Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4qu4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N LEU 46.A O no hydrogen 2.758 N/A ALA 4.A N VAL 44.A O no hydrogen 3.106 N/A PHE 7.A N HIS 42.A O no hydrogen 3.114 N/A GLN 9.A N VAL 40.A O no hydrogen 3.316 N/A ALA 11.A N HIS 38.A O no hydrogen 2.895 N/A ARG 13.A N LEU 36.A O no hydrogen 2.442 N/A VAL 15.A N VAL 34.A O no hydrogen 3.161 N/A GLY 19.A N SER 17.A OG no hydrogen 3.096 N/A LEU 20.A N TYR 250.A OH no hydrogen 2.919 N/A THR 21.A N LYS 18.A O no hydrogen 3.379 N/A THR 21.A OG1 LYS 18.A O no hydrogen 2.654 N/A THR 21.A OG1 SER 23.A O no hydrogen 2.763 N/A THR 25.A N SER 17.A O no hydrogen 3.065 N/A THR 25.A OG1 SER 17.A O no hydrogen 2.782 N/A THR 25.A OG1 GLU 265.A OE1 no hydrogen 3.445 N/A THR 25.A OG1 GLU 265.A OE2 no hydrogen 3.348 N/A GLU 29.A N LYS 33.A O no hydrogen 3.211 N/A GLY 32.A N GLU 29.A O no hydrogen 3.105 N/A VAL 34.A N VAL 15.A O no hydrogen 2.946 N/A LEU 36.A N ARG 13.A O no hydrogen 2.679 N/A HIS 38.A N ALA 11.A O no hydrogen 2.406 N/A HIS 38.A ND1 THR 240.A OG1 no hydrogen 3.162 N/A VAL 40.A N GLN 9.A O no hydrogen 3.057 N/A ARG 41.A N TYR 239.A O no hydrogen 2.907 N/A HIS 42.A N PHE 7.A O no hydrogen 3.182 N/A VAL 44.A N ALA 4.A O no hydrogen 3.074 N/A ALA 45.A N CYS 235.A O no hydrogen 3.045 N/A LEU 46.A N VAL 2.A O no hydrogen 2.638 N/A TYR 50.A N PRO 47.A O no hydrogen 3.097 N/A TYR 52.A OH ASP 5.A OD2 no hydrogen 2.804 N/A TYR 52.A OH HIS 236.A NE2 no hydrogen 3.208 N/A ILE 55.A N ASP 5.A OD2 no hydrogen 2.894 N/A GLU 57.A N PRO 54.A O no hydrogen 2.895 N/A HIS 58.A N ILE 55.A O no hydrogen 3.392 N/A ARG 60.A NE GLU 63.A OE1 no hydrogen 3.115 N/A ARG 60.A NE GLU 63.A OE2 no hydrogen 3.324 N/A ARG 60.A NH1 ASP 76.A O no hydrogen 3.155 N/A ARG 60.A NH1 SER 80.A OG no hydrogen 2.619 N/A ARG 60.A NH2 GLU 63.A OE1 no hydrogen 3.323 N/A ARG 60.A NH2 GLU 63.A OE2 no hydrogen 3.415 N/A ALA 64.A N TYR 104.A OH no hydrogen 3.132 N/A ARG 65.A NE GLU 103.A OE1 no hydrogen 3.553 N/A ASP 72.A N GLN 75.A OE1 no hydrogen 3.051 N/A PHE 74.A N ASP 72.A OD1 no hydrogen 2.607 N/A GLN 75.A NE2 GLY 97.A O no hydrogen 2.784 N/A ASP 76.A N ASP 72.A O no hydrogen 2.574 N/A THR 77.A N PRO 73.A O no hydrogen 3.264 N/A THR 77.A OG1 PRO 73.A O no hydrogen 2.849 N/A ILE 79.A N GLN 75.A O no hydrogen 3.060 N/A SER 80.A N ASP 76.A O no hydrogen 3.314 N/A SER 80.A N THR 77.A O no hydrogen 2.848 N/A SER 80.A OG ASP 76.A O no hydrogen 3.556 N/A CYS 81.A N THR 77.A O no hydrogen 2.957 N/A CYS 81.A N ALA 78.A O no hydrogen 2.644 N/A CYS 81.A SG THR 77.A O no hydrogen 3.143 N/A CYS 81.A SG HIS 236.A ND1 no hydrogen 2.429 N/A ILE 82.A N ALA 78.A O no hydrogen 3.006 N/A ASP 83.A N ILE 79.A O no hydrogen 2.974 N/A ARG 84.A N SER 80.A O no hydrogen 2.899 N/A GLY 85.A N ILE 82.A O no hydrogen 2.883 N/A GLU 86.A N CYS 81.A O no hydrogen 2.897 N/A SER 87.A OG TYR 210.A O no hydrogen 3.366 N/A SER 87.A OG GLN 233.A OE1 no hydrogen 2.788 N/A VAL 88.A N TYR 210.A O no hydrogen 3.056 N/A LEU 89.A N HIS 236.A O no hydrogen 2.662 N/A VAL 90.A N PHE 212.A O no hydrogen 2.768 N/A SER 91.A N VAL 238.A O no hydrogen 2.921 N/A ALA 92.A N SER 214.A O no hydrogen 3.162 N/A HIS 93.A ND1 PHE 242.A O no hydrogen 2.575 N/A SER 95.A N HIS 93.A O no hydrogen 2.458 N/A SER 95.A OG HIS 93.A O no hydrogen 3.480 N/A GLY 97.A N SER 95.A OG no hydrogen 2.970 N/A THR 99.A N ALA 96.A O no hydrogen 2.789 N/A THR 99.A OG1 ALA 96.A O no hydrogen 2.607 N/A VAL 101.A N LYS 98.A O no hydrogen 2.657 N/A ALA 102.A N LYS 98.A O no hydrogen 3.317 N/A GLU 103.A N THR 99.A O no hydrogen 2.746 N/A TYR 104.A N VAL 100.A O no hydrogen 3.140 N/A TYR 104.A OH ASN 62.A O no hydrogen 3.370 N/A ALA 105.A N VAL 101.A O no hydrogen 3.196 N/A ILE 106.A N ALA 102.A O no hydrogen 3.040 N/A ALA 107.A N GLU 103.A O no hydrogen 3.190 N/A GLN 108.A N TYR 104.A O no hydrogen 2.904 N/A GLN 108.A NE2 ILE 82.A O no hydrogen 2.568 N/A SER 109.A N ALA 105.A O no hydrogen 2.897 N/A SER 109.A OG ALA 105.A O no hydrogen 2.724 N/A LEU 110.A N ILE 106.A O no hydrogen 2.951 N/A LYS 111.A N ALA 107.A O no hydrogen 3.016 N/A ASN 112.A N SER 109.A O no hydrogen 2.669 N/A LYS 113.A N LEU 110.A O no hydrogen 3.244 N/A GLN 114.A N SER 109.A O no hydrogen 3.127 N/A ARG 115.A N GLU 176.A O no hydrogen 3.103 N/A VAL 116.A N GLY 154.A O no hydrogen 2.726 N/A ILE 117.A N TRP 179.A O no hydrogen 3.158 N/A TYR 118.A N LEU 156.A O no hydrogen 2.593 N/A THR 119.A N ILE 181.A O no hydrogen 3.017 N/A SER 120.A OG SER 126.A OG no hydrogen 3.348 N/A SER 126.A N ILE 122.A O no hydrogen 3.054 N/A SER 126.A OG SER 120.A OG no hydrogen 3.348 N/A SER 126.A OG ILE 122.A O no hydrogen 3.529 N/A ASN 127.A N LYS 123.A O no hydrogen 3.308 N/A GLN 128.A N ALA 124.A O no hydrogen 3.030 N/A LYS 129.A N LEU 125.A O no hydrogen 3.033 N/A LYS 129.A NZ GLU 132.A OE1 no hydrogen 2.592 N/A TYR 130.A N SER 126.A O no hydrogen 2.904 N/A ARG 131.A N ASN 127.A O no hydrogen 2.819 N/A GLU 132.A N GLN 128.A O no hydrogen 3.009 N/A LEU 133.A N LYS 129.A O no hydrogen 2.665 N/A LEU 134.A N TYR 130.A O no hydrogen 2.774 N/A ALA 135.A N ARG 131.A O no hydrogen 3.113 N/A GLU 136.A N LEU 133.A O no hydrogen 3.283 N/A PHE 137.A N LEU 133.A O no hydrogen 2.850 N/A PHE 137.A N LEU 134.A O no hydrogen 3.269 N/A GLY 138.A N LEU 134.A O no hydrogen 2.953 N/A VAL 140.A N GLY 138.A O no hydrogen 2.578 N/A GLY 141.A N CYS 155.A O no hydrogen 2.753 N/A LEU 142.A N ILE 149.A O no hydrogen 3.341 N/A MET 143.A N VAL 157.A O no hydrogen 2.617 N/A THR 144.A N ILE 147.A O no hydrogen 2.540 N/A THR 144.A OG1 ILE 147.A O no hydrogen 2.823 N/A ILE 147.A N THR 144.A OG1 no hydrogen 2.257 N/A ILE 149.A N LEU 142.A O no hydrogen 2.985 N/A LEU 156.A N VAL 116.A O no hydrogen 2.876 N/A VAL 157.A N GLY 141.A O no hydrogen 2.476 N/A MET 158.A N TYR 118.A O no hydrogen 3.139 N/A THR 159.A N MET 143.A O no hydrogen 3.194 N/A THR 160.A N SER 120.A O no hydrogen 3.118 N/A THR 160.A OG1 SER 120.A O no hydrogen 2.809 N/A ILE 162.A N THR 159.A OG1 no hydrogen 3.032 N/A LEU 163.A N THR 159.A O no hydrogen 3.307 N/A ARG 164.A N THR 160.A O no hydrogen 3.091 N/A SER 165.A N GLU 161.A O no hydrogen 3.086 N/A SER 165.A OG ILE 162.A O no hydrogen 2.602 N/A MET 166.A N ILE 162.A O no hydrogen 3.033 N/A LEU 167.A N LEU 163.A O no hydrogen 2.798 N/A TYR 168.A N ARG 164.A O no hydrogen 3.097 N/A ARG 169.A N SER 165.A O no hydrogen 2.488 N/A SER 171.A OG SER 171.A O no hydrogen 2.560 N/A GLU 176.A N VAL 173.A O no hydrogen 2.586 N/A VAL 177.A N MET 174.A O no hydrogen 3.143 N/A ALA 178.A N ARG 115.A O no hydrogen 2.660 N/A VAL 180.A N ARG 209.A O no hydrogen 2.648 N/A ILE 181.A N ILE 117.A O no hydrogen 2.916 N/A PHE 182.A N VAL 211.A O no hydrogen 2.866 N/A ASP 183.A N THR 119.A O no hydrogen 2.985 N/A VAL 185.A N LEU 213.A O no hydrogen 2.937 N/A TYR 187.A N GLU 184.A O no hydrogen 3.041 N/A MET 188.A N VAL 185.A O no hydrogen 3.053 N/A ARG 189.A NH2 ARG 470.A O no hydrogen 3.061 N/A ASP 190.A N TYR 187.A O no hydrogen 2.994 N/A GLU 192.A N ASP 190.A OD1 no hydrogen 3.147 N/A VAL 195.A N GLU 192.A O no hydrogen 3.171 N/A TRP 197.A N ARG 193.A O no hydrogen 3.445 N/A GLU 199.A N VAL 195.A O no hydrogen 2.726 N/A THR 200.A N VAL 196.A O no hydrogen 2.898 N/A THR 200.A OG1 VAL 196.A O no hydrogen 2.889 N/A ILE 201.A N TRP 197.A O no hydrogen 3.206 N/A ILE 202.A N GLU 198.A O no hydrogen 2.949 N/A LEU 203.A N GLU 199.A O no hydrogen 3.017 N/A LEU 203.A N THR 200.A O no hydrogen 3.054 N/A LEU 204.A N THR 200.A O no hydrogen 3.137 N/A VAL 208.A N PRO 205.A O no hydrogen 2.671 N/A ARG 209.A N ALA 178.A O no hydrogen 2.917 N/A TYR 210.A N SER 87.A OG no hydrogen 2.599 N/A VAL 211.A N VAL 180.A O no hydrogen 2.921 N/A PHE 212.A N VAL 88.A O no hydrogen 2.921 N/A LEU 213.A N PHE 182.A O no hydrogen 2.882 N/A SER 214.A N VAL 90.A O no hydrogen 2.610 N/A SER 214.A OG ALA 215.A O no hydrogen 2.358 N/A ALA 215.A N HIS 186.A ND1 no hydrogen 2.887 N/A ALA 224.A N ALA 220.A O no hydrogen 3.133 N/A TRP 226.A N GLU 222.A O no hydrogen 3.447 N/A TRP 226.A NE1 HIS 499.A O no hydrogen 3.101 N/A ILE 227.A N PHE 223.A O no hydrogen 3.137 N/A CYS 228.A N ALA 224.A O no hydrogen 2.681 N/A LYS 229.A N GLU 225.A O no hydrogen 2.499 N/A ILE 230.A N TRP 226.A O no hydrogen 2.692 N/A HIS 231.A N ILE 227.A O no hydrogen 2.827 N/A GLN 233.A NE2 ASP 206.A O no hydrogen 3.479 N/A GLN 233.A NE2 VAL 208.A O no hydrogen 3.307 N/A GLN 233.A NE2 HIS 231.A O no hydrogen 3.547 N/A CYS 235.A N ALA 45.A O no hydrogen 3.157 N/A CYS 235.A SG SER 87.A O no hydrogen 3.987 N/A CYS 235.A SG HIS 236.A O no hydrogen 3.774 N/A HIS 236.A N SER 87.A O no hydrogen 2.787 N/A ILE 237.A N GLN 43.A O no hydrogen 3.110 N/A VAL 238.A N LEU 89.A O no hydrogen 2.658 N/A TYR 239.A N ARG 41.A O no hydrogen 2.953 N/A THR 240.A N SER 91.A O no hydrogen 3.229 N/A THR 240.A OG1 HIS 38.A ND1 no hydrogen 3.162 N/A THR 240.A OG1 GLN 39.A O no hydrogen 3.157 N/A PHE 242.A N THR 240.A OG1 no hydrogen 2.719 N/A THR 245.A OG1 PRO 244.A O no hydrogen 2.457 N/A THR 245.A OG1 THR 245.A O no hydrogen 2.458 N/A GLN 248.A N GLY 445.A O no hydrogen 2.959 N/A GLN 248.A NE2 GLU 265.A OE2 no hydrogen 2.334 N/A TYR 250.A N VAL 447.A O no hydrogen 2.727 N/A TYR 250.A OH GLN 248.A OE1 no hydrogen 3.012 N/A LEU 251.A N TYR 260.A O no hydrogen 2.926 N/A PHE 252.A N MET 449.A O no hydrogen 3.496 N/A TYR 260.A N LEU 251.A O no hydrogen 3.045 N/A TYR 260.A OH SER 280.A OG no hydrogen 3.042 N/A VAL 262.A N HIS 249.A O no hydrogen 2.608 N/A VAL 263.A N HIS 249.A O no hydrogen 3.279 N/A ASP 264.A N THR 268.A O no hydrogen 2.558 N/A GLU 265.A N GLU 265.A OE1 no hydrogen 3.000 N/A ARG 270.A N VAL 262.A O no hydrogen 2.630 N/A GLU 271.A N PHE 269.A O no hydrogen 2.568 N/A PHE 274.A N ARG 270.A O no hydrogen 3.041 N/A PHE 274.A N GLU 271.A O no hydrogen 3.185 N/A GLN 275.A N GLU 271.A O no hydrogen 3.061 N/A LYS 276.A N GLU 272.A O no hydrogen 2.914 N/A ALA 277.A N ASN 273.A O no hydrogen 3.171 N/A MET 278.A N PHE 274.A O no hydrogen 2.813 N/A ALA 279.A N GLN 275.A O no hydrogen 3.366 N/A SER 280.A N LYS 276.A O no hydrogen 3.412 N/A SER 280.A N ALA 277.A O no hydrogen 3.083 N/A SER 280.A OG TYR 260.A OH no hydrogen 3.042 N/A SER 280.A OG ALA 277.A O no hydrogen 3.068 N/A ILE 281.A N MET 278.A O no hydrogen 3.026 N/A ILE 286.A N LYS 283.A O no hydrogen 3.287 N/A LYS 288.A N GLY 284.A O no hydrogen 3.042 N/A ILE 289.A N ASP 285.A O no hydrogen 3.148 N/A VAL 290.A N ILE 286.A O no hydrogen 2.656 N/A LYS 291.A N TYR 287.A O no hydrogen 2.759 N/A MET 292.A N LYS 288.A O no hydrogen 3.086 N/A ILE 293.A N VAL 290.A O no hydrogen 3.128 N/A TRP 294.A N VAL 290.A O no hydrogen 3.357 N/A LYS 295.A N LYS 291.A O no hydrogen 2.896 N/A LYS 296.A N MET 292.A O no hydrogen 2.681 N/A TYR 298.A N ILE 293.A O no hydrogen 2.770 N/A VAL 301.A N LYS 389.A O no hydrogen 2.581 N/A ILE 302.A N THR 407.A O no hydrogen 3.127 N/A VAL 303.A N LEU 391.A O no hydrogen 3.162 N/A SER 305.A N ALA 393.A O no hydrogen 3.056 N/A ASP 310.A N SER 307.A OG no hydrogen 3.328 N/A CYS 311.A SG SER 307.A O no hydrogen 3.755 N/A LEU 314.A N ASP 310.A O no hydrogen 3.068 N/A ALA 315.A N CYS 311.A O no hydrogen 3.333 N/A SER 319.A N LEU 316.A O no hydrogen 3.088 N/A PHE 323.A N LEU 321.A O no hydrogen 2.394 N/A SER 325.A OG ASN 324.A O no hydrogen 2.699 N/A LYS 329.A N SER 325.A O no hydrogen 3.027 N/A GLU 330.A N ASP 326.A O no hydrogen 2.943 N/A LEU 332.A N GLU 328.A O no hydrogen 2.953 N/A LEU 332.A N LYS 329.A O no hydrogen 3.299 N/A THR 333.A OG1 LYS 329.A O no hydrogen 3.171 N/A PHE 336.A N LEU 332.A O no hydrogen 3.237 N/A ASN 337.A N THR 333.A O no hydrogen 2.959 N/A LEU 342.A N ALA 339.A O no hydrogen 2.440 N/A LEU 343.A N ILE 340.A O no hydrogen 3.373 N/A ARG 348.A N GLU 345.A O no hydrogen 2.823 N/A LEU 357.A N HIS 355.A O no hydrogen 2.203 N/A LEU 360.A N ILE 356.A O no hydrogen 2.624 N/A ARG 361.A N LEU 357.A O no hydrogen 2.612 N/A GLY 363.A N LEU 360.A O no hydrogen 2.824 N/A ILE 364.A N LEU 359.A O no hydrogen 2.399 N/A GLY 365.A N VAL 390.A O no hydrogen 3.336 N/A SER 369.A OG SER 369.A O no hydrogen 2.573 N/A LYS 376.A N LEU 372.A O no hydrogen 2.719 N/A GLU 377.A N ILE 374.A O no hydrogen 3.127 N/A VAL 378.A N ILE 374.A O no hydrogen 2.839 N/A GLU 380.A N LYS 376.A O no hydrogen 2.812 N/A ILE 381.A N GLU 377.A O no hydrogen 2.898 N/A LEU 382.A N VAL 378.A O no hydrogen 2.504 N/A PHE 383.A N ILE 379.A O no hydrogen 2.420 N/A GLN 384.A N GLU 380.A O no hydrogen 2.680 N/A GLU 385.A N ILE 381.A O no hydrogen 2.708 N/A GLY 386.A N PHE 383.A O no hydrogen 2.822 N/A LEU 388.A N LEU 382.A O no hydrogen 3.257 N/A LYS 389.A N GLY 363.A O no hydrogen 2.434 N/A VAL 390.A N GLY 363.A O no hydrogen 3.349 N/A LEU 391.A N VAL 301.A O no hydrogen 3.199 N/A PHE 392.A N GLY 365.A O no hydrogen 3.198 N/A GLU 395.A N SER 305.A O no hydrogen 3.247 N/A THR 407.A N ALA 405.A O no hydrogen 2.448 N/A THR 407.A OG1 TYR 298.A O no hydrogen 2.381 N/A VAL 408.A N ILE 446.A O no hydrogen 2.841 N/A VAL 409.A N ILE 302.A O no hydrogen 3.246 N/A THR 411.A N PHE 304.A O no hydrogen 3.361 N/A SER 412.A OG ARG 414.A O no hydrogen 3.493 N/A ARG 414.A N SER 412.A OG no hydrogen 2.874 N/A ARG 414.A NH1 PHE 421.A O no hydrogen 3.141 N/A ARG 414.A NH1 GLU 636.A O no hydrogen 2.819 N/A ARG 414.A NH2 GLU 636.A O no hydrogen 3.064 N/A LYS 415.A N ARG 422.A O no hydrogen 2.576 N/A ASP 417.A N GLN 420.A O no hydrogen 3.113 N/A GLN 420.A NE2 LEU 634.A O no hydrogen 3.479 N/A ARG 422.A N LYS 415.A O no hydrogen 2.934 N/A VAL 424.A N VAL 413.A O no hydrogen 2.762 N/A SER 425.A N GLU 428.A OE1 no hydrogen 3.363 N/A GLU 428.A N SER 425.A OG no hydrogen 2.815 N/A TYR 429.A N SER 425.A O no hydrogen 3.235 N/A TYR 429.A N GLY 426.A O no hydrogen 3.183 N/A TYR 429.A OH HIS 249.A ND1 no hydrogen 2.384 N/A ILE 430.A N GLY 426.A O no hydrogen 3.221 N/A GLN 431.A N GLY 427.A O no hydrogen 3.332 N/A MET 432.A N GLU 428.A O no hydrogen 3.203 N/A SER 433.A N TYR 429.A O no hydrogen 2.985 N/A SER 433.A OG TYR 429.A O no hydrogen 2.723 N/A GLY 434.A N GLN 431.A O no hydrogen 2.815 N/A ARG 435.A N MET 432.A O no hydrogen 3.302 N/A ALA 436.A N SER 433.A O no hydrogen 3.188 N/A ARG 438.A NE ASP 442.A OD2 no hydrogen 2.412 N/A ARG 438.A NH2 ASP 442.A OD1 no hydrogen 3.104 N/A LEU 441.A N ARG 439.A O no hydrogen 2.719 N/A ARG 444.A NH1 GLU 265.A OE2 no hydrogen 2.672 N/A GLY 445.A N PRO 246.A O no hydrogen 2.927 N/A ILE 446.A N LYS 406.A O no hydrogen 2.596 N/A VAL 447.A N GLN 248.A O no hydrogen 2.726 N/A ILE 448.A N VAL 408.A O no hydrogen 2.915 N/A MET 449.A N TYR 250.A O no hydrogen 2.860 N/A MET 450.A N PHE 410.A O no hydrogen 3.161 N/A ILE 451.A N PHE 252.A O no hydrogen 3.186 N/A GLN 458.A N GLN 458.A OE1 no hydrogen 2.511 N/A ALA 460.A N GLU 456.A O no hydrogen 3.219 N/A LYS 461.A N PRO 457.A O no hydrogen 2.813 N/A GLY 462.A N GLN 458.A O no hydrogen 3.235 N/A GLY 462.A N VAL 459.A O no hydrogen 2.953 N/A MET 463.A N VAL 459.A O no hydrogen 3.132 N/A MET 463.A N ALA 460.A O no hydrogen 3.250 N/A VAL 464.A N ALA 460.A O no hydrogen 2.867 N/A LYS 465.A N LYS 461.A O no hydrogen 3.059 N/A LYS 465.A NZ SER 267.A O no hydrogen 3.250 N/A GLN 467.A N GLN 467.A OE1 no hydrogen 2.580 N/A SER 473.A N GLN 505.A OE1 no hydrogen 2.831 N/A SER 473.A OG GLU 198.A OE1 no hydrogen 2.846 N/A SER 473.A OG GLU 198.A OE2 no hydrogen 2.606 N/A PHE 475.A N SER 473.A OG no hydrogen 3.008 N/A ASN 480.A N GLU 806.A OE2 no hydrogen 2.375 N/A MET 481.A N TYR 479.A O no hydrogen 2.267 N/A ILE 482.A N GLY 478.A O no hydrogen 3.035 N/A LEU 483.A N TYR 479.A O no hydrogen 3.026 N/A LEU 485.A N MET 481.A O no hydrogen 2.730 N/A MET 486.A N ILE 482.A O no hydrogen 2.679 N/A ARG 487.A N LEU 483.A O no hydrogen 2.820 N/A GLU 489.A N GLU 489.A OE1 no hydrogen 2.823 N/A GLU 494.A N GLU 494.A OE1 no hydrogen 2.712 N/A PHE 495.A N SER 492.A O no hydrogen 3.007 N/A MET 496.A N SER 492.A O no hydrogen 3.001 N/A LEU 497.A N PRO 493.A O no hydrogen 3.168 N/A HIS 499.A N MET 496.A O no hydrogen 2.510 N/A SER 500.A N LEU 497.A O no hydrogen 3.115 N/A SER 500.A OG LEU 497.A O no hydrogen 2.682 N/A PHE 501.A N GLU 198.A OE2 no hydrogen 2.800 N/A PHE 502.A N GLU 198.A OE2 no hydrogen 3.078 N/A GLN 503.A N SER 500.A OG no hydrogen 3.281 N/A GLN 505.A N PHE 501.A O no hydrogen 2.863 N/A GLN 505.A NE2 LEU 471.A O no hydrogen 2.849 N/A ASN 506.A N PHE 502.A O no hydrogen 3.112 N/A VAL 507.A N GLN 503.A O no hydrogen 2.980 N/A ILE 508.A N PHE 504.A O no hydrogen 3.097 N/A SER 509.A N GLN 505.A O no hydrogen 3.224 N/A SER 509.A N ASN 506.A O no hydrogen 3.166 N/A SER 509.A OG ASN 506.A O no hydrogen 2.817 N/A MET 513.A N SER 509.A O no hydrogen 2.927 N/A GLU 514.A N VAL 510.A O no hydrogen 2.954 N/A LYS 515.A N PRO 511.A O no hydrogen 3.162 N/A LYS 516.A N MET 513.A O no hydrogen 3.041 N/A LEU 517.A N MET 513.A O no hydrogen 2.799 N/A ALA 518.A N GLU 514.A O no hydrogen 2.737 N/A LEU 520.A N LYS 516.A O no hydrogen 2.520 N/A LYS 521.A N LEU 517.A O no hydrogen 2.971 N/A ASP 523.A N LEU 520.A O no hydrogen 3.016 N/A PHE 524.A N LEU 520.A O no hydrogen 3.020 N/A VAL 535.A N ASP 531.A O no hydrogen 2.698 N/A LYS 536.A N GLU 532.A O no hydrogen 2.754 N/A TYR 538.A N ASN 534.A O no hydrogen 3.457 N/A HIS 539.A N VAL 535.A O no hydrogen 2.541 N/A GLU 540.A N LYS 536.A O no hydrogen 2.600 N/A ILE 541.A N GLU 537.A O no hydrogen 3.056 N/A GLU 542.A N TYR 538.A O no hydrogen 3.036 N/A GLN 543.A N HIS 539.A O no hydrogen 3.099 N/A GLN 543.A NE2 HIS 539.A NE2 no hydrogen 3.056 N/A ALA 544.A N GLU 540.A O no hydrogen 2.815 N/A ILE 545.A N ILE 541.A O no hydrogen 3.142 N/A LYS 546.A N GLU 542.A O no hydrogen 2.871 N/A GLY 547.A N GLN 543.A O no hydrogen 2.849 N/A TYR 548.A N ALA 544.A O no hydrogen 3.084 N/A ARG 549.A N ILE 545.A O no hydrogen 3.207 N/A GLU 550.A N LYS 546.A O no hydrogen 3.283 N/A ASP 551.A N GLY 547.A O no hydrogen 3.301 N/A VAL 552.A N TYR 548.A O no hydrogen 2.918 N/A ARG 553.A N ARG 549.A O no hydrogen 2.789 N/A ARG 553.A NH2 ASP 657.A O no hydrogen 2.518 N/A GLN 554.A N GLU 550.A O no hydrogen 2.937 N/A VAL 555.A N ASP 551.A O no hydrogen 3.281 N/A VAL 555.A N VAL 552.A O no hydrogen 2.922 N/A VAL 556.A N VAL 552.A O no hydrogen 3.134 N/A THR 557.A N ARG 553.A O no hydrogen 2.822 N/A THR 557.A OG1 ARG 553.A O no hydrogen 2.691 N/A THR 557.A OG1 GLN 554.A O no hydrogen 3.486 N/A THR 557.A OG1 HIS 606.A NE2 no hydrogen 3.425 N/A HIS 558.A N VAL 555.A O no hydrogen 3.060 N/A ALA 560.A N HIS 558.A ND1 no hydrogen 3.006 N/A ASN 561.A N HIS 558.A O no hydrogen 2.951 N/A ALA 562.A N HIS 558.A O no hydrogen 2.851 N/A PHE 565.A N ALA 562.A O no hydrogen 2.833 N/A GLY 569.A N VAL 587.A O no hydrogen 2.859 N/A ARG 570.A N GLN 567.A O no hydrogen 2.783 N/A ARG 570.A NH1 GLY 663.A O no hydrogen 3.353 N/A LEU 571.A N LEU 665.A O no hydrogen 2.895 N/A VAL 572.A N GLY 585.A O no hydrogen 2.877 N/A GLU 573.A N SER 661.A O no hydrogen 2.465 N/A ILE 574.A N GLY 583.A O no hydrogen 2.813 N/A SER 575.A N SER 658.A O no hydrogen 2.910 N/A VAL 576.A N ASP 580.A O no hydrogen 2.933 N/A GLY 578.A N SER 575.A O no hydrogen 3.301 N/A ASP 580.A N VAL 576.A O no hydrogen 3.313 N/A TYR 582.A N ILE 574.A O no hydrogen 2.920 N/A GLY 583.A N ASN 581.A OD1 no hydrogen 3.220 N/A GLY 585.A N VAL 572.A O no hydrogen 2.838 N/A ALA 586.A N VAL 614.A O no hydrogen 2.872 N/A VAL 587.A N ARG 570.A O no hydrogen 2.736 N/A VAL 588.A N ASN 612.A O no hydrogen 3.024 N/A ALA 591.A N ILE 610.A O no hydrogen 3.163 N/A ARG 593.A N SER 608.A O no hydrogen 2.838 N/A ARG 593.A NH1 GLU 607.A O no hydrogen 3.257 N/A HIS 606.A NE2 GLN 554.A O no hydrogen 2.966 N/A SER 608.A OG ASP 605.A O no hydrogen 2.391 N/A ILE 610.A N ALA 591.A O no hydrogen 2.990 N/A VAL 611.A N ILE 654.A O no hydrogen 2.613 N/A ASN 612.A N ASP 589.A O no hydrogen 3.035 N/A ASN 612.A ND2 ASP 589.A OD1 no hydrogen 2.479 N/A VAL 613.A N ILE 652.A O no hydrogen 2.976 N/A VAL 614.A N ALA 586.A O no hydrogen 2.781 N/A VAL 615.A N ALA 650.A O no hydrogen 3.140 N/A THR 617.A OG1 TYR 582.A O no hydrogen 2.889 N/A TYR 619.A N ARG 639.A O no hydrogen 3.073 N/A SER 622.A N TYR 619.A O no hydrogen 3.294 N/A SER 622.A OG TYR 619.A O no hydrogen 3.375 N/A SER 622.A OG GLY 637.A O no hydrogen 3.213 N/A SER 622.A OG ARG 639.A O no hydrogen 3.185 N/A VAL 624.A N SER 622.A O no hydrogen 2.566 N/A LEU 626.A N PRO 623.A O no hydrogen 2.823 N/A LEU 627.A N VAL 624.A O no hydrogen 3.413 N/A ASN 631.A ND2 GLN 419.A O no hydrogen 3.632 N/A THR 633.A N ASN 631.A OD1 no hydrogen 3.060 N/A ILE 638.A N PRO 635.A O no hydrogen 3.068 N/A ARG 639.A N SER 622.A OG no hydrogen 2.935 N/A ALA 641.A N THR 617.A O no hydrogen 3.021 N/A GLU 642.A N GLU 645.A OE1 no hydrogen 2.906 N/A GLU 645.A N GLU 642.A O no hydrogen 3.065 N/A ILE 648.A N MET 618.A O no hydrogen 2.854 N/A ALA 650.A N VAL 615.A O no hydrogen 3.005 N/A ILE 652.A N VAL 613.A O no hydrogen 3.117 N/A ILE 654.A N VAL 611.A O no hydrogen 2.599 N/A LEU 656.A N HIS 606.A O no hydrogen 3.157 N/A ASP 657.A N THR 655.A OG1 no hydrogen 3.115 N/A SER 658.A N THR 655.A O no hydrogen 2.914 N/A LYS 660.A N GLU 573.A O no hydrogen 2.467 N/A SER 661.A N GLU 573.A O no hydrogen 3.345 N/A GLY 663.A N LEU 571.A O no hydrogen 2.566 N/A ASN 664.A N PRO 698.A O no hydrogen 2.708 N/A ARG 666.A NH2 PRO 568.A O no hydrogen 3.475 N/A LEU 667.A N GLY 569.A O no hydrogen 2.783 N/A GLN 678.A N ALA 675.A O no hydrogen 3.374 N/A GLU 680.A N GLY 677.A O no hydrogen 2.795 N/A THR 681.A N GLY 677.A O no hydrogen 2.820 N/A THR 681.A OG1 GLN 678.A O no hydrogen 2.767 N/A VAL 682.A N GLN 678.A O no hydrogen 3.409 N/A GLY 683.A N LYS 679.A O no hydrogen 3.077 N/A LYS 684.A N GLU 680.A O no hydrogen 2.868 N/A SER 685.A N THR 681.A O no hydrogen 2.869 N/A SER 685.A OG THR 681.A O no hydrogen 3.496 N/A LEU 686.A N VAL 682.A O no hydrogen 2.700 N/A ARG 687.A N GLY 683.A O no hydrogen 2.958 N/A GLU 688.A N LYS 684.A O no hydrogen 2.808 N/A VAL 689.A N SER 685.A O no hydrogen 2.829 N/A ASN 690.A N LEU 686.A O no hydrogen 2.737 N/A ASN 690.A ND2 LEU 686.A O no hydrogen 2.736 N/A ARG 691.A N ARG 687.A O no hydrogen 2.944 N/A ARG 692.A N GLU 688.A O no hydrogen 2.843 N/A PHE 693.A N VAL 689.A O no hydrogen 3.070 N/A LEU 700.A N ILE 662.A O no hydrogen 3.208 N/A VAL 703.A N ASP 701.A OD1 no hydrogen 3.047 N/A LYS 704.A N ASP 701.A OD2 no hydrogen 2.353 N/A ASN 705.A N ASP 701.A O no hydrogen 2.827 N/A MET 706.A N ASP 701.A O no hydrogen 3.269 N/A MET 706.A N PRO 702.A O no hydrogen 3.170 N/A ILE 708.A N PRO 702.A O no hydrogen 3.182 N/A LEU 714.A N ASP 710.A O no hydrogen 3.132 N/A LYS 715.A N GLU 711.A O no hydrogen 3.402 N/A MET 717.A N PHE 713.A O no hydrogen 3.242 N/A LYS 718.A N LEU 714.A O no hydrogen 2.805 N/A LYS 719.A N LYS 715.A O no hydrogen 2.848 N/A ILE 720.A N LEU 716.A O no hydrogen 3.040 N/A ASP 721.A N MET 717.A O no hydrogen 3.124 N/A VAL 722.A N LYS 718.A O no hydrogen 2.927 N/A LEU 723.A N LYS 719.A O no hydrogen 2.937 N/A ASN 724.A N ILE 720.A O no hydrogen 2.896 N/A THR 725.A N ASP 721.A O no hydrogen 2.952 N/A THR 725.A OG1 ASP 721.A O no hydrogen 2.757 N/A LYS 726.A N VAL 722.A O no hydrogen 3.297 N/A LEU 727.A N LEU 723.A O no hydrogen 2.750 N/A SER 728.A N ASN 724.A O no hydrogen 3.234 N/A SER 728.A OG THR 725.A O no hydrogen 3.080 N/A SER 729.A N THR 725.A O no hydrogen 2.755 N/A SER 729.A OG SER 729.A O no hydrogen 2.503 N/A ASN 730.A N LEU 727.A O no hydrogen 3.069 N/A SER 735.A OG SER 735.A O no hydrogen 2.615 N/A ARG 737.A NH1 GLU 530.A OE1 no hydrogen 2.298 N/A GLU 740.A N ARG 737.A O no hydrogen 2.855 N/A LEU 741.A N ARG 737.A O no hydrogen 2.614 N/A TYR 742.A N LEU 738.A O no hydrogen 2.924 N/A LYS 744.A N GLU 740.A O no hydrogen 3.165 N/A TYR 745.A N LEU 741.A O no hydrogen 3.016 N/A SER 746.A N TYR 742.A O no hydrogen 2.604 N/A ARG 747.A N GLY 743.A O no hydrogen 3.272 N/A LYS 748.A N LYS 744.A O no hydrogen 3.384 N/A HIS 749.A N TYR 745.A O no hydrogen 2.908 N/A ASP 750.A N SER 746.A O no hydrogen 2.793 N/A LEU 751.A N ARG 747.A O no hydrogen 3.063 N/A HIS 752.A N LYS 748.A O no hydrogen 3.003 N/A GLU 753.A N HIS 749.A O no hydrogen 2.949 N/A ASP 754.A N ASP 750.A O no hydrogen 3.104 N/A MET 755.A N LEU 751.A O no hydrogen 2.920 N/A LYS 756.A N HIS 752.A O no hydrogen 3.039 N/A GLN 757.A N GLU 753.A O no hydrogen 3.280 N/A LEU 758.A N ASP 754.A O no hydrogen 3.222 N/A LYS 759.A N MET 755.A O no hydrogen 2.993 N/A LYS 761.A N GLN 757.A O no hydrogen 3.241 N/A ILE 762.A N LEU 758.A O no hydrogen 3.341 N/A SER 763.A OG ILE 762.A O no hydrogen 2.293 N/A GLU 764.A N ILE 762.A O no hydrogen 2.880 N/A LEU 772.A N GLN 768.A O no hydrogen 3.463 N/A ARG 773.A N LEU 769.A O no hydrogen 2.576 N/A ARG 774.A N ASP 770.A O no hydrogen 2.428 N/A ARG 775.A N ASP 771.A O no hydrogen 2.578 N/A LYS 776.A N LEU 772.A O no hydrogen 2.983 N/A LYS 776.A NZ GLU 494.A OE2 no hydrogen 3.140 N/A ARG 777.A N ARG 773.A O no hydrogen 2.949 N/A VAL 778.A N ARG 774.A O no hydrogen 3.024 N/A LEU 779.A N ARG 775.A O no hydrogen 2.649 N/A ARG 780.A N LYS 776.A O no hydrogen 2.643 N/A ARG 780.A NH1 ASN 788.A OD1 no hydrogen 3.186 N/A GLY 783.A N LEU 779.A O no hydrogen 2.799 N/A PHE 784.A N LEU 779.A O no hydrogen 3.351 N/A CYS 785.A N ASP 789.A O no hydrogen 2.724 N/A CYS 785.A SG ASP 789.A O no hydrogen 3.025 N/A ASN 788.A N CYS 785.A O no hydrogen 2.771 N/A ILE 791.A N GLY 783.A O no hydrogen 2.953 N/A GLY 795.A N GLU 792.A O no hydrogen 2.538 N/A GLU 800.A N VAL 797.A O no hydrogen 2.628 N/A SER 803.A OG GLU 800.A OE1 no hydrogen 2.092 N/A GLU 806.A N GLU 806.A OE1 no hydrogen 2.993 N/A LEU 809.A N ASP 805.A O no hydrogen 3.418 N/A THR 810.A N GLU 806.A O no hydrogen 2.985 N/A THR 810.A OG1 ARG 796.A O no hydrogen 2.317 N/A THR 810.A OG1 GLU 806.A O no hydrogen 2.741 N/A GLU 811.A N LEU 807.A O no hydrogen 3.356 N/A LEU 812.A N LEU 808.A O no hydrogen 3.176 N/A GLY 816.A N LEU 812.A O no hydrogen 2.857 N/A LYS 822.A N ASN 819.A OD1 no hydrogen 2.696 N/A GLN 825.A N LYS 822.A O no hydrogen 3.392 N/A ALA 827.A N GLU 824.A O no hydrogen 2.985 N/A ALA 828.A N GLN 825.A O no hydrogen 3.244 N/A LEU 829.A N ALA 826.A O no hydrogen 3.100 N/A LEU 830.A N ALA 826.A O no hydrogen 2.877 N/A SER 831.A N ALA 827.A O no hydrogen 3.280 N/A SER 831.A OG ALA 827.A O no hydrogen 2.864 N/A CYS 832.A SG LEU 829.A O no hydrogen 3.653 N/A GLU 842.A N LYS 838.A O no hydrogen 2.829 N/A ALA 844.A N MET 840.A O no hydrogen 2.677 N/A ILE 847.A N ILE 843.A O no hydrogen 3.015 N/A ALA 848.A N ALA 844.A O no hydrogen 2.420 N/A ILE 850.A N LYS 846.A O no hydrogen 2.966 N/A MET 851.A N ILE 847.A O no hydrogen 3.002 N/A LYS 852.A N ALA 848.A O no hydrogen 2.927 N/A ASP 853.A N LYS 849.A O no hydrogen 2.349 N/A SER 854.A N ILE 850.A O no hydrogen 2.464 N/A SER 854.A OG ILE 850.A O no hydrogen 3.542 N/A LYS 855.A N LYS 852.A O no hydrogen 3.117 N/A ILE 856.A N MET 851.A O no hydrogen 2.696 N/A ASP 862.A N GLU 860.A O no hydrogen 2.155 N/A TYR 863.A N VAL 859.A O no hydrogen 2.961 N/A GLU 865.A N LYS 861.A O no hydrogen 2.322 N/A SER 866.A N TYR 863.A O no hydrogen 3.344 N/A ARG 868.A N ALA 828.A O no hydrogen 2.588 N/A MET 872.A N HIS 869.A O no hydrogen 3.028 N/A GLU 877.A N GLU 873.A O no hydrogen 3.263 N/A GLU 877.A N VAL 874.A O no hydrogen 3.139 N/A TRP 878.A N VAL 874.A O no hydrogen 3.325 N/A ARG 880.A N GLU 877.A O no hydrogen 2.966 N/A GLY 881.A N TRP 878.A O no hydrogen 3.105 N/A ILE 886.A N THR 882.A O no hydrogen 3.194 N/A CYS 887.A SG PHE 883.A O no hydrogen 3.053 N/A LYS 888.A N GLN 885.A O no hydrogen 2.723 N/A MET 889.A N ILE 886.A O no hydrogen 3.028 N/A ASP 891.A N THR 890.A OG1 no hydrogen 2.538 N/A SER 896.A N TYR 893.A O no hydrogen 2.843 N/A MET 900.A N SER 896.A O no hydrogen 3.132 N/A PHE 901.A N LEU 897.A O no hydrogen 2.510 N/A LEU 904.A N MET 900.A O no hydrogen 2.415 N/A GLU 905.A N PHE 901.A O no hydrogen 3.007 N/A GLU 906.A N LYS 902.A O no hydrogen 3.279 N/A VAL 908.A N LEU 904.A O no hydrogen 3.299 N/A LYS 909.A N GLU 905.A O no hydrogen 2.858 N/A ILE 916.A N THR 915.A OG1 no hydrogen 2.547 N/A ASN 917.A ND2 ILE 813.A O no hydrogen 3.359 N/A LEU 920.A N ASN 917.A O no hydrogen 2.637 N/A GLU 922.A N SER 918.A O no hydrogen 3.205 N/A MET 924.A N LEU 920.A O no hydrogen 2.962 N/A GLU 925.A N GLU 922.A O no hydrogen 2.965 N/A ALA 926.A N GLU 922.A O no hydrogen 3.195 N/A VAL 927.A N LYS 923.A O no hydrogen 3.152 N/A LEU 928.A N MET 924.A O no hydrogen 2.676 N/A LEU 928.A N GLU 925.A O no hydrogen 3.186 N/A LYS 929.A N ALA 926.A O no hydrogen 2.900 N/A LEU 930.A N ALA 926.A O no hydrogen 2.942 N/A ASP 934.A N ILE 931.A O no hydrogen 3.452 N/A ILE 935.A N HIS 932.A O no hydrogen 3.172 N/A