Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6kre_G.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A NE2 VAL 453.A O no hydrogen 3.681 N/A ILE 5.A N ARG 1.A O no hydrogen 3.451 N/A SER 6.A N GLN 2.A O no hydrogen 3.116 N/A ASN 7.A N ALA 3.A O no hydrogen 2.980 N/A ILE 8.A N GLN 4.A O no hydrogen 3.166 N/A THR 9.A N ILE 5.A O no hydrogen 2.908 N/A THR 9.A OG1 ILE 5.A O no hydrogen 3.021 N/A THR 9.A OG1 SER 6.A O no hydrogen 3.279 N/A ALA 10.A N SER 6.A O no hydrogen 3.169 N/A LYS 12.A N ILE 8.A O no hydrogen 2.939 N/A ALA 13.A N THR 9.A O no hydrogen 3.144 N/A ALA 15.A N ALA 11.A O no hydrogen 3.187 N/A ASP 16.A N LYS 12.A O no hydrogen 3.080 N/A ARG 19.A NE ASP 16.A OD1 no hydrogen 2.763 N/A ARG 19.A NH2 ASP 16.A OD1 no hydrogen 2.697 N/A ARG 19.A NH2 GLU 85.A OE1 no hydrogen 3.013 N/A CYS 21.A N ILE 18.A O no hydrogen 2.960 N/A CYS 21.A SG ASN 42.A O no hydrogen 3.507 N/A LYS 25.A NZ ASP 417.A OD1 no hydrogen 3.116 N/A ALA 26.A N GLY 23.A O no hydrogen 3.191 N/A LYS 29.A NZ VAL 17.A O no hydrogen 3.200 N/A ASN 42.A ND2 ALA 26.A O no hydrogen 3.545 N/A HIS 45.A N ASP 43.A OD1 no hydrogen 3.168 N/A ILE 47.A N ASP 43.A O no hydrogen 3.186 N/A LEU 48.A N GLY 44.A O no hydrogen 3.029 N/A ARG 49.A NE HIS 45.A O no hydrogen 2.704 N/A GLU 50.A N ILE 47.A O no hydrogen 3.099 N/A ALA 57.A N HIS 55.A ND1 no hydrogen 2.993 N/A ALA 58.A N HIS 55.A O no hydrogen 3.200 N/A SER 60.A N PRO 56.A O no hydrogen 3.098 N/A SER 60.A OG PRO 56.A O no hydrogen 3.522 N/A MET 61.A N ALA 57.A O no hydrogen 3.238 N/A LEU 62.A N ALA 58.A O no hydrogen 3.175 N/A GLU 63.A N LYS 59.A O no hydrogen 3.119 N/A LEU 64.A N SER 60.A O no hydrogen 3.175 N/A SER 65.A N MET 61.A O no hydrogen 3.201 N/A SER 65.A OG LEU 62.A O no hydrogen 2.610 N/A ARG 66.A N LEU 62.A O no hydrogen 3.248 N/A THR 67.A N GLU 63.A O no hydrogen 3.228 N/A THR 67.A OG1 GLU 63.A O no hydrogen 3.292 N/A GLN 68.A N LEU 64.A O no hydrogen 2.924 N/A GLN 68.A NE2 GLN 68.A O no hydrogen 3.427 N/A ASP 69.A N SER 65.A O no hydrogen 3.002 N/A GLU 70.A N THR 67.A O no hydrogen 3.284 N/A GLU 71.A N THR 67.A O no hydrogen 3.390 N/A VAL 72.A N GLN 68.A O no hydrogen 3.356 N/A ILE 81.A N THR 77.A O no hydrogen 3.026 N/A LEU 82.A N THR 78.A O no hydrogen 3.002 N/A ALA 83.A N VAL 79.A O no hydrogen 3.007 N/A GLY 84.A N ILE 80.A O no hydrogen 2.976 N/A GLU 85.A N ILE 81.A O no hydrogen 2.992 N/A ILE 86.A N LEU 82.A O no hydrogen 3.403 N/A ALA 88.A N GLY 84.A O no hydrogen 3.352 N/A GLN 89.A N GLU 85.A O no hydrogen 2.896 N/A GLN 89.A NE2 GLU 85.A OE2 no hydrogen 2.651 N/A CYS 90.A N ILE 86.A O no hydrogen 2.998 N/A CYS 90.A SG ILE 86.A O no hydrogen 3.254 N/A ALA 91.A N ALA 88.A O no hydrogen 3.377 N/A LEU 94.A N CYS 90.A O no hydrogen 2.928 N/A ILE 95.A N ALA 91.A O no hydrogen 3.029 N/A LYS 97.A N PRO 92.A O no hydrogen 2.828 N/A ASN 98.A N ILE 95.A O no hydrogen 3.357 N/A ILE 99.A N TYR 93.A O no hydrogen 3.235 N/A VAL 102.A N HIS 100.A ND1 no hydrogen 3.065 N/A ILE 104.A N HIS 100.A O no hydrogen 3.472 N/A ILE 105.A N PRO 101.A O no hydrogen 2.808 N/A GLN 106.A N VAL 102.A O no hydrogen 2.559 N/A GLN 106.A NE2 GLN 106.A O no hydrogen 3.362 N/A ALA 107.A N ILE 103.A O no hydrogen 3.038 N/A LEU 108.A N ILE 104.A O no hydrogen 2.975 N/A LYS 109.A N ILE 105.A O no hydrogen 3.176 N/A LYS 110.A N GLN 106.A O no hydrogen 3.361 N/A ALA 111.A N ALA 107.A O no hydrogen 2.873 N/A LEU 112.A N LEU 108.A O no hydrogen 2.951 N/A ASP 114.A N LYS 110.A O no hydrogen 3.337 N/A ALA 115.A N ALA 111.A O no hydrogen 2.976 N/A LEU 116.A N LEU 112.A O no hydrogen 3.360 N/A GLU 117.A N THR 113.A O no hydrogen 3.278 N/A VAL 118.A N ASP 114.A O no hydrogen 3.395 N/A LYS 120.A N LEU 116.A O no hydrogen 3.329 N/A GLN 121.A N VAL 118.A O no hydrogen 3.161 N/A VAL 122.A N VAL 118.A O no hydrogen 3.056 N/A SER 123.A N ILE 119.A O no hydrogen 2.936 N/A SER 123.A OG ILE 119.A O no hydrogen 2.828 N/A SER 123.A OG SER 343.A OG no hydrogen 2.800 N/A LYS 124.A N LEU 342.A O no hydrogen 3.074 N/A VAL 126.A N PRO 340.A O no hydrogen 3.369 N/A GLU 129.A N ASP 127.A OD1 no hydrogen 3.017 N/A ALA 132.A N ASN 130.A OD1 no hydrogen 2.814 N/A ALA 133.A N ASN 130.A OD1 no hydrogen 3.357 N/A MET 134.A N ASN 130.A O no hydrogen 3.268 N/A LYS 135.A N ASP 131.A O no hydrogen 3.418 N/A LEU 137.A N ALA 133.A O no hydrogen 3.255 N/A ILE 138.A N MET 134.A O no hydrogen 3.128 N/A GLN 139.A N LYS 135.A O no hydrogen 3.171 N/A GLN 139.A N LYS 136.A O no hydrogen 3.252 N/A SER 141.A N ILE 138.A O no hydrogen 2.862 N/A SER 141.A OG ILE 138.A O no hydrogen 2.824 N/A ILE 142.A N GLN 139.A O no hydrogen 3.045 N/A GLY 143.A N GLN 139.A O no hydrogen 3.185 N/A THR 144.A OG1 GLY 143.A O no hydrogen 2.328 N/A LYS 145.A NZ SER 141.A O no hydrogen 2.763 N/A ILE 148.A N LYS 145.A O no hydrogen 3.014 N/A SER 151.A N ILE 148.A O no hydrogen 3.362 N/A SER 151.A OG ILE 148.A O no hydrogen 2.874 N/A MET 154.A N TRP 150.A O no hydrogen 2.504 N/A CYS 155.A N SER 151.A O no hydrogen 2.995 N/A CYS 155.A SG LYS 135.A O no hydrogen 3.404 N/A CYS 155.A SG SER 151.A O no hydrogen 3.170 N/A LEU 157.A N LYS 153.A O no hydrogen 3.007 N/A ALA 158.A N MET 154.A O no hydrogen 2.846 N/A LEU 159.A N CYS 155.A O no hydrogen 3.182 N/A ASP 160.A N GLU 156.A O no hydrogen 3.311 N/A ALA 161.A N LEU 157.A O no hydrogen 3.062 N/A VAL 162.A N ALA 158.A O no hydrogen 3.252 N/A LYS 163.A N LEU 159.A O no hydrogen 3.012 N/A THR 164.A OG1 ASP 160.A O no hydrogen 2.403 N/A ARG 166.A N VAL 162.A O no hydrogen 3.281 N/A ARG 166.A NH1 ASP 168.A OD1 no hydrogen 3.499 N/A LYS 184.A N ASP 182.A OD1 no hydrogen 3.218 N/A ARG 185.A NE ASP 182.A OD2 no hydrogen 2.974 N/A ARG 185.A NH2 ASP 182.A OD2 no hydrogen 3.213 N/A VAL 187.A N ILE 183.A O no hydrogen 3.297 N/A ARG 188.A NH2 ASP 269.A OD1 no hydrogen 2.738 N/A GLU 190.A N ILE 309.A O no hydrogen 3.365 N/A ILE 192.A N LEU 311.A O no hydrogen 3.158 N/A LEU 198.A N ASP 196.A OD1 no hydrogen 3.311 N/A SER 200.A N VAL 197.A O no hydrogen 3.233 N/A SER 200.A OG ASP 196.A O no hydrogen 2.706 N/A SER 200.A OG VAL 197.A O no hydrogen 3.482 N/A SER 200.A OG ARG 312.A O no hydrogen 2.997 N/A ARG 201.A NH1 LEU 198.A O no hydrogen 2.430 N/A ARG 201.A NH1 SER 200.A O no hydrogen 3.194 N/A LYS 216.A N HIS 214.A ND1 no hydrogen 2.971 N/A SER 218.A OG HIS 220.A O no hydrogen 2.914 N/A ARG 225.A N THR 238.A OG1 no hydrogen 2.411 N/A ARG 225.A NH2 ARG 236.A O no hydrogen 2.357 N/A CYS 231.A SG PRO 232.A O no hydrogen 3.580 N/A THR 238.A OG1 ASN 223.A O no hydrogen 3.473 N/A VAL 240.A N SER 260.A O no hydrogen 2.628 N/A THR 242.A N LEU 262.A O no hydrogen 2.683 N/A SER 247.A N LEU 233.A O no hydrogen 3.257 N/A SER 247.A OG LEU 233.A O no hydrogen 3.360 N/A GLN 251.A N ASP 248.A O no hydrogen 3.407 N/A LEU 254.A N ALA 250.A O no hydrogen 3.282 N/A GLY 258.A N LEU 255.A O no hydrogen 3.492 N/A CYS 259.A SG LEU 254.A O no hydrogen 3.201 N/A LEU 262.A N VAL 240.A O no hydrogen 2.822 N/A ARG 263.A NH1 VAL 246.A O no hydrogen 3.028 N/A ARG 264.A N LYS 244.A O no hydrogen 3.200 N/A VAL 265.A N GLU 243.A O no hydrogen 2.894 N/A ASN 270.A N LYS 267.A O no hydrogen 3.193 N/A ARG 272.A NE ARG 185.A O no hydrogen 2.868 N/A ARG 272.A NH2 ARG 185.A O no hydrogen 2.519 N/A ILE 273.A N ASP 269.A O no hydrogen 3.124 N/A ARG 275.A N ARG 272.A O no hydrogen 3.188 N/A THR 277.A N ILE 273.A O no hydrogen 2.836 N/A THR 277.A OG1 ILE 273.A O no hydrogen 2.370 N/A CYS 282.A SG LEU 298.A O no hydrogen 3.838 N/A CYS 282.A SG ASP 299.A O no hydrogen 3.309 N/A GLY 283.A N ASP 299.A O no hydrogen 2.984 N/A ILE 290.A N GLU 293.A O no hydrogen 3.284 N/A ASN 300.A ND2 VAL 276.A O no hydrogen 3.045 N/A LYS 302.A N ASN 300.A OD1 no hydrogen 2.925 N/A LYS 305.A NZ PHE 179.A O no hydrogen 3.499 N/A CYS 307.A SG TYR 186.A O no hydrogen 3.889 N/A ARG 312.A N SER 200.A OG no hydrogen 2.949 N/A GLY 313.A N GLY 194.A O no hydrogen 3.130 N/A LEU 319.A N SER 315.A O no hydrogen 3.383 N/A ASN 320.A N LYS 316.A O no hydrogen 3.091 N/A GLU 321.A N ASP 317.A O no hydrogen 3.412 N/A ILE 322.A N ILE 318.A O no hydrogen 3.071 N/A ASP 323.A N LEU 319.A O no hydrogen 2.946 N/A ASN 325.A N GLU 321.A O no hydrogen 3.306 N/A LEU 326.A N ILE 322.A O no hydrogen 2.679 N/A LEU 326.A N ASP 323.A O no hydrogen 3.246 N/A GLN 327.A N ASP 323.A O no hydrogen 3.207 N/A ASP 328.A N ARG 324.A O no hydrogen 3.340 N/A ALA 329.A N ASN 325.A O no hydrogen 3.059 N/A MET 330.A N LEU 326.A O no hydrogen 2.895 N/A ALA 331.A N GLN 327.A O no hydrogen 3.183 N/A ALA 333.A N ALA 329.A O no hydrogen 3.360 N/A ARG 334.A N MET 330.A O no hydrogen 2.717 N/A ARG 334.A NE ILE 181.A O no hydrogen 3.432 N/A ARG 334.A NH2 ILE 181.A O no hydrogen 3.057 N/A ASN 335.A N ALA 331.A O no hydrogen 3.433 N/A VAL 336.A N ALA 333.A O no hydrogen 3.249 N/A MET 337.A N ALA 333.A O no hydrogen 3.401 N/A MET 337.A N ARG 334.A O no hydrogen 3.203 N/A LEU 338.A N ARG 334.A O no hydrogen 3.213 N/A SER 341.A N SER 339.A O no hydrogen 2.846 N/A SER 341.A OG GLU 433.A OE1 no hydrogen 2.294 N/A LEU 342.A N LYS 124.A O no hydrogen 3.069 N/A SER 343.A N GLU 431.A O no hydrogen 2.617 N/A SER 343.A OG SER 123.A OG no hydrogen 2.800 N/A ALA 348.A N GLY 345.A O no hydrogen 3.269 N/A THR 349.A OG1 PRO 344.A O no hydrogen 2.676 N/A MET 351.A N GLY 347.A O no hydrogen 3.090 N/A ALA 352.A N ALA 348.A O no hydrogen 2.930 N/A VAL 353.A N THR 349.A O no hydrogen 3.408 N/A SER 354.A OG MET 351.A O no hydrogen 2.869 N/A VAL 355.A N MET 351.A O no hydrogen 3.223 N/A LEU 357.A N VAL 353.A O no hydrogen 2.932 N/A ALA 358.A N SER 354.A O no hydrogen 3.378 N/A LYS 360.A N LYS 356.A O no hydrogen 3.201 N/A LYS 360.A NZ ASP 114.A OD1 no hydrogen 2.768 N/A ALA 361.A N LEU 357.A O no hydrogen 3.015 N/A GLN 363.A N LYS 360.A O no hydrogen 3.314 N/A LEU 364.A N ALA 361.A O no hydrogen 3.464 N/A GLN 369.A N GLY 366.A O no hydrogen 3.216 N/A GLN 373.A N TRP 370.A O no hydrogen 3.153 N/A VAL 375.A N PRO 371.A O no hydrogen 3.123 N/A ALA 376.A N TYR 372.A O no hydrogen 2.959 N/A ASP 377.A N GLN 373.A O no hydrogen 3.034 N/A ALA 378.A N ALA 374.A O no hydrogen 3.042 N/A MET 379.A N VAL 375.A O no hydrogen 2.911 N/A CYS 381.A N ALA 378.A O no hydrogen 3.328 N/A CYS 381.A SG GLU 85.A OE2 no hydrogen 3.235 N/A CYS 381.A SG ASP 377.A O no hydrogen 3.201 N/A ARG 384.A N GLU 380.A O no hydrogen 3.231 N/A THR 385.A N CYS 381.A O no hydrogen 2.780 N/A THR 385.A OG1 CYS 381.A O no hydrogen 2.588 N/A ILE 387.A N PRO 383.A O no hydrogen 3.189 N/A GLN 388.A N ARG 384.A O no hydrogen 3.057 N/A ASN 389.A N THR 385.A O no hydrogen 3.198 N/A ALA 390.A N ILE 387.A O no hydrogen 3.039 N/A ILE 395.A N ASP 393.A OD1 no hydrogen 3.105 N/A LEU 397.A N ASP 393.A O no hydrogen 3.025 N/A SER 399.A N ILE 395.A O no hydrogen 3.498 N/A GLN 400.A N ARG 396.A O no hydrogen 3.153 N/A LEU 401.A N LEU 397.A O no hydrogen 3.239 N/A ARG 402.A N LEU 398.A O no hydrogen 3.094 N/A ALA 403.A N SER 399.A O no hydrogen 3.229 N/A LYS 404.A N LEU 401.A O no hydrogen 3.249 N/A HIS 405.A ND1 LEU 401.A O no hydrogen 2.600 N/A GLN 407.A N LYS 404.A O no hydrogen 3.303 N/A GLY 408.A N LYS 404.A O no hydrogen 2.610 N/A THR 411.A N ASN 409.A OD1 no hydrogen 3.284 N/A THR 411.A OG1 ASP 423.A OD1 no hydrogen 3.293 N/A THR 412.A OG1 ASN 409.A OD1 no hydrogen 2.972 N/A ILE 414.A N GLY 346.A O no hydrogen 3.034 N/A ASP 417.A N ASP 415.A OD1 no hydrogen 3.028 N/A LYS 418.A N ASP 415.A OD2 no hydrogen 3.355 N/A VAL 422.A N GLY 413.A O no hydrogen 3.404 N/A MET 424.A N THR 411.A O no hydrogen 3.291 N/A SER 426.A N ASP 423.A OD2 no hydrogen 2.755 N/A SER 426.A OG ASP 423.A OD2 no hydrogen 3.146 N/A GLY 428.A N VAL 425.A O no hydrogen 3.400 N/A ILE 429.A N MET 424.A O no hydrogen 2.854 N/A GLU 431.A N SER 343.A O no hydrogen 2.862 N/A LYS 436.A NZ GLU 431.A OE1 no hydrogen 3.252 N/A GLN 437.A N GLU 433.A O no hydrogen 2.786 N/A GLN 438.A N VAL 434.A O no hydrogen 2.839 N/A SER 439.A N ILE 435.A O no hydrogen 2.885 N/A VAL 440.A N LYS 436.A O no hydrogen 3.296 N/A LYS 441.A N GLN 437.A O no hydrogen 3.243 N/A THR 442.A N GLN 438.A O no hydrogen 3.401 N/A THR 442.A OG1 GLN 68.A OE1 no hydrogen 3.423 N/A THR 442.A OG1 GLN 438.A O no hydrogen 2.389 N/A ILE 444.A N VAL 440.A O no hydrogen 3.211 N/A GLU 445.A N LYS 441.A O no hydrogen 3.050 N/A SER 446.A N THR 442.A O no hydrogen 3.022 N/A ALA 447.A N ALA 443.A O no hydrogen 2.963 N/A CYS 448.A N ILE 444.A O no hydrogen 3.073 N/A CYS 448.A SG ILE 444.A O no hydrogen 3.225 N/A LEU 449.A N GLU 445.A O no hydrogen 3.415 N/A LEU 450.A N SER 446.A O no hydrogen 3.352 N/A LEU 451.A N CYS 448.A O no hydrogen 3.203 N/A ARG 452.A N LEU 449.A O no hydrogen 3.409 N/A