Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7n5h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 6.A N VAL 39.A O no hydrogen 3.314 N/A THR 6.A OG1 ASN 7.A O no hydrogen 3.475 N/A SER 8.A N ASN 7.A OD1 no hydrogen 3.250 N/A SER 8.A N SER 37.A O no hydrogen 3.324 N/A SER 8.A OG SER 37.A O no hydrogen 2.850 N/A THR 10.A OG1 PHE 9.A O no hydrogen 2.719 N/A THR 10.A OG1 GLY 159.A O no hydrogen 2.333 N/A ARG 11.A NH1 SER 161.A OG no hydrogen 3.290 N/A ARG 11.A NH2 PRO 157.A O no hydrogen 2.568 N/A TYR 14.A OH LEU 31.A O no hydrogen 2.491 N/A ARG 21.A NH2 ASP 17.A OD2 no hydrogen 3.233 N/A SER 22.A OG GLU 205.A O no hydrogen 3.257 N/A SER 23.A N ASN 204.A O no hydrogen 3.043 N/A HIS 26.A N LEU 201.A O no hydrogen 2.973 N/A THR 28.A N PHE 199.A O no hydrogen 2.826 N/A LEU 31.A N ASP 30.A OD1 no hydrogen 2.926 N/A PHE 32.A N GLN 195.A O no hydrogen 3.112 N/A PHE 36.A N SER 8.A O no hydrogen 3.145 N/A SER 37.A OG ASN 38.A O no hydrogen 3.554 N/A VAL 39.A N THR 6.A O no hydrogen 3.006 N/A THR 40.A N VAL 191.A O no hydrogen 3.061 N/A TRP 41.A N ALA 4.A O no hydrogen 2.953 N/A PHE 42.A N TYR 189.A O no hydrogen 3.068 N/A ALA 44.A N ALA 187.A O no hydrogen 2.735 N/A LEU 50.A N PHE 178.A O no hydrogen 3.031 N/A PHE 52.A N THR 176.A O no hydrogen 2.611 N/A ASP 54.A N ASN 53.A OD1 no hydrogen 2.789 N/A VAL 56.A N PHE 134.A O no hydrogen 3.380 N/A TYR 57.A N GLY 192.A O no hydrogen 2.992 N/A PHE 58.A N PHE 132.A O no hydrogen 2.561 N/A ALA 59.A N TYR 190.A O no hydrogen 2.922 N/A SER 60.A N ARG 130.A O no hydrogen 2.806 N/A SER 60.A OG ALA 188.A O no hydrogen 3.501 N/A THR 61.A N ALA 188.A O no hydrogen 3.245 N/A THR 61.A OG1 ALA 188.A O no hydrogen 3.455 N/A GLU 62.A N ASN 128.A O no hydrogen 3.223 N/A ARG 68.A N LEU 181.A O no hydrogen 3.391 N/A TRP 70.A N ILE 85.A O no hydrogen 3.040 N/A ILE 71.A N GLN 179.A O no hydrogen 2.698 N/A PHE 72.A N LEU 83.A O no hydrogen 3.003 N/A GLY 73.A N ARG 177.A O no hydrogen 3.051 N/A THR 74.A OG1 ASN 174.A O no hydrogen 2.409 N/A THR 75.A OG1 ASP 77.A OD1 no hydrogen 3.318 N/A THR 75.A OG1 THR 80.A OG1 no hydrogen 2.728 N/A SER 78.A OG ASP 77.A O no hydrogen 2.694 N/A SER 78.A OG GLN 100.A OE1 no hydrogen 2.766 N/A THR 80.A OG1 THR 75.A OG1 no hydrogen 2.728 N/A SER 82.A N CYS 97.A O no hydrogen 3.057 N/A LEU 84.A N LYS 95.A O no hydrogen 2.960 N/A ILE 85.A N TRP 70.A O no hydrogen 3.035 N/A VAL 86.A N VAL 93.A O no hydrogen 3.102 N/A ASN 87.A N ARG 68.A O no hydrogen 3.107 N/A THR 90.A N ASN 88.A OD1 no hydrogen 3.042 N/A THR 90.A OG1 ASN 88.A OD1 no hydrogen 2.355 N/A THR 90.A OG1 ASN 91.A OD1 no hydrogen 2.397 N/A ASN 91.A N ASN 88.A OD1 no hydrogen 2.969 N/A ASN 91.A ND2 SER 125.A O no hydrogen 2.701 N/A VAL 93.A N VAL 86.A O no hydrogen 3.031 N/A ILE 94.A N TYR 123.A O no hydrogen 2.709 N/A LYS 95.A N LEU 84.A O no hydrogen 3.030 N/A VAL 96.A N PHE 121.A O no hydrogen 3.264 N/A GLU 98.A N ASN 118.A O no hydrogen 3.196 N/A GLN 100.A N SER 115.A O no hydrogen 2.762 N/A CYS 102.A SG SER 114.A OG no hydrogen 3.259 N/A VAL 109.A N LEU 184.A O no hydrogen 3.055 N/A SER 114.A N GLN 100.A O no hydrogen 3.044 N/A ASN 117.A N GLU 98.A O no hydrogen 3.035 N/A ASN 117.A ND2 GLU 98.A OE1 no hydrogen 3.374 N/A THR 120.A OG1 GLN 81.A OE1 no hydrogen 2.341 N/A THR 120.A OG1 VAL 96.A O no hydrogen 3.266 N/A TYR 123.A N ILE 94.A O no hydrogen 2.688 N/A SER 125.A N VAL 92.A O no hydrogen 2.707 N/A LEU 129.A N THR 148.A O no hydrogen 3.052 N/A ARG 130.A N SER 60.A O no hydrogen 2.935 N/A ARG 130.A NH2 ASN 65.A OD1 no hydrogen 2.705 N/A GLU 131.A N LYS 146.A O no hydrogen 3.393 N/A PHE 132.A N PHE 58.A O no hydrogen 2.442 N/A VAL 133.A N TYR 144.A O no hydrogen 3.309 N/A PHE 134.A N VAL 56.A O no hydrogen 3.131 N/A LYS 135.A NZ TYR 14.A OH no hydrogen 2.811 N/A LYS 135.A NZ ASP 30.A OD2 no hydrogen 3.451 N/A ILE 137.A N TYR 140.A O no hydrogen 3.354 N/A TYR 140.A N ILE 137.A O no hydrogen 2.873 N/A PHE 141.A N LEU 169.A O no hydrogen 3.434 N/A LYS 142.A N LYS 135.A O no hydrogen 3.459 N/A ILE 143.A N VAL 167.A O no hydrogen 3.057 N/A TYR 144.A N VAL 133.A O no hydrogen 3.342 N/A SER 145.A N GLU 164.A O no hydrogen 2.993 N/A LYS 146.A NZ ALA 162.A O no hydrogen 3.175 N/A THR 148.A N LEU 129.A O no hydrogen 3.143 N/A ILE 150.A N LYS 127.A O no hydrogen 3.142 N/A ARG 154.A NH1 ARG 154.A O no hydrogen 3.074 N/A SER 161.A OG GLU 131.A OE1 no hydrogen 2.950 N/A LEU 163.A N VAL 13.A O no hydrogen 3.158 N/A LEU 166.A N ILE 143.A O no hydrogen 2.738 N/A LEU 169.A N PHE 141.A O no hydrogen 3.318 N/A ILE 171.A N LEU 169.A O no hydrogen 3.235 N/A PHE 178.A N LEU 50.A O no hydrogen 2.911 N/A GLN 179.A N ILE 71.A O no hydrogen 2.723 N/A GLN 179.A NE2 ASN 47.A O no hydrogen 3.093 N/A LEU 181.A N GLY 69.A O no hydrogen 2.859 N/A ALA 183.A N ILE 66.A O no hydrogen 3.313 N/A LEU 184.A N LEU 107.A O no hydrogen 2.900 N/A TYR 189.A N PHE 42.A O no hydrogen 3.161 N/A TYR 189.A OH ASP 46.A O no hydrogen 3.320 N/A TYR 190.A N ALA 59.A O no hydrogen 2.468 N/A VAL 191.A N THR 40.A O no hydrogen 2.852 N/A GLY 192.A N TYR 57.A O no hydrogen 2.735 N/A TYR 193.A OH PRO 51.A O no hydrogen 2.458 N/A LEU 194.A N GLY 55.A O no hydrogen 3.339 N/A GLN 195.A N PHE 32.A O no hydrogen 3.063 N/A ARG 197.A N ASP 30.A O no hydrogen 3.414 N/A ARG 197.A NE ASP 214.A OD1 no hydrogen 3.528 N/A ARG 197.A NE ASP 214.A OD2 no hydrogen 2.717 N/A ARG 197.A NH2 ASP 214.A OD2 no hydrogen 2.865 N/A PHE 199.A N THR 28.A O no hydrogen 2.753 N/A LEU 200.A N VAL 213.A O no hydrogen 2.984 N/A LEU 201.A N HIS 26.A O no hydrogen 2.781 N/A LYS 202.A N ASP 211.A O no hydrogen 3.011 N/A TYR 203.A N VAL 24.A O no hydrogen 3.293 N/A ASN 204.A N THR 208.A O no hydrogen 3.151 N/A GLY 207.A N ASN 204.A O no hydrogen 3.388 N/A THR 208.A N ASN 204.A OD1 no hydrogen 2.604 N/A THR 208.A OG1 ASN 204.A OD1 no hydrogen 2.837 N/A ILE 209.A N TYR 15.A OH no hydrogen 3.413 N/A THR 210.A N LYS 202.A O no hydrogen 3.225 N/A VAL 213.A N LEU 200.A O no hydrogen 3.043 N/A CYS 215.A N THR 198.A O no hydrogen 3.156 N/A CYS 215.A SG THR 198.A O no hydrogen 3.334 N/A LEU 220.A N ASP 218.A OD1 no hydrogen 3.497 N/A GLU 222.A N PRO 219.A O no hydrogen 3.310 N/A THR 223.A OG1 LEU 220.A O no hydrogen 3.165 N/A CYS 225.A N SER 221.A O no hydrogen 3.335 N/A THR 226.A N GLU 222.A O no hydrogen 3.212 N/A THR 226.A OG1 GLU 222.A O no hydrogen 2.909 N/A LEU 227.A N THR 223.A O no hydrogen 3.016 N/A LYS 228.A NZ LEU 25.A O no hydrogen 3.562 N/A SER 229.A N LYS 224.A O no hydrogen 3.323 N/A SER 229.A OG THR 231.A O no hydrogen 3.284 N/A LYS 234.A NZ ASP 567.A OD2 no hydrogen 2.731 N/A THR 239.A OG1 GLU 222.A OE1 no hydrogen 2.827 N/A PHE 242.A N GLY 517.A O no hydrogen 3.073 N/A ARG 243.A NE ASN 241.A OD1 no hydrogen 2.535 N/A VAL 244.A N SER 515.A O no hydrogen 3.324 N/A THR 247.A N CYS 462.A O no hydrogen 3.221 N/A ILE 250.A N ASN 464.A O no hydrogen 2.799 N/A ARG 252.A N ASN 466.A O no hydrogen 2.971 N/A ARG 252.A NH1 GLN 504.A OE1 no hydrogen 2.691 N/A CYS 260.A N VAL 286.A O no hydrogen 2.752 N/A CYS 260.A SG ILE 282.A O no hydrogen 3.907 N/A PHE 262.A N CYS 260.A O no hydrogen 3.058 N/A GLU 264.A N PRO 261.A O no hydrogen 3.254 N/A PHE 266.A N PHE 262.A O no hydrogen 3.216 N/A ASN 267.A N GLY 263.A O no hydrogen 2.968 N/A ALA 276.A N SER 273.A O no hydrogen 3.176 N/A ASN 278.A N SER 323.A O no hydrogen 3.172 N/A LYS 280.A N ALA 321.A O no hydrogen 2.898 N/A ARG 281.A NH2 ASN 318.A OD1 no hydrogen 2.862 N/A ASN 284.A N THR 447.A OG1 no hydrogen 2.960 N/A CYS 285.A SG ILE 282.A O no hydrogen 2.697 N/A ALA 287.A N CYS 449.A O no hydrogen 2.938 N/A SER 290.A OG TYR 293.A OH no hydrogen 3.091 N/A LEU 292.A N TYR 289.A O no hydrogen 3.255 N/A TYR 293.A N TYR 289.A O no hydrogen 3.488 N/A ASN 294.A N SER 290.A O no hydrogen 2.837 N/A SER 297.A N SER 295.A OG no hydrogen 3.198 N/A SER 299.A OG THR 300.A OG1 no hydrogen 3.083 N/A SER 299.A OG ALA 359.A O no hydrogen 2.958 N/A THR 300.A N ALA 359.A O no hydrogen 3.098 N/A THR 300.A OG1 SER 299.A OG no hydrogen 3.083 N/A LYS 302.A N VAL 357.A O no hydrogen 2.955 N/A TYR 304.A N GLY 355.A O no hydrogen 2.742 N/A SER 307.A OG THR 309.A O no hydrogen 2.842 N/A LEU 311.A N PRO 308.A O no hydrogen 3.219 N/A LEU 314.A N LYS 310.A O no hydrogen 3.234 N/A PHE 316.A N VAL 448.A O no hydrogen 2.871 N/A THR 317.A OG1 GLU 440.A O no hydrogen 3.091 N/A ASN 318.A N GLU 440.A O no hydrogen 3.059 N/A ASN 318.A ND2 GLU 440.A OE1 no hydrogen 2.893 N/A TYR 320.A N SER 438.A O no hydrogen 2.938 N/A ALA 321.A N LYS 280.A O no hydrogen 2.990 N/A ASP 322.A N VAL 436.A O no hydrogen 2.761 N/A SER 323.A N ASN 278.A O no hydrogen 3.368 N/A PHE 324.A N VAL 434.A O no hydrogen 3.188 N/A VAL 325.A N ALA 272.A O no hydrogen 3.102 N/A ILE 326.A N TYR 432.A O no hydrogen 3.249 N/A ARG 327.A NE GLU 330.A OE2 no hydrogen 3.067 N/A ARG 327.A NH2 GLU 330.A OE2 no hydrogen 3.389 N/A GLY 328.A N GLN 430.A O no hydrogen 3.286 N/A ASP 329.A N GLY 428.A O no hydrogen 2.919 N/A GLU 330.A N ARG 327.A O no hydrogen 3.061 N/A VAL 331.A N GLY 328.A O no hydrogen 3.085 N/A GLN 333.A N GLU 330.A O no hydrogen 3.019 N/A ILE 334.A N VAL 331.A O no hydrogen 3.213 N/A ALA 335.A N ARG 332.A O no hydrogen 3.026 N/A GLY 340.A N ASP 344.A OD1 no hydrogen 3.390 N/A LYS 341.A NZ LEU 379.A O no hydrogen 3.342 N/A ILE 342.A N GLN 333.A OE1 no hydrogen 3.035 N/A ALA 343.A N GLN 333.A OE1 no hydrogen 3.068 N/A ASP 344.A N GLY 340.A O no hydrogen 2.919 N/A ASN 346.A ND2 ARG 378.A O no hydrogen 3.141 N/A TYR 347.A N ILE 342.A O no hydrogen 2.797 N/A TYR 347.A OH ASP 322.A OD2 no hydrogen 2.899 N/A LYS 348.A NZ GLN 338.A O no hydrogen 3.563 N/A LYS 348.A NZ ASP 344.A OD2 no hydrogen 2.931 N/A THR 354.A OG1 THR 354.A O no hydrogen 2.303 N/A THR 354.A OG1 PHE 439.A O no hydrogen 2.378 N/A CYS 356.A N LEU 437.A O no hydrogen 3.121 N/A VAL 357.A N LYS 302.A O no hydrogen 2.555 N/A ILE 358.A N VAL 435.A O no hydrogen 2.889 N/A ALA 359.A N THR 300.A O no hydrogen 3.117 N/A TRP 360.A N ARG 433.A O no hydrogen 3.375 N/A ASN 361.A ND2 GLN 430.A OE1 no hydrogen 3.003 N/A SER 362.A N PRO 431.A O no hydrogen 3.226 N/A SER 362.A OG PRO 431.A O no hydrogen 3.066 N/A ASN 363.A ND2 PRO 423.A O no hydrogen 3.360 N/A LEU 365.A N SER 362.A O no hydrogen 3.152 N/A ASP 366.A N SER 362.A O no hydrogen 3.158 N/A SER 367.A N ASN 363.A O no hydrogen 3.289 N/A SER 367.A OG ASN 363.A O no hydrogen 3.365 N/A SER 367.A OG ASN 363.A OD1 no hydrogen 2.849 N/A LYS 368.A NZ ASN 374.A OD1 no hydrogen 3.178 N/A ASN 372.A ND2 ASN 374.A OD1 no hydrogen 3.136 N/A TYR 375.A N ASN 372.A OD1 no hydrogen 3.364 N/A LEU 376.A N SER 273.A OG no hydrogen 3.405 N/A TYR 377.A N GLN 417.A O no hydrogen 3.225 N/A ARG 378.A NH1 TYR 275.A O no hydrogen 2.992 N/A ARG 378.A NH2 TYR 345.A O no hydrogen 3.360 N/A LEU 379.A N PRO 415.A O no hydrogen 3.252 N/A ARG 381.A NH1 ASP 391.A OD2 no hydrogen 3.280 N/A ARG 381.A NH2 ASP 391.A OD2 no hydrogen 3.082 N/A LEU 385.A N ASP 344.A O no hydrogen 3.354 N/A LYS 386.A N GLU 389.A OE1 no hydrogen 3.035 N/A PHE 388.A N LYS 348.A O no hydrogen 2.866 N/A TYR 397.A N TYR 413.A O no hydrogen 2.979 N/A GLN 398.A NE2 SER 401.A O no hydrogen 2.848 N/A CYS 404.A SG VAL 407.A O no hydrogen 3.174 N/A GLY 409.A N CYS 412.A O no hydrogen 2.713 N/A CYS 412.A SG ASN 411.A O no hydrogen 3.220 N/A PHE 414.A N GLU 408.A OE1 no hydrogen 3.303 N/A GLN 417.A N TYR 377.A O no hydrogen 2.840 N/A TYR 419.A N TYR 375.A O no hydrogen 3.182 N/A GLN 422.A NE2 ASN 425.A OD1 no hydrogen 3.070 N/A ASN 425.A N GLN 422.A O no hydrogen 3.337 N/A ASN 425.A ND2 GLY 420.A O no hydrogen 3.582 N/A TYR 429.A N GLY 426.A O no hydrogen 3.075 N/A GLN 430.A NE2 ASN 425.A O no hydrogen 3.001 N/A TYR 432.A N ILE 326.A O no hydrogen 2.757 N/A ARG 433.A NE ASP 366.A OD2 no hydrogen 3.222 N/A ARG 433.A NH1 ALA 268.A O no hydrogen 3.053 N/A ARG 433.A NH2 THR 269.A O no hydrogen 3.377 N/A ARG 433.A NH2 TYR 375.A OH no hydrogen 3.559 N/A VAL 434.A N PHE 324.A O no hydrogen 2.811 N/A VAL 435.A N ILE 358.A O no hydrogen 2.830 N/A VAL 436.A N ASP 322.A O no hydrogen 2.710 N/A LEU 437.A N CYS 356.A O no hydrogen 2.814 N/A SER 438.A N TYR 320.A O no hydrogen 2.684 N/A PHE 439.A N THR 354.A O no hydrogen 3.191 N/A GLU 440.A N ASN 318.A O no hydrogen 2.842 N/A THR 447.A OG1 THR 317.A O no hydrogen 2.816 N/A VAL 448.A N PHE 316.A O no hydrogen 2.916 N/A THR 455.A N VAL 251.A O no hydrogen 3.164 N/A ASN 460.A N LEU 476.A O no hydrogen 3.088 N/A ASN 464.A N GLU 248.A O no hydrogen 2.913 N/A ASN 464.A ND2 SER 249.A OG no hydrogen 3.116 N/A PHE 465.A N GLY 472.A O no hydrogen 3.183 N/A ASN 466.A N ILE 250.A O no hydrogen 3.276 N/A PHE 467.A N LEU 470.A O no hydrogen 2.904 N/A LEU 470.A N PHE 467.A O no hydrogen 3.125 N/A THR 471.A OG1 ASN 466.A OD1 no hydrogen 3.237 N/A GLY 472.A N PHE 465.A O no hydrogen 3.107 N/A VAL 475.A N THR 512.A O no hydrogen 2.472 N/A THR 477.A N ASP 510.A O no hydrogen 2.901 N/A SER 479.A N ILE 508.A O no hydrogen 3.078 N/A SER 479.A OG ILE 508.A O no hydrogen 3.196 N/A ASP 495.A N ASP 492.A O no hydrogen 3.321 N/A VAL 500.A N LEU 509.A O no hydrogen 3.185 N/A ARG 501.A N GLN 488.A O no hydrogen 3.130 N/A ARG 501.A NH1 PRO 485.A O no hydrogen 3.205 N/A GLN 504.A NE2 PHE 253.A O no hydrogen 2.613 N/A GLN 504.A NE2 SER 454.A OG no hydrogen 3.137 N/A THR 505.A N ASP 502.A OD2 no hydrogen 2.850 N/A THR 505.A OG1 ASP 502.A OD2 no hydrogen 3.052 N/A THR 505.A OG1 GLU 507.A OE2 no hydrogen 2.684 N/A LEU 509.A N VAL 500.A O no hydrogen 3.363 N/A ASP 510.A N THR 477.A O no hydrogen 2.495 N/A ILE 511.A N ASP 498.A O no hydrogen 2.567 N/A THR 512.A N VAL 475.A O no hydrogen 2.822 N/A VAL 519.A N SER 240.A O no hydrogen 2.838 N/A SER 520.A N LEU 535.A O no hydrogen 2.814 N/A SER 520.A OG LEU 535.A O no hydrogen 3.367 N/A VAL 521.A N TYR 237.A O no hydrogen 3.446 N/A ILE 522.A N ALA 533.A O no hydrogen 2.559 N/A THR 523.A OG1 PRO 524.A O no hydrogen 3.034 N/A THR 526.A N VAL 232.A O no hydrogen 3.050 N/A THR 526.A OG1 VAL 232.A O no hydrogen 3.550 N/A THR 528.A N GLY 525.A O no hydrogen 3.121 N/A SER 529.A N GLY 525.A O no hydrogen 3.069 N/A SER 529.A OG TYR 578.A OH no hydrogen 3.363 N/A GLN 531.A N SER 529.A OG no hydrogen 3.336 N/A ALA 533.A N ILE 522.A O no hydrogen 2.961 N/A VAL 534.A N ILE 555.A O no hydrogen 3.076 N/A LEU 535.A N SER 520.A O no hydrogen 2.720 N/A TYR 536.A N CYS 553.A O no hydrogen 2.854 N/A GLN 537.A N GLY 518.A O no hydrogen 3.188 N/A ASP 538.A N ALA 551.A O no hydrogen 2.989 N/A CYS 541.A N ASN 540.A OD1 no hydrogen 2.752 N/A CYS 541.A SG PHE 547.A O no hydrogen 3.995 N/A CYS 541.A SG GLN 548.A OE1 no hydrogen 3.352 N/A THR 542.A OG1 GLU 543.A OE1 no hydrogen 3.424 N/A GLU 543.A N GLU 543.A OE1 no hydrogen 2.968 N/A PHE 547.A N LEU 554.A O no hydrogen 2.847 N/A GLN 548.A NE2 THR 549.A O no hydrogen 2.497 N/A THR 549.A N GLY 552.A O no hydrogen 2.852 N/A THR 549.A OG1 GLY 552.A O no hydrogen 2.726 N/A GLY 552.A N THR 549.A O no hydrogen 3.434 N/A CYS 553.A N TYR 536.A O no hydrogen 2.941 N/A LEU 554.A N PHE 547.A O no hydrogen 2.815 N/A ILE 555.A N VAL 534.A O no hydrogen 3.034 N/A GLY 556.A N ASN 545.A O no hydrogen 3.152 N/A GLU 558.A N ILE 583.A O no hydrogen 3.054 N/A VAL 560.A N ALA 585.A O no hydrogen 2.757 N/A ILE 568.A N ALA 576.A O no hydrogen 3.333 N/A ILE 570.A N ILE 574.A O no hydrogen 3.294 N/A GLY 571.A N ILE 574.A O no hydrogen 3.477 N/A ILE 574.A N GLY 571.A O no hydrogen 3.174 N/A CYS 575.A N TYR 586.A O no hydrogen 3.159 N/A CYS 575.A SG ILE 568.A O no hydrogen 3.950 N/A ALA 576.A N ILE 568.A O no hydrogen 3.398 N/A SER 577.A N ILE 584.A O no hydrogen 3.140 N/A GLN 579.A N SER 582.A O no hydrogen 3.475 N/A SER 582.A N GLN 579.A O no hydrogen 3.183 N/A ILE 584.A N SER 577.A O no hydrogen 2.969 N/A ALA 585.A N GLU 558.A O no hydrogen 2.616 N/A TYR 586.A N CYS 575.A O no hydrogen 3.065 N/A TYR 586.A OH GLU 565.A O no hydrogen 2.397 N/A MET 588.A N GLY 573.A O no hydrogen 3.101 N/A TYR 598.A N VAL 596.A O no hydrogen 2.828 N/A SER 599.A OG ASN 601.A OD1 no hydrogen 3.183 N/A ASN 601.A N SER 599.A OG no hydrogen 3.265 N/A ILE 603.A N PHE 939.A O no hydrogen 2.718 N/A ILE 605.A N LYS 937.A O no hydrogen 3.317 N/A PHE 609.A N ASN 608.A OD1 no hydrogen 2.935 N/A THR 610.A N VAL 932.A O no hydrogen 2.817 N/A THR 610.A OG1 VAL 932.A O no hydrogen 2.724 N/A SER 612.A N THR 930.A O no hydrogen 3.144 N/A SER 612.A OG THR 930.A OG1 no hydrogen 2.925 N/A THR 614.A N HIS 928.A O no hydrogen 2.937 N/A GLU 616.A N PHE 926.A O no hydrogen 2.991 N/A LEU 618.A N VAL 924.A O no hydrogen 3.070 N/A VAL 620.A N HIS 922.A O no hydrogen 3.336 N/A MET 622.A N GLN 665.A OE1 no hydrogen 2.563 N/A LYS 624.A NZ ASP 666.A OD1 no hydrogen 3.363 N/A LYS 624.A NZ ASP 666.A OD2 no hydrogen 2.537 N/A THR 625.A OG1 THR 723.A O no hydrogen 3.325 N/A SER 626.A N THR 723.A O no hydrogen 2.696 N/A ASP 628.A N GLY 721.A O no hydrogen 3.158 N/A THR 630.A OG1 ASP 628.A OD2 no hydrogen 3.493 N/A TYR 632.A N ASP 628.A O no hydrogen 3.246 N/A TYR 632.A OH LEU 826.A O no hydrogen 2.465 N/A ILE 633.A N CYS 629.A O no hydrogen 3.250 N/A CYS 634.A N THR 630.A O no hydrogen 2.970 N/A CYS 640.A N SER 637.A OG no hydrogen 3.300 N/A SER 641.A N SER 637.A O no hydrogen 3.123 N/A ASN 642.A N THR 638.A O no hydrogen 3.304 N/A LEU 643.A N GLU 639.A O no hydrogen 3.438 N/A LEU 644.A N CYS 640.A O no hydrogen 3.263 N/A LEU 645.A N SER 641.A O no hydrogen 3.324 N/A TYR 647.A N LEU 644.A O no hydrogen 3.297 N/A TYR 647.A OH ASP 858.A OD1 no hydrogen 3.186 N/A GLN 653.A N SER 649.A O no hydrogen 3.436 N/A LEU 654.A N CYS 651.A O no hydrogen 3.229 N/A ASN 655.A N CYS 651.A O no hydrogen 3.183 N/A ARG 656.A N THR 652.A O no hydrogen 3.464 N/A ALA 657.A N GLN 653.A O no hydrogen 2.941 N/A LEU 658.A N LEU 654.A O no hydrogen 2.850 N/A THR 659.A N ASN 655.A O no hydrogen 2.984 N/A GLY 660.A N ARG 656.A O no hydrogen 3.222 N/A VAL 663.A N THR 659.A O no hydrogen 3.286 N/A GLU 664.A N GLY 660.A O no hydrogen 3.151 N/A GLN 665.A N ILE 661.A O no hydrogen 2.949 N/A GLN 665.A NE2 ILE 661.A O no hydrogen 3.093 N/A LYS 667.A N VAL 663.A O no hydrogen 3.153 N/A ASN 668.A N GLU 664.A O no hydrogen 2.902 N/A THR 669.A N GLN 665.A O no hydrogen 3.208 N/A THR 669.A OG1 GLN 665.A O no hydrogen 2.985 N/A GLN 670.A N ASP 666.A O no hydrogen 3.085 N/A GLU 671.A N LYS 667.A O no hydrogen 2.986 N/A VAL 672.A N THR 669.A O no hydrogen 3.347 N/A PHE 673.A N THR 669.A O no hydrogen 2.976 N/A GLN 675.A N PHE 673.A O no hydrogen 2.838 N/A GLN 675.A NE2 GLU 671.A O no hydrogen 2.846 N/A GLN 675.A NE2 ALA 890.A O no hydrogen 3.254 N/A LYS 681.A NZ THR 682.A O no hydrogen 3.222 N/A LYS 686.A NZ PRO 683.A O no hydrogen 2.760 N/A PHE 691.A N PHE 688.A O no hydrogen 3.516 N/A ASN 692.A N ASN 792.A OD1 no hydrogen 2.940 N/A SER 694.A N ASN 692.A OD1 no hydrogen 3.283 N/A SER 694.A OG ASN 692.A OD1 no hydrogen 3.534 N/A LEU 697.A N PHE 693.A O no hydrogen 3.119 N/A ASP 699.A N ARG 706.A O no hydrogen 3.342 N/A SER 701.A OG ASP 699.A OD2 no hydrogen 2.584 N/A LYS 705.A NZ PRO 700.A O no hydrogen 3.406 N/A LYS 705.A NZ LYS 702.A O no hydrogen 3.353 N/A ARG 706.A N SER 704.A O no hydrogen 2.798 N/A ARG 706.A NH2 ASP 711.A OD1 no hydrogen 2.823 N/A SER 707.A N GLU 710.A OE1 no hydrogen 3.151 N/A SER 707.A OG GLN 918.A OE1 no hydrogen 3.090 N/A GLU 710.A N SER 707.A OG no hydrogen 3.062 N/A ASP 711.A N SER 707.A O no hydrogen 3.013 N/A LEU 712.A N PHE 708.A O no hydrogen 3.298 N/A LEU 713.A N ILE 709.A O no hydrogen 3.213 N/A PHE 714.A N GLU 710.A O no hydrogen 3.256 N/A LYS 716.A N LEU 713.A O no hydrogen 3.438 N/A LYS 716.A NZ LEU 802.A O no hydrogen 3.406 N/A THR 723.A N SER 626.A O no hydrogen 2.685 N/A LEU 725.A N LYS 624.A O no hydrogen 2.661 N/A LEU 728.A N ASP 666.A OD1 no hydrogen 3.239 N/A MET 733.A N THR 730.A O no hydrogen 3.275 N/A MET 733.A N THR 730.A OG1 no hydrogen 3.290 N/A ILE 734.A N THR 730.A O no hydrogen 3.351 N/A GLN 736.A N GLU 732.A O no hydrogen 3.216 N/A TYR 737.A N MET 733.A O no hydrogen 3.355 N/A THR 738.A N ILE 734.A O no hydrogen 3.128 N/A THR 738.A OG1 GLU 710.A OE2 no hydrogen 3.083 N/A THR 738.A OG1 ILE 734.A O no hydrogen 3.406 N/A THR 738.A OG1 ALA 735.A O no hydrogen 2.897 N/A SER 739.A N ALA 735.A O no hydrogen 3.096 N/A ALA 740.A N GLN 736.A O no hydrogen 3.163 N/A LEU 741.A N TYR 737.A O no hydrogen 3.234 N/A LEU 742.A N THR 738.A O no hydrogen 2.932 N/A ALA 743.A N SER 739.A O no hydrogen 3.047 N/A GLY 744.A N ALA 740.A O no hydrogen 3.069 N/A THR 745.A N LEU 741.A O no hydrogen 2.983 N/A THR 745.A OG1 LEU 741.A O no hydrogen 2.768 N/A ILE 746.A N LEU 742.A O no hydrogen 3.193 N/A THR 747.A N ALA 743.A O no hydrogen 2.941 N/A THR 747.A OG1 ALA 743.A O no hydrogen 2.428 N/A SER 748.A N GLY 744.A O no hydrogen 2.900 N/A SER 748.A OG GLY 744.A O no hydrogen 2.285 N/A GLY 749.A N THR 745.A O no hydrogen 3.073 N/A THR 751.A N SER 748.A O no hydrogen 3.441 N/A THR 751.A OG1 SER 748.A O no hydrogen 2.767 N/A THR 751.A OG1 LEU 758.A O no hydrogen 3.395 N/A GLY 755.A N THR 751.A O no hydrogen 3.101 N/A LEU 758.A N THR 751.A OG1 no hydrogen 3.324 N/A GLN 759.A N GLN 759.A OE1 no hydrogen 3.040 N/A ILE 760.A N THR 747.A O no hydrogen 3.253 N/A MET 764.A N PRO 761.A O no hydrogen 3.177 N/A GLN 765.A N PRO 761.A O no hydrogen 2.805 N/A GLN 765.A NE2 THR 745.A O no hydrogen 3.397 N/A GLN 765.A NE2 ILE 746.A O no hydrogen 2.893 N/A ALA 767.A N MET 764.A O no hydrogen 3.331 N/A TYR 768.A N GLN 765.A O no hydrogen 3.090 N/A ARG 769.A N GLN 765.A O no hydrogen 3.393 N/A ARG 769.A NH1 GLY 899.A O no hydrogen 3.440 N/A ARG 769.A NH2 GLN 765.A OE1 no hydrogen 3.244 N/A PHE 770.A N MET 766.A O no hydrogen 3.106 N/A ASN 771.A N ALA 767.A O no hydrogen 3.072 N/A ILE 773.A N PHE 770.A O no hydrogen 3.272 N/A VAL 775.A N PHE 770.A O no hydrogen 2.948 N/A THR 776.A OG1 ASN 778.A OD1 no hydrogen 2.463 N/A ASN 778.A ND2 GLU 975.A OE1 no hydrogen 3.048 N/A VAL 779.A N THR 776.A O no hydrogen 3.444 N/A GLU 782.A N ASN 778.A O no hydrogen 3.189 N/A ASN 783.A N VAL 779.A O no hydrogen 3.252 N/A ASN 783.A N LEU 780.A O no hydrogen 3.241 N/A GLN 784.A NE2 GLY 689.A O no hydrogen 3.496 N/A ILE 787.A N ASN 783.A O no hydrogen 3.043 N/A ALA 788.A N GLN 784.A O no hydrogen 3.065 N/A ASN 789.A N LYS 785.A O no hydrogen 3.102 N/A GLN 790.A N LEU 786.A O no hydrogen 3.031 N/A GLN 790.A NE2 PHE 609.A O no hydrogen 3.300 N/A PHE 791.A N ILE 787.A O no hydrogen 2.934 N/A ASN 792.A N ALA 788.A O no hydrogen 3.118 N/A ASN 792.A ND2 GLY 690.A O no hydrogen 3.240 N/A SER 793.A N ASN 789.A O no hydrogen 3.236 N/A ALA 794.A N GLN 790.A O no hydrogen 3.158 N/A ILE 795.A N PHE 791.A O no hydrogen 3.107 N/A GLY 796.A N ASN 792.A O no hydrogen 3.267 N/A LYS 797.A N SER 793.A O no hydrogen 3.248 N/A ILE 798.A N ILE 795.A O no hydrogen 3.224 N/A SER 801.A N LYS 797.A O no hydrogen 2.999 N/A LEU 802.A N ILE 798.A O no hydrogen 3.031 N/A SER 803.A N GLN 799.A O no hydrogen 3.271 N/A SER 804.A N ASP 800.A O no hydrogen 3.111 N/A SER 804.A OG ASP 800.A O no hydrogen 2.726 N/A THR 805.A N SER 801.A O no hydrogen 3.148 N/A GLN 813.A N LEU 809.A O no hydrogen 2.960 N/A ASP 814.A N GLY 810.A O no hydrogen 3.269 N/A ASN 817.A N GLN 813.A O no hydrogen 2.978 N/A GLN 818.A N ASP 814.A O no hydrogen 2.927 N/A ASN 819.A N VAL 815.A O no hydrogen 3.311 N/A ALA 820.A N VAL 816.A O no hydrogen 2.958 N/A GLN 821.A N ASN 817.A O no hydrogen 3.064 N/A GLN 821.A NE2 GLN 818.A O no hydrogen 3.600 N/A ALA 822.A N GLN 818.A O no hydrogen 3.081 N/A LEU 823.A N ASN 819.A O no hydrogen 3.496 N/A ASN 824.A N ALA 820.A O no hydrogen 3.220 N/A THR 825.A N GLN 821.A O no hydrogen 2.929 N/A THR 825.A OG1 GLN 821.A O no hydrogen 2.593 N/A LEU 826.A N ALA 822.A O no hydrogen 3.174 N/A VAL 827.A N LEU 823.A O no hydrogen 3.304 N/A LYS 828.A N ASN 824.A O no hydrogen 3.156 N/A LYS 828.A NZ ASN 824.A OD1 no hydrogen 3.522 N/A GLN 829.A N THR 825.A O no hydrogen 3.262 N/A LEU 830.A N VAL 827.A O no hydrogen 3.383 N/A SER 831.A OG LYS 828.A O no hydrogen 3.147 N/A SER 832.A N GLN 829.A O no hydrogen 3.320 N/A SER 832.A OG GLN 829.A O no hydrogen 3.463 N/A ALA 836.A N ASN 833.A O no hydrogen 3.065 N/A SER 839.A OG SER 831.A O no hydrogen 3.320 N/A VAL 840.A N SER 838.A OG no hydrogen 3.398 N/A LEU 845.A N LEU 841.A O no hydrogen 3.472 N/A SER 846.A N ASN 842.A O no hydrogen 3.167 N/A SER 846.A OG ASN 842.A O no hydrogen 2.577 N/A SER 846.A OG ASP 843.A O no hydrogen 3.210 N/A ARG 847.A N ASP 843.A O no hydrogen 3.134 N/A LEU 848.A N ILE 844.A O no hydrogen 2.893 N/A GLU 852.A N ASP 849.A O no hydrogen 3.263 N/A ALA 853.A N ASP 849.A O no hydrogen 2.865 N/A VAL 855.A N GLU 852.A O no hydrogen 3.446 N/A ILE 857.A N ALA 853.A O no hydrogen 3.036 N/A ASP 858.A N GLU 854.A O no hydrogen 3.044 N/A ARG 859.A N VAL 855.A O no hydrogen 3.390 N/A ARG 859.A NH1 GLN 856.A OE1 no hydrogen 3.446 N/A LEU 860.A N ILE 857.A O no hydrogen 2.934 N/A ILE 861.A N ILE 857.A O no hydrogen 2.976 N/A THR 862.A N ASP 858.A O no hydrogen 3.476 N/A ARG 864.A N LEU 860.A O no hydrogen 3.012 N/A ARG 864.A NH1 ILE 633.A O no hydrogen 2.968 N/A ARG 864.A NH2 LEU 830.A O no hydrogen 3.278 N/A LEU 865.A N ILE 861.A O no hydrogen 2.940 N/A GLN 866.A N THR 862.A O no hydrogen 3.181 N/A SER 867.A N GLY 863.A O no hydrogen 3.261 N/A LEU 868.A N ARG 864.A O no hydrogen 2.966 N/A GLN 869.A N LEU 865.A O no hydrogen 2.760 N/A THR 870.A N GLN 866.A O no hydrogen 2.785 N/A THR 870.A OG1 GLN 866.A O no hydrogen 2.793 N/A THR 870.A OG1 GLN 866.A OE1 no hydrogen 3.220 N/A TYR 871.A N SER 867.A O no hydrogen 3.177 N/A VAL 872.A N LEU 868.A O no hydrogen 3.140 N/A THR 873.A N GLN 869.A O no hydrogen 3.032 N/A THR 873.A OG1 GLN 869.A O no hydrogen 2.570 N/A GLN 874.A N THR 870.A O no hydrogen 2.969 N/A GLN 875.A N TYR 871.A O no hydrogen 3.021 N/A LEU 876.A N VAL 872.A O no hydrogen 2.882 N/A ILE 877.A N THR 873.A O no hydrogen 3.183 N/A ARG 878.A N GLN 874.A O no hydrogen 3.000 N/A ARG 878.A NH1 GLN 875.A OE1 no hydrogen 3.274 N/A ALA 879.A N GLN 875.A O no hydrogen 2.786 N/A ALA 880.A N LEU 876.A O no hydrogen 3.329 N/A ALA 880.A N ILE 877.A O no hydrogen 3.231 N/A ILE 882.A N ARG 878.A O no hydrogen 3.198 N/A ARG 883.A N ALA 879.A O no hydrogen 2.818 N/A ARG 883.A NH1 GLU 664.A OE1 no hydrogen 3.489 N/A ALA 884.A N ALA 880.A O no hydrogen 2.907 N/A SER 885.A N GLU 881.A O no hydrogen 3.094 N/A SER 885.A OG GLU 881.A O no hydrogen 3.314 N/A ALA 886.A N ILE 882.A O no hydrogen 2.699 N/A ASN 887.A N ARG 883.A O no hydrogen 2.844 N/A LEU 888.A N ALA 884.A O no hydrogen 3.064 N/A ALA 889.A N SER 885.A O no hydrogen 2.843 N/A ALA 890.A N ALA 886.A O no hydrogen 2.827 N/A THR 891.A N ASN 887.A O no hydrogen 2.976 N/A THR 891.A OG1 ASN 887.A O no hydrogen 2.564 N/A LYS 892.A N LEU 888.A O no hydrogen 2.884 N/A LYS 892.A NZ PHE 906.A O no hydrogen 2.505 N/A MET 893.A N ALA 889.A O no hydrogen 2.807 N/A SER 894.A N ALA 890.A O no hydrogen 3.066 N/A SER 894.A OG GLN 675.A OE1 no hydrogen 2.622 N/A SER 894.A OG ALA 890.A O no hydrogen 3.071 N/A GLU 895.A N THR 891.A O no hydrogen 2.987 N/A CYS 896.A N LYS 892.A O no hydrogen 2.758 N/A CYS 896.A SG HIS 912.A NE2 no hydrogen 3.217 N/A CYS 896.A SG SER 915.A OG no hydrogen 3.612 N/A CYS 896.A SG HIS 928.A ND1 no hydrogen 3.330 N/A VAL 897.A N LYS 892.A O no hydrogen 3.137 N/A LEU 898.A N MET 893.A O no hydrogen 2.984 N/A GLN 900.A NE2 ARG 769.A O no hydrogen 2.802 N/A GLN 900.A NE2 HIS 912.A O no hydrogen 3.451 N/A LYS 902.A NZ GLY 772.A O no hydrogen 2.999 N/A ARG 903.A N SER 901.A OG no hydrogen 3.185 N/A ARG 903.A NH1 GLU 895.A OE1 no hydrogen 2.969 N/A TYR 911.A N TYR 931.A O no hydrogen 2.931 N/A LEU 913.A N VAL 929.A O no hydrogen 3.189 N/A SER 915.A OG CYS 896.A O no hydrogen 2.758 N/A PHE 916.A N LEU 927.A O no hydrogen 3.117 N/A GLN 918.A N VAL 925.A O no hydrogen 2.743 N/A GLN 918.A NE2 PRO 917.A O no hydrogen 2.807 N/A SER 919.A N GLU 710.A OE2 no hydrogen 3.144 N/A GLY 923.A N ALA 920.A O no hydrogen 3.461 N/A VAL 924.A N LEU 618.A O no hydrogen 2.909 N/A VAL 925.A N GLN 918.A O no hydrogen 3.003 N/A PHE 926.A N GLU 616.A O no hydrogen 2.857 N/A LEU 927.A N PHE 916.A O no hydrogen 2.901 N/A HIS 928.A N THR 614.A O no hydrogen 3.002 N/A HIS 928.A NE2 GLU 616.A OE2 no hydrogen 2.794 N/A VAL 929.A N MET 914.A O no hydrogen 2.969 N/A THR 930.A N SER 612.A O no hydrogen 2.889 N/A THR 930.A OG1 SER 612.A O no hydrogen 3.424 N/A THR 930.A OG1 SER 612.A OG no hydrogen 2.925 N/A THR 930.A OG1 LYS 909.A O no hydrogen 2.971 N/A TYR 931.A N TYR 911.A O no hydrogen 2.628 N/A VAL 932.A N THR 610.A O no hydrogen 3.022 N/A ALA 934.A N ASN 608.A O no hydrogen 3.372 N/A PHE 939.A N ILE 603.A O no hydrogen 2.646 N/A THR 941.A OG1 ALA 942.A O no hydrogen 3.556 N/A THR 941.A OG1 PHE 959.A O no hydrogen 2.800 N/A ILE 945.A N HIS 952.A O no hydrogen 3.443 N/A CYS 946.A N VAL 997.A O no hydrogen 2.879 N/A CYS 946.A SG ASN 998.A OD1 no hydrogen 3.947 N/A HIS 952.A N ILE 945.A O no hydrogen 3.032 N/A HIS 952.A ND1 THR 984.A OG1 no hydrogen 3.276 N/A PHE 953.A N PHE 985.A O no hydrogen 3.046 N/A ARG 955.A N ASN 983.A O no hydrogen 3.206 N/A VAL 958.A N THR 969.A O no hydrogen 3.039 N/A VAL 960.A N PHE 967.A O no hydrogen 2.684 N/A SER 961.A OG THR 940.A O no hydrogen 2.658 N/A THR 964.A OG1 HIS 965.A ND1 no hydrogen 2.825 N/A PHE 967.A N VAL 960.A O no hydrogen 2.742 N/A VAL 968.A N GLN 977.A O no hydrogen 3.050 N/A THR 969.A N VAL 958.A O no hydrogen 3.062 N/A THR 969.A OG1 PHE 973.A O no hydrogen 3.178 N/A GLU 975.A N THR 969.A OG1 no hydrogen 2.489 N/A GLN 977.A N VAL 968.A O no hydrogen 2.896 N/A THR 980.A OG1 ASP 982.A OD1 no hydrogen 2.401 N/A THR 981.A OG1 ASP 1003.A OD1 no hydrogen 3.502 N/A ASN 983.A N THR 980.A O no hydrogen 3.341 N/A THR 984.A OG1 HIS 952.A ND1 no hydrogen 3.276 N/A THR 984.A OG1 THR 980.A O no hydrogen 3.114 N/A PHE 985.A N PHE 953.A O no hydrogen 3.091 N/A SER 987.A N ALA 951.A O no hydrogen 3.096 N/A CYS 990.A N GLY 949.A O no hydrogen 3.213 N/A CYS 990.A SG LYS 950.A O no hydrogen 3.729 N/A VAL 997.A N ALA 944.A O no hydrogen 3.416 N/A ASN 999.A N CYS 946.A O no hydrogen 3.134 N/A VAL 1001.A N HIS 947.A ND1 no hydrogen 3.301 N/A TYR 1002.A N ILE 979.A O no hydrogen 3.260 N/A GLN 1006.A N ASP 1003.A O no hydrogen 3.349 N/A LEU 1009.A N LEU 1005.A O no hydrogen 3.403 N/A ASP 1010.A N GLN 1006.A O no hydrogen 3.377 N/A SER 1011.A N PRO 1007.A O no hydrogen 3.260 N/A