Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vdt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N PHE 245.A O no hydrogen 3.015 N/A GLU 6.A N ASN 246.A OD1 no hydrogen 2.505 N/A ILE 10.A N THR 7.A O no hydrogen 3.018 N/A SER 11.A OG LEU 298.A O no hydrogen 3.272 N/A HIS 12.A NE2 THR 7.A O no hydrogen 2.638 N/A ILE 13.A N ALA 300.A O no hydrogen 2.980 N/A THR 14.A OG1 ASP 17.A OD1 no hydrogen 2.151 N/A ARG 15.A N TYR 249.A O no hydrogen 3.247 N/A ARG 15.A NH1 THR 303.A OG1 no hydrogen 3.421 N/A ARG 15.A NH1 THR 332.A OG1 no hydrogen 3.304 N/A ARG 15.A NH2 GLU 260.A OE2 no hydrogen 2.686 N/A HIS 16.A N TYR 250.A O no hydrogen 3.197 N/A ASP 17.A N THR 14.A OG1 no hydrogen 3.313 N/A ASP 17.A N ASP 17.A OD1 no hydrogen 2.579 N/A LEU 19.A N HIS 16.A O no hydrogen 2.207 N/A GLN 20.A N ASP 17.A O no hydrogen 3.059 N/A GLN 20.A NE2 ASP 17.A O no hydrogen 2.650 N/A GLU 23.A N GLN 20.A O no hydrogen 2.574 N/A GLN 24.A N GLN 20.A O no hydrogen 2.876 N/A LYS 26.A N GLU 23.A O no hydrogen 3.027 N/A ASN 27.A N GLN 24.A O no hydrogen 2.856 N/A LYS 29.A N ASN 27.A OD1 no hydrogen 2.897 N/A TYR 30.A N ASN 27.A O no hydrogen 3.193 N/A TYR 30.A OH ASN 359.A OD1 no hydrogen 3.127 N/A GLN 31.A N GLU 28.A O no hydrogen 3.165 N/A VAL 32.A N LYS 366.A O no hydrogen 3.187 N/A SER 38.A N ASP 36.A OD1 no hydrogen 2.833 N/A SER 38.A OG ASP 36.A OD1 no hydrogen 2.374 N/A SER 38.A OG ASP 36.A OD2 no hydrogen 3.366 N/A THR 39.A OG1 ASP 36.A O no hydrogen 2.082 N/A LYS 41.A NZ ASP 101.A OD1 no hydrogen 3.266 N/A LYS 41.A NZ ASP 101.A OD2 no hydrogen 2.548 N/A ASN 42.A ND2 GLN 407.A OE1 no hydrogen 3.055 N/A SER 45.A OG TRP 103.A O no hydrogen 2.513 N/A LYS 47.A N ILE 43.A O no hydrogen 3.319 N/A ASP 50.A N GLY 78.A O no hydrogen 2.867 N/A VAL 51.A N SER 408.A O no hydrogen 2.544 N/A SER 54.A OG TRP 52.A O no hydrogen 3.566 N/A TRP 55.A N PHE 74.A O no hydrogen 3.365 N/A LEU 57.A N ILE 72.A O no hydrogen 3.166 N/A GLN 58.A N ALA 134.A O no hydrogen 3.042 N/A ASN 59.A N THR 63.A O no hydrogen 2.782 N/A ASN 59.A ND2 THR 63.A OG1 no hydrogen 2.883 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.966 N/A ALA 65.A N LEU 57.A O no hydrogen 3.023 N/A TYR 70.A OH SER 169.A O no hydrogen 2.859 N/A HIS 71.A N GLN 93.A O no hydrogen 2.782 N/A HIS 71.A ND1 GLN 93.A OE1 no hydrogen 3.238 N/A VAL 73.A N PHE 91.A O no hydrogen 3.065 N/A PHE 74.A N TRP 55.A O no hydrogen 2.628 N/A LEU 76.A N ASP 53.A O no hydrogen 3.223 N/A GLY 78.A N ASP 50.A O no hydrogen 2.871 N/A ASP 79.A N ASP 85.A OD2 no hydrogen 2.775 N/A LYS 81.A N ASP 79.A OD1 no hydrogen 3.274 N/A ASN 82.A N ASP 79.A O no hydrogen 2.432 N/A THR 86.A OG1 GLN 128.A OE1 no hydrogen 1.892 N/A SER 87.A OG ALA 77.A O no hydrogen 3.324 N/A ILE 88.A N GLU 129.A OE1 no hydrogen 3.196 N/A TYR 89.A N ALA 75.A O no hydrogen 3.108 N/A TYR 92.A N LYS 104.A O no hydrogen 2.790 N/A GLN 93.A N HIS 71.A O no hydrogen 2.676 N/A GLN 93.A NE2 SER 102.A OG no hydrogen 2.398 N/A VAL 95.A N GLY 69.A O no hydrogen 2.489 N/A GLU 97.A N LYS 94.A O no hydrogen 3.480 N/A SER 99.A OG ASP 101.A OD2 no hydrogen 3.315 N/A SER 102.A N SER 99.A O no hydrogen 2.452 N/A TRP 103.A N ILE 100.A O no hydrogen 3.307 N/A ASN 105.A ND2 SER 45.A O no hydrogen 2.563 N/A ALA 106.A N MET 90.A O no hydrogen 2.662 N/A GLY 107.A N ASN 105.A OD1 no hydrogen 2.557 N/A VAL 109.A N ILE 88.A O no hydrogen 2.712 N/A LYS 111.A N ASP 114.A OD2 no hydrogen 2.577 N/A ASP 114.A N LYS 111.A O no hydrogen 2.532 N/A LYS 115.A NZ ASP 112.A O no hydrogen 2.315 N/A ASP 117.A N SER 113.A O no hydrogen 3.487 N/A ALA 118.A N ASP 114.A O no hydrogen 3.107 N/A ASN 119.A N PHE 116.A O no hydrogen 2.879 N/A LEU 123.A N ASP 120.A O no hydrogen 2.548 N/A LYS 124.A N SER 121.A O no hydrogen 3.403 N/A THR 127.A N PHE 149.A O no hydrogen 2.948 N/A GLN 128.A N PHE 149.A O no hydrogen 3.301 N/A TRP 130.A N THR 147.A O no hydrogen 2.760 N/A SER 133.A N PHE 145.A O no hydrogen 3.109 N/A THR 135.A OG1 GLN 58.A O no hydrogen 3.160 N/A THR 135.A OG1 ASN 59.A O no hydrogen 3.362 N/A THR 137.A N LYS 141.A O no hydrogen 3.044 N/A THR 137.A OG1 ASP 139.A OD1 no hydrogen 2.496 N/A LYS 141.A N THR 137.A OG1 no hydrogen 2.817 N/A ARG 143.A NH1 THR 161.A OG1 no hydrogen 2.951 N/A ARG 143.A NH1 ASP 180.A OD2 no hydrogen 3.344 N/A ARG 143.A NH2 ASP 180.A OD2 no hydrogen 3.101 N/A LEU 144.A N ALA 162.A O no hydrogen 2.745 N/A PHE 145.A N SER 133.A O no hydrogen 3.492 N/A TYR 146.A N THR 160.A O no hydrogen 2.931 N/A TYR 146.A OH TYR 181.A OH no hydrogen 2.974 N/A THR 147.A N TRP 130.A O no hydrogen 3.114 N/A THR 147.A OG1 ALA 131.A O no hydrogen 2.832 N/A ASP 148.A N THR 158.A O no hydrogen 2.888 N/A SER 150.A N LYS 156.A O no hydrogen 3.189 N/A GLY 151.A N THR 127.A OG1 no hydrogen 3.134 N/A HIS 153.A N SER 150.A OG no hydrogen 3.274 N/A LYS 156.A NZ ASP 186.A OD2 no hydrogen 2.898 N/A GLN 157.A NE2 GLY 155.A O no hydrogen 3.027 N/A GLN 157.A NE2 HIS 210.A O no hydrogen 3.669 N/A THR 158.A N ASP 148.A O no hydrogen 2.769 N/A LEU 159.A N PHE 185.A O no hydrogen 2.374 N/A THR 160.A N TYR 146.A O no hydrogen 3.253 N/A THR 161.A N LYS 182.A O no hydrogen 2.984 N/A THR 161.A OG1 LEU 144.A O no hydrogen 3.334 N/A GLN 163.A N GLU 179.A O no hydrogen 3.035 N/A GLN 163.A NE2 ASN 165.A OD1 no hydrogen 3.089 N/A VAL 164.A N ILE 142.A O no hydrogen 2.685 N/A SER 167.A N ASN 174.A O no hydrogen 2.806 N/A SER 169.A N SER 172.A O no hydrogen 2.884 N/A SER 169.A OG SER 172.A O no hydrogen 2.634 N/A ASN 174.A ND2 SER 172.A OG no hydrogen 2.987 N/A GLU 179.A N GLN 163.A O no hydrogen 3.378 N/A TYR 181.A OH TYR 146.A OH no hydrogen 2.974 N/A LYS 182.A NZ ASP 180.A OD1 no hydrogen 2.385 N/A LYS 182.A NZ ASP 180.A OD2 no hydrogen 2.584 N/A LYS 182.A NZ ASP 288.A O no hydrogen 2.614 N/A ILE 184.A N LEU 159.A O no hydrogen 2.325 N/A PHE 185.A N LEU 159.A O no hydrogen 3.156 N/A TYR 192.A N ASP 188.A OD1 no hydrogen 2.934 N/A TYR 192.A OH MET 282.A O no hydrogen 2.760 N/A TYR 192.A OH MET 295.A O no hydrogen 2.063 N/A ASN 194.A N GLN 197.A OE1 no hydrogen 3.383 N/A GLN 196.A N ASN 194.A OD1 no hydrogen 3.270 N/A GLN 197.A N ASN 194.A O no hydrogen 2.964 N/A GLN 197.A N ASN 194.A OD1 no hydrogen 3.378 N/A GLN 197.A NE2 GLY 189.A O no hydrogen 3.213 N/A ILE 199.A N GLN 196.A O no hydrogen 2.838 N/A GLY 202.A N ILE 199.A O no hydrogen 2.986 N/A SER 206.A OG ASN 203.A O no hydrogen 2.027 N/A GLY 207.A N TYR 204.A O no hydrogen 2.679 N/A ASN 209.A ND2 GLU 307.A OE1 no hydrogen 2.904 N/A HIS 210.A ND1 GLN 193.A OE1 no hydrogen 2.294 N/A THR 211.A N ASN 231.A OD1 no hydrogen 3.208 N/A THR 211.A OG1 GLU 229.A OE2 no hydrogen 2.469 N/A THR 211.A OG1 ASN 231.A OD1 no hydrogen 2.828 N/A LEU 212.A N GLN 157.A OE1 no hydrogen 2.859 N/A ARG 213.A N GLU 229.A O no hydrogen 3.370 N/A ARG 213.A NH1 GLU 307.A OE1 no hydrogen 3.465 N/A ARG 213.A NH2 GLU 307.A OE1 no hydrogen 2.831 N/A ARG 213.A NH2 GLU 309.A OE2 no hydrogen 2.966 N/A HIS 216.A N VAL 227.A O no hydrogen 2.529 N/A TYR 217.A N SER 133.A OG no hydrogen 3.230 N/A TYR 217.A OH GLU 219.A OE2 no hydrogen 2.713 N/A VAL 218.A N TYR 225.A O no hydrogen 3.227 N/A ASP 220.A N HIS 223.A O no hydrogen 2.791 N/A HIS 223.A N ASP 220.A O no hydrogen 3.133 N/A LYS 224.A NZ ASP 287.A OD1 no hydrogen 3.140 N/A LEU 226.A N ILE 283.A O no hydrogen 3.184 N/A VAL 227.A N HIS 216.A O no hydrogen 2.745 N/A PHE 228.A N GLY 281.A O no hydrogen 2.965 N/A GLU 229.A N ARG 213.A O no hydrogen 2.830 N/A ASN 231.A ND2 ASN 209.A O no hydrogen 3.117 N/A ASN 231.A ND2 ASN 277.A O no hydrogen 3.002 N/A ASN 231.A ND2 ASN 277.A OD1 no hydrogen 3.288 N/A ASN 231.A ND2 ASP 306.A O no hydrogen 3.590 N/A ASN 231.A ND2 ASP 306.A OD2 no hydrogen 3.029 N/A THR 232.A N ASN 277.A O no hydrogen 3.310 N/A THR 232.A OG1 GLY 237.A O no hydrogen 3.303 N/A GLY 233.A N THR 191.A O no hydrogen 2.723 N/A GLY 233.A N ASP 236.A OD2 no hydrogen 3.258 N/A THR 234.A N GLY 189.A O no hydrogen 3.249 N/A THR 234.A OG1 GLY 189.A O no hydrogen 3.366 N/A THR 234.A OG1 THR 234.A O no hydrogen 2.319 N/A GLU 235.A N GLY 233.A O no hydrogen 3.244 N/A GLN 239.A NE2 ASP 208.A OD2 no hydrogen 3.247 N/A GLY 240.A N GLU 274.A O no hydrogen 2.751 N/A SER 243.A OG GLY 240.A O no hydrogen 2.015 N/A LEU 244.A N GLU 241.A O no hydrogen 3.022 N/A PHE 245.A N GLU 242.A O no hydrogen 2.783 N/A ASN 246.A ND2 GLU 6.A O no hydrogen 2.335 N/A LYS 247.A N TYR 4.A O no hydrogen 2.737 N/A ALA 248.A N ASN 246.A OD1 no hydrogen 2.924 N/A TYR 249.A N ASN 246.A O no hydrogen 3.202 N/A TYR 250.A N LYS 247.A O no hydrogen 3.099 N/A TYR 250.A OH LEU 244.A O no hydrogen 2.644 N/A GLY 251.A N LYS 247.A O no hydrogen 3.006 N/A SER 253.A N GLY 251.A O no hydrogen 2.469 N/A PHE 256.A N SER 253.A O no hydrogen 3.315 N/A GLN 259.A N PHE 256.A O no hydrogen 2.463 N/A SER 261.A N PHE 257.A O no hydrogen 2.429 N/A SER 261.A OG PHE 257.A O no hydrogen 2.616 N/A LYS 263.A N GLN 259.A O no hydrogen 2.627 N/A GLN 266.A N GLN 262.A O no hydrogen 3.338 N/A SER 267.A OG LEU 265.A O no hydrogen 2.572 N/A GLU 274.A N LYS 270.A O no hydrogen 2.913 N/A LEU 275.A N ARG 271.A O no hydrogen 3.125 N/A ALA 276.A N ALA 273.A O no hydrogen 2.825 N/A ASN 277.A N ASP 306.A OD1 no hydrogen 2.455 N/A ASN 277.A ND2 THR 232.A O no hydrogen 3.300 N/A ASN 277.A ND2 THR 232.A OG1 no hydrogen 3.183 N/A ALA 279.A N ALA 230.A O no hydrogen 2.784 N/A LEU 280.A N ILE 299.A O no hydrogen 3.377 N/A GLY 281.A N PHE 228.A O no hydrogen 2.719 N/A MET 282.A N TYR 192.A OH no hydrogen 3.344 N/A GLU 284.A N LYS 293.A O no hydrogen 2.841 N/A ASN 286.A N THR 290.A O no hydrogen 3.045 N/A ASP 288.A N ASP 288.A OD1 no hydrogen 2.350 N/A TYR 289.A N ASN 286.A O no hydrogen 2.268 N/A LYS 292.A N GLU 284.A O no hydrogen 2.649 N/A MET 295.A N MET 282.A O no hydrogen 3.013 N/A LEU 298.A N LEU 280.A O no hydrogen 2.863 N/A SER 301.A N GLY 278.A O no hydrogen 2.744 N/A SER 301.A OG THR 305.A O no hydrogen 1.962 N/A THR 303.A N ALA 276.A O no hydrogen 3.006 N/A THR 303.A OG1 ASN 302.A O no hydrogen 2.278 N/A THR 305.A N SER 301.A O no hydrogen 3.091 N/A THR 305.A OG1 LYS 330.A O no hydrogen 2.080 N/A GLU 309.A N ASP 325.A O no hydrogen 2.858 N/A ARG 310.A N ASP 214.A OD2 no hydrogen 2.711 N/A ARG 310.A NH1 SER 54.A O no hydrogen 3.252 N/A ARG 310.A NH1 SER 379.A OG no hydrogen 3.259 N/A VAL 313.A N ASN 312.A OD1 no hydrogen 2.372 N/A PHE 314.A N TYR 321.A O no hydrogen 2.958 N/A MET 316.A N LYS 319.A O no hydrogen 2.963 N/A ASN 317.A ND2 GLY 388.A O no hydrogen 2.801 N/A LYS 319.A N MET 316.A O no hydrogen 3.116 N/A TRP 320.A N SER 348.A O no hydrogen 2.789 N/A TYR 321.A N PHE 314.A O no hydrogen 2.979 N/A TYR 321.A OH GLY 420.A O no hydrogen 2.935 N/A LEU 322.A N TYR 346.A O no hydrogen 2.737 N/A PHE 323.A N ASN 312.A O no hydrogen 2.839 N/A THR 324.A OG1 GLU 309.A O no hydrogen 2.739 N/A THR 324.A OG1 ASP 325.A O no hydrogen 3.279 N/A ASP 325.A N GLU 309.A O no hydrogen 2.593 N/A SER 326.A N TYR 342.A O no hydrogen 3.131 N/A SER 326.A OG GLU 307.A O no hydrogen 3.349 N/A LYS 330.A N ARG 327.A O no hydrogen 2.700 N/A LYS 330.A NZ GLU 307.A OE2 no hydrogen 3.226 N/A MET 331.A N GLY 328.A O no hydrogen 2.702 N/A THR 332.A N VAL 304.A O no hydrogen 3.005 N/A THR 332.A OG1 THR 303.A O no hydrogen 2.677 N/A THR 332.A OG1 VAL 304.A O no hydrogen 3.241 N/A ILE 336.A N ILE 333.A O no hydrogen 2.995 N/A THR 337.A N ASP 340.A OD2 no hydrogen 2.783 N/A ASN 339.A N THR 337.A OG1 no hydrogen 2.817 N/A ASN 339.A ND2 ASP 368.A O no hydrogen 3.235 N/A ASP 340.A N THR 337.A O no hydrogen 3.010 N/A TYR 342.A N SER 326.A O no hydrogen 2.874 N/A TYR 342.A OH GLN 25.A OE1 no hydrogen 2.858 N/A MET 343.A N LEU 365.A O no hydrogen 3.054 N/A LEU 344.A N THR 324.A O no hydrogen 2.601 N/A GLY 345.A N GLY 362.A O no hydrogen 2.977 N/A TYR 346.A N LEU 322.A O no hydrogen 2.797 N/A VAL 347.A N LYS 356.A O no hydrogen 3.185 N/A SER 348.A N TRP 320.A O no hydrogen 2.723 N/A SER 348.A OG ASN 349.A OD1 no hydrogen 3.099 N/A SER 348.A OG SER 350.A O no hydrogen 2.882 N/A SER 348.A OG GLY 353.A O no hydrogen 1.954 N/A SER 350.A N SER 348.A OG no hydrogen 2.717 N/A TYR 355.A N SER 11.A OG no hydrogen 3.363 N/A TYR 355.A OH LEU 351.A O no hydrogen 2.562 N/A LYS 356.A N VAL 347.A O no hydrogen 3.174 N/A LEU 358.A N GLY 345.A O no hydrogen 3.038 N/A ASN 359.A N LYS 421.A O no hydrogen 3.025 N/A ASN 359.A ND2 LEU 363.A O no hydrogen 2.183 N/A ASN 359.A ND2 THR 423.A OG1 no hydrogen 3.378 N/A THR 361.A N LEU 358.A O no hydrogen 2.863 N/A GLY 362.A N LEU 358.A O no hydrogen 2.574 N/A LEU 363.A N THR 361.A OG1 no hydrogen 3.093 N/A LYS 366.A N TYR 30.A O no hydrogen 3.054 N/A LYS 366.A NZ ASP 368.A OD2 no hydrogen 2.442 N/A MET 367.A N ILE 341.A O no hydrogen 3.132 N/A LEU 369.A N ASP 368.A OD1 no hydrogen 2.786 N/A ASN 372.A N ASP 370.A OD2 no hydrogen 2.971 N/A ASP 373.A N ASP 370.A O no hydrogen 3.226 N/A THR 375.A N ASP 373.A OD1 no hydrogen 2.898 N/A THR 375.A OG1 ASP 373.A OD1 no hydrogen 2.411 N/A THR 377.A OG1 HIS 380.A NE2 no hydrogen 3.001 N/A TYR 378.A N TYR 396.A O no hydrogen 3.151 N/A TYR 378.A OH GLU 309.A OE1 no hydrogen 2.831 N/A HIS 380.A NE2 THR 377.A OG1 no hydrogen 3.001 N/A PHE 381.A N THR 394.A O no hydrogen 2.532 N/A VAL 383.A N VAL 392.A O no hydrogen 3.044 N/A GLN 385.A NE2 VAL 383.A O no hydrogen 3.004 N/A GLN 385.A NE2 LEU 436.A O no hydrogen 3.640 N/A VAL 391.A N LEU 416.A O no hydrogen 3.076 N/A VAL 392.A N VAL 383.A O no hydrogen 2.812 N/A ILE 393.A N PHE 414.A O no hydrogen 3.010 N/A THR 394.A N PHE 381.A O no hydrogen 2.936 N/A THR 394.A OG1 PHE 381.A O no hydrogen 2.947 N/A TYR 396.A N TYR 378.A O no hydrogen 3.419 N/A MET 397.A N THR 409.A O no hydrogen 2.705 N/A THR 398.A N PHE 376.A O no hydrogen 2.887 N/A THR 398.A OG1 VAL 374.A O no hydrogen 2.063 N/A PHE 402.A N ASN 399.A O no hydrogen 3.372 N/A TYR 403.A OH ASN 372.A O no hydrogen 2.285 N/A THR 409.A N MET 397.A O no hydrogen 3.398 N/A THR 409.A OG1 LYS 41.A O no hydrogen 3.488 N/A THR 409.A OG1 PHE 410.A O no hydrogen 3.418 N/A ALA 411.A N SER 395.A O no hydrogen 3.368 N/A SER 413.A N GLU 432.A O no hydrogen 3.019 N/A SER 413.A OG GLN 435.A O no hydrogen 2.362 N/A PHE 414.A N ILE 393.A O no hydrogen 3.273 N/A ASN 417.A N SER 424.A O no hydrogen 2.706 N/A ASN 417.A ND2 ASN 390.A OD1 no hydrogen 3.648 N/A ILE 418.A N ASN 389.A O no hydrogen 2.779 N/A LYS 419.A N LYS 422.A O no hydrogen 3.275 N/A LYS 422.A N LYS 419.A O no hydrogen 3.252 N/A THR 423.A N ASN 359.A OD1 no hydrogen 3.221 N/A SER 424.A OG ASN 417.A O no hydrogen 3.566 N/A VAL 425.A N LYS 29.A O no hydrogen 2.542 N/A LEU 431.A N SER 413.A O no hydrogen 3.055 N/A GLU 432.A N GLN 435.A OE1 no hydrogen 3.375 N/A GLN 433.A NE2 LYS 41.A O no hydrogen 2.928 N/A GLY 434.A N GLU 432.A O no hydrogen 2.332 N/A GLN 435.A N GLU 432.A O no hydrogen 3.050 N/A GLN 435.A NE2 THR 437.A O no hydrogen 3.242 N/A