Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wbw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A NE2 GLY 40.A O no hydrogen 2.768 N/A THR 4.A OG1 GLN 16.A OE1 no hydrogen 2.681 N/A ILE 6.A N MET 14.A O no hydrogen 2.800 N/A SER 7.A OG THR 13.A OG1 no hydrogen 2.600 N/A PHE 8.A N HIS 12.A O no hydrogen 2.774 N/A GLY 11.A N PHE 8.A O no hydrogen 3.049 N/A HIS 12.A N ASP 10.A OD1 no hydrogen 2.950 N/A THR 13.A OG1 SER 7.A OG no hydrogen 2.600 N/A MET 14.A N ILE 6.A O no hydrogen 2.810 N/A GLN 16.A N THR 4.A O no hydrogen 3.014 N/A GLN 16.A NE2 LEU 217.A O no hydrogen 3.117 N/A GLN 16.A NE2 LEU 221.A O no hydrogen 2.903 N/A GLY 18.A N VAL 223.A O no hydrogen 2.957 N/A LEU 19.A N SER 43.A O no hydrogen 2.852 N/A GLY 20.A N PRO 225.A O no hydrogen 3.164 N/A VAL 21.A N ASP 45.A O no hydrogen 2.980 N/A THR 29.A N PRO 25.A O no hydrogen 2.809 N/A THR 29.A OG1 PRO 25.A O no hydrogen 2.637 N/A ALA 30.A N PRO 26.A O no hydrogen 3.000 N/A VAL 32.A N GLU 28.A O no hydrogen 2.984 N/A VAL 33.A N THR 29.A O no hydrogen 2.943 N/A LYS 34.A N ALA 30.A O no hydrogen 2.950 N/A LYS 34.A NZ GLU 31.A OE2 no hydrogen 3.006 N/A GLU 35.A N GLU 31.A O no hydrogen 2.958 N/A ALA 36.A N VAL 32.A O no hydrogen 2.812 N/A VAL 37.A N VAL 33.A O no hydrogen 2.949 N/A LYS 38.A N LYS 34.A O no hydrogen 2.927 N/A LEU 39.A N GLU 35.A O no hydrogen 2.909 N/A GLY 40.A N ALA 36.A O no hydrogen 3.048 N/A GLY 40.A N VAL 37.A O no hydrogen 3.071 N/A TYR 41.A N ALA 36.A O no hydrogen 3.067 N/A TYR 41.A OH LEU 233.A O no hydrogen 2.644 N/A VAL 44.A N PHE 67.A O no hydrogen 2.874 N/A ASP 45.A N LEU 19.A O no hydrogen 2.831 N/A THR 46.A N THR 69.A O no hydrogen 2.988 N/A THR 46.A OG1 ASN 52.A OD1 no hydrogen 2.851 N/A ALA 47.A N THR 46.A OG1 no hydrogen 2.760 N/A ARG 48.A N LYS 71.A O no hydrogen 3.147 N/A ARG 48.A NE GLU 76.A OE2 no hydrogen 3.534 N/A TYR 50.A N ALA 47.A O no hydrogen 3.043 N/A LYS 51.A N ARG 48.A O no hydrogen 2.915 N/A LYS 51.A NZ ARG 48.A O no hydrogen 3.380 N/A ASN 52.A ND2 TRP 22.A O no hydrogen 2.843 N/A ASN 52.A ND2 THR 24.A O no hydrogen 2.938 N/A VAL 56.A N ASN 52.A O no hydrogen 3.042 N/A GLY 57.A N GLU 53.A O no hydrogen 2.779 N/A LYS 58.A N GLU 54.A O no hydrogen 3.022 N/A GLY 59.A N GLY 55.A O no hydrogen 2.817 N/A LEU 60.A N VAL 56.A O no hydrogen 2.922 N/A GLU 61.A N LYS 58.A O no hydrogen 3.361 N/A HIS 63.A N LEU 60.A O no hydrogen 2.741 N/A HIS 63.A ND1 GLU 65.A OE2 no hydrogen 2.820 N/A GLU 65.A N GLU 65.A OE1 no hydrogen 2.739 N/A ILE 66.A N HIS 63.A O no hydrogen 3.257 N/A PHE 67.A N ARG 42.A O no hydrogen 2.904 N/A LEU 68.A N ASP 99.A OD1 no hydrogen 2.881 N/A THR 69.A N VAL 44.A O no hydrogen 3.128 N/A THR 70.A N LEU 100.A O no hydrogen 3.222 N/A THR 70.A OG1 GLU 53.A OE2 no hydrogen 2.738 N/A LYS 71.A N THR 70.A OG1 no hydrogen 2.903 N/A LYS 71.A NZ ASP 45.A OD1 no hydrogen 2.732 N/A LYS 71.A NZ ASP 45.A OD2 no hydrogen 3.330 N/A LYS 71.A NZ THR 46.A O no hydrogen 3.138 N/A LEU 72.A N LEU 102.A O no hydrogen 2.839 N/A GLU 76.A N TRP 73.A O no hydrogen 3.035 N/A GLN 77.A N ASN 74.A O no hydrogen 3.282 N/A GLN 77.A NE2 PRO 106.A O no hydrogen 3.613 N/A GLY 78.A N THR 116.A OG1 no hydrogen 2.935 N/A THR 82.A N GLY 78.A O no hydrogen 3.098 N/A THR 82.A OG1 GLU 76.A O no hydrogen 3.332 N/A THR 82.A OG1 GLY 78.A O no hydrogen 2.696 N/A LEU 83.A N TYR 79.A O no hydrogen 3.258 N/A ARG 84.A N ASP 80.A O no hydrogen 3.130 N/A ALA 85.A N SER 81.A O no hydrogen 2.860 N/A TYR 86.A N THR 82.A O no hydrogen 2.913 N/A TYR 86.A OH ARG 128.A O no hydrogen 2.465 N/A GLU 87.A N LEU 83.A O no hydrogen 3.106 N/A GLU 88.A N ARG 84.A O no hydrogen 3.022 N/A SER 89.A N ALA 85.A O no hydrogen 2.957 N/A SER 89.A OG GLU 53.A OE1 no hydrogen 3.432 N/A SER 89.A OG GLU 53.A OE2 no hydrogen 2.745 N/A SER 89.A OG ALA 85.A O no hydrogen 3.302 N/A ALA 90.A N TYR 86.A O no hydrogen 2.953 N/A ARG 91.A N GLU 87.A O no hydrogen 3.126 N/A LEU 92.A N GLU 88.A O no hydrogen 2.978 N/A LEU 93.A N SER 89.A O no hydrogen 2.879 N/A ARG 94.A N ARG 91.A O no hydrogen 3.015 N/A ARG 95.A N ALA 90.A O no hydrogen 3.069 N/A ARG 95.A NH1 ILE 66.A O no hydrogen 2.878 N/A ARG 95.A NH2 ILE 66.A O no hydrogen 2.236 N/A LEU 98.A N TYR 86.A OH no hydrogen 2.912 N/A ASP 99.A N LEU 68.A O no hydrogen 3.190 N/A LEU 100.A N LEU 68.A O no hydrogen 3.269 N/A TYR 101.A N SER 131.A O no hydrogen 3.134 N/A LEU 102.A N THR 70.A O no hydrogen 3.004 N/A ILE 103.A N GLY 133.A O no hydrogen 3.300 N/A HIS 104.A N LEU 72.A O no hydrogen 3.144 N/A GLN 110.A N MET 107.A O no hydrogen 2.880 N/A GLY 111.A N PRO 108.A O no hydrogen 2.887 N/A THR 116.A N GLN 112.A O no hydrogen 2.945 N/A THR 116.A OG1 GLN 112.A O no hydrogen 2.850 N/A TRP 117.A N TYR 113.A O no hydrogen 2.919 N/A TRP 117.A NE1 VAL 151.A O no hydrogen 3.001 N/A LYS 118.A N VAL 114.A O no hydrogen 2.980 N/A LYS 118.A NZ GLU 115.A OE2 no hydrogen 2.901 N/A ALA 119.A N GLU 115.A O no hydrogen 3.150 N/A LEU 120.A N THR 116.A O no hydrogen 3.049 N/A VAL 121.A N TRP 117.A O no hydrogen 2.849 N/A GLU 122.A N LYS 118.A O no hydrogen 2.930 N/A LEU 123.A N ALA 119.A O no hydrogen 2.809 N/A LYS 124.A N LEU 120.A O no hydrogen 2.907 N/A LYS 124.A NZ ASP 10.A OD2 no hydrogen 3.128 N/A LYS 124.A NZ LYS 130.A O no hydrogen 2.777 N/A LYS 125.A N VAL 121.A O no hydrogen 2.759 N/A SER 126.A N GLU 122.A O no hydrogen 2.863 N/A SER 126.A OG GLU 122.A O no hydrogen 2.783 N/A SER 126.A OG LEU 123.A O no hydrogen 3.367 N/A GLY 127.A N LYS 124.A O no hydrogen 3.115 N/A ARG 128.A N LEU 123.A O no hydrogen 2.896 N/A ARG 128.A NE GLU 87.A OE2 no hydrogen 2.702 N/A ARG 128.A NH1 PRO 96.A O no hydrogen 2.962 N/A ARG 128.A NH2 GLU 87.A OE1 no hydrogen 2.692 N/A ARG 128.A NH2 GLU 87.A OE2 no hydrogen 3.220 N/A ARG 128.A NH2 PRO 96.A O no hydrogen 2.914 N/A VAL 129.A N LEU 123.A O no hydrogen 3.380 N/A LYS 130.A N LEU 98.A O no hydrogen 3.025 N/A SER 131.A N ASP 99.A O no hydrogen 3.072 N/A SER 131.A OG ASP 10.A OD1 no hydrogen 3.552 N/A SER 131.A OG ASP 10.A OD2 no hydrogen 2.709 N/A GLY 133.A N TYR 101.A O no hydrogen 3.052 N/A VAL 134.A N VAL 155.A O no hydrogen 2.978 N/A SER 135.A OG HIS 104.A O no hydrogen 3.440 N/A SER 135.A OG GLN 157.A O no hydrogen 2.897 N/A ASN 136.A N GLN 157.A O no hydrogen 2.829 N/A ASN 136.A ND2 HIS 104.A O no hydrogen 2.811 N/A PHE 137.A N ASN 156.A OD1 no hydrogen 3.220 N/A GLU 138.A N HIS 141.A ND1 no hydrogen 3.037 N/A SER 139.A OG GLU 140.A OE1 no hydrogen 3.476 N/A HIS 141.A N GLU 138.A O no hydrogen 2.987 N/A LEU 142.A N GLU 138.A O no hydrogen 3.010 N/A GLU 143.A N SER 139.A O no hydrogen 2.799 N/A ARG 144.A N GLU 140.A O no hydrogen 3.048 N/A ILE 145.A N HIS 141.A O no hydrogen 3.093 N/A MET 146.A N LEU 142.A O no hydrogen 3.005 N/A ASP 147.A N GLU 143.A O no hydrogen 2.878 N/A ALA 148.A N ARG 144.A O no hydrogen 2.983 N/A THR 149.A N ILE 145.A O no hydrogen 3.162 N/A THR 149.A OG1 ILE 145.A O no hydrogen 2.752 N/A THR 149.A OG1 VAL 151.A O no hydrogen 3.307 N/A GLY 150.A N MET 146.A O no hydrogen 2.677 N/A VAL 151.A N THR 149.A OG1 no hydrogen 2.975 N/A VAL 154.A N ILE 132.A O no hydrogen 3.030 N/A ASN 156.A N ARG 179.A O no hydrogen 3.058 N/A ASN 156.A ND2 PHE 137.A O no hydrogen 2.787 N/A GLN 157.A N VAL 134.A O no hydrogen 3.000 N/A GLN 157.A NE2 ASP 45.A OD2 no hydrogen 2.912 N/A GLN 157.A NE2 GLU 181.A OE1 no hydrogen 2.909 N/A ILE 158.A N GLU 181.A O no hydrogen 2.770 N/A LEU 160.A N TRP 183.A O no hydrogen 2.986 N/A HIS 161.A N PHE 164.A O no hydrogen 3.061 N/A HIS 161.A NE2 GLU 159.A OE2 no hydrogen 2.778 N/A PHE 164.A N HIS 161.A O no hydrogen 2.915 N/A GLN 165.A N ASP 256.A OD1 no hydrogen 2.813 N/A GLN 165.A NE2 PRO 162.A O no hydrogen 2.926 N/A GLN 165.A NE2 ILE 252.A O no hydrogen 2.771 N/A GLN 165.A NE2 GLU 253.A O no hydrogen 3.415 N/A GLN 166.A NE2 GLU 159.A O no hydrogen 2.811 N/A ARG 167.A NE ASP 256.A OD2 no hydrogen 3.020 N/A ARG 167.A NH2 ASP 256.A OD2 no hydrogen 3.218 N/A ARG 170.A N GLN 166.A O no hydrogen 2.909 N/A ARG 170.A NE GLN 165.A O no hydrogen 3.056 N/A ARG 170.A NH2 GLN 165.A O no hydrogen 2.867 N/A GLU 171.A N ARG 167.A O no hydrogen 2.997 N/A PHE 172.A N ALA 168.A O no hydrogen 3.179 N/A HIS 173.A N LEU 169.A O no hydrogen 2.879 N/A GLU 174.A N ARG 170.A O no hydrogen 2.894 N/A LYS 175.A N GLU 171.A O no hydrogen 3.284 N/A HIS 176.A N PHE 172.A O no hydrogen 3.300 N/A HIS 176.A N HIS 173.A O no hydrogen 2.912 N/A ASN 177.A N GLU 174.A O no hydrogen 3.109 N/A ILE 178.A N HIS 173.A O no hydrogen 2.934 N/A ARG 179.A N VAL 154.A O no hydrogen 2.862 N/A ARG 179.A NE SER 7.A O no hydrogen 2.754 N/A ARG 179.A NH1 ASN 177.A OD1 no hydrogen 2.828 N/A ARG 179.A NH2 SER 7.A O no hydrogen 2.936 N/A GLU 181.A N ASN 156.A O no hydrogen 3.169 N/A SER 182.A N ILE 222.A O no hydrogen 2.765 N/A SER 182.A OG HIS 216.A ND1 no hydrogen 2.920 N/A TRP 183.A N ILE 158.A O no hydrogen 2.963 N/A TRP 183.A NE1 ASN 136.A OD1 no hydrogen 2.887 N/A GLY 187.A N ARG 184.A O no hydrogen 2.980 N/A GLY 189.A N LEU 186.A O no hydrogen 2.844 N/A ARG 190.A N GLY 187.A O no hydrogen 3.396 N/A LEU 192.A N GLY 189.A O no hydrogen 3.291 N/A SER 193.A N ARG 190.A O no hydrogen 3.422 N/A SER 193.A OG ARG 190.A O no hydrogen 3.279 N/A ASP 194.A N VAL 191.A O no hydrogen 2.901 N/A ARG 196.A N ASP 194.A OD1 no hydrogen 2.973 N/A ARG 196.A NE ASP 194.A OD1 no hydrogen 2.831 N/A ARG 196.A NE ASP 194.A OD2 no hydrogen 3.246 N/A ARG 196.A NH2 ASP 194.A OD2 no hydrogen 2.759 N/A GLY 198.A N ASP 194.A O no hydrogen 2.819 N/A LYS 199.A N GLU 195.A O no hydrogen 2.915 N/A ILE 200.A N ARG 196.A O no hydrogen 3.148 N/A ALA 201.A N ILE 197.A O no hydrogen 2.830 N/A GLU 202.A N GLY 198.A O no hydrogen 2.899 N/A LYS 203.A N LYS 199.A O no hydrogen 2.978 N/A LYS 203.A NZ ASP 245.A OD1 no hydrogen 3.304 N/A LYS 203.A NZ ASP 245.A OD2 no hydrogen 2.773 N/A LYS 203.A NZ ASP 248.A OD1 no hydrogen 2.796 N/A HIS 204.A N ILE 200.A O no hydrogen 3.163 N/A HIS 204.A N ALA 201.A O no hydrogen 3.305 N/A HIS 204.A NE2 ASP 248.A OD2 no hydrogen 2.645 N/A SER 205.A N GLU 202.A O no hydrogen 3.362 N/A ARG 206.A N ALA 201.A O no hydrogen 3.095 N/A ARG 206.A NH1 SER 205.A O no hydrogen 3.135 N/A THR 207.A OG1 GLU 235.A OE2 no hydrogen 2.682 N/A GLN 210.A N THR 207.A OG1 no hydrogen 3.117 N/A VAL 211.A N THR 207.A O no hydrogen 2.955 N/A VAL 212.A N PRO 208.A O no hydrogen 3.002 N/A ILE 213.A N ALA 209.A O no hydrogen 2.918 N/A ARG 214.A N GLN 210.A O no hydrogen 2.938 N/A ARG 214.A NH1 VAL 239.A O no hydrogen 2.941 N/A TRP 215.A N VAL 211.A O no hydrogen 2.841 N/A HIS 216.A N VAL 212.A O no hydrogen 3.135 N/A HIS 216.A ND1 SER 182.A OG no hydrogen 2.920 N/A HIS 216.A NE2 PRO 185.A O no hydrogen 2.853 N/A LEU 217.A N ILE 213.A O no hydrogen 2.939 N/A GLN 218.A N ARG 214.A O no hydrogen 2.830 N/A ASN 219.A N TRP 215.A O no hydrogen 3.240 N/A ASN 219.A N HIS 216.A O no hydrogen 3.063 N/A ASN 219.A ND2 TRP 215.A O no hydrogen 2.821 N/A GLY 220.A N LEU 217.A O no hydrogen 2.994 N/A LEU 221.A N HIS 216.A O no hydrogen 3.084 N/A ILE 222.A N THR 180.A O no hydrogen 2.972 N/A VAL 223.A N GLN 16.A O no hydrogen 2.898 N/A ILE 224.A N SER 182.A O no hydrogen 3.454 N/A SER 227.A OG ASN 229.A O no hydrogen 3.403 N/A ASN 229.A N SER 227.A OG no hydrogen 3.167 N/A LEU 233.A N ASN 229.A O no hydrogen 2.768 N/A ALA 234.A N PRO 230.A O no hydrogen 2.979 N/A GLU 235.A N LYS 231.A O no hydrogen 2.951 N/A ASN 236.A N ARG 232.A O no hydrogen 2.886 N/A LEU 237.A N ALA 234.A O no hydrogen 3.236 N/A ASP 238.A N GLU 235.A O no hydrogen 3.139 N/A VAL 239.A N LEU 237.A O no hydrogen 2.930 N/A ASP 245.A N ASP 248.A OD2 no hydrogen 2.911 N/A ASP 248.A N ASP 245.A OD1 no hydrogen 2.886 N/A MET 249.A N ASP 245.A O no hydrogen 2.956 N/A GLN 250.A N ALA 246.A O no hydrogen 2.980 N/A ALA 251.A N ASP 247.A O no hydrogen 2.942 N/A ILE 252.A N ASP 248.A O no hydrogen 3.056 N/A GLU 253.A N MET 249.A O no hydrogen 2.983 N/A GLN 254.A N GLN 250.A O no hydrogen 3.099 N/A MET 255.A N ILE 252.A O no hydrogen 2.942 N/A ASP 256.A N GLU 253.A O no hydrogen 3.358 N/A ARG 257.A N ASP 163.A O no hydrogen 2.848 N/A GLY 260.A N ARG 257.A O no hydrogen 3.010 N/A MET 262.A N GLU 159.A OE2 no hydrogen 2.687 N/A GLY 263.A N GLU 159.A OE1 no hydrogen 2.805 N/A ASN 267.A N ASP 265.A OD1 no hydrogen 2.987 N/A THR 268.A N ASP 265.A O no hydrogen 2.835 N/A THR 268.A OG1 ASP 265.A O no hydrogen 3.485 N/A ALA 269.A N ASP 265.A O no hydrogen 2.714 N/A