Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6vug_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N ASP 112.A OD2 no hydrogen 3.053 N/A LYS 7.A N GLN 81.A OE1 no hydrogen 2.698 N/A LYS 9.A N ARG 79.A O no hydrogen 2.964 N/A LYS 9.A NZ LYS 78.A O no hydrogen 3.548 N/A VAL 17.A N ASN 53.A O no hydrogen 3.104 N/A GLN 19.A NE2 VAL 56.A O no hydrogen 2.488 N/A LYS 26.A NZ GLU 395.A OE1 no hydrogen 3.317 N/A ILE 27.A N THR 23.A O no hydrogen 2.989 N/A LYS 28.A N GLU 24.A O no hydrogen 2.949 N/A ALA 29.A N GLU 25.A O no hydrogen 2.956 N/A LEU 30.A N LYS 26.A O no hydrogen 2.724 N/A VAL 31.A N ILE 27.A O no hydrogen 3.107 N/A ILE 33.A N ALA 29.A O no hydrogen 3.347 N/A CYS 34.A N LEU 30.A O no hydrogen 2.948 N/A CYS 34.A SG LEU 30.A O no hydrogen 3.302 N/A THR 35.A N VAL 31.A O no hydrogen 3.190 N/A THR 35.A OG1 VAL 31.A O no hydrogen 3.120 N/A THR 35.A OG1 GLU 32.A O no hydrogen 3.045 N/A MET 37.A N ILE 33.A O no hydrogen 2.907 N/A GLU 38.A N CYS 34.A O no hydrogen 2.846 N/A GLU 38.A N THR 35.A O no hydrogen 3.186 N/A LYS 39.A N THR 35.A O no hydrogen 2.974 N/A GLY 41.A N GLU 38.A O no hydrogen 3.132 N/A ILE 43.A N MET 37.A O no hydrogen 3.097 N/A SER 44.A N GLN 136.A O no hydrogen 3.083 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.619 N/A ASN 50.A N GLY 47.A O no hydrogen 3.287 N/A ASN 50.A ND2 LYS 117.A O no hydrogen 2.945 N/A TYR 52.A N ASN 50.A OD1 no hydrogen 3.341 N/A TYR 52.A OH ASP 13.A OD1 no hydrogen 2.639 N/A ASN 53.A N PRO 15.A O no hydrogen 2.947 N/A ASN 53.A ND2 VAL 17.A O no hydrogen 3.140 N/A VAL 56.A N GLN 19.A OE1 no hydrogen 3.056 N/A PHE 57.A N LEU 70.A O no hydrogen 2.949 N/A LYS 61.A N LYS 66.A O no hydrogen 2.822 N/A LYS 66.A N SER 64.A OG no hydrogen 2.840 N/A ARG 68.A N ILE 59.A O no hydrogen 2.664 N/A ARG 68.A NH2 ASP 101.A OD2 no hydrogen 2.787 N/A LYS 69.A NZ TYR 137.A OH no hydrogen 3.128 N/A LEU 70.A N PHE 57.A O no hydrogen 3.059 N/A ASP 72.A N PRO 55.A O no hydrogen 2.868 N/A ARG 74.A NE ASP 72.A OD2 no hydrogen 2.663 N/A ARG 74.A NH1 PRO 403.A O no hydrogen 2.997 N/A ASN 77.A N PHE 73.A O no hydrogen 2.908 N/A ASN 77.A ND2 GLY 143.A O no hydrogen 3.406 N/A LYS 78.A N ARG 74.A O no hydrogen 3.207 N/A ARG 79.A N LEU 76.A O no hydrogen 2.852 N/A ARG 79.A NH1 ASP 13.A O no hydrogen 3.143 N/A THR 80.A N LEU 76.A O no hydrogen 2.936 N/A THR 80.A OG1 ASN 77.A O no hydrogen 3.331 N/A GLN 81.A N LYS 7.A O no hydrogen 3.080 N/A HIS 87.A NE2 VAL 372.A O no hydrogen 3.022 N/A LEU 91.A N PRO 88.A O no hydrogen 3.395 N/A LYS 92.A NZ ALA 89.A O no hydrogen 3.045 N/A LYS 93.A N GLY 90.A O no hydrogen 3.069 N/A LYS 94.A N LEU 91.A O no hydrogen 3.525 N/A LYS 94.A NZ ASP 168.A O no hydrogen 3.420 N/A SER 96.A N SER 182.A O no hydrogen 3.231 N/A SER 96.A OG HIS 226.A ND1 no hydrogen 3.240 N/A VAL 97.A N LEU 225.A O no hydrogen 2.946 N/A THR 98.A N VAL 180.A O no hydrogen 2.889 N/A THR 98.A OG1 HIS 189.A NE2 no hydrogen 2.670 N/A THR 98.A OG1 GLU 224.A OE2 no hydrogen 3.246 N/A VAL 99.A N TYR 223.A O no hydrogen 3.020 N/A LEU 100.A N LEU 178.A O no hydrogen 2.897 N/A VAL 102.A N ASP 176.A O no hydrogen 2.756 N/A GLY 103.A N ASP 101.A OD1 no hydrogen 3.239 N/A ALA 105.A N VAL 102.A O no hydrogen 3.422 N/A TYR 106.A N GLY 103.A O no hydrogen 3.216 N/A TYR 106.A OH MET 175.A O no hydrogen 2.561 N/A PHE 107.A N ASP 104.A O no hydrogen 3.233 N/A SER 108.A N ALA 105.A O no hydrogen 3.291 N/A VAL 109.A N TYR 106.A O no hydrogen 3.458 N/A LEU 111.A N ASN 138.A O no hydrogen 2.718 N/A ASP 114.A N ASP 112.A OD1 no hydrogen 3.029 N/A PHE 115.A N ASP 112.A O no hydrogen 3.119 N/A ARG 116.A N GLU 113.A O no hydrogen 3.399 N/A ARG 116.A NE LEU 111.A O no hydrogen 2.987 N/A ARG 116.A NH2 LEU 111.A O no hydrogen 2.979 N/A LYS 117.A NZ ASP 114.A O no hydrogen 3.144 N/A TYR 118.A N PHE 115.A O no hydrogen 3.033 N/A THR 119.A N ARG 116.A O no hydrogen 3.050 N/A THR 119.A OG1 ARG 116.A O no hydrogen 3.391 N/A PHE 121.A N TYR 135.A O no hydrogen 3.225 N/A THR 122.A OG1 ASN 53.A OD1 no hydrogen 2.430 N/A ILE 123.A N ILE 133.A O no hydrogen 2.880 N/A ASN 128.A N SER 125.A O no hydrogen 3.103 N/A GLU 129.A N ILE 126.A O no hydrogen 3.409 N/A ILE 133.A N ILE 123.A O no hydrogen 3.209 N/A ARG 134.A NE GLY 47.A O no hydrogen 3.097 N/A ARG 134.A NH1 TYR 52.A O no hydrogen 3.492 N/A ARG 134.A NH2 TYR 52.A O no hydrogen 2.815 N/A TYR 135.A N PHE 121.A O no hydrogen 3.066 N/A GLN 136.A N SER 44.A O no hydrogen 3.186 N/A ASN 138.A N LYS 42.A O no hydrogen 2.786 N/A ASN 138.A ND2 GLY 41.A O no hydrogen 2.616 N/A LEU 140.A N VAL 109.A O no hydrogen 3.047 N/A GLY 143.A N ASP 176.A OD2 no hydrogen 3.478 N/A TRP 144.A N PRO 141.A O no hydrogen 3.420 N/A LYS 145.A N ASN 77.A OD1 no hydrogen 2.650 N/A LYS 145.A NZ ASN 77.A O no hydrogen 3.528 N/A LYS 145.A NZ ASP 82.A OD1 no hydrogen 3.250 N/A SER 147.A N TRP 144.A O no hydrogen 3.100 N/A SER 147.A OG PRO 141.A O no hydrogen 2.664 N/A ILE 150.A N GLY 146.A O no hydrogen 3.050 N/A PHE 151.A N SER 147.A O no hydrogen 3.080 N/A GLN 152.A N ALA 149.A O no hydrogen 3.154 N/A SER 154.A N PHE 151.A O no hydrogen 3.033 N/A MET 155.A N PHE 151.A O no hydrogen 2.941 N/A THR 156.A N GLN 152.A O no hydrogen 3.281 N/A THR 156.A OG1 GLN 152.A O no hydrogen 2.587 N/A ILE 158.A N SER 154.A O no hydrogen 3.320 N/A LEU 159.A N MET 155.A O no hydrogen 2.975 N/A LYS 163.A N LEU 159.A O no hydrogen 2.751 N/A LYS 164.A N GLU 160.A O no hydrogen 3.050 N/A GLN 165.A N PRO 161.A O no hydrogen 3.409 N/A ASN 166.A N PHE 162.A O no hydrogen 3.112 N/A ASN 166.A ND2 PHE 162.A O no hydrogen 3.273 N/A TYR 172.A N TYR 179.A O no hydrogen 2.934 N/A GLN 173.A NE2 MET 175.A O no hydrogen 3.068 N/A TYR 174.A N ASP 177.A O no hydrogen 3.081 N/A ASP 177.A N TYR 174.A O no hydrogen 3.209 N/A LEU 178.A N LEU 100.A O no hydrogen 2.810 N/A TYR 179.A N TYR 172.A O no hydrogen 2.559 N/A VAL 180.A N THR 98.A O no hydrogen 2.862 N/A GLY 181.A N VAL 170.A O no hydrogen 2.889 N/A SER 182.A N SER 96.A O no hydrogen 2.907 N/A SER 182.A OG HIS 189.A ND1 no hydrogen 2.344 N/A LEU 184.A N SER 182.A OG no hydrogen 3.423 N/A GLN 188.A N GLU 185.A O no hydrogen 3.053 N/A HIS 189.A ND1 SER 182.A OG no hydrogen 2.344 N/A HIS 189.A NE2 THR 98.A OG1 no hydrogen 2.670 N/A THR 191.A N GLY 187.A O no hydrogen 3.223 N/A THR 191.A OG1 GLY 187.A O no hydrogen 3.475 N/A THR 191.A OG1 GLN 188.A O no hydrogen 2.842 N/A LYS 192.A N GLN 188.A O no hydrogen 3.182 N/A LYS 192.A NZ ASN 166.A OD1 no hydrogen 3.018 N/A ILE 193.A N HIS 189.A O no hydrogen 3.205 N/A GLU 194.A N ARG 190.A O no hydrogen 3.351 N/A GLU 195.A N THR 191.A O no hydrogen 3.128 N/A LEU 196.A N LYS 192.A O no hydrogen 3.119 N/A ARG 197.A N ILE 193.A O no hydrogen 2.853 N/A ARG 197.A NE THR 207.A OG1 no hydrogen 2.683 N/A ARG 197.A NH2 THR 207.A O no hydrogen 3.098 N/A ARG 197.A NH2 THR 207.A OG1 no hydrogen 3.085 N/A GLN 198.A N GLU 194.A O no hydrogen 2.933 N/A HIS 199.A N GLU 195.A O no hydrogen 2.801 N/A HIS 199.A NE2 ILE 158.A O no hydrogen 2.451 N/A LEU 200.A N LEU 196.A O no hydrogen 2.918 N/A LEU 201.A N ARG 197.A O no hydrogen 3.219 N/A ARG 202.A N GLN 198.A O no hydrogen 3.177 N/A GLY 204.A N LEU 201.A O no hydrogen 2.869 N/A LEU 205.A N LEU 200.A O no hydrogen 2.772 N/A THR 206.A OG1 ASP 104.A OD2 no hydrogen 2.912 N/A GLN 213.A N ASP 63.A OD1 no hydrogen 3.432 N/A LYS 214.A NZ HIS 212.A O no hydrogen 2.839 N/A LEU 219.A N PRO 217.A O no hydrogen 2.866 N/A TRP 220.A NE1 GLN 213.A O no hydrogen 2.917 N/A MET 221.A N PHE 218.A O no hydrogen 3.068 N/A GLY 222.A N LEU 219.A O no hydrogen 3.217 N/A TYR 223.A N TRP 220.A O no hydrogen 3.257 N/A GLU 224.A N MET 221.A O no hydrogen 3.257 N/A LEU 225.A N VAL 97.A O no hydrogen 2.821 N/A HIS 226.A ND1 LYS 95.A O no hydrogen 2.834 N/A ASP 228.A N LYS 94.A O no hydrogen 3.371 N/A LYS 229.A N HIS 226.A O no hydrogen 3.180 N/A TRP 230.A N PRO 227.A O no hydrogen 3.258 N/A GLN 233.A N THR 342.A O no hydrogen 2.620 N/A THR 244.A N ASP 247.A OD1 no hydrogen 3.242 N/A THR 244.A OG1 ASP 247.A OD1 no hydrogen 2.850 N/A THR 244.A OG1 LEU 280.A O no hydrogen 3.493 N/A VAL 245.A N GLU 282.A O no hydrogen 3.097 N/A ASN 246.A N THR 244.A OG1 no hydrogen 3.168 N/A ASN 246.A N LEU 280.A O no hydrogen 3.271 N/A ASP 247.A N THR 244.A OG1 no hydrogen 3.166 N/A ILE 248.A N THR 244.A O no hydrogen 3.166 N/A GLN 249.A N VAL 245.A O no hydrogen 3.204 N/A LYS 250.A N ASN 246.A O no hydrogen 3.066 N/A LEU 251.A N ASP 247.A O no hydrogen 2.867 N/A VAL 252.A N ILE 248.A O no hydrogen 2.676 N/A GLY 253.A N GLN 249.A O no hydrogen 2.965 N/A LYS 254.A N LYS 250.A O no hydrogen 2.970 N/A LYS 254.A NZ VAL 236.A O no hydrogen 2.811 N/A LYS 254.A NZ LYS 415.A O no hydrogen 2.772 N/A LYS 254.A NZ LEU 416.A O no hydrogen 3.289 N/A LEU 255.A N LEU 251.A O no hydrogen 2.941 N/A ASN 256.A N VAL 252.A O no hydrogen 2.762 N/A TRP 257.A N GLY 253.A O no hydrogen 3.069 N/A ALA 258.A N LYS 254.A O no hydrogen 2.935 N/A SER 259.A N LEU 255.A O no hydrogen 2.864 N/A SER 259.A OG ASN 256.A O no hydrogen 2.534 N/A GLN 260.A N TRP 257.A O no hydrogen 3.207 N/A ILE 261.A N ALA 258.A O no hydrogen 3.010 N/A TYR 262.A N ALA 258.A O no hydrogen 2.918 N/A TYR 262.A OH GLU 303.A O no hydrogen 2.978 N/A GLN 269.A N GLU 293.A OE2 no hydrogen 3.189 N/A LEU 270.A N VAL 267.A O no hydrogen 2.959 N/A SER 271.A N VAL 267.A O no hydrogen 3.068 N/A SER 271.A OG VAL 267.A O no hydrogen 3.267 N/A SER 271.A OG ARG 268.A O no hydrogen 3.064 N/A LYS 272.A N ARG 268.A O no hydrogen 3.072 N/A LEU 273.A N LEU 270.A O no hydrogen 3.033 N/A LEU 274.A N SER 271.A O no hydrogen 2.990 N/A GLU 282.A N ALA 279.A O no hydrogen 3.218 N/A ILE 284.A N TRP 243.A O no hydrogen 3.107 N/A ALA 290.A N THR 287.A O no hydrogen 3.078 N/A ALA 290.A N THR 287.A OG1 no hydrogen 3.056 N/A GLU 291.A N THR 287.A O no hydrogen 3.086 N/A LEU 292.A N GLU 288.A O no hydrogen 3.440 N/A LEU 294.A N ALA 290.A O no hydrogen 2.945 N/A ALA 295.A N GLU 291.A O no hydrogen 2.971 N/A GLU 296.A N LEU 292.A O no hydrogen 2.957 N/A ASN 297.A N GLU 293.A O no hydrogen 2.895 N/A ASN 297.A ND2 LYS 266.A O no hydrogen 3.204 N/A ARG 298.A N LEU 294.A O no hydrogen 2.952 N/A GLU 299.A N ALA 295.A O no hydrogen 3.007 N/A ILE 300.A N GLU 296.A O no hydrogen 3.259 N/A LEU 301.A N ASN 297.A O no hydrogen 3.081 N/A LYS 302.A NZ GLU 299.A OE1 no hydrogen 3.502 N/A LYS 302.A NZ GLU 299.A OE2 no hydrogen 3.127 N/A ASP 311.A N GLN 334.A OE1 no hydrogen 2.960 N/A SER 313.A N ASP 311.A OD1 no hydrogen 3.290 N/A SER 313.A OG ASP 311.A OD1 no hydrogen 2.588 N/A SER 313.A OG ASP 311.A OD2 no hydrogen 3.077 N/A LYS 314.A N ASP 311.A O no hydrogen 3.045 N/A LYS 314.A NZ GLU 335.A OE2 no hydrogen 2.469 N/A ILE 317.A N TYR 333.A O no hydrogen 2.900 N/A ALA 318.A N LYS 379.A O no hydrogen 2.800 N/A GLU 319.A N GLN 331.A O no hydrogen 3.039 N/A GLN 321.A N THR 329.A O no hydrogen 2.796 N/A GLN 321.A NE2 GLN 331.A OE1 no hydrogen 2.659 N/A LYS 322.A NZ ASP 355.A OD2 no hydrogen 2.663 N/A GLN 323.A N GLN 327.A O no hydrogen 2.948 N/A GLN 323.A NE2 THR 329.A OG1 no hydrogen 2.915 N/A GLN 327.A N GLY 324.A O no hydrogen 3.107 N/A TRP 328.A N TYR 345.A O no hydrogen 2.970 N/A TRP 328.A NE1 GLN 358.A OE1 no hydrogen 2.709 N/A THR 329.A N GLN 321.A O no hydrogen 3.105 N/A THR 329.A OG1 GLN 321.A OE1 no hydrogen 2.896 N/A TYR 330.A N GLY 343.A O no hydrogen 3.201 N/A TYR 330.A OH GLU 369.A OE2 no hydrogen 2.622 N/A GLN 331.A N GLU 319.A O no hydrogen 2.998 N/A GLN 331.A NE2 GLN 321.A OE1 no hydrogen 2.750 N/A ILE 332.A N LYS 341.A O no hydrogen 2.943 N/A TYR 333.A N ILE 317.A O no hydrogen 2.913 N/A TYR 333.A OH GLU 319.A OE1 no hydrogen 2.301 N/A GLN 334.A NE2 ASP 311.A O no hydrogen 2.620 N/A GLN 334.A NE2 LYS 314.A O no hydrogen 3.511 N/A LYS 338.A N GLU 335.A O no hydrogen 3.273 N/A LEU 340.A N ILE 332.A O no hydrogen 2.760 N/A LYS 341.A NZ THR 231.A O no hydrogen 3.426 N/A THR 342.A OG1 GLN 233.A O no hydrogen 2.732 N/A GLY 343.A N TYR 330.A O no hydrogen 2.932 N/A TYR 345.A N TRP 328.A O no hydrogen 2.690 N/A TYR 345.A OH GLU 369.A OE1 no hydrogen 2.528 N/A ALA 351.A N MET 348.A O no hydrogen 3.037 N/A THR 353.A N GLY 350.A O no hydrogen 3.170 N/A ASN 354.A N GLY 350.A O no hydrogen 2.920 N/A LYS 357.A N ASN 354.A OD1 no hydrogen 2.898 N/A GLN 358.A N ASN 354.A O no hydrogen 3.315 N/A GLN 358.A NE2 ASN 354.A O no hydrogen 3.498 N/A LEU 359.A N ASP 355.A O no hydrogen 2.959 N/A THR 360.A N VAL 356.A O no hydrogen 3.022 N/A THR 360.A OG1 VAL 356.A O no hydrogen 3.211 N/A THR 360.A OG1 LYS 357.A O no hydrogen 3.132 N/A GLU 361.A N LYS 357.A O no hydrogen 3.362 N/A ALA 362.A N GLN 358.A O no hydrogen 2.952 N/A VAL 363.A N LEU 359.A O no hydrogen 2.884 N/A GLN 364.A N THR 360.A O no hydrogen 3.099 N/A LYS 365.A N GLU 361.A O no hydrogen 2.923 N/A ILE 366.A N ALA 362.A O no hydrogen 2.837 N/A THR 367.A N VAL 363.A O no hydrogen 3.000 N/A THR 367.A OG1 VAL 363.A O no hydrogen 2.811 N/A THR 368.A N GLN 364.A O no hydrogen 2.979 N/A THR 368.A OG1 GLN 364.A O no hydrogen 2.999 N/A GLU 369.A N LYS 365.A O no hydrogen 3.018 N/A SER 370.A N ILE 366.A O no hydrogen 2.921 N/A SER 370.A OG ILE 366.A O no hydrogen 2.932 N/A ILE 371.A N THR 367.A O no hydrogen 2.960 N/A VAL 372.A N THR 368.A O no hydrogen 3.220 N/A VAL 372.A N GLU 369.A O no hydrogen 3.213 N/A ILE 373.A N GLU 369.A O no hydrogen 3.016 N/A TRP 374.A N SER 370.A O no hydrogen 3.082 N/A GLY 375.A N SER 370.A O no hydrogen 3.050 N/A LYS 376.A NZ TYR 310.A OH no hydrogen 3.416 N/A LYS 376.A NZ PRO 312.A O no hydrogen 3.221 N/A LYS 379.A N LEU 316.A O no hydrogen 2.664 N/A PHE 380.A N GLU 404.A O no hydrogen 2.934 N/A LYS 381.A N ALA 318.A O no hydrogen 2.832 N/A LYS 381.A NZ GLU 406.A OE2 no hydrogen 3.156 N/A LEU 382.A N GLU 406.A O no hydrogen 2.846 N/A ILE 384.A N LEU 382.A O no hydrogen 2.976 N/A LYS 386.A NZ GLU 390.A OE2 no hydrogen 3.118 N/A THR 388.A OG1 GLN 385.A OE1 no hydrogen 3.403 N/A TRP 389.A N GLN 385.A O no hydrogen 3.167 N/A GLU 390.A N LYS 386.A O no hydrogen 3.152 N/A THR 391.A N GLU 387.A O no hydrogen 3.296 N/A THR 391.A OG1 GLU 387.A O no hydrogen 2.396 N/A TRP 392.A N TRP 389.A O no hydrogen 3.128 N/A TRP 393.A N TRP 389.A O no hydrogen 3.089 N/A GLU 395.A N TRP 392.A O no hydrogen 3.165 N/A TYR 396.A N TRP 393.A O no hydrogen 3.191 N/A TRP 397.A NE1 TRP 401.A O no hydrogen 2.834 N/A GLN 398.A N GLN 364.A OE1 no hydrogen 2.772 N/A GLN 398.A NE2 TYR 396.A O no hydrogen 2.978 N/A THR 400.A OG1 ASP 176.A OD1 no hydrogen 3.498 N/A THR 400.A OG1 ASP 177.A OD2 no hydrogen 3.416 N/A GLU 406.A N PHE 380.A O no hydrogen 2.635 N/A VAL 408.A N LEU 382.A O no hydrogen 3.133 N/A THR 410.A OG1 THR 410.A O no hydrogen 2.335 N/A