Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5mpb_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N ALA 1.A O no hydrogen 3.207 N/A ALA 5.A N ALA 1.A O no hydrogen 2.936 N/A ALA 5.A N ALA 2.A O no hydrogen 3.106 N/A LYS 7.A N TYR 4.A O no hydrogen 3.331 N/A GLN 10.A N ALA 6.A O no hydrogen 3.481 N/A THR 11.A N LYS 7.A O no hydrogen 2.983 N/A THR 11.A OG1 LYS 7.A O no hydrogen 3.402 N/A ASN 13.A ND2 LYS 9.A O no hydrogen 2.993 N/A LEU 15.A N THR 11.A O no hydrogen 2.888 N/A LYS 16.A N GLU 12.A O no hydrogen 3.079 N/A ASP 17.A N ASN 13.A O no hydrogen 3.323 N/A ILE 18.A N ASP 14.A O no hydrogen 3.109 N/A GLU 19.A N LEU 15.A O no hydrogen 3.129 N/A ALA 20.A N LYS 16.A O no hydrogen 3.398 N/A ARG 21.A N ASP 17.A O no hydrogen 3.331 N/A ARG 21.A NE ASP 17.A OD1 no hydrogen 3.246 N/A ARG 21.A NH1 GLU 24.A OE1 no hydrogen 3.235 N/A ARG 21.A NH2 ASP 17.A OD1 no hydrogen 3.356 N/A ILE 22.A N GLU 19.A O no hydrogen 3.357 N/A LYS 25.A N ARG 21.A O no hydrogen 3.263 N/A ALA 26.A N ILE 22.A O no hydrogen 3.350 N/A GLY 27.A N LYS 23.A O no hydrogen 3.303 N/A LYS 29.A NZ LYS 25.A O no hydrogen 3.480 N/A SER 38.A N LEU 35.A O no hydrogen 2.828 N/A HIS 39.A N ALA 36.A O no hydrogen 3.145 N/A GLY 45.A N TRP 41.A O no hydrogen 3.009 N/A ARG 47.A N MET 44.A O no hydrogen 3.067 N/A GLN 48.A N MET 44.A O no hydrogen 3.296 N/A ARG 49.A N GLY 45.A O no hydrogen 2.993 N/A ARG 49.A N ASP 46.A O no hydrogen 2.995 N/A GLY 51.A N GLN 48.A O no hydrogen 3.070 N/A GLN 57.A NE2 TYR 104.A OH no hydrogen 3.146 N/A ALA 59.A N VAL 97.A O no hydrogen 2.983 N/A CYS 61.A SG GLU 93.A OE1 no hydrogen 3.610 N/A CYS 61.A SG GLU 93.A OE2 no hydrogen 3.376 N/A THR 62.A N VAL 69.A O no hydrogen 3.110 N/A THR 62.A OG1 VAL 69.A O no hydrogen 3.058 N/A VAL 69.A N LYS 63.A O no hydrogen 3.030 N/A ILE 70.A N PHE 78.A O no hydrogen 3.116 N/A ASN 71.A N ARG 60.A O no hydrogen 3.380 N/A LEU 72.A N ALA 76.A O no hydrogen 3.079 N/A ILE 75.A N LEU 72.A O no hydrogen 2.888 N/A VAL 80.A N TYR 68.A O no hydrogen 2.934 N/A GLY 81.A N ASN 105.A OD1 no hydrogen 3.101 N/A GLU 84.A N GLU 107.A O no hydrogen 3.320 N/A SER 87.A OG ASP 90.A OD2 no hydrogen 2.542 N/A ASP 90.A N SER 87.A O no hydrogen 3.371 N/A ILE 91.A N PRO 88.A O no hydrogen 3.281 N/A MET 95.A N GLU 92.A O no hydrogen 3.398 N/A VAL 97.A N ALA 59.A O no hydrogen 3.177 N/A GLY 98.A N LEU 108.A O no hydrogen 3.170 N/A VAL 99.A N GLN 57.A O no hydrogen 3.006 N/A ASP 100.A N ASN 105.A O no hydrogen 3.300 N/A ARG 101.A NH1 PRO 55.A O no hydrogen 3.148 N/A ARG 101.A NH2 GLU 52.A OE2 no hydrogen 3.245 N/A ASN 105.A ND2 LEU 82.A O no hydrogen 3.459 N/A GLU 107.A N GLY 98.A O no hydrogen 3.236 N/A LEU 110.A N ARG 96.A O no hydrogen 3.203 N/A THR 119.A N ASP 115.A O no hydrogen 3.463 N/A THR 119.A OG1 ASP 115.A O no hydrogen 2.937 N/A THR 122.A OG1 GLU 201.A OE2 no hydrogen 3.356 N/A VAL 123.A N THR 119.A O no hydrogen 3.298 N/A THR 130.A OG1 SER 132.A OG no hydrogen 2.931 N/A THR 130.A OG1 ASP 133.A OD2 no hydrogen 3.294 N/A SER 132.A OG THR 130.A OG1 no hydrogen 2.931 N/A ASP 133.A N THR 130.A O no hydrogen 3.006 N/A VAL 134.A N TYR 131.A O no hydrogen 3.156 N/A LYS 138.A NZ GLY 135.A O no hydrogen 3.145 N/A LYS 138.A NZ GLY 136.A O no hydrogen 3.418 N/A LYS 143.A N ASP 139.A O no hydrogen 3.011 N/A LEU 144.A N GLN 140.A O no hydrogen 2.922 N/A ARG 145.A N ILE 141.A O no hydrogen 3.124 N/A VAL 147.A N LEU 144.A O no hydrogen 3.319 N/A VAL 148.A N LEU 144.A O no hydrogen 3.291 N/A GLU 149.A N ARG 145.A O no hydrogen 2.921 N/A LEU 152.A N GLU 149.A O no hydrogen 3.246 N/A LEU 153.A N GLU 149.A O no hydrogen 3.272 N/A SER 154.A N LEU 150.A O no hydrogen 3.261 N/A ALA 159.A N PRO 155.A O no hydrogen 3.258 N/A THR 160.A N GLU 156.A O no hydrogen 3.226 N/A THR 160.A OG1 ARG 157.A O no hydrogen 3.179 N/A LEU 161.A N ARG 157.A O no hydrogen 3.342 N/A GLY 162.A N PHE 158.A O no hydrogen 3.070 N/A GLY 162.A N ALA 159.A O no hydrogen 2.964 N/A ILE 169.A N VAL 274.A O no hydrogen 3.234 N/A LEU 170.A N ARG 296.A O no hydrogen 3.121 N/A LEU 171.A N PHE 276.A O no hydrogen 3.138 N/A TYR 172.A N VAL 298.A O no hydrogen 3.343 N/A THR 177.A OG1 PRO 174.A O no hydrogen 2.929 N/A LYS 179.A NZ GLY 173.A O no hydrogen 3.492 N/A CYS 182.A N GLY 178.A O no hydrogen 3.422 N/A CYS 182.A SG GLY 178.A O no hydrogen 3.647 N/A ARG 184.A N THR 180.A O no hydrogen 3.116 N/A ALA 185.A N LEU 181.A O no hydrogen 2.906 N/A VAL 186.A N CYS 182.A O no hydrogen 3.061 N/A ALA 187.A N ALA 183.A O no hydrogen 3.333 N/A ASN 188.A N ARG 184.A O no hydrogen 3.074 N/A ARG 189.A N ALA 185.A O no hydrogen 3.252 N/A THR 190.A N VAL 186.A O no hydrogen 3.018 N/A ASP 191.A N ALA 187.A O no hydrogen 3.181 N/A ALA 192.A N ALA 187.A O no hydrogen 3.205 N/A THR 193.A N ALA 226.A O no hydrogen 3.178 N/A THR 193.A OG1 ALA 226.A O no hydrogen 3.503 N/A ARG 196.A NE THR 122.A O no hydrogen 3.182 N/A VAL 197.A N PHE 230.A O no hydrogen 2.968 N/A GLY 199.A N ASP 232.A O no hydrogen 3.198 N/A LEU 202.A N ILE 198.A O no hydrogen 3.445 N/A GLN 204.A NE2 ASP 115.A OD1 no hydrogen 3.053 N/A TYR 206.A N GLU 209.A OE1 no hydrogen 3.309 N/A GLY 208.A N LYS 205.A O no hydrogen 3.171 N/A GLU 209.A N TYR 206.A O no hydrogen 3.063 N/A MET 213.A N GLU 209.A O no hydrogen 3.117 N/A VAL 214.A N GLY 210.A O no hydrogen 2.973 N/A ARG 215.A N ALA 211.A O no hydrogen 3.154 N/A GLU 216.A N ARG 212.A O no hydrogen 3.042 N/A LEU 217.A N MET 213.A O no hydrogen 3.168 N/A PHE 218.A N VAL 214.A O no hydrogen 3.143 N/A GLU 219.A N ARG 215.A O no hydrogen 3.312 N/A MET 220.A N GLU 216.A O no hydrogen 3.490 N/A ALA 221.A N LEU 217.A O no hydrogen 3.133 N/A ARG 222.A N PHE 218.A O no hydrogen 3.239 N/A ARG 222.A NH1 GLN 262.A O no hydrogen 2.944 N/A THR 223.A N MET 220.A O no hydrogen 3.196 N/A THR 223.A OG1 GLU 219.A O no hydrogen 3.325 N/A THR 223.A OG1 MET 220.A O no hydrogen 3.287 N/A LYS 225.A NZ ARG 269.A O no hydrogen 2.799 N/A CYS 227.A SG ALA 221.A O no hydrogen 3.148 N/A CYS 227.A SG LYS 224.A O no hydrogen 3.475 N/A ILE 229.A N LYS 273.A O no hydrogen 3.220 N/A PHE 230.A N ILE 195.A O no hydrogen 3.155 N/A PHE 231.A N MET 275.A O no hydrogen 3.480 N/A ASP 232.A N VAL 197.A O no hydrogen 2.998 N/A ILE 234.A N ALA 277.A O no hydrogen 3.300 N/A ALA 236.A N GLU 233.A O no hydrogen 3.347 N/A GLY 245.A N PHE 242.A O no hydrogen 3.241 N/A ARG 254.A N GLU 251.A O no hydrogen 3.338 N/A MET 256.A N VAL 252.A O no hydrogen 3.242 N/A LEU 257.A N GLN 253.A O no hydrogen 3.220 N/A LEU 259.A N THR 255.A O no hydrogen 3.314 N/A LEU 259.A N MET 256.A O no hydrogen 3.140 N/A ILE 260.A N MET 256.A O no hydrogen 3.277 N/A THR 261.A OG1 GLU 258.A O no hydrogen 3.108 N/A ASP 264.A N ILE 260.A O no hydrogen 3.407 N/A ARG 269.A NE ILE 272.A O no hydrogen 3.192 N/A ARG 269.A NH2 ILE 272.A O no hydrogen 3.104 N/A LYS 273.A N CYS 227.A O no hydrogen 3.328 N/A LYS 273.A NZ VAL 147.A O no hydrogen 3.347 N/A LYS 273.A NZ VAL 148.A O no hydrogen 3.309 N/A VAL 274.A N LYS 167.A O no hydrogen 3.331 N/A MET 275.A N ILE 229.A O no hydrogen 3.175 N/A ALA 277.A N PHE 231.A O no hydrogen 3.297 N/A THR 278.A N LEU 171.A O no hydrogen 3.365 N/A THR 278.A OG1 ARG 280.A O no hydrogen 3.092 N/A ASN 279.A N ASP 235.A OD2 no hydrogen 3.240 N/A LEU 284.A N PRO 281.A O no hydrogen 3.146 N/A ALA 287.A N ASP 285.A OD2 no hydrogen 3.430 N/A LEU 289.A N ASP 285.A O no hydrogen 3.265 N/A ARG 290.A NE ALA 287.A O no hydrogen 3.260 N/A ARG 290.A NH2 ALA 287.A O no hydrogen 3.549 N/A VAL 298.A N LEU 170.A O no hydrogen 3.305 N/A PHE 300.A N TYR 172.A O no hydrogen 2.908 N/A SER 301.A OG GLU 299.A OE1 no hydrogen 3.434 N/A GLU 306.A N ASP 304.A OD2 no hydrogen 3.061 N/A GLY 307.A N ASP 304.A OD1 no hydrogen 3.477 N/A ARG 308.A N ASP 304.A O no hydrogen 3.130 N/A ARG 308.A NH1 SER 331.A O no hydrogen 3.060 N/A ARG 308.A NH1 CYS 334.A O no hydrogen 3.537 N/A ALA 309.A N LEU 305.A O no hydrogen 2.906 N/A ASN 310.A N GLU 306.A O no hydrogen 3.211 N/A ILE 311.A N GLY 307.A O no hydrogen 3.050 N/A PHE 312.A N ARG 308.A O no hydrogen 3.169 N/A ARG 313.A N ALA 309.A O no hydrogen 2.890 N/A ARG 313.A NE ASN 310.A OD1 no hydrogen 3.172 N/A ARG 313.A NH1 GLU 328.A OE2 no hydrogen 2.972 N/A ARG 313.A NH2 ASN 310.A OD1 no hydrogen 3.138 N/A ARG 313.A NH2 GLU 328.A OE2 no hydrogen 3.065 N/A ILE 314.A N ASN 310.A O no hydrogen 3.365 N/A SER 316.A N PHE 312.A O no hydrogen 3.219 N/A SER 316.A OG PHE 312.A O no hydrogen 3.243 N/A SER 316.A OG ARG 313.A O no hydrogen 2.607 N/A LYS 317.A N ARG 313.A O no hydrogen 2.979 N/A SER 318.A OG ILE 314.A O no hydrogen 3.205 N/A SER 318.A OG HIS 315.A O no hydrogen 3.500 N/A MET 319.A N SER 316.A O no hydrogen 3.371 N/A GLU 322.A N ALA 361.A O no hydrogen 3.025 N/A ARG 323.A NH2 LYS 317.A O no hydrogen 3.557 N/A TRP 327.A NE1 SER 316.A OG no hydrogen 2.858 N/A SER 331.A N TRP 327.A O no hydrogen 3.339 N/A SER 331.A OG TRP 327.A O no hydrogen 3.133 N/A ARG 332.A N GLU 328.A O no hydrogen 3.107 N/A CYS 334.A SG ILE 330.A O no hydrogen 3.811 N/A SER 337.A OG PRO 335.A O no hydrogen 2.885 N/A GLY 339.A N GLY 176.A O no hydrogen 3.096 N/A ARG 343.A N GLY 339.A O no hydrogen 3.445 N/A SER 344.A N ALA 340.A O no hydrogen 3.158 N/A VAL 345.A N GLU 341.A O no hydrogen 3.133 N/A CYS 346.A N LEU 342.A O no hydrogen 3.340 N/A CYS 346.A SG LEU 342.A O no hydrogen 3.820 N/A THR 347.A N ARG 343.A O no hydrogen 3.000 N/A THR 347.A OG1 ARG 343.A O no hydrogen 3.121 N/A GLU 348.A N SER 344.A O no hydrogen 3.177 N/A ALA 349.A N VAL 345.A O no hydrogen 3.093 N/A GLY 350.A N CYS 346.A O no hydrogen 3.071 N/A MET 351.A N THR 347.A O no hydrogen 3.206 N/A PHE 352.A N GLU 348.A O no hydrogen 3.071 N/A ILE 354.A N GLY 350.A O no hydrogen 3.432 N/A ARG 355.A N MET 351.A O no hydrogen 2.992 N/A ARG 357.A N ILE 354.A O no hydrogen 3.047 N/A ASP 365.A N THR 362.A O no hydrogen 3.311 N/A PHE 366.A N GLU 363.A O no hydrogen 3.208 N/A LEU 367.A N LYS 364.A O no hydrogen 3.166 N/A LYS 368.A N LYS 364.A O no hydrogen 3.373 N/A ALA 369.A N ASP 365.A O no hydrogen 3.084 N/A VAL 370.A N PHE 366.A O no hydrogen 3.399 N/A ASP 371.A N LEU 367.A O no hydrogen 3.297 N/A LYS 372.A N LYS 368.A O no hydrogen 3.111 N/A VAL 373.A N ALA 369.A O no hydrogen 3.175 N/A ILE 374.A N VAL 370.A O no hydrogen 3.094 N/A SER 375.A N ASP 371.A O no hydrogen 2.940 N/A SER 375.A OG ASP 371.A O no hydrogen 2.835 N/A SER 375.A OG ASP 371.A OD1 no hydrogen 3.532 N/A GLY 376.A N LYS 372.A O no hydrogen 3.362 N/A TYR 377.A N VAL 373.A O no hydrogen 3.281 N/A LYS 378.A N ILE 374.A O no hydrogen 3.087 N/A PHE 380.A N TYR 377.A O no hydrogen 3.241 N/A