Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6crz_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N THR 133.A O no hydrogen 3.480 N/A ARG 1.A N PHE 136.A O no hydrogen 3.422 N/A CYS 2.A SG GLU 114.A O no hydrogen 3.552 N/A CYS 2.A SG ILE 135.A O no hydrogen 3.253 N/A THR 4.A OG1 PHE 5.A O no hydrogen 3.403 N/A ASP 7.A N ASP 6.A OD1 no hydrogen 2.722 N/A GLN 9.A NE2 ASP 7.A OD1 no hydrogen 3.013 N/A THR 14.A N GLY 51.A O no hydrogen 3.164 N/A THR 14.A OG1 GLY 51.A O no hydrogen 2.704 N/A THR 14.A OG1 ASP 191.A OD1 no hydrogen 3.391 N/A SER 18.A N SER 47.A O no hydrogen 2.454 N/A SER 19.A OG SER 194.A OG no hydrogen 3.272 N/A ARG 21.A NH1 GLU 167.A OE2 no hydrogen 3.214 N/A TYR 24.A OH LEU 41.A O no hydrogen 2.958 N/A TYR 25.A N LEU 199.A O no hydrogen 3.302 N/A ASP 33.A N ASP 247.A O no hydrogen 3.183 N/A THR 34.A N TYR 246.A O no hydrogen 3.448 N/A TYR 36.A N LEU 244.A O no hydrogen 3.293 N/A THR 38.A N PHE 242.A O no hydrogen 3.186 N/A LEU 41.A N ASP 40.A OD1 no hydrogen 2.731 N/A PHE 42.A N LYS 238.A O no hydrogen 2.726 N/A TYR 46.A N SER 19.A O no hydrogen 3.339 N/A SER 47.A N SER 18.A O no hydrogen 3.089 N/A VAL 49.A N HIS 16.A O no hydrogen 2.925 N/A THR 50.A N VAL 234.A O no hydrogen 3.377 N/A GLY 51.A N THR 14.A O no hydrogen 2.417 N/A PHE 52.A N TYR 232.A O no hydrogen 2.930 N/A HIS 53.A N ASN 12.A OD1 no hydrogen 3.118 N/A THR 54.A N ALA 230.A O no hydrogen 2.456 N/A HIS 57.A N ILE 55.A O no hydrogen 2.622 N/A THR 58.A N ILE 55.A O no hydrogen 3.322 N/A PHE 59.A N GLN 9.A O no hydrogen 3.038 N/A ILE 64.A N PHE 214.A O no hydrogen 2.830 N/A PHE 66.A N THR 212.A O no hydrogen 3.050 N/A ASP 68.A N PHE 66.A O no hydrogen 2.794 N/A TYR 71.A N GLY 235.A O no hydrogen 2.602 N/A TYR 71.A OH GLU 167.A OE2 no hydrogen 3.099 N/A PHE 72.A N PHE 168.A O no hydrogen 2.931 N/A ALA 74.A N ARG 166.A O no hydrogen 2.924 N/A THR 75.A OG1 ALA 231.A O no hydrogen 3.157 N/A GLU 76.A N HIS 164.A O no hydrogen 2.992 N/A LYS 77.A NZ GLY 160.A O no hydrogen 2.402 N/A ASN 79.A ND2 ASP 154.A O no hydrogen 3.408 N/A VAL 80.A N GLU 76.A OE1 no hydrogen 2.838 N/A ARG 82.A N ILE 217.A O no hydrogen 3.147 N/A ARG 82.A NE ASN 79.A O no hydrogen 2.506 N/A ARG 82.A NH1 GLN 130.A OE1 no hydrogen 2.458 N/A ARG 82.A NH2 SER 78.A O no hydrogen 3.557 N/A VAL 85.A N ARG 215.A O no hydrogen 2.418 N/A PHE 86.A N VAL 97.A O no hydrogen 2.613 N/A GLY 87.A N ASN 213.A O no hydrogen 3.359 N/A THR 89.A OG1 ASN 91.A O no hydrogen 3.472 N/A THR 89.A OG1 ASN 91.A OD1 no hydrogen 3.548 N/A LYS 93.A N ASN 91.A OD1 no hydrogen 3.458 N/A SER 96.A N CYS 111.A O no hydrogen 2.648 N/A VAL 97.A N PHE 86.A O no hydrogen 2.945 N/A ILE 99.A N TRP 84.A O no hydrogen 3.080 N/A ILE 100.A N VAL 107.A O no hydrogen 3.043 N/A ASN 101.A N ARG 82.A O no hydrogen 3.246 N/A ASN 102.A N ASN 105.A O no hydrogen 3.367 N/A SER 103.A N ASN 101.A OD1 no hydrogen 3.429 N/A SER 103.A OG ASN 102.A O no hydrogen 2.592 N/A THR 104.A OG1 ASN 102.A O no hydrogen 3.556 N/A THR 104.A OG1 ASN 102.A OD1 no hydrogen 3.377 N/A ASN 105.A N ASN 102.A OD1 no hydrogen 3.213 N/A ASN 105.A ND2 SER 148.A O no hydrogen 3.157 N/A ASN 105.A ND2 ASP 149.A O no hydrogen 2.847 N/A VAL 106.A N SER 148.A OG no hydrogen 2.612 N/A VAL 107.A N ILE 100.A O no hydrogen 3.080 N/A ILE 108.A N TYR 146.A O no hydrogen 2.894 N/A ALA 110.A N PHE 144.A O no hydrogen 2.561 N/A CYS 111.A N SER 96.A O no hydrogen 2.965 N/A ASN 112.A N PHE 140.A O no hydrogen 2.491 N/A GLU 114.A N ASN 138.A O no hydrogen 2.968 N/A PHE 120.A N MET 134.A O no hydrogen 3.380 N/A PHE 121.A N LEU 218.A O no hydrogen 2.718 N/A VAL 123.A N ALA 220.A O no hydrogen 2.823 N/A SER 124.A N THR 129.A O no hydrogen 3.178 N/A LYS 125.A NZ GLU 157.A OE1 no hydrogen 2.437 N/A GLY 128.A N SER 124.A O no hydrogen 2.425 N/A GLN 130.A NE2 ASN 101.A O no hydrogen 2.576 N/A THR 131.A N ALA 122.A O no hydrogen 2.953 N/A THR 131.A OG1 HIS 132.A ND1 no hydrogen 2.633 N/A HIS 132.A ND1 THR 131.A OG1 no hydrogen 2.633 N/A ILE 135.A N THR 133.A O no hydrogen 2.651 N/A ASP 137.A N GLU 114.A O no hydrogen 3.388 N/A ALA 139.A N ASN 138.A OD1 no hydrogen 2.675 N/A PHE 140.A N ASN 112.A O no hydrogen 3.192 N/A THR 143.A N ALA 110.A O no hydrogen 2.747 N/A THR 143.A OG1 ALA 110.A O no hydrogen 3.006 N/A TYR 146.A N ILE 108.A O no hydrogen 2.987 N/A SER 148.A N VAL 106.A O no hydrogen 2.757 N/A SER 148.A OG VAL 106.A O no hydrogen 3.522 N/A SER 148.A OG ASP 149.A O no hydrogen 3.235 N/A PHE 151.A N THR 104.A O no hydrogen 3.125 N/A LYS 158.A N SER 78.A OG no hydrogen 3.035 N/A LYS 158.A NZ ASP 154.A OD2 no hydrogen 3.182 N/A HIS 164.A N GLU 76.A O no hydrogen 3.338 N/A LEU 165.A N GLN 184.A O no hydrogen 3.440 N/A ARG 166.A N ALA 74.A O no hydrogen 2.912 N/A ARG 166.A NH2 VAL 81.A O no hydrogen 2.460 N/A GLU 167.A N GLY 182.A O no hydrogen 2.995 N/A PHE 168.A N PHE 72.A O no hydrogen 2.658 N/A VAL 169.A N TYR 180.A O no hydrogen 3.390 N/A PHE 170.A N ILE 70.A O no hydrogen 3.103 N/A LYS 171.A NZ TYR 24.A OH no hydrogen 2.993 N/A LYS 171.A NZ ASP 40.A OD1 no hydrogen 2.715 N/A LYS 171.A NZ ASP 40.A OD2 no hydrogen 2.943 N/A ASN 172.A N ASP 68.A O no hydrogen 3.398 N/A ASN 172.A ND2 ILE 211.A O no hydrogen 3.587 N/A LYS 173.A N PHE 176.A O no hydrogen 3.029 N/A LYS 173.A NZ ASP 174.A OD2 no hydrogen 2.794 N/A PHE 176.A N LYS 173.A O no hydrogen 2.755 N/A LEU 177.A N LEU 205.A O no hydrogen 3.135 N/A TYR 178.A N LYS 171.A O no hydrogen 2.477 N/A TYR 180.A N VAL 169.A O no hydrogen 3.024 N/A LYS 181.A N LYS 200.A O no hydrogen 3.044 N/A GLY 182.A N GLU 167.A O no hydrogen 3.096 N/A ILE 186.A N LYS 163.A O no hydrogen 2.715 N/A SER 194.A OG SER 19.A OG no hydrogen 3.272 N/A ASN 197.A ND2 TYR 183.A O no hydrogen 3.507 N/A THR 198.A OG1 ILE 252.A O no hydrogen 3.011 N/A LEU 199.A N VAL 23.A O no hydrogen 2.806 N/A LYS 200.A N LYS 181.A O no hydrogen 3.029 N/A PHE 203.A N VAL 179.A O no hydrogen 3.283 N/A LEU 205.A N LEU 177.A O no hydrogen 3.121 N/A LEU 207.A N LEU 205.A O no hydrogen 2.563 N/A THR 212.A N GLY 87.A O no hydrogen 2.921 N/A THR 212.A OG1 ASN 213.A OD1 no hydrogen 3.425 N/A ASN 213.A N GLY 87.A O no hydrogen 2.835 N/A PHE 214.A N ILE 64.A O no hydrogen 2.775 N/A ARG 215.A N VAL 85.A O no hydrogen 3.038 N/A ARG 215.A NH1 ASN 61.A O no hydrogen 2.383 N/A ILE 217.A N GLY 83.A O no hydrogen 2.563 N/A THR 219.A OG1 VAL 80.A O no hydrogen 2.604 N/A ALA 220.A N PHE 121.A O no hydrogen 2.667 N/A SER 222.A OG ILE 224.A O no hydrogen 3.131 N/A THR 227.A OG1 SER 228.A O no hydrogen 3.145 N/A SER 228.A OG GLU 157.A OE2 no hydrogen 2.771 N/A ALA 229.A N SER 228.A OG no hydrogen 2.522 N/A ALA 230.A N THR 54.A O no hydrogen 2.908 N/A TYR 232.A N PHE 52.A O no hydrogen 2.941 N/A TYR 232.A OH GLY 60.A O no hydrogen 2.331 N/A VAL 234.A N THR 50.A O no hydrogen 3.320 N/A GLY 235.A N TYR 71.A O no hydrogen 2.892 N/A LYS 238.A N PHE 42.A O no hydrogen 2.412 N/A THR 240.A OG1 ASP 257.A OD1 no hydrogen 3.349 N/A PHE 242.A N THR 38.A O no hydrogen 3.057 N/A MET 243.A N VAL 256.A O no hydrogen 2.967 N/A LEU 244.A N TYR 36.A O no hydrogen 3.069 N/A TYR 246.A N THR 34.A O no hydrogen 3.087 N/A ASP 247.A N THR 251.A O no hydrogen 3.067 N/A ASN 249.A N ASP 247.A OD1 no hydrogen 3.094 N/A THR 251.A N ASP 247.A OD1 no hydrogen 2.541 N/A ILE 252.A N TYR 25.A OH no hydrogen 3.254 N/A THR 253.A N LYS 245.A O no hydrogen 3.388 N/A VAL 256.A N MET 243.A O no hydrogen 3.067 N/A CYS 258.A N THR 241.A O no hydrogen 3.005 N/A SER 259.A OG ASP 257.A OD1 no hydrogen 2.955 N/A SER 259.A OG ASP 257.A OD2 no hydrogen 2.687 N/A GLN 260.A NE2 PHE 45.A O no hydrogen 3.079 N/A GLN 260.A NE2 ASP 257.A OD2 no hydrogen 3.131 N/A ALA 264.A N ASN 261.A OD1 no hydrogen 2.900 N/A LEU 266.A N LEU 263.A O no hydrogen 3.094 N/A CYS 268.A N ALA 264.A O no hydrogen 3.302 N/A CYS 268.A SG ASP 257.A O no hydrogen 3.888 N/A CYS 268.A SG ALA 264.A O no hydrogen 3.276 N/A SER 269.A N GLU 265.A O no hydrogen 2.657 N/A VAL 270.A N LEU 266.A O no hydrogen 3.219 N/A LYS 271.A NZ CYS 268.A O no hydrogen 3.241 N/A SER 272.A N LYS 267.A O no hydrogen 3.101 N/A SER 272.A OG GLU 274.A O no hydrogen 2.491 N/A GLU 274.A N SER 272.A OG no hydrogen 2.786 N/A ILE 275.A N THR 559.A OG1 no hydrogen 3.354 N/A LYS 277.A NZ ASP 620.A OD1 no hydrogen 3.348 N/A LYS 277.A NZ ASP 620.A OD2 no hydrogen 2.510 N/A GLY 278.A N THR 556.A O no hydrogen 3.136 N/A TYR 280.A N VAL 554.A O no hydrogen 2.968 N/A TYR 280.A OH ASP 276.A O no hydrogen 2.967 N/A GLN 281.A NE2 THR 282.A O no hydrogen 2.928 N/A THR 282.A N VAL 552.A O no hydrogen 3.147 N/A SER 283.A N THR 282.A OG1 no hydrogen 2.663 N/A PHE 285.A N GLY 550.A O no hydrogen 3.118 N/A ARG 286.A N THR 587.A O no hydrogen 3.201 N/A VAL 287.A N ALA 548.A O no hydrogen 3.366 N/A VAL 288.A N GLN 585.A O no hydrogen 3.130 N/A SER 290.A N CYS 495.A O no hydrogen 2.461 N/A VAL 294.A N THR 488.A OG1 no hydrogen 2.533 N/A ARG 295.A N ASN 499.A O no hydrogen 3.394 N/A ARG 295.A NE ASP 535.A OD1 no hydrogen 3.423 N/A ARG 295.A NE ASP 535.A OD2 no hydrogen 3.200 N/A ARG 295.A NH1 THR 488.A O no hydrogen 3.246 N/A ARG 295.A NH2 ASP 535.A OD2 no hydrogen 3.133 N/A THR 300.A OG1 ASN 327.A O no hydrogen 2.342 N/A CYS 303.A SG ASN 301.A O no hydrogen 3.551 N/A CYS 303.A SG ASN 301.A OD1 no hydrogen 3.751 N/A GLU 307.A N GLU 307.A OE1 no hydrogen 2.708 N/A VAL 308.A N PHE 305.A O no hydrogen 3.236 N/A ASN 310.A N GLY 306.A O no hydrogen 3.084 N/A TRP 320.A NE1 GLU 429.A O no hydrogen 2.487 N/A GLU 321.A N SER 363.A O no hydrogen 3.225 N/A ILE 325.A N VAL 359.A O no hydrogen 2.664 N/A ASN 327.A N THR 480.A O no hydrogen 3.068 N/A CYS 328.A SG SER 326.A O no hydrogen 3.521 N/A SER 333.A N ASP 331.A OD1 no hydrogen 3.200 N/A SER 333.A OG ASP 331.A OD1 no hydrogen 3.330 N/A SER 333.A OG ASP 331.A OD2 no hydrogen 2.939 N/A LEU 335.A N TYR 332.A O no hydrogen 3.282 N/A ASN 337.A N SER 333.A O no hydrogen 2.808 N/A SER 338.A N TYR 336.A O no hydrogen 2.948 N/A SER 338.A OG PHE 309.A O no hydrogen 3.200 N/A PHE 340.A N SER 338.A OG no hydrogen 2.931 N/A SER 342.A N ALA 399.A O no hydrogen 3.370 N/A THR 343.A OG1 ALA 399.A O no hydrogen 3.081 N/A LYS 345.A NZ CYS 346.A O no hydrogen 2.494 N/A TYR 347.A N GLY 395.A O no hydrogen 2.823 N/A LYS 350.A NZ TYR 347.A O no hydrogen 3.194 N/A LEU 354.A N ASN 352.A O no hydrogen 2.937 N/A CYS 355.A SG LEU 354.A O no hydrogen 3.074 N/A ASN 358.A N SER 357.A OG no hydrogen 2.437 N/A VAL 359.A N ILE 325.A O no hydrogen 3.326 N/A TYR 360.A N SER 477.A O no hydrogen 2.995 N/A ALA 361.A N LYS 323.A O no hydrogen 2.590 N/A ASP 362.A N VAL 475.A O no hydrogen 2.579 N/A SER 363.A N GLU 321.A O no hydrogen 3.130 N/A PHE 364.A N VAL 473.A O no hydrogen 3.149 N/A VAL 365.A N PRO 315.A O no hydrogen 3.232 N/A VAL 366.A N TYR 471.A O no hydrogen 3.084 N/A LYS 367.A NZ TYR 458.A O no hydrogen 2.631 N/A ASP 369.A N GLY 467.A O no hydrogen 2.885 N/A ASP 370.A N LYS 367.A O no hydrogen 2.889 N/A ILE 374.A N VAL 371.A O no hydrogen 3.336 N/A GLY 380.A N GLN 378.A O no hydrogen 2.707 N/A ASP 384.A N GLY 380.A O no hydrogen 2.620 N/A ASN 386.A N ILE 382.A O no hydrogen 2.935 N/A ASN 386.A ND2 ARG 418.A O no hydrogen 3.139 N/A TYR 387.A N ILE 382.A O no hydrogen 2.403 N/A TYR 387.A OH ASP 362.A OD2 no hydrogen 2.312 N/A LYS 388.A NZ LEU 425.A O no hydrogen 2.694 N/A VAL 397.A N LYS 345.A O no hydrogen 3.189 N/A LEU 398.A N VAL 474.A O no hydrogen 2.814 N/A ALA 399.A N THR 343.A OG1 no hydrogen 2.841 N/A THR 402.A OG1 ASP 406.A OD2 no hydrogen 3.392 N/A THR 402.A OG1 PRO 470.A O no hydrogen 2.268 N/A ARG 403.A N ASN 401.A OD1 no hydrogen 3.342 N/A ASP 406.A N THR 402.A O no hydrogen 3.297 N/A THR 408.A N PHE 460.A O no hydrogen 3.482 N/A GLY 411.A N THR 408.A O no hydrogen 3.450 N/A ASN 412.A N PHE 460.A O no hydrogen 3.025 N/A ASN 412.A ND2 ASP 406.A O no hydrogen 2.858 N/A TYR 413.A N GLY 411.A O no hydrogen 2.745 N/A ARG 418.A N ASN 386.A OD1 no hydrogen 2.618 N/A TYR 419.A OH TRP 453.A O no hydrogen 2.701 N/A ARG 421.A NE GLY 423.A O no hydrogen 3.279 N/A ARG 421.A NH1 TYR 385.A O no hydrogen 2.640 N/A ARG 421.A NH2 TYR 385.A O no hydrogen 3.543 N/A ARG 421.A NH2 GLY 423.A O no hydrogen 3.239 N/A LYS 424.A NZ ASP 384.A OD2 no hydrogen 2.390 N/A LYS 424.A NZ TYR 385.A OH no hydrogen 3.082 N/A LEU 425.A N ASP 384.A O no hydrogen 2.989 N/A ARG 426.A N GLU 429.A OE1 no hydrogen 3.043 N/A ARG 426.A NH1 LYS 424.A O no hydrogen 3.421 N/A PHE 428.A N LYS 388.A O no hydrogen 2.801 N/A ASP 431.A N TYR 318.A O no hydrogen 2.771 N/A SER 438.A OG LYS 442.A O no hydrogen 3.215 N/A SER 438.A OG CYS 444.A O no hydrogen 3.556 N/A LYS 442.A N ASP 440.A OD1 no hydrogen 3.329 N/A CYS 444.A N LYS 442.A O no hydrogen 2.603 N/A CYS 444.A SG ASN 450.A O no hydrogen 3.319 N/A ALA 448.A N THR 445.A O no hydrogen 3.057 N/A CYS 451.A SG THR 445.A O no hydrogen 3.799 N/A CYS 451.A SG LEU 449.A O no hydrogen 3.256 N/A ASN 456.A N TYR 417.A O no hydrogen 3.321 N/A TYR 458.A OH LYS 416.A O no hydrogen 3.184 N/A TYR 461.A N GLY 459.A O no hydrogen 2.920 N/A THR 462.A N THR 408.A O no hydrogen 2.957 N/A THR 464.A OG1 TYR 461.A O no hydrogen 3.213 N/A GLN 469.A NE2 TYR 461.A O no hydrogen 2.724 N/A GLN 469.A NE2 THR 464.A O no hydrogen 3.386 N/A GLN 469.A NE2 GLY 465.A O no hydrogen 3.203 N/A TYR 471.A N VAL 366.A O no hydrogen 2.926 N/A ARG 472.A NE ASP 406.A OD2 no hydrogen 2.548 N/A ARG 472.A NH2 ASP 406.A OD1 no hydrogen 3.325 N/A VAL 473.A N PHE 364.A O no hydrogen 2.706 N/A VAL 474.A N LEU 398.A O no hydrogen 2.978 N/A VAL 475.A N ASP 362.A O no hydrogen 2.972 N/A LEU 476.A N CYS 396.A O no hydrogen 3.125 N/A SER 477.A N TYR 360.A O no hydrogen 2.664 N/A GLU 479.A N SER 477.A O no hydrogen 3.158 N/A VAL 481.A N PHE 356.A O no hydrogen 2.885 N/A GLY 483.A N LEU 354.A O no hydrogen 2.556 N/A LYS 485.A N GLY 483.A O no hydrogen 2.869 N/A LYS 485.A NZ ASN 298.A O no hydrogen 3.439 N/A THR 488.A N VAL 294.A O no hydrogen 2.723 N/A THR 488.A OG1 ASP 292.A O no hydrogen 3.376 N/A THR 488.A OG1 VAL 294.A O no hydrogen 3.429 N/A LYS 492.A NZ GLU 540.A OE1 no hydrogen 3.084 N/A LYS 492.A NZ GLU 540.A OE2 no hydrogen 2.903 N/A ASN 493.A N LEU 509.A O no hydrogen 2.580 N/A CYS 495.A SG VAL 287.A O no hydrogen 3.685 N/A VAL 496.A N GLY 507.A O no hydrogen 2.755 N/A ASN 497.A N GLY 291.A O no hydrogen 2.880 N/A PHE 498.A N GLY 505.A O no hydrogen 2.764 N/A ASN 499.A N VAL 293.A O no hydrogen 2.791 N/A PHE 500.A N LEU 503.A O no hydrogen 2.581 N/A GLY 505.A N PHE 498.A O no hydrogen 3.170 N/A GLY 507.A N VAL 496.A O no hydrogen 3.156 N/A VAL 508.A N SER 545.A O no hydrogen 2.507 N/A SER 512.A N ILE 541.A O no hydrogen 2.459 N/A SER 512.A OG ASP 543.A OD1 no hydrogen 3.248 N/A LYS 514.A N SER 512.A OG no hydrogen 3.174 N/A PHE 516.A N LYS 514.A O no hydrogen 2.731 N/A GLN 517.A N GLN 520.A OE1 no hydrogen 2.976 N/A GLN 520.A N GLN 517.A O no hydrogen 3.023 N/A GLY 523.A N SER 532.A O no hydrogen 2.452 N/A VAL 526.A N ASP 525.A OD1 no hydrogen 2.708 N/A ASP 528.A N SER 527.A OG no hydrogen 2.565 N/A SER 532.A OG LEU 542.A O no hydrogen 2.613 N/A VAL 533.A N LEU 542.A O no hydrogen 3.193 N/A ARG 534.A N GLN 521.A O no hydrogen 3.138 N/A ARG 534.A NH1 PRO 518.A O no hydrogen 3.013 N/A ARG 534.A NH2 PRO 518.A O no hydrogen 3.418 N/A ASP 535.A N GLU 540.A O no hydrogen 3.226 N/A LYS 537.A NZ SER 487.A OG no hydrogen 2.407 N/A THR 538.A OG1 ASP 535.A OD2 no hydrogen 3.029 N/A SER 539.A N ASP 535.A O no hydrogen 3.005 N/A LEU 542.A N VAL 533.A O no hydrogen 2.679 N/A ASP 543.A N THR 510.A O no hydrogen 2.585 N/A ILE 544.A N ASP 531.A O no hydrogen 2.479 N/A SER 545.A N VAL 508.A O no hydrogen 3.005 N/A SER 553.A N LEU 568.A O no hydrogen 2.775 N/A VAL 554.A N TYR 280.A O no hydrogen 2.948 N/A ILE 555.A N ALA 566.A O no hydrogen 2.800 N/A THR 556.A N GLY 278.A O no hydrogen 3.402 N/A GLY 558.A N THR 556.A OG1 no hydrogen 3.230 N/A THR 559.A N ILE 275.A O no hydrogen 3.300 N/A SER 562.A N GLY 558.A O no hydrogen 2.703 N/A SER 563.A N SER 562.A OG no hydrogen 2.498 N/A GLU 564.A N SER 562.A OG no hydrogen 3.245 N/A ALA 566.A N ILE 555.A O no hydrogen 3.035 N/A VAL 567.A N ILE 608.A O no hydrogen 3.253 N/A LEU 568.A N SER 553.A O no hydrogen 3.202 N/A GLN 570.A N GLY 551.A O no hydrogen 2.805 N/A GLN 570.A NE2 SER 553.A OG no hydrogen 3.211 N/A ASP 571.A N ALA 604.A O no hydrogen 2.771 N/A THR 575.A N ASN 573.A OD1 no hydrogen 3.389 N/A ASP 576.A N ASN 573.A O no hydrogen 3.314 N/A VAL 577.A N ASN 573.A O no hydrogen 3.271 N/A SER 578.A N CYS 574.A O no hydrogen 3.371 N/A THR 579.A OG1 THR 575.A O no hydrogen 2.501 N/A ALA 580.A N ASP 576.A O no hydrogen 3.070 N/A ILE 581.A N VAL 577.A O no hydrogen 3.210 N/A ALA 583.A N THR 579.A O no hydrogen 3.061 N/A ASP 584.A N ILE 581.A O no hydrogen 3.241 N/A GLN 585.A N ALA 580.A O no hydrogen 2.788 N/A GLN 585.A NE2 ALA 583.A O no hydrogen 3.408 N/A THR 587.A N ARG 286.A O no hydrogen 3.414 N/A ARG 591.A NH1 TYR 46.A O no hydrogen 2.868 N/A ARG 591.A NH2 TYR 46.A O no hydrogen 2.494 N/A ILE 592.A N GLN 260.A O no hydrogen 3.115 N/A ASN 597.A N THR 595.A OG1 no hydrogen 3.001 N/A PHE 600.A N LEU 607.A O no hydrogen 3.426 N/A THR 602.A N GLY 605.A O no hydrogen 3.200 N/A THR 602.A OG1 GLY 605.A O no hydrogen 2.733 N/A ALA 604.A N THR 602.A OG1 no hydrogen 2.945 N/A GLY 605.A N THR 602.A OG1 no hydrogen 2.871 N/A CYS 606.A N TYR 569.A O no hydrogen 3.113 N/A CYS 606.A SG VAL 572.A O no hydrogen 3.681 N/A LEU 607.A N PHE 600.A O no hydrogen 3.164 N/A ILE 608.A N VAL 567.A O no hydrogen 3.129 N/A GLY 609.A N ASN 598.A O no hydrogen 3.431 N/A GLU 611.A N ILE 636.A O no hydrogen 3.093 N/A VAL 613.A N ALA 638.A O no hydrogen 2.918 N/A THR 615.A OG1 SER 616.A O no hydrogen 3.450 N/A SER 616.A N THR 615.A OG1 no hydrogen 2.596 N/A ILE 623.A N ILE 627.A O no hydrogen 2.995 N/A GLY 624.A N ILE 627.A O no hydrogen 3.398 N/A CYS 628.A N TYR 639.A O no hydrogen 3.114 N/A ALA 629.A N ILE 621.A O no hydrogen 2.910 N/A SER 630.A N VAL 637.A O no hydrogen 3.005 N/A SER 630.A OG TYR 639.A OH no hydrogen 3.138 N/A SER 635.A N HIS 632.A O no hydrogen 2.616 N/A VAL 637.A N SER 630.A O no hydrogen 2.774 N/A ALA 638.A N GLU 611.A O no hydrogen 2.951 N/A TYR 639.A N CYS 628.A O no hydrogen 3.091 N/A TYR 639.A OH GLU 618.A O no hydrogen 2.900 N/A TYR 639.A OH SER 630.A OG no hydrogen 3.138 N/A MET 641.A N GLY 626.A O no hydrogen 3.282 N/A SER 642.A N TYR 617.A O no hydrogen 2.546 N/A SER 642.A OG GLY 644.A O no hydrogen 3.319 N/A SER 647.A OG SER 648.A O no hydrogen 3.522 N/A SER 652.A OG THR 655.A OG1 no hydrogen 2.824 N/A THR 655.A OG1 SER 652.A OG no hydrogen 2.824 N/A THR 655.A OG1 ASN 654.A O no hydrogen 2.628 N/A THR 660.A N SER 1000.A O no hydrogen 3.143 N/A THR 660.A N GLN 1001.A O no hydrogen 3.238 N/A THR 660.A OG1 GLN 1001.A O no hydrogen 2.642 N/A ASN 661.A ND2 GLN 1001.A OE1 no hydrogen 3.518 N/A PHE 662.A N ASN 661.A OD1 no hydrogen 2.651 N/A SER 663.A N VAL 998.A O no hydrogen 3.107 N/A SER 663.A OG ILE 664.A O no hydrogen 3.264 N/A THR 668.A OG1 PHE 992.A O no hydrogen 2.270 N/A GLU 669.A N PHE 992.A O no hydrogen 3.408 N/A LYS 677.A NZ PRO 792.A O no hydrogen 3.005 N/A SER 679.A N THR 789.A O no hydrogen 3.446 N/A TYR 685.A N ASP 681.A O no hydrogen 2.739 N/A TYR 685.A N CYS 682.A O no hydrogen 2.846 N/A TYR 685.A OH LEU 892.A O no hydrogen 2.520 N/A ILE 686.A N CYS 682.A O no hydrogen 2.406 N/A SER 690.A OG GLU 692.A OE1 no hydrogen 3.153 N/A GLU 692.A N GLU 692.A OE1 no hydrogen 2.773 N/A ASN 695.A N THR 691.A O no hydrogen 2.812 N/A LEU 696.A N CYS 693.A O no hydrogen 2.945 N/A LEU 697.A N CYS 693.A O no hydrogen 2.905 N/A TYR 700.A N LEU 697.A O no hydrogen 2.974 N/A TYR 700.A OH THR 928.A OG1 no hydrogen 2.903 N/A GLY 701.A N LEU 698.A O no hydrogen 3.313 N/A PHE 703.A N GLY 701.A O no hydrogen 2.634 N/A LEU 707.A N PHE 703.A O no hydrogen 2.938 N/A ARG 709.A N THR 705.A O no hydrogen 3.326 N/A ALA 710.A N GLN 706.A O no hydrogen 3.284 N/A ALA 710.A N LEU 707.A O no hydrogen 3.004 N/A LEU 711.A N LEU 707.A O no hydrogen 3.048 N/A SER 712.A N ASN 708.A O no hydrogen 3.076 N/A GLY 713.A N ARG 709.A O no hydrogen 3.003 N/A ILE 714.A N ALA 710.A O no hydrogen 2.957 N/A ALA 715.A N LEU 711.A O no hydrogen 2.807 N/A ALA 716.A N SER 712.A O no hydrogen 3.018 N/A GLU 717.A N ILE 714.A O no hydrogen 3.213 N/A GLN 718.A N ALA 715.A O no hydrogen 3.355 N/A GLN 718.A NE2 ILE 714.A O no hydrogen 3.621 N/A ASP 719.A N ALA 716.A O no hydrogen 3.310 N/A ARG 720.A N ALA 716.A O no hydrogen 3.375 N/A ARG 720.A NE GLU 717.A OE1 no hydrogen 2.411 N/A ARG 720.A NH2 GLU 717.A OE1 no hydrogen 3.028 N/A ASN 721.A N GLU 717.A O no hydrogen 2.746 N/A THR 722.A OG1 GLN 718.A O no hydrogen 3.081 N/A ARG 723.A N ASP 719.A O no hydrogen 3.076 N/A GLU 724.A N ARG 720.A O no hydrogen 3.214 N/A VAL 725.A N THR 722.A O no hydrogen 3.279 N/A PHE 726.A N THR 722.A O no hydrogen 3.170 N/A ALA 727.A N ARG 723.A O no hydrogen 3.231 N/A GLN 728.A NE2 GLU 724.A O no hydrogen 3.070 N/A GLN 728.A NE2 ALA 956.A O no hydrogen 3.518 N/A PHE 741.A N PHE 744.A O no hydrogen 3.295 N/A ASN 745.A N ASN 858.A OD1 no hydrogen 3.058 N/A SER 747.A N ASN 745.A OD1 no hydrogen 3.403 N/A LEU 750.A N PHE 746.A O no hydrogen 3.245 N/A ASP 752.A N ARG 759.A O no hydrogen 3.129 N/A LYS 755.A N ASP 752.A O no hydrogen 3.243 N/A LYS 755.A NZ ARG 759.A O no hydrogen 2.579 N/A LYS 755.A NZ ASP 764.A OD2 no hydrogen 2.621 N/A ARG 759.A N THR 757.A O no hydrogen 2.648 N/A SER 760.A OG GLN 984.A OE1 no hydrogen 3.257 N/A ILE 762.A N GLN 748.A O no hydrogen 3.445 N/A GLU 763.A N SER 760.A OG no hydrogen 3.270 N/A ASP 764.A N SER 760.A O no hydrogen 3.093 N/A LEU 766.A N ILE 762.A O no hydrogen 3.246 N/A PHE 767.A N GLU 763.A O no hydrogen 2.884 N/A PHE 767.A N ASP 764.A O no hydrogen 3.293 N/A ASN 768.A N ASP 764.A O no hydrogen 3.310 N/A LYS 769.A N LEU 765.A O no hydrogen 3.269 N/A LYS 769.A NZ THR 869.A O no hydrogen 2.775 N/A THR 771.A N PHE 767.A O no hydrogen 3.172 N/A THR 771.A OG1 PHE 767.A O no hydrogen 2.386 N/A CYS 776.A SG ALA 782.A O no hydrogen 3.885 N/A THR 789.A N SER 679.A O no hydrogen 3.059 N/A THR 789.A OG1 GLY 774.A O no hydrogen 3.193 N/A THR 789.A OG1 VAL 790.A O no hydrogen 3.299 N/A LEU 791.A N LYS 677.A O no hydrogen 2.900 N/A ASP 798.A N ASP 797.A OD1 no hydrogen 2.593 N/A ILE 800.A N THR 796.A O no hydrogen 2.707 N/A ALA 801.A N ASP 797.A O no hydrogen 2.613 N/A ALA 802.A N ASP 798.A O no hydrogen 2.645 N/A TYR 803.A N MET 799.A O no hydrogen 2.744 N/A THR 804.A N ALA 801.A O no hydrogen 2.945 N/A THR 804.A OG1 ILE 800.A O no hydrogen 2.368 N/A ALA 805.A N ALA 801.A O no hydrogen 2.851 N/A LEU 807.A N THR 804.A O no hydrogen 3.132 N/A VAL 808.A N ALA 805.A O no hydrogen 2.898 N/A SER 809.A N ALA 805.A O no hydrogen 2.944 N/A SER 809.A OG LYS 734.A O no hydrogen 3.488 N/A SER 809.A OG ALA 805.A O no hydrogen 3.541 N/A THR 811.A OG1 LEU 807.A O no hydrogen 2.355 N/A ALA 812.A N VAL 808.A O no hydrogen 2.755 N/A ALA 812.A N SER 809.A O no hydrogen 3.116 N/A THR 813.A OG1 SER 809.A O no hydrogen 3.055 N/A ALA 814.A N GLY 810.A O no hydrogen 2.923 N/A GLY 815.A N GLY 810.A O no hydrogen 3.040 N/A THR 817.A N ALA 814.A O no hydrogen 3.155 N/A THR 817.A OG1 ALA 814.A O no hydrogen 2.328 N/A THR 817.A OG1 LEU 824.A O no hydrogen 3.241 N/A GLY 819.A N TRP 816.A O no hydrogen 3.191 N/A ALA 820.A N TRP 816.A O no hydrogen 2.968 N/A LEU 824.A N THR 817.A OG1 no hydrogen 2.877 N/A GLN 831.A N PRO 827.A O no hydrogen 3.074 N/A MET 832.A N PHE 828.A O no hydrogen 2.878 N/A ALA 833.A N ALA 829.A O no hydrogen 2.886 N/A TYR 834.A N MET 830.A O no hydrogen 2.831 N/A ARG 835.A N GLN 831.A O no hydrogen 2.871 N/A ARG 835.A NH1 LEU 979.A O no hydrogen 2.806 N/A PHE 836.A N MET 832.A O no hydrogen 2.661 N/A ASN 837.A N ALA 833.A O no hydrogen 3.162 N/A GLY 838.A N ARG 835.A O no hydrogen 2.735 N/A GLN 843.A N GLN 843.A OE1 no hydrogen 2.722 N/A VAL 845.A N THR 842.A O no hydrogen 3.335 N/A GLU 848.A N ASN 844.A O no hydrogen 2.384 N/A ASN 849.A N VAL 845.A O no hydrogen 2.576 N/A GLN 852.A NE2 ASN 661.A OD1 no hydrogen 3.439 N/A ILE 853.A N ASN 849.A O no hydrogen 2.706 N/A ALA 854.A N GLN 850.A O no hydrogen 2.544 N/A ASN 855.A N LYS 851.A O no hydrogen 3.192 N/A ASN 855.A N GLN 852.A O no hydrogen 3.053 N/A GLN 856.A N GLN 852.A O no hydrogen 2.596 N/A GLN 856.A NE2 PHE 662.A O no hydrogen 3.538 N/A PHE 857.A N ILE 853.A O no hydrogen 2.901 N/A ASN 858.A N ALA 854.A O no hydrogen 3.445 N/A ASN 858.A ND2 GLY 743.A O no hydrogen 3.102 N/A LYS 859.A N ASN 855.A O no hydrogen 2.955 N/A ILE 861.A N PHE 857.A O no hydrogen 3.084 N/A SER 862.A OG GLN 865.A OE1 no hydrogen 3.311 N/A GLN 863.A N LYS 859.A O no hydrogen 2.692 N/A ILE 864.A N ILE 861.A O no hydrogen 2.860 N/A GLN 865.A N ILE 861.A O no hydrogen 2.978 N/A SER 867.A N GLN 863.A O no hydrogen 3.200 N/A LEU 868.A N ILE 864.A O no hydrogen 2.855 N/A THR 869.A OG1 GLN 865.A O no hydrogen 2.268 N/A THR 870.A N GLU 866.A O no hydrogen 3.490 N/A THR 870.A OG1 GLU 866.A O no hydrogen 3.292 N/A THR 870.A OG1 THR 870.A O no hydrogen 2.585 N/A THR 873.A N THR 871.A OG1 no hydrogen 3.197 N/A ALA 874.A N THR 873.A OG1 no hydrogen 2.664 N/A LYS 877.A NZ VAL 670.A O no hydrogen 3.146 N/A GLN 879.A N LEU 875.A O no hydrogen 3.209 N/A GLN 879.A NE2 VAL 770.A O no hydrogen 3.481 N/A ASP 880.A N GLY 876.A O no hydrogen 3.121 N/A VAL 882.A N LEU 878.A O no hydrogen 3.038 N/A ASN 883.A N GLN 879.A O no hydrogen 3.289 N/A GLN 884.A N ASP 880.A O no hydrogen 2.735 N/A ASN 885.A N VAL 881.A O no hydrogen 3.110 N/A ALA 886.A N VAL 882.A O no hydrogen 2.865 N/A GLN 887.A N ASN 883.A O no hydrogen 2.817 N/A LEU 889.A N ALA 886.A O no hydrogen 2.822 N/A ASN 890.A N ALA 886.A O no hydrogen 3.079 N/A THR 891.A N GLN 887.A O no hydrogen 3.346 N/A THR 891.A OG1 GLN 887.A O no hydrogen 2.753 N/A VAL 893.A N LEU 889.A O no hydrogen 2.713 N/A LYS 894.A N ASN 890.A O no hydrogen 3.330 N/A LEU 896.A N VAL 893.A O no hydrogen 2.941 N/A SER 897.A OG LYS 894.A O no hydrogen 3.163 N/A PHE 900.A N SER 898.A OG no hydrogen 3.216 N/A ALA 902.A N ASN 899.A O no hydrogen 2.830 N/A ASP 909.A N VAL 906.A O no hydrogen 3.065 N/A ILE 910.A N VAL 906.A O no hydrogen 3.224 N/A LEU 911.A N LEU 907.A O no hydrogen 3.104 N/A LEU 914.A N ILE 910.A O no hydrogen 3.180 N/A GLU 918.A N ASP 915.A O no hydrogen 2.623 N/A ALA 919.A N ASP 915.A O no hydrogen 2.762 N/A ILE 923.A N ALA 919.A O no hydrogen 2.734 N/A ARG 925.A N VAL 921.A O no hydrogen 3.465 N/A LEU 926.A N ILE 923.A O no hydrogen 2.931 N/A ILE 927.A N ILE 923.A O no hydrogen 2.797 N/A THR 928.A N ASP 924.A O no hydrogen 2.975 N/A THR 928.A OG1 TYR 700.A OH no hydrogen 2.903 N/A THR 928.A OG1 ASP 924.A O no hydrogen 3.021 N/A GLY 929.A N ARG 925.A O no hydrogen 3.357 N/A ARG 930.A N LEU 926.A O no hydrogen 2.865 N/A ARG 930.A NH1 ILE 686.A O no hydrogen 2.726 N/A ARG 930.A NH2 LEU 896.A O no hydrogen 3.496 N/A LEU 931.A N ILE 927.A O no hydrogen 2.734 N/A LEU 931.A N THR 928.A O no hydrogen 3.250 N/A GLN 932.A N THR 928.A O no hydrogen 3.009 N/A LEU 934.A N LEU 931.A O no hydrogen 2.870 N/A GLN 935.A N LEU 931.A O no hydrogen 2.773 N/A THR 936.A OG1 GLN 932.A O no hydrogen 2.738 N/A TYR 937.A N SER 933.A O no hydrogen 3.370 N/A VAL 938.A N LEU 934.A O no hydrogen 3.293 N/A THR 939.A N GLN 935.A O no hydrogen 3.130 N/A THR 939.A OG1 GLN 935.A O no hydrogen 3.290 N/A GLN 940.A N THR 936.A O no hydrogen 2.831 N/A GLN 941.A N TYR 937.A O no hydrogen 2.965 N/A LEU 942.A N VAL 938.A O no hydrogen 2.668 N/A ILE 943.A N THR 939.A O no hydrogen 2.977 N/A ARG 944.A N GLN 940.A O no hydrogen 3.330 N/A ALA 945.A N GLN 941.A O no hydrogen 2.895 N/A GLU 947.A N ILE 943.A O no hydrogen 3.056 N/A ILE 948.A N ALA 945.A O no hydrogen 3.273 N/A ARG 949.A N ALA 945.A O no hydrogen 3.383 N/A ALA 952.A N ILE 948.A O no hydrogen 2.472 N/A ASN 953.A N ARG 949.A O no hydrogen 3.353 N/A LEU 954.A N ALA 950.A O no hydrogen 3.156 N/A ALA 955.A N SER 951.A O no hydrogen 3.413 N/A ALA 956.A N ALA 952.A O no hydrogen 3.095 N/A THR 957.A OG1 ASN 953.A O no hydrogen 3.180 N/A LYS 958.A N LEU 954.A O no hydrogen 2.674 N/A LYS 958.A NZ GLU 669.A OE1 no hydrogen 3.297 N/A MET 959.A N ALA 955.A O no hydrogen 3.159 N/A SER 960.A N ALA 956.A O no hydrogen 3.240 N/A SER 960.A OG ALA 956.A O no hydrogen 2.385 N/A CYS 962.A SG HIS 978.A NE2 no hydrogen 3.251 N/A CYS 962.A SG HIS 994.A ND1 no hydrogen 3.410 N/A VAL 963.A N MET 959.A O no hydrogen 3.232 N/A LEU 964.A N MET 959.A O no hydrogen 3.221 N/A GLN 966.A NE2 HIS 978.A O no hydrogen 2.440 N/A TYR 977.A N TYR 997.A O no hydrogen 2.969 N/A LEU 979.A N VAL 995.A O no hydrogen 2.663 N/A SER 981.A OG HIS 994.A ND1 no hydrogen 2.756 N/A PHE 982.A N LEU 993.A O no hydrogen 2.835 N/A GLN 984.A N VAL 991.A O no hydrogen 2.366 N/A ALA 986.A N GLY 989.A O no hydrogen 3.130 N/A HIS 988.A ND1 SER 674.A O no hydrogen 3.160 N/A GLY 989.A N ALA 986.A O no hydrogen 3.392 N/A VAL 990.A N MET 671.A O no hydrogen 3.074 N/A VAL 991.A N GLN 984.A O no hydrogen 3.178 N/A PHE 992.A N GLU 669.A O no hydrogen 2.648 N/A VAL 995.A N MET 980.A O no hydrogen 3.253 N/A THR 996.A N SER 665.A O no hydrogen 3.232 N/A THR 996.A OG1 LYS 975.A O no hydrogen 3.060 N/A TYR 997.A N TYR 977.A O no hydrogen 2.439 N/A VAL 998.A N SER 663.A O no hydrogen 3.046 N/A GLU 1002.A N GLU 1002.A OE1 no hydrogen 2.771 N/A PHE 1005.A N ILE 656.A O no hydrogen 3.248 N/A ALA 1008.A N THR 1007.A OG1 no hydrogen 2.602 N/A ILE 1011.A N TYR 1018.A O no hydrogen 3.137 N/A CYS 1012.A N ILE 1063.A O no hydrogen 3.271 N/A CYS 1012.A SG LYS 1016.A O no hydrogen 3.928 N/A HIS 1013.A N LYS 1016.A O no hydrogen 3.223 N/A HIS 1013.A ND1 ASN 1065.A O no hydrogen 3.329 N/A ALA 1017.A N GLY 1054.A O no hydrogen 2.818 N/A TYR 1018.A N ILE 1011.A O no hydrogen 2.699 N/A PHE 1019.A N PHE 1051.A O no hydrogen 3.110 N/A VAL 1026.A N PHE 1033.A O no hydrogen 2.648 N/A THR 1030.A N ASN 1028.A OD1 no hydrogen 3.191 N/A PHE 1033.A N VAL 1026.A O no hydrogen 2.790 N/A ILE 1034.A N GLN 1043.A O no hydrogen 2.818 N/A THR 1035.A OG1 PHE 1039.A O no hydrogen 2.791 N/A THR 1035.A OG1 SER 1041.A O no hydrogen 2.968 N/A GLN 1036.A NE2 GLU 1022.A O no hydrogen 2.901 N/A SER 1041.A N THR 1035.A OG1 no hydrogen 2.627 N/A THR 1046.A N ASN 1049.A OD1 no hydrogen 3.307 N/A THR 1046.A OG1 ASN 1049.A OD1 no hydrogen 3.220 N/A THR 1050.A OG1 THR 1046.A O no hydrogen 2.404 N/A PHE 1051.A N PHE 1019.A O no hydrogen 2.546 N/A CYS 1056.A N GLY 1015.A O no hydrogen 2.912 N/A ILE 1063.A N ALA 1010.A O no hydrogen 2.819 N/A THR 1066.A OG1 TYR 1068.A OH no hydrogen 3.197 N/A TYR 1068.A N ILE 1045.A O no hydrogen 3.019 N/A TYR 1068.A OH THR 1066.A OG1 no hydrogen 3.197 N/A