Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8g85_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 4.A N THR 435.A O no hydrogen 2.774 N/A THR 6.A N ALA 433.A O no hydrogen 3.017 N/A THR 6.A OG1 ALA 433.A O no hydrogen 2.709 N/A TYR 8.A N GLY 431.A O no hydrogen 2.924 N/A GLY 10.A N PRO 429.A O no hydrogen 2.467 N/A VAL 11.A N PRO 429.A O no hydrogen 3.042 N/A LYS 15.A N LYS 426.A O no hydrogen 3.384 N/A THR 20.A OG1 LEU 21.A O no hydrogen 3.392 N/A SER 25.A OG ASP 26.A O no hydrogen 3.302 N/A ASN 29.A ND2 GLU 160.A O no hydrogen 3.637 N/A VAL 30.A N ASN 29.A OD1 no hydrogen 2.913 N/A THR 33.A N ASN 29.A O no hydrogen 3.139 N/A THR 33.A OG1 ALA 32.A O no hydrogen 2.615 N/A ALA 35.A N ALA 32.A O no hydrogen 3.240 N/A THR 39.A OG1 ASP 40.A O no hydrogen 3.188 N/A THR 39.A OG1 ASP 40.A OD1 no hydrogen 3.079 N/A ASN 42.A N ASP 40.A O no hydrogen 2.789 N/A ILE 46.A N THR 193.A O no hydrogen 3.245 N/A ASN 61.A N GLU 18.A OE2 no hydrogen 3.378 N/A MET 62.A N ASN 60.A OD1 no hydrogen 2.712 N/A GLN 65.A N ASN 61.A O no hydrogen 2.842 N/A MET 66.A N MET 62.A O no hydrogen 3.175 N/A HIS 67.A N VAL 63.A O no hydrogen 3.208 N/A THR 68.A N GLU 64.A O no hydrogen 3.421 N/A THR 68.A OG1 GLU 64.A O no hydrogen 3.085 N/A ASP 69.A N GLN 65.A O no hydrogen 2.966 N/A ILE 70.A N MET 66.A O no hydrogen 3.334 N/A SER 72.A N THR 68.A O no hydrogen 3.290 N/A SER 72.A OG THR 68.A O no hydrogen 3.408 N/A LEU 73.A N ASP 69.A O no hydrogen 2.857 N/A TRP 74.A N ILE 71.A O no hydrogen 3.106 N/A ASP 75.A N ILE 71.A O no hydrogen 3.269 N/A SER 77.A N TRP 74.A O no hydrogen 3.281 N/A LEU 78.A N ASP 75.A O no hydrogen 3.459 N/A CYS 81.A N LEU 78.A O no hydrogen 3.372 N/A CYS 81.A SG SER 77.A O no hydrogen 4.009 N/A LYS 83.A NZ THR 85.A OG1 no hydrogen 3.214 N/A LEU 84.A N CYS 150.A O no hydrogen 2.707 N/A LEU 91.A N TYR 140.A O no hydrogen 3.260 N/A GLN 92.A N SER 112.A O no hydrogen 3.174 N/A THR 94.A N ASN 110.A O no hydrogen 2.925 N/A THR 94.A OG1 ASN 110.A O no hydrogen 3.475 N/A ASN 99.A N THR 97.A O no hydrogen 3.172 N/A ASN 99.A ND2 GLY 272.A O no hydrogen 3.617 N/A ARG 105.A N ASP 102.A O no hydrogen 3.470 N/A LYS 109.A N PHE 130.A O no hydrogen 3.070 N/A LYS 109.A NZ ASN 95.A OD1 no hydrogen 2.710 N/A ASN 110.A N THR 94.A O no hydrogen 2.567 N/A CYS 111.A N SER 128.A O no hydrogen 3.060 N/A CYS 111.A SG LYS 109.A O no hydrogen 3.737 N/A SER 112.A OG GLN 92.A O no hydrogen 3.554 N/A PHE 113.A N VAL 126.A O no hydrogen 3.360 N/A THR 116.A OG1 ILE 258.A O no hydrogen 3.357 N/A THR 117.A N LYS 122.A O no hydrogen 3.264 N/A LYS 122.A N LEU 119.A O no hydrogen 3.285 N/A GLN 124.A NE2 ARG 257.A O no hydrogen 3.406 N/A SER 128.A OG THR 267.A O no hydrogen 3.342 N/A SER 128.A OG THR 267.A OG1 no hydrogen 2.991 N/A LEU 129.A N THR 267.A OG1 no hydrogen 2.814 N/A PHE 130.A N LYS 109.A O no hydrogen 3.272 N/A ASP 134.A N TYR 131.A O no hydrogen 3.174 N/A VAL 136.A N ARG 141.A O no hydrogen 2.751 N/A ILE 138.A N GLU 139.A O no hydrogen 3.223 N/A ARG 141.A N VAL 136.A O no hydrogen 2.792 N/A ARG 141.A NH1 LEU 142.A O no hydrogen 3.130 N/A ILE 143.A N ASP 134.A O no hydrogen 3.296 N/A CYS 145.A SG LEU 142.A O no hydrogen 3.695 N/A CYS 145.A SG ASN 144.A OD1 no hydrogen 3.982 N/A THR 147.A N ASN 144.A O no hydrogen 2.755 N/A THR 147.A OG1 ASN 146.A OD1 no hydrogen 3.302 N/A SER 148.A OG GLY 367.A O no hydrogen 3.093 N/A GLN 152.A NE2 ALA 263.A O no hydrogen 3.439 N/A VAL 157.A N CYS 154.A O no hydrogen 3.135 N/A ILE 164.A N ILE 200.A O no hydrogen 3.053 N/A HIS 165.A N ALA 24.A O no hydrogen 2.809 N/A CYS 167.A N PHE 22.A O no hydrogen 3.011 N/A PHE 172.A N PRO 169.A O no hydrogen 3.404 N/A ALA 173.A N VAL 425.A O no hydrogen 3.243 N/A LEU 175.A N LYS 423.A O no hydrogen 3.019 N/A LYS 176.A N SER 192.A O no hydrogen 3.038 N/A CYS 177.A N LYS 421.A O no hydrogen 3.194 N/A LYS 178.A N SER 190.A OG no hydrogen 3.106 N/A LYS 178.A NZ GLU 45.A OE2 no hydrogen 2.408 N/A LYS 181.A N ASP 179.A OD1 no hydrogen 3.112 N/A LYS 181.A NZ GLU 218.A OE1 no hydrogen 3.176 N/A LYS 181.A NZ GLU 218.A OE2 no hydrogen 3.506 N/A CYS 188.A N GLU 53.A O no hydrogen 2.942 N/A CYS 188.A SG SER 190.A OG no hydrogen 3.261 N/A SER 192.A N LYS 176.A O no hydrogen 3.242 N/A SER 192.A OG ILE 46.A O no hydrogen 2.651 N/A SER 192.A OG THR 193.A O no hydrogen 3.324 N/A THR 193.A N ILE 46.A O no hydrogen 3.191 N/A VAL 194.A N ILE 174.A O no hydrogen 3.181 N/A GLN 195.A N GLN 195.A OE1 no hydrogen 3.197 N/A THR 197.A OG1 HIS 198.A ND1 no hydrogen 3.215 N/A THR 197.A OG1 TYR 422.A OH no hydrogen 2.875 N/A HIS 198.A N THR 197.A OG1 no hydrogen 2.464 N/A HIS 198.A ND1 TYR 422.A OH no hydrogen 2.800 N/A SER 205.A OG LEU 208.A O no hydrogen 2.850 N/A SER 205.A OG HIS 322.A NE2 no hydrogen 3.067 N/A SER 205.A OG SER 323.A O no hydrogen 2.890 N/A THR 206.A OG1 THR 321.A O no hydrogen 2.724 N/A LEU 209.A N GLY 387.A O no hydrogen 2.985 N/A ASN 211.A N ASN 384.A O no hydrogen 3.206 N/A GLY 212.A N THR 386.A OG1 no hydrogen 3.132 N/A SER 213.A N GLU 418.A OE2 no hydrogen 2.718 N/A ALA 215.A N PHE 237.A O no hydrogen 3.078 N/A MET 220.A N GLN 236.A O no hydrogen 3.266 N/A ARG 222.A N LEU 234.A O no hydrogen 2.844 N/A SER 223.A OG GLU 224.A O no hydrogen 2.800 N/A ASN 229.A ND2 ARG 392.A O no hydrogen 3.695 N/A ASN 229.A ND2 ASP 393.A O no hydrogen 2.790 N/A ASN 232.A ND2 THR 391.A OG1 no hydrogen 2.847 N/A ILE 233.A N LEU 390.A O no hydrogen 2.469 N/A VAL 235.A N LEU 388.A O no hydrogen 3.174 N/A GLN 236.A N MET 220.A O no hydrogen 3.171 N/A GLN 236.A NE2 SER 213.A O no hydrogen 2.426 N/A PHE 237.A N THR 386.A O no hydrogen 3.101 N/A VAL 241.A N ILE 385.A O no hydrogen 3.427 N/A ILE 243.A N SER 383.A O no hydrogen 2.979 N/A ASN 244.A N ASN 280.A O no hydrogen 2.615 N/A CYS 245.A N CYS 381.A O no hydrogen 3.144 N/A THR 246.A N HIS 278.A O no hydrogen 3.309 N/A ARG 247.A N ILE 379.A O no hydrogen 3.286 N/A ARG 247.A NH2 ILE 375.A O no hydrogen 2.943 N/A ARG 247.A NH2 GLY 377.A O no hydrogen 2.857 N/A LYS 254.A N ALA 266.A O no hydrogen 3.145 N/A LYS 254.A NZ TYR 127.A O no hydrogen 3.066 N/A ILE 256.A N PHE 264.A O no hydrogen 3.263 N/A ILE 258.A N GLN 262.A O no hydrogen 2.934 N/A GLY 259.A N GLN 262.A O no hydrogen 3.474 N/A GLN 262.A N GLY 259.A O no hydrogen 3.341 N/A PHE 264.A N ILE 256.A O no hydrogen 3.176 N/A TYR 265.A N GLN 152.A OE1 no hydrogen 3.080 N/A ALA 266.A N LYS 254.A O no hydrogen 2.942 N/A THR 267.A N SER 128.A OG no hydrogen 3.095 N/A THR 267.A OG1 SER 128.A OG no hydrogen 2.991 N/A THR 267.A OG1 LEU 129.A O no hydrogen 2.672 N/A GLY 268.A N THR 252.A O no hydrogen 3.439 N/A ILE 274.A N ASN 99.A O no hydrogen 2.959 N/A ARG 275.A NH1 HIS 278.A NE2 no hydrogen 3.042 N/A CYS 279.A N LEU 352.A O no hydrogen 3.285 N/A ASN 280.A N ASN 244.A O no hydrogen 2.465 N/A SER 282.A OG THR 285.A OG1 no hydrogen 3.119 N/A THR 285.A OG1 SER 282.A OG no hydrogen 3.119 N/A TRP 286.A N SER 282.A O no hydrogen 3.068 N/A ASN 287.A N LYS 283.A O no hydrogen 3.067 N/A GLU 288.A N ALA 284.A O no hydrogen 3.239 N/A THR 289.A N THR 285.A O no hydrogen 2.963 N/A THR 289.A OG1 THR 285.A O no hydrogen 2.763 N/A LEU 290.A N TRP 286.A O no hydrogen 2.960 N/A GLY 291.A N ASN 287.A O no hydrogen 3.150 N/A LYS 292.A N GLU 288.A O no hydrogen 3.271 N/A LYS 292.A N THR 289.A O no hydrogen 3.203 N/A LYS 292.A NZ ASN 238.A OD1 no hydrogen 2.714 N/A VAL 293.A N THR 289.A O no hydrogen 3.188 N/A VAL 294.A N LEU 290.A O no hydrogen 3.291 N/A GLN 296.A N LYS 292.A O no hydrogen 3.482 N/A LEU 297.A N VAL 293.A O no hydrogen 2.654 N/A ARG 298.A N VAL 294.A O no hydrogen 3.019 N/A ARG 298.A NH1 ILE 344.A O no hydrogen 3.445 N/A ARG 298.A NH2 THR 305.A O no hydrogen 2.771 N/A LYS 299.A N GLN 296.A O no hydrogen 3.370 N/A LYS 299.A NZ GLN 296.A OE1 no hydrogen 3.162 N/A HIS 300.A N LEU 297.A O no hydrogen 3.242 N/A ARG 308.A N GLU 402.A O no hydrogen 3.425 N/A PHE 309.A N SER 341.A O no hydrogen 2.926 N/A ASN 311.A ND2 SER 336.A OG no hydrogen 3.305 N/A GLY 314.A N SER 312.A OG no hydrogen 3.392 N/A VAL 319.A N ASP 316.A O no hydrogen 3.301 N/A THR 320.A N ASP 316.A O no hydrogen 2.991 N/A THR 320.A OG1 ASP 316.A O no hydrogen 2.793 N/A THR 321.A OG1 LEU 317.A O no hydrogen 2.968 N/A HIS 322.A N CYS 333.A O no hydrogen 3.277 N/A HIS 322.A NE2 LEU 208.A O no hydrogen 3.183 N/A TYR 332.A N ARG 355.A O no hydrogen 2.708 N/A CYS 333.A N HIS 322.A O no hydrogen 3.434 N/A ASN 334.A N PRO 353.A O no hydrogen 2.706 N/A THR 335.A OG1 GLN 207.A OE1 no hydrogen 2.426 N/A SER 336.A OG ASN 334.A OD1 no hydrogen 3.071 N/A SER 341.A OG ASN 340.A O no hydrogen 2.737 N/A TRP 343.A N ILE 307.A O no hydrogen 3.051 N/A SER 345.A OG ASN 303.A O no hydrogen 2.681 N/A ILE 350.A N VAL 281.A O no hydrogen 2.988 N/A LEU 352.A N CYS 279.A O no hydrogen 3.132 N/A CYS 354.A N ALA 277.A O no hydrogen 3.236 N/A CYS 354.A SG LEU 352.A O no hydrogen 3.308 N/A ARG 355.A N TYR 332.A O no hydrogen 2.500 N/A ILE 360.A N MET 370.A O no hydrogen 2.839 N/A ARG 365.A NH1 ASP 75.A OD2 no hydrogen 3.005 N/A ARG 365.A NH2 ASP 75.A OD1 no hydrogen 3.056 N/A CYS 369.A SG SER 148.A O no hydrogen 3.652 N/A CYS 369.A SG ALA 149.A O no hydrogen 3.325 N/A CYS 369.A SG GLN 368.A O no hydrogen 3.354 N/A ALA 372.A N GLN 358.A O no hydrogen 3.465 N/A GLY 377.A N ASN 251.A O no hydrogen 3.158 N/A SER 383.A N ILE 243.A O no hydrogen 3.333 N/A ILE 385.A N VAL 241.A O no hydrogen 2.714 N/A THR 386.A N LEU 209.A O no hydrogen 2.976 N/A THR 386.A OG1 LEU 209.A O no hydrogen 3.459 N/A LEU 388.A N VAL 235.A O no hydrogen 2.821 N/A ILE 389.A N GLN 207.A O no hydrogen 3.269 N/A LEU 390.A N ILE 233.A O no hydrogen 2.983 N/A THR 391.A N ARG 405.A O no hydrogen 2.457 N/A ARG 392.A NH2 ILE 226.A O no hydrogen 3.356 N/A ASP 393.A N THR 403.A O no hydrogen 3.398 N/A SER 396.A OG THR 400.A O no hydrogen 3.272 N/A SER 399.A OG ASN 398.A O no hydrogen 2.659 N/A THR 401.A N THR 305.A OG1 no hydrogen 3.315 N/A THR 401.A OG1 THR 400.A O no hydrogen 2.651 N/A THR 403.A OG1 ARG 308.A O no hydrogen 2.844 N/A PHE 404.A N ARG 308.A O no hydrogen 2.795 N/A ARG 405.A N THR 391.A O no hydrogen 3.086 N/A ARG 405.A NE ASP 393.A OD2 no hydrogen 3.479 N/A ARG 405.A NH1 ASN 311.A O no hydrogen 3.223 N/A ARG 412.A NE HIS 67.A ND1 no hydrogen 3.028 N/A TRP 415.A N ARG 412.A O no hydrogen 3.418 N/A ARG 416.A NH1 ASP 413.A OD1 no hydrogen 3.127 N/A GLU 418.A N TRP 415.A O no hydrogen 3.136 N/A LEU 419.A N TRP 415.A O no hydrogen 2.988 N/A TYR 422.A OH HIS 198.A ND1 no hydrogen 2.800 N/A LYS 423.A N LEU 175.A O no hydrogen 3.172 N/A LYS 423.A NZ ASP 16.A OD2 no hydrogen 3.340 N/A LYS 423.A NZ GLU 54.A O no hydrogen 3.264 N/A VAL 425.A N ALA 173.A O no hydrogen 2.998 N/A LYS 426.A N LYS 15.A O no hydrogen 3.104 N/A ILE 427.A N GLY 171.A O no hydrogen 3.172 N/A THR 435.A N TRP 4.A O no hydrogen 3.134 N/A ARG 436.A N THR 435.A OG1 no hydrogen 2.733 N/A CYS 437.A SG ARG 436.A O no hydrogen 3.257 N/A