Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kg2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 2.A OG THR 35.A OG1 no hydrogen 3.210 N/A ILE 3.A N ARG 33.A O no hydrogen 3.030 N/A ILE 5.A N THR 35.A O no hydrogen 3.037 N/A GLY 6.A N ALA 63.A O no hydrogen 2.939 N/A GLY 7.A N HIS 37.A O no hydrogen 3.124 N/A LEU 8.A N PHE 65.A O no hydrogen 2.849 N/A PHE 9.A N ASP 39.A O no hydrogen 3.364 N/A ALA 13.A N PRO 10.A O no hydrogen 2.978 N/A ASP 14.A N GLY 12.A O no hydrogen 2.844 N/A GLU 16.A N GLU 16.A OE1 no hydrogen 2.664 N/A TYR 17.A N ALA 13.A O no hydrogen 3.067 N/A SER 18.A N ASP 14.A O no hydrogen 2.820 N/A SER 18.A OG ASP 14.A O no hydrogen 2.964 N/A SER 18.A OG PRO 262.A O no hydrogen 3.073 N/A ALA 19.A N GLN 15.A O no hydrogen 2.874 N/A PHE 20.A N GLU 16.A O no hydrogen 2.926 N/A ARG 21.A N TYR 17.A O no hydrogen 2.810 N/A VAL 22.A N SER 18.A O no hydrogen 3.056 N/A GLY 23.A N ALA 19.A O no hydrogen 3.094 N/A MET 24.A N PHE 20.A O no hydrogen 3.258 N/A VAL 25.A N ARG 21.A O no hydrogen 3.172 N/A VAL 25.A N VAL 22.A O no hydrogen 3.206 N/A GLN 26.A N VAL 22.A O no hydrogen 2.918 N/A PHE 27.A N GLY 23.A O no hydrogen 2.995 N/A SER 28.A OG VAL 25.A O no hydrogen 2.957 N/A ARG 33.A N ASN 1.A O no hydrogen 2.927 N/A THR 35.A N ILE 3.A O no hydrogen 2.875 N/A THR 35.A OG1 SER 2.A OG no hydrogen 3.210 N/A HIS 37.A N ILE 5.A O no hydrogen 2.957 N/A ASP 39.A N GLY 7.A O no hydrogen 2.789 N/A ASN 45.A N GLU 42.A O no hydrogen 2.997 N/A SER 46.A OG LYS 71.A O no hydrogen 3.414 N/A PHE 47.A N ASN 45.A OD1 no hydrogen 3.014 N/A VAL 49.A N ASN 45.A O no hydrogen 3.187 N/A THR 50.A N SER 46.A O no hydrogen 3.061 N/A THR 50.A OG1 SER 46.A O no hydrogen 2.793 N/A ASN 51.A N PHE 47.A O no hydrogen 3.146 N/A ALA 52.A N ALA 48.A O no hydrogen 2.934 N/A PHE 53.A N VAL 49.A O no hydrogen 3.054 N/A CYS 54.A N THR 50.A O no hydrogen 3.021 N/A CYS 54.A SG THR 50.A O no hydrogen 3.170 N/A SER 55.A N ASN 51.A O no hydrogen 2.717 N/A GLN 56.A N ALA 52.A O no hydrogen 3.224 N/A PHE 57.A N PHE 53.A O no hydrogen 2.910 N/A SER 58.A N CYS 54.A O no hydrogen 2.896 N/A SER 58.A OG CYS 54.A O no hydrogen 3.003 N/A ARG 59.A N SER 55.A O no hydrogen 3.111 N/A GLY 60.A N PHE 57.A O no hydrogen 3.077 N/A TYR 62.A N GLN 4.A O no hydrogen 3.021 N/A ILE 64.A N SER 86.A O no hydrogen 2.903 N/A PHE 65.A N GLY 6.A O no hydrogen 2.842 N/A GLY 66.A N ILE 88.A O no hydrogen 3.063 N/A PHE 67.A N LEU 8.A O no hydrogen 3.264 N/A TYR 68.A N SER 91.A OG no hydrogen 3.362 N/A TYR 68.A OH PHE 92.A O no hydrogen 2.798 N/A ASP 69.A N SER 72.A OG no hydrogen 2.997 N/A SER 72.A OG VAL 43.A O no hydrogen 2.807 N/A VAL 73.A N ASP 69.A O no hydrogen 2.899 N/A THR 75.A N SER 72.A O no hydrogen 3.023 N/A ILE 76.A N SER 72.A O no hydrogen 3.323 N/A THR 77.A N VAL 73.A O no hydrogen 3.077 N/A THR 77.A OG1 VAL 73.A O no hydrogen 3.277 N/A THR 77.A OG1 ASN 74.A O no hydrogen 3.114 N/A SER 78.A N ASN 74.A O no hydrogen 3.098 N/A PHE 79.A N THR 75.A O no hydrogen 3.019 N/A CYS 80.A N ILE 76.A O no hydrogen 2.913 N/A CYS 80.A SG ILE 76.A O no hydrogen 3.248 N/A GLY 81.A N SER 78.A O no hydrogen 3.147 N/A THR 82.A N SER 78.A O no hydrogen 2.967 N/A THR 82.A OG1 SER 78.A O no hydrogen 3.196 N/A LEU 83.A N PHE 79.A O no hydrogen 2.769 N/A PHE 87.A N PHE 100.A O no hydrogen 3.106 N/A ILE 88.A N ILE 64.A O no hydrogen 2.784 N/A THR 89.A N ILE 102.A O no hydrogen 2.821 N/A THR 89.A OG1 GLY 66.A O no hydrogen 2.806 N/A SER 91.A N THR 89.A OG1 no hydrogen 3.087 N/A SER 91.A OG THR 89.A OG1 no hydrogen 3.343 N/A THR 94.A N GLN 103.A OE1 no hydrogen 2.983 N/A THR 94.A OG1 HIS 98.A ND1 no hydrogen 3.324 N/A THR 94.A OG1 GLN 103.A OE1 no hydrogen 2.703 N/A GLY 96.A N THR 94.A O no hydrogen 2.878 N/A THR 97.A OG1 THR 97.A O no hydrogen 2.589 N/A HIS 98.A ND1 THR 94.A OG1 no hydrogen 3.324 N/A PHE 100.A N GLU 321.A OE1 no hydrogen 3.351 N/A ILE 102.A N PHE 87.A O no hydrogen 2.743 N/A GLN 103.A N GLY 342.A O no hydrogen 3.435 N/A MET 104.A N THR 89.A O no hydrogen 2.849 N/A LYS 109.A N ASP 107.A OD1 no hydrogen 3.270 N/A LEU 112.A N LEU 108.A O no hydrogen 2.942 N/A LEU 113.A N LYS 109.A O no hydrogen 3.314 N/A SER 114.A N GLY 110.A O no hydrogen 3.165 N/A SER 114.A OG GLY 110.A O no hydrogen 3.134 N/A LEU 115.A N ALA 111.A O no hydrogen 3.176 N/A ILE 116.A N LEU 112.A O no hydrogen 3.072 N/A GLU 117.A N LEU 113.A O no hydrogen 3.391 N/A TYR 118.A N SER 114.A O no hydrogen 3.108 N/A TYR 119.A N LEU 115.A O no hydrogen 3.162 N/A TYR 119.A OH GLU 353.A OE1 no hydrogen 2.740 N/A GLN 120.A N GLU 117.A O no hydrogen 2.936 N/A TRP 121.A N ILE 116.A O no hydrogen 3.104 N/A ALA 125.A N ARG 182.A O no hydrogen 2.827 N/A TYR 126.A N THR 152.A O no hydrogen 3.048 N/A LEU 127.A N ILE 184.A O no hydrogen 3.019 N/A TYR 128.A N ILE 154.A O no hydrogen 3.173 N/A ARG 132.A NH2 ASP 186.A O no hydrogen 2.792 N/A ARG 132.A NH2 ASP 186.A OD1 no hydrogen 2.901 N/A SER 135.A OG ASP 95.A OD1 no hydrogen 3.352 N/A THR 136.A OG1 TYR 126.A OH no hydrogen 2.972 N/A THR 136.A OG1 ASP 186.A OD2 no hydrogen 2.695 N/A GLN 138.A N LEU 134.A O no hydrogen 2.980 N/A ALA 139.A N SER 135.A O no hydrogen 3.330 N/A VAL 140.A N THR 136.A O no hydrogen 3.130 N/A LEU 141.A N LEU 137.A O no hydrogen 3.019 N/A ASP 142.A N GLN 138.A O no hydrogen 2.846 N/A SER 143.A N ALA 139.A O no hydrogen 3.074 N/A SER 143.A OG ALA 139.A O no hydrogen 2.981 N/A ALA 144.A N VAL 140.A O no hydrogen 2.893 N/A ALA 144.A N LEU 141.A O no hydrogen 3.191 N/A ALA 145.A N ASP 142.A O no hydrogen 3.236 N/A LYS 147.A N SER 143.A O no hydrogen 2.783 N/A TRP 149.A N ALA 144.A O no hydrogen 2.816 N/A GLN 150.A N ASP 122.A O no hydrogen 2.851 N/A THR 152.A N PHE 124.A O no hydrogen 3.086 N/A THR 152.A OG1 GLU 180.A OE2 no hydrogen 3.496 N/A ILE 154.A N TYR 126.A O no hydrogen 3.082 N/A ASN 155.A ND2 ASN 158.A OD1 no hydrogen 3.591 N/A VAL 156.A N TYR 128.A O no hydrogen 2.993 N/A GLY 157.A N ASN 155.A OD1 no hydrogen 3.013 N/A ASP 165.A N LYS 163.A O no hydrogen 2.999 N/A ARG 169.A N ASP 165.A O no hydrogen 3.069 N/A LEU 171.A N TYR 168.A O no hydrogen 3.009 N/A PHE 172.A N TYR 168.A O no hydrogen 3.020 N/A LEU 175.A N LEU 171.A O no hydrogen 3.300 N/A LYS 179.A N GLU 176.A O no hydrogen 3.087 N/A GLU 180.A N LEU 175.A O no hydrogen 2.958 N/A ARG 181.A NH1 GLU 176.A OE2 no hydrogen 3.215 N/A ARG 181.A NH1 GLU 180.A O no hydrogen 3.241 N/A ARG 181.A NH2 GLU 176.A OE1 no hydrogen 3.231 N/A VAL 183.A N HIS 210.A O no hydrogen 2.922 N/A ILE 184.A N ALA 125.A O no hydrogen 2.777 N/A LEU 185.A N ILE 212.A O no hydrogen 2.797 N/A ASP 186.A N LEU 127.A O no hydrogen 2.884 N/A CYS 187.A SG LEU 127.A O no hydrogen 4.030 N/A VAL 192.A N GLU 188.A O no hydrogen 3.083 N/A ASP 194.A N ASP 190.A O no hydrogen 3.250 N/A ILE 195.A N LYS 191.A O no hydrogen 3.290 N/A VAL 196.A N VAL 192.A O no hydrogen 2.778 N/A ASP 197.A N ASN 193.A O no hydrogen 2.893 N/A GLN 198.A N ASP 194.A O no hydrogen 3.099 N/A GLN 198.A NE2 ASP 165.A OD1 no hydrogen 3.272 N/A VAL 199.A N ILE 195.A O no hydrogen 2.764 N/A ILE 200.A N VAL 196.A O no hydrogen 3.101 N/A THR 201.A N ASP 197.A O no hydrogen 3.092 N/A THR 201.A OG1 ASP 197.A O no hydrogen 2.990 N/A ILE 202.A N GLN 198.A O no hydrogen 3.039 N/A GLY 203.A N ILE 200.A O no hydrogen 3.104 N/A LYS 204.A N VAL 199.A O no hydrogen 2.850 N/A LYS 204.A NZ GLU 176.A OE2 no hydrogen 3.201 N/A LYS 204.A NZ TYR 209.A OH no hydrogen 3.021 N/A LYS 207.A NZ ASP 464.A OD1 no hydrogen 2.611 N/A LYS 207.A NZ ASP 464.A OD2 no hydrogen 2.619 N/A TYR 209.A N VAL 206.A O no hydrogen 3.374 N/A HIS 210.A N ARG 181.A O no hydrogen 2.809 N/A TYR 211.A N GLU 232.A O no hydrogen 2.915 N/A TYR 211.A OH LYS 204.A O no hydrogen 2.661 N/A ILE 212.A N VAL 183.A O no hydrogen 2.971 N/A ILE 213.A N SER 234.A O no hydrogen 2.859 N/A ALA 214.A N LEU 185.A O no hydrogen 2.727 N/A ASN 215.A N ILE 213.A O no hydrogen 2.908 N/A ASN 215.A ND2 GLY 217.A O no hydrogen 3.648 N/A PHE 218.A N PHE 236.A O no hydrogen 2.989 N/A THR 219.A N GLN 237.A OE1 no hydrogen 3.096 N/A LEU 224.A N ASP 222.A OD1 no hydrogen 3.077 N/A LYS 225.A NZ ASP 197.A OD1 no hydrogen 3.062 N/A GLN 227.A NE2 LYS 355.A O no hydrogen 3.416 N/A GLN 227.A NE2 THR 356.A O no hydrogen 2.746 N/A ALA 231.A N HIS 205.A O no hydrogen 2.923 N/A GLU 232.A N TYR 209.A O no hydrogen 3.095 N/A SER 234.A N TYR 211.A O no hydrogen 2.825 N/A SER 234.A OG TYR 119.A OH no hydrogen 2.708 N/A GLY 235.A N MET 352.A O no hydrogen 2.980 N/A GLN 237.A N ASN 350.A O no hydrogen 2.858 N/A GLN 237.A NE2 VAL 239.A O no hydrogen 3.264 N/A ILE 238.A N LEU 216.A O no hydrogen 3.232 N/A ASP 242.A N ASP 240.A OD2 no hydrogen 3.003 N/A ASP 243.A N ASP 240.A O no hydrogen 3.312 N/A SER 247.A N ASP 243.A O no hydrogen 2.705 N/A LYS 248.A N SER 244.A O no hydrogen 3.047 N/A PHE 249.A N LEU 245.A O no hydrogen 3.246 N/A ILE 250.A N VAL 246.A O no hydrogen 3.000 N/A GLU 251.A N SER 247.A O no hydrogen 3.237 N/A ARG 252.A N PHE 249.A O no hydrogen 3.183 N/A TRP 253.A N PHE 249.A O no hydrogen 2.812 N/A SER 254.A N ILE 250.A O no hydrogen 2.753 N/A SER 254.A OG ILE 250.A O no hydrogen 2.813 N/A THR 255.A OG1 ARG 252.A O no hydrogen 2.850 N/A LEU 256.A N TRP 253.A O no hydrogen 3.188 N/A TYR 261.A N GLU 257.A O no hydrogen 2.927 N/A HIS 265.A ND1 LEU 256.A O no hydrogen 2.883 N/A THR 266.A OG1 THR 268.A O no hydrogen 2.853 N/A ILE 269.A N TYR 241.A OH no hydrogen 2.880 N/A TYR 271.A N ASP 220.A OD1 no hydrogen 2.859 N/A THR 272.A OG1 GLU 16.A OE2 no hydrogen 2.795 N/A ALA 274.A N LYS 270.A O no hydrogen 2.925 N/A LEU 275.A N TYR 271.A O no hydrogen 3.005 N/A THR 276.A N THR 272.A O no hydrogen 3.232 N/A THR 276.A OG1 THR 272.A O no hydrogen 2.974 N/A TYR 277.A N SER 273.A O no hydrogen 3.109 N/A ASP 278.A N ALA 274.A O no hydrogen 3.100 N/A ALA 279.A N LEU 275.A O no hydrogen 2.757 N/A ALA 279.A N THR 276.A O no hydrogen 3.095 N/A VAL 280.A N THR 276.A O no hydrogen 3.254 N/A GLN 281.A NE2 GLU 330.A O no hydrogen 3.192 N/A VAL 282.A N ASP 278.A O no hydrogen 3.154 N/A MET 283.A N ALA 279.A O no hydrogen 3.011 N/A THR 284.A N VAL 280.A O no hydrogen 2.974 N/A THR 284.A OG1 VAL 280.A O no hydrogen 2.991 N/A GLU 285.A N GLN 281.A O no hydrogen 3.038 N/A ALA 286.A N VAL 282.A O no hydrogen 3.009 N/A PHE 287.A N MET 283.A O no hydrogen 3.127 N/A ARG 288.A N THR 284.A O no hydrogen 2.955 N/A ASN 289.A N GLU 285.A O no hydrogen 3.058 N/A LYS 292.A N ARG 288.A O no hydrogen 3.188 N/A ARG 294.A N ARG 291.A O no hydrogen 3.260 N/A ILE 295.A N LEU 290.A O no hydrogen 3.076 N/A CYS 306.A SG ASP 305.A OD2 no hydrogen 3.894 N/A ALA 308.A N ASP 305.A O no hydrogen 3.037 N/A GLY 317.A N TRP 314.A O no hydrogen 2.900 N/A VAL 318.A N GLY 315.A O no hydrogen 3.176 N/A GLU 321.A N GLY 317.A O no hydrogen 3.184 N/A ARG 322.A N VAL 318.A O no hydrogen 3.341 N/A LEU 324.A N ILE 320.A O no hydrogen 3.238 N/A LYS 325.A N GLU 321.A O no hydrogen 3.006 N/A GLN 326.A N ALA 323.A O no hydrogen 3.046 N/A VAL 327.A N LEU 324.A O no hydrogen 3.194 N/A GLY 331.A N GLY 334.A O no hydrogen 3.345 N/A LEU 332.A N ASP 278.A OD1 no hydrogen 2.848 N/A SER 333.A N ASP 278.A OD2 no hydrogen 2.888 N/A SER 333.A OG ASP 278.A OD2 no hydrogen 2.939 N/A ILE 336.A N VAL 329.A O no hydrogen 3.098 N/A ASP 339.A N LYS 343.A O no hydrogen 3.355 N/A ASN 341.A N ASP 339.A OD1 no hydrogen 3.264 N/A GLY 342.A N ASP 339.A OD1 no hydrogen 2.826 N/A ARG 344.A NH1 MET 104.A O no hydrogen 3.204 N/A ARG 344.A NH1 SER 333.A OG no hydrogen 2.810 N/A ARG 344.A NH2 SER 333.A O no hydrogen 3.095 N/A ARG 344.A NH2 ASN 335.A O no hydrogen 2.763 N/A ILE 345.A N LYS 337.A O no hydrogen 2.975 N/A ASN 346.A N GLU 367.A OE1 no hydrogen 2.872 N/A TYR 347.A OH ASP 107.A O no hydrogen 3.006 N/A ILE 349.A N TRP 365.A O no hydrogen 3.198 N/A ASN 350.A N GLN 237.A O no hydrogen 2.989 N/A ILE 351.A N GLY 363.A O no hydrogen 2.757 N/A MET 352.A N GLY 235.A O no hydrogen 3.019 N/A GLU 353.A N ARG 360.A O no hydrogen 3.070 N/A LEU 354.A N VAL 233.A O no hydrogen 2.881 N/A LYS 355.A N GLY 358.A O no hydrogen 3.189 N/A GLY 358.A N LYS 355.A O no hydrogen 3.352 N/A ARG 360.A N GLU 353.A O no hydrogen 2.911 N/A ILE 362.A N ILE 351.A O no hydrogen 3.019 N/A TYR 364.A N VAL 372.A O no hydrogen 3.004 N/A TRP 365.A N ILE 349.A O no hydrogen 2.792 N/A TRP 365.A NE1 SER 114.A OG no hydrogen 2.811 N/A SER 366.A N LYS 370.A O no hydrogen 2.831 N/A ASP 369.A N SER 366.A O no hydrogen 3.300 N/A VAL 372.A N TYR 364.A O no hydrogen 2.935 N/A THR 374.A N ILE 362.A O no hydrogen 2.923 N/A VAL 386.A N LYS 430.A O no hydrogen 2.768 N/A VAL 387.A N ASP 464.A OD2 no hydrogen 3.354 N/A VAL 388.A N LYS 432.A O no hydrogen 3.289 N/A THR 389.A N ILE 465.A O no hydrogen 2.924 N/A THR 389.A OG1 GLU 457.A OE1 no hydrogen 3.350 N/A THR 390.A N THR 434.A O no hydrogen 2.978 N/A THR 390.A OG1 ILE 391.A O no hydrogen 3.564 N/A THR 390.A OG1 ILE 467.A O no hydrogen 3.062 N/A TYR 396.A N GLU 393.A O no hydrogen 2.723 N/A VAL 397.A N GLU 393.A O no hydrogen 3.036 N/A MET 398.A N GLU 413.A O no hydrogen 2.822 N/A LYS 400.A N ARG 411.A O no hydrogen 2.869 N/A HIS 403.A N LYS 400.A O no hydrogen 3.245 N/A ALA 405.A N ASN 402.A O no hydrogen 3.152 N/A LEU 406.A N HIS 403.A O no hydrogen 3.255 N/A ASN 409.A ND2 TYR 431.A O no hydrogen 2.934 N/A ARG 411.A NE GLY 408.A O no hydrogen 2.860 N/A TYR 412.A N ASN 409.A O no hydrogen 3.308 N/A GLU 413.A N MET 398.A O no hydrogen 2.955 N/A TYR 415.A N PRO 395.A O no hydrogen 2.986 N/A TYR 415.A OH PHE 486.A O no hydrogen 3.420 N/A CYS 416.A N TYR 396.A O no hydrogen 2.975 N/A ASP 418.A N GLY 414.A O no hydrogen 3.041 N/A LEU 419.A N TYR 415.A O no hydrogen 2.864 N/A ALA 420.A N CYS 416.A O no hydrogen 2.773 N/A ALA 421.A N VAL 417.A O no hydrogen 3.491 N/A GLU 422.A N ASP 418.A O no hydrogen 3.085 N/A ILE 423.A N LEU 419.A O no hydrogen 3.000 N/A ALA 424.A N ALA 420.A O no hydrogen 2.863 N/A LYS 425.A N ALA 421.A O no hydrogen 3.000 N/A LYS 425.A N GLU 422.A O no hydrogen 3.160 N/A HIS 426.A N GLU 422.A O no hydrogen 3.163 N/A CYS 427.A N ILE 423.A O no hydrogen 2.955 N/A CYS 427.A SG ILE 423.A O no hydrogen 3.387 N/A PHE 429.A N ALA 424.A O no hydrogen 3.145 N/A LYS 432.A N VAL 386.A O no hydrogen 2.871 N/A LEU 433.A N ASN 409.A OD1 no hydrogen 3.001 N/A THR 434.A N VAL 388.A O no hydrogen 2.869 N/A THR 434.A OG1 VAL 388.A O no hydrogen 3.107 N/A VAL 436.A N THR 390.A O no hydrogen 3.119 N/A GLY 437.A N GLU 457.A OE2 no hydrogen 3.219 N/A LYS 440.A N ASP 438.A OD2 no hydrogen 3.265 N/A ALA 443.A N ASN 452.A OD1 no hydrogen 2.813 N/A ASP 445.A N ILE 450.A O no hydrogen 3.293 N/A ASP 447.A N ASP 445.A OD1 no hydrogen 3.144 N/A LYS 449.A N ASP 445.A O no hydrogen 2.759 N/A TRP 451.A N TYR 460.A OH no hydrogen 2.858 N/A ASN 452.A N ALA 443.A O no hydrogen 3.221 N/A GLY 453.A N ASP 438.A OD1 no hydrogen 2.891 N/A MET 454.A N LYS 440.A O no hydrogen 3.387 N/A VAL 455.A N TYR 441.A O no hydrogen 3.167 N/A GLU 457.A N GLY 453.A O no hydrogen 3.068 N/A LEU 458.A N MET 454.A O no hydrogen 3.061 N/A VAL 459.A N VAL 455.A O no hydrogen 3.301 N/A TYR 460.A N GLY 456.A O no hydrogen 3.058 N/A GLY 461.A N LEU 458.A O no hydrogen 3.408 N/A ALA 463.A N GLU 457.A O no hydrogen 2.856 N/A ASP 464.A N VAL 387.A O no hydrogen 2.932 N/A ILE 465.A N VAL 387.A O no hydrogen 3.283 N/A ALA 466.A N ALA 697.A O no hydrogen 2.729 N/A ILE 467.A N THR 389.A O no hydrogen 3.195 N/A LEU 470.A N ALA 468.A O no hydrogen 2.616 N/A ILE 472.A N GLY 693.A O no hydrogen 3.090 N/A ARG 476.A N THR 473.A O no hydrogen 3.132 N/A ARG 476.A NE GLY 442.A O no hydrogen 2.808 N/A ARG 476.A NH1 THR 471.A O no hydrogen 2.895 N/A ARG 476.A NH2 GLY 442.A O no hydrogen 2.869 N/A GLU 477.A N THR 473.A O no hydrogen 2.903 N/A VAL 479.A N ARG 476.A O no hydrogen 2.981 N/A ILE 480.A N ARG 476.A O no hydrogen 2.891 N/A ASP 481.A N THR 698.A O no hydrogen 2.898 N/A PHE 482.A N GLU 477.A OE1 no hydrogen 3.178 N/A SER 483.A N ILE 696.A O no hydrogen 3.080 N/A SER 483.A OG LYS 484.A O no hydrogen 3.391 N/A SER 483.A OG ILE 696.A O no hydrogen 3.405 N/A LYS 484.A N ASN 709.A OD1 no hydrogen 3.097 N/A PHE 486.A N TYR 694.A O no hydrogen 3.030 N/A LEU 489.A N LYS 692.A O no hydrogen 3.447 N/A ILE 491.A N ASP 690.A OD1 no hydrogen 2.895 N/A SER 492.A N LEU 666.A O no hydrogen 2.801 N/A SER 492.A OG LEU 666.A O no hydrogen 3.158 N/A MET 494.A N TYR 664.A O no hydrogen 2.901 N/A ILE 495.A N MET 683.A O no hydrogen 3.286 N/A LYS 497.A N ASP 681.A O no hydrogen 2.778 N/A SER 507.A N GLY 504.A O no hydrogen 3.073 N/A SER 507.A OG GLY 504.A O no hydrogen 3.316 N/A PHE 508.A N VAL 505.A O no hydrogen 3.149 N/A ILE 516.A N ALA 513.A O no hydrogen 2.884 N/A TRP 517.A N ALA 513.A O no hydrogen 2.951 N/A MET 518.A N TYR 514.A O no hydrogen 3.153 N/A CYS 519.A N GLU 515.A O no hydrogen 3.206 N/A CYS 519.A SG GLU 515.A O no hydrogen 3.572 N/A ILE 520.A N ILE 516.A O no hydrogen 2.984 N/A VAL 521.A N MET 518.A O no hydrogen 2.845 N/A PHE 522.A N MET 518.A O no hydrogen 2.851 N/A ALA 523.A N CYS 519.A O no hydrogen 2.814 N/A ILE 525.A N VAL 521.A O no hydrogen 3.060 N/A VAL 527.A N TYR 524.A O no hydrogen 3.309 N/A SER 528.A N TYR 524.A O no hydrogen 3.251 N/A SER 528.A OG TYR 524.A O no hydrogen 3.533 N/A SER 528.A OG ILE 525.A O no hydrogen 3.150 N/A VAL 529.A N ILE 525.A O no hydrogen 3.134 N/A LEU 531.A N VAL 527.A O no hydrogen 2.895 N/A LEU 533.A N VAL 530.A O no hydrogen 3.219 N/A VAL 534.A N LEU 531.A O no hydrogen 2.964 N/A SER 535.A OG PHE 532.A O no hydrogen 3.526 N/A GLY 540.A N ASN 537.A O no hydrogen 3.343 N/A ILE 541.A N GLU 538.A O no hydrogen 2.910 N/A PHE 542.A N GLU 538.A O no hydrogen 2.925 N/A SER 544.A N GLY 540.A O no hydrogen 2.994 N/A LEU 545.A N ILE 541.A O no hydrogen 3.003 N/A TRP 546.A N ASN 543.A O no hydrogen 2.915 N/A PHE 547.A N ASN 543.A O no hydrogen 2.778 N/A SER 548.A N SER 544.A O no hydrogen 3.189 N/A LEU 549.A N TRP 546.A O no hydrogen 3.159 N/A GLY 550.A N TRP 546.A O no hydrogen 2.868 N/A PHE 552.A N SER 548.A O no hydrogen 2.849 N/A ARG 561.A N SER 557.A O no hydrogen 2.813 N/A ARG 561.A N LEU 558.A O no hydrogen 3.237 N/A ILE 562.A N LEU 558.A O no hydrogen 3.247 N/A GLY 564.A N GLY 560.A O no hydrogen 3.228 N/A GLY 565.A N ARG 561.A O no hydrogen 3.173 N/A VAL 566.A N ILE 562.A O no hydrogen 2.821 N/A TRP 567.A N VAL 563.A O no hydrogen 2.905 N/A TRP 568.A N GLY 564.A O no hydrogen 3.091 N/A PHE 569.A N GLY 565.A O no hydrogen 2.954 N/A PHE 570.A N VAL 566.A O no hydrogen 2.849 N/A THR 571.A N TRP 567.A O no hydrogen 3.002 N/A LEU 572.A N TRP 568.A O no hydrogen 2.898 N/A ILE 573.A N PHE 569.A O no hydrogen 3.238 N/A ILE 574.A N PHE 570.A O no hydrogen 3.221 N/A ILE 575.A N THR 571.A O no hydrogen 2.964 N/A SER 576.A N LEU 572.A O no hydrogen 3.045 N/A SER 576.A OG LEU 572.A O no hydrogen 2.734 N/A SER 577.A N ILE 573.A O no hydrogen 2.810 N/A SER 577.A OG ILE 573.A O no hydrogen 3.006 N/A TYR 578.A N ILE 574.A O no hydrogen 2.794 N/A THR 579.A N ILE 575.A O no hydrogen 3.066 N/A THR 579.A OG1 ILE 575.A O no hydrogen 2.825 N/A ALA 580.A N SER 576.A O no hydrogen 2.936 N/A ASN 581.A N SER 577.A O no hydrogen 2.836 N/A LEU 582.A N TYR 578.A O no hydrogen 2.917 N/A ALA 583.A N THR 579.A O no hydrogen 3.120 N/A ALA 583.A N ALA 580.A O no hydrogen 3.068 N/A ALA 584.A N ALA 580.A O no hydrogen 3.318 N/A ALA 584.A N ASN 581.A O no hydrogen 3.219 N/A PHE 585.A N ASN 581.A O no hydrogen 3.442 N/A LEU 586.A N ALA 583.A O no hydrogen 3.126 N/A THR 587.A N ALA 583.A O no hydrogen 2.693 N/A THR 587.A OG1 ALA 583.A O no hydrogen 2.726 N/A VAL 588.A N ALA 584.A O no hydrogen 2.960 N/A ARG 590.A N LEU 586.A O no hydrogen 3.234 N/A ARG 590.A N THR 587.A O no hydrogen 3.195 N/A MET 591.A N THR 587.A O no hydrogen 3.017 N/A VAL 592.A N VAL 588.A O no hydrogen 3.179 N/A GLU 596.A N ASP 600.A OD1 no hydrogen 3.162 N/A SER 597.A N ASP 600.A OD1 no hydrogen 3.400 N/A SER 597.A OG ASP 600.A OD2 no hydrogen 3.381 N/A ASP 600.A N SER 597.A O no hydrogen 3.362 N/A LEU 601.A N ALA 598.A O no hydrogen 2.986 N/A SER 602.A OG GLU 599.A O no hydrogen 2.772 N/A LYS 603.A N GLU 599.A O no hydrogen 3.140 N/A GLN 604.A NE2 ILE 607.A O no hydrogen 2.929 N/A ILE 607.A N GLN 604.A OE1 no hydrogen 2.727 N/A ALA 608.A N LYS 661.A O no hydrogen 2.817 N/A TYR 609.A OH LEU 601.A O no hydrogen 3.397 N/A GLY 610.A N ALA 663.A O no hydrogen 3.201 N/A THR 611.A OG1 LEU 612.A O no hydrogen 3.352 N/A ASP 613.A N VAL 645.A O no hydrogen 3.062 N/A SER 614.A OG ASP 613.A OD1 no hydrogen 3.235 N/A GLU 619.A N GLY 615.A O no hydrogen 3.063 N/A PHE 620.A N THR 617.A O no hydrogen 3.336 N/A ARG 622.A N LYS 618.A O no hydrogen 3.326 N/A ARG 623.A N GLU 619.A O no hydrogen 3.179 N/A SER 624.A N PHE 621.A O no hydrogen 3.332 N/A ASP 630.A N ILE 626.A O no hydrogen 2.892 N/A ASP 630.A N ALA 627.A O no hydrogen 3.187 N/A LYS 631.A N ALA 627.A O no hydrogen 3.449 N/A MET 632.A N VAL 628.A O no hydrogen 3.222 N/A TRP 633.A N PHE 629.A O no hydrogen 3.098 N/A THR 634.A N ASP 630.A O no hydrogen 3.009 N/A THR 634.A OG1 ASP 630.A O no hydrogen 3.179 N/A THR 634.A OG1 ASP 630.A OD1 no hydrogen 3.421 N/A TYR 635.A N LYS 631.A O no hydrogen 3.028 N/A MET 636.A N MET 632.A O no hydrogen 3.015 N/A ARG 637.A N TRP 633.A O no hydrogen 2.733 N/A SER 638.A N TYR 635.A O no hydrogen 3.250 N/A SER 638.A OG THR 634.A O no hydrogen 3.375 N/A SER 642.A OG PHE 644.A O no hydrogen 3.464 N/A PHE 644.A N SER 642.A OG no hydrogen 3.383 N/A VAL 645.A N THR 611.A O no hydrogen 3.326 N/A GLY 651.A N THR 647.A O no hydrogen 3.291 N/A VAL 652.A N THR 648.A O no hydrogen 3.117 N/A ALA 653.A N ALA 649.A O no hydrogen 2.998 N/A ARG 654.A N GLU 650.A O no hydrogen 2.948 N/A VAL 655.A N GLY 651.A O no hydrogen 3.175 N/A VAL 655.A N VAL 652.A O no hydrogen 3.132 N/A ARG 656.A N VAL 652.A O no hydrogen 3.030 N/A SER 658.A OG ARG 654.A O no hydrogen 2.660 N/A LYS 661.A N SER 658.A O no hydrogen 3.020 N/A TYR 662.A OH VAL 643.A O no hydrogen 2.798 N/A ALA 663.A N ALA 608.A O no hydrogen 2.816 N/A TYR 664.A N MET 494.A O no hydrogen 3.031 N/A LEU 665.A N GLY 610.A O no hydrogen 3.036 N/A LEU 666.A N SER 492.A O no hydrogen 3.265 N/A SER 668.A N GLY 490.A O no hydrogen 2.819 N/A SER 668.A OG GLY 490.A O no hydrogen 3.528 N/A THR 669.A OG1 TYR 694.A OH no hydrogen 3.152 N/A ASN 671.A N GLU 667.A O no hydrogen 2.982 N/A ASN 671.A ND2 SER 492.A OG no hydrogen 2.983 N/A ASN 671.A ND2 ILE 493.A O no hydrogen 3.350 N/A GLU 672.A N SER 668.A O no hydrogen 2.767 N/A TYR 673.A N THR 669.A O no hydrogen 3.348 N/A ILE 674.A N MET 670.A O no hydrogen 3.056 N/A GLU 675.A N ASN 671.A O no hydrogen 3.043 N/A GLN 676.A N TYR 673.A O no hydrogen 2.946 N/A ARG 677.A N ILE 674.A O no hydrogen 2.997 N/A LYS 678.A N GLU 734.A OE1 no hydrogen 3.448 N/A CYS 680.A N ARG 677.A O no hydrogen 2.862 N/A CYS 680.A SG ARG 677.A O no hydrogen 3.985 N/A CYS 680.A SG GLU 734.A O no hydrogen 4.004 N/A MET 683.A N ILE 495.A O no hydrogen 3.157 N/A LYS 684.A N GLU 675.A OE1 no hydrogen 3.118 N/A VAL 685.A N ILE 493.A O no hydrogen 3.180 N/A LEU 689.A N ILE 491.A O no hydrogen 2.763 N/A LYS 692.A N LEU 489.A O no hydrogen 2.830 N/A TYR 694.A N MET 487.A O no hydrogen 3.140 N/A TYR 694.A OH THR 669.A OG1 no hydrogen 3.152 N/A GLY 695.A N LEU 470.A O no hydrogen 3.165 N/A ILE 696.A N SER 483.A OG no hydrogen 2.986 N/A ALA 697.A N ALA 466.A O no hydrogen 2.988 N/A THR 698.A N ASP 481.A O no hydrogen 2.888 N/A GLY 701.A N ASP 481.A OD2 no hydrogen 3.476 N/A SER 702.A OG THR 698.A OG1 no hydrogen 3.356 N/A LEU 704.A N SER 702.A OG no hydrogen 3.351 N/A VAL 708.A N LEU 704.A O no hydrogen 3.009 N/A ASN 709.A N GLY 705.A O no hydrogen 3.152 N/A LEU 710.A N THR 706.A O no hydrogen 3.064 N/A ALA 711.A N PRO 707.A O no hydrogen 2.943 N/A VAL 712.A N VAL 708.A O no hydrogen 2.949 N/A LEU 713.A N ASN 709.A O no hydrogen 3.309 N/A LYS 714.A N LEU 710.A O no hydrogen 2.827 N/A LEU 715.A N ALA 711.A O no hydrogen 2.900 N/A SER 716.A N VAL 712.A O no hydrogen 3.083 N/A SER 716.A OG LEU 713.A O no hydrogen 2.847 N/A GLU 717.A N LEU 713.A O no hydrogen 3.154 N/A GLN 718.A N LYS 714.A O no hydrogen 3.077 N/A GLY 719.A N SER 716.A O no hydrogen 2.981 N/A LEU 720.A N LEU 715.A O no hydrogen 2.855 N/A LEU 721.A N LEU 715.A O no hydrogen 3.442 N/A LYS 723.A N GLY 719.A O no hydrogen 2.991 N/A LEU 724.A N LEU 720.A O no hydrogen 2.952 N/A LYS 725.A N LEU 721.A O no hydrogen 3.095 N/A LYS 725.A NZ GLU 672.A OE2 no hydrogen 3.096 N/A ASN 726.A N ASP 722.A O no hydrogen 3.078 N/A LYS 727.A N LYS 723.A O no hydrogen 2.981 N/A LYS 727.A NZ ASP 418.A OD1 no hydrogen 2.944 N/A TRP 728.A N LEU 724.A O no hydrogen 3.181 N/A TRP 728.A N LYS 725.A O no hydrogen 3.164 N/A TRP 729.A N LYS 725.A O no hydrogen 2.790 N/A TRP 729.A NE1 THR 669.A O no hydrogen 3.073 N/A TYR 730.A N ASN 726.A O no hydrogen 3.281 N/A ASP 731.A N ASN 726.A O no hydrogen 2.717 N/A LYS 732.A N LYS 727.A O no hydrogen 2.983 N/A GLY 733.A N TYR 730.A O no hydrogen 3.062 N/A GLU 734.A N GLN 676.A O no hydrogen 3.058 N/A CYS 735.A SG GLU 675.A O no hydrogen 3.712 N/A GLY 741.A N ALA 737.A O no hydrogen 3.309 N/A SER 750.A OG SER 752.A OG no hydrogen 3.245 N/A SER 752.A N SER 750.A OG no hydrogen 3.286 N/A SER 752.A OG SER 750.A OG no hydrogen 3.245 N/A ALA 755.A N LEU 751.A O no hydrogen 2.733 N/A ALA 755.A N SER 752.A O no hydrogen 3.027 N/A GLY 756.A N SER 752.A O no hydrogen 3.443 N/A GLY 756.A N ASN 753.A O no hydrogen 3.223 N/A VAL 757.A N VAL 754.A O no hydrogen 3.164 N/A PHE 758.A N ALA 755.A O no hydrogen 2.793 N/A TYR 759.A N ALA 755.A O no hydrogen 3.154 N/A LEU 761.A N PHE 758.A O no hydrogen 3.157 N/A VAL 762.A N PHE 758.A O no hydrogen 3.062 N/A GLY 763.A N TYR 759.A O no hydrogen 2.968 N/A GLY 764.A N ILE 760.A O no hydrogen 3.194 N/A LEU 765.A N LEU 761.A O no hydrogen 2.882 N/A GLY 766.A N VAL 762.A O no hydrogen 2.870 N/A LEU 767.A N GLY 763.A O no hydrogen 2.996 N/A ALA 768.A N GLY 764.A O no hydrogen 3.028 N/A MET 769.A N LEU 765.A O no hydrogen 2.860 N/A LEU 770.A N GLY 766.A O no hydrogen 3.017 N/A LEU 770.A N LEU 767.A O no hydrogen 3.262 N/A VAL 771.A N LEU 767.A O no hydrogen 2.975 N/A ALA 772.A N ALA 768.A O no hydrogen 2.771 N/A ILE 774.A N LEU 770.A O no hydrogen 3.373 N/A GLU 775.A N VAL 771.A O no hydrogen 3.313 N/A PHE 776.A N ALA 772.A O no hydrogen 3.238 N/A CYS 777.A N LEU 773.A O no hydrogen 3.155 N/A CYS 777.A SG LEU 773.A O no hydrogen 3.185 N/A TYR 778.A N ILE 774.A O no hydrogen 3.005 N/A LYS 779.A N GLU 775.A O no hydrogen 3.181 N/A