Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c7a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N GLY 25.A O no hydrogen 3.238 N/A LYS 3.A N ASP 83.A OD2 no hydrogen 3.214 N/A VAL 4.A N GLU 27.A O no hydrogen 3.013 N/A CYS 5.A N VAL 84.A O no hydrogen 3.091 N/A CYS 5.A SG ARG 29.A O no hydrogen 4.012 N/A CYS 5.A SG ALA 78.A O no hydrogen 3.963 N/A VAL 6.A N ARG 29.A O no hydrogen 2.982 N/A CYS 7.A N ILE 86.A O no hydrogen 3.034 N/A GLY 8.A N LEU 31.A O no hydrogen 3.036 N/A HIS 14.A N GLY 10.A O no hydrogen 3.189 N/A HIS 14.A ND1 GLY 10.A O no hydrogen 2.874 N/A THR 15.A OG1 ASN 11.A O no hydrogen 3.193 N/A LEU 16.A N GLY 12.A O no hydrogen 3.171 N/A SER 17.A N ALA 13.A O no hydrogen 3.254 N/A SER 17.A OG ALA 13.A O no hydrogen 3.042 N/A GLY 18.A N HIS 14.A O no hydrogen 3.432 N/A LEU 19.A N THR 15.A O no hydrogen 3.341 N/A ALA 20.A N LEU 16.A O no hydrogen 3.161 N/A ALA 21.A N SER 17.A O no hydrogen 3.343 N/A SER 22.A N LEU 19.A O no hydrogen 3.358 N/A SER 22.A OG LEU 19.A O no hydrogen 2.732 N/A ARG 23.A N ALA 20.A O no hydrogen 3.401 N/A ARG 23.A NE LEU 186.A O no hydrogen 3.378 N/A ARG 23.A NH2 LEU 186.A O no hydrogen 3.370 N/A GLU 27.A N VAL 2.A O no hydrogen 3.115 N/A ARG 29.A N VAL 4.A O no hydrogen 2.967 N/A ARG 29.A NE ALA 78.A O no hydrogen 2.867 N/A ARG 29.A NH2 ALA 78.A O no hydrogen 3.288 N/A VAL 30.A N VAL 70.A O no hydrogen 3.007 N/A LEU 31.A N VAL 6.A O no hydrogen 3.045 N/A THR 32.A N THR 72.A O no hydrogen 3.370 N/A THR 32.A OG1 GLU 37.A OE1 no hydrogen 2.772 N/A GLU 37.A N PHE 34.A O no hydrogen 3.163 N/A ARG 40.A N ASP 36.A O no hydrogen 3.439 N/A TRP 41.A N GLU 37.A O no hydrogen 3.197 N/A THR 42.A N ALA 38.A O no hydrogen 3.251 N/A THR 42.A OG1 ALA 38.A O no hydrogen 3.008 N/A LYS 43.A N GLU 39.A O no hydrogen 3.295 N/A ALA 44.A N ARG 40.A O no hydrogen 3.333 N/A LEU 45.A N TRP 41.A O no hydrogen 3.228 N/A GLY 46.A N THR 42.A O no hydrogen 3.300 N/A ASP 48.A N LEU 45.A O no hydrogen 3.321 N/A LEU 50.A N SER 66.A O no hydrogen 2.991 N/A THR 51.A N ARG 154.A O no hydrogen 3.273 N/A VAL 52.A N VAL 64.A O no hydrogen 2.945 N/A ILE 53.A N VAL 156.A O no hydrogen 3.106 N/A VAL 54.A N THR 62.A O no hydrogen 2.875 N/A ASN 55.A N VAL 158.A O no hydrogen 3.450 N/A ASN 55.A ND2 GLU 157.A OE2 no hydrogen 3.299 N/A ASN 55.A ND2 VAL 158.A O no hydrogen 3.079 N/A GLU 56.A N THR 60.A O no hydrogen 3.102 N/A GLN 61.A NE2 ASN 55.A OD1 no hydrogen 2.811 N/A THR 62.A N VAL 54.A O no hydrogen 3.043 N/A THR 62.A OG1 GLU 56.A OE2 no hydrogen 2.960 N/A VAL 64.A N VAL 52.A O no hydrogen 2.996 N/A SER 66.A N LEU 50.A O no hydrogen 3.260 N/A SER 66.A OG GLY 18.A O no hydrogen 2.778 N/A ARG 67.A NH1 GLY 46.A O no hydrogen 3.314 N/A ARG 67.A NH1 ASP 48.A O no hydrogen 2.872 N/A LYS 69.A N VAL 28.A O no hydrogen 3.128 N/A THR 72.A N VAL 30.A O no hydrogen 3.078 N/A ASP 74.A N THR 72.A OG1 no hydrogen 3.090 N/A GLU 76.A N ASP 74.A OD1 no hydrogen 3.061 N/A ALA 78.A N ASP 74.A O no hydrogen 3.404 N/A ILE 79.A N PRO 75.A O no hydrogen 3.053 N/A SER 80.A OG GLU 76.A O no hydrogen 2.967 N/A ALA 82.A N ILE 79.A O no hydrogen 3.219 N/A ASP 83.A N LYS 3.A O no hydrogen 3.010 N/A VAL 84.A N LYS 3.A O no hydrogen 3.310 N/A VAL 85.A N LEU 110.A O no hydrogen 3.042 N/A ILE 86.A N CYS 5.A O no hydrogen 3.081 N/A LEU 87.A N VAL 112.A O no hydrogen 3.038 N/A THR 88.A N CYS 7.A O no hydrogen 3.363 N/A THR 88.A OG1 LEU 114.A O no hydrogen 3.328 N/A ALA 93.A N PRO 90.A O no hydrogen 3.253 N/A HIS 94.A N ALA 91.A O no hydrogen 3.319 N/A TYR 97.A N HIS 94.A O no hydrogen 3.233 N/A PHE 98.A N HIS 94.A O no hydrogen 3.295 N/A GLN 99.A N GLU 95.A O no hydrogen 3.343 N/A ALA 100.A N GLY 96.A O no hydrogen 3.357 N/A MET 101.A N TYR 97.A O no hydrogen 3.244 N/A TYR 104.A N MET 101.A O no hydrogen 3.099 N/A VAL 105.A N MET 101.A O no hydrogen 3.279 N/A GLN 106.A NE2 ALA 82.A O no hydrogen 3.134 N/A ALA 109.A N GLN 106.A O no hydrogen 3.334 N/A LEU 110.A N ASP 83.A O no hydrogen 3.328 N/A ILE 111.A N SER 136.A O no hydrogen 3.195 N/A VAL 112.A N VAL 85.A O no hydrogen 2.933 N/A GLY 113.A N MET 138.A O no hydrogen 2.991 N/A LEU 114.A N LEU 87.A O no hydrogen 3.075 N/A SER 116.A OG GLY 113.A O no hydrogen 3.410 N/A SER 116.A OG SER 139.A OG no hydrogen 3.071 N/A GLU 121.A N GLU 121.A OE1 no hydrogen 2.871 N/A GLN 123.A N GLY 119.A O no hydrogen 3.406 N/A CYS 124.A N PHE 120.A O no hydrogen 3.339 N/A ARG 125.A N GLU 121.A O no hydrogen 3.255 N/A ARG 125.A NH1 ILE 393.A O no hydrogen 3.327 N/A ARG 125.A NH2 LEU 394.A O no hydrogen 3.417 N/A ASP 126.A N PHE 122.A O no hydrogen 3.333 N/A ILE 127.A N GLN 123.A O no hydrogen 3.342 N/A LEU 128.A N CYS 124.A O no hydrogen 3.154 N/A GLY 129.A N ARG 125.A O no hydrogen 3.218 N/A LYS 131.A NZ VAL 105.A O no hydrogen 3.145 N/A LYS 131.A NZ ASP 107.A OD1 no hydrogen 2.760 N/A ALA 132.A N GLY 129.A O no hydrogen 3.220 N/A ALA 133.A N ASP 130.A O no hydrogen 3.205 N/A ALA 134.A N LYS 131.A O no hydrogen 3.097 N/A SER 136.A N ALA 109.A O no hydrogen 3.524 N/A MET 137.A N ILE 170.A O no hydrogen 3.158 N/A MET 138.A N ILE 111.A O no hydrogen 3.037 N/A SER 139.A N SER 168.A O no hydrogen 3.189 N/A SER 139.A OG SER 116.A OG no hydrogen 3.071 N/A SER 139.A OG GLU 121.A OE2 no hydrogen 3.185 N/A PHE 140.A N GLY 113.A O no hydrogen 3.232 N/A LEU 143.A N THR 142.A OG1 no hydrogen 2.821 N/A ALA 146.A N GLY 160.A O no hydrogen 3.152 N/A CYS 147.A SG ASN 11.A O no hydrogen 3.811 N/A ARG 148.A N GLU 157.A O no hydrogen 3.154 N/A ILE 149.A N ASN 11.A OD1 no hydrogen 3.113 N/A LYS 150.A N LYS 155.A O no hydrogen 3.121 N/A GLU 151.A N LYS 155.A O no hydrogen 3.321 N/A GLY 153.A N HIS 14.A NE2 no hydrogen 3.319 N/A ARG 154.A N GLU 151.A O no hydrogen 3.092 N/A ARG 154.A NH1 ALA 44.A O no hydrogen 3.111 N/A ARG 154.A NH1 ASP 48.A OD2 no hydrogen 3.296 N/A ARG 154.A NH2 ASP 48.A OD2 no hydrogen 3.146 N/A LYS 155.A N GLU 151.A O no hydrogen 3.090 N/A VAL 156.A N THR 51.A O no hydrogen 3.275 N/A GLU 157.A N ARG 148.A O no hydrogen 3.126 N/A VAL 158.A N ILE 53.A O no hydrogen 2.968 N/A LEU 159.A N ALA 146.A O no hydrogen 2.818 N/A LYS 162.A N PRO 144.A O no hydrogen 3.391 N/A LEU 165.A N VAL 192.A O no hydrogen 3.320 N/A ALA 166.A N GLU 141.A OE2 no hydrogen 3.095 N/A ALA 167.A N ARG 194.A O no hydrogen 3.184 N/A SER 168.A N SER 139.A O no hydrogen 3.121 N/A ILE 170.A N MET 137.A O no hydrogen 3.060 N/A THR 173.A N ALA 133.A O no hydrogen 3.344 N/A ALA 174.A N ALA 134.A O no hydrogen 3.282 N/A THR 176.A OG1 VAL 177.A O no hydrogen 2.894 N/A SER 181.A N ASP 178.A OD2 no hydrogen 3.418 N/A SER 181.A OG ASP 178.A OD2 no hydrogen 2.677 N/A THR 182.A N ASP 178.A O no hydrogen 3.213 N/A THR 182.A OG1 ASP 178.A O no hydrogen 2.689 N/A LEU 183.A N PRO 179.A O no hydrogen 3.435 N/A GLN 184.A N LEU 180.A O no hydrogen 3.306 N/A GLN 184.A NE2 GLY 188.A O no hydrogen 3.036 N/A GLN 184.A NE2 PRO 191.A O no hydrogen 3.073 N/A MET 185.A N SER 181.A O no hydrogen 3.214 N/A LEU 186.A N THR 182.A O no hydrogen 3.423 N/A GLY 188.A N GLN 184.A O no hydrogen 3.113 N/A VAL 192.A N SER 163.A O no hydrogen 3.220 N/A PHE 193.A N GLN 184.A OE1 no hydrogen 3.246 N/A ARG 194.A N LEU 165.A O no hydrogen 3.164 N/A ALA 196.A N ALA 167.A O no hydrogen 2.900 N/A LYS 197.A N GLU 201.A OE1 no hydrogen 3.289 N/A LYS 197.A NZ ASP 270.A OD2 no hydrogen 3.125 N/A HIS 198.A NE2 ASN 266.A OD1 no hydrogen 3.312 N/A LEU 200.A N HIS 198.A ND1 no hydrogen 3.157 N/A MET 202.A N HIS 198.A O no hydrogen 3.475 N/A LEU 203.A N PHE 199.A O no hydrogen 3.231 N/A ILE 204.A N LEU 200.A O no hydrogen 3.387 N/A MET 205.A N GLU 201.A O no hydrogen 3.239 N/A SER 206.A OG MET 202.A O no hydrogen 3.545 N/A SER 206.A OG LEU 203.A O no hydrogen 2.884 N/A TYR 207.A N ILE 204.A O no hydrogen 3.453 N/A TYR 207.A OH LYS 272.A O no hydrogen 3.112 N/A VAL 210.A N TYR 207.A O no hydrogen 3.290 N/A HIS 211.A NE2 TYR 234.A OH no hydrogen 3.093 N/A ALA 213.A N PHE 209.A O no hydrogen 3.233 N/A ILE 214.A N VAL 210.A O no hydrogen 3.377 N/A LEU 215.A N HIS 211.A O no hydrogen 3.283 N/A PHE 216.A N PRO 212.A O no hydrogen 3.155 N/A GLY 217.A N ALA 213.A O no hydrogen 3.060 N/A ARG 218.A NH1 ARG 218.A O no hydrogen 3.256 N/A TRP 219.A N LEU 215.A O no hydrogen 3.140 N/A TRP 222.A NE1 LYS 225.A O no hydrogen 3.073 N/A LYS 225.A N ASP 223.A OD1 no hydrogen 3.104 N/A VAL 227.A N VAL 316.A O no hydrogen 3.297 N/A PHE 233.A N LEU 305.A O no hydrogen 2.816 N/A TYR 234.A OH HIS 211.A NE2 no hydrogen 3.093 N/A GLN 235.A NE2 ASN 299.A O no hydrogen 2.883 N/A GLY 236.A N PHE 233.A O no hydrogen 3.462 N/A GLN 239.A NE2 ASP 243.A OD1 no hydrogen 3.315 N/A THR 241.A N ASP 238.A OD1 no hydrogen 2.893 N/A THR 241.A OG1 ASP 238.A OD1 no hydrogen 2.733 N/A ALA 242.A N ASP 238.A O no hydrogen 3.273 N/A ASP 243.A N GLN 239.A O no hydrogen 3.124 N/A MET 244.A N ALA 240.A O no hydrogen 3.227 N/A LEU 245.A N THR 241.A O no hydrogen 3.230 N/A THR 246.A N ALA 242.A O no hydrogen 3.369 N/A THR 246.A OG1 ALA 242.A O no hydrogen 3.214 N/A ALA 247.A N ASP 243.A O no hydrogen 3.296 N/A CYS 248.A N MET 244.A O no hydrogen 3.247 N/A CYS 248.A SG MET 244.A O no hydrogen 3.604 N/A SER 249.A N LEU 245.A O no hydrogen 3.192 N/A ASN 250.A N THR 246.A O no hydrogen 3.091 N/A GLU 251.A N ALA 247.A O no hydrogen 3.337 N/A CYS 252.A SG CYS 248.A O no hydrogen 3.741 N/A ASP 254.A N ASN 250.A O no hydrogen 3.284 N/A VAL 255.A N GLU 251.A O no hydrogen 3.411 N/A ALA 256.A N CYS 252.A O no hydrogen 3.445 N/A ASN 257.A N LYS 253.A O no hydrogen 3.176 N/A ALA 258.A N ASP 254.A O no hydrogen 3.406 N/A ILE 259.A N VAL 255.A O no hydrogen 3.367 N/A MET 260.A N ALA 256.A O no hydrogen 3.417 N/A ALA 261.A N ASN 257.A O no hydrogen 3.395 N/A ALA 262.A N ALA 258.A O no hydrogen 3.337 N/A CYS 263.A N ILE 259.A O no hydrogen 2.933 N/A ASN 266.A ND2 CYS 263.A O no hydrogen 3.022 N/A SER 269.A N ASP 267.A OD1 no hydrogen 3.228 N/A SER 269.A OG ASP 267.A OD1 no hydrogen 2.798 N/A LYS 272.A NZ GLU 280.A OE1 no hydrogen 3.366 N/A ILE 274.A N SER 249.A OG no hydrogen 3.407 N/A TYR 275.A OH ASP 289.A O no hydrogen 2.845 N/A GLN 276.A NE2 GLU 280.A OE2 no hydrogen 3.312 N/A TRP 277.A N ASP 273.A O no hydrogen 3.206 N/A TYR 278.A N ILE 274.A O no hydrogen 3.167 N/A GLU 280.A N GLN 276.A O no hydrogen 3.351 N/A TYR 282.A N TYR 278.A O no hydrogen 2.971 N/A ASP 285.A N TYR 282.A O no hydrogen 3.098 N/A GLN 287.A N THR 298.A O no hydrogen 3.454 N/A ASP 288.A N THR 298.A OG1 no hydrogen 3.314 N/A HIS 294.A N ASP 291.A OD1 no hydrogen 2.980 N/A HIS 294.A ND1 ASP 291.A OD1 no hydrogen 2.758 N/A ALA 295.A N ASP 291.A O no hydrogen 3.082 N/A ILE 296.A N LEU 292.A O no hydrogen 3.335 N/A THR 297.A N TYR 293.A O no hydrogen 3.333 N/A THR 297.A OG1 TYR 293.A O no hydrogen 2.747 N/A THR 298.A N HIS 294.A O no hydrogen 3.199 N/A THR 298.A OG1 ASP 288.A O no hydrogen 3.336 N/A THR 298.A OG1 HIS 294.A O no hydrogen 2.601 N/A ASN 299.A N ILE 296.A O no hydrogen 3.408 N/A LYS 300.A N ASP 285.A O no hydrogen 3.136 N/A SER 301.A N ASN 299.A OD1 no hydrogen 3.219 N/A SER 301.A OG ASN 299.A OD1 no hydrogen 2.965 N/A TYR 302.A N ASN 299.A O no hydrogen 3.365 N/A HIS 307.A N PRO 231.A O no hydrogen 3.104 N/A LYS 310.A N ALA 317.A O no hydrogen 2.932 N/A VAL 312.A N GLY 315.A O no hydrogen 3.082 N/A GLY 315.A N VAL 312.A O no hydrogen 3.437 N/A VAL 316.A N VAL 227.A O no hydrogen 3.071 N/A ALA 317.A N LYS 310.A O no hydrogen 2.998 N/A ASP 319.A N PRO 308.A O no hydrogen 3.063 N/A ASN 322.A ND2 ASP 319.A O no hydrogen 3.564 N/A THR 326.A OG1 ASN 322.A O no hydrogen 2.917 N/A ILE 329.A N LEU 325.A O no hydrogen 3.416 N/A MET 331.A N GLU 327.A O no hydrogen 3.152 N/A GLY 332.A N ILE 329.A O no hydrogen 3.481 N/A MET 333.A N ASP 328.A O no hydrogen 3.098 N/A ILE 334.A N ILE 329.A O no hydrogen 3.098 N/A VAL 335.A N GLY 332.A O no hydrogen 3.181 N/A PHE 336.A N GLY 332.A O no hydrogen 3.355 N/A LYS 337.A N MET 333.A O no hydrogen 3.220 N/A LYS 337.A NZ ASP 351.A OD1 no hydrogen 3.166 N/A LYS 337.A NZ ASP 351.A OD2 no hydrogen 3.504 N/A GLY 338.A N ILE 334.A O no hydrogen 3.311 N/A VAL 339.A N VAL 335.A O no hydrogen 3.447 N/A ALA 340.A N PHE 336.A O no hydrogen 3.193 N/A ILE 341.A N LYS 337.A O no hydrogen 3.104 N/A ALA 342.A N GLY 338.A O no hydrogen 3.412 N/A ALA 343.A N VAL 339.A O no hydrogen 3.268 N/A ALA 343.A N ALA 340.A O no hydrogen 3.269 N/A GLY 344.A N ALA 340.A O no hydrogen 3.005 N/A GLY 344.A N ILE 341.A O no hydrogen 3.262 N/A VAL 345.A N ALA 340.A O no hydrogen 3.161 N/A SER 349.A N GLU 251.A OE2 no hydrogen 3.134 N/A ASN 350.A N GLU 251.A OE1 no hydrogen 3.366 N/A ASN 350.A ND2 GLU 251.A OE1 no hydrogen 2.620 N/A ASP 351.A N ILE 347.A O no hydrogen 3.225 N/A ILE 354.A N ASN 350.A O no hydrogen 3.406 N/A MET 355.A N ASP 351.A O no hydrogen 3.299 N/A ALA 357.A N LEU 353.A O no hydrogen 3.169 N/A GLN 358.A N ILE 354.A O no hydrogen 3.218 N/A GLN 358.A NE2 LEU 366.A O no hydrogen 3.487 N/A LYS 360.A N ALA 357.A O no hydrogen 3.247 N/A LYS 363.A N GLN 358.A O no hydrogen 2.936 N/A GLU 364.A N ASP 375.A OD2 no hydrogen 3.121 N/A TYR 365.A N GLN 358.A OE1 no hydrogen 3.122 N/A LEU 366.A N GLN 358.A OE1 no hydrogen 3.450 N/A VAL 367.A N ALA 370.A O no hydrogen 2.927 N/A ALA 370.A N VAL 367.A O no hydrogen 2.924 N/A GLY 373.A N TYR 365.A O no hydrogen 3.106 N/A LYS 374.A N GLU 364.A OE1 no hydrogen 3.134 N/A ASP 375.A N GLU 364.A O no hydrogen 2.967 N/A VAL 376.A N GLY 373.A O no hydrogen 3.289 N/A THR 378.A N ASP 375.A O no hydrogen 3.241 N/A THR 378.A OG1 ASP 375.A O no hydrogen 2.711 N/A THR 379.A OG1 VAL 376.A O no hydrogen 2.940 N/A ARG 380.A NE GLN 123.A OE1 no hydrogen 3.442 N/A ARG 380.A NH1 ALA 118.A O no hydrogen 3.220 N/A ARG 380.A NH2 HIS 94.A ND1 no hydrogen 3.029 N/A ARG 380.A NH2 GLN 123.A OE1 no hydrogen 2.791 N/A CYS 381.A SG THR 379.A OG1 no hydrogen 3.652 N/A GLN 383.A N GLN 383.A OE1 no hydrogen 2.859 N/A GLN 383.A NE2 GLY 338.A O no hydrogen 3.245 N/A ARG 384.A N CYS 381.A O no hydrogen 3.070 N/A ARG 384.A NE ALA 377.A O no hydrogen 3.010 N/A ARG 384.A NH1 ALA 377.A O no hydrogen 3.437 N/A ARG 384.A NH2 ARG 384.A O no hydrogen 3.510 N/A TYR 385.A N PRO 382.A O no hydrogen 3.301 N/A GLY 386.A N GLN 383.A O no hydrogen 3.281 N/A PHE 387.A N PRO 382.A O no hydrogen 3.106 N/A ALA 392.A N THR 389.A OG1 no hydrogen 3.375 N/A ILE 393.A N THR 389.A O no hydrogen 3.034 N/A LEU 394.A N LEU 390.A O no hydrogen 3.127 N/A THR 395.A N ASP 391.A O no hydrogen 3.071 N/A THR 395.A OG1 ASP 391.A O no hydrogen 2.785 N/A GLY 396.A N ALA 392.A O no hydrogen 3.052 N/A LYS 397.A N THR 395.A OG1 no hydrogen 3.363 N/A LYS 398.A NZ TYR 385.A O no hydrogen 3.337 N/A