Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5mpb_K.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N LEU 1.A O no hydrogen 3.278 N/A SER 6.A N SER 2.A O no hydrogen 3.087 N/A SER 6.A N ASN 3.A O no hydrogen 3.152 N/A ASP 7.A N ASN 3.A O no hydrogen 3.175 N/A TYR 9.A N ASN 5.A O no hydrogen 3.471 N/A PHE 10.A N SER 6.A O no hydrogen 2.937 N/A LEU 12.A N ASP 7.A O no hydrogen 3.222 N/A LYS 14.A N LYS 11.A O no hydrogen 3.138 N/A LEU 15.A N LYS 11.A O no hydrogen 3.383 N/A GLU 16.A N LEU 12.A O no hydrogen 3.081 N/A TYR 19.A N LEU 15.A O no hydrogen 3.302 N/A GLU 20.A N GLU 16.A O no hydrogen 3.132 N/A LEU 21.A N LYS 17.A O no hydrogen 3.418 N/A LEU 22.A N GLU 18.A O no hydrogen 3.213 N/A THR 23.A N GLU 20.A O no hydrogen 3.231 N/A THR 23.A OG1 TYR 19.A O no hydrogen 2.871 N/A LEU 24.A N GLU 20.A O no hydrogen 3.201 N/A GLN 25.A N LEU 21.A O no hydrogen 3.268 N/A GLN 25.A N LEU 22.A O no hydrogen 3.205 N/A GLU 26.A N THR 23.A O no hydrogen 3.285 N/A TYR 28.A N LEU 24.A O no hydrogen 3.164 N/A ILE 29.A N GLN 25.A O no hydrogen 3.023 N/A LYS 30.A NZ GLU 26.A OE2 no hydrogen 3.400 N/A ASP 31.A N TYR 28.A O no hydrogen 3.076 N/A GLU 32.A N TYR 28.A O no hydrogen 3.035 N/A GLN 33.A N ILE 29.A O no hydrogen 3.231 N/A ARG 34.A N LYS 30.A O no hydrogen 3.487 N/A HIS 35.A N ASP 31.A O no hydrogen 3.127 N/A LEU 36.A N GLU 32.A O no hydrogen 3.131 N/A LEU 36.A N GLN 33.A O no hydrogen 3.229 N/A LYS 37.A N ARG 34.A O no hydrogen 3.084 N/A LEU 40.A N LEU 36.A O no hydrogen 3.217 N/A LYS 41.A N LYS 37.A O no hydrogen 3.161 N/A ARG 42.A N ARG 38.A O no hydrogen 3.088 N/A ARG 42.A NE GLU 45.A OE1 no hydrogen 2.746 N/A ARG 42.A NH2 GLU 45.A OE1 no hydrogen 3.308 N/A ALA 43.A N GLU 39.A O no hydrogen 2.961 N/A GLN 44.A N LEU 40.A O no hydrogen 3.043 N/A GLU 45.A N LYS 41.A O no hydrogen 3.180 N/A GLU 46.A N ARG 42.A O no hydrogen 3.340 N/A LYS 48.A N GLN 44.A O no hydrogen 3.255 N/A ARG 49.A N GLU 46.A O no hydrogen 3.372 N/A ILE 50.A N VAL 47.A O no hydrogen 3.081 N/A GLN 51.A N VAL 47.A O no hydrogen 3.174 N/A SER 52.A N ARG 49.A O no hydrogen 3.341 N/A SER 52.A OG LYS 48.A O no hydrogen 3.033 N/A VAL 56.A N LEU 100.A O no hydrogen 3.094 N/A GLY 58.A N VAL 98.A O no hydrogen 3.018 N/A GLN 59.A N SER 72.A O no hydrogen 2.824 N/A GLN 59.A NE2 SER 95.A OG no hydrogen 2.608 N/A LEU 61.A N ILE 70.A O no hydrogen 3.320 N/A ILE 64.A N THR 68.A O no hydrogen 3.407 N/A ASN 67.A N ASP 65.A OD1 no hydrogen 2.984 N/A ASN 67.A ND2 GLN 66.A OE1 no hydrogen 3.680 N/A GLY 69.A N VAL 81.A O no hydrogen 3.158 N/A ILE 70.A N GLU 62.A O no hydrogen 3.418 N/A VAL 71.A N TYR 79.A O no hydrogen 3.026 N/A SER 72.A N GLN 59.A O no hydrogen 3.200 N/A SER 72.A OG SER 73.A O no hydrogen 3.531 N/A SER 73.A N MET 77.A O no hydrogen 3.215 N/A SER 73.A OG THR 75.A OG1 no hydrogen 2.685 N/A SER 73.A OG MET 77.A O no hydrogen 3.469 N/A THR 74.A OG1 ILE 57.A O no hydrogen 3.304 N/A THR 75.A N SER 73.A OG no hydrogen 3.351 N/A THR 75.A OG1 SER 73.A OG no hydrogen 2.685 N/A GLY 76.A N SER 73.A O no hydrogen 3.414 N/A TYR 79.A N VAL 71.A O no hydrogen 3.077 N/A VAL 81.A N GLY 69.A O no hydrogen 2.951 N/A ARG 89.A NH1 ASN 67.A OD1 no hydrogen 3.525 N/A ARG 89.A NH2 ASN 67.A OD1 no hydrogen 3.131 N/A LEU 91.A N ASP 88.A OD2 no hydrogen 3.040 N/A MET 96.A N PHE 60.A O no hydrogen 3.208 N/A VAL 98.A N GLY 58.A O no hydrogen 3.258 N/A LEU 100.A N VAL 56.A O no hydrogen 2.914 N/A HIS 101.A N ALA 106.A O no hydrogen 2.993 N/A ASN 105.A N HIS 101.A O no hydrogen 3.000 N/A SER 115.A OG ASP 116.A OD2 no hydrogen 3.312 N/A SER 117.A OG ASP 114.A O no hydrogen 3.330 N/A SER 120.A OG SER 118.A O no hydrogen 3.175 N/A ASN 125.A ND2 PHE 195.A O no hydrogen 2.700 N/A LYS 127.A N ASN 189.A OD1 no hydrogen 3.346 N/A LYS 127.A NZ ASP 134.A OD2 no hydrogen 3.290 N/A LYS 127.A NZ MET 182.A O no hydrogen 3.065 N/A THR 131.A OG1 ASP 129.A OD1 no hydrogen 3.559 N/A TYR 132.A N ASP 129.A OD2 no hydrogen 3.170 N/A TYR 132.A OH SER 190.A OG no hydrogen 3.008 N/A LYS 142.A N ASP 139.A O no hydrogen 3.182 N/A GLN 143.A N ASP 139.A O no hydrogen 3.145 N/A GLU 144.A N MET 140.A O no hydrogen 3.377 N/A ILE 145.A N GLN 141.A O no hydrogen 3.201 N/A ARG 146.A N LYS 142.A O no hydrogen 3.130 N/A ARG 146.A NE GLU 150.A OE1 no hydrogen 2.758 N/A ARG 146.A NH1 GLN 143.A OE1 no hydrogen 2.881 N/A ARG 146.A NH2 GLU 150.A OE1 no hydrogen 3.529 N/A ARG 146.A NH2 GLU 150.A OE2 no hydrogen 2.998 N/A GLU 147.A N GLN 143.A O no hydrogen 2.923 N/A ALA 148.A N GLU 144.A O no hydrogen 3.338 N/A VAL 149.A N ILE 145.A O no hydrogen 2.876 N/A LEU 151.A N ARG 146.A O no hydrogen 3.064 N/A VAL 154.A N GLU 150.A O no hydrogen 3.180 N/A GLN 155.A N LEU 151.A O no hydrogen 3.102 N/A GLU 160.A N ALA 156.A O no hydrogen 3.273 N/A GLN 161.A N ASP 157.A O no hydrogen 3.319 N/A ILE 162.A N LEU 158.A O no hydrogen 3.445 N/A GLY 163.A N TYR 159.A O no hydrogen 3.013 N/A GLY 169.A N ARG 294.A O no hydrogen 3.024 N/A LEU 171.A N ARG 297.A O no hydrogen 3.373 N/A LEU 172.A N MET 277.A O no hydrogen 3.066 N/A THR 178.A OG1 PRO 175.A O no hydrogen 2.965 N/A LEU 183.A N GLY 179.A O no hydrogen 3.238 N/A ALA 186.A N MET 182.A O no hydrogen 3.137 N/A VAL 187.A N VAL 184.A O no hydrogen 3.138 N/A ALA 188.A N VAL 184.A O no hydrogen 3.392 N/A ALA 188.A N LYS 185.A O no hydrogen 3.066 N/A ASN 189.A N LYS 185.A O no hydrogen 3.083 N/A ASN 189.A ND2 TYR 132.A OH no hydrogen 3.061 N/A SER 190.A N ALA 186.A O no hydrogen 3.340 N/A SER 190.A OG TYR 132.A OH no hydrogen 3.008 N/A SER 190.A OG ALA 186.A O no hydrogen 3.430 N/A THR 191.A N VAL 187.A O no hydrogen 2.993 N/A THR 191.A OG1 VAL 187.A O no hydrogen 2.885 N/A LYS 192.A NZ GLU 126.A OE1 no hydrogen 2.862 N/A LYS 192.A NZ ASN 189.A OD1 no hydrogen 3.543 N/A ILE 196.A N ILE 229.A O no hydrogen 3.184 N/A VAL 198.A N PHE 231.A O no hydrogen 3.470 N/A ASN 199.A ND2 GLU 202.A OE2 no hydrogen 2.897 N/A SER 201.A OG GLU 202.A OE1 no hydrogen 2.720 N/A GLU 202.A N ASN 199.A O no hydrogen 3.331 N/A VAL 204.A N GLY 200.A O no hydrogen 3.065 N/A HIS 205.A NE2 GLU 252.A OE1 no hydrogen 2.651 N/A VAL 215.A N PRO 212.A O no hydrogen 3.045 N/A ARG 216.A N PRO 212.A O no hydrogen 3.206 N/A ASP 217.A N ARG 213.A O no hydrogen 3.356 N/A VAL 218.A N MET 214.A O no hydrogen 3.204 N/A VAL 218.A N VAL 215.A O no hydrogen 3.205 N/A ARG 220.A N ARG 216.A O no hydrogen 3.422 N/A ARG 220.A NE ARG 216.A O no hydrogen 3.463 N/A LEU 221.A N ASP 217.A O no hydrogen 2.920 N/A ALA 222.A N VAL 218.A O no hydrogen 3.176 N/A ARG 223.A N PHE 219.A O no hydrogen 3.296 N/A GLU 224.A N ARG 220.A O no hydrogen 3.067 N/A ASN 225.A N LEU 221.A O no hydrogen 3.339 N/A SER 228.A OG ASN 225.A OD1 no hydrogen 2.981 N/A PHE 231.A N ILE 196.A O no hydrogen 3.469 N/A ILE 232.A N ILE 276.A O no hydrogen 3.247 N/A ASP 233.A N VAL 198.A O no hydrogen 3.198 N/A SER 237.A OG GLU 234.A OE2 no hydrogen 3.494 N/A ALA 239.A N VAL 235.A O no hydrogen 3.432 N/A THR 240.A OG1 ARG 242.A O no hydrogen 3.261 N/A ARG 242.A NH1 ASP 244.A OD2 no hydrogen 2.804 N/A ALA 245.A N ASP 244.A OD1 no hydrogen 2.668 N/A GLN 246.A N ASP 244.A OD1 no hydrogen 2.750 N/A THR 247.A N ASP 250.A OD2 no hydrogen 3.218 N/A THR 247.A OG1 ASP 250.A OD2 no hydrogen 3.300 N/A ASP 250.A N THR 247.A O no hydrogen 3.462 N/A GLN 254.A N ASP 250.A O no hydrogen 3.157 N/A ARG 255.A N ARG 251.A O no hydrogen 2.987 N/A ARG 255.A N GLU 252.A O no hydrogen 3.149 N/A ARG 255.A NE GLU 252.A OE1 no hydrogen 3.430 N/A ARG 255.A NE GLU 252.A OE2 no hydrogen 3.009 N/A ARG 255.A NH2 GLU 252.A OE2 no hydrogen 3.539 N/A LEU 257.A N VAL 253.A O no hydrogen 3.242 N/A ILE 258.A N GLN 254.A O no hydrogen 3.338 N/A GLU 259.A N ARG 255.A O no hydrogen 3.311 N/A LEU 260.A N ILE 256.A O no hydrogen 2.991 N/A LEU 261.A N LEU 257.A O no hydrogen 3.185 N/A THR 262.A N ILE 258.A O no hydrogen 3.102 N/A THR 262.A OG1 ILE 258.A O no hydrogen 3.348 N/A GLN 263.A N GLU 259.A O no hydrogen 3.407 N/A GLN 263.A NE2 GLU 259.A O no hydrogen 3.215 N/A MET 264.A N LEU 260.A O no hydrogen 3.010 N/A ASP 265.A N LEU 261.A O no hydrogen 3.287 N/A PHE 267.A N MET 264.A O no hydrogen 3.226 N/A ASN 272.A ND2 ALA 222.A O no hydrogen 3.075 N/A LYS 274.A NZ PRO 166.A O no hydrogen 3.477 N/A LYS 274.A NZ SER 270.A O no hydrogen 3.530 N/A ILE 276.A N ILE 230.A O no hydrogen 3.168 N/A MET 277.A N VAL 170.A O no hydrogen 3.155 N/A THR 279.A N LEU 172.A O no hydrogen 3.023 N/A THR 279.A OG1 LEU 172.A O no hydrogen 3.453 N/A ASN 280.A N ASP 236.A OD2 no hydrogen 3.245 N/A THR 284.A OG1 ASP 236.A O no hydrogen 3.498 N/A LEU 285.A N ALA 282.A O no hydrogen 3.209 N/A LEU 290.A N ASP 286.A O no hydrogen 3.378 N/A ARG 291.A NE ALA 288.A O no hydrogen 3.321 N/A ILE 299.A N LEU 171.A O no hydrogen 2.989 N/A ARG 307.A NH1 ASN 336.A O no hydrogen 3.238 N/A ARG 307.A NH2 ASN 336.A O no hydrogen 3.336 N/A ARG 310.A N ASP 306.A O no hydrogen 3.093 N/A ARG 311.A N ARG 307.A O no hydrogen 3.288 N/A ARG 311.A N ARG 308.A O no hydrogen 3.259 N/A PHE 314.A N ARG 310.A O no hydrogen 3.145 N/A GLY 315.A N ARG 311.A O no hydrogen 3.283 N/A THR 316.A N ILE 313.A O no hydrogen 3.123 N/A THR 316.A OG1 ILE 313.A O no hydrogen 2.650 N/A ILE 317.A N ILE 313.A O no hydrogen 3.453 N/A ALA 318.A N PHE 314.A O no hydrogen 2.996 N/A SER 319.A N GLY 315.A O no hydrogen 3.290 N/A SER 319.A OG GLY 315.A O no hydrogen 2.894 N/A SER 322.A OG LEU 323.A O no hydrogen 3.047 N/A SER 331.A OG ASP 328.A O no hydrogen 2.945 N/A ASN 336.A ND2 LEU 339.A O no hydrogen 3.552 N/A LEU 339.A N ASN 336.A OD1 no hydrogen 2.698 N/A VAL 343.A N SER 340.A O no hydrogen 3.308 N/A ILE 344.A N SER 340.A O no hydrogen 3.341 N/A ALA 345.A N GLY 341.A O no hydrogen 3.106 N/A ALA 346.A N ALA 342.A O no hydrogen 3.291 N/A ILE 347.A N VAL 343.A O no hydrogen 3.007 N/A MET 348.A N ILE 344.A O no hydrogen 3.235 N/A GLN 349.A N ALA 345.A O no hydrogen 3.158 N/A GLU 350.A N ALA 346.A O no hydrogen 3.387 N/A ALA 351.A N ILE 347.A O no hydrogen 3.147 N/A GLY 352.A N MET 348.A O no hydrogen 3.353 N/A LEU 353.A N GLU 350.A O no hydrogen 3.242 N/A ARG 354.A NE GLU 350.A O no hydrogen 3.436 N/A ARG 354.A NH2 ASP 367.A O no hydrogen 2.633 N/A ALA 355.A N ALA 351.A O no hydrogen 3.278 N/A ARG 357.A N ARG 354.A O no hydrogen 3.315 N/A LYS 358.A NZ ARG 354.A O no hydrogen 3.130 N/A LYS 358.A NZ ASP 367.A OD1 no hydrogen 3.273 N/A LYS 358.A NZ ASP 367.A OD2 no hydrogen 3.198 N/A ARG 360.A N ALA 355.A O no hydrogen 3.409 N/A LEU 364.A N ASP 367.A OD2 no hydrogen 3.177 N/A GLN 365.A N GLU 326.A OE2 no hydrogen 3.244 N/A GLN 365.A NE2 ASP 328.A O no hydrogen 3.105 N/A GLN 365.A NE2 SER 331.A OG no hydrogen 3.152 N/A SER 366.A OG GLU 326.A OE1 no hydrogen 3.397 N/A SER 366.A OG GLU 326.A OE2 no hydrogen 3.503 N/A GLU 369.A N GLN 365.A O no hydrogen 3.168 N/A GLU 370.A N SER 366.A O no hydrogen 3.052 N/A GLU 370.A N ASP 367.A O no hydrogen 3.113 N/A ALA 371.A N ASP 367.A O no hydrogen 3.043 N/A TYR 372.A N LEU 368.A O no hydrogen 3.016 N/A THR 374.A N GLU 370.A O no hydrogen 3.304 N/A THR 374.A OG1 GLU 370.A O no hydrogen 3.083 N/A THR 374.A OG1 ALA 371.A O no hydrogen 2.753 N/A PHE 385.A N THR 381.A O no hydrogen 2.909 N/A PHE 387.A N LYS 384.A O no hydrogen 3.198 N/A