Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mar_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N SER 1.A OG no hydrogen 2.736 N/A ILE 4.A N TYR 33.A O no hydrogen 2.603 N/A GLY 6.A N GLU 35.A O no hydrogen 3.243 N/A VAL 10.A N VAL 68.A O no hydrogen 3.050 N/A GLU 11.A N HIS 39.A O no hydrogen 3.157 N/A GLN 13.A N TYR 41.A O no hydrogen 2.842 N/A ASP 15.A N ALA 73.A O no hydrogen 3.229 N/A THR 18.A N THR 290.A O no hydrogen 3.476 N/A ARG 19.A N GLU 16.A O no hydrogen 2.745 N/A ARG 19.A NH2 ASP 42.A OD2 no hydrogen 3.365 N/A ILE 21.A N MET 17.A O no hydrogen 3.287 N/A TRP 22.A N THR 18.A O no hydrogen 2.703 N/A TRP 22.A NE1 GLU 11.A OE2 no hydrogen 3.237 N/A GLU 23.A N ARG 19.A O no hydrogen 2.904 N/A ILE 25.A N ILE 21.A O no hydrogen 2.810 N/A ILE 25.A N TRP 22.A O no hydrogen 3.049 N/A LYS 26.A N TRP 22.A O no hydrogen 3.205 N/A LYS 26.A NZ GLU 11.A OE1 no hydrogen 2.815 N/A LYS 26.A NZ GLU 11.A OE2 no hydrogen 2.915 N/A LYS 26.A NZ GLU 23.A OE1 no hydrogen 2.893 N/A ILE 30.A N LYS 26.A O no hydrogen 3.171 N/A PHE 31.A N LYS 26.A O no hydrogen 2.796 N/A TYR 33.A N ILE 30.A O no hydrogen 2.818 N/A VAL 34.A N ILE 30.A O no hydrogen 3.169 N/A GLU 35.A N ILE 4.A O no hydrogen 2.589 N/A ASP 37.A N GLY 7.A O no hydrogen 3.102 N/A HIS 39.A N VAL 9.A O no hydrogen 2.982 N/A TYR 41.A N GLU 11.A O no hydrogen 3.075 N/A LEU 43.A N GLN 13.A O no hydrogen 2.842 N/A GLY 44.A N ASP 42.A OD1 no hydrogen 2.843 N/A ILE 45.A N ASP 15.A OD2 no hydrogen 2.553 N/A ASN 47.A ND2 ASP 42.A O no hydrogen 3.049 N/A ARG 48.A N GLY 44.A O no hydrogen 2.971 N/A ARG 48.A NE LEU 43.A O no hydrogen 2.638 N/A ARG 48.A NH1 ILE 75.A O no hydrogen 2.660 N/A ARG 48.A NH2 ASP 15.A OD2 no hydrogen 2.814 N/A ARG 48.A NH2 LEU 43.A O no hydrogen 3.241 N/A ARG 48.A NH2 ILE 75.A O no hydrogen 3.070 N/A ASP 49.A N ILE 45.A O no hydrogen 3.229 N/A ASP 49.A N GLU 46.A O no hydrogen 3.062 N/A ALA 50.A N GLU 46.A O no hydrogen 3.363 N/A THR 51.A N ASN 47.A O no hydrogen 3.309 N/A THR 51.A OG1 ASN 47.A O no hydrogen 3.197 N/A ASN 52.A N ASP 49.A O no hydrogen 2.815 N/A ASP 53.A N ARG 48.A O no hydrogen 2.833 N/A GLN 54.A N THR 51.A O no hydrogen 3.188 N/A THR 56.A N ASP 53.A O no hydrogen 2.990 N/A THR 56.A OG1 ASP 53.A O no hydrogen 3.327 N/A THR 56.A OG1 ASP 53.A OD1 no hydrogen 2.872 N/A LYS 57.A N ASP 53.A O no hydrogen 3.504 N/A ASP 58.A N GLN 54.A O no hydrogen 3.219 N/A ALA 59.A N VAL 55.A O no hydrogen 3.235 N/A ALA 60.A N THR 56.A O no hydrogen 3.234 N/A GLU 61.A N LYS 57.A O no hydrogen 2.995 N/A ALA 62.A N ASP 58.A O no hydrogen 2.756 N/A ILE 63.A N ALA 59.A O no hydrogen 2.992 N/A LYS 64.A N ALA 60.A O no hydrogen 3.144 N/A LYS 65.A N GLU 61.A O no hydrogen 3.144 N/A LYS 65.A N ALA 62.A O no hydrogen 3.016 N/A HIS 66.A N ALA 62.A O no hydrogen 3.176 N/A HIS 66.A ND1 ALA 62.A O no hydrogen 3.024 N/A ASN 67.A N ILE 63.A O no hydrogen 2.694 N/A GLY 69.A N VAL 282.A O no hydrogen 3.217 N/A VAL 70.A N VAL 10.A O no hydrogen 2.840 N/A LYS 71.A NZ CYS 72.A O no hydrogen 2.659 N/A LYS 71.A NZ THR 74.A OG1 no hydrogen 3.105 N/A LYS 71.A NZ GLU 285.A OE1 no hydrogen 3.417 N/A CYS 72.A N MET 12.A O no hydrogen 3.183 N/A CYS 72.A SG THR 18.A OG1 no hydrogen 3.443 N/A ILE 75.A N ASP 15.A OD1 no hydrogen 2.922 N/A GLU 79.A N ASP 78.A OD1 no hydrogen 3.024 N/A ARG 81.A NH1 GLU 84.A OE1 no hydrogen 3.367 N/A VAL 82.A N ASP 78.A O no hydrogen 3.364 N/A GLU 83.A N GLU 79.A O no hydrogen 3.387 N/A GLU 84.A N LYS 80.A O no hydrogen 2.548 N/A PHE 85.A N ARG 81.A O no hydrogen 2.779 N/A LYS 88.A N ASP 49.A OD1 no hydrogen 3.202 N/A TRP 91.A N GLN 89.A O no hydrogen 2.760 N/A TRP 91.A NE1 ASP 49.A OD1 no hydrogen 2.490 N/A SER 93.A OG ASN 95.A O no hydrogen 2.962 N/A THR 97.A OG1 SER 93.A O no hydrogen 2.618 N/A ILE 98.A N PRO 94.A O no hydrogen 3.319 N/A ARG 99.A NH2 GLU 285.A OE2 no hydrogen 3.342 N/A ASN 100.A N GLY 96.A O no hydrogen 2.443 N/A ILE 101.A N ILE 98.A O no hydrogen 2.933 N/A LEU 102.A N ARG 99.A O no hydrogen 3.096 N/A GLY 103.A N ARG 99.A O no hydrogen 2.744 N/A THR 105.A N VAL 275.A O no hydrogen 3.227 N/A PHE 107.A N VAL 273.A O no hydrogen 2.589 N/A ARG 108.A N ILE 129.A O no hydrogen 2.906 N/A GLU 109.A N THR 271.A O no hydrogen 2.954 N/A ILE 111.A N MET 269.A O no hydrogen 3.018 N/A LYS 114.A N GLU 347.A OE2 no hydrogen 3.078 N/A ILE 116.A N CYS 113.A O no hydrogen 2.798 N/A TRP 123.A N VAL 120.A O no hydrogen 3.265 N/A TRP 123.A NE1 ALA 251.A O no hydrogen 3.036 N/A VAL 124.A N GLU 253.A O no hydrogen 2.780 N/A ILE 128.A N PHE 256.A O no hydrogen 2.995 N/A ILE 129.A N ARG 108.A O no hydrogen 3.005 N/A GLY 130.A N TRP 258.A O no hydrogen 2.960 N/A HIS 132.A N CYS 260.A O no hydrogen 3.377 N/A HIS 132.A NE2 ASN 177.A OD1 no hydrogen 3.110 N/A THR 135.A N GLY 174.A O no hydrogen 3.209 N/A PHE 137.A N ALA 172.A O no hydrogen 3.119 N/A TYR 149.A N VAL 158.A O no hydrogen 2.924 N/A THR 155.A OG1 ASP 153.A OD1 no hydrogen 2.610 N/A VAL 158.A N TYR 149.A O no hydrogen 2.804 N/A VAL 162.A N VAL 145.A O no hydrogen 2.996 N/A PHE 165.A N GLY 143.A O no hydrogen 2.859 N/A ALA 172.A N PHE 137.A O no hydrogen 2.933 N/A ILE 182.A N GLN 178.A O no hydrogen 3.243 N/A ILE 182.A N ASP 179.A O no hydrogen 2.783 N/A GLU 183.A N ASP 179.A O no hydrogen 2.944 N/A ASP 184.A N LYS 180.A O no hydrogen 3.001 N/A PHE 185.A N SER 181.A O no hydrogen 3.294 N/A ALA 186.A N ILE 182.A O no hydrogen 3.175 N/A HIS 187.A N GLU 183.A O no hydrogen 3.215 N/A SER 188.A N ASP 184.A O no hydrogen 3.284 N/A SER 188.A OG ASP 184.A O no hydrogen 2.635 N/A SER 188.A OG VAL 275.A O no hydrogen 2.871 N/A SER 189.A N PHE 185.A O no hydrogen 3.379 N/A SER 189.A OG PHE 185.A O no hydrogen 2.371 N/A SER 189.A OG ALA 186.A O no hydrogen 2.669 N/A PHE 190.A N ALA 186.A O no hydrogen 2.521 N/A GLN 191.A N HIS 187.A O no hydrogen 2.477 N/A MET 192.A N SER 188.A O no hydrogen 2.883 N/A SER 195.A N GLN 191.A O no hydrogen 3.122 N/A LYS 196.A N ALA 193.A O no hydrogen 3.067 N/A GLY 197.A N LEU 194.A O no hydrogen 3.404 N/A TRP 198.A N ALA 193.A O no hydrogen 3.234 N/A LEU 200.A N TRP 238.A O no hydrogen 3.370 N/A TYR 201.A N ILE 257.A O no hydrogen 2.847 N/A LEU 202.A N GLU 240.A O no hydrogen 3.345 N/A SER 203.A N ALA 259.A O no hydrogen 3.362 N/A LEU 209.A N LYS 205.A O no hydrogen 3.133 N/A ARG 215.A N TYR 212.A O no hydrogen 3.103 N/A PHE 216.A N ASP 213.A O no hydrogen 2.744 N/A ILE 219.A N PHE 216.A O no hydrogen 3.091 N/A PHE 220.A N PHE 216.A O no hydrogen 2.713 N/A TYR 224.A N GLN 221.A O no hydrogen 2.761 N/A LYS 226.A N GLU 222.A O no hydrogen 3.354 N/A TYR 228.A OH HIS 187.A ND1 no hydrogen 2.546 N/A TYR 228.A OH GLN 191.A OE1 no hydrogen 2.706 N/A PHE 232.A N LYS 229.A O no hydrogen 3.261 N/A ALA 234.A N SER 230.A O no hydrogen 2.614 N/A GLN 235.A N PHE 232.A O no hydrogen 2.856 N/A GLN 235.A NE2 LEU 194.A O no hydrogen 3.244 N/A LYS 236.A N GLU 233.A O no hydrogen 3.111 N/A ILE 237.A N PHE 232.A O no hydrogen 2.594 N/A TRP 238.A NE1 TYR 201.A OH no hydrogen 3.139 N/A GLU 240.A N LEU 200.A O no hydrogen 3.373 N/A ARG 242.A N LEU 202.A O no hydrogen 2.909 N/A ILE 244.A N THR 204.A O no hydrogen 3.102 N/A ASP 246.A N LEU 243.A O no hydrogen 2.764 N/A MET 247.A N LEU 243.A O no hydrogen 3.105 N/A VAL 248.A N ILE 244.A O no hydrogen 3.089 N/A GLN 250.A N ASP 246.A O no hydrogen 2.920 N/A ALA 251.A N MET 247.A O no hydrogen 3.293 N/A GLY 254.A N SER 252.A OG no hydrogen 2.966 N/A ILE 257.A N PRO 199.A O no hydrogen 2.823 N/A TRP 258.A N ILE 128.A O no hydrogen 2.670 N/A TRP 258.A NE1 SER 203.A OG no hydrogen 2.573 N/A ALA 259.A N TYR 201.A O no hydrogen 2.675 N/A ASN 262.A ND2 HIS 131.A NE2 no hydrogen 3.340 N/A THR 271.A N GLU 109.A O no hydrogen 3.211 N/A THR 271.A OG1 GLU 109.A O no hydrogen 3.228 N/A SER 272.A N GLU 285.A O no hydrogen 2.801 N/A VAL 273.A N PHE 107.A O no hydrogen 3.032 N/A LEU 274.A N GLU 283.A O no hydrogen 2.764 N/A VAL 275.A N THR 105.A O no hydrogen 2.988 N/A CYS 276.A N THR 281.A O no hydrogen 3.248 N/A CYS 276.A SG LEU 102.A O no hydrogen 3.463 N/A GLY 279.A N CYS 276.A O no hydrogen 3.296 N/A THR 281.A N ASP 278.A OD1 no hydrogen 2.560 N/A THR 281.A OG1 ASN 67.A OD1 no hydrogen 3.419 N/A THR 281.A OG1 ASP 278.A OD1 no hydrogen 3.114 N/A THR 281.A OG1 ASP 278.A OD2 no hydrogen 2.857 N/A VAL 282.A N ASN 67.A O no hydrogen 2.710 N/A GLU 283.A N LEU 274.A O no hydrogen 3.051 N/A ALA 284.A N GLY 69.A O no hydrogen 2.858 N/A GLU 285.A N SER 272.A O no hydrogen 3.242 N/A THR 292.A OG1 GLU 16.A OE1 no hydrogen 3.030 N/A TYR 295.A N VAL 291.A O no hydrogen 3.271 N/A ARG 296.A N THR 292.A O no hydrogen 2.675 N/A ARG 296.A NH1 GLN 299.A OE1 no hydrogen 2.731 N/A MET 297.A N ARG 293.A O no hydrogen 3.253 N/A TYR 298.A N TYR 295.A O no hydrogen 2.848 N/A GLN 299.A N TYR 295.A O no hydrogen 2.828 N/A THR 304.A OG1 THR 306.A OG1 no hydrogen 3.329 N/A THR 304.A OG1 THR 373.A OG1 no hydrogen 3.068 N/A THR 306.A OG1 THR 304.A OG1 no hydrogen 3.329 N/A THR 306.A OG1 THR 373.A OG1 no hydrogen 2.926 N/A ASN 307.A ND2 THR 352.A OG1 no hydrogen 2.751 N/A ALA 310.A N GLY 268.A O no hydrogen 3.337 N/A ILE 312.A N PRO 308.A O no hydrogen 3.176 N/A PHE 313.A N ILE 309.A O no hydrogen 2.794 N/A ALA 314.A N ALA 310.A O no hydrogen 2.991 N/A TRP 315.A N SER 311.A O no hydrogen 3.410 N/A THR 316.A N ILE 312.A O no hydrogen 3.222 N/A THR 316.A OG1 PHE 313.A O no hydrogen 2.787 N/A THR 316.A OG1 GLU 339.A OE2 no hydrogen 2.843 N/A ARG 317.A N PHE 313.A O no hydrogen 2.859 N/A GLY 318.A N ALA 314.A O no hydrogen 3.312 N/A LEU 319.A N TRP 315.A O no hydrogen 2.792 N/A ALA 320.A N THR 316.A O no hydrogen 3.193 N/A HIS 321.A N ARG 317.A O no hydrogen 3.090 N/A HIS 321.A N GLY 318.A O no hydrogen 3.128 N/A HIS 321.A NE2 LYS 280.A O no hydrogen 2.686 N/A ARG 322.A N GLY 318.A O no hydrogen 3.216 N/A ARG 322.A NE ASP 326.A OD2 no hydrogen 3.018 N/A ARG 322.A NH2 ASP 326.A OD2 no hydrogen 2.429 N/A ALA 323.A N LEU 319.A O no hydrogen 3.142 N/A LYS 324.A N ALA 320.A O no hydrogen 2.967 N/A LYS 324.A NZ SER 195.A OG no hydrogen 3.421 N/A LYS 324.A NZ HIS 321.A ND1 no hydrogen 2.953 N/A LEU 325.A N HIS 321.A O no hydrogen 2.898 N/A ASP 326.A N ARG 322.A O no hydrogen 2.698 N/A ASN 328.A N ALA 323.A O no hydrogen 2.926 N/A ASN 328.A ND2 SER 5.A O no hydrogen 2.769 N/A GLU 330.A N GLU 330.A OE2 no hydrogen 2.865 N/A LEU 331.A N ASN 328.A OD1 no hydrogen 2.940 N/A ALA 332.A N ASN 328.A O no hydrogen 2.940 N/A PHE 333.A N LYS 329.A O no hydrogen 2.931 N/A PHE 334.A N GLU 330.A O no hydrogen 3.433 N/A ALA 335.A N LEU 331.A O no hydrogen 3.032 N/A ASN 336.A N ALA 332.A O no hydrogen 3.154 N/A ALA 337.A N PHE 333.A O no hydrogen 2.821 N/A LEU 338.A N PHE 334.A O no hydrogen 2.778 N/A GLU 339.A N ALA 335.A O no hydrogen 3.103 N/A GLU 340.A N ASN 336.A O no hydrogen 2.825 N/A VAL 341.A N ALA 337.A O no hydrogen 2.968 N/A SER 342.A N LEU 338.A O no hydrogen 3.049 N/A SER 342.A OG LEU 338.A O no hydrogen 2.776 N/A ILE 343.A N GLU 339.A O no hydrogen 3.227 N/A GLU 344.A N GLU 340.A O no hydrogen 2.973 N/A THR 345.A N VAL 341.A O no hydrogen 2.715 N/A THR 345.A OG1 VAL 341.A O no hydrogen 2.653 N/A ILE 346.A N SER 342.A O no hydrogen 3.299 N/A GLU 347.A N ILE 343.A O no hydrogen 2.806 N/A ALA 348.A N GLU 344.A O no hydrogen 2.803 N/A GLY 349.A N ILE 346.A O no hydrogen 2.819 N/A PHE 350.A N THR 345.A O no hydrogen 3.185 N/A THR 352.A OG1 ASP 354.A OD1 no hydrogen 2.598 N/A LYS 353.A N SER 305.A OG no hydrogen 2.912 N/A LEU 355.A N THR 352.A O no hydrogen 3.273 N/A ALA 356.A N THR 352.A O no hydrogen 3.075 N/A ALA 357.A N LYS 353.A O no hydrogen 2.638 N/A CYS 358.A N LEU 355.A O no hydrogen 3.326 N/A CYS 358.A SG ASP 354.A O no hydrogen 3.586 N/A ILE 359.A N ALA 356.A O no hydrogen 2.592 N/A LYS 360.A NZ ASP 369.A OD1 no hydrogen 2.695 N/A LYS 360.A NZ ASP 369.A OD2 no hydrogen 3.353 N/A VAL 365.A N LEU 362.A O no hydrogen 3.345 N/A GLN 366.A N ASP 369.A OD1 no hydrogen 3.345 N/A ASP 369.A N GLN 366.A O no hydrogen 3.273 N/A TYR 370.A N ARG 367.A O no hydrogen 3.390 N/A LEU 371.A N MET 351.A O no hydrogen 2.646 N/A ASN 372.A N GLU 375.A OE1 no hydrogen 2.797 N/A THR 373.A N THR 304.A O no hydrogen 3.153 N/A THR 373.A OG1 THR 304.A O no hydrogen 3.315 N/A THR 373.A OG1 THR 304.A OG1 no hydrogen 3.068 N/A THR 373.A OG1 THR 306.A OG1 no hydrogen 2.926 N/A PHE 376.A N ASN 372.A O no hydrogen 2.890 N/A MET 377.A N PHE 374.A O no hydrogen 3.196 N/A LEU 380.A N PHE 376.A O no hydrogen 3.316 N/A GLY 381.A N MET 377.A O no hydrogen 3.454 N/A GLU 382.A N ASP 378.A O no hydrogen 2.800 N/A ASN 383.A N LYS 379.A O no hydrogen 3.138 N/A ASN 383.A ND2 LYS 379.A O no hydrogen 3.016 N/A LEU 384.A N LEU 380.A O no hydrogen 2.895 N/A LYS 385.A N GLY 381.A O no hydrogen 2.778 N/A ILE 386.A N GLU 382.A O no hydrogen 3.006 N/A LYS 387.A N ASN 383.A O no hydrogen 2.726 N/A LYS 387.A NZ GLU 344.A OE1 no hydrogen 2.958 N/A LEU 388.A N LEU 384.A O no hydrogen 2.901 N/A ALA 389.A N LYS 385.A O no hydrogen 3.069 N/A GLN 390.A N ILE 386.A O no hydrogen 3.210 N/A ALA 391.A N LYS 387.A O no hydrogen 3.330 N/A ALA 391.A N LEU 388.A O no hydrogen 3.300 N/A LYS 392.A N ALA 389.A O no hydrogen 3.244 N/A