Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dap_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 3.A ND2 ASP 29.A OD1 no hydrogen 3.381 N/A ASN 3.A ND2 ASP 29.A OD2 no hydrogen 3.250 N/A ILE 4.A N ASP 27.A O no hydrogen 3.009 N/A ARG 5.A N ASP 60.A OD2 no hydrogen 2.708 N/A ARG 5.A NE ASP 60.A OD1 no hydrogen 3.357 N/A ARG 5.A NE ASP 60.A OD2 no hydrogen 3.327 N/A ARG 5.A NH1 ASP 57.A O no hydrogen 2.867 N/A ARG 5.A NH2 ASP 57.A O no hydrogen 3.198 N/A ARG 5.A NH2 ASP 60.A OD1 no hydrogen 2.841 N/A VAL 6.A N ASP 29.A O no hydrogen 2.862 N/A ALA 7.A N VAL 61.A O no hydrogen 3.150 N/A ILE 8.A N GLY 32.A O no hydrogen 3.093 N/A VAL 9.A N PHE 63.A O no hydrogen 2.883 N/A GLY 10.A N PHE 34.A O no hydrogen 3.074 N/A TYR 11.A OH GLU 19.A OE1 no hydrogen 2.678 N/A ARG 16.A N GLY 12.A O no hydrogen 3.005 N/A SER 17.A N ASN 13.A O no hydrogen 2.984 N/A SER 17.A OG ASN 13.A O no hydrogen 3.194 N/A SER 17.A OG ASP 272.A OD1 no hydrogen 2.645 N/A VAL 18.A N LEU 14.A O no hydrogen 2.942 N/A GLU 19.A N GLY 15.A O no hydrogen 3.077 N/A LYS 20.A N ARG 16.A O no hydrogen 3.297 N/A LYS 20.A NZ ASP 272.A OD1 no hydrogen 3.443 N/A LYS 20.A NZ ASP 272.A OD2 no hydrogen 2.886 N/A LEU 21.A N SER 17.A O no hydrogen 3.214 N/A ILE 22.A N VAL 18.A O no hydrogen 3.089 N/A LYS 24.A N LEU 21.A O no hydrogen 2.892 N/A GLN 25.A N ILE 22.A O no hydrogen 2.953 N/A ASP 29.A N ILE 4.A O no hydrogen 2.885 N/A VAL 31.A N VAL 6.A O no hydrogen 2.782 N/A ILE 33.A N PRO 45.A O no hydrogen 2.827 N/A PHE 34.A N ILE 8.A O no hydrogen 2.807 N/A SER 35.A N PHE 47.A O no hydrogen 2.860 N/A SER 35.A OG ARG 37.A O no hydrogen 3.454 N/A ARG 36.A NH1 ASP 71.A OD1 no hydrogen 3.439 N/A ARG 36.A NH1 ASP 71.A OD2 no hydrogen 3.420 N/A ARG 36.A NH2 ASP 71.A OD2 no hydrogen 3.381 N/A ARG 37.A N SER 35.A OG no hydrogen 3.159 N/A ARG 37.A NH2 TYR 11.A O no hydrogen 2.852 N/A THR 42.A N LEU 40.A O no hydrogen 2.884 N/A THR 42.A OG1 GLU 19.A OE2 no hydrogen 2.655 N/A THR 44.A N THR 42.A OG1 no hydrogen 3.349 N/A THR 44.A OG1 GLU 19.A OE2 no hydrogen 3.005 N/A PHE 47.A N ILE 33.A O no hydrogen 2.728 N/A VAL 49.A N SER 35.A O no hydrogen 3.314 N/A ALA 50.A N ASP 48.A OD1 no hydrogen 3.298 N/A ASP 51.A N ASP 48.A O no hydrogen 2.921 N/A LYS 54.A N ASP 51.A O no hydrogen 3.043 N/A HIS 55.A N VAL 52.A O no hydrogen 3.035 N/A HIS 55.A ND1 ASP 58.A OD2 no hydrogen 3.183 N/A ASP 58.A N HIS 55.A O no hydrogen 2.783 N/A ASP 60.A N ARG 5.A O no hydrogen 2.849 N/A VAL 61.A N ARG 5.A O no hydrogen 3.333 N/A LEU 62.A N CYS 84.A O no hydrogen 2.697 N/A PHE 63.A N ALA 7.A O no hydrogen 2.747 N/A LEU 64.A N VAL 86.A O no hydrogen 2.921 N/A CYS 65.A N VAL 9.A O no hydrogen 2.742 N/A CYS 65.A SG PHE 63.A O no hydrogen 3.722 N/A CYS 65.A SG GLN 278.A OE1 no hydrogen 3.944 N/A GLY 67.A N ASP 71.A OD2 no hydrogen 3.315 N/A SER 68.A OG ASP 90.A OD1 no hydrogen 3.306 N/A THR 70.A OG1 GLU 74.A OE1 no hydrogen 3.560 N/A ILE 72.A N GLY 67.A O no hydrogen 3.183 N/A GLN 75.A N ASP 71.A O no hydrogen 2.823 N/A ALA 76.A N ILE 72.A O no hydrogen 3.017 N/A LYS 78.A N GLN 75.A O no hydrogen 2.967 N/A PHE 79.A N GLN 75.A O no hydrogen 3.457 N/A ALA 80.A N ALA 76.A O no hydrogen 3.330 N/A PHE 82.A N PHE 79.A O no hydrogen 2.977 N/A CYS 84.A N ASP 60.A O no hydrogen 3.178 N/A CYS 84.A SG ALA 285.A O no hydrogen 3.933 N/A THR 85.A N VAL 112.A O no hydrogen 3.183 N/A VAL 86.A N LEU 62.A O no hydrogen 3.160 N/A ASP 87.A N LEU 114.A O no hydrogen 3.173 N/A TYR 89.A N ASP 87.A OD1 no hydrogen 3.137 N/A TYR 89.A OH ASP 94.A OD2 no hydrogen 2.558 N/A HIS 92.A N ASP 90.A O no hydrogen 2.937 N/A ASP 94.A N ASN 91.A O no hydrogen 2.721 N/A ILE 95.A N HIS 92.A O no hydrogen 3.277 N/A ARG 97.A NE ASP 94.A OD1 no hydrogen 2.819 N/A ARG 97.A NE ASP 94.A OD2 no hydrogen 3.191 N/A ARG 97.A NH2 ASP 94.A OD2 no hydrogen 3.189 N/A HIS 98.A N ASP 94.A O no hydrogen 2.865 N/A HIS 98.A NE2 ASP 87.A OD2 no hydrogen 2.854 N/A ARG 99.A N ILE 95.A O no hydrogen 2.901 N/A GLN 100.A N PRO 96.A O no hydrogen 3.140 N/A VAL 101.A N ARG 97.A O no hydrogen 3.123 N/A MET 102.A N HIS 98.A O no hydrogen 3.028 N/A ASN 103.A N ARG 99.A O no hydrogen 2.872 N/A GLU 104.A N GLN 100.A O no hydrogen 3.202 N/A ALA 105.A N VAL 101.A O no hydrogen 3.337 N/A ALA 106.A N MET 102.A O no hydrogen 2.835 N/A THR 107.A N ASN 103.A O no hydrogen 3.084 N/A THR 107.A OG1 ASN 103.A O no hydrogen 2.934 N/A ALA 108.A N GLU 104.A O no hydrogen 3.232 N/A ALA 109.A N ALA 105.A O no hydrogen 3.104 N/A GLY 110.A N THR 107.A O no hydrogen 3.103 N/A ASN 111.A N ALA 106.A O no hydrogen 2.812 N/A ASN 111.A ND2 ALA 80.A O no hydrogen 3.039 N/A ALA 113.A N GLY 295.A O no hydrogen 3.030 N/A LEU 114.A N THR 85.A O no hydrogen 2.844 N/A VAL 115.A N PHE 297.A O no hydrogen 3.065 N/A SER 116.A N ASP 87.A OD1 no hydrogen 2.817 N/A SER 116.A OG TYR 89.A O no hydrogen 2.895 N/A THR 117.A N ASP 87.A O no hydrogen 2.868 N/A THR 117.A OG1 ASP 87.A O no hydrogen 2.842 N/A GLY 118.A N SER 277.A OG no hydrogen 3.326 N/A TRP 119.A NE1 ASN 270.A OD1 no hydrogen 2.984 N/A GLY 122.A N SER 125.A OG no hydrogen 2.890 N/A MET 123.A N GLY 118.A O no hydrogen 3.171 N/A PHE 124.A N TRP 119.A O no hydrogen 2.591 N/A SER 125.A OG ASP 120.A O no hydrogen 2.838 N/A ILE 126.A N GLY 122.A O no hydrogen 3.023 N/A ASN 127.A N MET 123.A O no hydrogen 3.083 N/A ARG 128.A N PHE 124.A O no hydrogen 2.959 N/A ARG 128.A NH1 ASP 120.A OD1 no hydrogen 3.535 N/A ARG 128.A NH2 ASP 120.A OD1 no hydrogen 2.919 N/A VAL 129.A N SER 125.A O no hydrogen 3.257 N/A TYR 130.A N ILE 126.A O no hydrogen 3.123 N/A ALA 131.A N ASN 127.A O no hydrogen 2.959 N/A ALA 132.A N ARG 128.A O no hydrogen 2.999 N/A ALA 133.A N VAL 129.A O no hydrogen 3.225 N/A VAL 134.A N TYR 130.A O no hydrogen 3.122 N/A LEU 135.A N ALA 131.A O no hydrogen 3.081 N/A GLN 139.A N THR 251.A O no hydrogen 3.000 N/A GLN 140.A NE2 ARG 128.A O no hydrogen 3.001 N/A GLN 140.A NE2 THR 250.A OG1 no hydrogen 2.787 N/A HIS 141.A N ILE 249.A O no hydrogen 2.893 N/A PHE 143.A N HIS 247.A O no hydrogen 2.688 N/A TRP 144.A N HIS 193.A NE2 no hydrogen 3.175 N/A TRP 144.A NE1 ASP 120.A OD2 no hydrogen 2.773 N/A GLY 145.A N GLY 245.A O no hydrogen 2.514 N/A GLY 147.A N THR 169.A O no hydrogen 3.146 N/A LEU 148.A N PRO 243.A O no hydrogen 3.188 N/A SER 149.A N GLN 167.A O no hydrogen 3.008 N/A SER 153.A N SER 149.A O no hydrogen 2.829 N/A SER 153.A OG SER 149.A O no hydrogen 3.074 N/A ASP 154.A N GLN 150.A O no hydrogen 2.966 N/A ALA 155.A N HIS 152.A O no hydrogen 3.222 N/A LEU 156.A N HIS 152.A O no hydrogen 3.193 N/A ARG 157.A N SER 153.A O no hydrogen 3.107 N/A ARG 157.A NH1 ASP 154.A OD1 no hydrogen 3.025 N/A ILE 159.A N LEU 156.A O no hydrogen 3.350 N/A VAL 162.A N ILE 159.A O no hydrogen 3.432 N/A GLN 163.A N VAL 200.A O no hydrogen 2.951 N/A LYS 164.A NZ GLU 232.A OE2 no hydrogen 3.191 N/A LYS 164.A NZ ASP 236.A OD1 no hydrogen 2.767 N/A GLN 167.A N SER 153.A OG no hydrogen 2.969 N/A TYR 168.A N GLN 196.A O no hydrogen 2.899 N/A TYR 168.A OH HIS 239.A ND1 no hydrogen 2.890 N/A THR 169.A N GLY 147.A O no hydrogen 2.934 N/A THR 169.A OG1 GLN 167.A OE1 no hydrogen 3.295 N/A LEU 170.A N LYS 194.A O no hydrogen 3.038 N/A SER 172.A N THR 192.A O no hydrogen 2.897 N/A LEU 176.A N SER 172.A O no hydrogen 3.055 N/A GLU 177.A N GLU 173.A O no hydrogen 3.345 N/A LYS 178.A N ASP 174.A O no hydrogen 3.111 N/A ALA 179.A N ALA 175.A O no hydrogen 2.954 N/A ARG 180.A N LEU 176.A O no hydrogen 2.996 N/A ARG 180.A NE GLU 262.A OE1 no hydrogen 2.910 N/A ARG 180.A NH1 GLU 177.A OE1 no hydrogen 3.364 N/A ARG 180.A NH2 GLU 262.A OE1 no hydrogen 3.511 N/A ARG 180.A NH2 GLU 262.A OE2 no hydrogen 2.959 N/A ARG 181.A N LYS 178.A O no hydrogen 3.269 N/A GLY 182.A N ALA 179.A O no hydrogen 3.281 N/A GLU 183.A N LYS 178.A O no hydrogen 2.605 N/A LEU 187.A N ALA 184.A O no hydrogen 3.237 N/A THR 188.A N GLN 191.A OE1 no hydrogen 2.827 N/A THR 188.A OG1 GLN 191.A OE1 no hydrogen 3.084 N/A GLN 191.A N THR 188.A O no hydrogen 2.881 N/A THR 192.A OG1 GLY 189.A O no hydrogen 3.127 N/A THR 192.A OG1 HIS 193.A ND1 no hydrogen 2.915 N/A HIS 193.A ND1 THR 192.A OG1 no hydrogen 2.915 N/A LYS 194.A N LEU 170.A O no hydrogen 2.801 N/A ARG 195.A N GLU 224.A O no hydrogen 3.074 N/A ARG 195.A NH1 GLN 167.A OE1 no hydrogen 2.772 N/A ARG 195.A NH1 THR 169.A OG1 no hydrogen 3.203 N/A GLN 196.A N TYR 168.A O no hydrogen 3.136 N/A GLN 196.A NE2 GLU 226.A OE2 no hydrogen 3.009 N/A CYS 197.A N GLU 226.A O no hydrogen 2.698 N/A PHE 198.A N VAL 166.A O no hydrogen 3.180 N/A VAL 199.A N ASN 228.A O no hydrogen 2.840 N/A VAL 200.A N LYS 164.A O no hydrogen 3.008 N/A ASP 205.A N ASP 202.A O no hydrogen 2.834 N/A HIS 206.A N ALA 203.A O no hydrogen 3.179 N/A ARG 208.A NH1 PRO 160.A O no hydrogen 3.116 N/A ARG 208.A NH1 ASP 212.A OD2 no hydrogen 3.082 N/A ARG 208.A NH2 PRO 160.A O no hydrogen 2.978 N/A ILE 209.A N ASP 205.A O no hydrogen 2.953 N/A GLU 210.A N HIS 206.A O no hydrogen 3.121 N/A ASN 211.A N GLU 207.A O no hydrogen 3.319 N/A ASP 212.A N ARG 208.A O no hydrogen 2.898 N/A ILE 213.A N ILE 209.A O no hydrogen 2.971 N/A ARG 214.A N GLU 210.A O no hydrogen 3.036 N/A ARG 214.A NE GLU 210.A OE2 no hydrogen 3.280 N/A ARG 214.A NH1 VAL 225.A O no hydrogen 3.107 N/A ARG 214.A NH2 GLU 210.A OE2 no hydrogen 3.464 N/A ARG 214.A NH2 VAL 225.A O no hydrogen 3.560 N/A THR 215.A N ASN 211.A O no hydrogen 2.988 N/A THR 215.A OG1 ASN 211.A O no hydrogen 2.994 N/A MET 216.A N ILE 213.A O no hydrogen 3.286 N/A PHE 220.A N MET 216.A O no hydrogen 3.188 N/A VAL 221.A N MET 216.A O no hydrogen 3.258 N/A TYR 223.A N PHE 220.A O no hydrogen 3.249 N/A GLU 226.A N ARG 195.A O no hydrogen 2.845 N/A ASN 228.A N CYS 197.A O no hydrogen 3.023 N/A ASN 228.A ND2 CYS 197.A O no hydrogen 3.224 N/A ASN 228.A ND2 GLU 226.A OE2 no hydrogen 3.055 N/A ILE 230.A N VAL 199.A O no hydrogen 3.110 N/A ALA 233.A N ASP 231.A OD2 no hydrogen 3.062 N/A THR 234.A N ASP 231.A O no hydrogen 3.024 N/A PHE 235.A N ASP 231.A O no hydrogen 3.083 N/A ASP 236.A N GLU 232.A O no hydrogen 3.176 N/A SER 237.A N ALA 233.A O no hydrogen 3.322 N/A SER 237.A OG ALA 233.A O no hydrogen 3.192 N/A GLU 238.A N THR 234.A O no hydrogen 3.092 N/A HIS 239.A N PHE 235.A O no hydrogen 2.931 N/A HIS 239.A ND1 TYR 168.A OH no hydrogen 2.890 N/A THR 240.A OG1 ASP 236.A O no hydrogen 3.424 N/A HIS 244.A N LEU 267.A O no hydrogen 3.006 N/A GLY 245.A N HIS 244.A ND1 no hydrogen 3.041 N/A GLY 246.A N LEU 265.A O no hydrogen 3.031 N/A HIS 247.A N PHE 143.A O no hydrogen 2.735 N/A HIS 247.A ND1 GLU 262.A OE2 no hydrogen 2.768 N/A VAL 248.A N TYR 263.A O no hydrogen 2.869 N/A ILE 249.A N HIS 141.A O no hydrogen 2.903 N/A THR 250.A N VAL 261.A O no hydrogen 2.885 N/A THR 251.A N GLN 139.A O no hydrogen 2.996 N/A GLY 252.A N HIS 259.A O no hydrogen 3.157 N/A THR 254.A N PHE 257.A O no hydrogen 2.721 N/A THR 254.A OG1 PHE 257.A O no hydrogen 3.461 N/A GLY 255.A N ASP 253.A OD2 no hydrogen 3.000 N/A GLY 256.A N ASP 253.A OD2 no hydrogen 2.994 N/A HIS 259.A N GLY 252.A O no hydrogen 2.950 N/A THR 260.A OG1 ARG 180.A O no hydrogen 2.731 N/A VAL 261.A N THR 250.A O no hydrogen 2.804 N/A TYR 263.A N VAL 248.A O no hydrogen 2.849 N/A LEU 265.A N GLY 246.A O no hydrogen 3.041 N/A LYS 266.A NZ HIS 247.A NE2 no hydrogen 3.274 N/A LEU 267.A N HIS 244.A O no hydrogen 2.777 N/A ASN 270.A N MET 242.A O no hydrogen 2.763 N/A PHE 273.A N ARG 269.A O no hydrogen 3.424 N/A THR 274.A N ASN 270.A O no hydrogen 3.048 N/A THR 274.A OG1 ASN 270.A O no hydrogen 3.030 N/A THR 274.A OG1 ASN 270.A OD1 no hydrogen 2.973 N/A ALA 275.A N PRO 271.A O no hydrogen 2.936 N/A SER 276.A N ASP 272.A O no hydrogen 3.141 N/A SER 276.A OG ASP 272.A O no hydrogen 2.788 N/A SER 277.A N PHE 273.A O no hydrogen 3.157 N/A SER 277.A OG GLY 118.A O no hydrogen 2.896 N/A GLN 278.A N THR 274.A O no hydrogen 2.952 N/A GLN 278.A NE2 LEU 64.A O no hydrogen 3.193 N/A GLN 278.A NE2 VAL 86.A O no hydrogen 3.116 N/A ILE 279.A N ALA 275.A O no hydrogen 2.882 N/A ALA 280.A N SER 276.A O no hydrogen 3.091 N/A PHE 281.A N SER 277.A O no hydrogen 3.096 N/A GLY 282.A N GLN 278.A O no hydrogen 3.076 N/A GLY 282.A N ILE 279.A O no hydrogen 3.019 N/A ARG 283.A N ILE 279.A O no hydrogen 3.165 N/A ARG 283.A N ALA 280.A O no hydrogen 3.250 N/A ARG 283.A NE ASP 27.A OD2 no hydrogen 2.904 N/A ARG 283.A NH1 LEU 307.A O no hydrogen 3.004 N/A ARG 283.A NH2 ASP 27.A OD1 no hydrogen 2.835 N/A ALA 284.A N ALA 280.A O no hydrogen 3.214 N/A ALA 285.A N PHE 281.A O no hydrogen 2.883 N/A HIS 286.A N GLY 282.A O no hydrogen 3.271 N/A ARG 287.A N ARG 283.A O no hydrogen 3.105 N/A ARG 287.A NH1 LEU 306.A O no hydrogen 3.023 N/A ARG 287.A NH1 SER 308.A O no hydrogen 2.542 N/A ARG 287.A NH2 SER 308.A O no hydrogen 2.603 N/A MET 288.A N ALA 284.A O no hydrogen 2.995 N/A LYS 289.A N ALA 285.A O no hydrogen 3.186 N/A LYS 289.A NZ ASN 111.A OD1 no hydrogen 2.932 N/A GLN 290.A N HIS 286.A O no hydrogen 3.203 N/A GLN 291.A N ARG 287.A O no hydrogen 3.230 N/A GLY 292.A N LYS 289.A O no hydrogen 3.210 N/A GLN 293.A N MET 288.A O no hydrogen 3.160 N/A GLY 295.A N ASN 111.A O no hydrogen 2.901 N/A ALA 296.A N ASN 103.A OD1 no hydrogen 2.921 N/A PHE 297.A N ALA 113.A O no hydrogen 2.817 N/A THR 298.A N GLU 301.A OE2 no hydrogen 2.863 N/A THR 298.A OG1 GLU 301.A OE2 no hydrogen 2.673 N/A GLU 301.A N THR 298.A O no hydrogen 3.100 N/A LEU 306.A N ALA 303.A O no hydrogen 3.094 N/A LEU 307.A N PRO 304.A O no hydrogen 3.212 N/A SER 308.A N TYR 305.A O no hydrogen 3.047 N/A GLU 310.A N SER 308.A OG no hydrogen 3.152 N/A LEU 315.A N ASN 311.A O no hydrogen 2.999 N/A ILE 316.A N LEU 312.A O no hydrogen 2.875 N/A ALA 317.A N ASP 313.A O no hydrogen 3.077 N/A ARG 318.A N ASP 314.A O no hydrogen 3.010 N/A ARG 318.A N LEU 315.A O no hydrogen 3.231 N/A ARG 318.A NE ASP 319.A OD1 no hydrogen 3.158 N/A ARG 318.A NE ASP 319.A OD2 no hydrogen 3.292 N/A ARG 318.A NH2 ASP 319.A OD2 no hydrogen 3.388 N/A ASP 319.A N LEU 315.A O no hydrogen 2.732 N/A