Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ly6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 6.A N HIS 41.A O no hydrogen 2.727 N/A ARG 6.A NH2 GLU 43.A OE2 no hydrogen 3.518 N/A ASN 14.A ND2 TRP 37.A O no hydrogen 3.109 N/A ARG 16.A N GLU 12.A O no hydrogen 3.284 N/A ASP 17.A N THR 13.A O no hydrogen 3.173 N/A HIS 18.A N ASN 14.A O no hydrogen 2.789 N/A HIS 18.A NE2 PRO 35.A O no hydrogen 2.982 N/A THR 20.A N GLY 15.A O no hydrogen 2.861 N/A THR 20.A OG1 VAL 29.A O no hydrogen 2.787 N/A CYS 24.A N ALA 21.A O no hydrogen 2.889 N/A CYS 24.A SG THR 20.A O no hydrogen 3.282 N/A CYS 24.A SG THR 20.A OG1 no hydrogen 3.750 N/A CYS 24.A SG VAL 29.A O no hydrogen 3.567 N/A ARG 25.A N LEU 23.A O no hydrogen 3.235 N/A ARG 25.A NH2 PHE 180.A O no hydrogen 3.209 N/A VAL 30.A N ILE 131.A O no hydrogen 2.815 N/A ARG 31.A N HIS 18.A ND1 no hydrogen 2.859 N/A ARG 31.A NE HIS 18.A O no hydrogen 2.718 N/A ARG 31.A NE HIS 19.A O no hydrogen 3.412 N/A ARG 31.A NH1 PHE 134.A O no hydrogen 3.298 N/A ARG 31.A NH2 HIS 19.A O no hydrogen 2.933 N/A ARG 32.A N LEU 133.A O no hydrogen 2.952 N/A ARG 32.A NE ASP 141.A OD2 no hydrogen 2.628 N/A ARG 32.A NH1 ALA 105.A O no hydrogen 3.182 N/A ARG 32.A NH1 SER 210.A O no hydrogen 2.691 N/A ARG 32.A NH2 ASP 141.A OD1 no hydrogen 2.717 N/A ARG 32.A NH2 SER 210.A O no hydrogen 3.362 N/A GLN 34.A NE2 ASP 17.A O no hydrogen 3.055 N/A PHE 36.A N LEU 99.A O no hydrogen 3.111 N/A LEU 40.A N LEU 95.A O no hydrogen 2.965 N/A PHE 42.A N CYS 93.A O no hydrogen 3.108 N/A ARG 45.A NH1 ASP 52.A OD1 no hydrogen 2.915 N/A ARG 45.A NH2 ASP 52.A OD1 no hydrogen 3.100 N/A ARG 45.A NH2 ASP 52.A OD2 no hydrogen 3.161 N/A ASN 46.A ND2 THR 94.A O no hydrogen 3.453 N/A TYR 47.A N ASN 46.A OD1 no hydrogen 2.540 N/A TYR 47.A OH ASP 52.A O no hydrogen 3.189 N/A GLU 48.A N ASP 52.A OD1 no hydrogen 3.077 N/A ASP 52.A N GLU 48.A O no hydrogen 2.728 N/A SER 53.A N SER 117.A O no hydrogen 3.148 N/A THR 55.A N GLU 115.A O no hydrogen 2.799 N/A THR 55.A OG1 PHE 56.A O no hydrogen 3.289 N/A PHE 56.A N PHE 74.A O no hydrogen 2.737 N/A SER 57.A N SER 113.A O no hydrogen 3.170 N/A VAL 58.A N ALA 72.A O no hydrogen 2.681 N/A VAL 59.A N ARG 111.A O no hydrogen 3.330 N/A THR 60.A N THR 70.A O no hydrogen 2.832 N/A THR 60.A OG1 LEU 109.A O no hydrogen 2.877 N/A ALA 68.A N SER 65.A OG no hydrogen 2.619 N/A THR 70.A N SER 65.A O no hydrogen 3.069 N/A ALA 72.A N VAL 58.A O no hydrogen 2.797 N/A PHE 74.A N PHE 56.A O no hydrogen 2.643 N/A ARG 77.A N ALA 85.A O no hydrogen 3.178 N/A THR 84.A N THR 100.A O no hydrogen 3.253 N/A THR 86.A N GLN 98.A O no hydrogen 3.126 N/A VAL 87.A N ARG 77.A O no hydrogen 2.764 N/A VAL 88.A N SER 96.A O no hydrogen 3.120 N/A GLN 90.A N ASP 89.A OD2 no hydrogen 2.438 N/A GLN 90.A NE2 TYR 47.A O no hydrogen 3.324 N/A GLN 91.A N THR 94.A O no hydrogen 3.199 N/A CYS 93.A SG GLY 44.A O no hydrogen 3.382 N/A CYS 93.A SG ASP 92.A O no hydrogen 3.103 N/A THR 94.A N GLN 91.A O no hydrogen 3.077 N/A THR 94.A OG1 GLN 91.A O no hydrogen 2.831 N/A LEU 95.A N LEU 40.A O no hydrogen 2.580 N/A LEU 97.A N LEU 38.A O no hydrogen 2.947 N/A GLN 98.A N THR 86.A O no hydrogen 2.881 N/A LEU 99.A N PHE 36.A O no hydrogen 3.472 N/A THR 100.A N THR 84.A O no hydrogen 3.157 N/A THR 101.A OG1 GLN 34.A O no hydrogen 3.468 N/A ILE 107.A N ARG 209.A O no hydrogen 2.940 N/A GLY 108.A N LEU 132.A O no hydrogen 3.283 N/A TYR 110.A N PHE 130.A O no hydrogen 2.830 N/A TYR 110.A OH PRO 106.A O no hydrogen 2.609 N/A ARG 111.A N VAL 59.A O no hydrogen 2.905 N/A LEU 112.A N GLY 128.A O no hydrogen 2.930 N/A SER 113.A N SER 57.A O no hydrogen 2.724 N/A SER 113.A OG SER 57.A O no hydrogen 3.563 N/A LEU 114.A N PHE 125.A O no hydrogen 2.675 N/A GLU 115.A N THR 55.A O no hydrogen 2.654 N/A ALA 116.A N SER 123.A O no hydrogen 3.033 N/A THR 118.A OG1 ASP 52.A OD2 no hydrogen 2.848 N/A THR 118.A OG1 THR 118.A O no hydrogen 2.613 N/A TYR 120.A N GLN 121.A OE1 no hydrogen 3.131 N/A GLN 121.A N GLN 121.A OE1 no hydrogen 2.698 N/A GLN 121.A NE2 GLU 1.A O no hydrogen 2.972 N/A PHE 125.A N LEU 114.A O no hydrogen 2.995 N/A LEU 127.A N LEU 112.A O no hydrogen 2.640 N/A PHE 130.A N TYR 110.A O no hydrogen 3.167 N/A ILE 131.A N LEU 28.A O no hydrogen 2.850 N/A LEU 132.A N GLY 108.A O no hydrogen 3.062 N/A LEU 133.A N VAL 30.A O no hydrogen 2.765 N/A PHE 134.A N LEU 286.A O no hydrogen 2.928 N/A ASN 135.A N ASP 141.A OD2 no hydrogen 2.896 N/A ASN 135.A ND2 ARG 31.A O no hydrogen 3.400 N/A ASN 135.A ND2 ARG 32.A O no hydrogen 3.221 N/A ASN 135.A ND2 GLN 34.A OE1 no hydrogen 3.207 N/A TRP 137.A N ASN 135.A OD1 no hydrogen 2.759 N/A CYS 138.A SG GLY 33.A O no hydrogen 3.386 N/A ASP 141.A N CYS 138.A O no hydrogen 2.890 N/A VAL 143.A N ASP 141.A OD1 no hydrogen 3.044 N/A TYR 144.A N ASP 141.A O no hydrogen 3.365 N/A LEU 145.A N ALA 136.A O no hydrogen 2.987 N/A SER 147.A N ASP 146.A OD1 no hydrogen 2.580 N/A ARG 151.A N SER 147.A O no hydrogen 3.076 N/A ARG 151.A NE LEU 145.A O no hydrogen 2.645 N/A ARG 151.A NH1 GLU 148.A OE2 no hydrogen 2.436 N/A ARG 151.A NH2 LEU 145.A O no hydrogen 3.196 N/A GLN 152.A N GLU 148.A O no hydrogen 2.986 N/A GLU 153.A N GLU 149.A O no hydrogen 2.792 N/A TYR 154.A N GLU 150.A O no hydrogen 2.943 N/A VAL 155.A N ARG 151.A O no hydrogen 3.017 N/A THR 157.A N GLN 152.A O no hydrogen 2.832 N/A THR 157.A OG1 GLN 152.A O no hydrogen 3.105 N/A GLN 159.A NE2 ASN 176.A OD1 no hydrogen 2.902 N/A GLY 160.A N TRP 175.A O no hydrogen 2.877 N/A ILE 162.A N ILE 173.A O no hydrogen 2.850 N/A GLN 164.A N LYS 171.A O no hydrogen 2.758 N/A SER 166.A N PHE 169.A O no hydrogen 3.197 N/A SER 166.A OG ASP 576.A O no hydrogen 2.847 N/A PHE 169.A N SER 166.A O no hydrogen 3.140 N/A LYS 171.A N GLN 164.A O no hydrogen 2.983 N/A LYS 171.A NZ GLU 580.A OE1 no hydrogen 2.745 N/A LYS 171.A NZ GLU 580.A OE2 no hydrogen 3.079 N/A ILE 173.A N ILE 162.A O no hydrogen 2.867 N/A TRP 175.A N GLY 160.A O no hydrogen 2.774 N/A TRP 175.A NE1 SER 252.A OG no hydrogen 2.902 N/A ASN 176.A N ILE 250.A O no hydrogen 3.056 N/A PHE 177.A N GLN 158.A O no hydrogen 2.691 N/A GLY 178.A N GLN 158.A O no hydrogen 3.181 N/A GLN 179.A NE2 THR 157.A O no hydrogen 3.434 N/A PHE 180.A N GLN 158.A OE1 no hydrogen 3.112 N/A GLU 181.A N GLY 178.A O no hydrogen 2.813 N/A ILE 184.A N GLU 181.A O no hydrogen 3.095 N/A ILE 187.A N GLY 183.A O no hydrogen 3.065 N/A CYS 188.A N ILE 184.A O no hydrogen 3.119 N/A CYS 188.A N LEU 185.A O no hydrogen 2.643 N/A CYS 188.A SG ILE 184.A O no hydrogen 3.329 N/A LEU 189.A N LEU 185.A O no hydrogen 3.027 N/A ILE 190.A N ASP 186.A O no hydrogen 3.026 N/A LEU 191.A N ILE 187.A O no hydrogen 2.907 N/A LEU 192.A N CYS 188.A O no hydrogen 3.130 N/A LEU 192.A N LEU 189.A O no hydrogen 2.862 N/A ASP 193.A N LEU 189.A O no hydrogen 2.854 N/A ASN 195.A N LEU 192.A O no hydrogen 3.409 N/A ASN 195.A ND2 LEU 192.A O no hydrogen 2.491 N/A ASN 195.A ND2 ASP 205.A OD2 no hydrogen 3.417 N/A PHE 198.A N ASN 195.A O no hydrogen 2.898 N/A LEU 199.A N ASN 195.A O no hydrogen 3.114 N/A LYS 200.A N PRO 196.A O no hydrogen 2.811 N/A ASN 201.A N PHE 198.A O no hydrogen 3.293 N/A ARG 204.A NE ASN 201.A OD1 no hydrogen 3.561 N/A ASP 205.A N ASN 201.A O no hydrogen 3.089 N/A CYS 206.A N ALA 202.A O no hydrogen 2.882 N/A SER 207.A N GLY 203.A O no hydrogen 2.850 N/A SER 207.A N ARG 204.A O no hydrogen 3.198 N/A SER 207.A OG ALA 68.A O no hydrogen 3.196 N/A ARG 208.A N ARG 204.A O no hydrogen 3.059 N/A ARG 209.A NE ASP 205.A OD1 no hydrogen 2.901 N/A ARG 209.A NH1 ASP 193.A OD1 no hydrogen 2.964 N/A ARG 209.A NH2 ASP 193.A OD1 no hydrogen 2.813 N/A ARG 209.A NH2 ASP 205.A OD1 no hydrogen 2.906 N/A SER 210.A OG SER 207.A O no hydrogen 3.514 N/A SER 211.A N ARG 208.A O no hydrogen 2.988 N/A TYR 214.A N SER 211.A OG no hydrogen 3.083 N/A TYR 214.A OH ASP 205.A OD2 no hydrogen 2.688 N/A VAL 215.A N SER 211.A O no hydrogen 2.933 N/A GLY 216.A N PRO 212.A O no hydrogen 2.789 N/A ARG 217.A N VAL 213.A O no hydrogen 3.341 N/A ARG 217.A NH1 GLY 367.A O no hydrogen 3.411 N/A VAL 218.A N TYR 214.A O no hydrogen 3.062 N/A GLY 219.A N VAL 215.A O no hydrogen 2.869 N/A SER 220.A N GLY 216.A O no hydrogen 2.992 N/A GLY 221.A N ARG 217.A O no hydrogen 3.093 N/A MET 222.A N VAL 218.A O no hydrogen 2.965 N/A MET 222.A N GLY 219.A O no hydrogen 2.871 N/A VAL 223.A N SER 220.A O no hydrogen 3.378 N/A CYS 225.A SG SER 220.A O no hydrogen 4.020 N/A CYS 225.A SG GLY 221.A O no hydrogen 3.685 N/A CYS 225.A SG PRO 354.A O no hydrogen 3.733 N/A VAL 231.A N VAL 223.A O no hydrogen 3.173 N/A LEU 232.A N VAL 223.A O no hydrogen 2.941 N/A LEU 233.A N VAL 267.A O no hydrogen 3.031 N/A ARG 235.A NE ASP 237.A OD1 no hydrogen 2.852 N/A ARG 235.A NH2 ASP 237.A OD1 no hydrogen 2.936 N/A ASN 239.A N ASP 237.A OD2 no hydrogen 2.793 N/A VAL 244.A N LYS 268.A O no hydrogen 3.110 N/A SER 248.A N SER 245.A O no hydrogen 2.586 N/A SER 248.A OG GLU 664.A OE2 no hydrogen 3.396 N/A TRP 249.A NE1 TYR 269.A O no hydrogen 2.916 N/A SER 252.A OG ALA 277.A O no hydrogen 3.349 N/A SER 252.A OG THR 281.A OG1 no hydrogen 2.543 N/A LEU 256.A N SER 252.A O no hydrogen 2.940 N/A ARG 257.A N VAL 253.A O no hydrogen 3.372 N/A ARG 257.A NH2 ASP 182.A O no hydrogen 2.948 N/A ARG 258.A N ASP 254.A O no hydrogen 2.836 N/A ARG 258.A NE ASP 254.A OD1 no hydrogen 2.982 N/A TRP 259.A N ILE 255.A O no hydrogen 2.922 N/A TRP 259.A N LEU 256.A O no hydrogen 3.096 N/A TRP 259.A NE1 GLY 230.A O no hydrogen 2.646 N/A LYS 260.A N LEU 256.A O no hydrogen 3.108 N/A ASN 261.A N ARG 257.A O no hydrogen 2.770 N/A HIS 262.A N TRP 259.A O no hydrogen 3.385 N/A CYS 264.A N LYS 260.A O no hydrogen 3.443 N/A GLN 265.A N TRP 259.A O no hydrogen 3.315 N/A ARG 266.A NH1 ASP 227.A OD2 no hydrogen 3.207 N/A VAL 267.A N VAL 231.A O no hydrogen 2.601 N/A LYS 268.A NZ TYR 269.A OH no hydrogen 2.889 N/A TYR 269.A OH ASP 242.A OD1 no hydrogen 3.203 N/A TYR 269.A OH ASP 242.A OD2 no hydrogen 2.782 N/A GLY 270.A N LEU 233.A O no hydrogen 3.168 N/A GLN 271.A NE2 ARG 235.A O no hydrogen 2.745 N/A CYS 272.A SG HIS 330.A ND1 no hydrogen 3.421 N/A CYS 272.A SG TYR 511.A OH no hydrogen 2.666 N/A PHE 275.A N GLN 271.A O no hydrogen 2.965 N/A ALA 276.A N CYS 272.A O no hydrogen 3.036 N/A ALA 277.A N TRP 273.A O no hydrogen 2.873 N/A VAL 278.A N VAL 274.A O no hydrogen 3.200 N/A ALA 279.A N PHE 275.A O no hydrogen 2.914 N/A CYS 280.A N ALA 276.A O no hydrogen 2.849 N/A CYS 280.A SG THR 290.A O no hydrogen 3.677 N/A THR 281.A N ALA 277.A O no hydrogen 2.958 N/A THR 281.A OG1 PHE 177.A O no hydrogen 3.013 N/A THR 281.A OG1 SER 252.A OG no hydrogen 2.543 N/A THR 281.A OG1 ALA 277.A O no hydrogen 3.162 N/A VAL 282.A N VAL 278.A O no hydrogen 2.733 N/A LEU 283.A N ALA 279.A O no hydrogen 2.938 N/A ARG 284.A N CYS 280.A O no hydrogen 3.007 N/A ARG 284.A NE THR 290.A O no hydrogen 2.770 N/A ARG 284.A NH1 THR 157.A O no hydrogen 2.797 N/A ARG 284.A NH2 THR 290.A O no hydrogen 2.951 N/A CYS 285.A N THR 281.A O no hydrogen 3.166 N/A CYS 285.A SG GLN 179.A O no hydrogen 3.356 N/A LEU 286.A N VAL 282.A O no hydrogen 3.070 N/A GLY 287.A N ARG 284.A O no hydrogen 3.117 N/A ILE 288.A N LEU 283.A O no hydrogen 3.078 N/A THR 290.A N TYR 154.A O no hydrogen 3.138 N/A THR 290.A OG1 ILE 288.A O no hydrogen 2.800 N/A THR 290.A OG1 SER 335.A OG no hydrogen 2.627 N/A ARG 291.A N GLU 334.A O no hydrogen 3.007 N/A ARG 291.A NE GLU 334.A OE1 no hydrogen 2.805 N/A ARG 291.A NH1 TYR 154.A OH no hydrogen 3.165 N/A ARG 291.A NH2 GLU 334.A OE1 no hydrogen 2.700 N/A VAL 293.A N TRP 332.A O no hydrogen 2.796 N/A THR 294.A N SER 422.A O no hydrogen 2.737 N/A THR 294.A OG1 TYR 163.A O no hydrogen 2.769 N/A ASN 295.A N HIS 330.A O no hydrogen 2.970 N/A ASN 295.A ND2 SER 298.A OG no hydrogen 2.838 N/A ASN 295.A ND2 GLU 391.A O no hydrogen 3.333 N/A TYR 296.A N LEU 419.A O no hydrogen 3.244 N/A TYR 296.A OH GLN 164.A O no hydrogen 2.813 N/A ASN 297.A N ASN 328.A O no hydrogen 2.792 N/A ASN 297.A ND2 ILE 416.A O no hydrogen 2.804 N/A SER 298.A N TRP 327.A O no hydrogen 3.015 N/A SER 298.A OG GLU 391.A OE1 no hydrogen 2.783 N/A ALA 299.A N GLU 391.A O no hydrogen 3.207 N/A HIS 300.A ND1 GLU 391.A OE2 no hydrogen 2.749 N/A ASN 303.A ND2 LYS 359.A O no hydrogen 3.336 N/A SER 304.A OG PRO 386.A O no hydrogen 3.055 N/A ILE 308.A N ASP 395.A O no hydrogen 2.864 N/A TYR 310.A N VAL 397.A O no hydrogen 3.034 N/A TYR 310.A OH GLU 324.A O no hydrogen 2.685 N/A ARG 312.A N TRP 399.A O no hydrogen 2.807 N/A ARG 312.A NE ASP 398.A OD1 no hydrogen 2.693 N/A ARG 312.A NH1 GLY 316.A O no hydrogen 2.641 N/A ARG 312.A NH1 GLU 574.A OE2 no hydrogen 2.725 N/A ARG 312.A NH2 ASP 398.A OD1 no hydrogen 2.710 N/A ARG 312.A NH2 GLU 574.A OE1 no hydrogen 3.239 N/A ARG 312.A NH2 GLU 574.A OE2 no hydrogen 3.385 N/A ASN 313.A N GLU 317.A O no hydrogen 3.302 N/A GLU 314.A N GLU 314.A OE2 no hydrogen 2.612 N/A GLY 316.A N ASN 313.A O no hydrogen 3.167 N/A GLU 317.A N ASN 313.A OD1 no hydrogen 3.102 N/A GLN 319.A NE2 GLN 401.A OE1 no hydrogen 3.591 N/A GLY 320.A N PHE 311.A O no hydrogen 2.872 N/A TRP 327.A N SER 298.A O no hydrogen 2.861 N/A ASN 328.A N TYR 511.A O no hydrogen 3.150 N/A HIS 330.A N ASN 295.A O no hydrogen 2.938 N/A HIS 330.A NE2 ASP 353.A OD2 no hydrogen 2.494 N/A CYS 331.A SG THR 294.A OG1 no hydrogen 3.418 N/A TRP 332.A N VAL 293.A O no hydrogen 3.192 N/A TRP 332.A NE1 TYR 438.A OH no hydrogen 2.895 N/A VAL 333.A N LEU 352.A O no hydrogen 2.941 N/A GLU 334.A N ARG 291.A O no hydrogen 3.022 N/A SER 335.A N GLN 350.A O no hydrogen 2.840 N/A SER 335.A OG THR 290.A OG1 no hydrogen 2.627 N/A TRP 336.A N PRO 289.A O no hydrogen 2.828 N/A TRP 336.A NE1 TYR 144.A O no hydrogen 2.634 N/A MET 337.A N GLY 348.A O no hydrogen 3.112 N/A THR 338.A N ALA 142.A O no hydrogen 2.749 N/A ARG 339.A NH1 LYS 382.A O no hydrogen 3.489 N/A LEU 342.A N ARG 339.A O no hydrogen 3.081 N/A GLN 343.A N GLN 343.A OE1 no hydrogen 2.468 N/A GLY 345.A N GLU 347.A OE2 no hydrogen 2.486 N/A TYR 346.A OH ASP 378.A OD2 no hydrogen 2.640 N/A GLY 348.A N MET 337.A O no hydrogen 2.840 N/A GLN 350.A N SER 335.A O no hydrogen 2.794 N/A GLN 350.A NE2 MET 337.A O no hydrogen 3.627 N/A GLN 350.A NE2 TYR 346.A O no hydrogen 3.167 N/A GLN 350.A NE2 GLY 348.A O no hydrogen 3.047 N/A ALA 351.A N VAL 369.A O no hydrogen 2.812 N/A LEU 352.A N VAL 333.A O no hydrogen 2.945 N/A ASP 353.A N CYS 366.A O no hydrogen 3.181 N/A THR 355.A N ASP 353.A OD1 no hydrogen 2.493 N/A GLN 357.A N TYR 364.A O no hydrogen 3.111 N/A LYS 359.A N GLY 362.A O no hydrogen 2.699 N/A LYS 359.A NZ CYS 365.A O no hydrogen 3.150 N/A LYS 359.A NZ ASP 384.A OD1 no hydrogen 3.061 N/A CYS 366.A SG GLN 357.A OE1 no hydrogen 3.467 N/A GLY 367.A N ASP 384.A OD2 no hydrogen 2.957 N/A VAL 369.A N ALA 351.A O no hydrogen 3.410 N/A VAL 371.A N TRP 349.A O no hydrogen 2.895 N/A ALA 373.A N PRO 370.A O no hydrogen 3.070 N/A ILE 374.A N PRO 370.A O no hydrogen 3.169 N/A LYS 375.A N VAL 371.A O no hydrogen 2.845 N/A LYS 375.A NZ HIS 436.A O no hydrogen 2.885 N/A GLU 376.A N ARG 372.A O no hydrogen 3.069 N/A GLY 377.A N ALA 373.A O no hydrogen 3.030 N/A ASP 378.A N ALA 373.A O no hydrogen 3.302 N/A LEU 379.A N GLY 377.A O no hydrogen 2.651 N/A THR 381.A N ASP 378.A O no hydrogen 2.941 N/A THR 381.A OG1 ASP 378.A O no hydrogen 3.065 N/A PHE 387.A N ASP 384.A O no hydrogen 3.073 N/A VAL 388.A N ASP 384.A O no hydrogen 3.494 N/A PHE 389.A N ALA 385.A O no hydrogen 3.128 N/A ALA 390.A N PRO 386.A O no hydrogen 3.293 N/A GLU 391.A N PHE 387.A O no hydrogen 2.836 N/A VAL 392.A N PHE 389.A O no hydrogen 3.194 N/A ASN 393.A N PHE 389.A O no hydrogen 2.585 N/A ASN 393.A ND2 PHE 389.A O no hydrogen 3.295 N/A ALA 394.A N ALA 390.A O no hydrogen 2.972 N/A ASP 395.A N LEU 306.A O no hydrogen 2.974 N/A VAL 397.A N ILE 308.A O no hydrogen 2.860 N/A TRP 399.A N TYR 310.A O no hydrogen 2.775 N/A TRP 399.A NE1 GLU 309.A OE2 no hydrogen 3.204 N/A ILE 400.A N HIS 408.A O no hydrogen 3.026 N/A GLN 401.A N ARG 312.A O no hydrogen 2.704 N/A GLN 402.A N SER 406.A O no hydrogen 3.110 N/A GLN 402.A NE2 TYR 570.A OH no hydrogen 2.658 N/A SER 406.A OG VAL 407.A O no hydrogen 3.425 N/A HIS 408.A N ILE 400.A O no hydrogen 2.839 N/A SER 410.A N ASP 398.A O no hydrogen 3.103 N/A SER 410.A OG ASP 398.A O no hydrogen 2.758 N/A ILE 411.A N TYR 570.A O no hydrogen 3.051 N/A SER 414.A OG ASN 412.A OD1 no hydrogen 2.867 N/A SER 414.A OG GLU 574.A O no hydrogen 3.476 N/A GLY 418.A N ASN 297.A O no hydrogen 3.137 N/A LEU 419.A N TYR 296.A O no hydrogen 2.928 N/A SER 422.A N THR 294.A O no hydrogen 2.906 N/A SER 422.A OG LYS 420.A O no hydrogen 2.450 N/A THR 423.A N GLU 432.A O no hydrogen 3.400 N/A THR 423.A OG1 VAL 292.A O no hydrogen 3.076 N/A LYS 424.A NZ GLU 153.A OE1 no hydrogen 2.966 N/A LYS 424.A NZ GLU 153.A OE2 no hydrogen 3.519 N/A LYS 424.A NZ SER 425.A O no hydrogen 3.185 N/A LYS 424.A NZ ARG 428.A O no hydrogen 2.573 N/A SER 425.A N GLU 430.A O no hydrogen 3.022 N/A SER 425.A OG GLU 430.A O no hydrogen 2.568 N/A GLY 427.A N GLU 153.A OE1 no hydrogen 3.086 N/A ARG 428.A N SER 425.A O no hydrogen 3.502 N/A GLU 432.A N THR 423.A O no hydrogen 2.892 N/A ILE 434.A N ILE 421.A O no hydrogen 2.730 N/A THR 435.A N ASP 433.A OD1 no hydrogen 2.774 N/A THR 435.A OG1 ASP 433.A OD1 no hydrogen 2.940 N/A THR 435.A OG1 ASP 433.A OD2 no hydrogen 3.294 N/A THR 437.A N ILE 434.A O no hydrogen 3.109 N/A THR 437.A OG1 ILE 434.A O no hydrogen 2.791 N/A TYR 438.A N THR 435.A O no hydrogen 3.211 N/A TYR 438.A OH GLU 334.A OE2 no hydrogen 2.426 N/A LYS 439.A N THR 435.A O no hydrogen 3.212 N/A LYS 439.A NZ VAL 392.A O no hydrogen 3.069 N/A LYS 439.A NZ VAL 417.A O no hydrogen 2.660 N/A LYS 439.A NZ GLY 418.A O no hydrogen 3.243 N/A TYR 440.A OH GLU 376.A OE1 no hydrogen 2.863 N/A TYR 440.A OH GLU 376.A OE2 no hydrogen 3.202 N/A SER 444.A OG PRO 441.A O no hydrogen 2.541 N/A GLU 446.A N GLU 446.A OE1 no hydrogen 2.506 N/A GLU 447.A N SER 444.A OG no hydrogen 3.252 N/A GLU 449.A N SER 445.A O no hydrogen 2.834 N/A ALA 450.A N GLU 446.A O no hydrogen 3.054 N/A PHE 451.A N GLU 447.A O no hydrogen 2.963 N/A THR 452.A OG1 ARG 448.A O no hydrogen 2.528 N/A ARG 453.A NH1 GLU 449.A O no hydrogen 3.327 N/A ARG 453.A NH1 GLU 449.A OE1 no hydrogen 3.266 N/A ASN 455.A N THR 452.A O no hydrogen 3.117 N/A HIS 456.A N PHE 451.A O no hydrogen 2.623 N/A GLU 464.A N GLU 464.A OE1 no hydrogen 2.930 N/A GLU 465.A N GLU 462.A O no hydrogen 3.223 N/A GLU 465.A N GLU 464.A OE1 no hydrogen 2.510 N/A ALA 469.A N THR 491.A O no hydrogen 3.118 N/A ARG 471.A N HIS 489.A O no hydrogen 3.139 N/A ARG 473.A N PHE 487.A O no hydrogen 2.826 N/A GLN 476.A NE2 SER 477.A O no hydrogen 2.784 N/A MET 480.A N GLU 580.A O no hydrogen 2.761 N/A GLY 481.A N TYR 546.A OH no hydrogen 3.175 N/A SER 482.A N ASN 479.A O no hydrogen 3.313 N/A SER 482.A OG ASN 479.A O no hydrogen 3.193 N/A SER 482.A OG ASP 483.A O no hydrogen 3.372 N/A PHE 484.A N ILE 541.A O no hydrogen 3.183 N/A VAL 486.A N LEU 539.A O no hydrogen 3.292 N/A PHE 487.A N ARG 473.A O no hydrogen 2.661 N/A ALA 488.A N VAL 537.A O no hydrogen 2.837 N/A HIS 489.A N ARG 471.A O no hydrogen 2.831 N/A HIS 489.A NE2 GLU 534.A OE1 no hydrogen 2.824 N/A ILE 490.A N LYS 535.A O no hydrogen 2.873 N/A THR 491.A N ALA 469.A O no hydrogen 2.873 N/A ASN 492.A N SER 533.A O no hydrogen 2.953 N/A ASN 492.A ND2 GLU 496.A O no hydrogen 3.399 N/A ASN 492.A ND2 GLU 530.A O no hydrogen 2.707 N/A ASN 493.A N GLY 467.A O no hydrogen 3.155 N/A THR 494.A OG1 GLY 467.A O no hydrogen 3.511 N/A CYS 500.A N LEU 527.A O no hydrogen 2.932 N/A ARG 501.A N VAL 563.A O no hydrogen 2.878 N/A LEU 502.A N LEU 524.A O no hydrogen 2.899 N/A LEU 503.A N LEU 561.A O no hydrogen 2.666 N/A LEU 504.A N LYS 522.A O no hydrogen 2.857 N/A CYS 505.A N ARG 559.A O no hydrogen 2.724 N/A ALA 506.A N GLY 520.A O no hydrogen 2.797 N/A ARG 507.A N LYS 557.A O no hydrogen 2.763 N/A ARG 507.A NE GLY 516.A O no hydrogen 3.030 N/A THR 508.A OG1 CYS 549.A O no hydrogen 3.016 N/A VAL 509.A N LEU 555.A O no hydrogen 3.097 N/A SER 510.A N ILE 514.A O no hydrogen 3.323 N/A SER 510.A OG ASN 512.A OD1 no hydrogen 2.785 N/A SER 510.A OG ILE 514.A O no hydrogen 3.495 N/A GLY 513.A N SER 510.A O no hydrogen 2.965 N/A ILE 514.A N SER 510.A OG no hydrogen 3.107 N/A GLY 516.A N THR 508.A O no hydrogen 2.738 N/A CYS 519.A N ALA 506.A O no hydrogen 2.785 N/A GLY 520.A N GLU 518.A OE2 no hydrogen 3.300 N/A THR 521.A OG1 GLU 518.A OE2 no hydrogen 3.131 N/A LYS 522.A N LEU 504.A O no hydrogen 3.031 N/A LYS 522.A NZ PRO 538.A O no hydrogen 2.797 N/A LEU 524.A N LEU 502.A O no hydrogen 3.127 N/A LEU 527.A N CYS 500.A O no hydrogen 3.195 N/A LEU 529.A N TYR 498.A O no hydrogen 3.070 N/A PHE 532.A N THR 494.A O no hydrogen 3.039 N/A SER 533.A OG PRO 531.A O no hydrogen 2.803 N/A LYS 535.A N ILE 490.A O no hydrogen 2.801 N/A VAL 537.A N ALA 488.A O no hydrogen 3.127 N/A LEU 539.A N VAL 486.A O no hydrogen 3.005 N/A ILE 541.A N PHE 484.A O no hydrogen 2.999 N/A TYR 543.A N ASP 483.A OD1 no hydrogen 2.717 N/A LYS 545.A N LEU 542.A O no hydrogen 2.985 N/A TYR 546.A N TYR 543.A O no hydrogen 3.001 N/A TYR 546.A OH SER 482.A O no hydrogen 3.070 N/A ARG 547.A N TYR 543.A O no hydrogen 2.944 N/A ARG 547.A NH1 GLU 544.A OE1 no hydrogen 3.482 N/A THR 551.A OG1 VAL 509.A O no hydrogen 3.295 N/A ASN 554.A N THR 551.A O no hydrogen 2.942 N/A ASN 554.A ND2 LEU 579.A O no hydrogen 2.943 N/A ASN 554.A ND2 ASN 581.A OD1 no hydrogen 2.905 N/A ILE 556.A N LEU 577.A O no hydrogen 3.164 N/A LYS 557.A N ARG 507.A O no hydrogen 2.630 N/A LYS 557.A NZ ASP 576.A OD1 no hydrogen 2.636 N/A LYS 557.A NZ ASP 576.A OD2 no hydrogen 3.493 N/A VAL 558.A N ARG 575.A O no hydrogen 2.812 N/A ARG 559.A N CYS 505.A O no hydrogen 2.721 N/A ALA 560.A N ALA 573.A O no hydrogen 2.728 N/A LEU 561.A N LEU 503.A O no hydrogen 2.739 N/A LEU 562.A N LEU 571.A O no hydrogen 2.882 N/A VAL 563.A N ARG 501.A O no hydrogen 2.684 N/A GLU 564.A N SER 569.A O no hydrogen 2.904 N/A VAL 566.A N GLU 564.A OE1 no hydrogen 3.298 N/A ILE 567.A N GLU 564.A OE2 no hydrogen 2.896 N/A ASN 568.A N PRO 565.A O no hydrogen 2.871 N/A ASN 568.A ND2 GLN 402.A OE1 no hydrogen 3.623 N/A SER 569.A N GLU 564.A O no hydrogen 2.926 N/A TYR 570.A OH ASN 568.A OD1 no hydrogen 3.184 N/A LEU 571.A N LEU 562.A O no hydrogen 2.954 N/A LEU 572.A N ILE 411.A O no hydrogen 2.679 N/A ALA 573.A N ALA 560.A O no hydrogen 2.979 N/A GLU 574.A N SER 414.A OG no hydrogen 3.093 N/A ARG 575.A N VAL 558.A O no hydrogen 2.873 N/A ARG 575.A NH1 ILE 472.A O no hydrogen 2.754 N/A LEU 577.A N ILE 556.A O no hydrogen 2.802 N/A LEU 579.A N ASN 554.A O no hydrogen 2.868 N/A GLU 580.A N MET 478.A O no hydrogen 3.012 N/A LYS 585.A N SER 603.A O no hydrogen 3.063 N/A ARG 587.A N GLU 601.A O no hydrogen 2.971 N/A LEU 589.A N VAL 599.A O no hydrogen 2.995 N/A LYS 593.A N GLU 591.A O no hydrogen 2.776 N/A LYS 593.A NZ GLU 591.A OE1 no hydrogen 2.861 N/A GLN 594.A N GLY 680.A O no hydrogen 2.754 N/A GLN 594.A NE2 LEU 652.A O no hydrogen 2.904 N/A LYS 595.A N PRO 651.A O no hydrogen 2.954 N/A ARG 596.A NH2 ALA 682.A O no hydrogen 3.170 N/A LYS 597.A NZ ASP 648.A OD1 no hydrogen 2.523 N/A ALA 600.A N MET 647.A O no hydrogen 3.051 N/A GLU 601.A N ARG 587.A O no hydrogen 3.023 N/A VAL 602.A N VAL 645.A O no hydrogen 2.816 N/A SER 603.A N LYS 585.A O no hydrogen 2.945 N/A LEU 604.A N VAL 643.A O no hydrogen 3.018 N/A ASN 606.A N GLU 641.A O no hydrogen 3.228 N/A ASN 606.A ND2 VAL 610.A O no hydrogen 3.085 N/A ASN 606.A ND2 VAL 637.A O no hydrogen 3.083 N/A ASN 606.A ND2 GLU 638.A O no hydrogen 3.004 N/A LEU 608.A N ASN 606.A OD1 no hydrogen 3.163 N/A LEU 612.A N VAL 637.A O no hydrogen 2.703 N/A GLU 613.A N ASP 666.A OD2 no hydrogen 2.983 N/A THR 616.A N GLU 664.A O no hydrogen 2.573 N/A PHE 617.A N VAL 631.A O no hydrogen 3.000 N/A THR 618.A N ASN 662.A O no hydrogen 2.837 N/A VAL 619.A N LYS 629.A O no hydrogen 2.704 N/A GLU 620.A N VAL 660.A O no hydrogen 3.014 N/A ALA 622.A N ASN 176.A OD1 no hydrogen 2.969 N/A LEU 624.A N GLY 621.A O no hydrogen 2.916 N/A THR 625.A N GLY 621.A O no hydrogen 3.249 N/A LYS 629.A N VAL 619.A O no hydrogen 2.875 N/A VAL 631.A N PHE 617.A O no hydrogen 2.951 N/A ILE 633.A N CYS 615.A O no hydrogen 2.820 N/A VAL 637.A N LEU 612.A O no hydrogen 2.666 N/A VAL 643.A N LEU 604.A O no hydrogen 2.679 N/A VAL 645.A N VAL 602.A O no hydrogen 3.063 N/A MET 647.A N ALA 600.A O no hydrogen 2.898 N/A LEU 649.A N LEU 598.A O no hydrogen 2.679 N/A LEU 652.A N GLY 623.A O no hydrogen 3.357 N/A GLY 655.A N ILE 679.A O no hydrogen 2.841 N/A HIS 657.A N VAL 677.A O no hydrogen 2.845 N/A HIS 657.A NE2 HIS 653.A O no hydrogen 2.929 N/A LYS 658.A NZ ASP 429.A OD1 no hydrogen 2.837 N/A LYS 658.A NZ ASP 429.A OD2 no hydrogen 2.975 N/A LYS 658.A NZ ASN 676.A OD1 no hydrogen 2.636 N/A LEU 659.A N ARG 675.A O no hydrogen 2.864 N/A VAL 660.A N GLU 620.A O no hydrogen 3.123 N/A VAL 661.A N GLY 673.A O no hydrogen 2.818 N/A ASN 662.A N THR 618.A O no hydrogen 2.782 N/A PHE 663.A N VAL 671.A O no hydrogen 2.844 N/A GLU 664.A N THR 616.A O no hydrogen 2.708 N/A SER 665.A OG LEU 668.A O no hydrogen 2.906 N/A ASP 666.A N GLU 613.A O no hydrogen 3.051 N/A LEU 668.A N SER 665.A OG no hydrogen 2.789 N/A LYS 669.A NZ SER 665.A O no hydrogen 2.941 N/A LYS 669.A NZ ASP 666.A O no hydrogen 3.294 N/A ALA 670.A N GLU 664.A OE2 no hydrogen 3.377 N/A VAL 671.A N PHE 663.A O no hydrogen 3.174 N/A LYS 672.A NZ MET 247.A O no hydrogen 3.090 N/A LYS 672.A NZ TRP 249.A O no hydrogen 3.543 N/A LYS 672.A NZ ASN 662.A OD1 no hydrogen 3.042 N/A ARG 675.A N LEU 659.A O no hydrogen 2.959 N/A ARG 675.A NE ILE 586.A O no hydrogen 3.430 N/A ASN 676.A ND2 ASP 429.A OD2 no hydrogen 2.908 N/A VAL 677.A N HIS 657.A O no hydrogen 2.784 N/A ILE 679.A N GLY 655.A O no hydrogen 2.741 N/A GLY 680.A N PRO 592.A O no hydrogen 2.951 N/A