Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4oo1_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A NZ ASP 330.A O no hydrogen 3.523 N/A LYS 4.A NZ GLU 331.A OE2 no hydrogen 2.493 N/A GLN 6.A N GLN 6.A OE1 no hydrogen 2.612 N/A GLN 6.A NE2 ARG 118.A O no hydrogen 3.209 N/A GLN 6.A NE2 ASP 330.A OD2 no hydrogen 3.135 N/A LYS 8.A N PRO 5.A O no hydrogen 3.081 N/A SER 11.A OG GLU 145.A OE2 no hydrogen 2.593 N/A ASN 15.A ND2 ARG 327.A O no hydrogen 3.184 N/A ASN 15.A ND2 ASP 330.A OD1 no hydrogen 2.842 N/A SER 16.A N ASP 14.A OD1 no hydrogen 3.308 N/A SER 16.A OG SER 18.A OG no hydrogen 3.301 N/A SER 18.A OG SER 16.A OG no hydrogen 3.301 N/A PHE 21.A N GLU 275.A OE2 no hydrogen 2.800 N/A LYS 28.A NZ PRO 55.A O no hydrogen 2.547 N/A ASN 30.A ND2 GLU 152.A O no hydrogen 2.981 N/A LYS 33.A N GLU 59.A OE2 no hydrogen 2.963 N/A SER 38.A N LEU 35.A O no hydrogen 2.980 N/A SER 38.A OG PRO 34.A O no hydrogen 3.568 N/A VAL 42.A N HIS 51.A O no hydrogen 3.175 N/A ASP 45.A N ASN 48.A O no hydrogen 2.568 N/A ASN 47.A N ASN 47.A OD1 no hydrogen 2.629 N/A TYR 56.A N HIS 54.A ND1 no hydrogen 3.001 N/A TYR 56.A OH PRO 29.A O no hydrogen 3.165 N/A GLU 57.A N HIS 54.A O no hydrogen 3.229 N/A ILE 60.A N TYR 56.A O no hydrogen 2.681 N/A HIS 62.A N TYR 58.A O no hydrogen 3.446 N/A GLN 63.A N GLU 59.A O no hydrogen 3.360 N/A TYR 65.A OH LEU 184.A O no hydrogen 3.248 N/A ILE 69.A N SER 66.A O no hydrogen 2.941 N/A LYS 79.A NZ GLU 133.A O no hydrogen 3.329 N/A SER 84.A N SER 80.A O no hydrogen 2.854 N/A ILE 87.A N ASP 135.A O no hydrogen 3.025 N/A VAL 89.A N LEU 137.A O no hydrogen 3.020 N/A THR 91.A OG1 ASP 90.A OD1 no hydrogen 3.494 N/A GLU 94.A N THR 91.A O no hydrogen 3.285 N/A LEU 95.A N SER 92.A O no hydrogen 3.330 N/A GLU 96.A N SER 92.A O no hydrogen 3.406 N/A SER 97.A OG GLU 94.A O no hydrogen 2.719 N/A LEU 99.A N LEU 95.A O no hydrogen 3.000 N/A GLU 100.A N GLU 96.A O no hydrogen 3.328 N/A ASP 101.A N MET 98.A O no hydrogen 3.060 N/A LEU 102.A N MET 98.A O no hydrogen 2.971 N/A THR 105.A N LEU 102.A O no hydrogen 3.477 N/A THR 105.A OG1 LEU 102.A O no hydrogen 2.592 N/A LYS 106.A NZ GLU 68.A OE1 no hydrogen 3.199 N/A LYS 106.A NZ GLU 68.A OE2 no hydrogen 2.804 N/A ILE 108.A N VAL 160.A O no hydrogen 2.901 N/A ALA 109.A N SER 130.A O no hydrogen 3.114 N/A VAL 110.A N VAL 162.A O no hydrogen 3.088 N/A ASN 111.A N GLN 128.A O no hydrogen 3.133 N/A HIS 115.A N ILE 123.A O no hydrogen 3.160 N/A ARG 118.A NE GLU 331.A OE1 no hydrogen 3.061 N/A ARG 118.A NH2 GLU 331.A OE2 no hydrogen 3.505 N/A SER 119.A OG ASP 330.A OD2 no hydrogen 3.415 N/A TYR 120.A OH ASP 323.A OD1 no hydrogen 2.989 N/A TYR 121.A OH ASP 14.A O no hydrogen 3.393 N/A GLY 122.A N SER 119.A OG no hydrogen 3.302 N/A ILE 123.A N HIS 115.A O no hydrogen 3.031 N/A VAL 124.A N ASP 176.A OD2 no hydrogen 3.142 N/A CYS 125.A N GLU 113.A O no hydrogen 2.785 N/A CYS 125.A SG ILE 123.A O no hydrogen 3.617 N/A MET 127.A N VAL 138.A O no hydrogen 2.957 N/A GLN 128.A N ASN 111.A O no hydrogen 3.007 N/A GLN 128.A NE2 GLU 113.A OE2 no hydrogen 2.708 N/A ILE 129.A N TYR 136.A O no hydrogen 3.154 N/A SER 130.A N ALA 109.A O no hydrogen 2.960 N/A SER 130.A OG ASP 135.A OD1 no hydrogen 3.258 N/A SER 130.A OG THR 239.A OG1 no hydrogen 2.616 N/A THR 131.A N ARG 134.A O no hydrogen 2.863 N/A THR 131.A OG1 ARG 134.A O no hydrogen 3.143 N/A ARG 132.A NE GLU 107.A OE2 no hydrogen 2.777 N/A ARG 132.A NH1 LEU 243.A O no hydrogen 3.216 N/A ARG 132.A NH1 ASP 247.A OD2 no hydrogen 3.094 N/A ARG 132.A NH2 GLU 107.A OE2 no hydrogen 2.758 N/A ARG 132.A NH2 ASP 247.A OD1 no hydrogen 3.526 N/A ARG 132.A NH2 ASP 247.A OD2 no hydrogen 2.513 N/A ARG 134.A N THR 131.A OG1 no hydrogen 3.309 N/A ARG 134.A NH1 ASP 101.A OD2 no hydrogen 3.563 N/A TYR 136.A N ILE 129.A O no hydrogen 2.634 N/A TYR 136.A OH ASP 101.A OD2 no hydrogen 2.643 N/A LEU 137.A N ILE 87.A O no hydrogen 2.697 N/A VAL 138.A N MET 127.A O no hydrogen 2.638 N/A ASP 139.A N VAL 89.A O no hydrogen 3.208 N/A THR 140.A N CYS 125.A O no hydrogen 3.221 N/A THR 140.A OG1 VAL 124.A O no hydrogen 2.442 N/A THR 140.A OG1 CYS 125.A O no hydrogen 2.614 N/A LEU 141.A N ASP 139.A OD2 no hydrogen 3.262 N/A LYS 142.A NZ ASP 90.A O no hydrogen 3.565 N/A LEU 143.A N ASP 139.A OD1 no hydrogen 3.191 N/A LEU 147.A N ARG 144.A O no hydrogen 3.435 N/A HIS 148.A ND1 GLU 145.A O no hydrogen 2.653 N/A LEU 150.A N LEU 147.A O no hydrogen 3.242 N/A ASN 151.A N HIS 148.A O no hydrogen 3.360 N/A ASN 151.A ND2 HIS 148.A O no hydrogen 2.929 N/A ASN 151.A ND2 GLY 178.A O no hydrogen 3.308 N/A VAL 153.A N LEU 150.A O no hydrogen 3.050 N/A PHE 154.A N LEU 150.A O no hydrogen 2.962 N/A THR 155.A N ASN 151.A O no hydrogen 2.961 N/A THR 155.A OG1 PRO 29.A O no hydrogen 3.298 N/A THR 155.A OG1 ASN 151.A O no hydrogen 2.318 N/A ASN 156.A N VAL 153.A O no hydrogen 3.332 N/A VAL 160.A N LYS 106.A O no hydrogen 3.141 N/A LYS 161.A N GLY 183.A O no hydrogen 3.323 N/A LYS 161.A NZ VAL 153.A O no hydrogen 3.131 N/A LYS 161.A NZ ILE 159.A O no hydrogen 2.461 N/A LYS 161.A NZ VAL 182.A O no hydrogen 3.166 N/A VAL 162.A N ILE 108.A O no hydrogen 2.729 N/A PHE 163.A N PHE 185.A O no hydrogen 3.292 N/A HIS 164.A NE2 HIS 199.A O no hydrogen 3.217 N/A GLY 165.A N ASP 186.A OD1 no hydrogen 2.826 N/A ALA 166.A N ASP 186.A OD2 no hydrogen 2.939 N/A ILE 170.A N ALA 166.A O no hydrogen 2.983 N/A TRP 172.A N MET 168.A O no hydrogen 3.204 N/A LEU 173.A N ASP 169.A O no hydrogen 2.882 N/A GLN 174.A N ILE 170.A O no hydrogen 3.233 N/A GLN 174.A NE2 ARG 272.A O no hydrogen 2.971 N/A ARG 175.A N ILE 171.A O no hydrogen 3.026 N/A ARG 175.A NH1 GLY 122.A O no hydrogen 2.818 N/A ARG 175.A NH2 HIS 114.A NE2 no hydrogen 3.122 N/A ASP 176.A N TRP 172.A O no hydrogen 3.375 N/A LEU 179.A N LEU 173.A O no hydrogen 2.547 N/A TYR 180.A N ASN 151.A OD1 no hydrogen 3.043 N/A VAL 182.A N PHE 154.A O no hydrogen 2.958 N/A PHE 185.A N LYS 161.A O no hydrogen 2.874 N/A ASP 186.A N SER 266.A OG no hydrogen 3.234 N/A THR 187.A N PHE 163.A O no hydrogen 3.057 N/A THR 187.A OG1 PHE 163.A O no hydrogen 3.176 N/A TYR 188.A N ASP 186.A OD1 no hydrogen 3.083 N/A ALA 190.A N ASP 186.A O no hydrogen 3.320 N/A SER 191.A N THR 187.A O no hydrogen 2.911 N/A SER 191.A OG THR 187.A O no hydrogen 3.040 N/A LYS 192.A N TYR 188.A O no hydrogen 3.152 N/A ALA 193.A N HIS 189.A O no hydrogen 3.177 N/A ILE 194.A N ALA 190.A O no hydrogen 3.237 N/A GLY 195.A N SER 191.A O no hydrogen 3.202 N/A LEU 196.A N SER 191.A O no hydrogen 3.133 N/A ALA 202.A N SER 200.A OG no hydrogen 3.324 N/A LEU 205.A N LEU 201.A O no hydrogen 3.181 N/A GLU 206.A N TYR 203.A O no hydrogen 3.101 N/A ASN 207.A N TYR 203.A O no hydrogen 2.954 N/A ASN 210.A N GLU 206.A O no hydrogen 3.011 N/A PHE 211.A N LEU 205.A O no hydrogen 2.821 N/A THR 213.A OG1 SER 214.A O no hydrogen 3.560 N/A LYS 215.A NZ LYS 215.A O no hydrogen 3.407 N/A ARG 223.A N ASP 221.A OD1 no hydrogen 2.924 N/A ARG 225.A NE TRP 222.A O no hydrogen 3.502 N/A ARG 225.A NH1 ASP 139.A OD2 no hydrogen 2.395 N/A THR 232.A N SER 228.A O no hydrogen 3.166 N/A ALA 233.A N LYS 229.A O no hydrogen 3.158 N/A TYR 234.A N PRO 230.A O no hydrogen 3.216 N/A ALA 235.A N MET 231.A O no hydrogen 2.841 N/A ARG 236.A N THR 232.A O no hydrogen 3.333 N/A ARG 236.A NH1 SER 84.A O no hydrogen 2.801 N/A ARG 236.A NH2 SER 84.A O no hydrogen 3.457 N/A ALA 237.A N ALA 233.A O no hydrogen 3.286 N/A THR 239.A OG1 SER 130.A OG no hydrogen 2.616 N/A HIS 240.A N ARG 236.A O no hydrogen 3.017 N/A HIS 240.A ND1 ASP 135.A OD1 no hydrogen 3.165 N/A HIS 240.A ND1 ASP 135.A OD2 no hydrogen 2.660 N/A HIS 240.A NE2 LYS 79.A O no hydrogen 2.888 N/A ASN 244.A ND2 SER 78.A OG no hydrogen 3.411 N/A ILE 245.A N PHE 241.A O no hydrogen 3.128 N/A TYR 246.A N LEU 242.A O no hydrogen 2.966 N/A ASP 247.A N LEU 243.A O no hydrogen 3.363 N/A GLN 248.A N ASN 244.A O no hydrogen 3.294 N/A GLN 248.A NE2 PHE 208.A O no hydrogen 3.476 N/A GLN 248.A NE2 ASN 244.A OD1 no hydrogen 3.063 N/A LEU 249.A N ILE 245.A O no hydrogen 2.823 N/A ARG 250.A N TYR 246.A O no hydrogen 2.988 N/A ARG 250.A NH2 ASP 247.A OD1 no hydrogen 2.747 N/A ASN 251.A N ASP 247.A O no hydrogen 2.939 N/A ASN 251.A ND2 ARG 73.A O no hydrogen 3.096 N/A LYS 252.A N GLN 248.A O no hydrogen 3.270 N/A LEU 253.A N LEU 249.A O no hydrogen 3.091 N/A ILE 254.A N ARG 250.A O no hydrogen 3.311 N/A SER 256.A OG LYS 252.A O no hydrogen 2.681 N/A SER 256.A OG LEU 253.A O no hydrogen 3.265 N/A ASN 257.A N ILE 254.A O no hydrogen 3.083 N/A LYS 258.A N LEU 253.A O no hydrogen 2.793 N/A LYS 258.A NZ ALA 193.A O no hydrogen 2.876 N/A VAL 262.A N LYS 258.A O no hydrogen 3.374 N/A LEU 263.A N LEU 259.A O no hydrogen 3.162 N/A TYR 264.A N ALA 260.A O no hydrogen 3.208 N/A GLU 265.A N GLY 261.A O no hydrogen 3.008 N/A SER 266.A N VAL 262.A O no hydrogen 2.860 N/A SER 266.A OG VAL 262.A O no hydrogen 2.609 N/A ARG 267.A N LEU 263.A O no hydrogen 3.138 N/A ASN 268.A N TYR 264.A O no hydrogen 3.375 N/A ASN 268.A ND2 TYR 264.A O no hydrogen 2.412 N/A VAL 269.A N GLU 265.A O no hydrogen 3.243 N/A VAL 269.A N SER 266.A O no hydrogen 3.196 N/A ALA 270.A N SER 266.A O no hydrogen 3.025 N/A LYS 271.A N ARG 267.A O no hydrogen 2.981 N/A LYS 271.A NZ ASP 61.A OD1 no hydrogen 2.435 N/A LYS 271.A NZ ASP 61.A OD2 no hydrogen 3.120 N/A ARG 272.A N VAL 269.A O no hydrogen 3.284 N/A ARG 273.A N GLU 287.A O no hydrogen 3.095 N/A PHE 274.A N GLN 174.A OE1 no hydrogen 2.495 N/A GLU 275.A N TYR 289.A O no hydrogen 3.077 N/A TYR 279.A OH SER 18.A O no hydrogen 2.564 N/A ARG 280.A NH1 SER 277.A O no hydrogen 3.352 N/A LEU 282.A N ASN 47.A O no hydrogen 2.605 N/A TYR 289.A N ARG 273.A O no hydrogen 3.008 N/A SER 290.A OG ILE 292.A O no hydrogen 3.476 N/A ILE 292.A N SER 277.A OG no hydrogen 3.028 N/A TRP 298.A NE1 GLU 312.A OE2 no hydrogen 3.242 N/A LYS 299.A N SER 296.A O no hydrogen 3.146 N/A LYS 299.A NZ GLU 312.A OE1 no hydrogen 3.189 N/A LYS 299.A NZ GLU 312.A OE2 no hydrogen 3.274 N/A MET 302.A N LYS 299.A O no hydrogen 3.199 N/A TYR 303.A N LYS 299.A O no hydrogen 3.374 N/A ILE 307.A N MET 302.A O no hydrogen 2.708 N/A GLU 310.A N PRO 308.A O no hydrogen 2.648 N/A LEU 314.A N ARG 311.A O no hydrogen 3.107 N/A VAL 315.A N ARG 311.A O no hydrogen 2.961 N/A ARG 316.A N GLU 312.A O no hydrogen 2.924 N/A ARG 316.A NE GLN 320.A OE1 no hydrogen 2.991 N/A LEU 318.A N LEU 314.A O no hydrogen 3.150 N/A TYR 319.A N VAL 315.A O no hydrogen 3.072 N/A TYR 319.A N ARG 316.A O no hydrogen 3.096 N/A GLN 320.A N ARG 316.A O no hydrogen 2.820 N/A TRP 321.A N GLU 317.A O no hydrogen 2.938 N/A ARG 322.A N LEU 318.A O no hydrogen 3.306 N/A ARG 322.A NH1 MET 337.A O no hydrogen 3.176 N/A ARG 322.A NH1 ASN 339.A OD1 no hydrogen 3.384 N/A ASP 323.A N TYR 319.A O no hydrogen 2.996 N/A LEU 324.A N GLN 320.A O no hydrogen 2.918 N/A ILE 325.A N TRP 321.A O no hydrogen 3.032 N/A ALA 326.A N ARG 322.A O no hydrogen 3.288 N/A ARG 327.A N ASP 323.A O no hydrogen 3.083 N/A ARG 327.A NE TYR 120.A OH no hydrogen 2.926 N/A ARG 327.A NH2 TYR 120.A OH no hydrogen 2.891 N/A ARG 328.A N ILE 325.A O no hydrogen 2.977 N/A ASP 329.A N ILE 325.A O no hydrogen 2.947 N/A GLU 331.A N ALA 326.A O no hydrogen 2.867 N/A SER 332.A OG TYR 117.A O no hydrogen 2.673 N/A ARG 334.A NH1 ASP 116.A OD2 no hydrogen 3.536 N/A ARG 334.A NH2 ASP 116.A OD1 no hydrogen 2.982 N/A PHE 335.A N SER 332.A O no hydrogen 2.953 N/A VAL 336.A N SER 332.A O no hydrogen 3.158 N/A MET 337.A N PRO 333.A O no hydrogen 3.138 N/A LEU 342.A N PRO 338.A O no hydrogen 3.139 N/A ALA 343.A N ASN 339.A O no hydrogen 2.996 N/A ALA 344.A N LEU 341.A O no hydrogen 3.189 N/A LEU 345.A N LEU 342.A O no hydrogen 3.013 N/A VAL 346.A N LEU 342.A O no hydrogen 3.158 N/A VAL 346.A N ALA 343.A O no hydrogen 3.302 N/A ALA 347.A N ALA 343.A O no hydrogen 2.883 N/A TYR 348.A N ALA 344.A O no hydrogen 3.099 N/A THR 349.A OG1 TYR 348.A O no hydrogen 2.556 N/A THR 349.A OG1 THR 349.A O no hydrogen 2.578 N/A SER 358.A OG ILE 354.A O no hydrogen 3.239 N/A THR 360.A OG1 LEU 359.A O no hydrogen 2.605 N/A THR 364.A OG1 PHE 335.A O no hydrogen 3.058 N/A ASN 370.A ND2 HIS 366.A O no hydrogen 3.248 N/A LEU 374.A N ASN 370.A O no hydrogen 3.001 N/A ALA 375.A N ALA 371.A O no hydrogen 3.115 N/A ASN 376.A N LEU 373.A O no hydrogen 3.063 N/A LEU 377.A N LEU 373.A O no hydrogen 3.095 N/A ILE 378.A N LEU 374.A O no hydrogen 3.226 N/A ARG 379.A N ALA 375.A O no hydrogen 3.385 N/A ARG 379.A NE THR 351.A O no hydrogen 2.534 N/A ASP 380.A N ASN 376.A O no hydrogen 2.725 N/A ALA 381.A N LEU 377.A O no hydrogen 2.907 N/A LEU 382.A N ILE 378.A O no hydrogen 2.886 N/A ARG 383.A N ARG 379.A O no hydrogen 3.349 N/A ASN 384.A N ASP 380.A O no hydrogen 3.008 N/A ILE 385.A N ALA 381.A O no hydrogen 2.899 N/A LYS 386.A N LEU 382.A O no hydrogen 3.266 N/A ASN 387.A N ASN 384.A O no hydrogen 3.275 N/A THR 388.A OG1 ILE 385.A O no hydrogen 3.374 N/A THR 388.A OG1 ASN 389.A OD1 no hydrogen 2.819 N/A GLY 396.A N THR 392.A O no hydrogen 2.697 N/A LEU 398.A N ASP 395.A O no hydrogen 3.076 N/A LEU 399.A N ASP 395.A O no hydrogen 2.991 N/A GLU 400.A N GLY 396.A O no hydrogen 3.290 N/A THR 401.A N LEU 398.A O no hydrogen 3.302 N/A THR 401.A OG1 ILE 397.A O no hydrogen 2.449 N/A ILE 402.A N LEU 398.A O no hydrogen 3.278 N/A ILE 407.A N VAL 404.A O no hydrogen 3.048 N/A ASP 409.A N PRO 405.A O no hydrogen 3.018 N/A VAL 410.A N GLN 406.A O no hydrogen 2.741 N/A MET 411.A N ILE 407.A O no hydrogen 3.139 N/A GLU 412.A N ARG 408.A O no hydrogen 3.075 N/A ARG 413.A N ASP 409.A O no hydrogen 2.872 N/A PHE 414.A N MET 411.A O no hydrogen 3.098 N/A SER 415.A N MET 411.A O no hydrogen 2.807 N/A SER 415.A OG MET 411.A O no hydrogen 3.029 N/A VAL 416.A N GLU 412.A O no hydrogen 2.994 N/A LEU 417.A N PHE 414.A O no hydrogen 3.232 N/A CYS 418.A N PHE 414.A O no hydrogen 3.110 N/A CYS 418.A SG PHE 414.A O no hydrogen 3.287 N/A ASN 419.A N SER 415.A O no hydrogen 3.254 N/A ASN 421.A N CYS 418.A O no hydrogen 3.325 N/A ILE 422.A N CYS 418.A O no hydrogen 3.197 N/A SER 423.A OG CYS 418.A O no hydrogen 3.284 N/A SER 425.A OG LYS 424.A O no hydrogen 2.745 N/A THR 431.A OG1 SER 433.A OG no hydrogen 2.815 N/A SER 433.A N THR 431.A OG1 no hydrogen 3.261 N/A SER 433.A OG THR 431.A OG1 no hydrogen 2.815 N/A LEU 441.A N LEU 437.A O no hydrogen 3.125 N/A HIS 446.A NE2 GLU 444.A OE2 no hydrogen 3.123 N/A ALA 449.A N ASN 457.A O no hydrogen 2.932 N/A SER 451.A OG ASN 457.A OD1 no hydrogen 2.732 N/A GLY 454.A N SER 451.A O no hydrogen 3.358 N/A LEU 455.A N ASP 453.A OD1 no hydrogen 3.049 N/A VAL 459.A N ASP 447.A O no hydrogen 2.626 N/A ASP 463.A N LYS 460.A O no hydrogen 3.239 N/A ARG 465.A N GLU 462.A O no hydrogen 3.176 N/A ILE 466.A N GLU 462.A O no hydrogen 3.299 N/A ALA 468.A N ILE 464.A O no hydrogen 3.153 N/A GLN 469.A N ARG 465.A O no hydrogen 2.966 N/A ASN 470.A N ILE 466.A O no hydrogen 2.892 N/A PHE 471.A N ARG 467.A O no hydrogen 3.033 N/A LYS 472.A N ALA 468.A O no hydrogen 2.848 N/A SER 473.A OG GLN 469.A O no hydrogen 2.850 N/A SER 473.A OG ASN 470.A O no hydrogen 2.898 N/A ALA 474.A N ASN 470.A O no hydrogen 3.219 N/A LEU 475.A N PHE 471.A O no hydrogen 2.816 N/A ALA 476.A N LYS 472.A O no hydrogen 3.298 N/A GLU 486.A N GLU 486.A OE1 no hydrogen 2.766 N/A