Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5m3j_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A N ASN 4.A OD1 no hydrogen 2.913 N/A PHE 7.A N ASN 4.A O no hydrogen 3.214 N/A LEU 8.A N PRO 5.A O no hydrogen 3.298 N/A PHE 9.A N TYR 6.A O no hydrogen 2.985 N/A ILE 10.A N PHE 7.A O no hydrogen 3.331 N/A VAL 12.A N LEU 8.A O no hydrogen 2.939 N/A GLN 15.A N GLN 15.A OE1 no hydrogen 2.890 N/A ALA 17.A N PRO 13.A O no hydrogen 3.081 N/A ILE 18.A N GLN 15.A O no hydrogen 3.302 N/A THR 20.A OG1 ALA 17.A O no hydrogen 2.757 N/A THR 21.A N ILE 18.A O no hydrogen 3.138 N/A THR 21.A OG1 ILE 18.A O no hydrogen 2.657 N/A PHE 22.A N SER 19.A O no hydrogen 3.427 N/A GLY 26.A N PRO 23.A O no hydrogen 3.341 N/A SER 31.A N ASP 230.A OD2 no hydrogen 3.202 N/A SER 31.A OG ASP 230.A OD1 no hydrogen 3.105 N/A SER 31.A OG ASP 230.A OD2 no hydrogen 2.848 N/A THR 34.A OG1 THR 36.A OG1 no hydrogen 2.732 N/A THR 34.A OG1 GLY 354.A O no hydrogen 2.952 N/A THR 36.A N THR 34.A OG1 no hydrogen 3.151 N/A THR 36.A OG1 THR 34.A OG1 no hydrogen 2.732 N/A THR 36.A OG1 LEU 351.A O no hydrogen 2.662 N/A THR 36.A OG1 GLY 354.A O no hydrogen 3.022 N/A THR 39.A N GLY 35.A O no hydrogen 2.853 N/A THR 39.A OG1 GLY 35.A O no hydrogen 2.871 N/A THR 39.A OG1 THR 226.A OG1 no hydrogen 3.285 N/A ILE 40.A N THR 36.A O no hydrogen 2.830 N/A ASP 41.A N GLY 37.A O no hydrogen 3.045 N/A THR 42.A N TYR 38.A O no hydrogen 3.223 N/A THR 42.A OG1 TYR 38.A O no hydrogen 3.103 N/A VAL 43.A N THR 39.A O no hydrogen 3.044 N/A ILE 44.A N ILE 40.A O no hydrogen 2.882 N/A ARG 45.A N ASP 41.A O no hydrogen 2.921 N/A ARG 45.A NH2 GLU 311.A OE2 no hydrogen 3.237 N/A THR 46.A N THR 42.A O no hydrogen 2.808 N/A THR 46.A OG1 THR 42.A O no hydrogen 2.595 N/A HIS 47.A N VAL 43.A O no hydrogen 3.274 N/A HIS 47.A ND1 VAL 43.A O no hydrogen 2.805 N/A GLU 48.A N ILE 44.A O no hydrogen 2.768 N/A TYR 49.A N ARG 45.A O no hydrogen 3.124 N/A SER 50.A N HIS 47.A O no hydrogen 3.094 N/A SER 50.A OG THR 46.A O no hydrogen 3.060 N/A LYS 52.A N TYR 82.A OH no hydrogen 2.659 N/A GLY 53.A N SER 50.A O no hydrogen 3.377 N/A LYS 54.A N ASP 67.A O no hydrogen 2.899 N/A TYR 56.A N MET 65.A O no hydrogen 3.054 N/A SER 58.A N CYS 63.A O no hydrogen 2.941 N/A SER 58.A OG THR 61.A OG1 no hydrogen 3.382 N/A THR 61.A OG1 SER 58.A OG no hydrogen 3.382 N/A GLY 62.A N SER 58.A O no hydrogen 2.789 N/A CYS 63.A SG THR 61.A OG1 no hydrogen 3.213 N/A THR 64.A OG1 PRO 394.A O no hydrogen 3.011 N/A MET 65.A N TYR 56.A O no hydrogen 2.998 N/A ASP 67.A N LYS 54.A O no hydrogen 2.926 N/A THR 69.A N ASP 67.A OD1 no hydrogen 3.230 N/A THR 69.A OG1 ASP 67.A OD1 no hydrogen 2.548 N/A ASN 70.A N ALA 83.A O no hydrogen 2.807 N/A SER 80.A N ASN 475.A OD1 no hydrogen 2.784 N/A ALA 81.A N TYR 49.A O no hydrogen 3.292 N/A TYR 82.A N SER 80.A OG no hydrogen 3.149 N/A ALA 83.A N ALA 81.A O no hydrogen 2.967 N/A GLN 84.A N LEU 471.A O no hydrogen 2.897 N/A GLN 84.A NE2 GLY 71.A O no hydrogen 2.872 N/A LEU 85.A N ASN 70.A OD1 no hydrogen 2.997 N/A VAL 88.A N GLN 84.A O no hydrogen 3.172 N/A LEU 89.A N LEU 85.A O no hydrogen 2.870 N/A GLU 90.A N ASP 86.A O no hydrogen 2.831 N/A ALA 91.A N CYS 87.A O no hydrogen 3.020 N/A LEU 92.A N VAL 88.A O no hydrogen 2.889 N/A ASP 93.A N LEU 89.A O no hydrogen 2.723 N/A ARG 94.A N GLU 90.A O no hydrogen 2.821 N/A ARG 94.A NH2 ILE 427.A O no hydrogen 3.078 N/A MET 95.A N ALA 91.A O no hydrogen 3.092 N/A ASP 96.A N LEU 92.A O no hydrogen 2.773 N/A GLU 97.A N ASP 93.A O no hydrogen 2.726 N/A GLU 98.A N ARG 94.A O no hydrogen 3.152 N/A HIS 99.A N MET 95.A O no hydrogen 2.847 N/A ALA 105.A N GLY 101.A O no hydrogen 3.026 N/A ALA 106.A N LEU 102.A O no hydrogen 2.843 N/A SER 107.A OG PHE 103.A O no hydrogen 2.807 N/A SER 107.A OG ILE 325.A O no hydrogen 3.071 N/A GLN 108.A N GLN 104.A O no hydrogen 2.967 N/A GLN 108.A NE2 GLN 104.A OE1 no hydrogen 2.918 N/A ASN 109.A N ALA 105.A O no hydrogen 2.806 N/A ALA 110.A N ALA 106.A O no hydrogen 2.915 N/A MET 111.A N SER 107.A O no hydrogen 2.791 N/A GLU 112.A N GLN 108.A O no hydrogen 2.713 N/A THR 113.A N ASN 109.A O no hydrogen 2.957 N/A THR 113.A OG1 ASN 109.A O no hydrogen 2.614 N/A LEU 114.A N ALA 110.A O no hydrogen 2.734 N/A MET 115.A N MET 111.A O no hydrogen 3.230 N/A THR 117.A N THR 113.A O no hydrogen 2.741 N/A THR 117.A OG1 THR 113.A O no hydrogen 2.710 N/A THR 118.A OG1 ASP 120.A OD2 no hydrogen 2.683 N/A VAL 119.A N GLY 161.A O no hydrogen 2.939 N/A LEU 122.A N VAL 119.A O no hydrogen 2.931 N/A THR 123.A N ASP 120.A O no hydrogen 3.071 N/A THR 123.A OG1 ASP 120.A O no hydrogen 2.742 N/A THR 128.A N GLN 137.A O no hydrogen 2.935 N/A PHE 129.A N ALA 244.A O no hydrogen 2.922 N/A ASP 130.A N ARG 135.A O no hydrogen 2.906 N/A THR 132.A N ASP 130.A OD1 no hydrogen 3.269 N/A THR 132.A OG1 ASP 130.A OD1 no hydrogen 2.713 N/A CYS 134.A N ASP 130.A O no hydrogen 2.767 N/A CYS 134.A SG TRP 131.A O no hydrogen 3.900 N/A ARG 135.A NH1 GLN 137.A OE1 no hydrogen 2.568 N/A GLN 137.A N THR 128.A O no hydrogen 2.862 N/A THR 141.A OG1 PRO 138.A O no hydrogen 2.711 N/A ALA 142.A N PRO 138.A O no hydrogen 2.853 N/A LEU 143.A N ALA 139.A O no hydrogen 2.795 N/A ASN 144.A N ALA 140.A O no hydrogen 3.023 N/A ASN 144.A ND2 TYR 672.A OH no hydrogen 3.213 N/A THR 145.A N THR 141.A O no hydrogen 2.877 N/A THR 145.A OG1 ASP 130.A OD1 no hydrogen 3.048 N/A THR 145.A OG1 ASP 130.A OD2 no hydrogen 2.907 N/A THR 145.A OG1 THR 141.A O no hydrogen 3.107 N/A THR 145.A OG1 ALA 142.A O no hydrogen 2.794 N/A THR 146.A N ALA 142.A O no hydrogen 3.258 N/A THR 146.A OG1 ALA 142.A O no hydrogen 2.801 N/A ILE 147.A N LEU 143.A O no hydrogen 2.986 N/A THR 148.A N ASN 144.A O no hydrogen 2.927 N/A THR 148.A OG1 ASN 144.A O no hydrogen 3.010 N/A THR 148.A OG1 THR 145.A O no hydrogen 3.067 N/A SER 149.A N THR 145.A O no hydrogen 3.051 N/A SER 149.A OG THR 180.A O no hydrogen 2.892 N/A PHE 150.A N THR 146.A O no hydrogen 2.782 N/A ARG 151.A N ILE 147.A O no hydrogen 2.910 N/A ARG 151.A NH2 ASP 159.A OD2 no hydrogen 3.384 N/A LEU 152.A N THR 148.A O no hydrogen 3.397 N/A LEU 152.A N SER 149.A O no hydrogen 3.025 N/A ASN 153.A N PHE 150.A O no hydrogen 3.112 N/A ASN 153.A ND2 SER 149.A O no hydrogen 2.728 N/A ASN 153.A ND2 THR 180.A O no hydrogen 2.884 N/A ASP 154.A N ARG 151.A O no hydrogen 3.260 N/A LEU 155.A N PHE 150.A O no hydrogen 3.023 N/A GLY 157.A N ASP 169.A OD2 no hydrogen 2.738 N/A ASP 159.A N ASN 156.A O no hydrogen 3.355 N/A LYS 160.A N GLY 157.A O no hydrogen 3.207 N/A GLY 161.A N ALA 158.A O no hydrogen 3.033 N/A LEU 163.A N THR 117.A O no hydrogen 3.076 N/A CYS 167.A N LEU 163.A O no hydrogen 2.896 N/A CYS 167.A SG LEU 163.A O no hydrogen 3.778 N/A GLN 168.A N ILE 164.A O no hydrogen 2.803 N/A GLN 168.A NE2 ASP 172.A OD2 no hydrogen 3.343 N/A ASP 169.A N PRO 165.A O no hydrogen 2.903 N/A ILE 170.A N PHE 166.A O no hydrogen 3.030 N/A ILE 171.A N CYS 167.A O no hydrogen 3.359 N/A ASP 172.A N GLN 168.A O no hydrogen 2.993 N/A SER 173.A N ASP 169.A O no hydrogen 2.670 N/A SER 173.A OG ASP 169.A O no hydrogen 3.169 N/A SER 173.A OG ILE 170.A O no hydrogen 2.591 N/A SER 173.A OG TYR 217.A OH no hydrogen 3.041 N/A ASP 175.A N ASP 172.A O no hydrogen 3.066 N/A ARG 176.A N SER 173.A O no hydrogen 3.358 N/A ARG 176.A NE ASN 153.A O no hydrogen 3.159 N/A ARG 176.A NH2 ASN 153.A O no hydrogen 2.740 N/A MET 179.A N ILE 212.A O no hydrogen 2.858 N/A THR 180.A N ASN 153.A OD1 no hydrogen 2.841 N/A PHE 181.A N ASP 210.A O no hydrogen 2.699 N/A SER 183.A N VAL 208.A O no hydrogen 2.824 N/A SER 183.A OG VAL 208.A O no hydrogen 3.371 N/A LYS 185.A N MET 206.A O no hydrogen 2.827 N/A ILE 187.A N ILE 204.A O no hydrogen 2.841 N/A LEU 191.A N LEU 200.A O no hydrogen 2.779 N/A PHE 199.A N LYS 197.A O no hydrogen 2.685 N/A LEU 200.A N LEU 191.A O no hydrogen 2.881 N/A LYS 202.A N LYS 189.A O no hydrogen 3.420 N/A MET 206.A N LYS 185.A O no hydrogen 2.828 N/A VAL 208.A N SER 183.A O no hydrogen 2.820 N/A ASP 210.A N PHE 181.A O no hydrogen 2.783 N/A ILE 212.A N MET 179.A O no hydrogen 3.012 N/A TYR 217.A N THR 213.A O no hydrogen 2.922 N/A TYR 217.A OH SER 173.A OG no hydrogen 3.041 N/A ILE 218.A N LYS 214.A O no hydrogen 3.059 N/A LYS 219.A N VAL 215.A O no hydrogen 3.049 N/A LYS 219.A NZ GLU 399.A OE1 no hydrogen 3.471 N/A LYS 219.A NZ GLU 399.A OE2 no hydrogen 3.423 N/A ARG 220.A N GLU 216.A O no hydrogen 3.287 N/A ARG 220.A NH1 TRP 131.A O no hydrogen 3.119 N/A ALA 221.A N TYR 217.A O no hydrogen 2.745 N/A LEU 222.A N ILE 218.A O no hydrogen 2.890 N/A SER 223.A N ARG 220.A O no hydrogen 3.181 N/A SER 223.A OG LYS 219.A O no hydrogen 2.505 N/A LEU 224.A N ILE 348.A O no hydrogen 2.820 N/A ASN 225.A N THR 243.A O no hydrogen 2.946 N/A ASN 225.A ND2 ASN 136.A OD1 no hydrogen 2.732 N/A THR 226.A N ASN 225.A OD1 no hydrogen 2.652 N/A THR 226.A OG1 THR 39.A OG1 no hydrogen 3.285 N/A THR 226.A OG1 ARG 350.A O no hydrogen 2.750 N/A MET 227.A N ILE 241.A O no hydrogen 2.887 N/A LYS 229.A N ARG 239.A O no hydrogen 2.914 N/A ALA 231.A N PRO 29.A O no hydrogen 2.866 N/A ARG 233.A NH2 GLY 26.A O no hydrogen 2.882 N/A LYS 235.A NZ GLU 232.A OE2 no hydrogen 3.400 N/A ARG 238.A NH1 LYS 235.A O no hydrogen 3.551 N/A ARG 238.A NH2 LYS 235.A O no hydrogen 3.312 N/A ILE 241.A N MET 227.A O no hydrogen 2.709 N/A THR 243.A N ASN 225.A O no hydrogen 2.868 N/A GLN 247.A N GLN 247.A OE1 no hydrogen 2.719 N/A GLN 247.A NE2 TYR 217.A OH no hydrogen 3.466 N/A ARG 249.A NH1 THR 128.A OG1 no hydrogen 2.805 N/A ARG 249.A NH2 GLN 127.A O no hydrogen 2.717 N/A VAL 252.A N ILE 248.A O no hydrogen 2.962 N/A LEU 253.A N ARG 249.A O no hydrogen 2.941 N/A VAL 255.A N PHE 251.A O no hydrogen 3.303 N/A GLU 256.A N VAL 252.A O no hydrogen 2.758 N/A ASN 257.A N LEU 253.A O no hydrogen 2.807 N/A LEU 258.A N VAL 254.A O no hydrogen 2.648 N/A ALA 259.A N VAL 255.A O no hydrogen 2.869 N/A LYS 260.A N GLU 256.A O no hydrogen 2.608 N/A ASN 261.A N ASN 257.A O no hydrogen 2.957 N/A ASN 261.A ND2 ALA 106.A O no hydrogen 3.536 N/A ILE 262.A N LEU 258.A O no hydrogen 3.210 N/A CYS 263.A N ALA 259.A O no hydrogen 2.876 N/A CYS 263.A SG ALA 259.A O no hydrogen 3.242 N/A CYS 263.A SG MET 415.A O no hydrogen 3.738 N/A GLU 264.A N LYS 260.A O no hydrogen 2.802 N/A ASN 265.A N ILE 262.A O no hydrogen 3.336 N/A ASN 265.A ND2 ASN 261.A O no hydrogen 3.315 N/A SER 269.A OG CYS 263.A O no hydrogen 2.874 N/A GLY 270.A N GLN 441.A O no hydrogen 2.731 N/A LYS 278.A N GLY 274.A O no hydrogen 2.820 N/A LYS 278.A NZ GLY 270.A O no hydrogen 3.318 N/A LYS 281.A N GLU 277.A O no hydrogen 2.956 N/A LYS 281.A NZ LEU 266.A O no hydrogen 3.117 N/A LYS 281.A NZ SER 269.A O no hydrogen 3.113 N/A LEU 282.A N LYS 278.A O no hydrogen 2.827 N/A SER 283.A N LYS 279.A O no hydrogen 2.701 N/A SER 283.A OG LYS 279.A O no hydrogen 2.581 N/A ALA 285.A N LYS 281.A O no hydrogen 2.881 N/A VAL 286.A N LEU 282.A O no hydrogen 2.707 N/A ALA 287.A N SER 283.A O no hydrogen 2.916 N/A LYS 288.A N ASN 284.A O no hydrogen 2.981 N/A MET 289.A N ALA 285.A O no hydrogen 3.319 N/A LEU 290.A N VAL 286.A O no hydrogen 2.909 N/A SER 291.A N ALA 287.A O no hydrogen 3.406 N/A SER 291.A OG ALA 287.A O no hydrogen 3.386 N/A ASN 292.A N LEU 290.A O no hydrogen 2.916 N/A ILE 298.A N ALA 452.A O no hydrogen 2.913 N/A SER 299.A OG MET 289.A O no hydrogen 3.517 N/A SER 299.A OG ASN 451.A OD1 no hydrogen 2.783 N/A SER 299.A OG THR 486.A OG1 no hydrogen 2.964 N/A MET 300.A N VAL 450.A O no hydrogen 2.803 N/A THR 301.A N ASN 484.A O no hydrogen 2.801 N/A THR 301.A OG1 THR 486.A OG1 no hydrogen 2.757 N/A VAL 302.A N LEU 448.A O no hydrogen 2.695 N/A THR 303.A N TYR 482.A O no hydrogen 2.888 N/A GLY 304.A N PHE 446.A O no hydrogen 3.134 N/A ASN 306.A N ASP 444.A O no hydrogen 2.939 N/A THR 307.A N ASN 475.A O no hydrogen 3.110 N/A CYS 312.A N LYS 308.A O no hydrogen 3.127 N/A CYS 312.A SG SER 80.A O no hydrogen 3.817 N/A CYS 312.A SG LYS 308.A O no hydrogen 3.587 N/A ARG 316.A N ASN 314.A OD1 no hydrogen 2.685 N/A ARG 316.A NH1 TYR 56.A OH no hydrogen 3.157 N/A ARG 316.A NH2 TYR 56.A OH no hydrogen 2.966 N/A ARG 316.A NH2 SER 405.A OG no hydrogen 2.740 N/A ILE 317.A N ASN 314.A O no hydrogen 3.047 N/A PHE 318.A N ASN 314.A O no hydrogen 3.386 N/A LEU 319.A N PRO 315.A O no hydrogen 2.821 N/A ALA 320.A N ARG 316.A O no hydrogen 3.302 N/A MET 321.A N ILE 317.A O no hydrogen 2.873 N/A THR 322.A N PHE 318.A O no hydrogen 3.136 N/A THR 322.A OG1 PHE 318.A O no hydrogen 3.569 N/A THR 322.A OG1 LEU 319.A O no hydrogen 2.648 N/A GLU 323.A N LEU 319.A O no hydrogen 3.106 N/A ARG 324.A N ALA 320.A O no hydrogen 3.071 N/A ARG 324.A NE ASP 93.A OD1 no hydrogen 2.986 N/A ARG 324.A NH1 ASP 96.A OD2 no hydrogen 2.964 N/A ARG 324.A NH2 ASP 93.A OD1 no hydrogen 2.711 N/A ARG 324.A NH2 ASP 96.A OD2 no hydrogen 3.055 N/A ILE 325.A N MET 321.A O no hydrogen 2.850 N/A THR 326.A N THR 322.A O no hydrogen 2.834 N/A THR 326.A OG1 THR 322.A O no hydrogen 2.485 N/A ARG 327.A N ARG 324.A O no hydrogen 3.333 N/A ARG 334.A N PRO 330.A O no hydrogen 3.257 N/A ARG 334.A NH1 GLU 323.A O no hydrogen 3.054 N/A ARG 334.A NH1 THR 326.A O no hydrogen 2.667 N/A ASP 335.A N ILE 331.A O no hydrogen 2.899 N/A PHE 336.A N TRP 332.A O no hydrogen 2.958 N/A CYS 337.A N PHE 333.A O no hydrogen 3.010 N/A CYS 337.A SG PHE 333.A O no hydrogen 3.294 N/A SER 338.A N ARG 334.A O no hydrogen 3.232 N/A SER 338.A OG ARG 334.A O no hydrogen 3.340 N/A SER 338.A OG ASP 335.A O no hydrogen 2.726 N/A ILE 339.A N PHE 336.A O no hydrogen 3.373 N/A VAL 342.A N SER 338.A O no hydrogen 3.241 N/A LEU 343.A N ILE 339.A O no hydrogen 2.920 N/A PHE 344.A N ALA 340.A O no hydrogen 3.111 N/A SER 345.A N PRO 341.A O no hydrogen 2.774 N/A ASN 346.A N LEU 343.A O no hydrogen 3.134 N/A LYS 347.A NZ LEU 404.A O no hydrogen 2.749 N/A LYS 347.A NZ PRO 406.A O no hydrogen 3.120 N/A LYS 347.A NZ GLY 407.A O no hydrogen 3.005 N/A ILE 348.A N LEU 222.A O no hydrogen 2.940 N/A ALA 349.A N ALA 402.A O no hydrogen 2.725 N/A ARG 350.A N LEU 224.A O no hydrogen 2.903 N/A GLY 354.A N THR 34.A OG1 no hydrogen 3.329 N/A PHE 355.A N ILE 368.A O no hydrogen 3.378 N/A ILE 357.A N ALA 366.A O no hydrogen 2.994 N/A SER 359.A N LEU 364.A O no hydrogen 3.291 N/A ARG 363.A N SER 359.A O no hydrogen 2.868 N/A LEU 364.A N SER 359.A O no hydrogen 3.444 N/A ALA 366.A N ILE 357.A O no hydrogen 3.105 N/A ILE 368.A N PHE 355.A O no hydrogen 2.707 N/A CYS 370.A SG LEU 351.A O no hydrogen 3.223 N/A CYS 370.A SG GLY 352.A O no hydrogen 3.334 N/A CYS 370.A SG LYS 353.A O no hydrogen 3.802 N/A LEU 373.A N CYS 370.A O no hydrogen 3.156 N/A SER 375.A N ASP 372.A O no hydrogen 2.851 N/A ARG 380.A N PRO 377.A O no hydrogen 3.157 N/A TYR 381.A N LEU 378.A O no hydrogen 3.371 N/A TYR 381.A OH LEU 373.A O no hydrogen 2.567 N/A THR 385.A N ASN 382.A OD1 no hydrogen 2.617 N/A THR 385.A OG1 ASN 382.A OD1 no hydrogen 2.628 N/A ARG 386.A N ASN 382.A O no hydrogen 2.822 N/A ARG 386.A NE LEU 378.A O no hydrogen 3.180 N/A ARG 386.A NH2 GLU 379.A O no hydrogen 3.483 N/A ALA 387.A N GLU 383.A O no hydrogen 3.221 N/A LYS 388.A N GLU 384.A O no hydrogen 3.052 N/A LYS 388.A NZ GLY 37.A O no hydrogen 3.094 N/A LYS 388.A NZ ASP 41.A OD2 no hydrogen 2.719 N/A LYS 388.A NZ GLU 384.A OE2 no hydrogen 3.510 N/A LEU 389.A N THR 385.A O no hydrogen 2.893 N/A LYS 390.A N ARG 386.A O no hydrogen 3.293 N/A LYS 391.A N ALA 387.A O no hydrogen 3.249 N/A LEU 392.A N LYS 388.A O no hydrogen 2.861 N/A LYS 393.A N LYS 390.A O no hydrogen 3.433 N/A PHE 395.A N LEU 392.A O no hydrogen 3.042 N/A PHE 396.A N LYS 393.A O no hydrogen 3.006 N/A ASN 397.A N THR 401.A O no hydrogen 2.721 N/A ASN 397.A ND2 GLU 399.A OE1 no hydrogen 3.354 N/A GLY 400.A N ASN 397.A O no hydrogen 3.190 N/A THR 401.A OG1 GLU 399.A OE1 no hydrogen 3.421 N/A ALA 402.A N ALA 349.A O no hydrogen 2.764 N/A SER 403.A N PHE 395.A O no hydrogen 2.782 N/A SER 403.A OG THR 64.A O no hydrogen 2.986 N/A SER 405.A OG VAL 66.A O no hydrogen 3.506 N/A SER 405.A OG SER 345.A O no hydrogen 2.718 N/A MET 408.A N ASN 310.A O no hydrogen 2.625 N/A MET 415.A N GLU 256.A OE1 no hydrogen 3.120 N/A LEU 416.A N GLU 256.A OE2 no hydrogen 3.423 N/A SER 417.A N PHE 413.A O no hydrogen 2.963 N/A SER 417.A OG PHE 413.A O no hydrogen 2.704 N/A SER 417.A OG ASN 414.A O no hydrogen 2.938 N/A THR 418.A N ASN 414.A O no hydrogen 2.990 N/A THR 418.A OG1 ASN 414.A O no hydrogen 2.679 N/A VAL 419.A N MET 415.A O no hydrogen 2.955 N/A LEU 420.A N LEU 416.A O no hydrogen 3.312 N/A GLY 421.A N SER 417.A O no hydrogen 3.112 N/A VAL 422.A N THR 418.A O no hydrogen 2.786 N/A ALA 423.A N VAL 419.A O no hydrogen 2.779 N/A ALA 424.A N LEU 420.A O no hydrogen 3.257 N/A LEU 425.A N GLY 421.A O no hydrogen 3.278 N/A GLY 426.A N ALA 423.A O no hydrogen 3.300 N/A LYS 428.A NZ GLU 98.A OE2 no hydrogen 3.362 N/A ASN 429.A ND2 LYS 433.A O no hydrogen 2.711 N/A ASN 429.A ND2 TYR 435.A O no hydrogen 2.716 N/A LYS 433.A N ASN 429.A OD1 no hydrogen 3.227 N/A LYS 433.A NZ ASP 464.A OD2 no hydrogen 3.344 N/A TYR 435.A N LYS 433.A O no hydrogen 2.812 N/A TYR 435.A OH ASP 464.A OD2 no hydrogen 2.656 N/A LEU 436.A N ASN 451.A O no hydrogen 2.994 N/A TRP 437.A N LYS 428.A O no hydrogen 3.140 N/A ASP 438.A N PHE 449.A O no hydrogen 2.816 N/A LEU 440.A N ALA 447.A O no hydrogen 2.920 N/A GLN 441.A NE2 SER 443.A O no hydrogen 2.976 N/A SER 442.A N ASP 445.A O no hydrogen 3.010 N/A SER 442.A OG GLY 270.A O no hydrogen 3.295 N/A ASP 445.A N SER 442.A O no hydrogen 3.113 N/A ALA 447.A N LEU 440.A O no hydrogen 2.842 N/A LEU 448.A N VAL 302.A O no hydrogen 3.249 N/A PHE 449.A N ASP 438.A O no hydrogen 2.454 N/A VAL 450.A N MET 300.A O no hydrogen 2.816 N/A ASN 451.A N LEU 436.A O no hydrogen 3.042 N/A ASN 451.A ND2 MET 289.A O no hydrogen 2.608 N/A THR 457.A N ASP 454.A O no hydrogen 3.036 N/A THR 457.A OG1 ASP 454.A OD1 no hydrogen 2.682 N/A THR 457.A OG1 ASP 454.A OD2 no hydrogen 3.387 N/A CYS 458.A N ASP 454.A O no hydrogen 3.297 N/A CYS 458.A SG ILE 298.A O no hydrogen 3.287 N/A CYS 458.A SG VAL 450.A O no hydrogen 3.988 N/A CYS 458.A SG ASP 454.A O no hydrogen 3.767 N/A MET 459.A N GLU 455.A O no hydrogen 3.008 N/A GLY 461.A N THR 457.A O no hydrogen 2.719 N/A ILE 462.A N CYS 458.A O no hydrogen 2.736 N/A ASN 463.A N MET 459.A O no hydrogen 2.881 N/A ASP 464.A N GLU 460.A O no hydrogen 2.758 N/A PHE 465.A N GLY 461.A O no hydrogen 2.982 N/A TYR 466.A N ILE 462.A O no hydrogen 2.712 N/A TYR 466.A OH ASN 77.A OD1 no hydrogen 2.967 N/A ARG 467.A N ASN 463.A O no hydrogen 2.850 N/A THR 468.A N ASP 464.A O no hydrogen 2.946 N/A THR 468.A OG1 ASP 464.A O no hydrogen 2.529 N/A CYS 469.A N PHE 465.A O no hydrogen 2.942 N/A CYS 469.A SG PHE 465.A O no hydrogen 3.263 N/A LYS 470.A N TYR 466.A O no hydrogen 3.191 N/A LYS 470.A NZ ASN 475.A OD1 no hydrogen 3.117 N/A LEU 471.A N THR 468.A O no hydrogen 2.908 N/A LEU 472.A N CYS 469.A O no hydrogen 2.905 N/A GLY 473.A N LYS 470.A O no hydrogen 3.336 N/A ILE 474.A N CYS 469.A O no hydrogen 2.882 N/A ASN 475.A ND2 SER 80.A O no hydrogen 2.846 N/A ASN 475.A ND2 GLY 473.A O no hydrogen 3.541 N/A SER 477.A N ASP 305.A O no hydrogen 2.800 N/A LYS 480.A N SER 477.A OG no hydrogen 3.028 N/A SER 481.A N SER 477.A O no hydrogen 3.069 N/A SER 481.A OG ASP 305.A O no hydrogen 3.118 N/A SER 481.A OG SER 477.A O no hydrogen 3.111 N/A TYR 482.A N THR 303.A O no hydrogen 3.197 N/A CYS 483.A SG THR 301.A O no hydrogen 4.045 N/A CYS 483.A SG ASN 484.A O no hydrogen 4.044 N/A ASN 484.A N THR 301.A O no hydrogen 3.099 N/A ASN 484.A ND2 MET 488.A O no hydrogen 2.733 N/A THR 486.A N SER 299.A O no hydrogen 2.762 N/A THR 486.A OG1 SER 299.A OG no hydrogen 2.964 N/A THR 486.A OG1 THR 301.A OG1 no hydrogen 2.757 N/A PHE 489.A N TYR 496.A O no hydrogen 3.097 N/A GLU 490.A N THR 303.A OG1 no hydrogen 3.313 N/A PHE 491.A N MET 494.A O no hydrogen 3.050 N/A THR 492.A N ASP 445.A OD2 no hydrogen 3.351 N/A THR 492.A OG1 PHE 491.A O no hydrogen 2.505 N/A SER 493.A N GLU 490.A OE2 no hydrogen 3.000 N/A MET 494.A N PHE 491.A O no hydrogen 2.989 N/A TYR 496.A N PHE 489.A O no hydrogen 3.000 N/A ARG 497.A N GLY 499.A O no hydrogen 2.824 N/A ASP 498.A N GLY 487.A O no hydrogen 2.759 N/A VAL 501.A N PHE 495.A O no hydrogen 2.916 N/A ASN 503.A ND2 SER 493.A O no hydrogen 3.605 N/A MET 506.A N ASN 503.A O no hydrogen 3.395 N/A GLU 507.A N PHE 504.A O no hydrogen 3.193 N/A LEU 508.A N ALA 505.A O no hydrogen 3.196 N/A SER 510.A N GLU 507.A O no hydrogen 3.191 N/A SER 510.A OG GLU 507.A O no hydrogen 2.540 N/A PHE 511.A N LEU 508.A O no hydrogen 3.095 N/A GLY 512.A N PRO 509.A O no hydrogen 3.467 N/A VAL 513.A N ASP 553.A OD2 no hydrogen 3.401 N/A GLY 515.A N ASP 521.A OD2 no hydrogen 2.732 N/A VAL 516.A N ASP 521.A OD1 no hydrogen 2.896 N/A ASN 517.A N ASP 521.A OD1 no hydrogen 2.829 N/A ASN 517.A ND2 TRP 649.A O no hydrogen 2.918 N/A SER 519.A N HIS 647.A O no hydrogen 3.240 N/A SER 519.A OG VAL 643.A O no hydrogen 3.260 N/A SER 519.A OG SER 648.A OG no hydrogen 3.136 N/A ALA 520.A N ASN 517.A OD1 no hydrogen 2.728 N/A ASP 521.A N ASN 517.A O no hydrogen 2.751 N/A MET 522.A N GLU 518.A O no hydrogen 3.282 N/A ILE 524.A N ALA 520.A O no hydrogen 2.837 N/A GLY 525.A N ASP 521.A O no hydrogen 2.823 N/A MET 526.A N MET 522.A O no hydrogen 3.086 N/A THR 527.A N ALA 523.A O no hydrogen 2.929 N/A THR 527.A OG1 ALA 523.A O no hydrogen 2.867 N/A ILE 528.A N ILE 524.A O no hydrogen 2.953 N/A ILE 529.A N GLY 525.A O no hydrogen 3.468 N/A LYS 530.A N MET 526.A O no hydrogen 2.933 N/A ASN 531.A N THR 527.A O no hydrogen 2.830 N/A ASN 532.A N ILE 528.A O no hydrogen 3.006 N/A ASN 532.A ND2 ILE 528.A O no hydrogen 2.843 N/A MET 533.A N ILE 529.A O no hydrogen 3.003 N/A ILE 534.A N LYS 530.A O no hydrogen 3.378 N/A ASN 535.A N ASN 531.A O no hydrogen 2.869 N/A ASN 536.A N ASN 532.A O no hydrogen 3.110 N/A ALA 543.A N GLY 539.A O no hydrogen 2.934 N/A GLN 544.A N PRO 540.A O no hydrogen 2.728 N/A GLN 544.A NE2 ASN 599.A OD1 no hydrogen 2.739 N/A THR 545.A N ALA 541.A O no hydrogen 2.836 N/A THR 545.A OG1 ALA 541.A O no hydrogen 2.896 N/A ALA 546.A N THR 542.A O no hydrogen 2.973 N/A ILE 547.A N ALA 543.A O no hydrogen 2.945 N/A GLN 548.A N GLN 544.A O no hydrogen 3.282 N/A LEU 549.A N THR 545.A O no hydrogen 2.803 N/A PHE 550.A N ALA 546.A O no hydrogen 3.014 N/A ILE 551.A N ILE 547.A O no hydrogen 3.382 N/A ALA 552.A N GLN 548.A O no hydrogen 2.943 N/A ASP 553.A N LEU 549.A O no hydrogen 2.977 N/A TYR 554.A N PHE 550.A O no hydrogen 2.588 N/A TYR 554.A OH GLU 518.A O no hydrogen 2.956 N/A ARG 555.A N ILE 551.A O no hydrogen 2.786 N/A ARG 555.A NH2 GLY 594.A O no hydrogen 2.592 N/A TYR 556.A N ALA 552.A O no hydrogen 3.119 N/A THR 557.A N ASP 553.A O no hydrogen 3.203 N/A THR 557.A OG1 ASP 553.A O no hydrogen 2.752 N/A THR 557.A OG1 ASP 553.A OD1 no hydrogen 3.564 N/A TYR 558.A N TYR 554.A O no hydrogen 3.091 N/A TYR 558.A OH ASP 521.A OD2 no hydrogen 2.790 N/A CYS 560.A N ARG 555.A O no hydrogen 3.012 N/A CYS 560.A SG TYR 554.A O no hydrogen 4.007 N/A CYS 560.A SG VAL 590.A O no hydrogen 3.353 N/A ARG 562.A NE ASP 564.A OD1 no hydrogen 3.493 N/A GLY 563.A N GLY 593.A O no hydrogen 2.883 N/A SER 565.A OG ARG 562.A O no hydrogen 2.627 N/A ARG 571.A NH1 GLU 518.A OE2 no hydrogen 2.586 N/A ARG 571.A NH1 TYR 558.A O no hydrogen 2.873 N/A ARG 571.A NH2 GLU 518.A OE1 no hydrogen 3.560 N/A ARG 571.A NH2 GLU 518.A OE2 no hydrogen 2.958 N/A LYS 573.A N GLY 569.A O no hydrogen 3.021 N/A ILE 574.A N ARG 571.A O no hydrogen 2.848 N/A ILE 575.A N ARG 571.A O no hydrogen 2.905 N/A LYS 576.A N MET 572.A O no hydrogen 2.932 N/A LYS 576.A NZ VAL 567.A O no hydrogen 2.595 N/A LEU 578.A N ILE 574.A O no hydrogen 2.941 N/A TRP 579.A N ILE 575.A O no hydrogen 2.771 N/A GLU 580.A N LYS 576.A O no hydrogen 3.259 N/A ASN 581.A N GLU 577.A O no hydrogen 2.810 N/A THR 582.A N LEU 578.A O no hydrogen 2.951 N/A THR 582.A OG1 LEU 578.A O no hydrogen 2.801 N/A LYS 583.A N ASP 616.A OD2 no hydrogen 3.266 N/A GLY 584.A N ASP 616.A OD1 no hydrogen 2.888 N/A ARG 585.A NE TRP 579.A O no hydrogen 2.925 N/A ARG 585.A NH2 TRP 579.A O no hydrogen 3.289 N/A GLY 587.A N GLY 584.A O no hydrogen 3.147 N/A LEU 588.A N ARG 585.A O no hydrogen 3.044 N/A LEU 589.A N TYR 619.A OH no hydrogen 3.146 N/A ASP 592.A N LEU 589.A O no hydrogen 3.040 N/A GLY 593.A N VAL 590.A O no hydrogen 2.905 N/A GLY 594.A N LEU 589.A O no hydrogen 2.670 N/A TYR 598.A OH ILE 605.A O no hydrogen 2.878 N/A ASN 599.A N ASN 602.A OD1 no hydrogen 2.771 N/A LEU 600.A N ASN 599.A OD1 no hydrogen 2.740 N/A ASN 602.A ND2 ILE 597.A O no hydrogen 3.362 N/A ILE 605.A N ASN 602.A O no hydrogen 3.313 N/A LEU 610.A N PRO 606.A O no hydrogen 3.079 N/A LYS 611.A N GLU 607.A O no hydrogen 3.148 N/A LYS 611.A NZ LEU 588.A O no hydrogen 3.046 N/A LYS 611.A NZ PRO 595.A O no hydrogen 2.711 N/A LYS 611.A NZ GLU 607.A OE2 no hydrogen 3.085 N/A LEU 614.A N LYS 611.A O no hydrogen 3.009 N/A MET 615.A N TYR 612.A O no hydrogen 3.265 N/A GLU 618.A N GLU 618.A OE2 no hydrogen 2.923 N/A TYR 619.A OH ASP 592.A OD2 no hydrogen 3.015 N/A LYS 620.A N ASP 616.A O no hydrogen 2.991 N/A LYS 620.A NZ TYR 612.A O no hydrogen 3.363 N/A GLY 621.A N PRO 617.A O no hydrogen 3.139 N/A ARG 622.A N GLU 618.A O no hydrogen 3.050 N/A LEU 623.A N TYR 619.A O no hydrogen 2.748 N/A LEU 624.A N LYS 620.A O no hydrogen 3.019 N/A ASN 628.A N HIS 625.A O no hydrogen 3.125 N/A ASN 628.A ND2 HIS 625.A O no hydrogen 3.006 N/A PHE 630.A N ASN 628.A OD1 no hydrogen 2.925 N/A VAL 631.A N ASN 628.A OD1 no hydrogen 3.281 N/A GLY 645.A N SER 648.A OG no hydrogen 3.374 N/A THR 646.A N LEU 623.A O no hydrogen 2.988 N/A THR 646.A OG1 LEU 623.A O no hydrogen 3.467 N/A HIS 647.A ND1 GLU 518.A OE1 no hydrogen 2.618 N/A HIS 647.A NE2 ASP 592.A OD2 no hydrogen 2.761 N/A SER 648.A N GLY 645.A O no hydrogen 3.058 N/A SER 648.A OG VAL 643.A O no hydrogen 3.226 N/A ARG 650.A NE PHE 630.A O no hydrogen 2.881 N/A ARG 650.A NH2 PRO 629.A O no hydrogen 3.526 N/A ARG 653.A NH1 GLU 669.A OE2 no hydrogen 2.805 N/A ARG 653.A NH2 GLU 669.A OE1 no hydrogen 3.457 N/A ARG 653.A NH2 GLU 669.A OE2 no hydrogen 3.387 N/A SER 656.A N ASN 654.A OD1 no hydrogen 3.349 N/A SER 656.A OG ASN 654.A OD1 no hydrogen 3.007 N/A LEU 658.A N ARG 655.A O no hydrogen 2.987 N/A THR 660.A N ILE 657.A O no hydrogen 3.246 N/A THR 660.A OG1 ILE 657.A O no hydrogen 2.964 N/A ARG 663.A NE LEU 658.A O no hydrogen 2.908 N/A MET 665.A N GLN 662.A O no hydrogen 3.046 N/A ILE 666.A N ARG 663.A O no hydrogen 2.827 N/A GLU 668.A N ASN 664.A O no hydrogen 2.871 N/A GLU 669.A N MET 665.A O no hydrogen 2.711 N/A GLN 670.A N ILE 666.A O no hydrogen 2.901 N/A CYS 671.A N LEU 667.A O no hydrogen 3.017 N/A TYR 672.A N GLU 668.A O no hydrogen 3.329 N/A ALA 673.A N GLU 669.A O no hydrogen 2.756 N/A LYS 674.A N GLN 670.A O no hydrogen 2.919 N/A CYS 675.A N CYS 671.A O no hydrogen 3.304 N/A CYS 675.A SG CYS 671.A O no hydrogen 3.361 N/A CYS 676.A N TYR 672.A O no hydrogen 2.712 N/A CYS 676.A SG TYR 672.A O no hydrogen 3.459 N/A ASN 677.A N ALA 673.A O no hydrogen 2.690 N/A LEU 678.A N LYS 674.A O no hydrogen 3.156 N/A PHE 679.A N CYS 675.A O no hydrogen 2.784 N/A GLU 680.A N CYS 676.A O no hydrogen 2.725 N/A ALA 681.A N ASN 677.A O no hydrogen 3.157 N/A CYS 682.A N LEU 678.A O no hydrogen 3.004 N/A CYS 682.A SG LEU 678.A O no hydrogen 3.473 N/A PHE 683.A N PHE 679.A O no hydrogen 2.769 N/A ALA 686.A N PHE 683.A O no hydrogen 3.140 N/A ARG 689.A N SER 685.A O no hydrogen 2.707 N/A ALA 700.A N SER 696.A O no hydrogen 3.351 N/A ALA 702.A N LEU 698.A O no hydrogen 2.756 N/A HIS 703.A N GLU 699.A O no hydrogen 2.897 N/A ARG 704.A N ALA 700.A O no hydrogen 3.077 N/A ARG 704.A NE ASP 708.A OD1 no hydrogen 3.414 N/A LEU 705.A N MET 701.A O no hydrogen 2.988 N/A ARG 706.A N ALA 702.A O no hydrogen 2.953 N/A MET 707.A N HIS 703.A O no hydrogen 2.953 N/A ASP 708.A N ARG 704.A O no hydrogen 2.844 N/A ALA 709.A N LEU 705.A O no hydrogen 2.880 N/A ARG 710.A N ARG 706.A O no hydrogen 2.834 N/A ARG 710.A NE GLU 714.A OE2 no hydrogen 3.035 N/A ARG 710.A NH2 GLU 714.A OE2 no hydrogen 3.002 N/A LEU 711.A N MET 707.A O no hydrogen 2.773 N/A ASP 712.A N ASP 708.A O no hydrogen 3.009 N/A TYR 713.A N ALA 709.A O no hydrogen 3.123 N/A GLU 714.A N ARG 710.A O no hydrogen 3.072 N/A SER 715.A N LEU 711.A O no hydrogen 2.819 N/A SER 715.A OG LEU 711.A O no hydrogen 2.609 N/A GLY 716.A N ASP 712.A O no hydrogen 3.362 N/A ARG 717.A N ASP 712.A O no hydrogen 2.660 N/A MET 718.A N ASP 712.A O no hydrogen 3.031 N/A SER 719.A OG ASP 722.A OD1 no hydrogen 3.003 N/A ASP 722.A N SER 719.A OG no hydrogen 3.418 N/A PHE 723.A N SER 719.A O no hydrogen 2.894 N/A GLU 724.A N LYS 720.A O no hydrogen 2.974 N/A LYS 725.A N ASP 721.A O no hydrogen 3.007 N/A ALA 726.A N ASP 722.A O no hydrogen 2.977 N/A MET 727.A N PHE 723.A O no hydrogen 2.840 N/A ALA 728.A N GLU 724.A O no hydrogen 2.882 N/A HIS 729.A N LYS 725.A O no hydrogen 2.977 N/A LEU 730.A N ALA 726.A O no hydrogen 2.966 N/A GLY 731.A N MET 727.A O no hydrogen 2.865 N/A ILE 733.A N HIS 729.A O no hydrogen 3.328 N/A