Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1qwg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 5.A OE1 no hydrogen 3.011 N/A LEU 7.A N PHE 4.A O no hydrogen 2.987 N/A TYR 8.A N GLU 5.A O no hydrogen 2.970 N/A ARG 13.A NE GLU 237.A OE1 no hydrogen 3.290 N/A ARG 13.A NE GLU 237.A OE2 no hydrogen 2.925 N/A ARG 13.A NH2 TYR 8.A OH no hydrogen 3.094 N/A ARG 13.A NH2 GLU 237.A OE1 no hydrogen 2.787 N/A GLY 14.A N SER 221.A O no hydrogen 2.953 N/A LEU 15.A N ASN 224.A OD1 no hydrogen 2.994 N/A THR 16.A N ASP 40.A OD2 no hydrogen 2.932 N/A VAL 17.A N LEU 225.A O no hydrogen 2.860 N/A VAL 18.A N PHE 41.A O no hydrogen 3.024 N/A LEU 19.A N ILE 228.A O no hydrogen 3.060 N/A ASP 20.A N LYS 43.A O no hydrogen 2.887 N/A LYS 21.A NZ GLU 171.A OE1 no hydrogen 2.739 N/A LYS 21.A NZ GLU 171.A OE2 no hydrogen 3.280 N/A GLY 22.A N ASP 20.A OD1 no hydrogen 2.918 N/A LEU 23.A N ASP 20.A OD1 no hydrogen 2.861 N/A LYS 26.A NZ TYR 63.A OH no hydrogen 2.892 N/A VAL 28.A N PRO 24.A O no hydrogen 3.082 N/A GLU 29.A N PRO 25.A O no hydrogen 3.226 N/A ASP 30.A N LYS 26.A O no hydrogen 3.050 N/A TYR 31.A N PHE 27.A O no hydrogen 2.720 N/A TYR 31.A OH PHE 230.A O no hydrogen 2.714 N/A LEU 32.A N VAL 28.A O no hydrogen 3.037 N/A LYS 33.A N ASP 30.A O no hydrogen 3.064 N/A VAL 34.A N TYR 31.A O no hydrogen 3.068 N/A CYS 35.A N TYR 31.A O no hydrogen 3.227 N/A CYS 35.A SG TYR 31.A O no hydrogen 3.720 N/A GLY 36.A N LEU 32.A O no hydrogen 2.837 N/A TYR 38.A N CYS 35.A O no hydrogen 2.921 N/A ILE 39.A N GLY 36.A O no hydrogen 3.384 N/A ASP 40.A N THR 16.A O no hydrogen 3.013 N/A PHE 41.A N THR 16.A O no hydrogen 3.426 N/A VAL 42.A N LYS 70.A O no hydrogen 2.925 N/A LYS 43.A N VAL 18.A O no hydrogen 2.931 N/A LYS 43.A NZ ASN 227.A OD1 no hydrogen 3.174 N/A PHE 44.A N TYR 72.A O no hydrogen 2.888 N/A GLY 45.A N ASP 20.A O no hydrogen 3.059 N/A THR 48.A N GLY 45.A O no hydrogen 2.916 N/A THR 48.A OG1 GLY 45.A O no hydrogen 2.659 N/A ALA 50.A N GLY 47.A O no hydrogen 3.041 N/A VAL 51.A N THR 48.A O no hydrogen 3.007 N/A ILE 52.A N SER 49.A O no hydrogen 3.260 N/A ARG 54.A NE GLU 93.A OE1 no hydrogen 3.367 N/A ARG 54.A NE GLU 93.A OE2 no hydrogen 2.915 N/A ARG 54.A NH2 GLU 93.A OE1 no hydrogen 2.928 N/A VAL 56.A N ASP 53.A OD1 no hydrogen 2.990 N/A VAL 57.A N ASP 53.A O no hydrogen 2.954 N/A LYS 58.A N ARG 54.A O no hydrogen 3.068 N/A GLU 59.A N ASP 55.A O no hydrogen 2.893 N/A LYS 60.A N VAL 56.A O no hydrogen 2.965 N/A LYS 60.A NZ ASP 20.A OD1 no hydrogen 3.069 N/A LYS 60.A NZ ASP 20.A OD2 no hydrogen 2.946 N/A LYS 60.A NZ LEU 23.A O no hydrogen 2.728 N/A ILE 61.A N VAL 57.A O no hydrogen 3.060 N/A ASN 62.A N LYS 58.A O no hydrogen 3.032 N/A TYR 63.A N GLU 59.A O no hydrogen 3.043 N/A TYR 64.A N LYS 60.A O no hydrogen 3.023 N/A TYR 64.A OH ASP 20.A OD2 no hydrogen 2.694 N/A LYS 65.A N ILE 61.A O no hydrogen 2.910 N/A LYS 65.A NZ ASN 62.A OD1 no hydrogen 3.462 N/A ASP 66.A N ASN 62.A O no hydrogen 2.928 N/A TRP 67.A N TYR 64.A O no hydrogen 2.909 N/A GLY 68.A N LYS 65.A O no hydrogen 3.003 N/A ILE 69.A N TYR 64.A O no hydrogen 3.055 N/A LYS 70.A N ASP 40.A O no hydrogen 3.364 N/A VAL 71.A N GLU 100.A OE1 no hydrogen 2.880 N/A TYR 72.A N VAL 42.A O no hydrogen 3.052 N/A GLY 74.A N PHE 44.A O no hydrogen 2.966 N/A GLY 75.A N GLU 103.A OE2 no hydrogen 2.906 N/A LEU 77.A N GLY 74.A O no hydrogen 3.026 N/A PHE 78.A N GLY 74.A O no hydrogen 3.434 N/A GLU 79.A N GLY 75.A O no hydrogen 2.811 N/A TYR 80.A N THR 76.A O no hydrogen 3.025 N/A ALA 81.A N LEU 77.A O no hydrogen 3.049 N/A TYR 82.A N PHE 78.A O no hydrogen 2.769 N/A SER 83.A N GLU 79.A O no hydrogen 2.999 N/A SER 83.A OG GLU 79.A O no hydrogen 3.543 N/A SER 83.A OG TYR 80.A O no hydrogen 2.845 N/A LYS 84.A N TYR 80.A O no hydrogen 3.264 N/A LYS 84.A N ALA 81.A O no hydrogen 3.134 N/A GLY 85.A N TYR 82.A O no hydrogen 3.044 N/A LYS 86.A N ALA 81.A O no hydrogen 2.932 N/A PHE 90.A N LYS 86.A O no hydrogen 2.906 N/A LEU 91.A N PHE 87.A O no hydrogen 2.887 N/A ASN 92.A N ASP 88.A O no hydrogen 2.923 N/A GLU 93.A N GLU 89.A O no hydrogen 3.001 N/A CYS 94.A N PHE 90.A O no hydrogen 3.019 N/A CYS 94.A SG PHE 90.A O no hydrogen 3.334 N/A GLU 95.A N LEU 91.A O no hydrogen 3.015 N/A LYS 96.A N ASN 92.A O no hydrogen 2.983 N/A LEU 97.A N GLU 93.A O no hydrogen 2.897 N/A GLY 98.A N CYS 94.A O no hydrogen 3.133 N/A GLY 98.A N GLU 95.A O no hydrogen 3.283 N/A PHE 99.A N CYS 94.A O no hydrogen 3.142 N/A GLU 100.A N VAL 71.A O no hydrogen 3.248 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.885 N/A VAL 102.A N MET 129.A O no hydrogen 2.926 N/A ILE 104.A N LEU 131.A O no hydrogen 2.972 N/A SER 105.A OG GLU 79.A OE2 no hydrogen 2.656 N/A GLY 107.A N GLU 79.A OE2 no hydrogen 2.933 N/A SER 108.A N GLU 79.A OE1 no hydrogen 2.880 N/A SER 109.A OG GLU 79.A OE1 no hydrogen 2.713 N/A SER 112.A N GLU 115.A OE1 no hydrogen 3.062 N/A GLU 115.A N SER 112.A OG no hydrogen 3.120 N/A ARG 116.A N SER 112.A O no hydrogen 2.812 N/A ARG 116.A NE ASP 157.A OD1 no hydrogen 2.725 N/A ARG 116.A NE ASP 157.A OD2 no hydrogen 3.375 N/A ARG 116.A NH1 ASP 106.A OD1 no hydrogen 3.050 N/A ARG 116.A NH2 GLU 133.A O no hydrogen 2.950 N/A ARG 116.A NH2 ASP 157.A OD2 no hydrogen 2.851 N/A ASN 117.A N LEU 113.A O no hydrogen 2.826 N/A ASN 118.A N GLU 114.A O no hydrogen 3.007 N/A ALA 119.A N GLU 115.A O no hydrogen 2.940 N/A ILE 120.A N ARG 116.A O no hydrogen 3.034 N/A LYS 121.A N ASN 117.A O no hydrogen 3.031 N/A ARG 122.A N ASN 118.A O no hydrogen 2.900 N/A ALA 123.A N ALA 119.A O no hydrogen 3.034 N/A LYS 124.A N ILE 120.A O no hydrogen 2.943 N/A LYS 124.A NZ PHE 128.A O no hydrogen 3.383 N/A LYS 124.A NZ ASP 163.A OD1 no hydrogen 3.448 N/A LYS 124.A NZ ASP 163.A OD2 no hydrogen 2.705 N/A ASP 125.A N LYS 121.A O no hydrogen 2.840 N/A ASN 126.A N ARG 122.A O no hydrogen 3.176 N/A ASN 126.A N ALA 123.A O no hydrogen 3.137 N/A ASN 126.A ND2 ARG 122.A O no hydrogen 2.748 N/A GLY 127.A N LYS 124.A O no hydrogen 2.999 N/A PHE 128.A N ALA 123.A O no hydrogen 3.293 N/A MET 129.A N GLU 100.A O no hydrogen 3.060 N/A VAL 130.A N ASP 163.A OD2 no hydrogen 2.919 N/A LEU 131.A N VAL 102.A O no hydrogen 2.998 N/A THR 132.A N TYR 164.A O no hydrogen 2.972 N/A THR 132.A OG1 ASP 157.A OD2 no hydrogen 2.576 N/A GLU 133.A N ILE 104.A O no hydrogen 3.008 N/A VAL 134.A N ILE 166.A O no hydrogen 2.936 N/A LYS 136.A N ASP 142.A OD2 no hydrogen 3.038 N/A LYS 136.A NZ ASP 106.A O no hydrogen 2.746 N/A LYS 137.A N GLY 107.A O no hydrogen 2.918 N/A LYS 137.A NZ GLU 168.A OE1 no hydrogen 2.613 N/A LYS 141.A N MET 138.A O no hydrogen 3.025 N/A ASP 142.A N MET 138.A O no hydrogen 2.863 N/A LYS 143.A N PRO 139.A O no hydrogen 2.986 N/A GLN 144.A N LYS 141.A O no hydrogen 3.089 N/A LEU 145.A N ASP 142.A O no hydrogen 3.067 N/A THR 146.A N ASP 149.A OD2 no hydrogen 2.953 N/A ASP 149.A N THR 146.A OG1 no hydrogen 3.118 N/A ARG 150.A N THR 146.A O no hydrogen 3.112 N/A ARG 150.A NH1 ASP 142.A OD2 no hydrogen 2.991 N/A ARG 150.A NH2 ASP 142.A OD1 no hydrogen 3.119 N/A ARG 150.A NH2 ASP 142.A OD2 no hydrogen 3.439 N/A ARG 150.A NH2 LEU 145.A O no hydrogen 3.179 N/A ILE 151.A N ILE 147.A O no hydrogen 3.019 N/A LYS 152.A N ASP 148.A O no hydrogen 2.996 N/A LEU 153.A N ASP 149.A O no hydrogen 3.086 N/A ILE 154.A N ARG 150.A O no hydrogen 2.918 N/A ASN 155.A N ILE 151.A O no hydrogen 3.224 N/A PHE 156.A N LYS 152.A O no hydrogen 2.992 N/A ASP 157.A N LEU 153.A O no hydrogen 2.899 N/A LEU 158.A N ILE 154.A O no hydrogen 3.032 N/A ASP 159.A N ASN 155.A O no hydrogen 2.876 N/A ALA 160.A N PHE 156.A O no hydrogen 3.098 N/A GLY 161.A N LEU 158.A O no hydrogen 3.033 N/A ALA 162.A N ASP 157.A O no hydrogen 2.980 N/A ASP 163.A N VAL 130.A O no hydrogen 2.819 N/A TYR 164.A N VAL 130.A O no hydrogen 3.435 N/A VAL 165.A N LYS 201.A O no hydrogen 2.955 N/A ILE 166.A N THR 132.A O no hydrogen 2.749 N/A ILE 167.A N ILE 203.A O no hydrogen 2.837 N/A GLU 168.A N VAL 134.A O no hydrogen 3.061 N/A GLY 169.A N GLU 205.A OE1 no hydrogen 2.666 N/A ARG 170.A N GLU 205.A OE1 no hydrogen 2.954 N/A LYS 174.A N SER 172.A OG no hydrogen 3.210 N/A GLY 175.A N ASP 180.A O no hydrogen 2.844 N/A LYS 176.A NZ LYS 136.A O no hydrogen 2.513 N/A GLY 177.A N ASP 142.A OD1 no hydrogen 2.868 N/A PHE 179.A N LYS 176.A O no hydrogen 3.219 N/A ASP 180.A N LYS 184.A O no hydrogen 3.048 N/A GLY 183.A N ASP 180.A O no hydrogen 2.953 N/A LYS 184.A N ASP 180.A OD1 no hydrogen 2.877 N/A LYS 186.A N LEU 178.A O no hydrogen 2.850 N/A LEU 190.A N LYS 186.A O no hydrogen 3.075 N/A ASP 191.A N GLU 187.A O no hydrogen 3.021 N/A VAL 192.A N ASN 188.A O no hydrogen 3.210 N/A LEU 193.A N GLU 189.A O no hydrogen 3.408 N/A ALA 194.A N LEU 190.A O no hydrogen 3.063 N/A LYS 195.A N ASP 191.A O no hydrogen 3.179 N/A ASN 196.A N LEU 193.A O no hydrogen 3.108 N/A ASN 196.A ND2 VAL 192.A O no hydrogen 2.765 N/A VAL 197.A N LEU 193.A O no hydrogen 3.197 N/A ASN 200.A N ASP 198.A OD2 no hydrogen 3.145 N/A LYS 201.A N ASP 198.A O no hydrogen 2.957 N/A VAL 202.A N ILE 199.A O no hydrogen 3.049 N/A ILE 203.A N VAL 165.A O no hydrogen 2.881 N/A PHE 204.A N ASN 224.A O no hydrogen 3.003 N/A GLU 205.A N ILE 167.A O no hydrogen 3.127 N/A ALA 206.A N ALA 226.A O no hydrogen 2.891 N/A LYS 209.A NZ ASP 246.A OD1 no hydrogen 3.048 N/A LYS 209.A NZ ASP 246.A OD2 no hydrogen 3.073 N/A GLN 211.A N GLN 208.A O no hydrogen 2.940 N/A GLN 212.A N GLN 208.A O no hydrogen 3.120 N/A VAL 213.A N LYS 209.A O no hydrogen 2.931 N/A ALA 214.A N SER 210.A O no hydrogen 3.059 N/A PHE 215.A N GLN 211.A O no hydrogen 2.874 N/A ILE 216.A N GLN 212.A O no hydrogen 2.964 N/A LEU 217.A N VAL 213.A O no hydrogen 2.898 N/A LYS 218.A N ALA 214.A O no hydrogen 3.061 N/A LYS 218.A NZ ASP 191.A OD1 no hydrogen 2.942 N/A PHE 219.A N PHE 215.A O no hydrogen 2.929 N/A GLY 220.A N ILE 216.A O no hydrogen 2.822 N/A SER 221.A OG ARG 240.A O no hydrogen 2.691 N/A SER 222.A OG.B GLN 12.A O no hydrogen 2.510 N/A VAL 223.A N GLY 220.A O no hydrogen 3.147 N/A ASN 224.A ND2 ASN 200.A O no hydrogen 3.215 N/A ASN 224.A ND2 VAL 202.A O no hydrogen 2.933 N/A LEU 225.A N LEU 15.A O no hydrogen 2.930 N/A ALA 226.A N PHE 204.A O no hydrogen 2.860 N/A ILE 228.A N VAL 17.A O no hydrogen 3.142 N/A GLU 232.A N ALA 229.A O no hydrogen 2.912 N/A LEU 236.A N GLU 232.A O no hydrogen 2.835 N/A GLU 237.A N VAL 233.A O no hydrogen 3.080 N/A THR 238.A N ILE 234.A O no hydrogen 2.944 N/A THR 238.A OG1 SER 235.A O no hydrogen 2.628 N/A LEU 239.A N SER 235.A O no hydrogen 2.881 N/A ARG 240.A N LEU 236.A O no hydrogen 2.967 N/A ARG 240.A NH1 THR 16.A OG1 no hydrogen 3.204 N/A ARG 240.A NH1 VAL 223.A O no hydrogen 3.475 N/A ARG 240.A NH2 SER 221.A O no hydrogen 2.738 N/A ARG 240.A NH2 VAL 223.A O no hydrogen 2.925 N/A ARG 241.A N GLU 237.A O no hydrogen 3.066 N/A ARG 241.A N THR 238.A O no hydrogen 3.167 N/A GLY 242.A N LEU 239.A O no hydrogen 3.249 N/A LEU 243.A N THR 238.A O no hydrogen 2.804 N/A ARG 244.A NH1 SER 235.A OG no hydrogen 2.776 N/A THR 247.A N ARG 244.A O no hydrogen 3.131 N/A THR 247.A OG1 LEU 239.A O no hydrogen 2.633 N/A LYS 250.A N THR 247.A O no hydrogen 3.029 N/A