Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7mca_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N ASP 1.A OD2 no hydrogen 3.012 N/A PHE 4.A N ASP 1.A OD2 no hydrogen 2.916 N/A SER 6.A OG PRO 2.A O no hydrogen 3.455 N/A GLN 8.A N PHE 4.A O no hydrogen 3.087 N/A GLN 8.A NE2 VAL 273.A O no hydrogen 2.370 N/A GLN 8.A NE2 SER 276.A O no hydrogen 3.141 N/A ARG 9.A N GLY 5.A O no hydrogen 2.911 N/A ARG 10.A N SER 6.A O no hydrogen 2.938 N/A LEU 11.A N LEU 7.A O no hydrogen 2.918 N/A LEU 12.A N GLN 8.A O no hydrogen 2.935 N/A GLN 13.A N ARG 9.A O no hydrogen 2.906 N/A GLN 14.A N ARG 10.A O no hydrogen 2.962 N/A GLN 14.A NE2 THR 221.A O no hydrogen 3.159 N/A LEU 15.A N LEU 11.A O no hydrogen 2.928 N/A TYR 16.A N LEU 12.A O no hydrogen 2.916 N/A GLY 17.A N GLN 13.A O no hydrogen 2.997 N/A THR 18.A N GLN 13.A O no hydrogen 3.190 N/A LYS 24.A NZ GLY 17.A O no hydrogen 3.508 N/A LYS 24.A NZ LEU 19.A O no hydrogen 3.383 N/A LEU 30.A N PHE 27.A O no hydrogen 3.226 N/A GLN 31.A N THR 28.A O no hydrogen 3.400 N/A GLN 35.A N ASP 32.A O no hydrogen 3.106 N/A GLU 36.A N ASP 32.A O no hydrogen 3.238 N/A ILE 37.A N CYS 33.A O no hydrogen 3.324 N/A ASP 38.A N GLN 34.A O no hydrogen 2.952 N/A ARG 39.A N GLN 35.A O no hydrogen 2.872 N/A ILE 40.A N GLU 36.A O no hydrogen 2.945 N/A ILE 41.A N ILE 37.A O no hydrogen 2.865 N/A LYS 42.A N ASP 38.A O no hydrogen 2.913 N/A GLN 43.A N ARG 39.A O no hydrogen 3.320 N/A SER 44.A OG GLU 49.A O no hydrogen 2.726 N/A LYS 48.A NZ GLN 81.A OE1 no hydrogen 3.314 N/A LYS 48.A NZ LYS 137.A O no hydrogen 3.138 N/A GLU 49.A N GLN 43.A O no hydrogen 3.322 N/A SER 50.A OG VAL 166.A O no hydrogen 2.939 N/A HIS 51.A N VAL 173.A O no hydrogen 2.960 N/A SER 52.A OG SER 197.A OG no hydrogen 2.521 N/A VAL 53.A N ILE 175.A O no hydrogen 2.955 N/A LEU 55.A N GLY 177.A O no hydrogen 2.630 N/A VAL 56.A N ILE 201.A O no hydrogen 3.354 N/A GLY 57.A N THR 179.A O no hydrogen 3.451 N/A ARG 59.A NH1 GLU 146.A OE2 no hydrogen 3.145 N/A SER 61.A OG SER 61.A O no hydrogen 2.283 N/A LYS 63.A NZ PRO 58.A O no hydrogen 3.088 N/A TYR 65.A OH ILE 25.A O no hydrogen 2.896 N/A LEU 67.A N LYS 63.A O no hydrogen 2.965 N/A ASP 68.A N THR 64.A O no hydrogen 2.904 N/A TYR 69.A N TYR 65.A O no hydrogen 2.945 N/A GLU 70.A N LEU 66.A O no hydrogen 2.939 N/A LEU 71.A N LEU 67.A O no hydrogen 2.922 N/A SER 72.A N ASP 68.A O no hydrogen 2.902 N/A LEU 73.A N TYR 69.A O no hydrogen 2.888 N/A LEU 74.A N GLU 70.A O no hydrogen 2.634 N/A ILE 83.A N THR 139.A O no hydrogen 2.934 N/A ILE 85.A N VAL 141.A O no hydrogen 2.877 N/A ARG 86.A N GLN 104.A OE1 no hydrogen 3.141 N/A ARG 86.A NH2 ASP 68.A OD1 no hydrogen 3.259 N/A LEU 87.A N ILE 143.A O no hydrogen 2.923 N/A THR 96.A OG1 SER 93.A O no hydrogen 2.934 N/A GLY 100.A N THR 96.A O no hydrogen 3.277 N/A ILE 101.A N ALA 97.A O no hydrogen 2.981 N/A ALA 102.A N ILE 98.A O no hydrogen 2.954 N/A THR 103.A N ASN 99.A O no hydrogen 2.911 N/A THR 103.A OG1 ASN 99.A O no hydrogen 2.519 N/A GLN 104.A N GLY 100.A O no hydrogen 2.958 N/A GLN 104.A NE2 ARG 86.A O no hydrogen 3.303 N/A LEU 105.A N ILE 101.A O no hydrogen 2.779 N/A GLU 106.A N ALA 102.A O no hydrogen 3.209 N/A GLN 107.A N THR 103.A O no hydrogen 3.251 N/A GLN 108.A NE2 THR 84.A O no hydrogen 3.462 N/A HIS 113.A ND1 LEU 109.A O no hydrogen 3.017 N/A VAL 123.A N SER 119.A O no hydrogen 2.935 N/A PHE 124.A N LEU 120.A O no hydrogen 2.933 N/A GLU 125.A N THR 121.A O no hydrogen 2.933 N/A LYS 126.A N GLU 122.A O no hydrogen 2.901 N/A LYS 126.A NZ SER 117.A O no hydrogen 2.415 N/A ILE 127.A N VAL 123.A O no hydrogen 3.103 N/A LEU 128.A N GLU 125.A O no hydrogen 3.261 N/A LEU 129.A N GLU 125.A O no hydrogen 3.295 N/A SER 133.A OG ASP 132.A O no hydrogen 2.729 N/A THR 139.A N GLN 81.A O no hydrogen 3.487 N/A THR 139.A OG1 PRO 172.A O no hydrogen 2.625 N/A VAL 140.A N PRO 172.A O no hydrogen 3.294 N/A VAL 141.A N ILE 83.A O no hydrogen 2.929 N/A PHE 142.A N CYS 174.A O no hydrogen 3.024 N/A ILE 143.A N ILE 85.A O no hydrogen 2.867 N/A PHE 144.A N PHE 176.A O no hydrogen 2.616 N/A ASP 145.A N LEU 87.A O no hydrogen 2.951 N/A GLU 146.A N CYS 178.A O no hydrogen 2.735 N/A ILE 147.A N CYS 178.A O no hydrogen 3.439 N/A THR 149.A OG1 GLY 89.A O no hydrogen 2.744 N/A THR 149.A OG1 GLU 146.A O no hydrogen 3.390 N/A GLN 156.A NE2 GLY 152.A O no hydrogen 3.118 N/A GLN 156.A NE2 TYR 187.A O no hydrogen 2.999 N/A ASN 161.A N THR 157.A O no hydrogen 2.934 N/A LEU 162.A N LEU 158.A O no hydrogen 2.924 N/A PHE 163.A N LEU 159.A O no hydrogen 2.883 N/A ASP 164.A N TYR 160.A O no hydrogen 2.901 N/A MET 165.A N ASN 161.A O no hydrogen 3.232 N/A SER 169.A OG LEU 131.A O no hydrogen 2.722 N/A SER 169.A OG VAL 171.A O no hydrogen 3.129 N/A VAL 171.A N SER 169.A OG no hydrogen 2.751 N/A CYS 174.A N VAL 140.A O no hydrogen 3.135 N/A ILE 175.A N HIS 51.A O no hydrogen 2.987 N/A PHE 176.A N PHE 142.A O no hydrogen 2.659 N/A GLY 177.A N VAL 53.A O no hydrogen 2.880 N/A CYS 178.A N PHE 144.A O no hydrogen 2.796 N/A THR 179.A N LEU 55.A O no hydrogen 2.935 N/A THR 179.A OG1 ASP 148.A OD2 no hydrogen 2.845 N/A THR 180.A N THR 179.A OG1 no hydrogen 2.537 N/A THR 180.A OG1 GLU 146.A OE1 no hydrogen 3.400 N/A THR 180.A OG1 GLU 146.A OE2 no hydrogen 3.231 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.578 N/A TYR 187.A N ILE 184.A O no hydrogen 3.161 N/A GLU 189.A N GLN 156.A OE1 no hydrogen 2.646 N/A VAL 192.A N GLU 189.A O no hydrogen 2.792 N/A LYS 193.A N GLU 189.A O no hydrogen 2.943 N/A LYS 193.A NZ LEU 185.A O no hydrogen 2.423 N/A ARG 195.A NE ASP 164.A OD1 no hydrogen 3.452 N/A ARG 195.A NH1 ARG 191.A O no hydrogen 2.800 N/A PHE 196.A N LYS 193.A O no hydrogen 3.041 N/A SER 197.A OG SER 52.A O no hydrogen 2.298 N/A SER 197.A OG SER 52.A OG no hydrogen 2.521 N/A ILE 201.A N ILE 54.A O no hydrogen 3.010 N/A MET 203.A N VAL 56.A O no hydrogen 2.705 N/A ASN 208.A N ASP 211.A OD2 no hydrogen 3.069 N/A MET 212.A N LEU 209.A O no hydrogen 3.150 N/A VAL 213.A N LEU 209.A O no hydrogen 3.235 N/A ASP 214.A N ASP 210.A O no hydrogen 2.940 N/A ALA 215.A N ASP 211.A O no hydrogen 2.884 N/A VAL 216.A N MET 212.A O no hydrogen 2.944 N/A ARG 217.A N VAL 213.A O no hydrogen 2.878 N/A ARG 217.A NE GLU 238.A OE1 no hydrogen 3.416 N/A ARG 217.A NE GLU 238.A OE2 no hydrogen 2.969 N/A ASN 218.A N ASP 214.A O no hydrogen 2.891 N/A LEU 219.A N ALA 215.A O no hydrogen 2.893 N/A LEU 220.A N VAL 216.A O no hydrogen 2.950 N/A THR 221.A N ARG 217.A O no hydrogen 3.303 N/A THR 221.A OG1 ASN 234.A OD1 no hydrogen 3.426 N/A VAL 222.A N ASN 234.A OD1 no hydrogen 3.298 N/A SER 227.A OG GLY 3.A O no hydrogen 2.306 N/A GLN 232.A N TRP 229.A O no hydrogen 2.982 N/A TRP 233.A N TRP 229.A O no hydrogen 2.907 N/A TRP 233.A NE1 LEU 220.A O no hydrogen 3.200 N/A ASN 234.A N VAL 230.A O no hydrogen 3.037 N/A THR 236.A N GLN 232.A O no hydrogen 2.801 N/A THR 236.A OG1 GLN 232.A O no hydrogen 2.982 N/A THR 236.A OG1 TRP 233.A O no hydrogen 3.334 N/A LEU 237.A N TRP 233.A O no hydrogen 3.111 N/A LEU 237.A N ASN 234.A O no hydrogen 2.976 N/A GLU 238.A N ASN 234.A O no hydrogen 2.986 N/A LYS 239.A N GLU 235.A O no hydrogen 2.997 N/A GLU 240.A N LEU 237.A O no hydrogen 2.945 N/A LEU 241.A N LEU 237.A O no hydrogen 3.204 N/A LEU 241.A N GLU 238.A O no hydrogen 2.972 N/A SER 242.A N GLU 238.A O no hydrogen 2.722 N/A SER 242.A OG GLU 238.A O no hydrogen 2.477 N/A ARG 245.A N ASP 243.A OD2 no hydrogen 3.069 N/A ASN 247.A ND2 LYS 287.A O no hydrogen 3.307 N/A ASN 249.A ND2 LEU 241.A O no hydrogen 3.613 N/A HIS 251.A N ASN 247.A O no hydrogen 2.909 N/A ILE 252.A N LEU 248.A O no hydrogen 2.972 N/A ARG 253.A N ASN 249.A O no hydrogen 2.869 N/A ARG 253.A NE GLU 257.A OE2 no hydrogen 3.044 N/A MET 254.A N ARG 250.A O no hydrogen 2.928 N/A ASN 255.A N HIS 251.A O no hydrogen 2.894 N/A ASN 255.A ND2 SER 261.A O no hydrogen 3.136 N/A PHE 256.A N ILE 252.A O no hydrogen 2.922 N/A THR 258.A N MET 254.A O no hydrogen 3.341 N/A THR 258.A OG1 MET 254.A O no hydrogen 2.339 N/A ARG 260.A NH1 ILE 206.A O no hydrogen 2.687 N/A SER 261.A N PHE 259.A O no hydrogen 2.872 N/A SER 261.A OG THR 264.A OG1 no hydrogen 2.572 N/A THR 264.A N SER 261.A OG no hydrogen 3.361 N/A THR 264.A OG1 SER 261.A O no hydrogen 2.782 N/A THR 264.A OG1 SER 261.A OG no hydrogen 2.572 N/A LYS 266.A N LEU 262.A O no hydrogen 2.892 N/A LYS 266.A NZ TYR 62.A OH no hydrogen 3.385 N/A ASN 267.A N PRO 263.A O no hydrogen 2.942 N/A SER 268.A N THR 264.A O no hydrogen 2.968 N/A SER 268.A OG THR 264.A O no hydrogen 3.307 N/A ILE 269.A N LEU 265.A O no hydrogen 2.887 N/A ILE 270.A N LYS 266.A O no hydrogen 2.949 N/A LEU 272.A N ILE 269.A O no hydrogen 3.031 N/A VAL 273.A N ILE 269.A O no hydrogen 3.052 N/A ALA 274.A N ILE 270.A O no hydrogen 2.950 N/A THR 275.A N PRO 271.A O no hydrogen 3.320 N/A THR 275.A OG1 PRO 271.A O no hydrogen 2.363 N/A SER 276.A OG LEU 272.A O no hydrogen 2.701 N/A LEU 282.A N ASN 278.A O no hydrogen 2.897 N/A CYS 283.A N PHE 279.A O no hydrogen 2.872 N/A CYS 283.A SG PHE 279.A O no hydrogen 3.473 N/A THR 284.A N GLY 280.A O no hydrogen 2.935 N/A ALA 285.A N SER 281.A O no hydrogen 2.866 N/A ILE 286.A N LEU 282.A O no hydrogen 2.946 N/A LYS 287.A N CYS 283.A O no hydrogen 2.861 N/A SER 288.A N THR 284.A O no hydrogen 2.916 N/A SER 288.A OG THR 284.A O no hydrogen 3.228 N/A SER 288.A OG SER 290.A OG no hydrogen 2.336 N/A CYS 289.A SG ILE 286.A O no hydrogen 3.882 N/A SER 290.A OG SER 288.A OG no hydrogen 2.336 N/A TYR 295.A N PHE 291.A O no hydrogen 2.925 N/A LYS 297.A N ASP 293.A O no hydrogen 3.112 N/A ASN 298.A N ILE 294.A O no hydrogen 3.155 N/A GLN 299.A N TYR 295.A O no hydrogen 2.966 N/A LEU 300.A N LYS 297.A O no hydrogen 3.266 N/A SER 301.A N ASN 298.A O no hydrogen 3.234 N/A SER 301.A OG ASN 298.A O no hydrogen 3.040 N/A SER 301.A OG ASN 302.A OD1 no hydrogen 3.566 N/A LEU 304.A N ASN 303.A OD1 no hydrogen 2.735 N/A THR 305.A N ASN 303.A OD1 no hydrogen 3.411 N/A GLN 309.A N THR 305.A O no hydrogen 3.203 N/A SER 310.A OG ARG 307.A O no hydrogen 3.106 N/A LEU 311.A N LEU 308.A O no hydrogen 3.239 N/A LEU 316.A N SER 312.A O no hydrogen 3.024 N/A ALA 317.A N ASP 313.A O no hydrogen 2.979 N/A ILE 318.A N LEU 314.A O no hydrogen 2.903 N/A LEU 319.A N GLU 315.A O no hydrogen 2.913 N/A ILE 320.A N LEU 316.A O no hydrogen 2.911 N/A SER 321.A N ALA 317.A O no hydrogen 2.948 N/A SER 321.A OG ALA 317.A O no hydrogen 2.780 N/A SER 321.A OG ILE 318.A O no hydrogen 2.703 N/A ALA 322.A N ILE 318.A O no hydrogen 2.923 N/A ALA 323.A N LEU 319.A O no hydrogen 2.958 N/A ARG 324.A N ILE 320.A O no hydrogen 2.933 N/A ARG 324.A NE GLU 342.A OE2 no hydrogen 3.297 N/A ARG 324.A NH1 TRP 435.A O no hydrogen 2.829 N/A VAL 325.A N SER 321.A O no hydrogen 2.936 N/A ALA 326.A N ALA 322.A O no hydrogen 2.945 N/A LEU 327.A N ALA 323.A O no hydrogen 2.875 N/A ARG 328.A N ARG 324.A O no hydrogen 2.940 N/A ARG 328.A NH1 GLU 342.A OE1 no hydrogen 2.339 N/A ALA 329.A N VAL 325.A O no hydrogen 3.128 N/A PHE 334.A N TYR 413.A O no hydrogen 3.407 N/A ASN 337.A ND2 ASP 409.A OD2 no hydrogen 3.523 N/A LEU 338.A N ASN 335.A OD1 no hydrogen 3.430 N/A ALA 339.A N ASN 335.A O no hydrogen 2.908 N/A TYR 340.A N PHE 336.A O no hydrogen 2.941 N/A TYR 340.A OH TRP 360.A O no hydrogen 2.613 N/A ALA 341.A N ASN 337.A O no hydrogen 3.026 N/A GLU 342.A N ALA 339.A O no hydrogen 3.135 N/A TYR 343.A N ALA 339.A O no hydrogen 3.043 N/A GLU 344.A N TYR 340.A O no hydrogen 3.364 N/A MET 346.A N GLU 342.A O no hydrogen 2.951 N/A ILE 347.A N TYR 343.A O no hydrogen 2.945 N/A LYS 348.A N GLU 344.A O no hydrogen 2.858 N/A ALA 349.A N LYS 345.A O no hydrogen 2.975 N/A ILE 350.A N MET 346.A O no hydrogen 2.881 N/A ASN 351.A N ILE 347.A O no hydrogen 2.907 N/A THR 356.A OG1 ASN 351.A OD1 no hydrogen 2.302 N/A THR 356.A OG1 ILE 357.A O no hydrogen 3.384 N/A ILE 357.A N THR 356.A OG1 no hydrogen 2.391 N/A ASP 364.A N LEU 361.A O no hydrogen 2.979 N/A VAL 365.A N LEU 361.A O no hydrogen 3.237 N/A TRP 369.A N VAL 365.A O no hydrogen 2.905 N/A GLU 370.A N LYS 366.A O no hydrogen 2.934 N/A ASN 371.A N ASN 367.A O no hydrogen 2.980 N/A LEU 372.A N TRP 369.A O no hydrogen 3.383 N/A GLN 374.A N GLU 370.A O no hydrogen 3.354 N/A PHE 377.A N LEU 372.A O no hydrogen 3.239 N/A THR 379.A N GLN 414.A O no hydrogen 2.827 N/A THR 379.A OG1 GLN 414.A O no hydrogen 3.461 N/A ARG 387.A NH2 GLY 385.A O no hydrogen 3.214 N/A ASN 389.A N ASN 389.A OD1 no hydrogen 2.432 N/A PHE 394.A N THR 391.A O no hydrogen 2.872 N/A TYR 395.A N THR 391.A O no hydrogen 2.709 N/A SER 397.A N PHE 394.A O no hydrogen 3.178 N/A TYR 399.A N ALA 396.A O no hydrogen 3.376 N/A ASP 409.A N ASP 409.A OD1 no hydrogen 2.345 N/A ARG 411.A N PHE 408.A O no hydrogen 3.522 N/A TYR 413.A N PHE 334.A O no hydrogen 2.782 N/A GLN 416.A N PHE 377.A O no hydrogen 2.973 N/A LEU 422.A N ILE 418.A O no hydrogen 2.943 N/A ARG 423.A N LEU 419.A O no hydrogen 2.866 N/A ARG 423.A N GLN 420.A O no hydrogen 3.199 N/A ARG 423.A NH1 THR 436.A OG1 no hydrogen 3.423 N/A TRP 435.A N TYR 432.A O no hydrogen 2.931 N/A THR 436.A N TYR 433.A O no hydrogen 3.403 N/A THR 436.A OG1 TYR 433.A O no hydrogen 2.605 N/A