120.A O no hydrogen 2.794 N/A LYS 101.A NZ THR 91.A OG1 no hydrogen 2.938 N/A THR 102.A N ARG 90.A O no hydrogen 2.947 N/A ARG 103.A N GLU 118.A O no hydrogen 2.990 N/A ARG 103.A NH1 GLU 105.A OE2 no hydrogen 3.068 N/A ALA 104.A N GLN 88.A O no hydrogen 2.761 N/A GLU 105.A N ARG 116.A O no hydrogen 2.886 N/A VAL 106.A N TYR 86.A O no hydrogen 2.949 N/A LYS 107.A N VAL 114.A O no hydrogen 3.030 N/A LYS 107.A NZ GLU 105.A OE1 no hydrogen 2.881 N/A PHE 108.A N PRO 83.A O no hydrogen 3.226 N/A GLU 109.A N THR 112.A O no hydrogen 2.821 N/A THR 112.A N GLU 109.A O no hydrogen 3.110 N/A THR 112.A OG1 ASP 111.A OD1 no hydrogen 2.922 N/A LEU 113.A N PRO 10.A O no hydrogen 2.976 N/A VAL 114.A N LYS 107.A O no hydrogen 2.872 N/A ASN 115.A N LEU 12.A O no hydrogen 2.934 N/A ASN 115.A ND2 THR 60.A O no hydrogen 3.350 N/A ASN 115.A ND2 LEU 61.A O no hydrogen 3.026 N/A ARG 116.A N GLU 105.A O no hydrogen 2.987 N/A ILE 117.A N GLU 14.A O no hydrogen 2.863 N/A GLU 118.A N ARG 103.A O no hydrogen 2.906 N/A LEU 119.A N ASP 16.A O no hydrogen 2.907 N/A LYS 120.A N LYS 101.A O no hydrogen 2.818 N/A GLY 121.A N ASP 18.A O no hydrogen 2.820 N/A ILE 122.A N ASN 99.A O no hydrogen 2.968 N/A PHE 124.A N ASN 20.A OD1 no hydrogen 3.026 N/A LYS 125.A N ASP 97.A OD1 no hydrogen 2.848 N/A LYS 125.A NZ ASP 96.A O no hydrogen 2.728 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.492 N/A GLY 128.A N LYS 125.A O no hydrogen 2.997 N/A GLY 132.A N GLY 128.A O no hydrogen 2.882 N/A HIS 133.A N ILE 130.A O no hydrogen 3.075 N/A LYS 134.A N ASN 129.A O no hydrogen 2.941 N/A LYS 134.A NZ ASP 127.A O no hydrogen 2.922 N/A GLU 136.A N ASN 164.A O no hydrogen 2.865 N/A TYR 137.A OH SER 202.A O no hydrogen 2.577 N/A ASN 138.A N GLU 136.A O no hydrogen 2.920 N/A ASN 138.A ND2 GLU 136.A OE1 no hydrogen 2.845 N/A ASN 140.A ND2 ARG 162.A O no hydrogen 2.716 N/A ASN 140.A ND2 ASN 164.A OD1 no hydrogen 3.195 N/A GLY 142.A N THR 197.A O no hydrogen 3.275 N/A ASN 143.A ND2 TYR 145.A OH no hydrogen 3.095 N/A VAL 144.A N LEU 195.A O no hydrogen 2.777 N/A TYR 145.A N ASN 158.A O no hydrogen 3.179 N/A ILE 146.A N HIS 193.A O no hydrogen 2.897 N/A THR 147.A N LYS 156.A O no hydrogen 2.901 N/A THR 147.A OG1.B ASN 192.A OD1 no hydrogen 2.711 N/A ASP 149.A N GLY 154.A O no hydrogen 2.869 N/A LYS 152.A N ASP 149.A O no hydrogen 2.946 N/A LYS 152.A NZ GLN 178.A OE1 no hydrogen 3.359 N/A ASN 153.A N LYS 150.A O no hydrogen 3.012 N/A GLY 154.A N ASP 149.A O no hydrogen 3.163 N/A ILE 155.A N ASN 179.A O no hydrogen 3.029 N/A LYS 156.A N THR 147.A O no hydrogen 2.923 N/A LYS 156.A NZ TYR 176.A OH no hydrogen 2.898 N/A ALA 157.A N GLN 177.A O no hydrogen 2.891 N/A ASN 158.A N TYR 145.A O no hydrogen 3.047 N/A PHE 159.A N HIS 175.A O no hydrogen 3.132 N/A LYS 160.A NZ ASP 174.A OD1 no hydrogen 2.500 N/A ILE 161.A N ALA 173.A O no hydrogen 2.953 N/A HIS 163.A N GLN 171.A O no hydrogen 2.856 N/A ASN 164.A ND2 ASN 138.A OD1 no hydrogen 2.864 N/A ASN 164.A ND2 ASN 140.A OD1 no hydrogen 3.219 N/A ILE 165.A N SER 169.A O no hydrogen 2.959 N/A GLU 166.A N LYS 134.A O no hydrogen 2.960 N/A GLY 168.A N ILE 165.A O no hydrogen 2.916 N/A SER 169.A N ASP 167.A OD1 no hydrogen 2.802 N/A GLN 171.A N HIS 163.A O no hydrogen 2.790 N/A ALA 173.A N ILE 161.A O no hydrogen 2.748 N/A ASP 174.A N SER 93.A O no hydrogen 2.879 N/A HIS 175.A N PHE 159.A O no hydrogen 2.813 N/A HIS 175.A ND1 ALA 173.A O no hydrogen 2.947 N/A HIS 175.A NE2 THR 59.A OG1 no hydrogen 2.726 N/A TYR 176.A N THR 91.A O no hydrogen 3.051 N/A GLN 177.A N ALA 157.A O no hydrogen 2.882 N/A GLN 177.A NE2 GLN 63.A OE1 no hydrogen 2.781 N/A GLN 177.A NE2 ASN 179.A OD1 no hydrogen 2.908 N/A GLN 178.A N GLU 89.A O no hydrogen 2.880 N/A ASN 179.A N ILE 155.A O no hydrogen 2.865 N/A ASN 179.A ND2 GLN 88.A OE1 no hydrogen 2.954 N/A THR 180.A N VAL 87.A O no hydrogen 3.006 N/A ILE 182.A N GLY 85.A O no hydrogen 2.879 N/A LEU 188.A N SER 80.A OG no hydrogen 2.927 N/A ASP 191.A N HIS 75.A ND1 no hydrogen 2.970 N/A HIS 193.A N ILE 146.A O no hydrogen 3.278 N/A HIS 193.A ND1 ASP 191.A O no hydrogen 2.831 N/A HIS 193.A NE2 TYR 68.A OH no hydrogen 2.640 N/A TYR 194.A N ALA 221.A O no hydrogen 3.025 N/A LEU 195.A N VAL 144.A O no hydrogen 2.904 N/A SER 196.A N THR 219.A O no hydrogen 2.756 N/A THR 197.A N GLY 142.A O no hydrogen 2.947 N/A THR 197.A OG1 GLY 142.A O no hydrogen 3.202 N/A GLN 198.A N PHE 217.A O no hydrogen 2.876 N/A SER 199.A OG GLU 216.A OE1 no hydrogen 2.442 N/A ALA 200.A N LEU 215.A O no hydrogen 2.835 N/A SER 202.A N VAL 213.A O no hydrogen 2.902 N/A LYS 203.A NZ HIS 211.A O no hydrogen 2.769 N/A ASP 204.A N HIS 211.A NE2 no hydrogen 3.103 N/A ASN 206.A N ASP 204.A OD1 no hydrogen 3.211 N/A GLU 207.A N ASP 204.A O no hydrogen 2.841 N/A ARG 209.A N GLU 207.A OE2 no hydrogen 2.820 N/A ARG 209.A NE GLU 207.A OE2 no hydrogen 2.617 N/A ARG 209.A NH2 GLU 207.A OE1 no hydrogen 2.782 N/A ARG 209.A NH2 GLU 207.A OE2 no hydrogen 3.498 N/A HIS 211.A ND1 ARG 209.A O no hydrogen 2.619 N/A MET 212.A N PHE 43.A O no hydrogen 2.925 N/A VAL 213.A N SER 202.A O no hydrogen 3.013 N/A LEU 214.A N LEU 41.A O no hydrogen 2.846 N/A LEU 215.A N ALA 200.A O no hydrogen 2.963 N/A GLU 216.A N LEU 39.A O no hydrogen 2.917 N/A PHE 217.A N GLN 198.A O no hydrogen 2.921 N/A VAL 218.A N GLY 37.A O no hydrogen 2.813 N/A THR 219.A N SER 196.A O no hydrogen 2.913 N/A ALA 220.A N ARG 67.A O no hydrogen 2.869 N/A ALA 221.A N TYR 194.A O no hydrogen 2.813 N/A