Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mwa_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N GLU 1.A OE2 no hydrogen 2.587 N/A THR 5.A N ASN 24.A O no hydrogen 2.843 N/A GLN 6.A NE2 TYR 89.A O no hydrogen 2.797 N/A GLN 6.A NE2 THR 105.A OG1 no hydrogen 2.984 N/A SER 7.A N SER 22.A O no hydrogen 2.854 N/A SER 7.A OG SER 22.A OG no hydrogen 2.725 N/A LYS 11.A NZ SER 210.A OG no hydrogen 3.430 N/A ALA 13.A N SER 108.A O no hydrogen 3.073 N/A THR 15.A N LEU 110.A O no hydrogen 2.854 N/A THR 15.A OG1 LEU 110.A O no hydrogen 3.241 N/A GLY 16.A N ALA 81.A O no hydrogen 3.056 N/A GLY 17.A N VAL 14.A O no hydrogen 2.762 N/A VAL 19.A N LEU 78.A O no hydrogen 3.430 N/A LEU 21.A N LEU 76.A O no hydrogen 3.253 N/A SER 22.A N SER 7.A O no hydrogen 2.907 N/A SER 22.A OG SER 7.A O no hydrogen 3.444 N/A SER 22.A OG SER 7.A OG no hydrogen 2.725 N/A ASN 24.A N THR 5.A O no hydrogen 2.776 N/A GLN 25.A N GLU 72.A O no hydrogen 2.542 N/A GLN 25.A NE2 HIS 29.A O no hydrogen 3.342 N/A THR 26.A N ALA 3.A O no hydrogen 3.466 N/A ASN 27.A ND2 ALA 2.A O no hydrogen 3.170 N/A ASN 27.A ND2 SER 93.A OG no hydrogen 2.836 N/A HIS 29.A N GLN 25.A OE1 no hydrogen 2.514 N/A HIS 29.A ND1 SER 93.A OG no hydrogen 2.802 N/A ASN 30.A ND2 GLN 71.A OE1 no hydrogen 3.187 N/A ASN 31.A ND2 SER 49.A O no hydrogen 3.571 N/A MET 32.A N SER 49.A O no hydrogen 3.024 N/A TYR 33.A N ALA 92.A O no hydrogen 2.710 N/A TRP 34.A N HIS 47.A O no hydrogen 2.884 N/A TRP 34.A NE1 PHE 74.A O no hydrogen 2.811 N/A TYR 35.A N PHE 90.A O no hydrogen 2.656 N/A ARG 36.A N ARG 44.A O no hydrogen 3.101 N/A ARG 36.A NE ASP 38.A OD2 no hydrogen 2.558 N/A ARG 36.A NH1 TYR 64.A OH no hydrogen 3.165 N/A ARG 36.A NH1 SER 84.A O no hydrogen 3.222 N/A ARG 36.A NH2 ASP 38.A OD1 no hydrogen 2.951 N/A ARG 36.A NH2 ASP 38.A OD2 no hydrogen 2.872 N/A ARG 36.A NH2 SER 84.A O no hydrogen 3.342 N/A GLN 37.A N VAL 88.A O no hydrogen 2.710 N/A ASP 38.A N GLY 42.A O no hydrogen 3.350 N/A HIS 41.A N ASP 38.A O no hydrogen 3.122 N/A ARG 44.A N ARG 36.A O no hydrogen 3.103 N/A ARG 44.A NH2 ASP 38.A OD2 no hydrogen 3.198 N/A ILE 46.A N TRP 34.A O no hydrogen 2.826 N/A HIS 47.A NE2 TYR 64.A O no hydrogen 3.279 N/A TYR 48.A N GLU 56.A O no hydrogen 3.224 N/A SER 49.A N MET 32.A O no hydrogen 2.904 N/A SER 49.A OG GLY 51.A O no hydrogen 3.025 N/A SER 49.A OG SER 54.A O no hydrogen 3.162 N/A TYR 50.A N SER 54.A OG no hydrogen 3.043 N/A GLY 51.A N SER 49.A OG no hydrogen 3.037 N/A GLY 53.A N ARG 68.A O no hydrogen 2.702 N/A SER 54.A N GLY 51.A O no hydrogen 2.663 N/A THR 55.A OG1 SER 54.A O no hydrogen 2.738 N/A GLU 56.A N TYR 48.A O no hydrogen 3.032 N/A GLY 58.A N ILE 46.A O no hydrogen 2.756 N/A ASP 59.A N LEU 45.A O no hydrogen 2.919 N/A ILE 60.A N LEU 45.A O no hydrogen 3.120 N/A TYR 64.A N PRO 61.A O no hydrogen 2.861 N/A TYR 64.A OH TYR 89.A OH no hydrogen 2.924 N/A LYS 65.A N ILE 77.A O no hydrogen 2.998 N/A LYS 65.A NZ GLU 79.A OE2 no hydrogen 2.345 N/A SER 67.A N SER 75.A O no hydrogen 3.175 N/A ARG 68.A NH1 GLN 71.A O no hydrogen 2.414 N/A ARG 68.A NH2 HIS 29.A O no hydrogen 3.500 N/A ARG 68.A NH2 ASN 30.A O no hydrogen 2.941 N/A ARG 68.A NH2 GLN 71.A O no hydrogen 3.334 N/A SER 70.A OG GLU 72.A OE1 no hydrogen 3.268 N/A ASN 73.A N SER 70.A O no hydrogen 3.283 N/A PHE 74.A N CYS 23.A O no hydrogen 3.224 N/A SER 75.A N SER 67.A O no hydrogen 3.060 N/A LEU 76.A N LEU 21.A O no hydrogen 3.053 N/A ILE 77.A N LYS 65.A O no hydrogen 2.657 N/A LEU 78.A N VAL 19.A O no hydrogen 2.770 N/A ALA 81.A N GLY 17.A O no hydrogen 3.155 N/A THR 82.A N GLN 85.A OE1 no hydrogen 2.978 N/A THR 82.A OG1 SER 84.A OG no hydrogen 2.544 N/A SER 84.A OG THR 82.A OG1 no hydrogen 2.544 N/A GLN 85.A N THR 82.A O no hydrogen 2.786 N/A GLN 85.A NE2 GLY 63.A O no hydrogen 3.209 N/A THR 86.A N PRO 83.A O no hydrogen 3.152 N/A THR 86.A OG1 PRO 83.A O no hydrogen 3.325 N/A SER 87.A N LEU 107.A O no hydrogen 2.939 N/A SER 87.A OG GLN 37.A O no hydrogen 2.709 N/A SER 87.A OG ASP 38.A OD1 no hydrogen 2.834 N/A SER 87.A OG ASP 38.A OD2 no hydrogen 3.353 N/A SER 87.A OG VAL 88.A O no hydrogen 3.446 N/A TYR 89.A N THR 105.A O no hydrogen 3.092 N/A TYR 89.A OH TYR 64.A OH no hydrogen 2.924 N/A TYR 89.A OH GLN 85.A O no hydrogen 2.379 N/A PHE 90.A N TYR 35.A O no hydrogen 2.819 N/A CYS 91.A N GLN 6.A OE1 no hydrogen 2.944 N/A ALA 92.A N TYR 33.A O no hydrogen 2.869 N/A SER 93.A N TYR 100.A O no hydrogen 2.992 N/A SER 93.A OG HIS 29.A ND1 no hydrogen 2.802 N/A GLY 94.A N ASN 31.A O no hydrogen 2.906 N/A TYR 100.A N SER 93.A O no hydrogen 2.945 N/A GLY 102.A N CYS 91.A O no hydrogen 3.050 N/A THR 105.A OG1 PRO 8.A O no hydrogen 2.779 N/A ARG 106.A N ARG 9.A O no hydrogen 2.816 N/A ARG 106.A NH1 ASN 10.A OD1 no hydrogen 3.121 N/A LEU 107.A N SER 87.A O no hydrogen 2.819 N/A SER 108.A N LYS 11.A O no hydrogen 2.897 N/A SER 108.A OG HIS 150.A NE2 no hydrogen 2.662 N/A VAL 109.A N THR 86.A OG1 no hydrogen 2.652 N/A LEU 110.A N ALA 13.A O no hydrogen 2.926 N/A LEU 113.A N ASP 112.A OD2 no hydrogen 3.044 N/A ARG 114.A NE ASP 112.A OD1 no hydrogen 2.671 N/A THR 117.A OG1 ASN 115.A O no hydrogen 2.986 N/A LYS 120.A N ARG 144.A O no hydrogen 2.639 N/A SER 122.A N LEU 142.A O no hydrogen 3.194 N/A PHE 124.A N VAL 140.A O no hydrogen 2.937 N/A GLU 130.A N SER 127.A OG no hydrogen 3.239 N/A ILE 131.A N SER 127.A O no hydrogen 3.475 N/A ALA 132.A N LYS 128.A O no hydrogen 2.698 N/A ALA 132.A N ALA 129.A O no hydrogen 3.042 N/A ASN 133.A N ALA 129.A O no hydrogen 3.258 N/A LYS 134.A N GLU 130.A O no hydrogen 3.026 N/A GLN 135.A NE2 ALA 132.A O no hydrogen 3.124 N/A ALA 137.A N VAL 188.A O no hydrogen 2.644 N/A THR 138.A N GLU 130.A OE2 no hydrogen 3.061 N/A THR 138.A OG1 GLU 130.A OE1 no hydrogen 2.559 N/A THR 138.A OG1 GLU 130.A OE2 no hydrogen 3.389 N/A LEU 139.A N LEU 186.A O no hydrogen 2.780 N/A VAL 140.A N PHE 124.A O no hydrogen 3.073 N/A CYS 141.A N SER 184.A O no hydrogen 2.642 N/A LEU 142.A N SER 122.A O no hydrogen 3.316 N/A ALA 143.A N LEU 182.A O no hydrogen 2.656 N/A ARG 144.A N LYS 120.A O no hydrogen 2.807 N/A ARG 144.A NH1 GLU 175.A OE1 no hydrogen 2.503 N/A PHE 147.A N THR 117.A O no hydrogen 3.187 N/A HIS 150.A N PRO 148.A O no hydrogen 2.704 N/A HIS 150.A NE2 SER 108.A OG no hydrogen 2.662 N/A GLU 152.A N GLN 205.A O no hydrogen 2.949 N/A SER 154.A N GLN 203.A O no hydrogen 2.918 N/A TRP 155.A NE1 SER 184.A OG no hydrogen 2.685 N/A TRP 156.A N ARG 201.A O no hydrogen 2.751 N/A TRP 156.A NE1 SER 154.A OG no hydrogen 2.888 N/A VAL 157.A N LYS 160.A O no hydrogen 2.974 N/A ASN 158.A N HIS 199.A O no hydrogen 2.838 N/A ASN 158.A ND2 ASN 198.A OD1 no hydrogen 3.232 N/A LYS 160.A N VAL 157.A O no hydrogen 3.040 N/A VAL 162.A N TRP 155.A O no hydrogen 2.999 N/A VAL 166.A N HIS 163.A O no hydrogen 3.120 N/A SER 167.A N ARG 185.A O no hydrogen 3.324 N/A THR 168.A OG1 SER 184.A OG no hydrogen 2.924 N/A ASP 169.A N SER 183.A O no hydrogen 3.187 N/A TYR 173.A N CYS 181.A O no hydrogen 2.818 N/A GLU 175.A N SER 179.A O no hydrogen 2.997 N/A TYR 178.A N SER 176.A OG no hydrogen 3.232 N/A SER 179.A OG GLU 175.A OE2 no hydrogen 2.957 N/A TYR 180.A N PHE 146.A O no hydrogen 2.663 N/A CYS 181.A N TYR 173.A O no hydrogen 2.954 N/A LEU 182.A N ALA 143.A O no hydrogen 2.857 N/A SER 183.A N ASP 169.A OD2 no hydrogen 2.740 N/A SER 183.A OG ASP 169.A OD2 no hydrogen 3.052 N/A SER 184.A N CYS 141.A O no hydrogen 2.598 N/A SER 184.A OG SER 167.A O no hydrogen 3.265 N/A SER 184.A OG THR 168.A OG1 no hydrogen 2.924 N/A SER 184.A OG ARG 185.A O no hydrogen 3.368 N/A ARG 185.A N SER 167.A O no hydrogen 3.061 N/A LEU 186.A N LEU 139.A O no hydrogen 2.917 N/A ARG 187.A N GLY 165.A O no hydrogen 2.842 N/A ARG 187.A NE THR 138.A OG1 no hydrogen 3.120 N/A VAL 188.A N ALA 137.A O no hydrogen 3.018 N/A ALA 190.A N GLN 135.A O no hydrogen 3.005 N/A PHE 192.A N SER 189.A OG no hydrogen 3.029 N/A HIS 194.A N ALA 190.A O no hydrogen 2.763 N/A ASN 195.A N THR 191.A O no hydrogen 3.123 N/A ARG 197.A N ASN 195.A OD1 no hydrogen 2.821 N/A ARG 197.A NE ARG 197.A O no hydrogen 3.443 N/A ASN 198.A N ASN 195.A O no hydrogen 2.760 N/A ASN 198.A ND2 PHE 192.A O no hydrogen 2.394 N/A HIS 199.A N ASN 158.A OD1 no hydrogen 2.530 N/A HIS 199.A NE2 GLU 230.A OE2 no hydrogen 2.955 N/A PHE 200.A N ALA 231.A O no hydrogen 2.972 N/A ARG 201.A N TRP 156.A O no hydrogen 2.784 N/A ARG 201.A NE SER 228.A OG no hydrogen 3.306 N/A CYS 202.A N ALA 229.A O no hydrogen 2.840 N/A GLN 203.A N SER 154.A O no hydrogen 3.014 N/A VAL 204.A N ILE 227.A O no hydrogen 2.857 N/A GLN 205.A N GLU 152.A O no hydrogen 2.937 N/A GLN 205.A NE2 GLU 152.A OE2 no hydrogen 3.256 N/A PHE 206.A N GLN 225.A O no hydrogen 2.805 N/A HIS 207.A N HIS 150.A O no hydrogen 2.758 N/A HIS 207.A NE2 GLU 152.A OE2 no hydrogen 3.214 N/A GLY 208.A N THR 224.A OG1 no hydrogen 3.211 N/A LEU 209.A N PRO 222.A O no hydrogen 2.677 N/A SER 210.A N ASP 213.A OD2 no hydrogen 2.778 N/A SER 210.A OG ASP 213.A OD2 no hydrogen 2.873 N/A GLU 211.A N GLU 211.A OE2 no hydrogen 2.493 N/A ASP 213.A N SER 210.A O no hydrogen 2.867 N/A TRP 215.A NE1 SER 219.A O no hydrogen 2.673 N/A SER 219.A OG PRO 220.A O no hydrogen 3.566 N/A LYS 221.A NZ SER 210.A O no hydrogen 2.962 N/A LYS 221.A NZ GLU 211.A O no hydrogen 3.568 N/A VAL 223.A N LYS 221.A O no hydrogen 2.530 N/A GLN 225.A N PHE 206.A O no hydrogen 3.057 N/A GLN 225.A NE2 VAL 223.A O no hydrogen 3.530 N/A ILE 227.A N VAL 204.A O no hydrogen 3.388 N/A ALA 229.A N CYS 202.A O no hydrogen 2.976 N/A ALA 231.A N PHE 200.A O no hydrogen 3.069 N/A GLY 233.A N ASN 198.A O no hydrogen 2.857 N/A ARG 234.A N TRP 193.A O no hydrogen 3.008 N/A