Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8jfk_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N SER 1.A OG no hydrogen 3.387 N/A PHE 5.A N SER 1.A O no hydrogen 3.226 N/A TYR 6.A N ALA 2.A O no hydrogen 3.080 N/A GLU 7.A N GLN 3.A O no hydrogen 2.860 N/A ASN 8.A N PHE 5.A O no hydrogen 3.463 N/A TYR 9.A N PHE 5.A O no hydrogen 3.032 N/A GLU 10.A N ILE 27.A O no hydrogen 3.028 N/A LYS 12.A N ARG 25.A O no hydrogen 2.804 N/A LEU 15.A N VAL 23.A O no hydrogen 2.845 N/A GLY 16.A N VAL 23.A O no hydrogen 3.029 N/A SER 20.A OG ASP 41.A O no hydrogen 2.967 N/A VAL 22.A N VAL 39.A O no hydrogen 2.784 N/A VAL 23.A N GLY 16.A O no hydrogen 3.150 N/A ARG 24.A N VAL 37.A O no hydrogen 2.504 N/A ARG 25.A N GLU 13.A O no hydrogen 2.855 N/A ARG 25.A NE GLU 13.A OE2 no hydrogen 2.705 N/A ARG 25.A NH1 GLU 34.A OE1 no hydrogen 3.524 N/A ARG 25.A NH2 GLU 13.A OE2 no hydrogen 2.715 N/A CYS 26.A N TYR 35.A O no hydrogen 3.000 N/A CYS 26.A SG TYR 35.A O no hydrogen 3.141 N/A ILE 27.A N GLU 10.A O no hydrogen 3.040 N/A HIS 28.A N GLN 33.A O no hydrogen 3.351 N/A HIS 28.A ND1 ASN 8.A O no hydrogen 2.499 N/A LYS 29.A N ASN 8.A O no hydrogen 2.889 N/A LYS 29.A NZ TYR 6.A O no hydrogen 2.434 N/A LYS 29.A NZ TYR 9.A O no hydrogen 2.793 N/A THR 31.A N HIS 28.A O no hydrogen 3.088 N/A THR 31.A OG1 GLN 33.A OE1 no hydrogen 3.211 N/A SER 32.A N HIS 28.A O no hydrogen 2.407 N/A SER 32.A OG THR 31.A O no hydrogen 2.546 N/A TYR 35.A N CYS 26.A O no hydrogen 3.398 N/A TYR 35.A OH GLN 33.A OE1 no hydrogen 3.022 N/A ALA 36.A N PHE 93.A O no hydrogen 2.535 N/A VAL 37.A N ARG 24.A O no hydrogen 2.757 N/A LYS 38.A N LEU 91.A O no hydrogen 2.778 N/A VAL 39.A N VAL 22.A O no hydrogen 2.392 N/A ILE 40.A N PHE 89.A O no hydrogen 3.460 N/A ASP 41.A N SER 20.A O no hydrogen 2.886 N/A VAL 42.A N THR 87.A O no hydrogen 2.837 N/A GLY 44.A N ASP 41.A OD1 no hydrogen 2.784 N/A GLY 46.A N THR 43.A O no hydrogen 3.110 N/A SER 47.A N GLY 44.A O no hydrogen 3.468 N/A SER 49.A N GLU 52.A OE2 no hydrogen 2.868 N/A SER 49.A OG GLU 52.A OE2 no hydrogen 2.303 N/A VAL 53.A N SER 49.A O no hydrogen 2.771 N/A ARG 54.A N PRO 50.A O no hydrogen 2.816 N/A GLU 55.A N GLU 51.A O no hydrogen 2.568 N/A LEU 56.A N GLU 52.A O no hydrogen 2.688 N/A ARG 57.A N VAL 53.A O no hydrogen 3.322 N/A ARG 57.A NH2 ASN 86.A O no hydrogen 2.748 N/A GLU 58.A N ARG 54.A O no hydrogen 2.921 N/A ALA 59.A N GLU 55.A O no hydrogen 2.688 N/A THR 60.A N LEU 56.A O no hydrogen 2.706 N/A THR 60.A OG1 LEU 56.A O no hydrogen 2.413 N/A LEU 61.A N ARG 57.A O no hydrogen 2.419 N/A LYS 62.A N GLU 58.A O no hydrogen 2.822 N/A GLU 63.A N ALA 59.A O no hydrogen 2.808 N/A VAL 64.A N THR 60.A O no hydrogen 2.938 N/A ASP 65.A N LYS 62.A O no hydrogen 2.717 N/A ILE 66.A N LYS 62.A O no hydrogen 3.299 N/A LEU 67.A N GLU 63.A O no hydrogen 3.431 N/A ARG 68.A N ASP 65.A O no hydrogen 2.910 N/A LYS 69.A N ASP 65.A O no hydrogen 2.736 N/A LYS 69.A NZ GLN 163.A OE1 no hydrogen 3.069 N/A VAL 70.A N ILE 66.A O no hydrogen 3.036 N/A SER 71.A OG GLN 78.A OE1 no hydrogen 2.687 N/A GLY 72.A N GLN 78.A OE1 no hydrogen 3.040 N/A ASN 75.A ND2 ILE 153.A O no hydrogen 3.425 N/A GLN 78.A N ASP 94.A OD2 no hydrogen 3.483 N/A GLN 78.A NE2 SER 71.A OG no hydrogen 2.797 N/A LYS 80.A N VAL 92.A O no hydrogen 2.865 N/A LYS 80.A NZ TYR 35.A OH no hydrogen 3.074 N/A TYR 83.A N PHE 90.A O no hydrogen 2.795 N/A THR 85.A N PHE 88.A O no hydrogen 2.915 N/A THR 85.A OG1 PHE 88.A O no hydrogen 2.912 N/A PHE 88.A N THR 85.A OG1 no hydrogen 2.774 N/A PHE 89.A N ILE 40.A O no hydrogen 3.146 N/A PHE 90.A N TYR 83.A O no hydrogen 2.589 N/A LEU 91.A N LYS 38.A O no hydrogen 3.111 N/A VAL 92.A N ASP 81.A O no hydrogen 3.337 N/A PHE 93.A N ALA 36.A O no hydrogen 2.434 N/A LEU 101.A N PRO 142.A O no hydrogen 3.233 N/A LEU 101.A N ILE 145.A O no hydrogen 2.855 N/A TYR 104.A N GLU 100.A O no hydrogen 3.182 N/A LEU 105.A N LEU 101.A O no hydrogen 2.607 N/A THR 106.A N PHE 102.A O no hydrogen 2.862 N/A THR 106.A OG1 PHE 102.A O no hydrogen 2.994 N/A GLU 107.A N ASP 103.A O no hydrogen 3.137 N/A LYS 108.A N TYR 104.A O no hydrogen 2.946 N/A LYS 108.A NZ TYR 104.A OH no hydrogen 2.820 N/A LEU 111.A N LEU 212.A O no hydrogen 2.604 N/A GLU 115.A N SER 112.A OG no hydrogen 3.368 N/A THR 116.A N SER 112.A O no hydrogen 2.957 N/A ARG 117.A N GLU 113.A O no hydrogen 3.269 N/A ARG 117.A N LYS 114.A O no hydrogen 3.236 N/A ILE 119.A N GLU 115.A O no hydrogen 3.251 N/A MET 120.A N THR 116.A O no hydrogen 2.917 N/A ARG 121.A N ARG 117.A O no hydrogen 2.690 N/A ARG 121.A NH1 PHE 277.A O no hydrogen 2.758 N/A ARG 121.A NH2 PHE 277.A O no hydrogen 3.159 N/A ALA 122.A N LYS 118.A O no hydrogen 3.151 N/A LEU 123.A N ILE 119.A O no hydrogen 3.243 N/A LEU 124.A N MET 120.A O no hydrogen 2.520 N/A GLU 125.A N ARG 121.A O no hydrogen 2.968 N/A VAL 126.A N ALA 122.A O no hydrogen 2.392 N/A ILE 127.A N LEU 123.A O no hydrogen 2.650 N/A CYS 128.A N LEU 124.A O no hydrogen 2.774 N/A CYS 128.A SG LEU 124.A O no hydrogen 3.120 N/A THR 129.A N GLU 125.A O no hydrogen 3.468 N/A THR 129.A OG1 GLU 125.A O no hydrogen 2.988 N/A LEU 130.A N VAL 126.A O no hydrogen 3.189 N/A HIS 131.A N ILE 127.A O no hydrogen 2.964 N/A HIS 131.A ND1 ILE 127.A O no hydrogen 2.713 N/A HIS 131.A NE2 LYS 198.A O no hydrogen 2.389 N/A LYS 132.A N CYS 128.A O no hydrogen 2.781 N/A LEU 133.A N THR 129.A O no hydrogen 3.090 N/A ASN 134.A N HIS 131.A O no hydrogen 2.934 N/A ASN 134.A ND2 LEU 164.A O no hydrogen 2.731 N/A ILE 135.A N LEU 130.A O no hydrogen 2.652 N/A HIS 137.A N ASP 201.A OD1 no hydrogen 3.307 N/A HIS 137.A N ASP 201.A OD2 no hydrogen 3.187 N/A HIS 137.A NE2 ASP 157.A O no hydrogen 2.565 N/A ARG 138.A N ASP 201.A OD1 no hydrogen 3.203 N/A ARG 138.A NE TYR 196.A OH no hydrogen 3.189 N/A LYS 141.A NZ THR 176.A OG1 no hydrogen 2.569 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.642 N/A ASN 144.A N LYS 141.A O no hydrogen 2.841 N/A ILE 145.A N PRO 142.A O no hydrogen 2.931 N/A LEU 146.A N LYS 154.A O no hydrogen 2.902 N/A LEU 147.A N GLY 99.A O no hydrogen 3.424 N/A ASP 148.A N ASN 152.A O no hydrogen 3.299 N/A ASN 150.A N ASP 148.A OD1 no hydrogen 3.085 N/A MET 151.A N ASP 148.A O no hydrogen 3.138 N/A ASN 152.A N ASP 148.A OD1 no hydrogen 2.825 N/A LYS 154.A N LEU 146.A O no hydrogen 2.489 N/A LYS 154.A NZ PRO 74.A O no hydrogen 2.463 N/A LYS 154.A NZ ILE 153.A O no hydrogen 2.930 N/A LEU 155.A N ASN 75.A O no hydrogen 3.119 N/A THR 156.A N ASN 144.A O no hydrogen 2.524 N/A THR 156.A OG1 LYS 154.A O no hydrogen 2.771 N/A CYS 162.A N VAL 136.A O no hydrogen 3.362 N/A CYS 162.A SG GLN 163.A O no hydrogen 3.773 N/A LEU 170.A N TYR 196.A O no hydrogen 2.949 N/A ARG 171.A NE HIS 193.A O no hydrogen 2.930 N/A ARG 171.A NH2 HIS 193.A O no hydrogen 2.468 N/A CYS 174.A SG GLU 172.A O no hydrogen 3.592 N/A SER 178.A OG PHE 219.A O no hydrogen 3.464 N/A LEU 180.A N PRO 177.A O no hydrogen 3.283 N/A GLU 183.A N GLU 183.A OE2 no hydrogen 2.440 N/A ILE 184.A N ALA 181.A O no hydrogen 3.000 N/A GLU 186.A N PRO 182.A O no hydrogen 3.116 N/A CYS 187.A N GLU 183.A O no hydrogen 2.790 N/A CYS 187.A SG GLU 183.A O no hydrogen 3.179 N/A CYS 187.A SG HIS 193.A ND1 no hydrogen 3.150 N/A CYS 187.A SG HIS 193.A O no hydrogen 3.830 N/A SER 188.A N ILE 184.A O no hydrogen 3.109 N/A SER 188.A OG ILE 185.A O no hydrogen 2.417 N/A MET 189.A N ILE 185.A O no hydrogen 2.791 N/A MET 189.A N GLU 186.A O no hydrogen 3.058 N/A TYR 196.A N LEU 170.A O no hydrogen 3.123 N/A TYR 196.A OH GLU 172.A O no hydrogen 3.027 N/A VAL 200.A N GLY 197.A O no hydrogen 3.385 N/A MET 202.A N GLU 199.A O no hydrogen 3.227 N/A TRP 203.A N VAL 200.A O no hydrogen 3.213 N/A SER 204.A N VAL 200.A O no hydrogen 3.474 N/A SER 204.A OG TYR 179.A O no hydrogen 3.004 N/A THR 205.A N ASP 201.A O no hydrogen 3.009 N/A THR 205.A OG1 ASP 201.A O no hydrogen 3.411 N/A GLY 206.A N MET 202.A O no hydrogen 3.085 N/A VAL 207.A N TRP 203.A O no hydrogen 3.045 N/A VAL 207.A N SER 204.A O no hydrogen 3.230 N/A ILE 208.A N SER 204.A O no hydrogen 3.407 N/A TYR 210.A OH GLN 237.A O no hydrogen 3.142 N/A THR 211.A N VAL 207.A O no hydrogen 3.036 N/A THR 211.A OG1 VAL 207.A O no hydrogen 3.421 N/A THR 211.A OG1 ILE 208.A O no hydrogen 2.646 N/A LEU 212.A N ILE 208.A O no hydrogen 2.636 N/A LEU 213.A N MET 209.A O no hydrogen 3.122 N/A GLY 215.A N THR 211.A O no hydrogen 2.659 N/A TRP 220.A NE1 GLN 352.A O no hydrogen 3.237 N/A LYS 223.A N HIS 221.A ND1 no hydrogen 3.130 N/A LEU 228.A N MET 225.A O no hydrogen 2.888 N/A ARG 229.A N MET 225.A O no hydrogen 3.313 N/A ARG 229.A NE MET 225.A O no hydrogen 2.528 N/A MET 230.A N LEU 226.A O no hydrogen 3.335 N/A ILE 231.A N MET 227.A O no hydrogen 3.095 N/A ILE 231.A N LEU 228.A O no hydrogen 2.787 N/A MET 232.A N LEU 228.A O no hydrogen 2.938 N/A SER 233.A N ARG 229.A O no hydrogen 3.220 N/A SER 233.A OG ARG 229.A O no hydrogen 2.112 N/A SER 233.A OG ASN 235.A OD1 no hydrogen 3.079 N/A GLY 234.A N MET 230.A O no hydrogen 3.062 N/A ASN 235.A N MET 230.A O no hydrogen 3.213 N/A SER 240.A OG ASP 244.A OD1 no hydrogen 3.013 N/A SER 240.A OG ASP 244.A OD2 no hydrogen 2.593 N/A TRP 243.A N GLY 239.A O no hydrogen 2.783 N/A SER 247.A N GLU 113.A OE2 no hydrogen 3.147 N/A VAL 250.A N SER 247.A O no hydrogen 3.032 N/A LYS 251.A NZ TYR 246.A O no hydrogen 2.900 N/A LYS 251.A NZ SER 247.A O no hydrogen 2.312 N/A VAL 254.A N VAL 250.A O no hydrogen 3.198 N/A SER 255.A N LYS 251.A O no hydrogen 3.056 N/A SER 255.A OG LYS 251.A O no hydrogen 3.197 N/A SER 255.A OG ASP 252.A O no hydrogen 2.512 N/A ARG 256.A N ASP 252.A O no hydrogen 3.020 N/A LEU 258.A N VAL 254.A O no hydrogen 3.200 N/A LEU 258.A N SER 255.A O no hydrogen 2.975 N/A ASN 264.A N GLN 261.A OE1 no hydrogen 2.762 N/A ARG 265.A N PRO 262.A O no hydrogen 2.889 N/A ARG 265.A NH1 GLU 199.A O no hydrogen 3.055 N/A ARG 265.A NH2 VAL 260.A O no hydrogen 3.554 N/A THR 267.A N GLU 270.A OE2 no hydrogen 2.788 N/A ALA 271.A N THR 267.A O no hydrogen 2.664 N/A LEU 272.A N ALA 268.A O no hydrogen 3.199 N/A ALA 273.A N GLU 270.A O no hydrogen 3.001 N/A HIS 274.A N ALA 271.A O no hydrogen 3.366 N/A HIS 274.A NE2 ASP 252.A OD2 no hydrogen 2.725 N/A PHE 276.A N HIS 274.A ND1 no hydrogen 2.794 N/A PHE 277.A N HIS 274.A O no hydrogen 3.174 N/A GLN 278.A N PRO 275.A O no hydrogen 3.354 N/A GLN 279.A N GLN 279.A OE1 no hydrogen 2.761 N/A GLU 284.A N VAL 282.A O no hydrogen 3.026 N/A ARG 286.A NH1 GLU 284.A OE1 no hydrogen 2.785 N/A GLY 292.A N SER 289.A OG no hydrogen 3.203 N/A LYS 293.A N SER 289.A O no hydrogen 2.821 N/A PHE 294.A N PRO 290.A O no hydrogen 2.999 N/A LYS 295.A N ARG 291.A O no hydrogen 2.919 N/A VAL 296.A N GLY 292.A O no hydrogen 3.112 N/A ILE 297.A N LYS 293.A O no hydrogen 3.078 N/A ALA 298.A N PHE 294.A O no hydrogen 2.991 N/A LEU 299.A N LYS 295.A O no hydrogen 2.474 N/A THR 300.A N VAL 296.A O no hydrogen 2.544 N/A THR 300.A OG1 VAL 296.A O no hydrogen 2.574 N/A VAL 301.A N ILE 297.A O no hydrogen 2.911 N/A LEU 302.A N ALA 298.A O no hydrogen 2.529 N/A ALA 303.A N LEU 299.A O no hydrogen 2.554 N/A SER 304.A N THR 300.A O no hydrogen 3.223 N/A VAL 305.A N VAL 301.A O no hydrogen 2.828 N/A ARG 306.A N LEU 302.A O no hydrogen 3.016 N/A ILE 307.A N ALA 303.A O no hydrogen 2.870 N/A TYR 308.A N SER 304.A O no hydrogen 3.331 N/A TYR 309.A N VAL 305.A O no hydrogen 2.992 N/A GLN 310.A N ARG 306.A O no hydrogen 2.814 N/A TYR 311.A N ILE 307.A O no hydrogen 3.192 N/A ARG 312.A N TYR 308.A O no hydrogen 3.056 N/A ARG 312.A NH1 TYR 308.A OH no hydrogen 3.478 N/A ARG 313.A N TYR 309.A O no hydrogen 3.148 N/A VAL 314.A N GLN 310.A O no hydrogen 3.383 N/A GLU 320.A N THR 318.A OG1 no hydrogen 3.232 N/A ILE 323.A N ARG 319.A O no hydrogen 3.218 N/A ARG 324.A N GLU 320.A O no hydrogen 2.849 N/A ASP 325.A N ILE 321.A O no hydrogen 3.077 N/A TYR 327.A OH ASP 337.A OD1 no hydrogen 3.081 N/A ARG 330.A NE ASP 245.A OD2 no hydrogen 3.467 N/A ARG 333.A N LEU 329.A O no hydrogen 3.225 N/A ARG 333.A NE TYR 327.A O no hydrogen 3.086 N/A ARG 334.A N ARG 330.A O no hydrogen 2.993 N/A ILE 336.A N LEU 332.A O no hydrogen 2.903 N/A ASP 337.A N ARG 333.A O no hydrogen 2.946 N/A ALA 338.A N ARG 334.A O no hydrogen 2.873 N/A TYR 339.A N LEU 335.A O no hydrogen 2.873 N/A ALA 340.A N ILE 336.A O no hydrogen 2.793 N/A PHE 341.A N ASP 337.A O no hydrogen 3.048 N/A PHE 341.A N ALA 338.A O no hydrogen 3.245 N/A ARG 342.A N ALA 338.A O no hydrogen 3.230 N/A TYR 344.A N ALA 340.A O no hydrogen 3.306 N/A TRP 347.A N TYR 344.A O no hydrogen 3.184 N/A LYS 349.A N GLN 354.A O no hydrogen 2.861 N/A LYS 350.A NZ GLU 100.A OE1 no hydrogen 2.478 N/A LYS 350.A NZ GLU 100.A OE2 no hydrogen 3.449 N/A GLN 352.A NE2 LYS 223.A O no hydrogen 2.723 N/A GLN 353.A NE2 ARG 222.A O no hydrogen 2.223 N/A GLN 353.A NE2 GLN 352.A OE1 no hydrogen 3.019 N/A ARG 356.A NH1 LEU 105.A O no hydrogen 3.211 N/A ARG 356.A NH2 THR 106.A OG1 no hydrogen 2.914 N/A ALA 358.A N ASN 355.A O no hydrogen 3.273 N/A LEU 359.A N ARG 356.A O no hydrogen 3.023 N/A PHE 360.A N ALA 357.A O no hydrogen 3.064 N/A THR 363.A OG1 PRO 364.A O no hydrogen 3.172 N/A LYS 365.A NZ GLU 361.A OE2 no hydrogen 3.350 N/A LEU 368.A N PRO 364.A O no hydrogen 3.111 N/A LEU 369.A N LYS 365.A O no hydrogen 2.829 N/A SER 370.A N VAL 367.A O no hydrogen 3.437 N/A SER 370.A OG VAL 367.A O no hydrogen 2.836 N/A