Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1kyt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A ND1 ASP 162.A OD1 no hydrogen 2.993 N/A ARG 3.A N.A GLU 163.A O no hydrogen 2.774 N/A ARG 3.A N.B GLU 163.A O no hydrogen 2.781 N/A LEU 4.A N GLU 163.A O no hydrogen 3.218 N/A ALA 5.A N THR 37.A O no hydrogen 2.932 N/A ALA 6.A N LEU 165.A O no hydrogen 2.795 N/A ILE 7.A N SER 39.A O no hydrogen 2.817 N/A ASP 8.A N ILE 167.A O no hydrogen 3.115 N/A VAL 9.A N LEU 41.A O no hydrogen 2.897 N/A GLY 11.A N ASP 8.A OD1 no hydrogen 3.109 N/A ASN 12.A N ASP 8.A O no hydrogen 3.009 N/A ASN 12.A ND2 ASP 8.A O no hydrogen 3.578 N/A LEU 13.A N VAL 9.A O no hydrogen 2.898 N/A THR 14.A OG1 ASP 10.A O no hydrogen 3.111 N/A ASP 15.A N LEU 19.A O no hydrogen 2.893 N/A ASP 17.A N ASP 15.A OD1 no hydrogen 2.755 N/A ARG 18.A N ASP 15.A O no hydrogen 2.943 N/A LEU 19.A N ASP 15.A OD1 no hydrogen 3.055 N/A SER 21.A N LEU 13.A O no hydrogen 2.824 N/A LYS 23.A NZ GLU 205.A OE1 no hydrogen 2.934 N/A ALA 24.A N SER 21.A OG no hydrogen 3.221 N/A ILE 25.A N SER 21.A O no hydrogen 3.127 N/A GLU 26.A N THR 22.A O no hydrogen 2.949 N/A SER 27.A N LYS 23.A O no hydrogen 2.803 N/A SER 27.A OG LYS 23.A O no hydrogen 3.026 N/A ILE 28.A N ALA 24.A O no hydrogen 2.911 N/A ARG 29.A N ILE 25.A O no hydrogen 2.978 N/A ARG 29.A NE LEU 56.A O no hydrogen 2.784 N/A ARG 29.A NH2 LEU 56.A O no hydrogen 3.156 N/A SER 30.A N GLU 26.A O no hydrogen 2.906 N/A SER 30.A OG GLU 26.A O no hydrogen 3.101 N/A ALA 31.A N SER 27.A O no hydrogen 2.942 N/A GLU 32.A N ILE 28.A O no hydrogen 2.802 N/A LYS 33.A N ARG 29.A O no hydrogen 2.940 N/A LYS 34.A N ALA 31.A O no hydrogen 2.955 N/A GLY 35.A N GLU 32.A O no hydrogen 3.018 N/A LEU 36.A N ALA 31.A O no hydrogen 3.341 N/A THR 37.A N ARG 3.A O.A no hydrogen 3.001 N/A THR 37.A N ARG 3.A O.B no hydrogen 3.025 N/A VAL 38.A N ASN 59.A OD1 no hydrogen 2.831 N/A SER 39.A N ALA 5.A O no hydrogen 2.892 N/A SER 39.A OG PRO 61.A O no hydrogen 2.787 N/A LEU 41.A N ILE 7.A O no hydrogen 2.878 N/A SER 42.A N PHE 63.A O no hydrogen 3.034 N/A SER 42.A OG ASP 10.A OD1 no hydrogen 2.901 N/A ASN 44.A N SER 42.A OG no hydrogen 2.843 N/A VAL 45.A N ASN 44.A OD1 no hydrogen 2.876 N/A VAL 48.A N VAL 45.A O no hydrogen 2.870 N/A VAL 49.A N VAL 45.A O no hydrogen 3.173 N/A TYR 50.A N ILE 46.A O no hydrogen 2.790 N/A ALA 51.A N PRO 47.A O no hydrogen 3.067 N/A LEU 52.A N VAL 48.A O no hydrogen 3.257 N/A LYS 53.A N VAL 49.A O no hydrogen 2.967 N/A LYS 53.A NZ ILE 58.A O no hydrogen 2.896 N/A LYS 53.A NZ GLY 60.A O no hydrogen 2.859 N/A ILE 54.A N TYR 50.A O no hydrogen 3.084 N/A PHE 55.A N ALA 51.A O no hydrogen 3.026 N/A LEU 56.A N LEU 52.A O no hydrogen 2.777 N/A GLY 57.A N LYS 53.A O no hydrogen 2.962 N/A ILE 58.A N LYS 53.A O no hydrogen 2.906 N/A ASN 59.A N GLU 32.A OE2 no hydrogen 2.957 N/A ASN 59.A ND2 LEU 36.A O no hydrogen 3.059 N/A VAL 62.A N PHE 70.A O no hydrogen 3.204 N/A PHE 63.A N LEU 40.A O no hydrogen 2.826 N/A GLY 64.A N ILE 69.A O no hydrogen 2.853 N/A GLU 65.A N ASN 44.A O no hydrogen 2.917 N/A ASN 66.A N SER 42.A O no hydrogen 2.840 N/A GLY 67.A N GLY 64.A O no hydrogen 3.008 N/A GLY 68.A N GLU 65.A O no hydrogen 3.284 N/A ILE 69.A N GLY 64.A O no hydrogen 3.448 N/A ASP 71.A N SER 75.A O no hydrogen 2.805 N/A ASN 72.A N ASP 71.A OD1 no hydrogen 3.049 N/A ASN 72.A ND2 TYR 157.A OH no hydrogen 3.428 N/A GLY 74.A N ASP 71.A O no hydrogen 3.308 N/A SER 75.A N ASP 73.A OD1 no hydrogen 2.985 N/A SER 75.A OG ASP 73.A OD1 no hydrogen 2.768 N/A SER 75.A OG ASP 73.A OD2 no hydrogen 3.415 N/A LYS 78.A NZ GLU 106.A O no hydrogen 2.847 N/A PHE 79.A N GLY 68.A O no hydrogen 2.885 N/A SER 81.A OG GLU 83.A OE2.B no hydrogen 3.213 N/A THR 85.A OG1 ASN 82.A O no hydrogen 3.209 N/A THR 85.A OG1 THR 109.A OG1 no hydrogen 2.683 N/A ASN 86.A N ASN 82.A O no hydrogen 2.804 N/A LYS 87.A N GLU 83.A O.A no hydrogen 3.326 N/A LYS 87.A N GLU 83.A O.B no hydrogen 3.382 N/A LYS 87.A NZ GLU 91.A OE2 no hydrogen 2.868 N/A PHE 88.A N GLY 84.A O no hydrogen 2.961 N/A LEU 89.A N THR 85.A O no hydrogen 3.044 N/A GLU 90.A N ASN 86.A O no hydrogen 3.055 N/A GLU 91.A N LYS 87.A O no hydrogen 3.106 N/A SER 92.A OG LEU 89.A O no hydrogen 3.135 N/A SER 92.A OG GLU 90.A O no hydrogen 2.807 N/A LYS 93.A N GLU 91.A O no hydrogen 2.886 N/A ARG 94.A NE TYR 120.A OH no hydrogen 2.999 N/A ARG 94.A NH2 TYR 120.A OH no hydrogen 2.571 N/A SER 96.A N ASP 117.A OD2 no hydrogen 2.930 N/A SER 96.A OG ASP 117.A OD2 no hydrogen 2.671 N/A ARG 97.A NH1 THR 95.A O no hydrogen 2.741 N/A ARG 97.A NH2 THR 95.A O no hydrogen 3.535 N/A ASN 102.A N ILE 99.A O no hydrogen 3.040 N/A ASN 102.A ND2 SER 98.A OG no hydrogen 3.062 N/A ASN 102.A ND2 GLY 110.A O no hydrogen 2.875 N/A ARG 103.A N LEU 100.A O no hydrogen 3.103 N/A TRP 104.A N THR 101.A O no hydrogen 3.073 N/A ARG 105.A N ASN 102.A O no hydrogen 3.082 N/A ARG 105.A NH1 THR 101.A OG1 no hydrogen 2.995 N/A ARG 105.A NH1 ASN 102.A OD1 no hydrogen 2.992 N/A ARG 105.A NH2 GLY 43.A O no hydrogen 3.093 N/A GLU 106.A N GLU 65.A OE2 no hydrogen 2.756 N/A ALA 107.A N GLU 65.A OE1 no hydrogen 2.798 N/A ALA 107.A N GLU 65.A OE2 no hydrogen 3.305 N/A SER 108.A OG GLU 65.A OE1 no hydrogen 2.672 N/A THR 109.A N LEU 141.A O no hydrogen 3.167 N/A THR 109.A OG1 THR 85.A OG1 no hydrogen 2.683 N/A THR 109.A OG1 ASN 86.A OD1 no hydrogen 2.814 N/A GLY 110.A N ASN 102.A OD1 no hydrogen 2.928 N/A PHE 111.A N TRP 139.A O no hydrogen 2.941 N/A ASP 112.A N ARG 97.A O no hydrogen 2.845 N/A ASP 114.A N SER 96.A OG no hydrogen 2.719 N/A GLU 116.A N GLU 116.A OE1 no hydrogen 2.765 N/A ASP 117.A N ASP 114.A O no hydrogen 2.917 N/A VAL 118.A N PRO 115.A O no hydrogen 3.303 N/A VAL 121.A N ASP 117.A O no hydrogen 3.080 N/A ARG 122.A N VAL 118.A O no hydrogen 2.922 N/A ARG 122.A NH2 ILE 132.A O no hydrogen 3.033 N/A LYS 123.A N ASP 119.A O no hydrogen 3.281 N/A GLU 124.A N TYR 120.A O no hydrogen 3.050 N/A ALA 125.A N VAL 121.A O no hydrogen 2.722 N/A GLU 126.A N ARG 122.A O no hydrogen 2.858 N/A SER 127.A N LYS 123.A O no hydrogen 3.064 N/A SER 127.A OG LYS 123.A O no hydrogen 3.476 N/A SER 127.A OG GLU 124.A O no hydrogen 2.658 N/A ARG 128.A N ALA 125.A O no hydrogen 2.902 N/A ARG 128.A NH2 GLU 91.A OE1 no hydrogen 3.037 N/A GLY 129.A N GLU 126.A O no hydrogen 2.940 N/A PHE 130.A N ALA 125.A O no hydrogen 2.954 N/A PHE 133.A N HIS 140.A O no hydrogen 3.264 N/A TYR 134.A OH GLY 136.A O no hydrogen 3.064 N/A SER 135.A N SER 138.A O no hydrogen 2.935 N/A SER 138.A N SER 135.A O no hydrogen 3.372 N/A SER 138.A OG TRP 139.A O no hydrogen 3.059 N/A TRP 139.A N PHE 111.A O no hydrogen 3.052 N/A HIS 140.A N PHE 133.A O no hydrogen 2.738 N/A LEU 141.A N THR 109.A O no hydrogen 2.735 N/A ASN 142.A N GLU 145.A OE1 no hydrogen 2.955 N/A ASN 142.A ND2 SER 81.A O no hydrogen 3.311 N/A ASN 142.A ND2 ALA 107.A O no hydrogen 3.700 N/A ASN 142.A ND2 GLU 145.A OE1 no hydrogen 3.067 N/A ARG 143.A N GLY 129.A O no hydrogen 3.234 N/A GLU 145.A N ASN 142.A O no hydrogen 2.934 N/A LYS 147.A NZ ASN 172.A O no hydrogen 3.075 N/A LYS 147.A NZ ASP 173.A OD1 no hydrogen 3.065 N/A PHE 149.A N ASP 146.A OD1 no hydrogen 2.952 N/A ALA 150.A N ASP 146.A O no hydrogen 3.231 N/A VAL 151.A N LYS 147.A O no hydrogen 2.823 N/A ASN 152.A N ALA 148.A O no hydrogen 2.911 N/A LYS 153.A N PHE 149.A O no hydrogen 2.984 N/A LEU 154.A N ALA 150.A O no hydrogen 3.059 N/A LYS 155.A N VAL 151.A O no hydrogen 2.953 N/A GLU 156.A N ASN 152.A O no hydrogen 3.132 N/A SER 158.A N GLU 156.A O no hydrogen 3.355 N/A LEU 159.A N LYS 155.A O no hydrogen 2.966 N/A GLU 160.A N GLU 163.A OE1 no hydrogen 2.704 N/A TYR 161.A OH ASN 152.A OD1 no hydrogen 2.638 N/A GLU 163.A N GLU 160.A O no hydrogen 2.930 N/A ILE 164.A N TYR 161.A O no hydrogen 2.932 N/A LEU 165.A N LEU 4.A O no hydrogen 2.830 N/A VAL 166.A N ARG 180.A O no hydrogen 2.806 N/A ILE 167.A N ALA 6.A O no hydrogen 3.029 N/A ASP 169.A N ASP 173.A OD2 no hydrogen 2.635 N/A SER 170.A N ASP 173.A OD2 no hydrogen 2.833 N/A SER 170.A OG ASP 169.A OD1 no hydrogen 3.318 N/A SER 170.A OG ASN 172.A OD1 no hydrogen 3.232 N/A ASN 172.A ND2 TYR 134.A O no hydrogen 2.931 N/A ASP 173.A N SER 170.A O no hydrogen 2.887 N/A GLN 176.A NE2 PRO 174.A O no hydrogen 2.742 N/A ARG 180.A N ILE 164.A O no hydrogen 2.730 N/A ARG 180.A NE ASP 162.A OD2 no hydrogen 2.697 N/A ARG 180.A NH2 HIS 1.A O no hydrogen 2.706 N/A ARG 180.A NH2 ASP 162.A OD1 no hydrogen 3.150 N/A ARG 180.A NH2 ASP 162.A OD2 no hydrogen 3.138 N/A LYS 181.A N ASP 196.A OD2 no hydrogen 2.970 N/A LYS 181.A NZ PHE 175.A O no hydrogen 2.633 N/A LYS 181.A NZ VAL 179.A O no hydrogen 3.151 N/A ALA 182.A N VAL 166.A O no hydrogen 3.110 N/A CYS 183.A N PHE 197.A O no hydrogen 3.069 N/A CYS 183.A SG PRO 184.A O no hydrogen 3.914 N/A CYS 183.A SG SER 195.A OG no hydrogen 3.270 N/A ALA 185.A N TYR 201.A O no hydrogen 2.863 N/A ASN 186.A N SER 202.A OG no hydrogen 3.042 N/A ALA 187.A N PRO 184.A O no hydrogen 3.124 N/A THR 188.A N ASP 169.A O no hydrogen 3.094 N/A LYS 192.A N THR 188.A O no hydrogen 3.048 N/A LYS 192.A NZ ALA 185.A O no hydrogen 2.842 N/A ALA 193.A N ASP 189.A O no hydrogen 2.881 N/A VAL 194.A N ILE 191.A O no hydrogen 3.338 N/A SER 195.A N LYS 192.A O no hydrogen 3.059 N/A SER 195.A OG ILE 191.A O no hydrogen 2.636 N/A ASP 196.A N LYS 181.A O no hydrogen 2.768 N/A PHE 197.A N LYS 181.A O no hydrogen 3.193 N/A SER 199.A N CYS 183.A O no hydrogen 2.919 N/A SER 199.A OG TYR 201.A O no hydrogen 3.543 N/A SER 199.A OG GLN 209.A OE1 no hydrogen 2.586 N/A ASP 200.A N GLN 209.A OE1 no hydrogen 2.932 N/A TYR 201.A N SER 199.A OG no hydrogen 3.097 N/A SER 202.A OG ASN 186.A OD1 no hydrogen 3.250 N/A GLY 204.A N GLU 206.A OE1 no hydrogen 2.740 N/A GLU 205.A N SER 202.A O no hydrogen 3.155 N/A GLU 206.A N GLU 206.A OE1 no hydrogen 2.796 N/A ILE 207.A N GLY 204.A O no hydrogen 3.437 N/A GLN 209.A NE2 ASP 200.A OD2 no hydrogen 2.782 N/A ILE 210.A N GLU 206.A O no hydrogen 2.788 N/A PHE 211.A N ILE 207.A O no hydrogen 2.922 N/A LYS 212.A N GLY 208.A O no hydrogen 3.030 N/A HIS 213.A N GLN 209.A O no hydrogen 2.932 N/A PHE 214.A N ILE 210.A O no hydrogen 3.074 N/A GLU 215.A N LYS 212.A O no hydrogen 3.147 N/A LEU 216.A N PHE 211.A O no hydrogen 2.686 N/A