Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8j8c_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ ASP 28.A OD1 no hydrogen 3.308 N/A TYR 6.A OH TYR 98.A OH no hydrogen 2.639 N/A THR 7.A N MET 55.A O no hydrogen 3.103 N/A ARG 8.A NH2 ALA 12.A O no hydrogen 3.543 N/A ARG 10.A N PHE 50.A O no hydrogen 3.362 N/A ARG 10.A NH1 ASP 51.A OD1 no hydrogen 2.422 N/A ALA 12.A N ALA 9.A O no hydrogen 3.464 N/A GLY 13.A N ARG 97.A O no hydrogen 3.131 N/A GLY 14.A N ASN 11.A O no hydrogen 3.291 N/A ARG 16.A NE ASP 19.A OD2 no hydrogen 2.552 N/A ARG 16.A NH2 ASP 19.A OD2 no hydrogen 2.903 N/A ALA 17.A N GLY 14.A O no hydrogen 3.238 N/A ASP 19.A N ARG 16.A O no hydrogen 3.157 N/A CYS 20.A N ALA 17.A O no hydrogen 2.966 N/A CYS 20.A SG ARG 16.A O no hydrogen 3.211 N/A MET 21.A N PHE 52.A O no hydrogen 3.190 N/A LEU 22.A N CYS 100.A O no hydrogen 2.918 N/A LEU 23.A N GLY 54.A O no hydrogen 2.785 N/A ALA 24.A N VAL 102.A O no hydrogen 2.622 N/A ALA 25.A N ILE 56.A O no hydrogen 2.696 N/A GLU 26.A N CYS 104.A O no hydrogen 3.067 N/A LEU 31.A N GLY 27.A O no hydrogen 2.956 N/A SER 32.A N ASP 28.A O no hydrogen 2.978 N/A SER 32.A OG SER 29.A O no hydrogen 2.555 N/A LEU 33.A N SER 29.A O no hydrogen 3.260 N/A LEU 34.A N ALA 30.A O no hydrogen 3.028 N/A ARG 35.A N LEU 31.A O no hydrogen 2.868 N/A THR 36.A N SER 32.A O no hydrogen 3.054 N/A THR 36.A OG1 SER 32.A O no hydrogen 2.962 N/A GLY 37.A N LEU 33.A O no hydrogen 2.995 N/A LEU 38.A N LEU 34.A O no hydrogen 2.777 N/A THR 39.A OG1 ARG 35.A O no hydrogen 2.380 N/A SER 43.A OG LEU 40.A O no hydrogen 2.335 N/A ASN 44.A N GLY 41.A O no hydrogen 3.242 N/A ASN 44.A ND2 PHE 196.A O no hydrogen 2.825 N/A GLY 47.A N ASN 44.A O no hydrogen 3.177 N/A SER 49.A OG ASP 51.A OD2 no hydrogen 3.438 N/A ASP 51.A N SER 49.A OG no hydrogen 3.348 N/A CYS 53.A SG MET 21.A O no hydrogen 3.985 N/A GLY 54.A N MET 21.A O no hydrogen 2.865 N/A MET 55.A N THR 7.A O no hydrogen 3.237 N/A ILE 56.A N LEU 23.A O no hydrogen 2.938 N/A LEU 58.A N ALA 25.A O no hydrogen 2.583 N/A GLY 59.A N SER 57.A OG no hydrogen 3.271 N/A THR 67.A N ASN 63.A O no hydrogen 3.419 N/A THR 67.A OG1 ASN 63.A O no hydrogen 3.267 N/A ASN 68.A N GLN 65.A O no hydrogen 3.154 N/A ASN 69.A N LEU 66.A O no hydrogen 3.362 N/A VAL 71.A N ASN 69.A OD1 no hydrogen 3.156 N/A GLN 73.A N ASN 69.A O no hydrogen 2.936 N/A GLN 73.A NE2 THR 67.A O no hydrogen 2.643 N/A GLY 74.A N LYS 70.A O no hydrogen 2.923 N/A ILE 75.A N VAL 71.A O no hydrogen 3.167 N/A VAL 76.A N LEU 72.A O no hydrogen 3.134 N/A GLN 77.A N GLN 73.A O no hydrogen 2.926 N/A VAL 78.A N GLY 74.A O no hydrogen 2.926 N/A LEU 79.A N ILE 75.A O no hydrogen 3.026 N/A GLY 80.A N GLN 77.A O no hydrogen 3.236 N/A LEU 81.A N VAL 76.A O no hydrogen 3.027 N/A ASP 82.A N TYR 87.A OH no hydrogen 3.135 N/A THR 89.A OG1 GLU 92.A OE1 no hydrogen 2.846 N/A ARG 93.A N THR 89.A O no hydrogen 3.171 N/A ARG 93.A NH1 TYR 87.A O no hydrogen 2.769 N/A ARG 93.A NH2 GLN 90.A OE1 no hydrogen 3.254 N/A ALA 94.A N GLU 91.A O no hydrogen 3.152 N/A ARG 97.A N LEU 79.A O no hydrogen 3.063 N/A ARG 97.A NE VAL 78.A O no hydrogen 3.304 N/A TYR 98.A OH TYR 6.A OH no hydrogen 2.639 N/A GLY 99.A N CYS 20.A O no hydrogen 2.710 N/A ILE 101.A N PHE 135.A O no hydrogen 3.013 N/A VAL 102.A N LEU 22.A O no hydrogen 2.640 N/A ALA 103.A N LYS 137.A O no hydrogen 2.969 N/A CYS 104.A N ALA 24.A O no hydrogen 2.909 N/A CYS 104.A SG VAL 102.A O no hydrogen 4.035 N/A ASP 106.A N GLU 26.A OE1 no hydrogen 3.045 N/A GLN 107.A NE2 THR 141.A O no hydrogen 2.329 N/A LEU 109.A N ASP 108.A OD1 no hydrogen 2.758 N/A CYS 112.A N ASP 106.A O no hydrogen 2.842 N/A CYS 112.A SG ASP 106.A O no hydrogen 3.508 N/A LYS 114.A N GLY 111.A O no hydrogen 3.239 N/A LYS 114.A NZ ASP 110.A OD1 no hydrogen 3.151 N/A ILE 115.A N GLY 111.A O no hydrogen 2.953 N/A LEU 118.A N LYS 114.A O no hydrogen 3.121 N/A LEU 119.A N ILE 115.A O no hydrogen 3.169 N/A LEU 120.A N LEU 116.A O no hydrogen 2.844 N/A ALA 121.A N GLY 117.A O no hydrogen 2.828 N/A TYR 122.A N LEU 118.A O no hydrogen 2.711 N/A PHE 123.A N LEU 119.A O no hydrogen 3.087 N/A HIS 124.A N LEU 120.A O no hydrogen 2.825 N/A LEU 125.A N ALA 121.A O no hydrogen 2.826 N/A PHE 126.A N TYR 122.A O no hydrogen 3.412 N/A TRP 127.A N PHE 123.A O no hydrogen 2.726 N/A TRP 127.A NE1 ASP 82.A O no hydrogen 3.085 N/A LEU 130.A N TRP 127.A O no hydrogen 3.258 N/A ILE 132.A N PRO 128.A O no hydrogen 3.263 N/A HIS 133.A N GLN 129.A O no hydrogen 2.922 N/A GLY 134.A N ILE 131.A O no hydrogen 3.242 N/A PHE 135.A N LEU 130.A O no hydrogen 2.648 N/A LYS 137.A N ILE 101.A O no hydrogen 2.858 N/A ARG 138.A N TYR 204.A O no hydrogen 2.576 N/A LEU 139.A N ALA 103.A O no hydrogen 3.188 N/A LEU 140.A N MET 202.A O no hydrogen 2.840 N/A LEU 143.A N PHE 157.A O no hydrogen 2.891 N/A ILE 144.A N PHE 157.A O no hydrogen 2.942 N/A ARG 145.A N LYS 179.A O no hydrogen 3.138 N/A ARG 145.A NH2 HIS 187.A ND1 no hydrogen 3.112 N/A VAL 146.A N VAL 155.A O no hydrogen 2.865 N/A TYR 147.A N THR 177.A O no hydrogen 2.647 N/A TYR 147.A OH GLU 191.A OE2 no hydrogen 2.501 N/A LYS 149.A N ASN 175.A O no hydrogen 3.259 N/A LYS 151.A N GLU 148.A O no hydrogen 3.098 N/A VAL 155.A N VAL 146.A O no hydrogen 3.015 N/A PHE 157.A N ILE 144.A O no hydrogen 2.744 N/A TYR 158.A N GLU 162.A OE1 no hydrogen 3.173 N/A ASP 164.A N GLU 160.A O no hydrogen 3.106 N/A ALA 165.A N GLN 161.A O no hydrogen 2.994 N/A TRP 166.A N GLU 162.A O no hydrogen 2.988 N/A ALA 167.A N PHE 163.A O no hydrogen 2.646 N/A LYS 168.A N ASP 164.A O no hydrogen 2.908 N/A LYS 169.A N ALA 165.A O no hydrogen 3.287 N/A GLN 170.A N ALA 167.A O no hydrogen 3.132 N/A THR 177.A N TYR 147.A O no hydrogen 2.511 N/A LYS 179.A N ARG 145.A O no hydrogen 3.024 N/A TYR 181.A N LEU 143.A O no hydrogen 2.808 N/A LYS 182.A NZ ASP 108.A OD1 no hydrogen 3.557 N/A LEU 184.A N ASP 106.A OD1 no hydrogen 2.681 N/A ALA 186.A N GLY 183.A O no hydrogen 3.094 N/A ASP 188.A N GLU 191.A OE1 no hydrogen 2.919 N/A THR 189.A N ASP 188.A OD1 no hydrogen 2.669 N/A VAL 192.A N ASP 188.A O no hydrogen 3.004 N/A LYS 193.A N THR 189.A O no hydrogen 3.332 N/A LYS 193.A NZ THR 189.A O no hydrogen 3.484 N/A SER 194.A N HIS 190.A O no hydrogen 3.230 N/A SER 194.A OG HIS 190.A O no hydrogen 3.161 N/A MET 195.A N GLU 191.A O no hydrogen 2.881 N/A PHE 196.A N VAL 192.A O no hydrogen 2.985 N/A LYS 197.A N LYS 193.A O no hydrogen 2.989 N/A HIS 198.A N MET 195.A O no hydrogen 3.357 N/A ASN 201.A N HIS 198.A O no hydrogen 3.027 N/A MET 202.A N PHE 199.A O no hydrogen 3.172 N/A TYR 204.A N ARG 138.A O no hydrogen 2.693 N/A THR 205.A N ARG 250.A O no hydrogen 3.029 N/A PHE 206.A N VAL 136.A O no hydrogen 3.211 N/A THR 207.A N ILE 252.A O no hydrogen 3.007 N/A SER 211.A N ASP 210.A OD1 no hydrogen 2.672 N/A SER 211.A OG ASP 209.A OD2 no hydrogen 3.341 N/A ALA 212.A N ASP 209.A O no hydrogen 3.326 N/A LYS 213.A N ASP 210.A O no hydrogen 3.309 N/A LEU 215.A N SER 211.A O no hydrogen 3.433 N/A PHE 216.A N ALA 212.A O no hydrogen 2.971 N/A ILE 218.A N GLU 214.A O no hydrogen 2.993 N/A TYR 219.A N LEU 215.A O no hydrogen 2.938 N/A PHE 220.A N PHE 216.A O no hydrogen 3.006 N/A ARG 227.A NE ILE 218.A O no hydrogen 3.614 N/A ARG 229.A N GLU 225.A O no hydrogen 2.967 N/A GLU 230.A N LEU 226.A O no hydrogen 3.400 N/A LEU 231.A N ARG 227.A O no hydrogen 3.172 N/A LEU 231.A N LYS 228.A O no hydrogen 3.153 N/A CYS 232.A N ARG 229.A O no hydrogen 3.452 N/A CYS 232.A SG LYS 228.A O no hydrogen 3.142 N/A CYS 232.A SG ILE 589.A O no hydrogen 3.317 N/A THR 239.A N GLN 242.A OE1 no hydrogen 3.439 N/A THR 243.A N THR 239.A O no hydrogen 2.997 N/A THR 243.A OG1 THR 239.A O no hydrogen 3.082 N/A GLN 244.A N GLU 240.A O no hydrogen 2.790 N/A SER 245.A N THR 241.A O no hydrogen 3.145 N/A ILE 246.A N GLN 242.A O no hydrogen 3.092 N/A HIS 247.A N THR 243.A O no hydrogen 3.103 N/A SER 248.A N GLN 244.A O no hydrogen 2.833 N/A SER 248.A OG GLN 244.A O no hydrogen 3.233 N/A SER 248.A OG SER 245.A O no hydrogen 2.777 N/A VAL 249.A N SER 245.A O no hydrogen 3.331 N/A ARG 251.A N VAL 249.A O no hydrogen 2.523 N/A ILE 252.A N THR 205.A O no hydrogen 2.511 N/A CYS 254.A N THR 207.A O no hydrogen 2.899 N/A CYS 254.A SG THR 207.A O no hydrogen 3.269 N/A SER 255.A OG ASP 209.A OD2 no hydrogen 3.087 N/A HIS 257.A N PRO 253.A O no hydrogen 3.457 N/A LEU 258.A N CYS 254.A O no hydrogen 3.050 N/A GLN 259.A N SER 255.A O no hydrogen 2.924 N/A VAL 260.A N LEU 256.A O no hydrogen 3.234 N/A ASP 261.A N HIS 257.A O no hydrogen 2.894 N/A THR 262.A N HIS 257.A O no hydrogen 3.301 N/A THR 262.A OG1 GLY 113.A O no hydrogen 3.290 N/A LYS 263.A N LEU 258.A O no hydrogen 3.202 N/A LYS 263.A NZ GLU 230.A O no hydrogen 3.445 N/A LYS 263.A NZ GLY 234.A O no hydrogen 3.119 N/A ALA 264.A N VAL 260.A O no hydrogen 3.179 N/A TYR 265.A N ASP 261.A O no hydrogen 3.329 N/A LYS 266.A N THR 262.A O no hydrogen 3.054 N/A LEU 267.A N LYS 263.A O no hydrogen 2.824 N/A ASP 268.A N ALA 264.A O no hydrogen 2.842 N/A ALA 269.A N TYR 265.A O no hydrogen 3.121 N/A ILE 270.A N LYS 266.A O no hydrogen 3.297 N/A GLU 271.A N LEU 267.A O no hydrogen 2.780 N/A ARG 272.A N ASP 268.A O no hydrogen 3.207 N/A GLN 273.A N ILE 270.A O no hydrogen 2.839 N/A ILE 274.A N ILE 270.A O no hydrogen 2.762 N/A ASN 276.A N MET 281.A O no hydrogen 3.386 N/A LEU 278.A N ASN 276.A OD1 no hydrogen 2.848 N/A GLY 280.A N ASN 276.A O no hydrogen 2.615 N/A ARG 283.A NE GLU 271.A OE1 no hydrogen 2.389 N/A ARG 283.A NH1 GLU 402.A OE1 no hydrogen 3.438 N/A ARG 283.A NH2 GLU 402.A OE1 no hydrogen 3.167 N/A ARG 286.A N THR 282.A O no hydrogen 2.822 N/A ARG 286.A NH1 ASP 279.A OD2 no hydrogen 2.530 N/A LYS 287.A N ARG 283.A O no hydrogen 3.078 N/A LYS 287.A NZ GLU 400.A OE1 no hydrogen 3.119 N/A LYS 287.A NZ GLU 400.A OE2 no hydrogen 3.124 N/A ILE 288.A N ALA 284.A O no hydrogen 3.347 N/A LEU 289.A N ARG 285.A O no hydrogen 2.977 N/A ALA 290.A N ARG 286.A O no hydrogen 2.739 N/A GLY 291.A N LYS 287.A O no hydrogen 2.649 N/A GLY 292.A N ILE 288.A O no hydrogen 2.714 N/A VAL 293.A N LEU 289.A O no hydrogen 3.104 N/A LYS 294.A N ALA 290.A O no hydrogen 3.212 N/A LYS 294.A NZ HIS 315.A ND1 no hydrogen 3.096 N/A CYS 295.A N GLY 291.A O no hydrogen 2.777 N/A PHE 296.A N GLY 292.A O no hydrogen 2.908 N/A SER 298.A OG ASN 299.A OD1 no hydrogen 3.036 N/A ASN 299.A N SER 298.A OG no hydrogen 2.615 N/A ASN 299.A ND2 CYS 295.A O no hydrogen 2.358 N/A ARG 303.A N VAL 370.A O no hydrogen 2.980 N/A ARG 303.A NE GLN 307.A OE1 no hydrogen 3.336 N/A ARG 303.A NH2 GLN 307.A OE1 no hydrogen 3.486 N/A VAL 305.A N ILE 368.A O no hydrogen 2.965 N/A PHE 308.A N LYS 304.A O no hydrogen 2.772 N/A GLY 309.A N VAL 305.A O no hydrogen 2.689 N/A GLY 310.A N PHE 306.A O no hydrogen 2.990 N/A TYR 311.A N GLN 307.A O no hydrogen 3.307 N/A VAL 312.A N PHE 308.A O no hydrogen 3.109 N/A ALA 313.A N GLY 309.A O no hydrogen 3.156 N/A ASP 314.A N GLY 310.A O no hydrogen 2.980 N/A HIS 315.A N TYR 311.A O no hydrogen 2.871 N/A MET 316.A N VAL 312.A O no hydrogen 2.767 N/A TYR 318.A OH SER 324.A OG no hydrogen 3.193 N/A SER 324.A OG TYR 318.A OH no hydrogen 3.193 N/A SER 324.A OG HIS 320.A O no hydrogen 3.273 N/A SER 324.A OG GLY 321.A O no hydrogen 3.218 N/A LEU 325.A N GLY 321.A O no hydrogen 3.158 N/A ASN 326.A N ASP 322.A O no hydrogen 2.601 N/A THR 327.A N MET 323.A O no hydrogen 3.419 N/A THR 327.A OG1 MET 323.A O no hydrogen 2.855 N/A SER 328.A N SER 324.A O no hydrogen 3.067 N/A SER 328.A OG SER 324.A O no hydrogen 2.836 N/A ILE 329.A N LEU 325.A O no hydrogen 2.840 N/A ILE 330.A N ASN 326.A O no hydrogen 2.938 N/A LYS 331.A N THR 327.A O no hydrogen 3.020 N/A ALA 332.A N SER 328.A O no hydrogen 3.063 N/A ALA 333.A N ILE 330.A O no hydrogen 2.985 N/A GLN 334.A NE2 PHE 352.A O no hydrogen 3.021 N/A GLN 334.A NE2 GLY 359.A O no hydrogen 3.005 N/A TYR 336.A N SER 339.A OG no hydrogen 3.412 N/A TYR 336.A OH GLN 334.A OE1 no hydrogen 3.254 N/A SER 339.A N TYR 336.A O no hydrogen 2.905 N/A SER 339.A OG TYR 336.A O no hydrogen 2.797 N/A SER 339.A OG HIS 341.A O no hydrogen 3.069 N/A SER 340.A OG HIS 341.A ND1 no hydrogen 2.925 N/A HIS 341.A ND1 SER 340.A OG no hydrogen 2.925 N/A LEU 342.A N GLU 414.A OE1 no hydrogen 2.442 N/A ILE 347.A N GLN 371.A O no hydrogen 2.384 N/A SER 354.A N ASP 361.A OD1 no hydrogen 2.968 N/A SER 354.A OG ASP 361.A OD2 no hydrogen 2.286 N/A HIS 356.A ND1 THR 510.A OG1 no hydrogen 3.077 N/A HIS 356.A NE2 SER 535.A O no hydrogen 2.752 N/A GLY 358.A N ARG 355.A O no hydrogen 3.387 N/A GLY 359.A N SER 354.A O no hydrogen 3.092 N/A LYS 360.A N LEU 357.A O no hydrogen 3.287 N/A ASP 361.A N ASP 361.A OD1 no hydrogen 2.480 N/A GLY 363.A N SER 351.A O no hydrogen 2.877 N/A ARG 366.A NH1 ARG 366.A O no hydrogen 3.011 N/A TYR 367.A N SER 364.A O no hydrogen 3.149 N/A ILE 368.A N SER 364.A O no hydrogen 3.171 N/A SER 369.A N ILE 349.A O no hydrogen 3.373 N/A VAL 370.A N ARG 303.A O no hydrogen 2.475 N/A GLN 371.A N ILE 347.A O no hydrogen 3.444 N/A ALA 373.A N VAL 345.A O no hydrogen 3.111 N/A SER 374.A OG LEU 372.A O no hydrogen 3.570 N/A ILE 377.A N ALA 373.A O no hydrogen 3.005 N/A LYS 378.A N SER 374.A O no hydrogen 2.982 N/A THR 379.A N PHE 376.A O no hydrogen 3.288 N/A THR 379.A OG1 GLU 375.A O no hydrogen 3.366 N/A THR 379.A OG1 PHE 376.A O no hydrogen 2.741 N/A MET 380.A N PHE 376.A O no hydrogen 2.971 N/A PHE 381.A N ILE 377.A O no hydrogen 2.877 N/A SER 386.A OG ALA 383.A O no hydrogen 3.081 N/A TYR 391.A OH SER 386.A O no hydrogen 2.838 N/A VAL 392.A N GLU 400.A O no hydrogen 3.129 N/A GLU 394.A N GLN 397.A O no hydrogen 2.794 N/A GLN 397.A N GLU 394.A O no hydrogen 3.021 N/A ALA 399.A N VAL 392.A O no hydrogen 2.706 N/A GLU 402.A N PRO 390.A O no hydrogen 2.773 N/A TYR 404.A N ASP 279.A OD2 no hydrogen 3.137 N/A VAL 407.A N MET 380.A O no hydrogen 3.067 N/A ILE 412.A N PRO 409.A O no hydrogen 3.231 N/A MET 413.A N LEU 410.A O no hydrogen 3.333 N/A TYR 415.A N SER 340.A O no hydrogen 3.009 N/A TYR 415.A OH SER 469.A O no hydrogen 3.309 N/A GLY 416.A N THR 427.A O no hydrogen 2.982 N/A ASN 418.A N TYR 425.A O no hydrogen 2.853 N/A ASN 418.A ND2 GLY 422.A O no hydrogen 3.333 N/A ASN 418.A ND2 TRP 423.A O no hydrogen 3.139 N/A SER 420.A OG PRO 419.A O no hydrogen 2.492 N/A THR 426.A N HIS 579.A O no hydrogen 3.290 N/A THR 427.A N GLY 416.A O no hydrogen 2.570 N/A THR 427.A OG1 TYR 425.A OH no hydrogen 3.224 N/A TRP 428.A N TYR 595.A OH no hydrogen 2.889 N/A TRP 428.A NE1 HIS 577.A O no hydrogen 2.480 N/A ARG 430.A N ILE 412.A O no hydrogen 2.816 N/A GLN 431.A N ARG 467.A O no hydrogen 3.113 N/A GLN 431.A NE2 ASP 434.A OD1 no hydrogen 3.113 N/A ILE 435.A N GLN 431.A O no hydrogen 3.483 N/A ALA 437.A N GLU 433.A O no hydrogen 3.341 N/A LEU 438.A N ASP 434.A O no hydrogen 2.975 N/A VAL 439.A N ILE 435.A O no hydrogen 2.947 N/A ARG 440.A N LEU 436.A O no hydrogen 2.900 N/A ARG 440.A NH2 ASP 700.A OD1 no hydrogen 3.325 N/A ARG 440.A NH2 GLU 703.A OE1 no hydrogen 2.446 N/A ALA 441.A N ALA 437.A O no hydrogen 3.118 N/A TYR 442.A N LEU 438.A O no hydrogen 3.163 N/A VAL 443.A N VAL 439.A O no hydrogen 3.007 N/A ASP 444.A N ARG 440.A O no hydrogen 2.646 N/A ASP 446.A N ASP 444.A OD1 no hydrogen 3.083 N/A ASN 447.A N ASP 444.A O no hydrogen 3.422 N/A LYS 449.A N ASN 447.A OD1 no hydrogen 2.674 N/A HIS 450.A N ASN 447.A O no hydrogen 3.206 N/A GLU 451.A N GLU 451.A OE1 no hydrogen 2.655 N/A LEU 453.A N LYS 449.A O no hydrogen 2.807 N/A HIS 454.A N HIS 450.A O no hydrogen 3.311 N/A TYR 455.A N GLU 451.A O no hydrogen 3.176 N/A ALA 456.A N LEU 452.A O no hydrogen 2.944 N/A ILE 457.A N HIS 454.A O no hydrogen 3.160 N/A LYS 460.A NZ LYS 458.A O no hydrogen 3.158 N/A ILE 461.A N ALA 456.A O no hydrogen 3.348 N/A THR 462.A OG1 ILE 461.A O no hydrogen 2.437 N/A LEU 466.A N TYR 596.A OH no hydrogen 2.919 N/A ARG 467.A N ASP 434.A OD2 no hydrogen 2.917 N/A SER 469.A N ALA 429.A O no hydrogen 2.751 N/A LYS 474.A NZ GLU 503.A OE1 no hydrogen 3.549 N/A HIS 476.A N TYR 487.A O no hydrogen 3.211 N/A LYS 478.A N TYR 485.A O no hydrogen 2.905 N/A PHE 480.A N TYR 483.A O no hydrogen 3.030 N/A TYR 483.A N PHE 480.A O no hydrogen 3.221 N/A TYR 485.A N LYS 478.A O no hydrogen 2.778 N/A SER 486.A N ASN 574.A O no hydrogen 3.224 N/A TYR 487.A N HIS 476.A O no hydrogen 2.807 N/A TYR 487.A OH GLU 562.A O no hydrogen 2.918 N/A GLY 488.A N LEU 572.A O no hydrogen 2.882 N/A THR 489.A N GLU 503.A O no hydrogen 3.042 N/A THR 489.A OG1 LYS 474.A O no hydrogen 3.171 N/A TYR 490.A OH ASP 564.A OD2 no hydrogen 2.367 N/A ASP 491.A N THR 500.A O no hydrogen 2.597 N/A SER 493.A N ILE 498.A O no hydrogen 2.858 N/A GLN 495.A N GLN 495.A OE1 no hydrogen 2.743 N/A ASN 497.A ND2 LYS 546.A O no hydrogen 2.395 N/A ILE 498.A N SER 493.A O no hydrogen 3.249 N/A ILE 499.A N VAL 543.A O no hydrogen 2.876 N/A THR 500.A N ASP 491.A O no hydrogen 2.631 N/A ILE 501.A N ILE 541.A O no hydrogen 2.794 N/A THR 502.A N THR 489.A O no hydrogen 2.866 N/A THR 502.A OG1 THR 489.A O no hydrogen 3.111 N/A GLU 503.A N THR 489.A O no hydrogen 3.044 N/A LEU 506.A N SER 486.A OG no hydrogen 3.317 N/A LEU 506.A N ASN 574.A OD1 no hydrogen 3.385 N/A ARG 507.A NE GLY 338.A O no hydrogen 2.634 N/A THR 510.A OG1 HIS 356.A ND1 no hydrogen 3.077 N/A VAL 511.A N HIS 356.A O no hydrogen 2.910 N/A TYR 513.A N PRO 509.A O no hydrogen 2.974 N/A ILE 514.A N THR 510.A O no hydrogen 3.024 N/A GLU 515.A N VAL 511.A O no hydrogen 3.037 N/A SER 516.A N ALA 512.A O no hydrogen 2.873 N/A SER 516.A OG ALA 512.A O no hydrogen 3.390 N/A SER 516.A OG TYR 513.A O no hydrogen 2.469 N/A ILE 517.A N TYR 513.A O no hydrogen 2.968 N/A LYS 518.A N ILE 514.A O no hydrogen 2.751 N/A LYS 519.A N GLU 515.A O no hydrogen 2.959 N/A SER 520.A N ILE 517.A O no hydrogen 3.081 N/A SER 520.A OG SER 516.A O no hydrogen 3.206 N/A ARG 523.A N ASN 522.A OD1 no hydrogen 2.757 N/A MET 524.A N SER 520.A O no hydrogen 3.042 N/A THR 525.A N ASN 522.A O no hydrogen 3.263 N/A THR 525.A OG1 ASN 522.A O no hydrogen 2.385 N/A PHE 526.A N ARG 523.A O no hydrogen 3.153 N/A GLU 528.A N LYS 544.A O no hydrogen 2.921 N/A ILE 531.A N LEU 542.A O no hydrogen 3.002 N/A SER 534.A N ASP 532.A OD1 no hydrogen 3.288 N/A SER 534.A OG ASP 532.A OD1 no hydrogen 2.372 N/A THR 538.A OG1 GLU 537.A O no hydrogen 2.739 N/A ILE 541.A N ILE 501.A O no hydrogen 3.136 N/A LEU 542.A N ILE 531.A O no hydrogen 2.928 N/A VAL 543.A N ILE 499.A O no hydrogen 2.835 N/A LYS 544.A N GLU 529.A O no hydrogen 3.088 N/A LYS 544.A NZ GLU 528.A OE2 no hydrogen 3.566 N/A LEU 545.A N ASN 497.A O no hydrogen 3.210 N/A LYS 546.A N PHE 526.A O no hydrogen 2.786 N/A SER 549.A N LYS 546.A O no hydrogen 3.395 N/A SER 549.A OG PHE 526.A O no hydrogen 2.856 N/A SER 549.A OG LYS 546.A O no hydrogen 3.005 N/A ILE 553.A N LEU 550.A O no hydrogen 3.242 N/A GLU 556.A N ILE 553.A O no hydrogen 3.354 N/A PHE 557.A N ILE 553.A O no hydrogen 3.448 N/A GLN 563.A NE2 GLU 567.A O no hydrogen 2.371 N/A ASP 564.A N GLU 567.A OE1 no hydrogen 3.228 N/A SER 565.A N ASP 564.A OD1 no hydrogen 2.497 N/A SER 565.A OG GLU 559.A OE1 no hydrogen 2.851 N/A SER 565.A OG ASP 564.A OD1 no hydrogen 3.381 N/A ASN 568.A N SER 565.A O no hydrogen 2.959 N/A PHE 569.A N SER 565.A O no hydrogen 2.532 N/A LEU 570.A N ILE 566.A O no hydrogen 2.754 N/A ASN 574.A N SER 486.A O no hydrogen 3.375 N/A CYS 575.A SG HIS 577.A NE2 no hydrogen 3.190 N/A LEU 576.A N TYR 484.A O no hydrogen 2.809 N/A SER 578.A OG TYR 595.A OH no hydrogen 2.657 N/A HIS 579.A N THR 426.A O no hydrogen 2.892 N/A ASN 581.A N HIS 579.A O no hydrogen 2.868 N/A PHE 582.A N ILE 590.A O no hydrogen 3.312 N/A VAL 583.A N PRO 275.A O no hydrogen 3.211 N/A LYS 584.A N GLY 588.A O no hydrogen 3.245 N/A LYS 584.A NZ CYS 232.A O no hydrogen 2.702 N/A GLY 587.A N LYS 584.A O no hydrogen 2.995 N/A ILE 590.A N PHE 582.A O no hydrogen 2.878 N/A PHE 592.A N LEU 580.A O no hydrogen 3.208 N/A ASN 593.A N GLU 597.A OE1 no hydrogen 2.732 N/A TYR 595.A OH TRP 428.A O no hydrogen 3.430 N/A TYR 595.A OH SER 578.A OG no hydrogen 2.657 N/A TYR 596.A OH LEU 464.A O no hydrogen 3.207 N/A GLU 597.A N SER 594.A O no hydrogen 3.204 N/A LEU 599.A N TYR 595.A O no hydrogen 3.257 N/A TYR 600.A N TYR 596.A O no hydrogen 2.793 N/A ALA 601.A N GLU 597.A O no hydrogen 2.832 N/A TRP 602.A N ILE 598.A O no hydrogen 2.990 N/A LEU 603.A N LEU 599.A O no hydrogen 3.152 N/A ARG 606.A N TRP 602.A O no hydrogen 3.361 N/A ARG 606.A NE ARG 606.A O no hydrogen 3.278 N/A ARG 606.A NH1 ASP 385.A OD2 no hydrogen 2.946 N/A ARG 606.A NH2 ASP 385.A OD2 no hydrogen 2.372 N/A ARG 607.A N LEU 603.A O no hydrogen 2.876 N/A GLU 608.A N PRO 604.A O no hydrogen 2.786 N/A LEU 609.A N TYR 605.A O no hydrogen 3.190 N/A TYR 610.A N ARG 606.A O no hydrogen 3.211 N/A TYR 610.A OH GLU 698.A OE1 no hydrogen 2.250 N/A GLN 611.A N ARG 607.A O no hydrogen 3.422 N/A LYS 612.A N GLU 608.A O no hydrogen 2.820 N/A ARG 613.A N LEU 609.A O no hydrogen 2.536 N/A ARG 613.A NH1 GLU 698.A OE2 no hydrogen 2.390 N/A ARG 613.A NH2 ASP 385.A OD2 no hydrogen 2.790 N/A LEU 614.A N TYR 610.A O no hydrogen 3.012 N/A MET 615.A N GLN 611.A O no hydrogen 2.905 N/A ARG 616.A N LYS 612.A O no hydrogen 3.130 N/A ARG 616.A NE ALA 646.A O no hydrogen 3.158 N/A GLU 617.A N ARG 613.A O no hydrogen 3.034 N/A HIS 618.A N LEU 614.A O no hydrogen 2.487 N/A ALA 619.A N MET 615.A O no hydrogen 2.922 N/A VAL 620.A N ARG 616.A O no hydrogen 2.891 N/A LEU 621.A N GLU 617.A O no hydrogen 2.987 N/A LYS 622.A N HIS 618.A O no hydrogen 3.270 N/A LEU 623.A N ALA 619.A O no hydrogen 3.198 N/A ARG 624.A N VAL 620.A O no hydrogen 3.028 N/A ILE 625.A N LEU 621.A O no hydrogen 2.999 N/A ILE 626.A N LYS 622.A O no hydrogen 3.057 N/A MET 627.A N LEU 623.A O no hydrogen 2.998 N/A GLU 628.A N ARG 624.A O no hydrogen 2.730 N/A THR 629.A N ILE 625.A O no hydrogen 2.707 N/A THR 629.A OG1 ILE 625.A O no hydrogen 2.709 N/A ALA 630.A N ILE 626.A O no hydrogen 2.880 N/A ILE 631.A N MET 627.A O no hydrogen 3.182 N/A VAL 632.A N GLU 628.A O no hydrogen 3.265 N/A ARG 633.A N THR 629.A O no hydrogen 3.034 N/A TYR 634.A N ALA 630.A O no hydrogen 3.048 N/A ILE 635.A N ILE 631.A O no hydrogen 3.005 N/A ASN 636.A ND2 HIS 637.A O no hydrogen 2.832 N/A THR 638.A OG1 HIS 637.A O no hydrogen 2.382 N/A ILE 640.A N ASN 636.A O no hydrogen 3.371 N/A SER 642.A OG GLU 644.A OE2 no hydrogen 3.567 N/A ALA 646.A N GLU 644.A O no hydrogen 2.658 N/A SER 647.A OG GLU 649.A OE2 no hydrogen 2.858 N/A GLU 649.A N GLU 649.A OE1 no hydrogen 2.671 N/A LEU 651.A N SER 647.A O no hydrogen 2.941 N/A ASN 652.A N ILE 648.A O no hydrogen 3.345 N/A GLN 653.A N GLU 649.A O no hydrogen 3.185 N/A LYS 654.A N GLU 650.A O no hydrogen 3.115 N/A ALA 655.A N LEU 651.A O no hydrogen 2.985 N/A LEU 656.A N ASN 652.A O no hydrogen 3.472 N/A GLN 657.A N GLN 653.A O no hydrogen 3.319 N/A THR 664.A OG1 ALA 661.A O no hydrogen 2.425 N/A ARG 665.A N ALA 661.A O no hydrogen 3.208 N/A ARG 666.A N ALA 662.A O no hydrogen 3.410 N/A ARG 666.A NE GLU 628.A OE1 no hydrogen 3.380 N/A ARG 666.A NH2 GLU 628.A OE1 no hydrogen 2.662 N/A ARG 666.A NH2 GLU 628.A OE2 no hydrogen 3.231 N/A VAL 667.A N LYS 663.A O no hydrogen 3.234 N/A GLU 668.A N THR 664.A O no hydrogen 3.048 N/A LYS 669.A N ARG 665.A O no hydrogen 3.125 N/A ILE 670.A N ARG 666.A O no hydrogen 3.440 N/A LYS 671.A N VAL 667.A O no hydrogen 3.334 N/A LYS 672.A N GLU 668.A O no hydrogen 3.196 N/A MET 673.A N LYS 669.A O no hydrogen 3.041 N/A GLN 674.A N ILE 670.A O no hydrogen 2.851 N/A ALA 675.A N LYS 671.A O no hydrogen 2.854 N/A ARG 676.A N LYS 672.A O no hydrogen 2.884 N/A LEU 677.A N MET 673.A O no hydrogen 2.835 N/A ASP 678.A N GLN 674.A O no hydrogen 2.915 N/A LYS 679.A N ALA 675.A O no hydrogen 2.823 N/A VAL 680.A N ARG 676.A O no hydrogen 2.698 N/A GLU 681.A N LEU 677.A O no hydrogen 2.748 N/A GLN 682.A N ASP 678.A O no hydrogen 2.689 N/A LEU 683.A N LYS 679.A O no hydrogen 2.849 N/A SER 693.A N GLU 686.A OE1 no hydrogen 3.011 N/A SER 693.A OG GLU 686.A OE2 no hydrogen 2.856 N/A TRP 695.A N GLY 691.A O no hydrogen 3.409 N/A LEU 696.A N ALA 692.A O no hydrogen 3.154 N/A GLU 697.A N SER 693.A O no hydrogen 3.115 N/A GLU 698.A N VAL 694.A O no hydrogen 3.045 N/A ILE 699.A N TRP 695.A O no hydrogen 2.996 N/A ASP 700.A N LEU 696.A O no hydrogen 3.256 N/A ALA 701.A N GLU 697.A O no hydrogen 3.176 N/A VAL 702.A N GLU 698.A O no hydrogen 2.835 N/A GLU 703.A N ILE 699.A O no hydrogen 2.773 N/A LYS 704.A N ASP 700.A O no hydrogen 2.873 N/A ALA 705.A N ALA 701.A O no hydrogen 2.978 N/A ILE 706.A N VAL 702.A O no hydrogen 2.921 N/A ILE 707.A N GLU 703.A O no hydrogen 2.907 N/A LYS 708.A N LYS 704.A O no hydrogen 3.035 N/A LYS 708.A NZ GLU 375.A OE1 no hydrogen 2.787 N/A GLY 709.A N ALA 705.A O no hydrogen 2.958 N/A ARG 710.A N ILE 706.A O no hydrogen 2.834 N/A ASN 711.A N ILE 707.A O no hydrogen 2.872 N/A THR 712.A N LYS 708.A O no hydrogen 3.363 N/A THR 712.A OG1 LYS 708.A O no hydrogen 3.500 N/A THR 712.A OG1 GLY 709.A O no hydrogen 3.247 N/A TRP 714.A N GLY 709.A O no hydrogen 2.972 N/A TRP 714.A NE1 PRO 344.A O no hydrogen 2.949 N/A LYS 715.A N THR 712.A OG1 no hydrogen 3.187 N/A LYS 715.A NZ GLY 348.A O no hydrogen 3.410 N/A PHE 716.A N THR 712.A OG1 no hydrogen 3.130 N/A HIS 717.A ND1 LYS 715.A O no hydrogen 2.947 N/A