Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tbt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N LEU 103.A O no hydrogen 3.155 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.580 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.908 N/A MET 5.A N CYS 101.A O no hydrogen 2.984 N/A ARG 6.A N TYR 27.A O no hydrogen 3.009 N/A ARG 6.A NH1 MET 5.A O no hydrogen 2.922 N/A ARG 6.A NH1 CYS 101.A O no hydrogen 3.236 N/A ARG 6.A NH1 ASP 102.A OD1 no hydrogen 2.979 N/A ARG 6.A NH2 ASP 102.A OD1 no hydrogen 2.907 N/A ARG 6.A NH2 ASP 102.A OD2 no hydrogen 3.499 N/A TYR 7.A N SER 99.A O no hydrogen 2.931 N/A PHE 8.A N VAL 25.A O no hydrogen 2.886 N/A GLU 9.A N GLN 97.A O no hydrogen 2.798 N/A THR 10.A N ILE 23.A O no hydrogen 2.768 N/A ALA 11.A N LEU 95.A O no hydrogen 2.873 N/A VAL 12.A N ARG 21.A O no hydrogen 2.975 N/A SER 13.A N HIS 93.A O no hydrogen 2.864 N/A ARG 21.A N VAL 12.A O no hydrogen 3.025 N/A ARG 21.A NE ASP 37.A OD1 no hydrogen 3.021 N/A ARG 21.A NH2 ASP 37.A OD1 no hydrogen 3.241 N/A ARG 21.A NH2 ASP 37.A OD2 no hydrogen 2.765 N/A TYR 22.A N SER 38.A OG no hydrogen 3.030 N/A TYR 22.A OH GLU 9.A OE1 no hydrogen 2.636 N/A ILE 23.A N THR 10.A O no hydrogen 2.828 N/A SER 24.A N PHE 36.A O no hydrogen 2.879 N/A SER 24.A OG TYR 45.A OH no hydrogen 2.541 N/A VAL 25.A N PHE 8.A O no hydrogen 2.993 N/A GLY 26.A N VAL 34.A O no hydrogen 2.970 N/A TYR 27.A N ARG 6.A O no hydrogen 2.823 N/A VAL 28.A N LYS 31.A O no hydrogen 2.889 N/A ASP 29.A N SER 4.A O no hydrogen 2.781 N/A LYS 31.A N VAL 28.A O no hydrogen 2.826 N/A PHE 33.A N GLY 26.A O no hydrogen 2.857 N/A ARG 35.A N GLU 46.A O no hydrogen 3.140 N/A ARG 35.A NH1 GLU 32.A OE2 no hydrogen 3.154 N/A PHE 36.A N SER 24.A O no hydrogen 2.934 N/A SER 38.A N TYR 22.A O no hydrogen 3.024 N/A SER 38.A OG TYR 22.A O no hydrogen 3.468 N/A ASP 39.A N ASP 37.A OD1 no hydrogen 3.184 N/A ALA 40.A N ASP 37.A O no hydrogen 3.019 N/A TYR 45.A N THR 64.A OG1 no hydrogen 3.162 N/A TYR 45.A OH SER 24.A OG no hydrogen 2.541 N/A GLU 46.A N ARG 35.A O no hydrogen 2.857 N/A ARG 48.A N PHE 33.A O no hydrogen 2.734 N/A MET 52.A N ALA 49.A O no hydrogen 3.164 N/A GLU 53.A N PRO 50.A O no hydrogen 3.054 N/A GLU 55.A N MET 52.A O no hydrogen 2.985 N/A TYR 59.A N GLY 56.A O no hydrogen 3.125 N/A TYR 59.A OH TYR 171.A OH no hydrogen 2.660 N/A TRP 60.A NE1 GLU 55.A O no hydrogen 3.042 N/A GLU 61.A N PRO 57.A O no hydrogen 3.097 N/A ARG 62.A N GLU 58.A O no hydrogen 3.144 N/A GLU 63.A N TYR 59.A O no hydrogen 3.104 N/A THR 64.A N TRP 60.A O no hydrogen 3.033 N/A THR 64.A OG1 TRP 60.A O no hydrogen 2.876 N/A GLN 65.A N GLU 61.A O no hydrogen 3.189 N/A LYS 66.A N ARG 62.A O no hydrogen 2.968 N/A LYS 66.A NZ GLU 63.A OE2 no hydrogen 2.764 N/A ALA 67.A N GLU 63.A O no hydrogen 3.008 N/A LYS 68.A N THR 64.A O no hydrogen 3.175 N/A GLY 69.A N GLN 65.A O no hydrogen 2.994 N/A GLN 70.A N LYS 66.A O no hydrogen 2.860 N/A GLN 70.A NE2 GLU 9.A OE1 no hydrogen 2.722 N/A GLN 70.A NE2 GLU 9.A OE2 no hydrogen 3.236 N/A GLU 71.A N ALA 67.A O no hydrogen 2.881 N/A GLN 72.A N LYS 68.A O no hydrogen 3.154 N/A TRP 73.A N GLY 69.A O no hydrogen 3.008 N/A PHE 74.A N GLN 70.A O no hydrogen 2.771 N/A ARG 75.A N GLU 71.A O no hydrogen 3.117 N/A ARG 75.A NH1 GLN 72.A OE1 no hydrogen 3.042 N/A VAL 76.A N GLN 72.A O no hydrogen 3.094 N/A SER 77.A N TRP 73.A O no hydrogen 2.989 N/A SER 77.A OG TRP 73.A O no hydrogen 2.618 N/A LEU 78.A N PHE 74.A O no hydrogen 2.903 N/A ARG 79.A N ARG 75.A O no hydrogen 3.039 N/A ASN 80.A N VAL 76.A O no hydrogen 2.930 N/A LEU 81.A N SER 77.A O no hydrogen 2.797 N/A LEU 82.A N LEU 78.A O no hydrogen 3.014 N/A GLY 83.A N ARG 79.A O no hydrogen 3.369 N/A TYR 84.A N ASN 80.A O no hydrogen 2.935 N/A TYR 85.A N LEU 81.A O no hydrogen 3.034 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.665 N/A ASN 86.A N GLY 83.A O no hydrogen 3.337 N/A GLN 87.A N LEU 82.A O no hydrogen 3.037 N/A GLN 87.A NE2 GLU 119.A OE2 no hydrogen 2.906 N/A HIS 93.A N SER 13.A O no hydrogen 2.984 N/A HIS 93.A ND1 GLU 119.A OE2 no hydrogen 2.706 N/A THR 94.A N GLU 119.A OE1 no hydrogen 3.340 N/A LEU 95.A N ALA 11.A O no hydrogen 2.894 N/A GLN 96.A N ALA 117.A O no hydrogen 2.949 N/A GLN 97.A N GLU 9.A O no hydrogen 2.763 N/A MET 98.A N GLN 115.A O no hydrogen 2.964 N/A SER 99.A N TYR 7.A O no hydrogen 3.084 N/A SER 99.A OG GLN 97.A OE1 no hydrogen 3.034 N/A GLY 100.A N TYR 113.A O no hydrogen 3.082 N/A CYS 101.A N MET 5.A O no hydrogen 3.077 N/A ASP 102.A N ARG 111.A O no hydrogen 2.910 N/A LEU 103.A N HIS 3.A O no hydrogen 2.746 N/A GLY 104.A N ARG 108.A O no hydrogen 2.729 N/A TRP 107.A N GLY 104.A O no hydrogen 2.717 N/A ARG 108.A N ASP 106.A OD1 no hydrogen 2.800 N/A LEU 110.A N ASP 102.A O no hydrogen 2.606 N/A ARG 111.A N ASP 102.A O no hydrogen 3.328 N/A TYR 113.A N GLY 100.A O no hydrogen 3.000 N/A TYR 113.A OH ASP 102.A OD2 no hydrogen 2.691 N/A GLN 115.A N MET 98.A O no hydrogen 2.884 N/A PHE 116.A N ILE 124.A O no hydrogen 2.847 N/A ALA 117.A N GLN 96.A O no hydrogen 3.031 N/A TYR 118.A N ARG 121.A O no hydrogen 2.779 N/A TYR 118.A OH GLN 87.A OE1 no hydrogen 2.632 N/A GLU 119.A N THR 94.A O no hydrogen 3.112 N/A ARG 121.A N TYR 118.A O no hydrogen 2.962 N/A TYR 123.A N PHE 116.A O no hydrogen 2.921 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.817 N/A ALA 125.A N THR 134.A O no hydrogen 2.954 N/A LEU 126.A N LEU 114.A O no hydrogen 2.810 N/A ASN 127.A N THR 132.A O no hydrogen 2.778 N/A ASN 127.A ND2 THR 132.A OG1 no hydrogen 2.899 N/A LEU 130.A N ASN 127.A O no hydrogen 2.821 N/A LYS 131.A N ASP 129.A OD1 no hydrogen 2.819 N/A THR 132.A N ASP 129.A OD1 no hydrogen 3.073 N/A THR 132.A OG1 ASP 129.A OD1 no hydrogen 3.332 N/A THR 132.A OG1 ASP 129.A OD2 no hydrogen 2.786 N/A THR 134.A N ALA 125.A O no hydrogen 2.864 N/A THR 134.A OG1 ASN 127.A OD1 no hydrogen 2.509 N/A GLN 141.A N MET 138.A O no hydrogen 3.145 N/A GLN 141.A NE2 ALA 135.A O no hydrogen 2.673 N/A GLN 141.A NE2 ALA 136.A O no hydrogen 3.515 N/A GLN 141.A NE2 ASP 137.A O no hydrogen 2.780 N/A ILE 142.A N ALA 139.A O no hydrogen 3.360 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.817 N/A ARG 144.A N ALA 140.A O no hydrogen 3.068 N/A ARG 144.A NH1 GLU 148.A OE2 no hydrogen 3.545 N/A ARG 145.A N GLN 141.A O no hydrogen 2.924 N/A LYS 146.A N ILE 142.A O no hydrogen 3.032 N/A TRP 147.A N THR 143.A O no hydrogen 2.903 N/A GLU 148.A N ARG 144.A O no hydrogen 2.892 N/A GLN 149.A N ARG 145.A O no hydrogen 2.928 N/A SER 150.A N LYS 146.A O no hydrogen 2.960 N/A SER 150.A OG LYS 146.A O no hydrogen 3.350 N/A ALA 152.A N TRP 147.A O no hydrogen 3.186 N/A GLU 154.A N GLY 151.A O no hydrogen 3.305 N/A TYR 156.A N ALA 152.A O no hydrogen 3.080 N/A LYS 157.A N ALA 153.A O no hydrogen 2.811 N/A LYS 157.A NZ GLU 161.A OE1 no hydrogen 3.183 N/A ALA 158.A N GLU 154.A O no hydrogen 2.904 N/A TYR 159.A N HIS 155.A O no hydrogen 3.158 N/A LEU 160.A N TYR 156.A O no hydrogen 2.976 N/A GLU 161.A N LYS 157.A O no hydrogen 2.910 N/A GLY 162.A N ALA 158.A O no hydrogen 2.951 N/A CYS 164.A N TYR 159.A O no hydrogen 2.980 N/A GLU 166.A N GLY 162.A O no hydrogen 2.774 N/A TRP 167.A N GLU 163.A O no hydrogen 2.774 N/A LEU 168.A N CYS 164.A O no hydrogen 3.071 N/A HIS 169.A N VAL 165.A O no hydrogen 2.896 N/A HIS 169.A NE2 TRP 107.A O no hydrogen 2.850 N/A ARG 170.A N GLU 166.A O no hydrogen 3.295 N/A ARG 170.A NE GLU 55.A OE2 no hydrogen 2.694 N/A ARG 170.A NH2 GLU 55.A OE2 no hydrogen 3.354 N/A TYR 171.A N TRP 167.A O no hydrogen 3.009 N/A TYR 171.A OH TYR 59.A OH no hydrogen 2.660 N/A LEU 172.A N LEU 168.A O no hydrogen 2.963 N/A LYS 173.A N HIS 169.A O no hydrogen 3.091 N/A ASN 174.A N ARG 170.A O no hydrogen 3.050 N/A GLY 175.A N TYR 171.A O no hydrogen 2.965 N/A ASP 179.A N TYR 203.A O no hydrogen 2.776 N/A SER 180.A OG GLY 253.A O no hydrogen 3.030 N/A LYS 182.A N LEU 200.A O no hydrogen 2.969 N/A HIS 184.A N TRP 198.A O no hydrogen 3.114 N/A THR 186.A N ARG 196.A O no hydrogen 3.070 N/A THR 186.A OG1 ARG 196.A O no hydrogen 3.157 N/A HIS 188.A N THR 194.A O no hydrogen 2.953 N/A ARG 190.A N GLU 192.A O no hydrogen 3.233 N/A ARG 190.A NE SER 191.A OG no hydrogen 2.437 N/A SER 191.A OG GLU 192.A OE1 no hydrogen 3.382 N/A VAL 193.A N VAL 237.A O no hydrogen 2.557 N/A THR 194.A N HIS 188.A O no hydrogen 2.820 N/A LEU 195.A N VAL 235.A O no hydrogen 3.320 N/A ARG 196.A N THR 186.A O no hydrogen 3.220 N/A ARG 196.A NH1 SER 234.A OG no hydrogen 3.219 N/A CYS 197.A N ALA 233.A O no hydrogen 2.655 N/A TRP 198.A N HIS 184.A O no hydrogen 2.880 N/A ALA 199.A N LYS 231.A O no hydrogen 2.969 N/A LEU 200.A N LYS 182.A O no hydrogen 3.015 N/A TYR 203.A N ASP 179.A O no hydrogen 2.841 N/A THR 208.A N TYR 250.A O no hydrogen 3.157 N/A THR 210.A N ARG 248.A O no hydrogen 3.199 N/A TRP 211.A NE1 ALA 233.A O no hydrogen 2.988 N/A GLN 212.A N THR 246.A O no hydrogen 2.661 N/A GLU 215.A N GLU 214.A OE1 no hydrogen 3.121 N/A GLU 217.A N SER 234.A O no hydrogen 3.139 N/A VAL 219.A N TRP 232.A O no hydrogen 3.323 N/A ARG 222.A N GLN 230.A O no hydrogen 3.158 N/A ARG 222.A NH1 GLN 230.A OE1 no hydrogen 3.185 N/A ALA 224.A N THR 228.A O no hydrogen 2.947 N/A THR 228.A N ASP 226.A OD1 no hydrogen 2.700 N/A THR 228.A OG1 ASP 226.A OD1 no hydrogen 2.460 N/A THR 228.A OG1 ASP 226.A OD2 no hydrogen 3.373 N/A PHE 229.A N PHE 202.A O no hydrogen 2.984 N/A GLN 230.A N ARG 222.A O no hydrogen 2.896 N/A LYS 231.A N ALA 199.A O no hydrogen 3.145 N/A LYS 231.A NZ VAL 219.A O no hydrogen 2.513 N/A LYS 231.A NZ THR 221.A OG1 no hydrogen 3.397 N/A ALA 233.A N CYS 197.A O no hydrogen 2.941 N/A SER 234.A N GLU 217.A O no hydrogen 2.799 N/A SER 234.A OG GLU 217.A O no hydrogen 3.540 N/A VAL 235.A N LEU 195.A O no hydrogen 3.037 N/A VAL 237.A N VAL 193.A O no hydrogen 3.000 N/A GLY 240.A N GLU 242.A OE1 no hydrogen 3.184 N/A GLN 243.A NE2 TRP 262.A O no hydrogen 3.137 N/A THR 246.A N GLN 212.A O no hydrogen 2.882 N/A THR 246.A OG1 GLN 212.A O no hydrogen 2.863 N/A CYS 247.A N LEU 260.A O no hydrogen 3.008 N/A CYS 247.A SG THR 210.A O no hydrogen 3.597 N/A ARG 248.A N THR 210.A O no hydrogen 2.938 N/A ARG 248.A NE GLN 212.A OE1 no hydrogen 3.034 N/A TYR 250.A N THR 208.A O no hydrogen 2.951 N/A HIS 251.A NE2 PRO 204.A O no hydrogen 2.806 N/A GLY 253.A N HIS 251.A ND1 no hydrogen 3.096 N/A LEU 254.A N HIS 251.A O no hydrogen 3.043 N/A LEU 258.A N VAL 249.A O no hydrogen 2.983 N/A LEU 260.A N CYS 247.A O no hydrogen 3.253 N/A