Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6w03_G.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N GLU 1.A O no hydrogen 2.712 N/A TRP 4.A N THR 421.A O no hydrogen 2.772 N/A THR 6.A N ALA 419.A O no hydrogen 3.101 N/A THR 6.A OG1 ALA 419.A O no hydrogen 3.137 N/A TYR 8.A N GLY 417.A O no hydrogen 2.637 N/A GLY 10.A N PRO 415.A O no hydrogen 2.665 N/A VAL 11.A N PRO 415.A O no hydrogen 3.178 N/A VAL 13.A N VAL 11.A O no hydrogen 2.941 N/A TRP 14.A NE1 GLU 54.A OE2 no hydrogen 2.514 N/A LYS 15.A N LYS 412.A O no hydrogen 2.991 N/A LYS 15.A NZ GLU 414.A OE1 no hydrogen 3.472 N/A LEU 21.A N GLN 66.A OE1 no hydrogen 3.365 N/A PHE 22.A N CYS 164.A O no hydrogen 3.129 N/A ALA 24.A N HIS 162.A O no hydrogen 2.849 N/A SER 25.A N VAL 38.A O no hydrogen 3.085 N/A SER 25.A OG THR 34.A O no hydrogen 3.322 N/A HIS 29.A ND1 LYS 28.A O no hydrogen 3.105 N/A ASN 30.A ND2 THR 34.A OG1 no hydrogen 3.134 N/A VAL 31.A N SER 155.A O no hydrogen 3.171 N/A TRP 32.A NE1 GLU 157.A O no hydrogen 2.892 N/A ALA 33.A N ASN 30.A O no hydrogen 2.943 N/A THR 34.A N ASN 30.A OD1 no hydrogen 3.288 N/A THR 34.A OG1 ASN 30.A OD1 no hydrogen 3.154 N/A ALA 36.A N ALA 33.A O no hydrogen 2.851 N/A THR 40.A N SER 25.A O no hydrogen 2.353 N/A ASN 43.A N ASP 41.A OD2 no hydrogen 3.353 N/A GLN 45.A N GLN 192.A OE1 no hydrogen 2.577 N/A ILE 47.A N THR 190.A O no hydrogen 3.145 N/A LEU 49.A N VAL 188.A O no hydrogen 3.132 N/A ASN 51.A N GLU 50.A OE2 no hydrogen 3.304 N/A VAL 52.A N LEU 49.A O no hydrogen 3.374 N/A GLU 54.A N CYS 185.A O no hydrogen 3.208 N/A PHE 56.A N GLY 183.A O no hydrogen 2.903 N/A MET 58.A N GLY 181.A O no hydrogen 3.496 N/A TRP 59.A N ASN 57.A OD1 no hydrogen 3.312 N/A LYS 60.A N ASN 57.A O no hydrogen 3.219 N/A LYS 60.A NZ ASP 16.A OD2 no hydrogen 3.035 N/A MET 63.A N ASN 61.A OD1 no hydrogen 2.680 N/A GLN 66.A N ASN 62.A O no hydrogen 2.809 N/A GLN 66.A NE2 LEU 21.A O no hydrogen 2.993 N/A MET 67.A N MET 63.A O no hydrogen 2.837 N/A HIS 68.A N VAL 64.A O no hydrogen 2.925 N/A THR 69.A N GLN 66.A O no hydrogen 3.131 N/A THR 69.A OG1 GLN 66.A O no hydrogen 2.658 N/A ASP 70.A N GLN 66.A O no hydrogen 2.839 N/A ILE 71.A N MET 67.A O no hydrogen 2.884 N/A SER 73.A N THR 69.A O no hydrogen 2.751 N/A LEU 74.A N ASP 70.A O no hydrogen 2.835 N/A TRP 75.A N ILE 71.A O no hydrogen 2.766 N/A ASP 76.A N ILE 72.A O no hydrogen 3.097 N/A GLN 77.A N SER 73.A O no hydrogen 3.101 N/A SER 78.A N LEU 74.A O no hydrogen 2.985 N/A SER 78.A N TRP 75.A O no hydrogen 3.198 N/A CYS 82.A N LEU 79.A O no hydrogen 3.360 N/A CYS 82.A SG SER 78.A O no hydrogen 3.337 N/A LEU 85.A N CYS 147.A O no hydrogen 2.771 N/A CYS 89.A N THR 86.A O no hydrogen 3.205 N/A VAL 90.A N LEU 88.A O no hydrogen 2.802 N/A LEU 92.A N TYR 137.A O no hydrogen 2.788 N/A GLN 93.A N SER 107.A O no hydrogen 2.956 N/A GLN 93.A NE2 GLU 136.A OE2 no hydrogen 3.110 N/A CYS 94.A N LYS 135.A O no hydrogen 3.004 N/A THR 95.A N ASN 105.A O no hydrogen 2.801 N/A THR 95.A OG1 ASN 96.A O no hydrogen 3.056 N/A LYS 104.A N PHE 125.A O no hydrogen 2.897 N/A ASN 105.A N THR 95.A O no hydrogen 2.607 N/A CYS 106.A N SER 123.A O no hydrogen 2.880 N/A SER 107.A N GLN 93.A O no hydrogen 2.840 N/A SER 107.A OG GLN 93.A O no hydrogen 3.545 N/A PHE 108.A N VAL 121.A O no hydrogen 2.732 N/A MET 110.A N GLN 119.A O no hydrogen 2.736 N/A THR 112.A OG1 LEU 114.A O no hydrogen 2.699 N/A THR 112.A OG1 LYS 117.A O no hydrogen 2.413 N/A LYS 117.A N LEU 114.A O no hydrogen 3.172 N/A GLN 119.A N MET 110.A O no hydrogen 2.851 N/A GLN 119.A NE2 THR 111.A O no hydrogen 3.188 N/A GLN 119.A NE2 ARG 254.A O no hydrogen 3.063 N/A VAL 121.A N PHE 108.A O no hydrogen 3.002 N/A SER 123.A N CYS 106.A O no hydrogen 2.697 N/A SER 123.A OG LEU 124.A O no hydrogen 3.558 N/A SER 123.A OG LEU 264.A O no hydrogen 3.305 N/A LEU 124.A N LEU 264.A O no hydrogen 3.145 N/A PHE 125.A N LYS 104.A O no hydrogen 3.255 N/A ASP 129.A N TYR 126.A O no hydrogen 2.795 N/A VAL 130.A N ARG 127.A O no hydrogen 3.248 N/A VAL 131.A N ARG 138.A O no hydrogen 2.809 N/A ILE 133.A N GLU 136.A O no hydrogen 3.304 N/A TYR 137.A N LEU 92.A O no hydrogen 2.779 N/A ARG 138.A N VAL 131.A O no hydrogen 2.676 N/A ARG 138.A NE LEU 139.A O no hydrogen 3.062 N/A ARG 138.A NH2 ILE 140.A O no hydrogen 3.549 N/A ILE 140.A N ASP 129.A O no hydrogen 2.773 N/A ASN 141.A ND2 SER 145.A O no hydrogen 3.288 N/A CYS 142.A N LEU 139.A O no hydrogen 3.382 N/A CYS 142.A SG LEU 139.A O no hydrogen 3.591 N/A THR 144.A N ASN 141.A O no hydrogen 2.844 N/A THR 144.A OG1 ASN 141.A O no hydrogen 3.113 N/A THR 144.A OG1 SER 145.A OG no hydrogen 3.328 N/A SER 145.A N ASN 141.A O no hydrogen 2.849 N/A SER 145.A OG THR 144.A OG1 no hydrogen 3.328 N/A CYS 147.A SG ASN 141.A OD1 no hydrogen 3.644 N/A THR 148.A N CYS 361.A O no hydrogen 3.112 N/A GLN 149.A N VAL 83.A O no hydrogen 2.892 N/A GLN 149.A NE2 ALA 260.A O no hydrogen 3.256 N/A ALA 150.A N TYR 363.A O no hydrogen 2.985 N/A VAL 154.A N CYS 151.A O no hydrogen 3.272 N/A SER 155.A N HIS 29.A O no hydrogen 3.072 N/A ILE 161.A N ILE 197.A O no hydrogen 2.723 N/A HIS 162.A N ALA 24.A O no hydrogen 3.063 N/A HIS 162.A ND1 THR 194.A O no hydrogen 2.981 N/A TYR 163.A N THR 194.A OG1 no hydrogen 2.942 N/A CYS 164.A N PHE 22.A O no hydrogen 2.828 N/A CYS 164.A SG HIS 162.A O no hydrogen 4.050 N/A ALA 165.A N GLN 192.A O no hydrogen 3.272 N/A PHE 169.A N PRO 166.A O no hydrogen 3.066 N/A ALA 170.A N VAL 411.A O no hydrogen 2.826 N/A ILE 171.A N VAL 191.A O no hydrogen 3.363 N/A LEU 172.A N LYS 409.A O no hydrogen 3.033 N/A LYS 173.A N SER 189.A O no hydrogen 2.609 N/A LYS 173.A NZ GLU 46.A OE2 no hydrogen 2.936 N/A LYS 175.A N SER 187.A O no hydrogen 2.994 N/A LYS 175.A NZ HIS 48.A ND1 no hydrogen 3.081 N/A LYS 175.A NZ SER 187.A OG no hydrogen 3.000 N/A THR 182.A N ASN 180.A OD1 no hydrogen 3.225 N/A GLY 183.A N PHE 56.A O no hydrogen 3.350 N/A CYS 185.A N GLU 54.A O no hydrogen 2.691 N/A CYS 185.A SG SER 187.A O no hydrogen 3.236 N/A SER 189.A N LYS 173.A O no hydrogen 3.266 N/A THR 190.A N ILE 47.A O no hydrogen 2.941 N/A THR 190.A OG1 ILE 171.A O no hydrogen 3.291 N/A VAL 191.A N ILE 171.A O no hydrogen 2.775 N/A THR 194.A N TYR 163.A O no hydrogen 2.729 N/A THR 194.A OG1 TYR 163.A O no hydrogen 3.461 N/A THR 194.A OG1 HIS 195.A O no hydrogen 3.265 N/A HIS 195.A N TYR 408.A OH no hydrogen 3.101 N/A HIS 195.A ND1 TYR 408.A OH no hydrogen 2.578 N/A ILE 197.A N ILE 161.A O no hydrogen 2.707 N/A LYS 198.A NZ ASN 208.A O no hydrogen 3.409 N/A VAL 200.A N LYS 198.A O no hydrogen 2.651 N/A SER 202.A OG LEU 205.A O no hydrogen 2.283 N/A THR 203.A OG1 SER 202.A O no hydrogen 2.702 N/A THR 203.A OG1 GLU 315.A O no hydrogen 3.431 N/A THR 203.A OG1 SER 320.A OG no hydrogen 2.903 N/A GLN 204.A NE2 VAL 316.A O no hydrogen 2.460 N/A LEU 205.A N THR 203.A O no hydrogen 2.465 N/A ASN 208.A N ASN 376.A O no hydrogen 2.457 N/A SER 210.A N GLU 404.A OE2 no hydrogen 2.849 N/A SER 210.A OG GLU 404.A OE1 no hydrogen 2.684 N/A ALA 212.A N PHE 234.A O no hydrogen 2.796 N/A VAL 216.A N GLU 215.A OE1 no hydrogen 3.188 N/A ARG 219.A N LEU 231.A O no hydrogen 2.836 N/A THR 224.A OG1 ASN 222.A OD1 no hydrogen 2.640 N/A ASN 225.A N ASN 222.A O no hydrogen 2.873 N/A ALA 227.A N ASN 225.A OD1 no hydrogen 3.324 N/A LYS 228.A NZ GLU 221.A OE1 no hydrogen 3.086 N/A ASN 229.A ND2 ASP 399.A OD2 no hydrogen 3.429 N/A ILE 230.A N LEU 382.A O no hydrogen 3.286 N/A VAL 232.A N LEU 380.A O no hydrogen 3.118 N/A GLN 233.A N MET 217.A O no hydrogen 3.051 N/A GLN 233.A NE2 SER 210.A O no hydrogen 3.279 N/A PHE 234.A N THR 378.A O no hydrogen 2.747 N/A ASN 235.A N ASN 235.A OD1 no hydrogen 2.542 N/A ILE 240.A N SER 375.A O no hydrogen 3.110 N/A ASN 241.A N ASN 277.A O no hydrogen 2.836 N/A CYS 242.A N CYS 373.A O no hydrogen 3.088 N/A THR 243.A N HIS 275.A O no hydrogen 3.027 N/A THR 243.A OG1 ILE 371.A O no hydrogen 2.611 N/A ARG 244.A N ILE 371.A O no hydrogen 2.659 N/A ARG 244.A NE ARG 244.A O no hydrogen 3.386 N/A ARG 244.A NH1 ILE 367.A O no hydrogen 3.251 N/A ARG 244.A NH2 ILE 367.A O no hydrogen 3.410 N/A MET 248.A N GLY 369.A O no hydrogen 3.505 N/A THR 249.A OG1 ASP 266A.A O no hydrogen 2.519 N/A THR 249.A OG1 ASP 266A.A OD1 no hydrogen 2.771 N/A ARG 250.A N GLN 368.A OE1 no hydrogen 2.870 N/A LYS 251.A N ALA 263.A O no hydrogen 2.920 N/A LYS 251.A NZ TYR 122.A O no hydrogen 2.617 N/A ILE 253.A N PHE 261.A O no hydrogen 2.883 N/A ARG 254.A NH1 GLU 113.A OE1 no hydrogen 3.441 N/A ARG 254.A NH1 GLU 113.A OE2 no hydrogen 2.332 N/A ILE 255.A N GLN 259.A O no hydrogen 2.860 N/A GLN 259.A N GLY 256.A O no hydrogen 2.987 N/A PHE 261.A N ILE 253.A O no hydrogen 2.978 N/A TYR 262.A N GLN 149.A OE1 no hydrogen 3.048 N/A ALA 263.A N LYS 251.A O no hydrogen 2.598 N/A LEU 264.A N SER 123.A OG no hydrogen 2.875 N/A GLY 265.A N THR 249.A O no hydrogen 2.761 N/A ILE 268.A N ASN 247.A O no hydrogen 2.854 N/A ARG 272.A N ASN 246.A OD1 no hydrogen 3.141 N/A HIS 275.A N THR 243.A O no hydrogen 3.181 N/A HIS 275.A ND1 GLN 273.A O no hydrogen 2.883 N/A CYS 276.A N LEU 346.A O no hydrogen 3.100 N/A ASN 277.A N ASN 241.A O no hydrogen 2.588 N/A VAL 278.A N ILE 344.A O no hydrogen 3.044 N/A SER 279.A OG ASP 342.A OD2 no hydrogen 3.320 N/A THR 282.A N SER 279.A OG no hydrogen 3.401 N/A TRP 283.A N SER 279.A O no hydrogen 2.740 N/A TRP 283.A NE1 LEU 335.A O no hydrogen 2.921 N/A ASN 284.A N LYS 280.A O no hydrogen 2.899 N/A GLU 285.A N ALA 281.A O no hydrogen 2.960 N/A THR 286.A N THR 282.A O no hydrogen 2.976 N/A THR 286.A OG1 THR 282.A O no hydrogen 2.930 N/A LEU 287.A N TRP 283.A O no hydrogen 2.893 N/A GLY 288.A N ASN 284.A O no hydrogen 2.831 N/A LYS 289.A N GLU 285.A O no hydrogen 3.034 N/A VAL 290.A N THR 286.A O no hydrogen 3.018 N/A VAL 291.A N LEU 287.A O no hydrogen 3.150 N/A LYS 292.A N GLY 288.A O no hydrogen 3.310 N/A LEU 294.A N VAL 290.A O no hydrogen 3.151 N/A ARG 295.A N LYS 292.A O no hydrogen 3.181 N/A HIS 297.A ND1 GLN 293.A O no hydrogen 2.969 N/A PHE 298.A N ARG 295.A O no hydrogen 3.183 N/A GLY 299.A N ARG 295.A O no hydrogen 2.750 N/A THR 302.A OG1 ILE 303.A O no hydrogen 3.386 N/A ILE 304.A N TRP 340.A O no hydrogen 3.045 N/A ARG 305.A N GLU 388.A O no hydrogen 2.951 N/A PHE 306.A N SER 338.A O no hydrogen 2.670 N/A ALA 307.A N PHE 390.A O no hydrogen 3.088 N/A GLY 311.A N SER 309.A OG no hydrogen 3.077 N/A GLU 315.A N GLU 315.A OE1 no hydrogen 2.433 N/A VAL 316.A N ASP 313.A O no hydrogen 3.385 N/A THR 317.A N ASP 313.A O no hydrogen 3.076 N/A THR 317.A OG1 ASP 313.A O no hydrogen 2.754 N/A THR 317.A OG1 LEU 314.A O no hydrogen 3.235 N/A THR 318.A OG1 LEU 314.A O no hydrogen 2.990 N/A HIS 319.A N CYS 330.A O no hydrogen 2.891 N/A SER 320.A OG THR 203.A OG1 no hydrogen 2.903 N/A SER 320.A OG GLU 315.A O no hydrogen 2.943 N/A PHE 321.A N PHE 328.A O no hydrogen 3.437 N/A CYS 323.A N GLU 326.A O no hydrogen 3.017 N/A GLY 325.A N ASN 322.A OD1 no hydrogen 3.123 N/A GLU 326.A N CYS 323.A O no hydrogen 3.469 N/A PHE 328.A N PHE 321.A O no hydrogen 3.063 N/A TYR 329.A N ARG 349.A O no hydrogen 3.163 N/A CYS 330.A N HIS 319.A O no hydrogen 3.111 N/A ASN 331.A N PRO 347.A O no hydrogen 3.126 N/A THR 332.A OG1 GLN 204.A OE1 no hydrogen 2.815 N/A SER 333.A N ASN 331.A OD1 no hydrogen 3.037 N/A LEU 335.A N THR 332.A O no hydrogen 2.947 N/A PHE 336.A N THR 332.A O no hydrogen 3.409 N/A TRP 340.A N ILE 304.A O no hydrogen 2.940 N/A ILE 344.A N VAL 278.A O no hydrogen 2.755 N/A THR 345.A OG1 ASN 277.A OD1 no hydrogen 2.759 N/A LEU 346.A N CYS 276.A O no hydrogen 2.912 N/A CYS 348.A N PRO 274.A O no hydrogen 2.941 N/A CYS 348.A SG LEU 346.A O no hydrogen 3.332 N/A ARG 349.A N TYR 329.A O no hydrogen 3.123 N/A ARG 349.A NE GLU 102.A OE2 no hydrogen 3.284 N/A ARG 349.A NH2 GLU 102.A OE1 no hydrogen 3.191 N/A ARG 349.A NH2 GLU 102.A OE2 no hydrogen 2.948 N/A LYS 351.A N PHE 327.A O no hydrogen 3.369 N/A LYS 351.A NZ LEU 128.A O no hydrogen 2.643 N/A LYS 351.A NZ ASP 129.A OD1 no hydrogen 3.508 N/A LYS 351.A NZ ILE 353.A O no hydrogen 2.984 N/A GLN 352.A N ASP 129.A OD1 no hydrogen 3.228 N/A GLN 352.A N ASP 129.A OD2 no hydrogen 3.055 N/A ILE 353.A N ASP 129.A OD1 no hydrogen 3.063 N/A ILE 354.A N MET 362.A O no hydrogen 3.233 N/A CYS 361.A SG ALA 146.A O no hydrogen 3.339 N/A MET 362.A N ILE 354.A O no hydrogen 2.933 N/A TYR 363.A N THR 148.A O no hydrogen 3.136 N/A ALA 364.A N GLN 352.A O no hydrogen 3.089 N/A ILE 367.A N GLU 326.A OE2 no hydrogen 3.242 N/A GLY 369.A N MET 248.A O no hydrogen 3.375 N/A ILE 371.A N ARG 244.A O no hydrogen 3.178 N/A CYS 373.A N CYS 242.A O no hydrogen 2.965 N/A SER 375.A N ILE 240.A O no hydrogen 3.049 N/A ASN 376.A N ASN 208.A OD1 no hydrogen 3.414 N/A ILE 377.A N VAL 238.A O no hydrogen 3.266 N/A THR 378.A N LEU 206.A O no hydrogen 2.637 N/A THR 378.A OG1 LEU 206.A O no hydrogen 3.539 N/A GLY 379.A N LEU 206.A O no hydrogen 3.098 N/A ILE 381.A N GLN 204.A O no hydrogen 3.058 N/A LEU 382.A N ILE 230.A O no hydrogen 3.005 N/A THR 383.A OG1 ASN 229.A OD1 no hydrogen 3.446 N/A THR 383.A OG1 LEU 382.A O no hydrogen 2.613 N/A ARG 384.A NH2 THR 224.A O no hydrogen 3.378 N/A ASP 385.A N THR 389.A O no hydrogen 3.363 N/A GLU 388.A N ILE 303.A O no hydrogen 3.143 N/A PHE 390.A N ARG 305.A O no hydrogen 2.590 N/A ARG 391.A N THR 383.A O no hydrogen 3.007 N/A ARG 391.A NE ASN 308.A O no hydrogen 2.874 N/A ARG 391.A NH1 ASP 385.A OD1 no hydrogen 3.179 N/A GLY 393.A N ILE 381.A O no hydrogen 2.733 N/A ARG 398.A N ASP 396.A OD1 no hydrogen 3.380 N/A ARG 398.A NE ASP 396.A OD1 no hydrogen 3.212 N/A ARG 398.A NH1 GLU 65.A OE2 no hydrogen 3.056 N/A ASN 400.A N MET 397.A O no hydrogen 3.026 N/A ASN 400.A ND2 MET 397.A O no hydrogen 3.240 N/A ARG 402.A N ARG 398.A O no hydrogen 2.934 N/A SER 403.A N ASP 399.A O no hydrogen 3.130 N/A SER 403.A N ASN 400.A O no hydrogen 3.045 N/A SER 403.A OG ASN 400.A O no hydrogen 2.313 N/A GLU 404.A N TRP 401.A O no hydrogen 3.069 N/A LEU 405.A N TRP 401.A O no hydrogen 2.866 N/A TYR 408.A N LEU 405.A O no hydrogen 3.242 N/A TYR 408.A OH HIS 195.A ND1 no hydrogen 2.578 N/A LYS 409.A NZ ASP 16.A OD1 no hydrogen 3.232 N/A LYS 409.A NZ GLU 54.A OE1 no hydrogen 2.445 N/A LYS 409.A NZ GLU 55.A O no hydrogen 3.007 N/A VAL 411.A N ALA 170.A O no hydrogen 3.063 N/A LYS 412.A N LYS 15.A O no hydrogen 2.894 N/A ILE 413.A N GLY 168.A O no hydrogen 2.972 N/A GLU 414.A N VAL 13.A O no hydrogen 3.175 N/A GLY 417.A N TYR 8.A O no hydrogen 2.835 N/A ALA 419.A N THR 6.A O no hydrogen 3.426 N/A THR 421.A N TRP 4.A O no hydrogen 2.953 N/A ASP 266A.A N THR 249.A OG1 no hydrogen 2.513 N/A