Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5wbj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 4.A N ALA 1.A O no hydrogen 3.338 N/A ALA 5.A N THR 2.A O no hydrogen 3.010 N/A TYR 6.A N SER 3.A O no hydrogen 3.276 N/A LEU 7.A N MET 4.A O no hydrogen 3.316 N/A GLN 9.A NE2 GLU 723.A OE2 no hydrogen 2.714 N/A THR 10.A OG1 GLN 857.A O no hydrogen 3.005 N/A VAL 12.A N ASN 809.A OD1 no hydrogen 3.020 N/A CYS 14.A SG VAL 12.A O no hydrogen 3.444 N/A GLU 15.A N HIS 18.A ND1 no hydrogen 3.231 N/A ARG 17.A NE GLU 878.A OE2 no hydrogen 2.972 N/A ARG 17.A NH1 GLU 584.A OE2 no hydrogen 2.833 N/A ARG 17.A NH2 GLU 876.A O no hydrogen 3.533 N/A ARG 17.A NH2 GLU 878.A OE2 no hydrogen 3.086 N/A HIS 18.A N GLU 15.A O no hydrogen 2.972 N/A HIS 18.A NE2 GLU 878.A OE2 no hydrogen 2.772 N/A ALA 20.A N ASP 19.A OD1 no hydrogen 2.674 N/A TRP 38.A NE1 ASP 474.A OD2 no hydrogen 3.057 N/A ARG 43.A NE GLN 310.A O no hydrogen 3.350 N/A ARG 43.A NH2 ARG 309.A O no hydrogen 3.509 N/A MET 44.A N GLN 310.A O no hydrogen 2.903 N/A THR 46.A OG1 ASP 311.A OD1 no hydrogen 3.150 N/A THR 46.A OG1 ASP 311.A OD2 no hydrogen 2.825 N/A CYS 48.A SG ARG 107.A O no hydrogen 3.768 N/A CYS 48.A SG CYS 126.A O no hydrogen 4.048 N/A VAL 49.A N ARG 107.A O no hydrogen 2.774 N/A ALA 50.A N LEU 136.A O no hydrogen 2.711 N/A LEU 51.A N LYS 109.A O no hydrogen 2.737 N/A VAL 52.A N HIS 138.A O no hydrogen 2.837 N/A LEU 53.A N GLN 111.A O no hydrogen 3.067 N/A CYS 54.A N ASN 140.A O no hydrogen 2.830 N/A CYS 54.A SG TRP 154.A O no hydrogen 3.631 N/A LEU 55.A N ASP 113.A OD1 no hydrogen 2.813 N/A ASP 63.A N PRO 61.A O no hydrogen 2.875 N/A CYS 70.A SG ALA 71.A O no hydrogen 3.916 N/A ALA 71.A N GLN 227.A O no hydrogen 2.626 N/A GLU 74.A N ILE 77.A O no hydrogen 2.995 N/A ALA 75.A N ASP 234.A OD2 no hydrogen 2.926 N/A TRP 76.A NE1 THR 242.A OG1 no hydrogen 2.854 N/A ILE 77.A N GLU 74.A O no hydrogen 2.976 N/A PHE 80.A N ASP 78.A OD1 no hydrogen 2.942 N/A SER 81.A N ASP 78.A O no hydrogen 3.051 N/A SER 81.A OG ASP 78.A O no hydrogen 2.452 N/A ALA 87.A N ALA 83.A O no hydrogen 3.065 N/A LEU 88.A N PRO 84.A O no hydrogen 2.939 N/A GLU 89.A N PRO 85.A O no hydrogen 3.293 N/A THR 90.A N LYS 86.A O no hydrogen 3.056 N/A THR 90.A OG1 LYS 86.A O no hydrogen 2.520 N/A ILE 91.A N ALA 87.A O no hydrogen 2.957 N/A GLY 92.A N LEU 88.A O no hydrogen 3.240 N/A LYS 93.A N GLU 89.A O no hydrogen 2.922 N/A ASN 94.A N THR 90.A O no hydrogen 2.838 N/A LEU 95.A N ILE 91.A O no hydrogen 2.964 N/A SER 96.A N GLY 92.A O no hydrogen 3.243 N/A SER 96.A OG LYS 93.A O no hydrogen 3.360 N/A THR 97.A N LYS 93.A O no hydrogen 2.919 N/A THR 97.A OG1 LYS 93.A O no hydrogen 2.867 N/A GLN 98.A N ASN 94.A O no hydrogen 2.706 N/A TYR 99.A N LEU 95.A O no hydrogen 3.084 N/A TYR 99.A OH HIS 138.A ND1 no hydrogen 2.571 N/A GLU 100.A N SER 96.A O no hydrogen 2.647 N/A ARG 101.A NH1 ASN 284.A OD1 no hydrogen 3.493 N/A ARG 101.A NH2 ASN 284.A OD1 no hydrogen 2.876 N/A TRP 102.A N TYR 99.A O no hydrogen 2.956 N/A TRP 102.A NE1 THR 241.A O no hydrogen 3.015 N/A GLN 103.A N TYR 99.A O no hydrogen 3.357 N/A ARG 105.A N GLN 103.A OE1 no hydrogen 3.023 N/A ARG 107.A N GLY 47.A O no hydrogen 2.957 N/A TYR 108.A OH GLN 103.A O no hydrogen 2.580 N/A LYS 109.A N VAL 49.A O no hydrogen 2.937 N/A GLN 111.A N LEU 51.A O no hydrogen 2.823 N/A ASP 113.A N LEU 53.A O no hydrogen 2.829 N/A THR 115.A OG1 GLU 118.A OE2 no hydrogen 3.272 N/A VAL 119.A N THR 115.A O no hydrogen 3.261 N/A ARG 120.A N VAL 116.A O no hydrogen 2.788 N/A LYS 121.A N ASP 117.A O no hydrogen 3.144 N/A LEU 122.A N GLU 118.A O no hydrogen 2.849 N/A CYS 123.A N VAL 119.A O no hydrogen 3.082 N/A CYS 123.A SG VAL 119.A O no hydrogen 3.578 N/A LEU 124.A N ARG 120.A O no hydrogen 2.963 N/A THR 125.A N LYS 121.A O no hydrogen 2.869 N/A THR 125.A OG1 LYS 121.A O no hydrogen 2.461 N/A CYS 126.A N LEU 122.A O no hydrogen 3.102 N/A CYS 126.A SG LEU 122.A O no hydrogen 3.069 N/A ARG 127.A N CYS 123.A O no hydrogen 3.281 N/A ARG 127.A NH1 GLU 133.A O no hydrogen 3.485 N/A ARG 127.A NH2 PRO 178.A O no hydrogen 2.552 N/A LYS 128.A N LEU 124.A O no hydrogen 3.457 N/A TYR 129.A N THR 125.A O no hydrogen 3.144 N/A ALA 130.A N CYS 126.A O no hydrogen 3.336 N/A ARG 134.A N LYS 45.A O no hydrogen 2.827 N/A ARG 134.A NE ASP 311.A OD2 no hydrogen 3.115 N/A ARG 134.A NH1 ASP 212.A OD1 no hydrogen 2.917 N/A VAL 135.A N PRO 178.A O no hydrogen 3.248 N/A LEU 136.A N CYS 48.A O no hydrogen 3.110 N/A PHE 137.A N ILE 180.A O no hydrogen 2.907 N/A HIS 138.A N ALA 50.A O no hydrogen 2.969 N/A TYR 139.A N VAL 182.A O no hydrogen 2.873 N/A TYR 139.A OH TRP 154.A O no hydrogen 2.876 N/A ASN 140.A N VAL 52.A O no hydrogen 3.222 N/A ASN 140.A ND2 GLU 74.A OE1 no hydrogen 2.825 N/A HIS 142.A N ASN 140.A OD1 no hydrogen 3.309 N/A HIS 142.A ND1 GLU 74.A OE1 no hydrogen 3.228 N/A HIS 142.A ND1 GLU 74.A OE2 no hydrogen 2.725 N/A HIS 142.A NE2 ASP 184.A OD1 no hydrogen 3.309 N/A GLY 143.A N CYS 54.A O no hydrogen 2.964 N/A LYS 146.A N ASP 63.A OD2 no hydrogen 2.913 N/A LYS 146.A NZ THR 224.A OG1 no hydrogen 3.084 N/A THR 148.A N GLU 152.A O no hydrogen 3.361 N/A GLY 151.A N THR 148.A O no hydrogen 3.440 N/A ILE 153.A N LEU 166.A O no hydrogen 2.905 N/A TRP 154.A NE1 LYS 146.A O no hydrogen 2.760 N/A VAL 155.A N ILE 164.A O no hydrogen 2.743 N/A PHE 156.A N PRO 114.A O no hydrogen 3.090 N/A ASN 157.A ND2 THR 161.A OG1 no hydrogen 2.965 N/A SER 159.A OG THR 161.A OG1 no hydrogen 3.396 N/A TYR 160.A N ASN 157.A O no hydrogen 3.145 N/A TYR 160.A OH ASP 113.A O no hydrogen 3.386 N/A THR 161.A OG1 SER 159.A OG no hydrogen 3.396 N/A GLN 162.A N ASN 157.A OD1 no hydrogen 3.014 N/A ILE 164.A N VAL 155.A O no hydrogen 2.644 N/A LEU 166.A N ILE 153.A O no hydrogen 2.568 N/A ILE 168.A N GLY 151.A O no hydrogen 3.161 N/A GLU 170.A N PRO 167.A O no hydrogen 3.170 N/A LEU 171.A N PRO 167.A O no hydrogen 3.357 N/A ASP 172.A N ILE 168.A O no hydrogen 2.870 N/A SER 173.A N SER 169.A O no hydrogen 2.939 N/A SER 173.A OG SER 169.A O no hydrogen 3.493 N/A SER 173.A OG GLU 170.A O no hydrogen 2.709 N/A TRP 174.A N GLU 170.A O no hydrogen 3.084 N/A LEU 175.A N LEU 171.A O no hydrogen 3.043 N/A SER 179.A N ASP 212.A O no hydrogen 3.387 N/A SER 179.A OG LYS 176.A O no hydrogen 2.644 N/A ILE 180.A N VAL 135.A O no hydrogen 2.838 N/A TYR 181.A N ILE 214.A O no hydrogen 2.694 N/A VAL 182.A N PHE 137.A O no hydrogen 2.764 N/A PHE 183.A N LEU 216.A O no hydrogen 2.837 N/A ASP 184.A N TYR 139.A O no hydrogen 2.970 N/A CYS 185.A SG SER 186.A O no hydrogen 4.018 N/A ARG 189.A N CYS 219.A O no hydrogen 3.215 N/A ARG 189.A NE ASP 220.A OD1 no hydrogen 3.439 N/A ARG 189.A NH1 ASN 193.A OD1 no hydrogen 3.567 N/A ILE 191.A N ALA 188.A O no hydrogen 2.919 N/A ASN 193.A N ARG 189.A O no hydrogen 2.731 N/A ALA 194.A N MET 190.A O no hydrogen 3.171 N/A PHE 195.A N ILE 191.A O no hydrogen 2.907 N/A ALA 196.A N LEU 192.A O no hydrogen 2.964 N/A GLU 197.A N ALA 194.A O no hydrogen 2.886 N/A LEU 198.A N PHE 195.A O no hydrogen 3.179 N/A HIS 199.A NE2 ASP 172.A OD1 no hydrogen 2.842 N/A TRP 201.A NE1 ALA 196.A O no hydrogen 2.918 N/A ILE 214.A N SER 179.A O no hydrogen 3.014 N/A LEU 216.A N TYR 181.A O no hydrogen 2.821 N/A ALA 217.A N ILE 336.A O no hydrogen 2.914 N/A CYS 219.A SG SER 186.A O no hydrogen 2.975 N/A CYS 219.A SG ASP 220.A O no hydrogen 3.583 N/A CYS 219.A SG GLU 223.A O no hydrogen 3.543 N/A ASP 220.A N GLU 223.A OE1 no hydrogen 2.884 N/A GLU 223.A N ASP 220.A O no hydrogen 3.481 N/A GLN 227.A NE2 ILE 65.A O no hydrogen 2.686 N/A PHE 231.A N SER 228.A O no hydrogen 3.344 N/A ALA 233.A N ILE 73.A O no hydrogen 3.174 N/A THR 237.A N ASP 184.A OD2 no hydrogen 3.303 N/A THR 237.A OG1 ASP 184.A OD2 no hydrogen 2.702 N/A SER 238.A N ASP 234.A O no hydrogen 2.658 N/A SER 238.A OG ASP 234.A O no hydrogen 2.774 N/A SER 238.A OG ASP 234.A OD2 no hydrogen 2.994 N/A CYS 239.A N VAL 235.A O no hydrogen 2.757 N/A CYS 239.A SG VAL 235.A O no hydrogen 3.433 N/A LEU 240.A N PHE 236.A O no hydrogen 2.975 N/A THR 241.A N THR 237.A O no hydrogen 2.814 N/A THR 241.A OG1 THR 237.A O no hydrogen 2.514 N/A THR 242.A N SER 238.A O no hydrogen 2.927 N/A THR 242.A OG1 SER 238.A O no hydrogen 2.735 N/A MET 246.A N THR 242.A O no hydrogen 3.200 N/A ALA 247.A N PRO 243.A O no hydrogen 2.786 N/A LEU 248.A N ILE 244.A O no hydrogen 2.985 N/A LYS 249.A N LYS 245.A O no hydrogen 3.223 N/A LYS 249.A NZ ASP 267.A OD1 no hydrogen 3.087 N/A TRP 250.A N MET 246.A O no hydrogen 2.848 N/A PHE 251.A N ALA 247.A O no hydrogen 3.048 N/A CYS 252.A N LEU 248.A O no hydrogen 2.854 N/A CYS 252.A SG LEU 248.A O no hydrogen 3.409 N/A ARG 253.A N LYS 249.A O no hydrogen 3.405 N/A ARG 253.A NE GLU 263.A OE1 no hydrogen 3.316 N/A ARG 253.A NH2 GLU 263.A OE1 no hydrogen 3.279 N/A ARG 254.A N TRP 250.A O no hydrogen 3.012 N/A SER 255.A N PHE 251.A O no hydrogen 3.268 N/A SER 255.A OG PHE 251.A O no hydrogen 2.650 N/A GLU 259.A N LEU 257.A O no hydrogen 2.719 N/A SER 264.A OG ASP 262.A OD1 no hydrogen 2.685 N/A LEU 265.A N ASP 262.A O no hydrogen 3.407 N/A ILE 266.A N GLU 263.A O no hydrogen 3.288 N/A ARG 268.A N LEU 265.A O no hydrogen 3.006 N/A ARG 272.A NE ASP 275.A OD2 no hydrogen 2.903 N/A THR 278.A N ASP 275.A O no hydrogen 3.004 N/A THR 278.A OG1 ASP 275.A O no hydrogen 2.765 N/A LEU 280.A N PRO 270.A O no hydrogen 3.148 N/A GLU 282.A N THR 278.A O no hydrogen 2.895 N/A LEU 283.A N LEU 279.A O no hydrogen 3.284 N/A ASN 284.A N LEU 280.A O no hydrogen 2.855 N/A TRP 285.A N GLY 281.A O no hydrogen 2.831 N/A ILE 286.A N GLU 282.A O no hydrogen 2.992 N/A PHE 287.A N LEU 283.A O no hydrogen 3.099 N/A THR 288.A N ASN 284.A O no hydrogen 3.071 N/A THR 288.A OG1 ASN 284.A O no hydrogen 2.756 N/A ALA 289.A N TRP 285.A O no hydrogen 3.017 N/A VAL 290.A N ILE 286.A O no hydrogen 2.734 N/A THR 291.A N PHE 287.A O no hydrogen 2.821 N/A THR 291.A OG1 PHE 287.A O no hydrogen 2.688 N/A ASP 292.A N THR 288.A O no hydrogen 2.870 N/A THR 293.A N ALA 289.A O no hydrogen 3.199 N/A THR 293.A OG1 ALA 289.A O no hydrogen 2.619 N/A ILE 294.A N VAL 290.A O no hydrogen 3.119 N/A ALA 295.A N THR 291.A O no hydrogen 3.042 N/A TRP 296.A N ASP 292.A O no hydrogen 3.239 N/A ASN 297.A N THR 293.A O no hydrogen 3.210 N/A VAL 298.A N ILE 294.A O no hydrogen 3.247 N/A VAL 298.A N ALA 295.A O no hydrogen 3.263 N/A LEU 299.A N ALA 295.A O no hydrogen 2.837 N/A PHE 304.A N PRO 300.A O no hydrogen 3.026 N/A GLN 305.A N HIS 301.A O no hydrogen 2.909 N/A GLN 305.A NE2 HIS 301.A O no hydrogen 3.267 N/A GLN 305.A NE2 SER 441.A O no hydrogen 3.302 N/A ARG 306.A N GLU 302.A O no hydrogen 2.956 N/A ARG 306.A NH2 ASP 212.A OD1 no hydrogen 2.872 N/A LEU 307.A N LEU 303.A O no hydrogen 3.006 N/A PHE 308.A N PHE 304.A O no hydrogen 2.873 N/A ARG 309.A NH1 ASP 292.A OD1 no hydrogen 2.691 N/A ARG 309.A NH1 ASP 292.A OD2 no hydrogen 3.550 N/A ARG 309.A NH1 PHE 308.A O no hydrogen 3.426 N/A GLN 310.A NE2 ARG 306.A O no hydrogen 3.645 N/A LEU 313.A N ASP 311.A OD1 no hydrogen 3.175 N/A ALA 315.A N ASP 311.A O no hydrogen 2.650 N/A SER 316.A N LEU 312.A O no hydrogen 3.143 N/A SER 316.A OG LEU 312.A O no hydrogen 2.951 N/A LEU 317.A N LEU 313.A O no hydrogen 2.709 N/A PHE 318.A N VAL 314.A O no hydrogen 2.868 N/A ARG 319.A N ALA 315.A O no hydrogen 2.880 N/A ARG 319.A NH2 SER 316.A OG no hydrogen 3.281 N/A ASN 320.A N SER 316.A O no hydrogen 2.767 N/A ASN 320.A ND2 LEU 240.A O no hydrogen 2.670 N/A PHE 321.A N LEU 317.A O no hydrogen 2.618 N/A LEU 322.A N ARG 319.A O no hydrogen 2.951 N/A LEU 323.A N ASN 320.A O no hydrogen 3.184 N/A ALA 324.A N ASN 320.A O no hydrogen 3.319 N/A GLU 325.A N PHE 321.A O no hydrogen 2.793 N/A ARG 326.A N LEU 323.A O no hydrogen 3.075 N/A ARG 326.A NH1 ASP 354.A OD1 no hydrogen 2.933 N/A ARG 326.A NH2 ASP 354.A OD1 no hydrogen 3.556 N/A ARG 326.A NH2 ASP 354.A OD2 no hydrogen 2.730 N/A ILE 327.A N LEU 323.A O no hydrogen 2.921 N/A MET 328.A N ALA 324.A O no hydrogen 3.064 N/A ARG 329.A NE HIS 345.A ND1 no hydrogen 3.434 N/A ARG 329.A NH1 ASN 334.A OD1 no hydrogen 2.919 N/A ARG 329.A NH2 HIS 345.A ND1 no hydrogen 3.229 N/A SER 330.A OG ILE 327.A O no hydrogen 2.431 N/A ALA 331.A N MET 328.A O no hydrogen 2.851 N/A ASN 332.A N ARG 329.A O no hydrogen 3.328 N/A CYS 333.A N MET 328.A O no hydrogen 3.074 N/A CYS 333.A SG THR 224.A O no hydrogen 3.239 N/A CYS 333.A SG ALA 331.A O no hydrogen 3.878 N/A CYS 333.A SG ASN 332.A O no hydrogen 3.304 N/A ASN 334.A N GLU 223.A OE1 no hydrogen 2.882 N/A ASN 334.A ND2 GLU 223.A OE1 no hydrogen 3.537 N/A ASN 334.A ND2 GLU 223.A OE2 no hydrogen 2.697 N/A ILE 336.A N ALA 217.A O no hydrogen 3.244 N/A SER 337.A OG PRO 339.A O no hydrogen 2.750 N/A SER 337.A OG MET 340.A O no hydrogen 3.210 N/A HIS 338.A N LEU 215.A O no hydrogen 2.911 N/A TRP 350.A N HIS 347.A O no hydrogen 3.196 N/A TRP 353.A N MET 349.A O no hydrogen 3.104 N/A ASP 354.A N TRP 350.A O no hydrogen 2.783 N/A MET 355.A N ASP 351.A O no hydrogen 2.942 N/A ALA 356.A N ALA 352.A O no hydrogen 3.296 N/A ALA 357.A N TRP 353.A O no hydrogen 2.850 N/A GLU 358.A N ASP 354.A O no hydrogen 3.010 N/A ILE 359.A N MET 355.A O no hydrogen 2.968 N/A CYS 360.A N ALA 356.A O no hydrogen 2.775 N/A LEU 361.A N ALA 357.A O no hydrogen 3.004 N/A SER 362.A N GLU 358.A O no hydrogen 3.145 N/A SER 362.A OG GLU 358.A O no hydrogen 2.984 N/A SER 362.A OG ILE 359.A O no hydrogen 3.360 N/A LEU 367.A N GLN 363.A O no hydrogen 3.290 N/A GLU 374.A N SER 372.A OG no hydrogen 3.052 N/A SER 378.A N GLU 282.A OE2 no hydrogen 2.657 N/A SER 378.A OG GLU 282.A OE1 no hydrogen 3.032 N/A SER 378.A OG GLU 282.A OE2 no hydrogen 3.483 N/A GLU 383.A N PRO 379.A O no hydrogen 2.932 N/A GLN 384.A N PHE 380.A O no hydrogen 2.935 N/A LEU 385.A N PHE 381.A O no hydrogen 2.936 N/A THR 386.A N THR 382.A O no hydrogen 3.093 N/A THR 386.A OG1 THR 382.A O no hydrogen 2.743 N/A ALA 387.A N GLU 383.A O no hydrogen 3.256 N/A PHE 388.A N GLN 384.A O no hydrogen 3.065 N/A GLU 389.A N LEU 385.A O no hydrogen 3.131 N/A VAL 390.A N THR 386.A O no hydrogen 2.971 N/A TRP 391.A N ALA 387.A O no hydrogen 3.303 N/A LEU 392.A N PHE 388.A O no hydrogen 2.963 N/A ASP 393.A N GLU 389.A O no hydrogen 3.065 N/A HIS 394.A N VAL 390.A O no hydrogen 3.047 N/A SER 396.A OG LEU 392.A O no hydrogen 2.724 N/A ILE 407.A N GLN 404.A O no hydrogen 3.082 N/A VAL 408.A N GLN 404.A O no hydrogen 2.957 N/A LEU 409.A N LEU 405.A O no hydrogen 3.114 N/A GLN 410.A N PRO 406.A O no hydrogen 3.392 N/A VAL 411.A N ILE 407.A O no hydrogen 3.049 N/A LEU 412.A N VAL 408.A O no hydrogen 3.360 N/A LEU 412.A N LEU 409.A O no hydrogen 3.064 N/A LEU 413.A N GLN 410.A O no hydrogen 3.131 N/A ARG 418.A N GLN 415.A O no hydrogen 3.220 N/A ARG 418.A NE LEU 412.A O no hydrogen 3.121 N/A ARG 418.A NH2 LEU 412.A O no hydrogen 3.282 N/A ARG 418.A NH2 LEU 413.A O no hydrogen 3.377 N/A ARG 420.A NH1 THR 382.A O no hydrogen 3.463 N/A ALA 421.A N HIS 417.A O no hydrogen 3.086 N/A LEU 422.A N ARG 418.A O no hydrogen 2.817 N/A VAL 423.A N PHE 419.A O no hydrogen 2.849 N/A LEU 424.A N ARG 420.A O no hydrogen 2.766 N/A LEU 425.A N ALA 421.A O no hydrogen 2.709 N/A GLY 426.A N LEU 422.A O no hydrogen 2.966 N/A ARG 427.A N VAL 423.A O no hydrogen 3.013 N/A ARG 427.A NH1 GLU 389.A OE1 no hydrogen 3.013 N/A PHE 428.A N LEU 424.A O no hydrogen 2.936 N/A LEU 429.A N LEU 425.A O no hydrogen 2.681 N/A ASP 430.A N GLY 426.A O no hydrogen 2.749 N/A MET 431.A N PHE 428.A O no hydrogen 3.310 N/A GLY 432.A N LEU 429.A O no hydrogen 3.291 N/A ALA 435.A N GLY 432.A O no hydrogen 3.240 N/A VAL 436.A N GLY 432.A O no hydrogen 3.388 N/A ASP 437.A N SER 433.A O no hydrogen 2.949 N/A LEU 438.A N TRP 434.A O no hydrogen 3.128 N/A ALA 439.A N ALA 435.A O no hydrogen 3.006 N/A LEU 440.A N VAL 436.A O no hydrogen 2.857 N/A SER 441.A N ASP 437.A O no hydrogen 3.072 N/A SER 441.A OG HIS 301.A ND1 no hydrogen 2.848 N/A VAL 442.A N LEU 438.A O no hydrogen 3.074 N/A GLY 443.A N ALA 439.A O no hydrogen 3.305 N/A ILE 444.A N ALA 439.A O no hydrogen 3.295 N/A TYR 447.A N ILE 444.A O no hydrogen 3.136 N/A VAL 448.A N ILE 444.A O no hydrogen 3.059 N/A LEU 449.A N PHE 445.A O no hydrogen 2.785 N/A LYS 450.A N PRO 446.A O no hydrogen 3.001 N/A LEU 451.A N TYR 447.A O no hydrogen 3.206 N/A GLN 453.A N LYS 450.A O no hydrogen 2.920 N/A THR 454.A N LEU 451.A O no hydrogen 3.236 N/A THR 454.A OG1 LEU 451.A O no hydrogen 3.125 N/A LEU 459.A N THR 456.A O no hydrogen 3.244 N/A ARG 460.A NH1 ASN 457.A OD1 no hydrogen 2.715 N/A LEU 463.A N LEU 459.A O no hydrogen 2.973 N/A VAL 464.A N ARG 460.A O no hydrogen 3.122 N/A PHE 465.A N GLN 461.A O no hydrogen 3.390 N/A ILE 466.A N ILE 462.A O no hydrogen 2.895 N/A TRP 467.A N LEU 463.A O no hydrogen 3.035 N/A THR 468.A N VAL 464.A O no hydrogen 2.872 N/A THR 468.A OG1 VAL 464.A O no hydrogen 2.971 N/A LYS 469.A N PHE 465.A O no hydrogen 3.191 N/A LYS 469.A NZ ASP 430.A OD1 no hydrogen 3.264 N/A LYS 469.A NZ PHE 707.A O no hydrogen 3.100 N/A LYS 469.A NZ LYS 709.A O no hydrogen 3.030 N/A ILE 470.A N ILE 466.A O no hydrogen 3.135 N/A LEU 471.A N TRP 467.A O no hydrogen 2.974 N/A ALA 472.A N THR 468.A O no hydrogen 2.806 N/A LEU 473.A N LYS 469.A O no hydrogen 3.342 N/A ASP 474.A N ILE 470.A O no hydrogen 2.832 N/A LYS 475.A NZ ASP 516.A OD2 no hydrogen 3.211 N/A SER 476.A N ASP 474.A OD1 no hydrogen 3.410 N/A SER 476.A OG ASP 474.A OD1 no hydrogen 2.543 N/A CYS 477.A SG ASP 474.A O no hydrogen 3.570 N/A GLN 478.A N LYS 475.A O no hydrogen 3.252 N/A GLN 478.A NE2 VAL 513.A O no hydrogen 2.873 N/A GLN 478.A NE2 ASP 516.A O no hydrogen 2.475 N/A ILE 479.A N SER 476.A O no hydrogen 3.273 N/A LEU 481.A N CYS 477.A O no hydrogen 2.981 N/A VAL 482.A N GLN 478.A O no hydrogen 3.285 N/A LYS 483.A N ILE 479.A O no hydrogen 3.109 N/A ASP 484.A N ASP 480.A O no hydrogen 3.332 N/A GLY 485.A N VAL 482.A O no hydrogen 3.129 N/A GLY 486.A N LEU 481.A O no hydrogen 2.694 N/A TYR 489.A N GLY 486.A O no hydrogen 3.028 N/A ILE 491.A N HIS 487.A O no hydrogen 3.399 N/A ARG 492.A N THR 488.A O no hydrogen 3.137 N/A PHE 493.A N TYR 489.A O no hydrogen 3.241 N/A LEU 494.A N PHE 490.A O no hydrogen 2.956 N/A ASP 495.A N ILE 491.A O no hydrogen 3.069 N/A SER 496.A N ARG 492.A O no hydrogen 2.734 N/A SER 496.A OG ASP 495.A O no hydrogen 2.838 N/A SER 496.A OG GLY 498.A O no hydrogen 2.911 N/A GLN 503.A N PHE 500.A O no hydrogen 3.203 N/A ARG 504.A N PHE 500.A O no hydrogen 3.352 N/A ARG 504.A NH2 GLY 498.A O no hydrogen 3.009 N/A ALA 505.A N PRO 501.A O no hydrogen 2.986 N/A MET 506.A N GLU 502.A O no hydrogen 3.465 N/A ALA 507.A N GLN 503.A O no hydrogen 3.124 N/A ALA 508.A N ARG 504.A O no hydrogen 2.929 N/A PHE 509.A N ALA 505.A O no hydrogen 2.721 N/A VAL 510.A N MET 506.A O no hydrogen 2.701 N/A LEU 511.A N ALA 507.A O no hydrogen 3.167 N/A ALA 512.A N ALA 508.A O no hydrogen 2.944 N/A VAL 513.A N PHE 509.A O no hydrogen 2.959 N/A ILE 514.A N VAL 510.A O no hydrogen 2.978 N/A VAL 515.A N LEU 511.A O no hydrogen 3.040 N/A ASP 516.A N ALA 512.A O no hydrogen 2.962 N/A HIS 518.A N VAL 515.A O no hydrogen 2.817 N/A ARG 519.A NH2 ASP 557.A O no hydrogen 2.745 N/A GLN 522.A N HIS 518.A O no hydrogen 2.701 N/A GLN 522.A NE2 GLU 556.A O no hydrogen 3.526 N/A GLU 523.A N ARG 519.A O no hydrogen 3.151 N/A ALA 524.A N ARG 520.A O no hydrogen 2.944 N/A CYS 525.A N GLY 521.A O no hydrogen 3.076 N/A CYS 525.A SG GLY 521.A O no hydrogen 3.244 N/A LEU 526.A N GLN 522.A O no hydrogen 2.792 N/A GLU 527.A N GLU 523.A O no hydrogen 3.062 N/A ASN 529.A N LEU 526.A O no hydrogen 3.203 N/A LEU 530.A N CYS 525.A O no hydrogen 3.150 N/A VAL 533.A N ASN 529.A O no hydrogen 2.844 N/A CYS 534.A N LEU 530.A O no hydrogen 2.911 N/A CYS 534.A SG LEU 530.A O no hydrogen 3.242 N/A LEU 535.A N ILE 531.A O no hydrogen 2.856 N/A GLY 536.A N GLY 532.A O no hydrogen 3.020 N/A HIS 537.A N CYS 534.A O no hydrogen 3.181 N/A HIS 537.A ND1 VAL 533.A O no hydrogen 2.934 N/A LEU 544.A N GLU 540.A O no hydrogen 2.984 N/A GLN 545.A N PRO 541.A O no hydrogen 2.852 N/A TRP 546.A N LEU 542.A O no hydrogen 3.028 N/A LEU 547.A N PHE 543.A O no hydrogen 2.819 N/A CYS 548.A N LEU 544.A O no hydrogen 3.251 N/A CYS 548.A SG LEU 544.A O no hydrogen 3.127 N/A LEU 549.A N GLN 545.A O no hydrogen 3.008 N/A CYS 550.A N TRP 546.A O no hydrogen 3.025 N/A CYS 550.A SG ALA 508.A O no hydrogen 3.806 N/A LEU 551.A N LEU 547.A O no hydrogen 3.181 N/A GLY 552.A N CYS 548.A O no hydrogen 2.663 N/A LYS 553.A N LEU 549.A O no hydrogen 3.127 N/A LYS 553.A NZ ASP 516.A OD1 no hydrogen 3.167 N/A LYS 553.A NZ GLU 556.A OE1 no hydrogen 3.408 N/A LEU 554.A N CYS 550.A O no hydrogen 3.061 N/A TRP 555.A N LEU 551.A O no hydrogen 2.952 N/A GLU 556.A N GLY 552.A O no hydrogen 3.192 N/A ALA 561.A N PHE 558.A O no hydrogen 3.010 N/A GLN 562.A N PHE 558.A O no hydrogen 3.190 N/A GLN 562.A NE2 THR 595.A O no hydrogen 2.849 N/A GLN 562.A NE2 LEU 597.A O no hydrogen 2.906 N/A ILE 563.A N MET 559.A O no hydrogen 2.976 N/A MET 564.A N GLU 560.A O no hydrogen 3.273 N/A GLY 565.A N ALA 561.A O no hydrogen 2.719 N/A ARG 566.A N GLN 562.A O no hydrogen 3.009 N/A ARG 566.A NH2 LEU 596.A O no hydrogen 3.488 N/A GLU 567.A N ILE 563.A O no hydrogen 3.216 N/A ALA 568.A N MET 564.A O no hydrogen 3.090 N/A ASN 569.A N ARG 566.A O no hydrogen 2.832 N/A ALA 570.A N GLY 565.A O no hydrogen 2.895 N/A LYS 573.A N ALA 570.A O no hydrogen 3.135 N/A LYS 573.A NZ ALA 568.A O no hydrogen 3.444 N/A LEU 574.A N ALA 570.A O no hydrogen 2.756 N/A ALA 575.A N PHE 571.A O no hydrogen 2.867 N/A LEU 577.A N LEU 574.A O no hydrogen 2.893 N/A LEU 578.A N ALA 575.A O no hydrogen 2.915 N/A SER 579.A OG PRO 576.A O no hydrogen 3.206 N/A GLU 580.A N LEU 577.A O no hydrogen 3.015 N/A GLU 584.A N GLU 584.A OE1 no hydrogen 3.002 N/A VAL 585.A N GLN 582.A O no hydrogen 2.948 N/A ARG 586.A N GLN 582.A O no hydrogen 3.214 N/A ARG 586.A NE GLU 580.A O no hydrogen 2.621 N/A ARG 586.A NH2 PRO 581.A O no hydrogen 3.212 N/A ALA 587.A N PRO 583.A O no hydrogen 2.803 N/A ALA 588.A N GLU 584.A O no hydrogen 3.170 N/A ALA 589.A N VAL 585.A O no hydrogen 2.903 N/A VAL 590.A N ARG 586.A O no hydrogen 2.883 N/A PHE 591.A N ALA 587.A O no hydrogen 3.033 N/A ALA 592.A N ALA 588.A O no hydrogen 3.024 N/A LEU 593.A N ALA 589.A O no hydrogen 2.897 N/A GLY 594.A N VAL 590.A O no hydrogen 2.775 N/A THR 595.A N PHE 591.A O no hydrogen 2.997 N/A THR 595.A OG1 GLY 552.A O no hydrogen 2.865 N/A THR 595.A OG1 PHE 591.A O no hydrogen 3.438 N/A THR 595.A OG1 ALA 592.A O no hydrogen 3.246 N/A LEU 596.A N ALA 592.A O no hydrogen 3.306 N/A LEU 597.A N GLY 594.A O no hydrogen 3.460 N/A ASP 598.A N GLU 609.A OE2 no hydrogen 3.136 N/A GLU 599.A N GLU 599.A OE1 no hydrogen 2.896 N/A ILE 606.A N ASP 603.A O no hydrogen 2.720 N/A ALA 608.A N GLU 604.A O no hydrogen 3.501 N/A GLU 609.A N LYS 605.A O no hydrogen 2.699 N/A ASP 610.A N ILE 606.A O no hydrogen 2.936 N/A ALA 611.A N ARG 607.A O no hydrogen 2.996 N/A ILE 612.A N ALA 608.A O no hydrogen 2.761 N/A ILE 613.A N GLU 609.A O no hydrogen 3.175 N/A LYS 614.A N ASP 610.A O no hydrogen 2.979 N/A SER 615.A N ALA 611.A O no hydrogen 3.164 N/A SER 615.A OG ALA 611.A O no hydrogen 3.513 N/A SER 615.A OG ILE 612.A O no hydrogen 2.762 N/A LEU 616.A N ILE 612.A O no hydrogen 2.966 N/A LEU 617.A N ILE 613.A O no hydrogen 2.859 N/A ASP 618.A N LYS 614.A O no hydrogen 3.069 N/A VAL 619.A N LEU 616.A O no hydrogen 3.263 N/A VAL 620.A N LEU 617.A O no hydrogen 3.212 N/A SER 621.A OG GLN 847.A OE1 no hydrogen 3.447 N/A SER 624.A N ASP 622.A OD2 no hydrogen 2.885 N/A LEU 626.A N SER 624.A OG no hydrogen 3.298 N/A VAL 627.A N SER 624.A O no hydrogen 2.991 N/A ARG 628.A N SER 624.A O no hydrogen 3.234 N/A ARG 628.A NE ASP 622.A O no hydrogen 2.703 N/A ARG 628.A NH1 ASP 670.A OD2 no hydrogen 3.123 N/A ARG 628.A NH2 GLY 623.A O no hydrogen 3.311 N/A ARG 628.A NH2 GLY 842.A O no hydrogen 2.483 N/A ALA 629.A N PRO 625.A O no hydrogen 2.872 N/A VAL 631.A N VAL 627.A O no hydrogen 2.874 N/A ALA 632.A N ARG 628.A O no hydrogen 2.924 N/A VAL 633.A N ALA 629.A O no hydrogen 3.072 N/A ALA 634.A N GLU 630.A O no hydrogen 2.963 N/A LEU 635.A N VAL 631.A O no hydrogen 2.850 N/A ALA 636.A N ALA 632.A O no hydrogen 3.006 N/A ARG 637.A N VAL 633.A O no hydrogen 2.949 N/A ARG 637.A NE GLY 594.A O no hydrogen 2.915 N/A ARG 637.A NH1 ASP 557.A OD1 no hydrogen 3.367 N/A ARG 637.A NH2 LEU 597.A O no hydrogen 2.924 N/A PHE 638.A N ALA 634.A O no hydrogen 2.979 N/A ALA 639.A N LEU 635.A O no hydrogen 2.662 N/A PHE 640.A N ALA 636.A O no hydrogen 2.934 N/A HIS 642.A N PHE 638.A O no hydrogen 3.304 N/A HIS 642.A ND1 PHE 638.A O no hydrogen 2.973 N/A LYS 643.A NZ GLU 690.A OE1 no hydrogen 3.096 N/A LEU 646.A N HIS 642.A O no hydrogen 3.058 N/A LYS 647.A N LYS 643.A O no hydrogen 2.845 N/A LEU 648.A N GLN 644.A O no hydrogen 3.231 N/A ALA 649.A N HIS 645.A O no hydrogen 3.075 N/A ALA 650.A N LEU 646.A O no hydrogen 3.308 N/A ALA 651.A N LYS 647.A O no hydrogen 3.205 N/A ALA 651.A N LEU 648.A O no hydrogen 3.336 N/A SER 652.A OG ALA 649.A O no hydrogen 3.242 N/A TYR 653.A N ALA 649.A O no hydrogen 3.276 N/A SER 658.A OG ALA 655.A O no hydrogen 2.692 N/A CYS 660.A N VAL 656.A O no hydrogen 3.227 N/A VAL 661.A N TYR 657.A O no hydrogen 3.222 N/A ARG 662.A N SER 658.A O no hydrogen 3.409 N/A ALA 663.A N GLN 659.A O no hydrogen 3.234 N/A MET 664.A N CYS 660.A O no hydrogen 3.119 N/A PHE 665.A N VAL 661.A O no hydrogen 3.130 N/A ALA 666.A N ARG 662.A O no hydrogen 2.777 N/A LEU 667.A N ALA 663.A O no hydrogen 2.925 N/A ALA 668.A N MET 664.A O no hydrogen 2.759 N/A LYS 669.A N ALA 666.A O no hydrogen 3.321 N/A ASP 670.A N LEU 667.A O no hydrogen 3.258 N/A SER 672.A N ASP 670.A OD1 no hydrogen 2.904 N/A ALA 676.A N SER 672.A O no hydrogen 2.886 N/A SER 677.A N PRO 673.A O no hydrogen 3.059 N/A SER 677.A OG PRO 673.A O no hydrogen 3.433 N/A SER 677.A OG ARG 674.A O no hydrogen 3.006 N/A LEU 678.A N ARG 674.A O no hydrogen 3.021 N/A GLY 679.A N ILE 675.A O no hydrogen 2.993 N/A ARG 680.A N ALA 676.A O no hydrogen 3.051 N/A ARG 681.A N SER 677.A O no hydrogen 2.952 N/A VAL 682.A N LEU 678.A O no hydrogen 3.103 N/A LEU 683.A N GLY 679.A O no hydrogen 3.096 N/A SER 684.A N ARG 680.A O no hydrogen 3.312 N/A SER 684.A OG ARG 680.A O no hydrogen 2.844 N/A SER 684.A OG ARG 681.A O no hydrogen 2.761 N/A ILE 685.A N ARG 681.A O no hydrogen 3.052 N/A ILE 686.A N VAL 682.A O no hydrogen 3.186 N/A GLY 687.A N LEU 683.A O no hydrogen 3.012 N/A ILE 688.A N LEU 683.A O no hydrogen 2.903 N/A LEU 693.A N GLU 690.A O no hydrogen 3.241 N/A LEU 694.A N ARG 691.A O no hydrogen 2.975 N/A SER 697.A OG GLU 630.A OE1 no hydrogen 2.845 N/A SER 697.A OG GLU 630.A OE2 no hydrogen 3.416 N/A THR 698.A N GLU 630.A OE2 no hydrogen 3.165 N/A THR 698.A OG1 GLU 630.A OE2 no hydrogen 3.483 N/A ILE 699.A N GLU 630.A OE2 no hydrogen 2.870 N/A TRP 702.A N THR 698.A O no hydrogen 2.855 N/A SER 703.A N ILE 699.A O no hydrogen 3.028 N/A SER 703.A OG GLN 545.A OE1 no hydrogen 2.624 N/A SER 703.A OG ILE 699.A O no hydrogen 2.643 N/A CYS 704.A N TYR 700.A O no hydrogen 3.064 N/A CYS 704.A SG TYR 700.A O no hydrogen 3.247 N/A GLY 705.A N TRP 702.A O no hydrogen 3.015 N/A HIS 706.A N SER 703.A O no hydrogen 3.116 N/A PHE 707.A N CYS 704.A O no hydrogen 2.965 N/A SER 708.A N CYS 704.A O no hydrogen 3.345 N/A SER 708.A OG GLY 705.A O no hydrogen 3.156 N/A LEU 711.A N ASP 430.A OD1 no hydrogen 2.990 N/A ALA 716.A N SER 712.A O no hydrogen 3.392 N/A LYS 718.A N GLU 714.A O no hydrogen 3.368 N/A LYS 718.A NZ GLU 714.A OE2 no hydrogen 3.280 N/A ARG 719.A N ILE 715.A O no hydrogen 3.334 N/A ARG 719.A NE ASP 812.A OD2 no hydrogen 3.248 N/A ARG 719.A NH2 PRO 8.A O no hydrogen 2.963 N/A GLU 720.A N ALA 716.A O no hydrogen 2.998 N/A GLU 721.A N ALA 717.A O no hydrogen 2.908 N/A LYS 722.A N LYS 718.A O no hydrogen 3.442 N/A GLU 723.A N ARG 719.A O no hydrogen 3.188 N/A LYS 724.A N GLU 720.A O no hydrogen 2.985 N/A PHE 725.A N GLU 721.A O no hydrogen 3.381 N/A ALA 726.A N LYS 722.A O no hydrogen 2.763 N/A LEU 727.A N GLU 723.A O no hydrogen 2.927 N/A GLU 728.A N LYS 724.A O no hydrogen 3.002 N/A HIS 729.A N PHE 725.A O no hydrogen 3.097 N/A ILE 730.A N ALA 726.A O no hydrogen 2.774 N/A ALA 731.A N LEU 727.A O no hydrogen 3.351 N/A LYS 732.A N GLU 728.A O no hydrogen 3.116 N/A LYS 732.A NZ HIS 729.A NE2 no hydrogen 3.533 N/A CYS 733.A N HIS 729.A O no hydrogen 2.957 N/A CYS 733.A SG HIS 729.A O no hydrogen 3.223 N/A GLN 734.A N ILE 730.A O no hydrogen 3.110 N/A HIS 735.A N ALA 731.A O no hydrogen 2.881 N/A SER 736.A N LYS 732.A O no hydrogen 3.036 N/A SER 736.A OG LYS 732.A O no hydrogen 2.730 N/A SER 736.A OG CYS 733.A O no hydrogen 3.382 N/A SER 739.A OG ASP 1058.A OD1 no hydrogen 3.541 N/A LEU 741.A N LEU 1014.A O no hydrogen 2.884 N/A ASN 742.A N THR 1056.A O no hydrogen 2.749 N/A ILE 746.A N ILE 1054.A O no hydrogen 2.862 N/A TRP 749.A N VAL 1052.A O no hydrogen 3.258 N/A THR 751.A N SER 1050.A O no hydrogen 3.114 N/A THR 751.A OG1 SER 1050.A O no hydrogen 2.784 N/A ARG 752.A N ASP 750.A OD1 no hydrogen 3.198 N/A PHE 753.A N THR 751.A OG1 no hydrogen 3.218 N/A LYS 758.A N ALA 772.A O no hydrogen 3.109 N/A LYS 758.A NZ GLY 756.A O no hydrogen 3.184 N/A LYS 758.A NZ GLU 774.A OE1 no hydrogen 3.514 N/A LEU 761.A N VAL 770.A O no hydrogen 2.775 N/A HIS 763.A N ILE 768.A O no hydrogen 3.059 N/A HIS 763.A NE2 SER 814.A OG no hydrogen 3.193 N/A PHE 765.A N HIS 763.A ND1 no hydrogen 3.209 N/A ILE 768.A N SER 766.A O no hydrogen 2.998 N/A VAL 769.A N TRP 781.A O no hydrogen 2.722 N/A VAL 770.A N LEU 761.A O no hydrogen 2.907 N/A ALA 771.A N ARG 779.A O no hydrogen 3.028 N/A ALA 772.A N THR 759.A O no hydrogen 3.019 N/A ASP 773.A N ARG 777.A O no hydrogen 3.243 N/A GLU 774.A N ASP 773.A OD1 no hydrogen 2.650 N/A GLU 776.A N ASP 773.A O no hydrogen 3.211 N/A ARG 777.A NH1 GLU 754.A OE2 no hydrogen 3.167 N/A ARG 779.A N ALA 771.A O no hydrogen 3.214 N/A VAL 780.A N ASN 790.A O no hydrogen 3.106 N/A ASN 782.A N THR 787.A O no hydrogen 2.742 N/A GLU 784.A N ASN 782.A OD1 no hydrogen 3.026 N/A GLU 785.A N ASN 782.A OD1 no hydrogen 2.669 N/A THR 787.A OG1 LEU 788.A O no hydrogen 3.274 N/A LEU 789.A N VAL 780.A O no hydrogen 2.776 N/A ASN 790.A ND2 TYR 831.A O no hydrogen 3.449 N/A GLY 791.A N ASN 790.A OD1 no hydrogen 2.625 N/A PHE 792.A N ILE 778.A O no hydrogen 2.832 N/A ASN 794.A N GLU 776.A O no hydrogen 3.204 N/A ASN 794.A ND2 GLU 776.A OE1 no hydrogen 2.812 N/A HIS 795.A NE2 GLU 776.A OE2 no hydrogen 2.765 N/A PHE 797.A N HIS 795.A ND1 no hydrogen 3.128 N/A LYS 800.A NZ PHE 797.A O no hydrogen 2.873 N/A GLY 801.A N GLU 776.A OE2 no hydrogen 2.949 N/A SER 803.A N ALA 819.A O no hydrogen 2.955 N/A SER 803.A OG ALA 850.A O no hydrogen 2.674 N/A LYS 804.A N ALA 819.A O no hydrogen 3.163 N/A LYS 804.A NZ ASP 853.A OD1 no hydrogen 2.929 N/A CYS 806.A N LEU 817.A O no hydrogen 3.242 N/A ILE 808.A N LEU 815.A O no hydrogen 3.020 N/A ASN 809.A N GLN 856.A OE1 no hydrogen 2.592 N/A ASN 809.A ND2 VAL 12.A O no hydrogen 2.622 N/A ASP 812.A N ASN 809.A O no hydrogen 3.211 N/A SER 814.A OG HIS 763.A NE2 no hydrogen 3.193 N/A SER 814.A OG TYR 831.A OH no hydrogen 2.899 N/A LEU 815.A N ILE 808.A O no hydrogen 2.934 N/A LEU 816.A N TRP 828.A O no hydrogen 3.026 N/A LEU 817.A N CYS 806.A O no hydrogen 2.932 N/A VAL 818.A N ARG 826.A O no hydrogen 2.735 N/A ALA 819.A N LYS 804.A O no hydrogen 3.043 N/A SER 820.A N SER 824.A O no hydrogen 2.881 N/A SER 820.A OG GLU 776.A OE1 no hydrogen 2.662 N/A CYS 821.A N GLY 801.A O no hydrogen 2.842 N/A CYS 821.A SG ILE 802.A O no hydrogen 3.215 N/A GLY 823.A N SER 820.A O no hydrogen 2.838 N/A SER 824.A N ASP 822.A OD1 no hydrogen 3.324 N/A SER 824.A OG ASP 822.A OD1 no hydrogen 2.606 N/A SER 824.A OG ASP 822.A OD2 no hydrogen 3.272 N/A VAL 825.A N PHE 843.A O no hydrogen 2.883 N/A ARG 826.A N VAL 818.A O no hydrogen 3.229 N/A ILE 827.A N THR 841.A O no hydrogen 3.011 N/A TRP 828.A N LEU 816.A O no hydrogen 3.015 N/A TRP 828.A NE1 ASN 794.A OD1 no hydrogen 2.848 N/A LYS 829.A N LYS 838.A O no hydrogen 3.028 N/A TYR 831.A OH SER 814.A OG no hydrogen 2.899 N/A THR 833.A N ASN 830.A O no hydrogen 3.243 N/A THR 833.A OG1 ASN 830.A O no hydrogen 3.047 N/A GLN 837.A NE2 ASN 790.A OD1 no hydrogen 3.690 N/A VAL 840.A N ILE 827.A O no hydrogen 2.829 N/A THR 841.A OG1 VAL 840.A O no hydrogen 2.978 N/A PHE 843.A N VAL 825.A O no hydrogen 3.187 N/A SER 845.A OG GLY 823.A O no hydrogen 2.445 N/A GLN 847.A NE2 SER 844.A O no hydrogen 3.503 N/A ALA 850.A N CYS 821.A O no hydrogen 2.887 N/A VAL 851.A N SER 864.A O no hydrogen 2.588 N/A ASP 853.A N TYR 862.A O no hydrogen 2.974 N/A TRP 854.A NE1 GLN 856.A OE1 no hydrogen 3.242 N/A GLN 855.A N TYR 860.A O no hydrogen 2.819 N/A GLN 855.A NE2 SER 898.A O no hydrogen 2.557 N/A GLN 855.A NE2 GLN 904.A O no hydrogen 3.117 N/A GLN 856.A NE2 GLN 856.A O no hydrogen 2.874 N/A GLN 857.A NE2 GLN 857.A O no hydrogen 3.541 N/A SER 858.A OG GLN 855.A OE1 no hydrogen 2.822 N/A TYR 860.A N SER 858.A OG no hydrogen 3.299 N/A LEU 861.A N TRP 873.A O no hydrogen 2.728 N/A TYR 862.A N ASP 853.A O no hydrogen 2.907 N/A TYR 862.A OH GLN 855.A OE1 no hydrogen 2.696 N/A ALA 863.A N THR 871.A O no hydrogen 2.999 N/A SER 864.A N VAL 851.A O no hydrogen 2.934 N/A GLU 866.A N LEU 848.A O no hydrogen 2.832 N/A VAL 870.A N VAL 884.A O no hydrogen 2.671 N/A THR 871.A N ALA 863.A O no hydrogen 2.743 N/A LEU 872.A N ARG 882.A O no hydrogen 2.703 N/A TRP 873.A N LEU 861.A O no hydrogen 2.812 N/A ASP 874.A N GLN 879.A O no hydrogen 3.024 N/A LEU 875.A N GLY 859.A O no hydrogen 3.052 N/A GLU 876.A N ASP 874.A OD1 no hydrogen 3.171 N/A GLU 878.A N ASP 874.A O no hydrogen 2.527 N/A GLN 879.A N ASP 874.A O no hydrogen 3.383 N/A GLN 879.A NE2 SER 579.A O no hydrogen 3.584 N/A ARG 882.A N LEU 872.A O no hydrogen 3.368 N/A ARG 882.A NH2 VAL 919.A O no hydrogen 3.163 N/A ARG 882.A NH2 SER 921.A O no hydrogen 2.529 N/A VAL 884.A N VAL 870.A O no hydrogen 2.845 N/A SER 886.A N SER 868.A O no hydrogen 2.902 N/A SER 886.A OG SER 868.A O no hydrogen 2.804 N/A SER 888.A OG CYS 890.A O no hydrogen 3.433 N/A CYS 890.A SG SER 888.A OG no hydrogen 3.311 N/A VAL 892.A N GLY 865.A O no hydrogen 2.732 N/A THR 893.A N GLY 908.A O no hydrogen 2.877 N/A ALA 894.A N GLY 908.A O no hydrogen 3.229 N/A SER 896.A N ALA 906.A O no hydrogen 2.951 N/A ALA 897.A N ASP 853.A OD2 no hydrogen 2.669 N/A SER 898.A N GLN 904.A O no hydrogen 3.162 N/A HIS 901.A N SER 898.A OG no hydrogen 2.983 N/A GLY 903.A N GLN 855.A OE1 no hydrogen 2.897 N/A GLN 904.A N HIS 901.A O no hydrogen 3.316 N/A LEU 905.A N TYR 917.A O no hydrogen 3.113 N/A ALA 906.A N SER 896.A O no hydrogen 2.757 N/A ALA 907.A N ARG 915.A O no hydrogen 2.937 N/A GLY 908.A N ALA 894.A O no hydrogen 2.811 N/A PHE 909.A N SER 913.A O no hydrogen 3.106 N/A ALA 910.A N GLY 891.A O no hydrogen 2.884 N/A GLY 912.A N PHE 909.A O no hydrogen 2.919 N/A SER 913.A N ASP 911.A OD1 no hydrogen 2.843 N/A SER 913.A OG ASP 911.A OD1 no hydrogen 2.699 N/A ARG 915.A N ALA 907.A O no hydrogen 3.076 N/A ARG 915.A NH2 SER 913.A OG no hydrogen 2.695 N/A LEU 916.A N CYS 927.A O no hydrogen 3.044 N/A TYR 917.A N LEU 905.A O no hydrogen 2.801 N/A TYR 917.A OH SER 886.A O no hydrogen 2.752 N/A ASP 918.A N PRO 924.A O no hydrogen 2.719 N/A VAL 919.A N GLY 903.A O no hydrogen 2.969 N/A SER 921.A OG GLU 923.A O no hydrogen 3.474 N/A SER 921.A OG GLU 923.A OE2 no hydrogen 3.180 N/A VAL 926.A N LEU 916.A O no hydrogen 2.992 N/A THR 929.A N LEU 914.A O no hydrogen 3.004 N/A HIS 932.A ND1 HIS 932.A O no hydrogen 2.865 N/A GLU 936.A N LYS 934.A O no hydrogen 2.942 N/A VAL 938.A N PHE 909.A O no hydrogen 3.076 N/A GLY 940.A N ALA 955.A O no hydrogen 3.482 N/A SER 942.A OG PHE 943.A O no hydrogen 3.066 N/A GLN 944.A N ALA 950.A O no hydrogen 3.141 N/A LYS 951.A N LEU 964.A O no hydrogen 2.962 N/A VAL 953.A N SER 942.A O no hydrogen 3.123 N/A ALA 955.A N GLY 940.A O no hydrogen 3.208 N/A SER 956.A N ASP 960.A O no hydrogen 3.301 N/A SER 956.A OG GLU 936.A O no hydrogen 3.533 N/A GLN 957.A N ARG 937.A O no hydrogen 3.148 N/A GLN 957.A NE2 GLU 936.A OE2 no hydrogen 3.140 N/A ALA 958.A N SER 956.A OG no hydrogen 3.265 N/A GLY 959.A N SER 956.A O no hydrogen 2.873 N/A ILE 961.A N ILE 976.A O no hydrogen 2.927 N/A GLN 962.A N SER 954.A O no hydrogen 2.815 N/A GLN 962.A NE2 ASP 960.A OD2 no hydrogen 2.816 N/A PHE 963.A N LEU 974.A O no hydrogen 2.694 N/A LEU 964.A N LYS 951.A O no hydrogen 3.350 N/A ARG 967.A NH2 ASP 948.A OD2 no hydrogen 3.481 N/A THR 968.A OG1 ASP 965.A OD1 no hydrogen 2.687 N/A THR 968.A OG1 THR 969.A OG1 no hydrogen 3.069 N/A THR 969.A OG1 THR 968.A OG1 no hydrogen 3.069 N/A ASP 971.A N ASP 971.A OD1 no hydrogen 2.511 N/A LEU 974.A N PHE 963.A O no hydrogen 3.392 N/A THR 975.A OG1 GLN 962.A OE1 no hydrogen 2.660 N/A ILE 976.A N ILE 961.A O no hydrogen 2.960 N/A HIS 979.A N GLY 959.A O no hydrogen 3.244 N/A HIS 979.A NE2 SER 997.A OG no hydrogen 2.705 N/A GLY 981.A N ALA 958.A O no hydrogen 3.063 N/A LEU 983.A N GLN 957.A O no hydrogen 2.948 N/A THR 984.A N GLY 998.A O no hydrogen 2.965 N/A ALA 985.A N GLY 998.A O no hydrogen 3.486 N/A ALA 987.A N ALA 996.A O no hydrogen 2.667 N/A HIS 989.A N ILE 994.A O no hydrogen 3.267 N/A HIS 989.A NE2 GLN 1040.A O no hydrogen 2.969 N/A ARG 990.A NH1 GLU 810.A OE1 no hydrogen 3.353 N/A ARG 990.A NH1 GLU 810.A OE2 no hydrogen 2.992 N/A ARG 990.A NH2 GLU 810.A OE1 no hydrogen 3.568 N/A HIS 991.A N HIS 989.A ND1 no hydrogen 3.250 N/A HIS 991.A ND1 PRO 1038.A O no hydrogen 3.130 N/A ALA 992.A N HIS 989.A ND1 no hydrogen 3.329 N/A ILE 995.A N PHE 1007.A O no hydrogen 2.884 N/A ALA 996.A N ALA 987.A O no hydrogen 2.709 N/A SER 997.A N LYS 1005.A O no hydrogen 2.906 N/A SER 997.A OG HIS 979.A NE2 no hydrogen 2.705 N/A SER 997.A OG LYS 1005.A O no hydrogen 3.437 N/A GLY 998.A N ALA 985.A O no hydrogen 2.724 N/A SER 999.A N LEU 1003.A O no hydrogen 2.892 N/A ALA 1000.A N SER 982.A O no hydrogen 2.897 N/A LYS 1001.A N SER 999.A OG no hydrogen 3.035 N/A ILE 1004.A N ILE 1017.A O no hydrogen 2.705 N/A LYS 1005.A N SER 997.A O no hydrogen 3.235 N/A LYS 1005.A NZ ALA 978.A O no hydrogen 2.800 N/A VAL 1006.A N GLY 1015.A O no hydrogen 2.789 N/A PHE 1007.A N ILE 995.A O no hydrogen 2.773 N/A SER 1008.A N GLU 1012.A O no hydrogen 2.771 N/A SER 1008.A OG GLU 1012.A OE2 no hydrogen 3.468 N/A GLN 1010.A N SER 1008.A OG no hydrogen 2.758 N/A GLY 1011.A N SER 1008.A O no hydrogen 3.238 N/A LEU 1014.A N VAL 1006.A O no hydrogen 2.949 N/A GLY 1015.A N VAL 1006.A O no hydrogen 3.278 N/A ILE 1017.A N ILE 1004.A O no hydrogen 2.711 N/A TYR 1019.A N GLN 1002.A O no hydrogen 3.036 N/A TYR 1019.A OH PHE 1051.A O no hydrogen 2.816 N/A SER 1022.A OG ASP 1049.A OD2 no hydrogen 3.336 N/A SER 1030.A OG SER 1032.A OG no hydrogen 2.700 N/A SER 1032.A N GLY 1046.A O no hydrogen 3.037 N/A SER 1032.A OG SER 1030.A O no hydrogen 2.631 N/A THR 1035.A N ALA 1044.A O no hydrogen 3.209 N/A THR 1035.A OG1 PHE 1036.A O no hydrogen 3.502 N/A HIS 1037.A N LEU 1042.A O no hydrogen 2.952 N/A TYR 1039.A N HIS 1037.A ND1 no hydrogen 3.280 N/A LEU 1042.A N GLN 1040.A O no hydrogen 2.981 N/A LEU 1043.A N TYR 1055.A O no hydrogen 3.098 N/A ALA 1045.A N SER 1053.A O no hydrogen 2.851 N/A GLY 1046.A N CYS 1033.A O no hydrogen 3.187 N/A SER 1050.A OG ASP 1049.A OD1 no hydrogen 3.515 N/A PHE 1051.A N TYR 1019.A OH no hydrogen 2.901 N/A VAL 1052.A N TRP 749.A O no hydrogen 2.879 N/A SER 1053.A N ALA 1045.A O no hydrogen 2.895 N/A SER 1053.A OG ALA 1045.A O no hydrogen 3.202 N/A SER 1053.A OG TYR 1055.A OH no hydrogen 2.908 N/A ILE 1054.A N ALA 747.A O no hydrogen 3.163 N/A TYR 1055.A N LEU 1043.A O no hydrogen 3.198 N/A TYR 1055.A OH SER 1053.A OG no hydrogen 2.908 N/A THR 1056.A OG1 VAL 1041.A O no hydrogen 3.423 N/A