Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3tzb_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLY 34.A O no hydrogen 2.817 N/A LYS 5.A N ASP 96.A OD2 no hydrogen 2.927 N/A VAL 6.A N THR 36.A O no hydrogen 2.785 N/A LEU 7.A N LEU 97.A O no hydrogen 2.885 N/A ILE 8.A N THR 38.A O no hydrogen 2.801 N/A VAL 9.A N ILE 99.A O no hydrogen 2.752 N/A TYR 10.A N SER 40.A O no hydrogen 2.912 N/A ALA 11.A N GLN 101.A O no hydrogen 2.989 N/A GLN 13.A N GLN 13.A OE1 no hydrogen 2.766 N/A GLN 13.A NE2 TYR 105.A OH no hydrogen 3.058 N/A GLU 14.A N HIS 12.A ND1 no hydrogen 3.060 N/A LYS 16.A N GLU 14.A OE2 no hydrogen 3.016 N/A SER 17.A N GLU 14.A O no hydrogen 3.111 N/A SER 17.A OG GLU 14.A O no hydrogen 2.536 N/A ASN 19.A ND2 THR 148.A OG1 no hydrogen 2.686 N/A GLY 20.A N SER 17.A OG no hydrogen 2.875 N/A SER 21.A N SER 17.A O no hydrogen 2.887 N/A SER 21.A OG SER 17.A O no hydrogen 3.345 N/A LEU 22.A N PHE 18.A O no hydrogen 2.928 N/A LYS 23.A N ASN 19.A O no hydrogen 2.971 N/A LYS 23.A NZ ASN 24.A OD1 no hydrogen 3.055 N/A ASN 24.A N GLY 20.A O no hydrogen 3.046 N/A VAL 25.A N SER 21.A O no hydrogen 3.000 N/A ALA 26.A N LEU 22.A O no hydrogen 3.137 N/A VAL 27.A N LYS 23.A O no hydrogen 3.045 N/A ASP 28.A N ASN 24.A O no hydrogen 2.926 N/A GLU 29.A N VAL 25.A O no hydrogen 2.939 N/A LEU 30.A N ALA 26.A O no hydrogen 2.919 N/A SER 31.A N VAL 27.A O no hydrogen 3.088 N/A ARG 32.A N ASP 28.A O no hydrogen 2.878 N/A ARG 32.A NE GLU 29.A OE1 no hydrogen 2.930 N/A ARG 32.A NH2 GLU 29.A OE2 no hydrogen 2.943 N/A GLN 33.A N GLU 29.A O no hydrogen 3.118 N/A GLN 33.A NE2 GLU 29.A OE2 no hydrogen 2.778 N/A GLN 33.A NE2 LEU 212.A O no hydrogen 2.769 N/A GLY 34.A N SER 31.A O no hydrogen 2.839 N/A CYS 35.A N LEU 30.A O no hydrogen 2.914 N/A CYS 35.A SG GLN 33.A OE1 no hydrogen 3.941 N/A THR 36.A N LYS 4.A O no hydrogen 2.756 N/A THR 38.A N VAL 6.A O no hydrogen 2.768 N/A SER 40.A N ILE 8.A O no hydrogen 2.958 N/A SER 40.A OG GLU 88.A OE1 no hydrogen 2.683 N/A SER 40.A OG GLU 88.A OE2 no hydrogen 3.554 N/A LEU 42.A N TYR 10.A O no hydrogen 3.029 N/A MET 45.A N ASP 41.A O no hydrogen 2.968 N/A ASN 46.A N TYR 43.A O no hydrogen 3.027 N/A PHE 47.A N LEU 42.A O no hydrogen 2.964 N/A ARG 50.A N GLU 48.A OE2 no hydrogen 2.778 N/A ARG 50.A NH1 GLU 48.A OE2 no hydrogen 3.135 N/A THR 52.A N ASP 55.A OD2 no hydrogen 3.365 N/A LYS 54.A N THR 52.A OG1 no hydrogen 3.090 N/A ASP 55.A N THR 52.A O no hydrogen 2.957 N/A ILE 56.A N ASP 53.A O no hydrogen 3.252 N/A THR 57.A N SER 80.A O no hydrogen 2.957 N/A THR 57.A OG1 SER 80.A O no hydrogen 3.106 N/A SER 61.A N GLU 71.A OE1 no hydrogen 3.160 N/A SER 61.A OG GLU 71.A OE2 no hydrogen 2.996 N/A ASN 62.A N GLU 71.A OE2 no hydrogen 3.176 N/A TYR 68.A OH ASP 55.A OD2 no hydrogen 2.812 N/A VAL 70.A N ASN 67.A OD1 no hydrogen 2.992 N/A GLU 71.A N ASN 67.A O no hydrogen 2.859 N/A THR 72.A N TYR 68.A O no hydrogen 2.977 N/A THR 72.A OG1 TYR 68.A O no hydrogen 2.802 N/A THR 72.A OG1 GLY 69.A O no hydrogen 3.183 N/A HIS 73.A N GLY 69.A O no hydrogen 3.086 N/A GLU 74.A N VAL 70.A O no hydrogen 3.092 N/A ALA 75.A N GLU 71.A O no hydrogen 2.880 N/A TYR 76.A N THR 72.A O no hydrogen 2.719 N/A LYS 77.A N HIS 73.A O no hydrogen 3.265 N/A LYS 77.A NZ GLU 74.A OE1 no hydrogen 3.475 N/A GLN 78.A N GLU 74.A O no hydrogen 2.915 N/A ARG 79.A N TYR 76.A O no hydrogen 3.134 N/A SER 80.A N ALA 75.A O no hydrogen 2.921 N/A ALA 82.A N ASP 55.A O no hydrogen 2.766 N/A THR 86.A N ALA 82.A O no hydrogen 2.836 N/A THR 86.A OG1 ALA 82.A O no hydrogen 3.378 N/A THR 86.A OG1 SER 83.A O no hydrogen 2.879 N/A ASP 87.A N SER 83.A O no hydrogen 2.599 N/A GLU 88.A N ASP 84.A O no hydrogen 3.153 N/A GLN 89.A N ILE 85.A O no hydrogen 3.023 N/A GLN 89.A NE2 VAL 120.A O no hydrogen 3.021 N/A LYS 90.A N THR 86.A O no hydrogen 3.046 N/A LYS 90.A NZ GLU 94.A OE2 no hydrogen 3.432 N/A LYS 91.A N ASP 87.A O no hydrogen 3.208 N/A LYS 91.A NZ SER 40.A OG no hydrogen 3.116 N/A LYS 91.A NZ GLU 88.A OE2 no hydrogen 2.986 N/A VAL 92.A N GLU 88.A O no hydrogen 2.886 N/A ARG 93.A N GLN 89.A O no hydrogen 2.715 N/A ARG 93.A NH2 TYR 76.A OH no hydrogen 2.947 N/A GLU 94.A N LYS 90.A O no hydrogen 3.138 N/A ALA 95.A N VAL 92.A O no hydrogen 3.224 N/A ASP 96.A N LYS 5.A O no hydrogen 2.747 N/A LEU 97.A N LYS 5.A O no hydrogen 3.224 N/A VAL 98.A N LEU 142.A O no hydrogen 2.803 N/A ILE 99.A N LEU 7.A O no hydrogen 2.855 N/A PHE 100.A N LEU 144.A O no hydrogen 2.848 N/A GLN 101.A N VAL 9.A O no hydrogen 3.007 N/A GLN 101.A NE2 ASN 19.A OD1 no hydrogen 2.640 N/A PHE 102.A N SER 146.A O no hydrogen 3.082 N/A LEU 104.A N THR 148.A O no hydrogen 2.778 N/A TYR 105.A N SER 108.A O no hydrogen 2.898 N/A SER 108.A N TYR 105.A O no hydrogen 2.875 N/A VAL 109.A N SER 108.A OG no hydrogen 2.656 N/A LEU 113.A N PRO 110.A O no hydrogen 2.920 N/A LYS 114.A N PRO 110.A O no hydrogen 2.953 N/A LYS 114.A NZ ASP 118.A OD1 no hydrogen 2.743 N/A GLY 115.A N ALA 111.A O no hydrogen 2.774 N/A TRP 116.A N ILE 112.A O no hydrogen 3.237 N/A TRP 116.A NE1 GLU 88.A OE1 no hydrogen 3.057 N/A MET 117.A N LEU 113.A O no hydrogen 3.004 N/A ASP 118.A N LYS 114.A O no hydrogen 2.853 N/A ARG 119.A N GLY 115.A O no hydrogen 2.917 N/A ARG 119.A NE ASP 55.A OD1 no hydrogen 3.333 N/A ARG 119.A NE ASP 55.A OD2 no hydrogen 3.098 N/A ARG 119.A NH1 ASP 84.A OD2 no hydrogen 2.975 N/A ARG 119.A NH2 ASP 55.A OD1 no hydrogen 2.715 N/A ARG 119.A NH2 ASP 84.A OD1 no hydrogen 3.524 N/A ARG 119.A NH2 ASP 84.A OD2 no hydrogen 2.762 N/A VAL 120.A N TRP 116.A O no hydrogen 2.915 N/A LEU 121.A N MET 117.A O no hydrogen 3.290 N/A CYS 122.A SG GLN 123.A O no hydrogen 3.560 N/A GLN 123.A NE2 ASP 128.A OD1 no hydrogen 2.834 N/A GLY 124.A N PHE 127.A O no hydrogen 2.695 N/A PHE 125.A N CYS 122.A O no hydrogen 3.089 N/A ALA 126.A N CYS 122.A O no hydrogen 3.057 N/A ASP 128.A N GLY 131.A O no hydrogen 2.861 N/A ILE 129.A N ASP 128.A OD1 no hydrogen 2.664 N/A PHE 132.A N SER 135.A OG no hydrogen 3.076 N/A TYR 133.A N PHE 179.A O no hydrogen 2.847 N/A TYR 133.A OH HIS 174.A NE2 no hydrogen 3.146 N/A SER 135.A N PHE 132.A O no hydrogen 2.990 N/A SER 135.A OG PHE 132.A O no hydrogen 3.083 N/A GLY 136.A N TYR 133.A O no hydrogen 2.696 N/A LEU 137.A N ALA 126.A O no hydrogen 2.911 N/A LEU 138.A N CYS 180.A O no hydrogen 2.808 N/A GLN 139.A N GLY 136.A O no hydrogen 3.386 N/A LYS 141.A N LEU 138.A O no hydrogen 3.227 N/A LYS 141.A NZ VAL 92.A O no hydrogen 3.017 N/A LYS 141.A NZ ARG 93.A O no hydrogen 2.803 N/A LYS 141.A NZ ALA 95.A O no hydrogen 2.805 N/A LEU 142.A N ASP 96.A O no hydrogen 2.920 N/A ALA 143.A N LYS 183.A O no hydrogen 2.867 N/A LEU 144.A N VAL 98.A O no hydrogen 2.947 N/A SER 146.A N PHE 100.A O no hydrogen 2.666 N/A SER 146.A OG GLN 101.A OE1 no hydrogen 2.648 N/A VAL 147.A N GLN 188.A O no hydrogen 2.834 N/A THR 148.A N PHE 102.A O no hydrogen 3.130 N/A THR 149.A N SER 190.A O no hydrogen 3.232 N/A THR 149.A OG1 GLY 151.A O no hydrogen 2.720 N/A MET 155.A N THR 152.A O no hydrogen 2.965 N/A TYR 156.A N ALA 153.A O no hydrogen 2.909 N/A THR 157.A OG1 GLU 154.A O no hydrogen 3.140 N/A GLY 160.A N THR 157.A O no hydrogen 3.197 N/A ASN 162.A N MET 155.A O no hydrogen 2.910 N/A GLY 163.A N GLY 160.A O no hydrogen 3.463 N/A SER 165.A N TYR 156.A O no hydrogen 3.106 N/A ARG 166.A NH1 TRP 227.A O no hydrogen 3.418 N/A TYR 167.A N ASP 164.A O no hydrogen 3.040 N/A PHE 168.A N SER 165.A O no hydrogen 3.180 N/A LEU 169.A N SER 165.A O no hydrogen 3.232 N/A TRP 170.A N ARG 166.A O no hydrogen 3.087 N/A LEU 172.A N LEU 169.A O no hydrogen 2.929 N/A GLN 173.A N LEU 169.A O no hydrogen 2.887 N/A GLN 173.A NE2 HIS 228.A NE2 no hydrogen 3.331 N/A HIS 174.A N TRP 170.A O no hydrogen 2.942 N/A GLY 175.A N TRP 170.A O no hydrogen 3.209 N/A THR 176.A N LEU 172.A O no hydrogen 3.361 N/A THR 176.A OG1 PRO 171.A O no hydrogen 3.341 N/A LEU 177.A N LEU 172.A O no hydrogen 2.917 N/A HIS 178.A N GLN 173.A O no hydrogen 2.732 N/A HIS 178.A ND1 HIS 174.A ND1 no hydrogen 3.364 N/A HIS 178.A NE2 ASP 134.A OD1 no hydrogen 3.352 N/A PHE 179.A N HIS 174.A O no hydrogen 3.059 N/A CYS 180.A N THR 176.A O no hydrogen 3.077 N/A CYS 180.A SG THR 176.A O no hydrogen 3.284 N/A GLY 181.A N HIS 178.A O no hydrogen 2.803 N/A PHE 182.A N LEU 177.A O no hydrogen 3.001 N/A LYS 183.A N LYS 141.A O no hydrogen 2.816 N/A LEU 185.A N ALA 143.A O no hydrogen 2.892 N/A GLN 188.A N LEU 145.A O no hydrogen 2.913 N/A SER 190.A N VAL 147.A O no hydrogen 2.867 N/A ALA 192.A N THR 149.A O no hydrogen 2.958 N/A ALA 192.A N THR 149.A OG1 no hydrogen 3.302 N/A ILE 195.A N ALA 192.A O no hydrogen 3.307 N/A ALA 196.A N PRO 193.A O no hydrogen 3.316 N/A SER 197.A N GLU 200.A OE1 no hydrogen 2.974 N/A SER 197.A OG GLU 200.A OE1 no hydrogen 3.087 N/A GLU 200.A N SER 197.A OG no hydrogen 2.972 N/A ARG 201.A N SER 197.A O no hydrogen 3.001 N/A ARG 201.A NE PRO 193.A O no hydrogen 3.100 N/A ARG 201.A NE ALA 196.A O no hydrogen 3.362 N/A ARG 201.A NH1 GLU 198.A OE1 no hydrogen 2.616 N/A ARG 201.A NH2 ALA 196.A O no hydrogen 2.831 N/A LYS 202.A N GLU 198.A O no hydrogen 3.181 N/A GLY 203.A N GLU 199.A O no hydrogen 3.146 N/A MET 204.A N GLU 200.A O no hydrogen 3.072 N/A VAL 205.A N ARG 201.A O no hydrogen 3.056 N/A ALA 206.A N LYS 202.A O no hydrogen 2.708 N/A ALA 207.A N GLY 203.A O no hydrogen 2.647 N/A TRP 208.A N MET 204.A O no hydrogen 3.264 N/A TRP 208.A NE1 LEU 22.A O no hydrogen 2.983 N/A SER 209.A N VAL 205.A O no hydrogen 2.916 N/A GLN 210.A N ALA 206.A O no hydrogen 2.822 N/A ARG 211.A N ALA 207.A O no hydrogen 3.108 N/A ARG 211.A NE GLU 218.A OE2 no hydrogen 2.764 N/A ARG 211.A NH1 ALA 186.A O no hydrogen 2.793 N/A ARG 211.A NH1 GLN 188.A OE1 no hydrogen 2.997 N/A ARG 211.A NH2 ALA 186.A O no hydrogen 2.530 N/A ARG 211.A NH2 GLU 218.A OE1 no hydrogen 3.008 N/A LEU 212.A N TRP 208.A O no hydrogen 3.129 N/A GLN 213.A N GLN 210.A O no hydrogen 3.156 N/A THR 214.A N ARG 211.A O no hydrogen 3.189 N/A ILE 215.A N LEU 212.A O no hydrogen 3.234 N/A TRP 216.A NE1 GLN 33.A OE1 no hydrogen 3.242 N/A LYS 217.A N THR 214.A O no hydrogen 3.246 N/A GLU 218.A N ILE 215.A O no hydrogen 3.147 N/A ILE 221.A N VAL 184.A O no hydrogen 2.904 N/A CYS 223.A SG GLN 173.A O no hydrogen 3.797 N/A THR 224.A OG1 PRO 222.A O no hydrogen 3.425 N/A TRP 227.A N THR 224.A O no hydrogen 2.750 N/A