Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mdz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 7.A N THR 708.A O no hydrogen 2.912 N/A ARG 7.A NH1 ASP 711.A OD1 no hydrogen 3.187 N/A GLY 11.A N ASP 701.A OD2 no hydrogen 3.188 N/A THR 12.A N ASP 741.A OD1 no hydrogen 2.585 N/A THR 12.A N ASP 741.A OD2 no hydrogen 3.226 N/A SER 13.A N ASP 741.A OD1 no hydrogen 2.542 N/A ARG 15.A N VAL 380.A O no hydrogen 3.083 N/A ARG 15.A NH1 GLU 686.A OE1 no hydrogen 3.450 N/A ARG 15.A NH1 GLU 686.A OE2 no hydrogen 3.186 N/A ILE 17.A N GLY 378.A O no hydrogen 3.389 N/A LEU 19.A N VAL 376.A O no hydrogen 2.907 N/A GLN 20.A N PHE 680.A O no hydrogen 2.823 N/A GLN 20.A NE2 ASP 375.A OD1 no hydrogen 3.170 N/A ALA 21.A N THR 374.A O no hydrogen 3.036 N/A ASN 22.A N ARG 678.A O no hydrogen 3.350 N/A ASN 22.A ND2 ILE 188.A O no hydrogen 2.988 N/A ASN 22.A ND2 HIS 676.A O no hydrogen 2.839 N/A PHE 24.A N LEU 186.A O no hydrogen 3.011 N/A MET 26.A N MET 184.A O no hydrogen 2.854 N/A ASP 27.A N MET 368.A O no hydrogen 2.576 N/A ILE 33.A N VAL 109.A O no hydrogen 3.062 N/A TYR 34.A N THR 79.A O no hydrogen 2.917 N/A HIS 35.A N SER 107.A O no hydrogen 3.049 N/A HIS 35.A ND1 LEU 77.A O no hydrogen 3.035 N/A TYR 36.A N LEU 77.A O no hydrogen 2.782 N/A GLU 37.A N LYS 104.A O no hydrogen 2.538 N/A LEU 38.A N LYS 75.A O no hydrogen 2.691 N/A ASP 39.A N SER 102.A O no hydrogen 2.729 N/A LYS 41.A N LYS 100.A O no hydrogen 3.320 N/A CYS 45.A SG PRO 42.A O no hydrogen 3.516 N/A ASN 50.A N PRO 46.A O no hydrogen 3.091 N/A ASN 50.A ND2 GLY 73.A O no hydrogen 3.032 N/A ARG 51.A N ARG 47.A O no hydrogen 3.020 N/A ARG 51.A NH1 PHE 71.A O no hydrogen 2.941 N/A GLU 52.A N ARG 48.A O no hydrogen 3.080 N/A ILE 53.A N VAL 49.A O no hydrogen 2.804 N/A VAL 54.A N ASN 50.A O no hydrogen 2.923 N/A GLU 55.A N ARG 51.A O no hydrogen 2.986 N/A HIS 56.A N GLU 52.A O no hydrogen 3.031 N/A HIS 56.A ND1 GLU 52.A O no hydrogen 2.806 N/A MET 57.A N ILE 53.A O no hydrogen 2.870 N/A VAL 58.A N VAL 54.A O no hydrogen 2.877 N/A HIS 60.A N HIS 56.A O no hydrogen 3.073 N/A ILE 65.A N PHE 61.A O no hydrogen 2.880 N/A LYS 68.A NZ GLU 364.A OE1 no hydrogen 3.398 N/A VAL 70.A N TYR 78.A O no hydrogen 2.959 N/A PHE 71.A N HIS 139.A ND1 no hydrogen 2.969 N/A ASP 72.A N ASN 76.A O no hydrogen 2.907 N/A LEU 77.A N TYR 36.A O no hydrogen 2.947 N/A TYR 78.A N VAL 70.A O no hydrogen 3.152 N/A TYR 78.A OH GLN 131.A OE1 no hydrogen 3.420 N/A THR 79.A N TYR 34.A O no hydrogen 2.903 N/A THR 79.A OG1 MET 81.A O no hydrogen 2.994 N/A VAL 90.A N ILE 103.A O no hydrogen 2.915 N/A LEU 92.A N VAL 101.A O no hydrogen 2.829 N/A VAL 94.A N PHE 99.A O no hydrogen 3.005 N/A PHE 99.A N VAL 94.A O no hydrogen 2.949 N/A VAL 101.A N LEU 92.A O no hydrogen 2.988 N/A SER 102.A N ASP 39.A O no hydrogen 2.774 N/A ILE 103.A N VAL 90.A O no hydrogen 2.838 N/A LYS 104.A N GLU 37.A O no hydrogen 2.703 N/A VAL 106.A N HIS 35.A O no hydrogen 3.169 N/A VAL 109.A N ILE 33.A O no hydrogen 2.928 N/A HIS 115.A N LEU 111.A O no hydrogen 3.117 N/A HIS 115.A ND1 LEU 111.A O no hydrogen 2.536 N/A ASP 116.A N GLN 112.A O no hydrogen 3.007 N/A ALA 117.A N ALA 113.A O no hydrogen 2.879 N/A LEU 118.A N LEU 114.A O no hydrogen 2.848 N/A SER 119.A N HIS 115.A O no hydrogen 2.824 N/A GLY 120.A N SER 119.A OG no hydrogen 2.697 N/A LEU 122.A N ASP 116.A O no hydrogen 2.661 N/A GLU 128.A N GLU 128.A OE1 no hydrogen 2.689 N/A THR 129.A N PRO 126.A O no hydrogen 3.248 N/A ILE 130.A N PRO 126.A O no hydrogen 3.317 N/A GLN 131.A N PHE 127.A O no hydrogen 2.925 N/A ALA 132.A N GLU 128.A O no hydrogen 2.965 N/A LEU 133.A N THR 129.A O no hydrogen 2.924 N/A ASP 134.A N ILE 130.A O no hydrogen 2.978 N/A VAL 135.A N GLN 131.A O no hydrogen 2.941 N/A VAL 136.A N ALA 132.A O no hydrogen 3.026 N/A MET 137.A N LEU 133.A O no hydrogen 2.992 N/A ARG 138.A N ASP 134.A O no hydrogen 3.014 N/A ARG 138.A NE GLN 175.A O no hydrogen 3.445 N/A ARG 138.A NH2 GLN 175.A O no hydrogen 2.815 N/A HIS 139.A N VAL 136.A O no hydrogen 3.286 N/A SER 142.A N ARG 138.A O no hydrogen 3.077 N/A SER 142.A OG ARG 138.A O no hydrogen 2.325 N/A MET 143.A N LEU 140.A O no hydrogen 3.033 N/A ARG 144.A N LEU 140.A O no hydrogen 2.858 N/A TYR 145.A N PRO 141.A O no hydrogen 2.946 N/A THR 146.A N PHE 153.A O no hydrogen 2.823 N/A VAL 148.A N SER 151.A O no hydrogen 2.953 N/A SER 151.A N VAL 148.A O no hydrogen 2.927 N/A PHE 152.A N PHE 173.A O no hydrogen 2.900 N/A PHE 153.A N THR 146.A O no hydrogen 2.765 N/A THR 154.A N PHE 171.A O no hydrogen 2.911 N/A ARG 167.A N GLY 164.A O no hydrogen 3.233 N/A ARG 167.A NH1 GLU 232.A OE2 no hydrogen 3.193 N/A GLU 168.A N PHE 195.A O no hydrogen 2.859 N/A VAL 169.A N ASN 161.A O no hydrogen 2.849 N/A TRP 170.A N THR 193.A O no hydrogen 2.963 N/A TRP 170.A NE1 GLU 168.A OE2 no hydrogen 2.924 N/A GLY 172.A N SER 191.A O no hydrogen 2.848 N/A PHE 173.A N PHE 152.A O no hydrogen 2.965 N/A HIS 174.A N ASP 189.A O no hydrogen 2.827 N/A SER 176.A N ASN 187.A O no hydrogen 2.925 N/A VAL 177.A N ASP 134.A OD1 no hydrogen 3.503 N/A ARG 178.A N MET 185.A O no hydrogen 2.901 N/A ARG 178.A NH2 GLU 637.A OE2 no hydrogen 3.488 N/A SER 180.A OG LYS 703.A O no hydrogen 2.158 N/A LEU 181.A N SER 180.A OG no hydrogen 2.420 N/A MET 185.A N ARG 178.A O no hydrogen 3.007 N/A LEU 186.A N PHE 24.A O no hydrogen 2.804 N/A ASN 187.A N SER 176.A O no hydrogen 2.824 N/A ASN 187.A ND2 HIS 676.A O no hydrogen 2.975 N/A ILE 188.A N ASN 22.A O no hydrogen 3.199 N/A ASP 189.A N HIS 174.A O no hydrogen 3.075 N/A SER 191.A N GLY 172.A O no hydrogen 2.797 N/A THR 193.A N TRP 170.A O no hydrogen 3.026 N/A ALA 194.A N THR 193.A OG1 no hydrogen 2.485 N/A PHE 195.A N GLU 168.A O no hydrogen 2.938 N/A TYR 196.A N GLN 318.A O no hydrogen 2.670 N/A LYS 197.A N GLY 166.A O no hydrogen 2.605 N/A GLN 199.A NE2 GLU 207.A OE2 no hydrogen 3.291 N/A VAL 201.A N CYS 312.A O no hydrogen 2.954 N/A GLU 203.A N PRO 200.A O no hydrogen 2.835 N/A PHE 204.A N PRO 200.A O no hydrogen 3.036 N/A VAL 205.A N VAL 201.A O no hydrogen 2.845 N/A CYS 206.A SG ILE 202.A O no hydrogen 3.176 N/A GLU 207.A N GLU 203.A O no hydrogen 2.971 N/A VAL 208.A N PHE 204.A O no hydrogen 2.941 N/A LEU 209.A N VAL 205.A O no hydrogen 2.914 N/A PHE 211.A N CYS 206.A O no hydrogen 2.496 N/A GLU 216.A N SER 213.A O no hydrogen 3.402 N/A THR 222.A OG1 SER 224.A OG no hydrogen 2.989 N/A SER 224.A OG THR 222.A OG1 no hydrogen 2.989 N/A GLN 225.A NE2 GLN 217.A OE1 no hydrogen 3.640 N/A ARG 226.A N THR 222.A O no hydrogen 2.931 N/A VAL 227.A N ASP 223.A O no hydrogen 3.033 N/A LYS 228.A N SER 224.A O no hydrogen 2.956 N/A LYS 228.A NZ VAL 208.A O no hydrogen 3.556 N/A PHE 229.A N GLN 225.A O no hydrogen 2.890 N/A THR 230.A N ARG 226.A O no hydrogen 2.850 N/A THR 230.A OG1 ARG 226.A O no hydrogen 2.405 N/A LYS 231.A N VAL 227.A O no hydrogen 2.757 N/A GLU 232.A N LYS 228.A O no hydrogen 3.235 N/A GLU 232.A N PHE 229.A O no hydrogen 3.292 N/A ILE 233.A N PHE 229.A O no hydrogen 3.068 N/A ILE 233.A N THR 230.A O no hydrogen 3.210 N/A LYS 234.A N THR 230.A O no hydrogen 2.788 N/A GLY 235.A N VAL 249.A O no hydrogen 2.930 N/A LEU 236.A N ILE 233.A O no hydrogen 3.063 N/A LYS 237.A N GLN 318.A OE1 no hydrogen 2.863 N/A VAL 238.A N TYR 247.A O no hydrogen 2.785 N/A GLU 239.A N ASN 313.A O no hydrogen 2.765 N/A ILE 240.A N ARG 245.A O no hydrogen 3.158 N/A THR 241.A N VAL 311.A O no hydrogen 2.962 N/A THR 241.A OG1 VAL 311.A O no hydrogen 3.114 N/A CYS 243.A SG HIS 242.A ND1 no hydrogen 3.469 N/A TYR 247.A N VAL 238.A O no hydrogen 2.643 N/A VAL 249.A N LEU 236.A O no hydrogen 2.965 N/A CYS 250.A N GLN 297.A O no hydrogen 2.859 N/A CYS 250.A SG GLN 297.A O no hydrogen 3.184 N/A CYS 250.A SG GLY 299.A O no hydrogen 3.626 N/A ASN 251.A N GLN 297.A O no hydrogen 3.259 N/A VAL 252.A N ASN 251.A OD1 no hydrogen 2.525 N/A THR 253.A N CYS 295.A O no hydrogen 2.952 N/A THR 253.A OG1 ARG 255.A O no hydrogen 3.197 N/A THR 253.A OG1 CYS 295.A O no hydrogen 3.197 N/A ALA 257.A N LEU 293.A O no hydrogen 3.087 N/A SER 258.A OG HIS 259.A ND1 no hydrogen 2.613 N/A HIS 259.A N PRO 256.A O no hydrogen 3.181 N/A HIS 259.A ND1 SER 258.A OG no hydrogen 2.613 N/A GLN 260.A N PRO 256.A O no hydrogen 2.852 N/A PHE 262.A N CYS 274.A O no hydrogen 2.960 N/A LEU 264.A N VAL 272.A O no hydrogen 3.056 N/A CYS 274.A N PHE 262.A O no hydrogen 3.283 N/A CYS 274.A SG THR 275.A O no hydrogen 3.321 N/A VAL 276.A N GLN 260.A O no hydrogen 2.892 N/A ALA 277.A N ALA 257.A O no hydrogen 3.069 N/A GLN 278.A NE2 ASP 282.A OD2 no hydrogen 3.024 N/A TYR 279.A N THR 275.A O no hydrogen 2.992 N/A PHE 280.A N VAL 276.A O no hydrogen 3.004 N/A LYS 281.A N ALA 277.A O no hydrogen 3.078 N/A ASP 282.A N GLN 278.A O no hydrogen 2.981 N/A ARG 283.A N TYR 279.A O no hydrogen 2.641 N/A ARG 283.A NH1 ARG 283.A O no hydrogen 3.311 N/A LEU 286.A N PHE 280.A O no hydrogen 2.547 N/A ARG 289.A N GLU 310.A OE1 no hydrogen 2.992 N/A TYR 290.A N GLU 310.A OE2 no hydrogen 3.327 N/A CYS 295.A N THR 253.A OG1 no hydrogen 2.542 N/A LEU 296.A N LEU 307.A O no hydrogen 2.780 N/A GLN 297.A N ASN 251.A O no hydrogen 2.667 N/A VAL 298.A N THR 305.A O no hydrogen 2.684 N/A GLY 299.A N ARG 248.A O no hydrogen 3.507 N/A GLU 301.A N GLU 301.A OE2 no hydrogen 2.396 N/A LYS 303.A N GLN 300.A O no hydrogen 2.930 N/A HIS 304.A ND1 TYR 306.A OH no hydrogen 2.522 N/A TYR 306.A OH HIS 304.A ND1 no hydrogen 2.522 N/A LEU 307.A N LEU 296.A O no hydrogen 2.936 N/A VAL 311.A N PRO 308.A O no hydrogen 3.417 N/A CYS 312.A N LEU 309.A O no hydrogen 3.291 N/A CYS 312.A SG PRO 308.A O no hydrogen 3.475 N/A ASN 313.A N GLU 239.A O no hydrogen 2.899 N/A ILE 314.A N GLN 199.A O no hydrogen 2.946 N/A VAL 315.A N LYS 237.A O no hydrogen 3.477 N/A CYS 320.A N ALA 194.A O no hydrogen 2.694 N/A CYS 320.A SG TYR 196.A OH no hydrogen 3.482 N/A CYS 320.A SG LYS 322.A O no hydrogen 3.992 N/A LYS 322.A NZ LYS 231.A O no hydrogen 2.763 N/A THR 325.A N GLN 328.A OE1 no hydrogen 3.178 N/A GLN 328.A NE2 LEU 163.A O no hydrogen 3.471 N/A GLN 328.A NE2 GLY 164.A O no hydrogen 3.693 N/A THR 329.A N THR 325.A O no hydrogen 2.945 N/A THR 329.A OG1 LEU 324.A O no hydrogen 3.402 N/A THR 329.A OG1 THR 325.A O no hydrogen 3.032 N/A SER 330.A N ASP 326.A O no hydrogen 2.914 N/A THR 331.A N ASN 327.A O no hydrogen 2.926 N/A THR 331.A OG1 ASN 327.A O no hydrogen 2.493 N/A MET 332.A N GLN 328.A O no hydrogen 2.943 N/A ILE 333.A N THR 329.A O no hydrogen 3.056 N/A ARG 334.A N SER 330.A O no hydrogen 2.608 N/A ALA 335.A N MET 332.A O no hydrogen 2.917 N/A ARG 338.A NE ALA 335.A O no hydrogen 3.083 N/A ALA 340.A N SER 691.A O no hydrogen 2.893 N/A ARG 343.A N SER 339.A O no hydrogen 2.931 N/A ARG 343.A NH1 VAL 190.A O no hydrogen 3.283 N/A GLN 344.A N ALA 340.A O no hydrogen 2.923 N/A GLU 345.A N PRO 341.A O no hydrogen 2.959 N/A GLU 346.A N ASP 342.A O no hydrogen 2.910 N/A ILE 347.A N ARG 343.A O no hydrogen 2.931 N/A SER 348.A N GLN 344.A O no hydrogen 3.040 N/A SER 348.A OG GLN 344.A O no hydrogen 2.962 N/A LYS 349.A N GLU 345.A O no hydrogen 2.745 N/A LEU 350.A N GLU 346.A O no hydrogen 2.865 N/A MET 351.A N ILE 347.A O no hydrogen 2.884 N/A ARG 352.A N SER 348.A O no hydrogen 2.992 N/A ARG 352.A N LYS 349.A O no hydrogen 3.195 N/A SER 353.A N LYS 349.A O no hydrogen 2.981 N/A SER 353.A OG LYS 349.A O no hydrogen 3.289 N/A ALA 354.A N LEU 350.A O no hydrogen 2.782 N/A ASN 357.A ND2 VAL 369.A O no hydrogen 3.364 N/A THR 358.A OG1 ASP 355.A O no hydrogen 3.209 N/A THR 358.A OG1 ASP 355.A OD2 no hydrogen 2.526 N/A VAL 362.A N ASP 359.A O no hydrogen 3.241 N/A ARG 363.A N ASP 359.A O no hydrogen 2.986 N/A GLU 364.A N PRO 360.A O no hydrogen 2.830 N/A PHE 365.A N VAL 362.A O no hydrogen 3.285 N/A GLY 366.A N ARG 363.A O no hydrogen 3.102 N/A ILE 367.A N VAL 362.A O no hydrogen 3.257 N/A MET 368.A N ASP 27.A O no hydrogen 3.080 N/A LYS 370.A N GLU 25.A O no hydrogen 2.819 N/A ASP 371.A N ASP 371.A OD1 no hydrogen 2.515 N/A THR 374.A N PHE 23.A O no hydrogen 3.027 N/A THR 374.A OG1 PHE 23.A O no hydrogen 2.739 N/A VAL 376.A N LEU 19.A O no hydrogen 2.925 N/A ARG 379.A N THR 699.A O no hydrogen 3.000 N/A ARG 379.A NH1 SER 13.A O no hydrogen 3.477 N/A ARG 379.A NH1 GLN 744.A OE1 no hydrogen 2.856 N/A ARG 379.A NH2 ASP 701.A OD2 no hydrogen 2.601 N/A ARG 379.A NH2 GLN 744.A OE1 no hydrogen 2.576 N/A VAL 380.A N ARG 15.A O no hydrogen 2.636 N/A LEU 381.A N GLY 697.A O no hydrogen 2.845 N/A ILE 386.A N ALA 396.A O no hydrogen 2.967 N/A LEU 387.A N ILE 545.A O no hydrogen 3.050 N/A TYR 388.A N ALA 394.A O no hydrogen 3.196 N/A GLY 389.A N GLN 409.A O no hydrogen 3.078 N/A ALA 396.A N ILE 386.A O no hydrogen 2.870 N/A VAL 399.A N VAL 402.A O no hydrogen 3.058 N/A VAL 402.A N VAL 399.A O no hydrogen 3.147 N/A TRP 403.A N THR 758.A O no hydrogen 2.989 N/A TRP 403.A NE1 TYR 388.A OH no hydrogen 2.806 N/A ARG 406.A NE ASP 404.A OD2 no hydrogen 3.181 N/A LYS 408.A N MET 405.A O no hydrogen 2.899 N/A LYS 408.A NZ ARG 406.A O no hydrogen 2.813 N/A PHE 410.A N ALA 449.A O no hydrogen 2.861 N/A HIS 411.A N ASN 543.A O no hydrogen 2.890 N/A THR 412.A N VAL 542.A O no hydrogen 2.811 N/A THR 412.A OG1 HIS 411.A ND1 no hydrogen 3.218 N/A ILE 416.A N PRO 452.A O no hydrogen 2.963 N/A LYS 417.A N GLN 484.A OE1 no hydrogen 2.749 N/A TRP 419.A NE1 GLY 455.A O no hydrogen 3.048 N/A ALA 420.A N LEU 485.A O no hydrogen 3.039 N/A ILE 421.A N PHE 459.A O no hydrogen 2.849 N/A ALA 422.A N VAL 487.A O no hydrogen 2.937 N/A CYS 423.A N LYS 461.A O no hydrogen 3.121 N/A CYS 423.A SG ALA 425.A O no hydrogen 3.530 N/A PHE 424.A N ILE 489.A O no hydrogen 2.843 N/A GLN 429.A N PRO 426.A O no hydrogen 3.225 N/A CYS 430.A N PRO 426.A O no hydrogen 3.054 N/A CYS 430.A N GLN 427.A O no hydrogen 3.302 N/A THR 431.A N HIS 434.A ND1 no hydrogen 3.219 N/A HIS 434.A N THR 431.A OG1 no hydrogen 3.359 N/A LYS 436.A N GLU 432.A O no hydrogen 2.993 N/A SER 437.A N VAL 433.A O no hydrogen 2.965 N/A PHE 438.A N HIS 434.A O no hydrogen 2.903 N/A THR 439.A N LEU 435.A O no hydrogen 2.904 N/A THR 439.A OG1 LEU 435.A O no hydrogen 2.458 N/A GLU 440.A N LYS 436.A O no hydrogen 2.888 N/A GLN 441.A N SER 437.A O no hydrogen 2.987 N/A LEU 442.A N PHE 438.A O no hydrogen 2.909 N/A ARG 443.A N THR 439.A O no hydrogen 2.858 N/A ARG 443.A NH2 ILE 453.A O no hydrogen 3.461 N/A LYS 444.A N GLU 440.A O no hydrogen 3.051 N/A LYS 444.A NZ ASP 448.A OD2 no hydrogen 3.225 N/A ILE 445.A N GLN 441.A O no hydrogen 3.124 N/A SER 446.A N LEU 442.A O no hydrogen 2.805 N/A SER 446.A OG LEU 442.A O no hydrogen 3.189 N/A SER 446.A OG ARG 443.A O no hydrogen 2.490 N/A ARG 447.A N ARG 443.A O no hydrogen 2.986 N/A ASP 448.A N LYS 444.A O no hydrogen 2.991 N/A ALA 449.A N ILE 445.A O no hydrogen 2.955 N/A ALA 449.A N SER 446.A O no hydrogen 3.087 N/A GLY 450.A N ARG 447.A O no hydrogen 3.387 N/A MET 451.A N SER 446.A O no hydrogen 2.957 N/A ILE 453.A N SER 446.A OG no hydrogen 3.247 N/A GLN 454.A N ILE 416.A O no hydrogen 2.867 N/A CYS 458.A N TRP 419.A O no hydrogen 3.016 N/A CYS 458.A SG TRP 419.A O no hydrogen 3.403 N/A LYS 461.A N ILE 421.A O no hydrogen 3.097 N/A TYR 462.A OH CYS 430.A O no hydrogen 2.615 N/A ALA 463.A N CYS 423.A O no hydrogen 2.671 N/A SER 468.A N GLY 465.A O no hydrogen 3.291 N/A SER 468.A OG GLN 464.A O no hydrogen 2.877 N/A VAL 469.A N ALA 466.A O no hydrogen 3.078 N/A MET 472.A N SER 468.A O no hydrogen 3.334 N/A PHE 473.A N VAL 469.A O no hydrogen 3.085 N/A ARG 474.A N GLU 470.A O no hydrogen 3.438 N/A ARG 474.A NH1 GLU 470.A OE1 no hydrogen 3.231 N/A HIS 475.A N PRO 471.A O no hydrogen 3.158 N/A LEU 476.A N MET 472.A O no hydrogen 2.750 N/A LYS 477.A N PHE 473.A O no hydrogen 2.861 N/A ASN 478.A N ARG 474.A O no hydrogen 3.039 N/A THR 479.A N HIS 475.A O no hydrogen 2.984 N/A THR 479.A OG1 HIS 475.A O no hydrogen 2.365 N/A TYR 480.A N LEU 476.A O no hydrogen 3.467 N/A TYR 480.A OH CYS 458.A O no hydrogen 3.042 N/A GLN 484.A N VAL 418.A O no hydrogen 2.879 N/A VAL 486.A N ALA 511.A O no hydrogen 2.899 N/A VAL 487.A N ALA 420.A O no hydrogen 3.022 N/A VAL 488.A N GLN 513.A O no hydrogen 3.102 N/A ILE 489.A N ALA 422.A O no hydrogen 3.351 N/A LEU 490.A N VAL 515.A O no hydrogen 2.895 N/A VAL 496.A N THR 494.A OG1 no hydrogen 3.200 N/A TYR 497.A N THR 494.A O no hydrogen 3.366 N/A VAL 500.A N VAL 496.A O no hydrogen 2.893 N/A LYS 501.A N TYR 497.A O no hydrogen 2.942 N/A LYS 501.A NZ THR 512.A O no hydrogen 3.394 N/A LYS 501.A NZ THR 512.A OG1 no hydrogen 3.313 N/A ARG 502.A N ALA 498.A O no hydrogen 2.986 N/A VAL 503.A N GLU 499.A O no hydrogen 2.811 N/A GLY 504.A N VAL 500.A O no hydrogen 2.800 N/A ASP 505.A N LYS 501.A O no hydrogen 2.883 N/A THR 506.A N ARG 502.A O no hydrogen 3.135 N/A THR 506.A OG1 ARG 502.A O no hydrogen 2.211 N/A VAL 507.A N ARG 502.A O no hydrogen 3.330 N/A LEU 508.A N VAL 503.A O no hydrogen 2.919 N/A MET 510.A N GLY 504.A O no hydrogen 2.961 N/A GLN 513.A N VAL 486.A O no hydrogen 3.059 N/A GLN 513.A NE2 CYS 514.A O no hydrogen 2.949 N/A VAL 515.A N VAL 488.A O no hydrogen 2.955 N/A ASN 519.A N GLN 516.A O no hydrogen 3.302 N/A VAL 520.A N MET 517.A O no hydrogen 3.049 N/A GLN 521.A N MET 517.A O no hydrogen 3.375 N/A ARG 522.A N LYS 518.A O no hydrogen 3.101 N/A GLN 526.A NE2 GLN 526.A O no hydrogen 3.472 N/A GLN 526.A NE2 ASN 530.A OD1 no hydrogen 3.052 N/A THR 527.A OG1 THR 524.A OG1 no hydrogen 3.082 N/A LEU 528.A N THR 524.A O no hydrogen 3.250 N/A SER 529.A N PRO 525.A O no hydrogen 2.962 N/A ASN 530.A N GLN 526.A O no hydrogen 3.071 N/A ASN 530.A ND2 ARG 756.A O no hydrogen 3.545 N/A LEU 531.A N THR 527.A O no hydrogen 3.003 N/A CYS 532.A N LEU 528.A O no hydrogen 2.823 N/A CYS 532.A SG LEU 528.A O no hydrogen 3.142 N/A LEU 533.A N SER 529.A O no hydrogen 2.982 N/A LYS 534.A N ASN 530.A O no hydrogen 3.196 N/A LYS 534.A NZ GLN 513.A OE1 no hydrogen 2.789 N/A LYS 534.A NZ ALA 804.A O no hydrogen 3.117 N/A LYS 534.A NZ ALA 804.A OXT no hydrogen 3.052 N/A ILE 535.A N LEU 531.A O no hydrogen 2.976 N/A ASN 536.A N CYS 532.A O no hydrogen 2.932 N/A ASN 536.A ND2 THR 412.A O no hydrogen 3.579 N/A ASN 536.A ND2 ASN 543.A OD1 no hydrogen 2.656 N/A VAL 537.A N LEU 533.A O no hydrogen 3.218 N/A LYS 538.A N LYS 534.A O no hydrogen 2.840 N/A LYS 538.A NZ THR 512.A O no hydrogen 2.678 N/A LYS 538.A NZ GLN 513.A OE1 no hydrogen 2.799 N/A LEU 539.A N ILE 535.A O no hydrogen 2.961 N/A GLY 540.A N VAL 537.A O no hydrogen 3.108 N/A GLY 541.A N ASN 536.A O no hydrogen 2.821 N/A VAL 542.A N THR 412.A O no hydrogen 3.251 N/A ASN 543.A ND2 LEU 533.A O no hydrogen 3.035 N/A ASN 543.A ND2 VAL 755.A O no hydrogen 3.102 N/A ASN 544.A ND2 TYR 388.A OH no hydrogen 3.004 N/A ILE 545.A N LEU 387.A O no hydrogen 3.512 N/A LEU 547.A N SER 385.A O no hydrogen 3.092 N/A GLN 549.A N GLN 549.A OE1 no hydrogen 2.926 N/A GLY 550.A N LEU 547.A O no hydrogen 2.783 N/A ARG 551.A NE PRO 548.A O no hydrogen 2.917 N/A ARG 551.A NH2 PRO 548.A O no hydrogen 3.467 N/A PHE 555.A N PRO 552.A O no hydrogen 3.138 N/A GLN 556.A N PRO 553.A O no hydrogen 3.178 N/A ILE 560.A N ARG 627.A O no hydrogen 3.090 N/A PHE 561.A N SER 581.A OG no hydrogen 2.964 N/A LEU 562.A N ILE 629.A O no hydrogen 2.674 N/A GLY 563.A N VAL 579.A O no hydrogen 3.107 N/A ALA 564.A N TYR 631.A O no hydrogen 3.093 N/A ASP 565.A N ALA 577.A O no hydrogen 3.038 N/A VAL 566.A N ASP 565.A OD1 no hydrogen 2.516 N/A THR 567.A N ILE 575.A O no hydrogen 2.995 N/A SER 574.A N GLN 596.A O no hydrogen 3.121 N/A SER 574.A OG GLN 597.A O no hydrogen 3.167 N/A ILE 575.A N THR 567.A O no hydrogen 3.116 N/A ALA 576.A N ARG 594.A O no hydrogen 3.075 N/A ALA 577.A N ASP 565.A O no hydrogen 2.867 N/A VAL 578.A N THR 592.A O no hydrogen 2.937 N/A VAL 579.A N GLY 563.A O no hydrogen 2.848 N/A GLY 580.A N CYS 590.A O no hydrogen 3.061 N/A SER 581.A N PHE 561.A O no hydrogen 2.985 N/A MET 582.A N ARG 588.A O no hydrogen 2.768 N/A ASN 587.A N ASP 583.A OD1 no hydrogen 2.810 N/A ARG 588.A N ASP 583.A OD1 no hydrogen 3.384 N/A ARG 588.A N ASP 583.A OD2 no hydrogen 3.055 N/A ARG 588.A NH1 VAL 537.A O no hydrogen 2.984 N/A ARG 588.A NH2 VAL 537.A O no hydrogen 2.526 N/A CYS 590.A N GLY 580.A O no hydrogen 2.894 N/A CYS 590.A SG LEU 798.A O no hydrogen 3.685 N/A THR 592.A N VAL 578.A O no hydrogen 3.063 N/A THR 592.A OG1 VAL 578.A O no hydrogen 2.554 N/A ARG 594.A N ALA 576.A O no hydrogen 2.998 N/A ARG 594.A NE ASP 605.A OD2 no hydrogen 3.529 N/A ARG 594.A NH1 GLU 612.A OE2 no hydrogen 3.287 N/A ARG 594.A NH2 GLU 612.A OE2 no hydrogen 2.629 N/A GLN 596.A N SER 574.A O no hydrogen 2.622 N/A GLN 596.A NE2 ILE 602.A O no hydrogen 3.583 N/A HIS 598.A ND1 LYS 572.A O no hydrogen 2.440 N/A ARG 599.A N SER 574.A OG no hydrogen 2.743 N/A ARG 599.A NH2 PRO 569.A O no hydrogen 3.452 N/A GLN 600.A N GLN 597.A O no hydrogen 3.384 N/A ILE 603.A N GLU 647.A OE2 no hydrogen 3.028 N/A GLN 604.A N GLN 596.A OE1 no hydrogen 2.292 N/A MET 609.A N ASP 605.A O no hydrogen 3.302 N/A VAL 610.A N LEU 606.A O no hydrogen 2.811 N/A ARG 611.A N ALA 607.A O no hydrogen 2.974 N/A GLU 612.A N ALA 608.A O no hydrogen 3.055 N/A LEU 613.A N MET 609.A O no hydrogen 3.184 N/A LEU 614.A N VAL 610.A O no hydrogen 2.848 N/A ILE 615.A N ARG 611.A O no hydrogen 2.946 N/A GLN 616.A N GLU 612.A O no hydrogen 2.835 N/A PHE 617.A N LEU 613.A O no hydrogen 2.787 N/A TYR 618.A N LEU 614.A O no hydrogen 3.063 N/A LYS 619.A N ILE 615.A O no hydrogen 2.966 N/A SER 620.A N GLN 616.A O no hydrogen 3.012 N/A SER 620.A N PHE 617.A O no hydrogen 3.119 N/A SER 620.A OG GLN 616.A O no hydrogen 2.933 N/A THR 621.A OG1 PHE 617.A O no hydrogen 2.594 N/A THR 621.A OG1 PHE 623.A O no hydrogen 3.288 N/A ARG 622.A N TYR 618.A O no hydrogen 2.671 N/A PHE 623.A N THR 621.A OG1 no hydrogen 3.172 N/A LYS 624.A NZ GLU 659.A OE1 no hydrogen 2.921 N/A THR 626.A N PRO 558.A O no hydrogen 2.579 N/A THR 626.A OG1 GLN 557.A OE1 no hydrogen 3.318 N/A THR 626.A OG1 PRO 558.A O no hydrogen 2.956 N/A ARG 627.A N PRO 558.A O no hydrogen 3.396 N/A ILE 628.A N GLY 665.A O no hydrogen 2.840 N/A ILE 629.A N ILE 560.A O no hydrogen 2.962 N/A PHE 630.A N THR 667.A O no hydrogen 2.973 N/A TYR 631.A N LEU 562.A O no hydrogen 2.763 N/A TYR 631.A OH THR 747.A OG1 no hydrogen 2.566 N/A ARG 632.A N ILE 669.A O no hydrogen 2.618 N/A ARG 632.A NE GLU 647.A OE1 no hydrogen 2.744 N/A ARG 632.A NE GLU 647.A OE2 no hydrogen 2.965 N/A ARG 632.A NH1 ALA 633.A O no hydrogen 3.298 N/A ARG 632.A NH2 GLU 647.A OE2 no hydrogen 2.736 N/A ALA 633.A N ALA 564.A O no hydrogen 2.852 N/A SER 636.A N GLN 639.A OE1 no hydrogen 2.894 N/A GLN 639.A N SER 636.A O no hydrogen 3.210 N/A GLN 639.A NE2 GLU 601.A OE1 no hydrogen 2.855 N/A PHE 640.A N GLU 637.A O no hydrogen 3.160 N/A VAL 643.A N GLN 639.A O no hydrogen 2.880 N/A LEU 644.A N PHE 640.A O no hydrogen 2.855 N/A HIS 645.A N GLN 641.A O no hydrogen 3.352 N/A HIS 646.A N GLN 642.A O no hydrogen 3.191 N/A HIS 646.A NE2 GLN 604.A O no hydrogen 3.350 N/A GLU 647.A N VAL 643.A O no hydrogen 2.849 N/A ALA 650.A N HIS 646.A O no hydrogen 2.846 N/A ILE 651.A N GLU 647.A O no hydrogen 2.964 N/A ARG 652.A N LEU 648.A O no hydrogen 2.943 N/A GLU 653.A N LEU 649.A O no hydrogen 2.551 N/A ALA 654.A N ALA 650.A O no hydrogen 3.170 N/A CYS 655.A N ILE 651.A O no hydrogen 3.294 N/A CYS 655.A N ARG 652.A O no hydrogen 3.151 N/A CYS 655.A SG ILE 651.A O no hydrogen 3.477 N/A ILE 656.A N GLU 653.A O no hydrogen 3.072 N/A LYS 657.A N GLU 653.A O no hydrogen 3.026 N/A LYS 657.A NZ GLU 653.A OE1 no hydrogen 3.447 N/A TYR 662.A N GLU 659.A O no hydrogen 3.201 N/A TYR 662.A OH PRO 625.A O no hydrogen 2.239 N/A GLY 665.A N THR 626.A O no hydrogen 3.379 N/A ILE 666.A N ASP 735.A OD2 no hydrogen 3.326 N/A THR 667.A N ILE 628.A O no hydrogen 2.831 N/A THR 667.A OG1 ASP 734.A OD1 no hydrogen 3.054 N/A THR 667.A OG1 ASN 736.A OD1 no hydrogen 2.877 N/A PHE 668.A N TRP 733.A O no hydrogen 2.829 N/A ILE 669.A N PHE 630.A O no hydrogen 2.819 N/A VAL 670.A N HIS 730.A O no hydrogen 2.907 N/A VAL 671.A N ARG 632.A O no hydrogen 2.794 N/A GLN 672.A N HIS 728.A O no hydrogen 2.815 N/A HIS 675.A NE2 PRO 726.A O no hydrogen 2.639 N/A THR 677.A N HIS 675.A ND1 no hydrogen 3.186 N/A THR 677.A OG1 TYR 713.A OH no hydrogen 2.975 N/A ARG 678.A N ASN 22.A OD1 no hydrogen 2.314 N/A PHE 680.A N GLN 20.A O no hydrogen 2.908 N/A CYS 681.A SG GLU 686.A O no hydrogen 3.498 N/A THR 682.A N LYS 18.A O no hydrogen 2.873 N/A GLU 686.A N ASP 683.A O no hydrogen 3.076 N/A VAL 688.A N ASN 693.A O no hydrogen 3.023 N/A SER 691.A OG GLY 719.A O no hydrogen 2.870 N/A GLY 692.A N GLY 689.A O no hydrogen 3.241 N/A ASN 693.A N VAL 688.A O no hydrogen 3.268 N/A GLY 697.A N CYS 715.A O no hydrogen 2.635 N/A THR 698.A N PRO 695.A O no hydrogen 3.257 N/A THR 698.A OG1 PRO 695.A O no hydrogen 2.529 N/A THR 699.A N ARG 379.A O no hydrogen 2.622 N/A THR 699.A OG1 GLY 697.A O no hydrogen 3.134 N/A VAL 700.A N TYR 713.A O no hydrogen 2.919 N/A ILE 704.A N THR 702.A O no hydrogen 2.502 N/A HIS 706.A N ASP 711.A OD1 no hydrogen 3.133 N/A HIS 706.A N ASP 711.A OD2 no hydrogen 3.151 N/A THR 708.A N HIS 706.A ND1 no hydrogen 3.350 N/A GLU 709.A N HIS 706.A ND1 no hydrogen 3.036 N/A PHE 712.A N TYR 729.A O no hydrogen 2.985 N/A TYR 713.A N VAL 700.A O no hydrogen 2.815 N/A TYR 713.A OH THR 677.A OG1 no hydrogen 2.975 N/A LEU 714.A N SER 727.A O no hydrogen 2.866 N/A CYS 715.A N THR 698.A O no hydrogen 2.888 N/A CYS 715.A SG HIS 717.A O no hydrogen 3.549 N/A SER 716.A OG VAL 761.A O no hydrogen 2.764 N/A THR 723.A OG1 ARG 338.A O no hydrogen 3.557 N/A SER 727.A OG SER 762.A O no hydrogen 2.686 N/A HIS 728.A N GLN 672.A O no hydrogen 2.840 N/A HIS 728.A NE2 ASP 711.A OD2 no hydrogen 3.096 N/A TYR 729.A N PHE 712.A O no hydrogen 2.968 N/A HIS 730.A N VAL 670.A O no hydrogen 3.010 N/A HIS 730.A NE2 GLU 709.A OE1 no hydrogen 2.763 N/A VAL 731.A N PHE 710.A O no hydrogen 2.828 N/A LEU 732.A N PHE 668.A O no hydrogen 2.817 N/A TRP 733.A N PHE 668.A O no hydrogen 3.307 N/A TRP 733.A NE1 ASP 735.A OD2 no hydrogen 3.228 N/A ASP 735.A N ILE 666.A O no hydrogen 3.123 N/A PHE 738.A N ASP 734.A OD2 no hydrogen 2.710 N/A SER 740.A N ASP 9.A OD1 no hydrogen 2.928 N/A SER 740.A OG ASP 9.A O no hydrogen 2.486 N/A SER 740.A OG ASP 9.A OD1 no hydrogen 3.137 N/A GLU 742.A N SER 739.A OG no hydrogen 3.288 N/A LEU 743.A N SER 739.A O no hydrogen 3.123 N/A GLN 744.A N SER 740.A O no hydrogen 3.123 N/A GLN 744.A NE2 ASP 701.A OD2 no hydrogen 3.099 N/A ILE 745.A N ASP 741.A O no hydrogen 2.966 N/A LEU 746.A N GLU 742.A O no hydrogen 2.870 N/A THR 747.A N LEU 743.A O no hydrogen 2.859 N/A THR 747.A OG1 TYR 631.A OH no hydrogen 2.566 N/A THR 747.A OG1 LEU 743.A O no hydrogen 2.826 N/A TYR 748.A N GLN 744.A O no hydrogen 2.863 N/A GLN 749.A N ILE 745.A O no hydrogen 2.790 N/A GLN 749.A NE2 GLY 550.A O no hydrogen 2.718 N/A LEU 750.A N LEU 746.A O no hydrogen 2.981 N/A CYS 751.A N TYR 748.A O no hydrogen 3.346 N/A CYS 751.A SG SER 716.A OG no hydrogen 3.565 N/A CYS 751.A SG THR 747.A O no hydrogen 3.241 N/A HIS 752.A N GLN 749.A O no hydrogen 3.029 N/A HIS 752.A ND1 TYR 748.A O no hydrogen 2.656 N/A THR 753.A OG1 LEU 750.A O no hydrogen 2.772 N/A VAL 755.A N TYR 769.A OH no hydrogen 3.090 N/A ARG 756.A NH1 ALA 804.A OXT no hydrogen 3.178 N/A THR 758.A OG1 TRP 403.A O no hydrogen 2.645 N/A SER 760.A N GLY 401.A O no hydrogen 2.869 N/A SER 760.A OG SER 716.A O no hydrogen 2.424 N/A VAL 761.A N CYS 751.A O no hydrogen 3.176 N/A ALA 765.A N LEU 750.A O no hydrogen 3.123 N/A TYR 768.A N PRO 764.A O no hydrogen 3.119 N/A TYR 769.A N ALA 765.A O no hydrogen 2.813 N/A TYR 769.A OH THR 753.A O no hydrogen 3.089 N/A ALA 770.A N PRO 766.A O no hydrogen 2.982 N/A HIS 771.A N ALA 767.A O no hydrogen 3.154 N/A HIS 771.A ND1 ASP 565.A OD2 no hydrogen 2.703 N/A LEU 772.A N TYR 768.A O no hydrogen 3.013 N/A VAL 773.A N TYR 769.A O no hydrogen 2.709 N/A ALA 774.A N ALA 770.A O no hydrogen 3.071 N/A PHE 775.A N HIS 771.A O no hydrogen 3.021 N/A ARG 776.A N LEU 772.A O no hydrogen 2.848 N/A ARG 776.A NH1 ASP 505.A OD2 no hydrogen 2.639 N/A ARG 776.A NH1 TYR 802.A O no hydrogen 3.353 N/A ALA 777.A N VAL 773.A O no hydrogen 2.898 N/A ARG 778.A N ALA 774.A O no hydrogen 3.012 N/A ARG 778.A NH2 HIS 568.A O no hydrogen 2.539 N/A TYR 779.A N ARG 776.A O no hydrogen 3.041 N/A VAL 782.A N TYR 779.A O no hydrogen 3.280 N/A LEU 787.A N ASP 783.A O no hydrogen 3.191 N/A LYS 789.A N ALA 786.A O no hydrogen 3.403 N/A ALA 790.A N LEU 787.A O no hydrogen 3.083 N/A HIS 794.A N ASP 505.A O no hydrogen 2.862 N/A ASP 796.A N HIS 794.A ND1 no hydrogen 2.991 N/A THR 797.A OG1 ASP 505.A O no hydrogen 2.870 N/A LEU 798.A N HIS 794.A O no hydrogen 2.982 N/A ARG 799.A NH2 GLN 795.A OE1 no hydrogen 2.550 N/A THR 800.A N THR 797.A O no hydrogen 2.958 N/A THR 800.A OG1 THR 797.A O no hydrogen 2.504 N/A ALA 804.A N MET 801.A O no hydrogen 3.241 N/A