Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dpw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N PHE 49.A O no hydrogen 3.368 N/A GLY 5.A N VAL 47.A O no hydrogen 2.995 N/A ALA 7.A N THR 45.A O no hydrogen 2.996 N/A ARG 8.A N GLU 324.A O no hydrogen 2.785 N/A ARG 8.A NE GLU 44.A OE2 no hydrogen 2.947 N/A ARG 8.A NH1 GLU 324.A OE2 no hydrogen 3.249 N/A ARG 8.A NH2 GLU 44.A OE2 no hydrogen 2.820 N/A ALA 9.A N THR 43.A O no hydrogen 2.990 N/A THR 11.A N PHE 41.A O no hydrogen 3.189 N/A ASN 12.A ND2 SER 141.A O no hydrogen 2.978 N/A ASN 12.A ND2 SER 145.A OG no hydrogen 2.796 N/A ILE 13.A N VAL 36.A O no hydrogen 3.175 N/A LEU 15.A N LEU 34.A O no hydrogen 2.674 N/A ILE 16.A N LEU 34.A O no hydrogen 3.061 N/A LYS 17.A N ASN 239.A OD1 no hydrogen 2.881 N/A LYS 17.A NZ ALA 14.A O no hydrogen 2.727 N/A LYS 17.A NZ THR 281.A OG1 no hydrogen 2.769 N/A LYS 17.A NZ MET 282.A O no hydrogen 3.413 N/A LYS 21.A NZ TYR 18.A OH no hydrogen 2.543 N/A ALA 22.A N ILE 28.A O no hydrogen 2.514 N/A ASP 23.A N ILE 28.A O no hydrogen 3.117 N/A THR 25.A N ASP 23.A OD1 no hydrogen 2.832 N/A TYR 26.A N ASP 23.A OD1 no hydrogen 2.834 N/A ILE 28.A N ASP 23.A O no hydrogen 3.215 N/A MET 30.A N GLY 20.A O no hydrogen 3.047 N/A ASN 31.A ND2 LYS 17.A O no hydrogen 3.008 N/A ASN 31.A ND2 ASN 32.A O no hydrogen 2.688 N/A ASN 32.A ND2 GLU 152.A OE2 no hydrogen 3.110 N/A ASN 32.A ND2 GLU 154.A OE1 no hydrogen 3.027 N/A SER 33.A OG ILE 16.A O no hydrogen 3.411 N/A LEU 34.A N ILE 16.A O no hydrogen 3.182 N/A SER 35.A N ALA 151.A O no hydrogen 2.941 N/A SER 35.A OG ASN 12.A OD1 no hydrogen 2.995 N/A VAL 36.A N ILE 13.A O no hydrogen 3.040 N/A THR 37.A N GLY 149.A O no hydrogen 3.283 N/A THR 37.A OG1 PHE 147.A O no hydrogen 2.984 N/A LEU 38.A N THR 11.A O no hydrogen 2.853 N/A ASP 39.A N ASP 317.A O no hydrogen 3.241 N/A ARG 40.A N SER 316.A OG no hydrogen 3.299 N/A ARG 40.A NH1 ALA 315.A O no hydrogen 2.722 N/A TYR 42.A N TYR 97.A O no hydrogen 3.493 N/A THR 43.A N ALA 9.A O no hydrogen 2.813 N/A THR 43.A OG1 ASN 96.A OD1 no hydrogen 2.885 N/A THR 43.A OG1 SER 109.A OG no hydrogen 2.791 N/A GLU 44.A N GLU 95.A O no hydrogen 3.199 N/A THR 45.A N ALA 7.A O no hydrogen 3.095 N/A THR 45.A OG1 SER 94.A OG no hydrogen 2.984 N/A LYS 46.A N GLU 93.A O no hydrogen 2.976 N/A VAL 47.A N GLY 5.A O no hydrogen 2.854 N/A THR 48.A N ARG 91.A O no hydrogen 3.115 N/A THR 48.A OG1 ARG 91.A O no hydrogen 3.427 N/A PHE 49.A N LYS 3.A O no hydrogen 2.797 N/A ASP 50.A N HIS 89.A O no hydrogen 3.412 N/A ASP 52.A N ASP 50.A OD1 no hydrogen 2.927 N/A PHE 53.A N ASP 50.A O no hydrogen 3.092 N/A CYS 57.A N ALA 90.A O no hydrogen 2.959 N/A ILE 59.A N ILE 92.A O no hydrogen 2.667 N/A LEU 60.A N ASN 63.A O no hydrogen 2.830 N/A ASN 61.A N SER 94.A O no hydrogen 2.939 N/A ASN 61.A ND2 THR 100.A OG1 no hydrogen 3.341 N/A ASN 63.A N LEU 60.A O no hydrogen 3.150 N/A LYS 68.A N ASN 66.A OD1 no hydrogen 3.124 N/A GLU 69.A N ASN 66.A OD1 no hydrogen 2.988 N/A LYS 70.A N ASN 66.A O no hydrogen 2.836 N/A LYS 72.A N LYS 68.A O no hydrogen 3.071 N/A ILE 73.A N GLU 69.A O no hydrogen 3.172 N/A GLN 74.A N LYS 70.A O no hydrogen 2.901 N/A GLN 74.A N GLU 71.A O no hydrogen 3.037 N/A ASN 75.A N GLU 71.A O no hydrogen 3.175 N/A TYR 76.A OH LEU 134.A O no hydrogen 3.032 N/A MET 77.A N ILE 73.A O no hydrogen 3.127 N/A ASN 78.A N GLN 74.A O no hydrogen 2.902 N/A ILE 79.A N ASN 75.A O no hydrogen 3.351 N/A VAL 80.A N TYR 76.A O no hydrogen 2.983 N/A ARG 81.A N MET 77.A O no hydrogen 2.854 N/A ARG 81.A NE ASN 78.A OD1 no hydrogen 3.439 N/A ARG 81.A NH1 ASP 56.A OD1 no hydrogen 2.868 N/A ARG 81.A NH1 LEU 88.A O no hydrogen 2.690 N/A ARG 81.A NH2 ASP 56.A OD1 no hydrogen 3.329 N/A ARG 81.A NH2 ASP 56.A OD2 no hydrogen 3.021 N/A ARG 81.A NH2 ASN 78.A OD1 no hydrogen 3.208 N/A ASP 82.A N ASN 78.A O no hydrogen 3.009 N/A LEU 83.A N ILE 79.A O no hydrogen 3.279 N/A ALA 84.A N VAL 80.A O no hydrogen 2.946 N/A GLY 85.A N ARG 81.A O no hydrogen 3.105 N/A HIS 89.A ND1 ASP 56.A OD2 no hydrogen 3.201 N/A ALA 90.A N ASP 56.A OD1 no hydrogen 3.082 N/A ARG 91.A N THR 48.A O no hydrogen 2.951 N/A ARG 91.A NE GLU 93.A OE2 no hydrogen 3.151 N/A ILE 92.A N CYS 57.A O no hydrogen 2.550 N/A GLU 93.A N LYS 46.A O no hydrogen 2.932 N/A SER 94.A N ILE 59.A O no hydrogen 2.907 N/A SER 94.A OG THR 45.A OG1 no hydrogen 2.984 N/A GLU 95.A N GLU 44.A O no hydrogen 2.965 N/A ASN 96.A N ASN 61.A OD1 no hydrogen 3.018 N/A ASN 96.A ND2 THR 100.A OG1 no hydrogen 3.100 N/A TYR 97.A N TYR 42.A O no hydrogen 2.920 N/A ALA 101.A N SER 106.A OG no hydrogen 3.314 N/A SER 109.A OG THR 43.A OG1 no hydrogen 2.791 N/A SER 109.A OG ALA 105.A O no hydrogen 3.541 N/A SER 109.A OG SER 106.A O no hydrogen 3.083 N/A ALA 110.A N SER 106.A O no hydrogen 2.881 N/A TYR 111.A N SER 107.A O no hydrogen 3.070 N/A ALA 112.A N ALA 108.A O no hydrogen 3.388 N/A ALA 113.A N SER 109.A O no hydrogen 2.889 N/A LEU 114.A N ALA 110.A O no hydrogen 2.962 N/A ALA 115.A N TYR 111.A O no hydrogen 3.150 N/A ALA 116.A N ALA 112.A O no hydrogen 2.989 N/A ALA 117.A N ALA 113.A O no hydrogen 2.972 N/A CYS 118.A N LEU 114.A O no hydrogen 2.796 N/A CYS 118.A SG LEU 114.A O no hydrogen 3.605 N/A ASN 119.A N ALA 115.A O no hydrogen 2.970 N/A GLU 120.A N ALA 116.A O no hydrogen 3.277 N/A ALA 121.A N ALA 117.A O no hydrogen 2.822 N/A LEU 122.A N CYS 118.A O no hydrogen 2.960 N/A SER 123.A N GLU 120.A O no hydrogen 3.154 N/A LEU 124.A N ASN 119.A O no hydrogen 2.969 N/A ASN 125.A ND2 SER 123.A O no hydrogen 3.432 N/A LEU 126.A N ASN 119.A OD1 no hydrogen 3.145 N/A SER 127.A OG ASP 130.A OD2 no hydrogen 2.736 N/A ASP 130.A N SER 127.A OG no hydrogen 3.272 N/A LEU 131.A N SER 127.A O no hydrogen 2.727 N/A SER 132.A N ASP 128.A O no hydrogen 2.910 N/A SER 132.A OG SER 143.A O no hydrogen 3.296 N/A ARG 133.A N THR 129.A O no hydrogen 3.058 N/A ARG 133.A NE ASP 159.A O no hydrogen 2.708 N/A ARG 133.A NH1 ASP 130.A OD1 no hydrogen 2.658 N/A ARG 133.A NH2 ASP 159.A OD2 no hydrogen 2.945 N/A LEU 134.A N ASP 130.A O no hydrogen 2.823 N/A ALA 135.A N LEU 131.A O no hydrogen 2.863 N/A ARG 136.A N SER 132.A O no hydrogen 3.089 N/A ARG 136.A NE SER 162.A O no hydrogen 2.966 N/A ARG 136.A NH1 TYR 26.A O no hydrogen 2.766 N/A ARG 136.A NH1 ASP 159.A OD1 no hydrogen 3.025 N/A ARG 136.A NH2 ASP 159.A O no hydrogen 2.462 N/A ARG 136.A NH2 ASP 159.A OD1 no hydrogen 3.048 N/A ARG 136.A NH2 SER 162.A O no hydrogen 2.800 N/A ARG 137.A N LEU 134.A O no hydrogen 2.962 N/A GLY 138.A N ALA 135.A O no hydrogen 2.852 N/A SER 139.A N ALA 135.A O no hydrogen 3.041 N/A SER 139.A OG SER 141.A OG no hydrogen 3.356 N/A SER 141.A OG SER 139.A OG no hydrogen 3.356 N/A ALA 142.A N SER 139.A O no hydrogen 2.723 N/A SER 143.A N GLY 140.A O no hydrogen 3.012 N/A SER 143.A OG GLY 140.A O no hydrogen 2.891 N/A ARG 144.A N SER 141.A O no hydrogen 3.027 N/A ARG 144.A NE ASN 12.A OD1 no hydrogen 3.055 N/A ARG 144.A NH2 ASN 12.A OD1 no hydrogen 3.010 N/A SER 145.A N ALA 142.A O no hydrogen 2.823 N/A SER 145.A OG HIS 10.A O no hydrogen 3.023 N/A PHE 147.A N ARG 144.A O no hydrogen 3.347 N/A GLY 149.A N ILE 319.A O no hydrogen 2.674 N/A ALA 151.A N SER 35.A O no hydrogen 2.998 N/A GLU 152.A N HIS 165.A O no hydrogen 2.876 N/A TRP 153.A N SER 33.A O no hydrogen 2.895 N/A TRP 153.A NE1 SER 162.A OG no hydrogen 3.114 N/A GLU 154.A N TYR 163.A O no hydrogen 2.888 N/A LYS 155.A N ASN 32.A OD1 no hydrogen 2.737 N/A GLY 156.A N GLU 154.A OE2 no hydrogen 3.458 N/A HIS 157.A N THR 161.A OG1 no hydrogen 2.878 N/A ASP 158.A N THR 161.A OG1 no hydrogen 2.971 N/A LEU 160.A N ASP 158.A OD1 no hydrogen 2.734 N/A THR 161.A N ASP 158.A O no hydrogen 3.164 N/A THR 161.A N ASP 158.A OD1 no hydrogen 3.078 N/A THR 161.A OG1 ASP 158.A O no hydrogen 3.293 N/A THR 161.A OG1 ASP 158.A OD1 no hydrogen 3.038 N/A SER 162.A N ASP 158.A O no hydrogen 3.056 N/A SER 162.A OG LYS 155.A O no hydrogen 3.154 N/A TYR 163.A N GLU 154.A O no hydrogen 3.273 N/A ALA 164.A N SER 132.A OG no hydrogen 2.895 N/A HIS 165.A N GLU 152.A O no hydrogen 2.887 N/A HIS 165.A ND1 GLY 166.A O no hydrogen 3.058 N/A ILE 167.A N PHE 150.A O no hydrogen 3.028 N/A TRP 172.A N SER 169.A O no hydrogen 2.870 N/A LYS 174.A N GLY 171.A O no hydrogen 3.074 N/A ASP 175.A N TRP 172.A O no hydrogen 3.093 N/A LEU 176.A N GLU 173.A O no hydrogen 3.254 N/A SER 177.A OG SER 316.A O no hydrogen 3.219 N/A MET 178.A N SER 316.A O no hydrogen 2.942 N/A ILE 179.A N VAL 290.A O no hydrogen 2.819 N/A PHE 180.A N ILE 314.A O no hydrogen 2.956 N/A VAL 181.A N VAL 288.A O no hydrogen 2.786 N/A VAL 182.A N LYS 312.A O no hydrogen 2.817 N/A ASN 184.A N ASN 287.A OD1 no hydrogen 3.031 N/A GLN 186.A N ASN 184.A OD1 no hydrogen 2.714 N/A LYS 188.A N ALA 101.A O no hydrogen 2.748 N/A LYS 188.A NZ SER 192.A OG no hydrogen 2.667 N/A LYS 188.A NZ ALA 284.A O no hydrogen 2.860 N/A SER 191.A OG SER 194.A OG no hydrogen 2.998 N/A ARG 193.A NH2 GLY 138.A O no hydrogen 2.915 N/A SER 194.A OG SER 191.A O no hydrogen 3.501 N/A SER 194.A OG SER 191.A OG no hydrogen 2.998 N/A GLY 195.A N SER 191.A O no hydrogen 3.028 N/A MET 196.A N SER 192.A O no hydrogen 2.963 N/A SER 197.A N ARG 193.A O no hydrogen 3.051 N/A LEU 198.A N SER 194.A O no hydrogen 3.065 N/A THR 199.A N GLY 195.A O no hydrogen 2.927 N/A THR 199.A OG1 GLY 195.A O no hydrogen 3.540 N/A THR 199.A OG1 ASN 247.A OD1 no hydrogen 2.529 N/A ARG 200.A N MET 196.A O no hydrogen 2.880 N/A ARG 200.A NE LYS 21.A O no hydrogen 3.121 N/A ASP 201.A N SER 197.A O no hydrogen 3.146 N/A THR 202.A N LEU 198.A O no hydrogen 3.171 N/A THR 202.A OG1 LEU 198.A O no hydrogen 2.632 N/A SER 203.A N THR 199.A O no hydrogen 2.913 N/A SER 203.A OG THR 246.A O no hydrogen 2.635 N/A ARG 204.A N GLY 249.A O no hydrogen 3.076 N/A ARG 204.A NE GLY 249.A O no hydrogen 3.000 N/A ARG 204.A NH2 ALA 250.A O no hydrogen 3.082 N/A PHE 205.A N SER 203.A OG no hydrogen 3.147 N/A TYR 206.A N SER 203.A O no hydrogen 3.190 N/A TYR 206.A OH TRP 19.A O no hydrogen 2.706 N/A GLN 207.A NE2 ASP 211.A OD1 no hydrogen 2.709 N/A TRP 209.A N PHE 205.A O no hydrogen 3.049 N/A TRP 209.A NE1 ASN 31.A OD1 no hydrogen 3.047 N/A LEU 210.A N TYR 206.A O no hydrogen 2.933 N/A ASP 211.A N GLN 207.A O no hydrogen 2.936 N/A HIS 212.A N TRP 209.A O no hydrogen 3.375 N/A ASP 216.A N HIS 212.A O no hydrogen 3.167 N/A LEU 217.A N VAL 213.A O no hydrogen 3.133 N/A ASN 218.A N ASP 214.A O no hydrogen 3.197 N/A GLU 219.A N GLU 215.A O no hydrogen 3.340 N/A ALA 220.A N ASP 216.A O no hydrogen 2.782 N/A LYS 221.A N LEU 217.A O no hydrogen 2.773 N/A LYS 221.A NZ GLU 152.A OE1 no hydrogen 3.536 N/A LYS 221.A NZ GLU 152.A OE2 no hydrogen 3.382 N/A GLU 222.A N ASN 218.A O no hydrogen 2.664 N/A ALA 223.A N GLU 219.A O no hydrogen 2.872 N/A VAL 224.A N ALA 220.A O no hydrogen 2.992 N/A LYS 225.A N LYS 221.A O no hydrogen 3.052 N/A LYS 225.A NZ GLU 222.A OE1 no hydrogen 2.930 N/A LYS 225.A NZ GLU 222.A OE2 no hydrogen 2.791 N/A ASN 226.A N ALA 223.A O no hydrogen 3.260 N/A GLN 227.A NE2 SER 169.A O no hydrogen 3.593 N/A ASP 228.A N ALA 223.A O no hydrogen 3.204 N/A GLN 230.A NE2 GLU 234.A OE2 no hydrogen 3.261 N/A ARG 231.A NE GLU 219.A OE1 no hydrogen 3.169 N/A ARG 231.A NE GLU 219.A OE2 no hydrogen 3.178 N/A ARG 231.A NH2 GLU 219.A OE1 no hydrogen 2.938 N/A LEU 232.A N ASP 228.A O no hydrogen 3.024 N/A GLY 233.A N PHE 229.A O no hydrogen 2.789 N/A GLU 234.A N GLN 230.A O no hydrogen 3.104 N/A ILE 236.A N LEU 232.A O no hydrogen 3.142 N/A GLU 237.A N GLY 233.A O no hydrogen 2.816 N/A ALA 238.A N GLU 234.A O no hydrogen 3.176 N/A ASN 239.A N VAL 235.A O no hydrogen 2.783 N/A ASN 239.A ND2 ASP 216.A OD2 no hydrogen 3.158 N/A GLY 240.A N ILE 236.A O no hydrogen 2.919 N/A LEU 241.A N GLU 237.A O no hydrogen 3.165 N/A ARG 242.A N ALA 238.A O no hydrogen 2.824 N/A ARG 242.A NE TYR 208.A OH no hydrogen 3.277 N/A ARG 242.A NH1 ASP 216.A OD2 no hydrogen 2.703 N/A MET 243.A N ASN 239.A O no hydrogen 2.875 N/A HIS 244.A N GLY 240.A O no hydrogen 3.121 N/A HIS 244.A NE2 MET 282.A O no hydrogen 2.773 N/A ALA 245.A N LEU 241.A O no hydrogen 2.890 N/A THR 246.A N ARG 242.A O no hydrogen 3.312 N/A THR 246.A N MET 243.A O no hydrogen 3.112 N/A THR 246.A OG1 MET 243.A O no hydrogen 2.876 N/A ASN 247.A N HIS 244.A O no hydrogen 2.899 N/A LEU 248.A N ALA 245.A O no hydrogen 2.983 N/A GLY 249.A N THR 246.A O no hydrogen 3.297 N/A ALA 250.A N ASN 247.A O no hydrogen 3.200 N/A GLN 251.A N THR 202.A OG1 no hydrogen 3.128 N/A PHE 254.A N ASN 247.A O no hydrogen 3.169 N/A TYR 256.A OH VAL 190.A O no hydrogen 3.037 N/A LEU 257.A N THR 255.A OG1 no hydrogen 3.135 N/A VAL 258.A N SER 261.A OG no hydrogen 3.072 N/A GLN 259.A NE2 GLN 259.A O no hydrogen 3.012 N/A GLN 259.A NE2 ASP 263.A OD1 no hydrogen 2.852 N/A SER 261.A OG VAL 258.A O no hydrogen 3.365 N/A SER 261.A OG PRO 286.A O no hydrogen 2.714 N/A TYR 262.A N VAL 258.A O no hydrogen 3.275 N/A ASP 263.A N GLN 259.A O no hydrogen 2.850 N/A ALA 264.A N GLU 260.A O no hydrogen 2.918 N/A MET 265.A N SER 261.A O no hydrogen 3.079 N/A ALA 266.A N TYR 262.A O no hydrogen 2.980 N/A ILE 267.A N ASP 263.A O no hydrogen 3.233 N/A VAL 268.A N ALA 264.A O no hydrogen 3.136 N/A GLU 269.A N MET 265.A O no hydrogen 3.047 N/A GLN 270.A N ALA 266.A O no hydrogen 2.879 N/A CYS 271.A N ILE 267.A O no hydrogen 2.872 N/A CYS 271.A SG ILE 267.A O no hydrogen 3.314 N/A ARG 272.A N VAL 268.A O no hydrogen 2.966 N/A ARG 272.A NE CYS 278.A O no hydrogen 3.125 N/A ARG 272.A NH1 GLU 269.A OE1 no hydrogen 2.752 N/A LYS 273.A N GLU 269.A O no hydrogen 2.910 N/A ALA 274.A N GLN 270.A O no hydrogen 2.767 N/A ASN 275.A N ARG 272.A O no hydrogen 3.214 N/A LEU 276.A N CYS 271.A O no hydrogen 2.792 N/A CYS 278.A SG VAL 268.A O no hydrogen 3.859 N/A CYS 278.A SG LEU 276.A O no hydrogen 3.369 N/A TYR 279.A N LEU 291.A O no hydrogen 2.989 N/A PHE 280.A N GLU 237.A OE1 no hydrogen 3.037 N/A THR 281.A N LYS 289.A O no hydrogen 2.982 N/A ASN 287.A ND2 ALA 102.A O no hydrogen 3.132 N/A ASN 287.A ND2 ASN 184.A O no hydrogen 3.029 N/A VAL 288.A N VAL 181.A O no hydrogen 3.180 N/A LYS 289.A N THR 281.A O no hydrogen 2.945 N/A LYS 289.A NZ ASN 287.A O no hydrogen 3.483 N/A VAL 290.A N ILE 179.A O no hydrogen 2.813 N/A LEU 291.A N TYR 279.A O no hydrogen 2.633 N/A VAL 292.A N SER 177.A O no hydrogen 3.041 N/A LYS 294.A N ASP 175.A O no hydrogen 2.749 N/A LYS 294.A NZ LYS 174.A O no hydrogen 3.331 N/A ASN 296.A N GLU 293.A O no hydrogen 3.080 N/A LYS 297.A N LYS 294.A O no hydrogen 3.146 N/A VAL 300.A N ASN 296.A O no hydrogen 3.031 N/A MET 301.A N LYS 297.A O no hydrogen 2.784 N/A GLU 302.A N GLN 298.A O no hydrogen 2.750 N/A GLN 303.A N ALA 299.A O no hydrogen 3.065 N/A PHE 304.A N VAL 300.A O no hydrogen 3.411 N/A LEU 305.A N MET 301.A O no hydrogen 3.354 N/A LEU 305.A N GLU 302.A O no hydrogen 2.906 N/A LYS 306.A NZ GLN 303.A OE1 no hydrogen 3.570 N/A VAL 307.A N PHE 304.A O no hydrogen 2.883 N/A PHE 308.A N PHE 304.A O no hydrogen 2.806 N/A SER 311.A OG ASP 309.A OD2 no hydrogen 2.818 N/A ILE 314.A N PHE 180.A O no hydrogen 3.042 N/A SER 316.A N MET 178.A O no hydrogen 3.003 N/A SER 316.A OG ASP 317.A O no hydrogen 2.792 N/A ILE 319.A N THR 37.A O no hydrogen 3.042 N/A SER 320.A OG GLU 173.A OE2 no hydrogen 2.759 N/A VAL 323.A N ILE 146.A O no hydrogen 3.009 N/A GLU 324.A N ARG 8.A O no hydrogen 3.202 N/A ILE 326.A N LYS 6.A O no hydrogen 2.703 N/A