Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5zr1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 13.A NH2 TYR 18.A OH no hydrogen 2.580 N/A LYS 16.A N ALA 14.A O no hydrogen 2.920 N/A LYS 17.A N ARG 169.A O no hydrogen 2.966 N/A PHE 21.A N SER 178.A OG no hydrogen 2.956 N/A ARG 24.A NH2 THR 19.A O no hydrogen 3.096 N/A ALA 29.A N SER 27.A OG no hydrogen 3.108 N/A ALA 30.A N SER 27.A O no hydrogen 3.236 N/A ILE 31.A N ILE 28.A O no hydrogen 3.262 N/A LEU 34.A N LYS 190.A O no hydrogen 3.048 N/A THR 35.A OG1 ASP 33.A OD2 no hydrogen 2.714 N/A SER 36.A N ASP 33.A OD2 no hydrogen 3.337 N/A SER 36.A OG ASP 33.A O no hydrogen 3.463 N/A SER 36.A OG ASP 33.A OD2 no hydrogen 3.062 N/A GLU 39.A N GLU 39.A OE1 no hydrogen 2.864 N/A TYR 41.A N VAL 165.A O no hydrogen 2.728 N/A TYR 41.A OH TYR 182.A OH no hydrogen 2.313 N/A ASN 43.A ND2 LEU 37.A O no hydrogen 3.588 N/A ASN 43.A ND2 PRO 38.A O no hydrogen 3.607 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.709 N/A SER 50.A OG LEU 47.A O no hydrogen 3.199 N/A ARG 51.A N MET 48.A O no hydrogen 3.194 N/A GLU 66.A N ASN 289.A OD1 no hydrogen 3.365 N/A ILE 68.A N THR 67.A OG1 no hydrogen 2.566 N/A SER 70.A OG GLU 336.A OE2 no hydrogen 3.317 N/A LYS 71.A NZ ALA 290.A O no hydrogen 3.298 N/A LYS 73.A N PHE 69.A O no hydrogen 3.264 N/A LYS 74.A N SER 70.A O no hydrogen 3.191 N/A GLN 75.A N VAL 72.A O no hydrogen 3.188 N/A LEU 76.A N VAL 72.A O no hydrogen 3.158 N/A TYR 80.A N ASN 77.A O no hydrogen 3.331 N/A ARG 85.A NH2 ALA 84.A O no hydrogen 3.382 N/A GLU 88.A N GLU 88.A OE1 no hydrogen 2.817 N/A ALA 90.A N GLU 86.A O no hydrogen 3.012 N/A SER 91.A OG ASN 87.A O no hydrogen 2.774 N/A ILE 92.A N GLU 88.A O no hydrogen 3.261 N/A TYR 93.A N PHE 89.A O no hydrogen 2.890 N/A SER 95.A N SER 91.A O no hydrogen 3.268 N/A SER 95.A OG SER 91.A O no hydrogen 2.987 N/A ALA 96.A N ILE 92.A O no hydrogen 3.115 N/A TYR 97.A N TYR 93.A O no hydrogen 2.900 N/A SER 98.A N LEU 94.A O no hydrogen 3.368 N/A SER 98.A OG LEU 94.A O no hydrogen 3.445 N/A SER 98.A OG SER 95.A O no hydrogen 3.194 N/A ILE 100.A N ALA 96.A O no hydrogen 3.276 N/A GLU 101.A N TYR 97.A O no hydrogen 3.201 N/A SER 102.A N SER 98.A O no hydrogen 3.155 N/A ASP 103.A N ILE 100.A O no hydrogen 3.471 N/A SER 104.A N ALA 99.A O no hydrogen 2.776 N/A SER 104.A OG ALA 105.A O no hydrogen 3.467 N/A THR 106.A N LEU 226.A O no hydrogen 3.156 N/A THR 106.A OG1 THR 107.A O no hydrogen 3.538 N/A THR 107.A OG1 THR 219.A OG1 no hydrogen 2.831 N/A ILE 108.A N VAL 228.A O no hydrogen 2.814 N/A TYR 109.A N THR 253.A O no hydrogen 3.075 N/A TYR 109.A OH THR 234.A O no hydrogen 2.561 N/A VAL 110.A N ALA 230.A O no hydrogen 3.053 N/A ALA 111.A N ILE 255.A O no hydrogen 3.017 N/A GLY 112.A N ASN 233.A O no hydrogen 2.921 N/A LYS 118.A NZ GLY 112.A O no hydrogen 3.388 N/A LYS 118.A NZ THR 113.A O no hydrogen 3.235 N/A THR 121.A N GLY 117.A O no hydrogen 3.102 N/A VAL 122.A N LYS 118.A O no hydrogen 3.235 N/A ARG 123.A N THR 119.A O no hydrogen 3.497 N/A ARG 123.A NE GLU 145.A OE2 no hydrogen 3.342 N/A GLU 124.A N LEU 120.A O no hydrogen 3.050 N/A VAL 125.A N THR 121.A O no hydrogen 2.893 N/A VAL 126.A N VAL 122.A O no hydrogen 3.028 N/A LYS 127.A N ARG 123.A O no hydrogen 3.161 N/A GLU 128.A N GLU 124.A O no hydrogen 3.229 N/A LEU 129.A N VAL 125.A O no hydrogen 3.069 N/A LEU 130.A N VAL 126.A O no hydrogen 2.957 N/A SER 131.A N LYS 127.A O no hydrogen 3.249 N/A SER 132.A N GLU 128.A O no hydrogen 2.975 N/A SER 133.A N LEU 129.A O no hydrogen 3.235 N/A SER 133.A OG ILE 138.A O no hydrogen 3.381 N/A SER 133.A OG PRO 139.A O no hydrogen 2.909 N/A SER 133.A OG ASP 140.A OD1 no hydrogen 3.453 N/A ALA 134.A N LEU 130.A O no hydrogen 2.812 N/A ARG 136.A N SER 133.A O no hydrogen 3.063 N/A GLU 137.A N SER 132.A O no hydrogen 3.288 N/A LEU 142.A N THR 193.A O no hydrogen 3.062 N/A TYR 143.A OH GLU 145.A OE2 no hydrogen 2.403 N/A VAL 144.A N VAL 195.A O no hydrogen 3.159 N/A ILE 146.A N LEU 197.A O no hydrogen 2.814 N/A GLY 148.A N ASP 199.A O no hydrogen 2.858 N/A LEU 149.A N ASN 147.A OD1 no hydrogen 3.499 N/A LYS 150.A N ASN 147.A O no hydrogen 3.310 N/A LYS 153.A N ASP 156.A OD2 no hydrogen 2.990 N/A ASP 156.A N LYS 153.A O no hydrogen 3.449 N/A CYS 157.A SG PRO 154.A O no hydrogen 4.048 N/A THR 160.A N ASP 156.A O no hydrogen 3.028 N/A THR 160.A OG1 ASP 156.A O no hydrogen 2.955 N/A THR 160.A OG1 CYS 157.A O no hydrogen 3.252 N/A LEU 161.A N CYS 157.A O no hydrogen 2.966 N/A TRP 162.A N TYR 158.A O no hydrogen 3.209 N/A ASN 163.A N GLU 159.A O no hydrogen 2.992 N/A LYS 164.A N THR 160.A O no hydrogen 3.155 N/A VAL 165.A N LEU 161.A O no hydrogen 2.922 N/A SER 166.A N TRP 162.A O no hydrogen 2.963 N/A SER 166.A OG TRP 162.A O no hydrogen 2.600 N/A GLY 167.A N ASN 163.A O no hydrogen 2.830 N/A GLU 168.A N SER 166.A OG no hydrogen 3.293 N/A THR 171.A N LYS 17.A O no hydrogen 3.226 N/A SER 175.A N TRP 172.A O no hydrogen 3.155 N/A SER 175.A OG LEU 170.A O no hydrogen 3.549 N/A SER 175.A OG THR 171.A O no hydrogen 2.636 N/A MET 176.A N TRP 172.A O no hydrogen 3.105 N/A SER 178.A N ALA 174.A O no hydrogen 3.214 N/A SER 178.A OG ALA 174.A O no hydrogen 2.488 N/A LEU 179.A N SER 175.A O no hydrogen 2.879 N/A GLU 180.A N MET 176.A O no hydrogen 2.975 N/A PHE 181.A N GLU 177.A O no hydrogen 3.138 N/A TYR 182.A N SER 178.A O no hydrogen 3.054 N/A TYR 182.A OH TYR 41.A OH no hydrogen 2.313 N/A PHE 183.A N LEU 179.A O no hydrogen 2.943 N/A LYS 184.A N GLU 180.A O no hydrogen 3.369 N/A ARG 185.A N PHE 181.A O no hydrogen 3.366 N/A LYS 188.A NZ ASP 103.A O no hydrogen 3.286 N/A LYS 190.A N PRO 187.A O no hydrogen 3.261 N/A LYS 191.A NZ TYR 182.A O no hydrogen 3.082 N/A LYS 191.A NZ ASN 223.A O no hydrogen 2.765 N/A LYS 192.A N TYR 41.A OH no hydrogen 3.119 N/A THR 193.A OG1 ASP 140.A O no hydrogen 3.106 N/A ILE 194.A N LYS 225.A O no hydrogen 2.961 N/A VAL 195.A N LEU 142.A O no hydrogen 2.873 N/A VAL 196.A N ILE 227.A O no hydrogen 2.992 N/A LEU 197.A N VAL 144.A O no hydrogen 2.838 N/A LEU 198.A N ILE 229.A O no hydrogen 2.993 N/A ASP 199.A N ILE 146.A O no hydrogen 2.544 N/A LEU 201.A N VAL 231.A O no hydrogen 3.377 N/A ALA 203.A N GLU 200.A O no hydrogen 3.297 N/A VAL 205.A N ASP 202.A O no hydrogen 3.448 N/A SER 208.A OG ASP 210.A OD2 no hydrogen 2.364 N/A ASN 214.A ND2 TYR 158.A OH no hydrogen 2.503 N/A ASN 217.A N TYR 213.A O no hydrogen 2.837 N/A TRP 218.A N ASN 214.A O no hydrogen 3.004 N/A THR 219.A N PHE 216.A O no hydrogen 3.326 N/A THR 219.A OG1 THR 107.A OG1 no hydrogen 2.831 N/A THR 219.A OG1 PHE 216.A O no hydrogen 2.507 N/A THR 220.A N ASN 217.A O no hydrogen 3.244 N/A THR 220.A OG1 ASN 217.A O no hydrogen 2.650 N/A THR 220.A OG1 ASN 217.A OD1 no hydrogen 3.127 N/A ASN 223.A ND2 LYS 184.A O no hydrogen 2.961 N/A LYS 225.A NZ LYS 188.A O no hydrogen 2.922 N/A LYS 225.A NZ LYS 191.A O no hydrogen 3.254 N/A ILE 227.A N ILE 194.A O no hydrogen 2.870 N/A VAL 228.A N THR 106.A O no hydrogen 3.281 N/A ILE 229.A N VAL 196.A O no hydrogen 3.040 N/A ALA 230.A N ILE 108.A O no hydrogen 2.802 N/A VAL 231.A N LEU 198.A O no hydrogen 3.265 N/A ALA 232.A N VAL 110.A O no hydrogen 3.024 N/A ASN 233.A ND2 GLY 112.A O no hydrogen 3.387 N/A THR 234.A OG1 ASP 236.A OD1 no hydrogen 2.618 N/A ARG 240.A N ASP 236.A O no hydrogen 2.965 N/A ARG 240.A NE ASP 236.A O no hydrogen 3.385 N/A GLN 241.A N LEU 237.A O no hydrogen 3.422 N/A LEU 242.A N PRO 238.A O no hydrogen 3.024 N/A THR 247.A OG1 GLY 243.A O no hydrogen 2.768 N/A THR 247.A OG1 ASN 244.A O no hydrogen 3.438 N/A SER 248.A OG ASN 244.A O no hydrogen 3.275 N/A SER 248.A OG LYS 245.A O no hydrogen 3.036 N/A ARG 249.A N ILE 246.A O no hydrogen 3.018 N/A ARG 249.A NH1 ASN 217.A OD1 no hydrogen 2.850 N/A ARG 249.A NH2 ASN 217.A OD1 no hydrogen 3.439 N/A ILE 250.A N ILE 246.A O no hydrogen 3.209 N/A THR 253.A N THR 107.A O no hydrogen 3.304 N/A ILE 255.A N TYR 109.A O no hydrogen 2.711 N/A PHE 257.A N ALA 111.A O no hydrogen 2.824 N/A TYR 260.A N GLY 319.A O no hydrogen 3.025 N/A THR 261.A N GLU 264.A OE1 no hydrogen 3.262 N/A GLU 264.A N THR 261.A O no hydrogen 3.126 N/A LEU 265.A N THR 261.A O no hydrogen 3.073 N/A LYS 266.A N HIS 262.A O no hydrogen 3.301 N/A ILE 268.A N LEU 265.A O no hydrogen 3.268 N/A ILE 269.A N LEU 265.A O no hydrogen 3.047 N/A ASP 270.A N LYS 266.A O no hydrogen 3.076 N/A ARG 272.A N ILE 268.A O no hydrogen 3.283 N/A LEU 276.A N LEU 273.A O no hydrogen 3.359 N/A ASN 277.A N LEU 273.A O no hydrogen 2.883 N/A ASP 278.A N LEU 300.A O no hydrogen 2.832 N/A PHE 281.A N VAL 298.A O no hydrogen 2.897 N/A TYR 282.A N ILE 291.A O no hydrogen 2.652 N/A VAL 283.A N ARG 296.A O no hydrogen 3.284 N/A THR 285.A N ASP 294.A O no hydrogen 2.951 N/A THR 285.A OG1 ASP 294.A O no hydrogen 3.323 N/A THR 287.A OG1 ASP 284.A OD1 no hydrogen 3.012 N/A THR 287.A OG1 ASP 284.A OD2 no hydrogen 2.643 N/A GLY 288.A N ASP 284.A O no hydrogen 3.351 N/A ALA 290.A N GLU 66.A O no hydrogen 2.768 N/A ILE 291.A N TYR 282.A O no hydrogen 3.009 N/A ARG 296.A N VAL 283.A O no hydrogen 3.010 N/A LEU 300.A N SER 279.A O no hydrogen 3.093 N/A MET 302.A N ASN 277.A OD1 no hydrogen 3.199 N/A SER 303.A OG ASP 305.A OD1 no hydrogen 2.267 N/A ALA 306.A N SER 303.A O no hydrogen 3.250 N/A ILE 307.A N SER 303.A O no hydrogen 3.439 N/A GLU 308.A N ALA 304.A O no hydrogen 3.023 N/A ILE 309.A N ASP 305.A O no hydrogen 3.121 N/A ALA 310.A N ALA 306.A O no hydrogen 3.209 N/A SER 311.A N ILE 307.A O no hydrogen 2.996 N/A SER 311.A N GLU 308.A O no hydrogen 2.978 N/A SER 311.A OG ILE 307.A O no hydrogen 2.821 N/A ARG 312.A N GLU 308.A O no hydrogen 2.771 N/A ARG 312.A NH1 GLU 308.A OE2 no hydrogen 3.493 N/A LYS 313.A N ILE 309.A O no hydrogen 3.351 N/A ALA 315.A N SER 311.A O no hydrogen 3.193 N/A VAL 317.A N VAL 314.A O no hydrogen 3.159 N/A SER 318.A N VAL 314.A O no hydrogen 3.223 N/A SER 318.A OG ASP 320.A OD1 no hydrogen 2.724 N/A GLY 319.A N VAL 314.A O no hydrogen 3.220 N/A ALA 321.A N GLY 115.A O no hydrogen 2.888 N/A LEU 325.A N ALA 321.A O no hydrogen 3.225 N/A LYS 326.A N ARG 322.A O no hydrogen 3.034 N/A CYS 328.A N ALA 324.A O no hydrogen 3.370 N/A CYS 328.A SG ALA 324.A O no hydrogen 3.445 N/A LYS 329.A N LEU 325.A O no hydrogen 3.018 N/A ARG 330.A NH2 GLU 364.A OE1 no hydrogen 3.437 N/A ALA 331.A N VAL 327.A O no hydrogen 3.270 N/A ALA 332.A N CYS 328.A O no hydrogen 3.137 N/A GLU 333.A N LYS 329.A O no hydrogen 3.229 N/A ILE 334.A N ARG 330.A O no hydrogen 3.115 N/A ALA 335.A N ALA 331.A O no hydrogen 3.197 N/A LYS 337.A N GLU 333.A O no hydrogen 3.158 N/A HIS 338.A ND1 ILE 334.A O no hydrogen 2.556 N/A TYR 339.A N ALA 335.A O no hydrogen 3.323 N/A MET 340.A N GLU 336.A O no hydrogen 2.578 N/A ALA 341.A N LYS 337.A O no hydrogen 3.011 N/A LYS 342.A N HIS 338.A O no hydrogen 3.030 N/A GLY 344.A N MET 340.A O no hydrogen 3.108 N/A GLN 351.A N ARG 299.A O no hydrogen 3.174 N/A THR 352.A OG1 ARG 301.A O no hydrogen 2.887 N/A HIS 354.A N HIS 357.A ND1 no hydrogen 3.276 N/A MET 359.A N ILE 355.A O no hydrogen 3.074 N/A LYS 360.A N THR 356.A O no hydrogen 3.195 N/A ALA 361.A N HIS 357.A O no hydrogen 3.058 N/A LEU 362.A N VAL 358.A O no hydrogen 2.930 N/A LEU 362.A N MET 359.A O no hydrogen 3.286 N/A ASN 363.A N MET 359.A O no hydrogen 2.840 N/A THR 365.A OG1 LEU 362.A O no hydrogen 3.275 N/A LEU 366.A N ASN 363.A O no hydrogen 3.261 N/A ASN 367.A N ASN 363.A O no hydrogen 2.884 N/A VAL 370.A N SER 368.A OG no hydrogen 3.418 N/A PHE 373.A N HIS 369.A O no hydrogen 2.805 N/A THR 375.A N ILE 371.A O no hydrogen 3.241 N/A THR 375.A OG1 THR 372.A O no hydrogen 3.296 N/A ARG 376.A N PHE 373.A O no hydrogen 3.442 N/A LYS 382.A N SER 378.A O no hydrogen 3.070 N/A LYS 382.A NZ ASP 488.A OD1 no hydrogen 2.725 N/A LEU 383.A N PHE 379.A O no hydrogen 2.787 N/A PHE 384.A N THR 380.A O no hydrogen 3.061 N/A ILE 385.A N ALA 381.A O no hydrogen 3.363 N/A TYR 386.A N LYS 382.A O no hydrogen 2.992 N/A ALA 387.A N LEU 383.A O no hydrogen 3.094 N/A LEU 388.A N PHE 384.A O no hydrogen 3.114 N/A LEU 389.A N ILE 385.A O no hydrogen 2.837 N/A ASN 390.A N TYR 386.A O no hydrogen 3.366 N/A LEU 391.A N ALA 387.A O no hydrogen 3.358 N/A MET 392.A N LEU 388.A O no hydrogen 3.262 N/A LYS 393.A N ASN 390.A O no hydrogen 3.371 N/A LYS 393.A NZ LEU 389.A O no hydrogen 2.768 N/A LYS 394.A N ASN 390.A O no hydrogen 3.088 N/A LYS 394.A NZ GLU 408.A OE1 no hydrogen 2.723 N/A ASN 395.A N LEU 391.A O no hydrogen 3.279 N/A SER 397.A OG GLU 399.A O no hydrogen 3.567 N/A SER 397.A OG GLN 400.A OE1 no hydrogen 2.355 N/A GLN 400.A N VAL 472.A O no hydrogen 2.953 N/A LEU 402.A N CYS 470.A O no hydrogen 2.601 N/A GLY 403.A N ARG 468.A O no hydrogen 2.679 N/A ASP 404.A N GLU 401.A O no hydrogen 3.051 N/A ILE 405.A N GLU 401.A O no hydrogen 3.274 N/A VAL 406.A N LEU 402.A O no hydrogen 3.299 N/A ASP 407.A N GLY 403.A O no hydrogen 3.311 N/A GLU 408.A N ASP 404.A O no hydrogen 3.220 N/A ILE 409.A N ILE 405.A O no hydrogen 2.992 N/A LYS 410.A N VAL 406.A O no hydrogen 3.118 N/A LYS 410.A NZ GLU 439.A OE2 no hydrogen 3.282 N/A LEU 411.A N ASP 407.A O no hydrogen 2.958 N/A LEU 412.A N GLU 408.A O no hydrogen 2.826 N/A ILE 413.A N ILE 409.A O no hydrogen 3.291 N/A GLU 414.A N LYS 410.A O no hydrogen 2.915 N/A VAL 415.A N LEU 411.A O no hydrogen 3.053 N/A ASN 416.A ND2 LEU 412.A O no hydrogen 3.319 N/A ASN 419.A N ASN 416.A O no hydrogen 3.485 N/A MET 423.A N ASN 419.A O no hydrogen 3.256 N/A ALA 426.A N VAL 422.A O no hydrogen 3.128 N/A LYS 427.A NZ GLY 433.A O no hydrogen 2.510 N/A LYS 427.A NZ ASP 435.A OD1 no hydrogen 3.556 N/A THR 428.A OG1 ILE 425.A O no hydrogen 2.875 N/A GLY 433.A N LYS 427.A O no hydrogen 3.152 N/A SER 434.A N GLN 432.A O no hydrogen 3.154 N/A ILE 444.A N LEU 429.A O no hydrogen 3.056 N/A SER 445.A OG ILE 444.A O no hydrogen 2.507 N/A LEU 450.A N TRP 446.A O no hydrogen 3.159 N/A ASN 451.A N ASP 447.A O no hydrogen 3.437 N/A GLN 452.A N PHE 448.A O no hydrogen 2.826 N/A LEU 453.A N VAL 449.A O no hydrogen 3.198 N/A LEU 454.A N LEU 450.A O no hydrogen 3.238 N/A ASP 455.A N ASN 451.A O no hydrogen 3.046 N/A ALA 456.A N GLN 452.A O no hydrogen 3.264 N/A GLY 457.A N LEU 454.A O no hydrogen 3.438 N/A LEU 459.A N LEU 453.A O no hydrogen 3.131 N/A PHE 460.A N LYS 473.A O no hydrogen 3.232 N/A LYS 461.A NZ GLN 462.A O no hydrogen 3.480 N/A GLN 462.A N CYS 471.A O no hydrogen 3.255 N/A ARG 468.A NH1 ASP 407.A OD1 no hydrogen 3.084 N/A CYS 470.A SG GLN 462.A O no hydrogen 3.218 N/A CYS 470.A SG CYS 471.A O no hydrogen 3.740 N/A VAL 472.A N GLN 400.A O no hydrogen 2.852 N/A LYS 473.A N PHE 460.A O no hydrogen 2.863 N/A ASN 475.A N ILE 458.A O no hydrogen 2.797 N/A ASN 475.A ND2 GLY 457.A O no hydrogen 3.487 N/A SER 477.A OG ILE 476.A O no hydrogen 2.502 N/A SER 477.A OG GLU 480.A OE2 no hydrogen 3.507 N/A LYS 482.A N VAL 478.A O no hydrogen 3.123 N/A ARG 483.A N GLU 479.A O no hydrogen 2.851 N/A MET 485.A N LYS 482.A O no hydrogen 3.312 N/A ASN 486.A N LYS 482.A O no hydrogen 3.041 N/A LEU 491.A N ASP 488.A OD2 no hydrogen 3.157 N/A ARG 492.A NH1 GLU 489.A OE1 no hydrogen 2.415 N/A ARG 492.A NH2 ASN 486.A O no hydrogen 3.201 N/A