Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6wi1_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 1.A O no hydrogen 2.431 N/A ALA 5.A N GLY 63.A O no hydrogen 3.096 N/A ILE 7.A N VAL 65.A O no hydrogen 3.098 N/A VAL 9.A N ALA 67.A O no hydrogen 3.430 N/A GLY 10.A N MET 40.A O no hydrogen 2.905 N/A ALA 16.A N ASP 13.A O no hydrogen 3.068 N/A ILE 17.A N GLU 14.A O no hydrogen 2.974 N/A LYS 18.A N VAL 15.A O no hydrogen 3.039 N/A ALA 20.A N ALA 16.A O no hydrogen 3.325 N/A GLU 22.A N ASP 19.A O no hydrogen 3.169 N/A LYS 23.A N ALA 20.A O no hydrogen 2.932 N/A ASP 24.A N HIS 21.A O no hydrogen 3.333 N/A PHE 26.A N LYS 23.A O no hydrogen 3.286 N/A SER 30.A OG HIS 27.A O no hydrogen 2.522 N/A GLU 36.A N ILE 4.A O no hydrogen 3.376 N/A VAL 38.A N VAL 6.A O no hydrogen 2.989 N/A MET 40.A N LEU 8.A O no hydrogen 3.223 N/A THR 43.A OG1 ASP 44.A O no hydrogen 3.276 N/A ASP 44.A N SER 47.A OG no hydrogen 2.716 N/A SER 47.A N ASP 44.A OD1 no hydrogen 2.153 N/A SER 47.A OG ASP 44.A O no hydrogen 2.683 N/A SER 47.A OG ASP 44.A OD1 no hydrogen 2.386 N/A ILE 48.A N ASP 44.A O no hydrogen 3.349 N/A ILE 49.A N PRO 45.A O no hydrogen 2.973 N/A THR 50.A N LYS 46.A O no hydrogen 2.929 N/A THR 50.A OG1 LYS 46.A O no hydrogen 2.506 N/A ARG 51.A N SER 47.A O no hydrogen 2.849 N/A ILE 52.A N ILE 48.A O no hydrogen 2.924 N/A CYS 53.A N ILE 49.A O no hydrogen 3.063 N/A CYS 53.A SG ILE 49.A O no hydrogen 3.993 N/A ASP 54.A N THR 50.A O no hydrogen 2.873 N/A LEU 55.A N ARG 51.A O no hydrogen 2.950 N/A MET 56.A N ILE 52.A O no hydrogen 3.027 N/A SER 57.A N CYS 53.A O no hydrogen 2.875 N/A SER 57.A OG CYS 53.A O no hydrogen 2.630 N/A SER 57.A OG ASP 54.A O no hydrogen 2.603 N/A ASP 58.A N ASP 54.A O no hydrogen 2.859 N/A ASP 58.A N LEU 55.A O no hydrogen 2.930 N/A ARG 59.A N LEU 55.A O no hydrogen 3.044 N/A ARG 59.A NE GLU 36.A OE1 no hydrogen 2.559 N/A GLY 63.A N GLY 3.A O no hydrogen 2.481 N/A VAL 65.A N ALA 5.A O no hydrogen 2.797 N/A PHE 66.A N LEU 91.A O no hydrogen 3.335 N/A ASP 69.A N ASP 68.A OD1 no hydrogen 2.189 N/A THR 70.A OG1 ASP 69.A O no hydrogen 2.302 N/A GLU 73.A N GLU 73.A OE1 no hydrogen 2.368 N/A ILE 75.A N GLN 72.A O no hydrogen 2.996 N/A GLN 77.A N GLU 73.A O no hydrogen 2.995 N/A ILE 78.A N ALA 74.A O no hydrogen 2.893 N/A LEU 79.A N ILE 75.A O no hydrogen 2.910 N/A ASP 80.A N ALA 76.A O no hydrogen 3.474 N/A PHE 81.A N GLN 77.A O no hydrogen 2.976 N/A ILE 82.A N ILE 78.A O no hydrogen 2.941 N/A SER 83.A N LEU 79.A O no hydrogen 2.892 N/A SER 83.A OG MET 109.A O no hydrogen 2.948 N/A ALA 84.A N ASP 80.A O no hydrogen 2.931 N/A GLN 85.A N PHE 81.A O no hydrogen 2.952 N/A THR 86.A N ILE 82.A O no hydrogen 3.044 N/A THR 86.A N SER 83.A O no hydrogen 3.264 N/A THR 86.A OG1 ILE 82.A O no hydrogen 3.420 N/A THR 86.A OG1 THR 88.A OG1 no hydrogen 2.576 N/A LEU 87.A N SER 83.A O no hydrogen 2.856 N/A THR 88.A OG1 THR 86.A O no hydrogen 2.895 N/A THR 88.A OG1 THR 86.A OG1 no hydrogen 2.576 N/A ILE 90.A N MET 109.A O no hydrogen 3.421 N/A LEU 91.A N VAL 64.A O no hydrogen 3.009 N/A ILE 93.A N PHE 66.A O no hydrogen 3.059 N/A GLY 96.A N ASP 68.A O no hydrogen 3.239 N/A SER 97.A OG HIS 94.A O no hydrogen 3.523 N/A SER 98.A N HIS 94.A O no hydrogen 2.593 N/A SER 98.A OG HIS 94.A O no hydrogen 2.745 N/A MET 99.A N SER 97.A O no hydrogen 2.558 N/A MET 101.A N GLN 112.A OE1 no hydrogen 3.398 N/A LYS 104.A NZ MET 101.A O no hydrogen 3.395 N/A LYS 104.A NZ GLN 112.A OE1 no hydrogen 3.207 N/A GLU 106.A N ASP 105.A OD1 no hydrogen 2.342 N/A SER 108.A OG ASP 105.A O no hydrogen 3.333 N/A MET 109.A N SER 83.A OG no hydrogen 2.746 N/A GLN 112.A NE2 SER 97.A O no hydrogen 2.231 N/A GLN 112.A NE2 MET 99.A O no hydrogen 2.703 N/A SER 116.A N GLN 119.A OE1 no hydrogen 3.143 N/A GLU 118.A N GLU 118.A OE1 no hydrogen 2.613 N/A GLN 119.A NE2 GLN 324.A O no hydrogen 3.219 N/A ALA 121.A N ILE 117.A O no hydrogen 2.944 N/A SER 122.A N GLU 118.A O no hydrogen 2.873 N/A SER 122.A OG GLU 118.A O no hydrogen 3.525 N/A SER 122.A OG GLN 119.A O no hydrogen 2.648 N/A VAL 123.A N GLN 119.A O no hydrogen 2.944 N/A MET 124.A N GLN 120.A O no hydrogen 2.937 N/A LEU 125.A N ALA 121.A O no hydrogen 2.931 N/A ASN 126.A N SER 122.A O no hydrogen 2.923 N/A ILE 127.A N VAL 123.A O no hydrogen 2.980 N/A MET 128.A N MET 124.A O no hydrogen 2.944 N/A GLU 129.A N LEU 125.A O no hydrogen 2.868 N/A GLU 130.A N ASN 126.A O no hydrogen 3.052 N/A GLU 130.A N ILE 127.A O no hydrogen 3.027 N/A TYR 131.A OH GLU 130.A OE2 no hydrogen 3.210 N/A PHE 136.A N ILE 194.A O no hydrogen 3.163 N/A SER 137.A OG PHE 136.A O no hydrogen 2.263 N/A VAL 139.A N LEU 196.A O no hydrogen 2.975 N/A THR 141.A OG1 GLU 203.A OE1 no hydrogen 3.390 N/A GLN 147.A N GLN 147.A OE1 no hydrogen 2.584 N/A PHE 149.A N GLY 145.A O no hydrogen 3.362 N/A ASN 151.A N GLN 147.A O no hydrogen 3.298 N/A LYS 152.A N ASP 148.A O no hydrogen 2.930 N/A ILE 153.A N PHE 149.A O no hydrogen 3.459 N/A ARG 154.A N VAL 150.A O no hydrogen 2.926 N/A SER 155.A N ASN 151.A O no hydrogen 2.891 N/A THR 156.A N LYS 152.A O no hydrogen 2.983 N/A THR 156.A OG1 LYS 152.A O no hydrogen 3.295 N/A ILE 157.A N ILE 153.A O no hydrogen 2.810 N/A GLU 158.A N ARG 154.A O no hydrogen 3.002 N/A SER 160.A N GLU 158.A O no hydrogen 2.896 N/A VAL 162.A N SER 160.A OG no hydrogen 2.988 N/A TRP 164.A NE1 SER 160.A OG no hydrogen 3.083 N/A LEU 170.A N ILE 138.A O no hydrogen 3.001 N/A MET 174.A N LEU 172.A O no hydrogen 3.022 N/A LEU 176.A N ASP 173.A O no hydrogen 3.241 N/A SER 181.A N ASP 178.A O no hydrogen 3.473 N/A ILE 183.A N GLY 179.A O no hydrogen 2.949 N/A GLN 184.A N ASP 180.A O no hydrogen 2.776 N/A ASN 185.A N SER 181.A O no hydrogen 2.859 N/A GLN 186.A N LYS 182.A O no hydrogen 2.953 N/A LYS 188.A N GLN 184.A O no hydrogen 2.856 N/A LYS 189.A N ASN 185.A O no hydrogen 2.924 N/A LEU 190.A N LEU 187.A O no hydrogen 2.854 N/A GLN 191.A N GLN 191.A OE1 no hydrogen 2.807 N/A SER 192.A OG LEU 190.A O no hydrogen 2.604 N/A ILE 195.A N THR 222.A O no hydrogen 3.157 N/A LEU 196.A N SER 137.A O no hydrogen 3.173 N/A TYR 198.A OH PRO 144.A O no hydrogen 2.717 N/A CYS 199.A SG THR 200.A O no hydrogen 3.497 N/A THR 200.A OG1 GLU 202.A OE1 no hydrogen 3.299 N/A THR 200.A OG1 GLU 203.A OE2 no hydrogen 3.395 N/A GLU 202.A N GLU 202.A OE1 no hydrogen 2.467 N/A ALA 204.A N THR 200.A O no hydrogen 2.969 N/A THR 205.A N LYS 201.A O no hydrogen 2.942 N/A THR 205.A OG1 GLU 202.A O no hydrogen 2.360 N/A TYR 206.A N GLU 202.A O no hydrogen 2.936 N/A TYR 206.A OH ASP 180.A OD2 no hydrogen 3.205 N/A ILE 207.A N GLU 203.A O no hydrogen 2.871 N/A PHE 208.A N ALA 204.A O no hydrogen 2.857 N/A GLU 209.A N THR 205.A O no hydrogen 2.935 N/A VAL 210.A N TYR 206.A O no hydrogen 2.967 N/A ALA 211.A N ILE 207.A O no hydrogen 2.882 N/A ASN 212.A N PHE 208.A O no hydrogen 2.912 N/A ASN 212.A ND2 PHE 208.A O no hydrogen 3.295 N/A SER 213.A N GLU 209.A O no hydrogen 2.903 N/A SER 213.A OG VAL 210.A O no hydrogen 2.628 N/A VAL 214.A N VAL 210.A O no hydrogen 2.897 N/A GLY 215.A N ASN 212.A O no hydrogen 3.097 N/A LEU 216.A N ALA 211.A O no hydrogen 2.596 N/A THR 217.A OG1 ASN 212.A OD1 no hydrogen 2.443 N/A THR 222.A OG1 TYR 221.A O no hydrogen 2.390 N/A VAL 225.A N ILE 245.A O no hydrogen 3.121 N/A SER 227.A N GLN 120.A OE1 no hydrogen 2.715 N/A SER 227.A OG SER 227.A O no hydrogen 2.323 N/A VAL 229.A N PRO 226.A O no hydrogen 3.486 N/A THR 233.A OG1 ASP 232.A O no hydrogen 2.359 N/A THR 233.A OG1 ASP 232.A OD1 no hydrogen 3.506 N/A THR 235.A OG1 THR 235.A O no hydrogen 2.332 N/A SER 238.A OG GLU 239.A OE2 no hydrogen 2.497 N/A THR 242.A OG1 LEU 334.A O no hydrogen 2.843 N/A GLY 243.A N LEU 334.A O no hydrogen 2.603 N/A ILE 245.A N TRP 223.A O no hydrogen 3.246 N/A SER 246.A N ILE 332.A O no hydrogen 2.949 N/A SER 246.A OG VAL 225.A O no hydrogen 3.536 N/A SER 248.A N VAL 330.A O no hydrogen 3.112 N/A SER 248.A OG TYR 249.A O no hydrogen 3.256 N/A GLU 251.A N TYR 249.A O no hydrogen 2.958 N/A ARG 259.A N GLY 255.A O no hydrogen 2.745 N/A VAL 260.A N LEU 256.A O no hydrogen 2.922 N/A ARG 261.A N PRO 257.A O no hydrogen 2.908 N/A ASP 262.A N ALA 258.A O no hydrogen 2.886 N/A GLY 263.A N ARG 259.A O no hydrogen 2.949 N/A ILE 264.A N VAL 260.A O no hydrogen 2.936 N/A ALA 265.A N ARG 261.A O no hydrogen 2.899 N/A ILE 266.A N ASP 262.A O no hydrogen 2.857 N/A ILE 267.A N GLY 263.A O no hydrogen 3.002 N/A THR 268.A N ILE 264.A O no hydrogen 2.953 N/A THR 268.A OG1 ILE 264.A O no hydrogen 3.136 N/A THR 268.A OG1 ALA 265.A O no hydrogen 2.850 N/A THR 269.A N ALA 265.A O no hydrogen 2.847 N/A THR 269.A OG1 ALA 265.A O no hydrogen 2.661 N/A ALA 270.A N ILE 266.A O no hydrogen 2.945 N/A ALA 271.A N ILE 267.A O no hydrogen 2.910 N/A SER 272.A N THR 268.A O no hydrogen 2.922 N/A SER 272.A OG THR 268.A O no hydrogen 2.945 N/A SER 272.A OG THR 269.A O no hydrogen 2.529 N/A ASP 273.A N THR 269.A O no hydrogen 2.910 N/A MET 274.A N ALA 270.A O no hydrogen 2.918 N/A LEU 275.A N ALA 271.A O no hydrogen 2.890 N/A SER 276.A N SER 272.A O no hydrogen 2.882 N/A SER 276.A OG SER 272.A O no hydrogen 3.188 N/A HIS 278.A N MET 274.A O no hydrogen 3.214 N/A HIS 278.A N LEU 275.A O no hydrogen 2.618 N/A SER 279.A N LEU 275.A O no hydrogen 2.163 N/A LYS 285.A NZ LEU 87.A O no hydrogen 2.584 N/A SER 287.A OG CYS 288.A O no hydrogen 3.395 N/A CYS 288.A SG ASN 290.A OD1 no hydrogen 3.873 N/A TYR 297.A N GLU 293.A O no hydrogen 2.916 N/A SER 299.A N ILE 296.A O no hydrogen 3.123 N/A SER 299.A OG ILE 296.A O no hydrogen 2.533 N/A TYR 305.A N LEU 302.A O no hydrogen 2.861 N/A LEU 306.A N LEU 302.A O no hydrogen 2.982 N/A ILE 307.A N ASN 303.A O no hydrogen 2.876 N/A THR 310.A OG1 ARG 314.A O no hydrogen 2.539 N/A PHE 311.A N ARG 314.A O no hydrogen 3.231 N/A ARG 314.A N PHE 311.A O no hydrogen 2.795 N/A LEU 316.A N VAL 309.A O no hydrogen 3.310 N/A SER 317.A N ASN 315.A OD1 no hydrogen 3.386 N/A SER 317.A OG ILE 307.A O no hydrogen 2.990 N/A SER 317.A OG PHE 318.A O no hydrogen 2.815 N/A PHE 318.A N ILE 307.A O no hydrogen 2.927 N/A SER 319.A N TYR 323.A O no hydrogen 2.946 N/A GLU 320.A N GLU 320.A OE2 no hydrogen 2.532 N/A ASP 321.A N SER 319.A OG no hydrogen 3.156 N/A GLY 322.A N SER 319.A O no hydrogen 3.084 N/A GLN 324.A N GLY 114.A O no hydrogen 3.461 N/A MET 325.A N SER 317.A O no hydrogen 3.296 N/A VAL 330.A N SER 248.A O no hydrogen 3.133 N/A ILE 331.A N GLY 344.A O no hydrogen 2.884 N/A ILE 332.A N SER 246.A O no hydrogen 3.335 N/A LEU 333.A N GLU 341.A O no hydrogen 3.216 N/A LEU 334.A N LEU 244.A O no hydrogen 2.874 N/A ARG 338.A N ASN 335.A O no hydrogen 3.314 N/A ARG 338.A NH1 PHE 240.A O no hydrogen 3.450 N/A ARG 338.A NH2 PRO 237.A O no hydrogen 2.894 N/A ARG 338.A NH2 PHE 240.A O no hydrogen 3.171 N/A LYS 339.A N ASN 335.A OD1 no hydrogen 3.409 N/A GLU 341.A N LEU 333.A O no hydrogen 3.139 N/A VAL 343.A N ILE 331.A O no hydrogen 3.001 N/A GLY 344.A N ILE 331.A O no hydrogen 3.498 N/A LYS 345.A N GLN 352.A O no hydrogen 3.170 N/A SER 350.A N LYS 347.A O no hydrogen 3.165 N/A SER 350.A OG LYS 347.A O no hydrogen 3.269 N/A SER 350.A OG ASP 348.A O no hydrogen 3.563 N/A SER 368.A OG ARG 466.A O no hydrogen 2.945 N/A ILE 369.A N ASP 438.A OD1 no hydrogen 3.449 N/A VAL 370.A N MET 469.A O no hydrogen 3.253 N/A THR 371.A N TYR 440.A O no hydrogen 3.323 N/A THR 371.A OG1 LEU 372.A O no hydrogen 3.264 N/A LEU 372.A N THR 371.A OG1 no hydrogen 2.349 N/A GLU 374.A N VAL 378.A O no hydrogen 3.123 N/A VAL 378.A N ALA 375.A O no hydrogen 3.020 N/A ILE 379.A N LYS 419.A O no hydrogen 2.804 N/A LEU 386.A N ASP 384.A OD1 no hydrogen 3.301 N/A SER 387.A N ASP 384.A O no hydrogen 3.205 N/A SER 387.A OG ASP 384.A OD2 no hydrogen 3.151 N/A GLY 388.A N ASP 384.A O no hydrogen 3.276 N/A THR 394.A OG1 ARG 392.A O no hydrogen 3.291 N/A VAL 395.A N CYS 418.A O no hydrogen 3.105 N/A CYS 397.A N LYS 416.A O no hydrogen 2.555 N/A GLN 398.A N LEU 439.A O no hydrogen 3.296 N/A LYS 399.A N ILE 414.A O no hydrogen 2.878 N/A ILE 401.A N GLY 412.A O no hydrogen 3.169 N/A ILE 414.A N LYS 399.A O no hydrogen 2.910 N/A LYS 416.A N CYS 397.A O no hydrogen 3.054 N/A CYS 418.A N VAL 395.A O no hydrogen 2.721 N/A LYS 419.A N ILE 379.A O no hydrogen 2.934 N/A PHE 421.A N PRO 376.A O no hydrogen 3.288 N/A CYS 422.A N PHE 377.A O no hydrogen 3.070 N/A ASP 424.A N GLY 420.A O no hydrogen 2.931 N/A ILE 425.A N PHE 421.A O no hydrogen 2.984 N/A LEU 426.A N CYS 422.A O no hydrogen 2.937 N/A LYS 427.A N ILE 423.A O no hydrogen 2.881 N/A LYS 428.A N ASP 424.A O no hydrogen 2.990 N/A LYS 428.A N ILE 425.A O no hydrogen 3.173 N/A LYS 428.A NZ GLU 729.A OE1 no hydrogen 2.602 N/A ILE 429.A N ILE 425.A O no hydrogen 2.961 N/A SER 430.A N LEU 426.A O no hydrogen 2.887 N/A SER 430.A OG LYS 427.A O no hydrogen 3.461 N/A SER 432.A N LYS 428.A O no hydrogen 2.979 N/A VAL 433.A N ILE 429.A O no hydrogen 2.936 N/A LYS 434.A N SER 430.A O no hydrogen 2.735 N/A PHE 435.A N SER 430.A O no hydrogen 3.306 N/A TYR 440.A OH GLU 461.A OE2 no hydrogen 3.226 N/A LEU 441.A N GLN 398.A O no hydrogen 3.148 N/A LYS 449.A N ASN 456.A OD1 no hydrogen 2.836 N/A LYS 449.A NZ LYS 450.A O no hydrogen 2.488 N/A ILE 451.A N THR 454.A O no hydrogen 2.439 N/A THR 454.A N ILE 451.A O no hydrogen 2.573 N/A THR 454.A OG1 ILE 451.A O no hydrogen 2.427 N/A GLY 457.A N ASN 444.A O no hydrogen 2.670 N/A MET 458.A N HIS 447.A O no hydrogen 2.861 N/A GLY 460.A N ASN 456.A O no hydrogen 2.908 N/A GLU 461.A N GLY 457.A O no hydrogen 2.897 N/A VAL 462.A N MET 458.A O no hydrogen 2.906 N/A VAL 462.A N ILE 459.A O no hydrogen 3.013 N/A VAL 463.A N ILE 459.A O no hydrogen 2.941 N/A MET 464.A N GLY 460.A O no hydrogen 3.194 N/A LYS 465.A N VAL 462.A O no hydrogen 3.097 N/A ARG 466.A NH1 GLU 461.A OE2 no hydrogen 2.400 N/A ALA 470.A N ALA 706.A O no hydrogen 2.834 N/A VAL 471.A N VAL 370.A O no hydrogen 3.154 N/A SER 473.A OG TYR 703.A OH no hydrogen 3.261 N/A ARG 480.A N ASN 477.A OD1 no hydrogen 2.943 N/A ARG 480.A NH1 GLY 448.A O no hydrogen 3.330 N/A ARG 480.A NH2 THR 475.A OG1 no hydrogen 3.123 N/A GLU 482.A N GLU 478.A O no hydrogen 3.049 N/A GLU 482.A N GLU 479.A O no hydrogen 3.314 N/A VAL 483.A N ARG 480.A O no hydrogen 2.884 N/A VAL 484.A N ARG 480.A O no hydrogen 3.046 N/A ASP 485.A N ILE 707.A O no hydrogen 3.323 N/A PHE 486.A N ASP 485.A OD1 no hydrogen 2.310 N/A SER 487.A N ILE 705.A O no hydrogen 3.359 N/A SER 487.A OG ILE 705.A O no hydrogen 3.269 N/A VAL 488.A N ASP 718.A OD1 no hydrogen 2.856 N/A GLU 492.A N GLU 492.A OE2 no hydrogen 2.389 N/A THR 493.A N THR 701.A O no hydrogen 2.518 N/A GLY 494.A N THR 493.A OG1 no hydrogen 2.541 N/A ILE 495.A N PHE 698.A O no hydrogen 3.160 N/A SER 496.A N TYR 672.A O no hydrogen 3.237 N/A SER 496.A OG ILE 495.A O no hydrogen 2.713 N/A SER 496.A OG LYS 696.A O no hydrogen 3.456 N/A MET 498.A N PHE 670.A O no hydrogen 3.052 N/A VAL 499.A N LEU 689.A O no hydrogen 2.896 N/A SER 500.A OG ARG 501.A O no hydrogen 3.495 N/A SER 502.A OG VAL 601.A O no hydrogen 2.524 N/A PHE 515.A N LEU 512.A O no hydrogen 3.139 N/A VAL 519.A N SER 516.A OG no hydrogen 2.738 N/A TRP 520.A N SER 516.A O no hydrogen 2.940 N/A VAL 521.A N ALA 517.A O no hydrogen 2.987 N/A MET 522.A N ASP 518.A O no hydrogen 2.900 N/A MET 523.A N VAL 519.A O no hydrogen 2.955 N/A PHE 524.A N TRP 520.A O no hydrogen 2.900 N/A VAL 525.A N VAL 521.A O no hydrogen 2.899 N/A MET 526.A N MET 522.A O no hydrogen 2.969 N/A LEU 527.A N MET 523.A O no hydrogen 2.880 N/A LEU 528.A N PHE 524.A O no hydrogen 2.975 N/A ILE 529.A N VAL 525.A O no hydrogen 2.922 N/A VAL 530.A N MET 526.A O no hydrogen 2.949 N/A SER 531.A N LEU 527.A O no hydrogen 2.894 N/A SER 531.A OG LEU 527.A O no hydrogen 3.221 N/A SER 531.A OG LEU 528.A O no hydrogen 2.319 N/A ALA 532.A N LEU 528.A O no hydrogen 2.958 N/A VAL 533.A N ILE 529.A O no hydrogen 2.950 N/A ALA 534.A N VAL 530.A O no hydrogen 2.877 N/A VAL 535.A N SER 531.A O no hydrogen 2.947 N/A PHE 536.A N ALA 532.A O no hydrogen 2.921 N/A VAL 537.A N VAL 533.A O no hydrogen 2.898 N/A PHE 538.A N ALA 534.A O no hydrogen 2.855 N/A GLU 539.A N VAL 535.A O no hydrogen 2.934 N/A TYR 540.A N VAL 537.A O no hydrogen 3.281 N/A LYS 545.A N THR 542.A O no hydrogen 2.329 N/A ILE 547.A N ILE 543.A O no hydrogen 2.959 N/A TRP 548.A N GLY 544.A O no hydrogen 2.863 N/A LEU 549.A N LYS 545.A O no hydrogen 2.930 N/A LEU 550.A N ALA 546.A O no hydrogen 2.924 N/A TRP 551.A N ILE 547.A O no hydrogen 2.948 N/A GLY 552.A N TRP 548.A O no hydrogen 2.876 N/A LEU 553.A N LEU 549.A O no hydrogen 2.904 N/A VAL 554.A N LEU 550.A O no hydrogen 2.975 N/A PHE 555.A N TRP 551.A O no hydrogen 2.897 N/A ASN 556.A N GLY 552.A O no hydrogen 2.618 N/A LYS 565.A N ASN 563.A O no hydrogen 2.917 N/A THR 568.A N THR 567.A OG1 no hydrogen 2.626 N/A LYS 570.A N THR 567.A O no hydrogen 2.951 N/A MET 572.A N THR 568.A O no hydrogen 2.945 N/A VAL 573.A N SER 569.A O no hydrogen 2.935 N/A SER 574.A N LYS 570.A O no hydrogen 2.897 N/A SER 574.A OG ILE 571.A O no hydrogen 2.260 N/A VAL 575.A N ILE 571.A O no hydrogen 2.980 N/A TRP 576.A N MET 572.A O no hydrogen 2.872 N/A ALA 577.A N VAL 573.A O no hydrogen 2.846 N/A PHE 578.A N SER 574.A O no hydrogen 2.954 N/A PHE 579.A N VAL 575.A O no hydrogen 2.945 N/A ALA 580.A N TRP 576.A O no hydrogen 2.818 N/A VAL 581.A N ALA 577.A O no hydrogen 2.871 N/A ILE 582.A N PHE 578.A O no hydrogen 3.049 N/A PHE 583.A N PHE 579.A O no hydrogen 2.858 N/A LEU 584.A N ALA 580.A O no hydrogen 2.858 N/A ALA 585.A N VAL 581.A O no hydrogen 2.933 N/A SER 586.A N ILE 582.A O no hydrogen 2.945 N/A SER 586.A OG ILE 582.A O no hydrogen 3.222 N/A TYR 587.A N PHE 583.A O no hydrogen 2.856 N/A THR 588.A N LEU 584.A O no hydrogen 2.903 N/A ALA 589.A N ALA 585.A O no hydrogen 2.992 N/A ASN 590.A N SER 586.A O no hydrogen 2.862 N/A LEU 591.A N TYR 587.A O no hydrogen 2.906 N/A ALA 592.A N THR 588.A O no hydrogen 2.936 N/A ALA 593.A N ALA 589.A O no hydrogen 2.887 N/A PHE 594.A N ASN 590.A O no hydrogen 2.893 N/A ILE 596.A N ALA 593.A O no hydrogen 3.259 N/A ASP 609.A N GLY 606.A O no hydrogen 2.937 N/A GLN 613.A N ASP 609.A O no hydrogen 2.883 N/A ARG 614.A N LYS 610.A O no hydrogen 2.432 N/A PHE 622.A N ASP 668.A OD1 no hydrogen 3.205 N/A THR 626.A OG1 PHE 624.A O no hydrogen 3.362 N/A THR 626.A OG1 GLY 625.A O no hydrogen 2.683 N/A ARG 634.A NE GLU 479.A OE1 no hydrogen 2.378 N/A ARG 634.A NE GLU 479.A OE2 no hydrogen 3.028 N/A ASN 635.A N SER 631.A O no hydrogen 2.948 N/A ILE 636.A N THR 632.A O no hydrogen 2.892 N/A ARG 637.A N GLU 633.A O no hydrogen 2.915 N/A ARG 637.A NE HIS 644.A NE2 no hydrogen 3.164 N/A ARG 637.A NH2 HIS 644.A NE2 no hydrogen 3.052 N/A ASN 638.A N ARG 634.A O no hydrogen 2.921 N/A ASN 639.A N ASN 635.A O no hydrogen 3.004 N/A ASN 639.A N ILE 636.A O no hydrogen 2.934 N/A TYR 640.A N ILE 636.A O no hydrogen 2.623 N/A GLU 642.A N GLU 642.A OE1 no hydrogen 2.462 N/A HIS 644.A N TYR 640.A O no hydrogen 3.224 N/A ALA 645.A N ALA 641.A O no hydrogen 2.959 N/A TYR 646.A N GLU 642.A O no hydrogen 2.920 N/A MET 647.A N MET 643.A O no hydrogen 2.815 N/A GLY 648.A N ALA 645.A O no hydrogen 3.148 N/A ASN 651.A ND2 ASP 657.A O no hydrogen 3.208 N/A ARG 653.A N ASN 651.A OD1 no hydrogen 3.188 N/A LEU 659.A N VAL 655.A O no hydrogen 2.903 N/A LEU 660.A N ASP 656.A O no hydrogen 2.908 N/A SER 661.A N ASP 657.A O no hydrogen 2.867 N/A SER 661.A OG ASP 657.A O no hydrogen 2.839 N/A SER 661.A OG ASP 657.A OD1 no hydrogen 2.845 N/A LEU 662.A N ALA 658.A O no hydrogen 2.926 N/A LYS 663.A N LEU 659.A O no hydrogen 2.902 N/A THR 664.A N LEU 660.A O no hydrogen 2.916 N/A LYS 666.A N THR 664.A OG1 no hydrogen 2.945 N/A LEU 667.A N SER 661.A O no hydrogen 3.127 N/A PHE 670.A N MET 498.A O no hydrogen 2.848 N/A ALA 674.A N GLY 494.A O no hydrogen 2.744 N/A ALA 675.A N THR 493.A OG1 no hydrogen 3.203 N/A VAL 676.A N ASP 673.A O no hydrogen 3.167 N/A LEU 677.A N ASP 673.A O no hydrogen 3.175 N/A ASN 678.A N ALA 674.A O no hydrogen 2.950 N/A MET 680.A N VAL 676.A O no hydrogen 2.902 N/A ALA 681.A N LEU 677.A O no hydrogen 2.896 N/A GLY 682.A N ASN 678.A O no hydrogen 2.941 N/A ARG 683.A N TYR 679.A O no hydrogen 3.024 N/A ASP 684.A N GLY 682.A O no hydrogen 2.884 N/A CYS 687.A SG GLY 686.A O no hydrogen 3.035 N/A THR 691.A N VAL 497.A O no hydrogen 2.309 N/A ILE 692.A N THR 691.A OG1 no hydrogen 2.635 N/A LYS 696.A N GLY 693.A O no hydrogen 2.844 N/A PHE 698.A N ILE 495.A O no hydrogen 3.439 N/A THR 701.A N THR 493.A O no hydrogen 2.976 N/A THR 701.A OG1 ILE 476.A O no hydrogen 3.336 N/A TYR 703.A N ILE 491.A O no hydrogen 2.942 N/A TYR 703.A OH SER 473.A OG no hydrogen 3.261 N/A ILE 705.A N SER 487.A OG no hydrogen 2.807 N/A ALA 706.A N ALA 470.A O no hydrogen 3.286 N/A GLN 708.A N TYR 468.A O no hydrogen 2.698 N/A GLN 708.A NE2 ALA 467.A O no hydrogen 3.220 N/A TRP 713.A N SER 711.A OG no hydrogen 2.891 N/A LYS 714.A NZ PHE 486.A O no hydrogen 3.216 N/A LYS 714.A NZ ASP 718.A OD2 no hydrogen 2.398 N/A VAL 717.A N TRP 713.A O no hydrogen 2.931 N/A ASP 718.A N LYS 714.A O no hydrogen 2.932 N/A LEU 719.A N ARG 715.A O no hydrogen 2.929 N/A ALA 720.A N GLN 716.A O no hydrogen 2.901 N/A ILE 721.A N VAL 717.A O no hydrogen 2.966 N/A LEU 722.A N ASP 718.A O no hydrogen 2.978 N/A GLN 723.A N LEU 719.A O no hydrogen 2.902 N/A LEU 724.A N ALA 720.A O no hydrogen 2.944 N/A PHE 725.A N ILE 721.A O no hydrogen 2.986 N/A GLY 726.A N LEU 722.A O no hydrogen 2.932 N/A GLY 726.A N GLN 723.A O no hydrogen 2.977 N/A ASP 727.A N GLN 723.A O no hydrogen 3.305 N/A GLU 732.A N GLU 729.A O no hydrogen 3.169 N/A GLU 734.A N MET 730.A O no hydrogen 2.909 N/A ALA 735.A N GLU 731.A O no hydrogen 2.819 N/A CYS 736.A N GLU 732.A O no hydrogen 2.979 N/A TRP 737.A NE1 ASP 424.A OD2 no hydrogen 2.873 N/A LEU 738.A N GLU 734.A O no hydrogen 3.264 N/A CYS 742.A SG CYS 742.A O no hydrogen 3.013 N/A LEU 754.A N SER 752.A O no hydrogen 2.576 N/A MET 759.A N ASP 755.A O no hydrogen 3.327 N/A ALA 760.A N ILE 756.A O no hydrogen 2.884 N/A GLY 761.A N ASP 757.A O no hydrogen 2.895 N/A VAL 762.A N ASN 758.A O no hydrogen 2.985 N/A PHE 763.A N MET 759.A O no hydrogen 2.862 N/A TYR 764.A N ALA 760.A O no hydrogen 2.863 N/A MET 765.A N GLY 761.A O no hydrogen 2.969 N/A LEU 766.A N VAL 762.A O no hydrogen 2.926 N/A GLY 767.A N PHE 763.A O no hydrogen 2.891 N/A ALA 768.A N TYR 764.A O no hydrogen 2.920 N/A ALA 769.A N MET 765.A O no hydrogen 2.935 N/A MET 770.A N LEU 766.A O no hydrogen 2.923 N/A ALA 771.A N GLY 767.A O no hydrogen 2.937 N/A LEU 772.A N ALA 768.A O no hydrogen 2.909 N/A SER 773.A N ALA 769.A O no hydrogen 2.889 N/A SER 773.A OG MET 770.A O no hydrogen 2.258 N/A LEU 774.A N MET 770.A O no hydrogen 2.964 N/A ILE 775.A N ALA 771.A O no hydrogen 2.937 N/A THR 776.A N LEU 772.A O no hydrogen 2.893 N/A PHE 777.A N SER 773.A O no hydrogen 2.920 N/A ILE 778.A N LEU 774.A O no hydrogen 2.991 N/A CYS 779.A N ILE 775.A O no hydrogen 2.893 N/A CYS 779.A SG ILE 775.A O no hydrogen 3.100 N/A GLU 780.A N THR 776.A O no hydrogen 2.861 N/A HIS 781.A N PHE 777.A O no hydrogen 2.928 N/A LEU 782.A N ILE 778.A O no hydrogen 2.933 N/A PHE 783.A N CYS 779.A O no hydrogen 2.868 N/A TYR 784.A N GLU 780.A O no hydrogen 2.916 N/A