Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5swr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N HIS 5.A NE2 no hydrogen 3.448 N/A HIS 6.A N TYR 3.A O no hydrogen 3.187 N/A SER 20.A N MET 18.A O no hydrogen 2.798 N/A SER 20.A OG GLY 19.A O no hydrogen 2.858 N/A GLU 28.A N HIS 33.A O no hydrogen 3.033 N/A TRP 30.A N PHE 114.A O no hydrogen 3.202 N/A ILE 32.A N LEU 29.A O no hydrogen 3.357 N/A MET 35.A N GLU 28.A OE2 no hydrogen 2.754 N/A ARG 38.A NH1 GLU 54.A OE1 no hydrogen 2.694 N/A ILE 39.A N CYS 55.A O no hydrogen 2.834 N/A VAL 41.A N LEU 53.A O no hydrogen 2.907 N/A GLU 42.A N GLU 42.A OE2 no hydrogen 3.257 N/A CYS 43.A N VAL 51.A O no hydrogen 2.960 N/A CYS 43.A SG VAL 41.A O no hydrogen 3.799 N/A LEU 44.A N LEU 118.A O no hydrogen 2.910 N/A LEU 45.A N MET 49.A O no hydrogen 3.033 N/A ASN 47.A ND2 LEU 77.A O no hydrogen 3.299 N/A GLY 48.A N LEU 45.A O no hydrogen 3.052 N/A MET 49.A N ASN 47.A OD1 no hydrogen 2.939 N/A VAL 51.A N CYS 43.A O no hydrogen 3.300 N/A LEU 53.A N VAL 41.A O no hydrogen 3.084 N/A CYS 55.A N ILE 39.A O no hydrogen 2.734 N/A ARG 57.A N PRO 37.A O no hydrogen 3.017 N/A ARG 57.A NH2 ASP 743.A OD2 no hydrogen 3.180 N/A ALA 59.A N LEU 56.A O no hydrogen 3.042 N/A THR 60.A OG1 THR 63.A OG1 no hydrogen 2.617 N/A LEU 61.A N ARG 106.A O no hydrogen 3.079 N/A ILE 62.A N GLU 104.A O no hydrogen 3.072 N/A THR 63.A N THR 60.A OG1 no hydrogen 3.157 N/A THR 63.A OG1 THR 60.A OG1 no hydrogen 2.617 N/A ILE 64.A N THR 60.A O no hydrogen 2.969 N/A LYS 65.A N LEU 61.A O no hydrogen 2.737 N/A LYS 65.A NZ GLU 84.A O no hydrogen 3.338 N/A LYS 65.A NZ GLU 104.A OE1 no hydrogen 3.266 N/A HIS 66.A N ILE 62.A O no hydrogen 3.050 N/A GLU 67.A N THR 63.A O no hydrogen 3.020 N/A LEU 68.A N ILE 64.A O no hydrogen 2.815 N/A PHE 69.A N LYS 65.A O no hydrogen 2.929 N/A LYS 70.A N HIS 66.A O no hydrogen 3.283 N/A GLU 71.A N GLU 67.A O no hydrogen 2.734 N/A ALA 72.A N LEU 68.A O no hydrogen 2.728 N/A LYS 74.A NZ GLU 71.A OE1 no hydrogen 2.697 N/A TYR 75.A N ALA 72.A O no hydrogen 2.705 N/A LEU 80.A N LEU 77.A O no hydrogen 3.153 N/A LEU 81.A N HIS 78.A O no hydrogen 3.037 N/A GLN 82.A N TYR 87.A OH no hydrogen 3.071 N/A SER 85.A N ASP 83.A OD1 no hydrogen 3.373 N/A SER 86.A N ASP 83.A O no hydrogen 2.878 N/A SER 86.A OG ASP 83.A O no hydrogen 3.348 N/A TYR 87.A N GLU 84.A O no hydrogen 2.960 N/A ILE 88.A N ILE 121.A O no hydrogen 2.714 N/A VAL 90.A N LYS 119.A O no hydrogen 2.761 N/A SER 91.A N GLU 99.A O no hydrogen 3.234 N/A SER 91.A OG VAL 92.A O no hydrogen 3.222 N/A SER 91.A OG PHE 117.A O no hydrogen 2.841 N/A THR 93.A N GLU 97.A O no hydrogen 3.047 N/A THR 93.A OG1 GLU 97.A O no hydrogen 3.444 N/A GLN 94.A N ARG 112.A O no hydrogen 3.049 N/A GLN 94.A NE2 GLY 27.A O no hydrogen 2.461 N/A GLN 94.A NE2 LEU 113.A O no hydrogen 3.527 N/A GLU 95.A N THR 93.A OG1 no hydrogen 3.277 N/A ALA 96.A N THR 93.A O no hydrogen 2.959 N/A PHE 101.A N PHE 89.A O no hydrogen 2.719 N/A THR 105.A OG1 ASP 103.A OD1 no hydrogen 2.217 N/A ARG 106.A N ASP 103.A O no hydrogen 3.233 N/A ARG 107.A NE ASP 746.A OD2 no hydrogen 2.954 N/A ARG 107.A NH1 GLU 58.A O no hydrogen 2.742 N/A ARG 107.A NH2 ASP 746.A OD2 no hydrogen 3.152 N/A LEU 108.A N ALA 59.A O no hydrogen 3.060 N/A CYS 109.A N ARG 57.A O no hydrogen 3.048 N/A CYS 109.A SG ARG 57.A O no hydrogen 3.407 N/A CYS 109.A SG ASP 110.A OD1 no hydrogen 3.710 N/A ASP 110.A N ARG 107.A O no hydrogen 2.786 N/A ARG 112.A NH2 GLU 95.A OE2 no hydrogen 3.548 N/A PHE 114.A N VAL 92.A O no hydrogen 3.185 N/A PHE 117.A N GLN 115.A O no hydrogen 2.796 N/A LEU 118.A N GLU 42.A O no hydrogen 2.957 N/A LYS 119.A N VAL 90.A O no hydrogen 2.722 N/A VAL 120.A N LEU 44.A O no hydrogen 2.707 N/A ILE 121.A N ILE 88.A O no hydrogen 3.157 N/A ASN 126.A ND2 ASN 126.A O no hydrogen 2.765 N/A ILE 131.A N GLU 128.A O no hydrogen 3.180 N/A LEU 132.A N GLU 129.A O no hydrogen 3.092 N/A GLY 137.A N ASN 133.A O no hydrogen 3.136 N/A PHE 138.A N ARG 134.A O no hydrogen 2.835 N/A ALA 139.A N GLU 135.A O no hydrogen 3.143 N/A ILE 140.A N ILE 136.A O no hydrogen 2.766 N/A GLY 141.A N GLY 137.A O no hydrogen 3.112 N/A GLU 146.A N PRO 143.A O no hydrogen 3.079 N/A PHE 147.A N VAL 144.A O no hydrogen 2.918 N/A VAL 150.A N PHE 147.A O no hydrogen 2.917 N/A GLU 154.A N ASP 152.A OD1 no hydrogen 3.257 N/A GLN 156.A N ASP 152.A O no hydrogen 3.456 N/A ASP 157.A N PRO 153.A O no hydrogen 2.699 N/A PHE 158.A N GLU 154.A O no hydrogen 2.645 N/A ARG 159.A N VAL 155.A O no hydrogen 2.928 N/A ARG 159.A NE GLU 689.A OE1 no hydrogen 3.110 N/A ARG 159.A NH1 ASP 148.A OD1 no hydrogen 3.395 N/A ARG 159.A NH2 GLU 689.A OE2 no hydrogen 2.994 N/A ARG 160.A N GLN 156.A O no hydrogen 3.224 N/A ASN 161.A N ASP 157.A O no hydrogen 2.903 N/A ILE 162.A N PHE 158.A O no hydrogen 2.869 N/A VAL 165.A N ILE 162.A O no hydrogen 2.811 N/A CYS 166.A SG ILE 162.A O no hydrogen 3.913 N/A LYS 167.A N LEU 163.A O no hydrogen 2.997 N/A LYS 167.A NZ ASP 171.A OD1 no hydrogen 3.046 N/A GLU 168.A N ASN 164.A O no hydrogen 3.108 N/A ALA 169.A N VAL 165.A O no hydrogen 3.210 N/A VAL 170.A N CYS 166.A O no hydrogen 2.873 N/A ASP 171.A N LYS 167.A O no hydrogen 3.262 N/A LEU 172.A N GLU 168.A O no hydrogen 3.231 N/A ARG 173.A N ALA 169.A O no hydrogen 3.210 N/A ARG 173.A NH1 LEU 658.A O no hydrogen 2.929 N/A ARG 173.A NH1 ALA 694.A O no hydrogen 3.218 N/A ARG 173.A NH2 ASP 319.A OD2 no hydrogen 3.510 N/A ARG 173.A NH2 ALA 694.A O no hydrogen 2.963 N/A ASP 174.A N VAL 170.A O no hydrogen 3.407 N/A SER 180.A N ASN 176.A O no hydrogen 3.406 N/A ARG 181.A NH2 LEU 316.A O no hydrogen 2.825 N/A ALA 182.A N PRO 178.A O no hydrogen 3.199 N/A MET 183.A N HIS 179.A O no hydrogen 2.823 N/A TYR 184.A N SER 180.A O no hydrogen 2.952 N/A TYR 184.A N ARG 181.A O no hydrogen 2.981 N/A TYR 184.A OH CYS 695.A O no hydrogen 3.025 N/A VAL 185.A N ARG 181.A O no hydrogen 2.955 N/A TYR 186.A N ALA 182.A O no hydrogen 2.815 N/A GLU 191.A N GLN 288.A O no hydrogen 2.686 N/A SER 193.A OG GLU 195.A O no hydrogen 3.360 N/A ILE 200.A N PRO 197.A O no hydrogen 3.315 N/A TYR 201.A N PRO 197.A O no hydrogen 3.250 N/A ASN 202.A N LYS 198.A O no hydrogen 3.191 N/A LYS 203.A N ILE 200.A O no hydrogen 2.838 N/A LYS 203.A NZ MET 297.A O no hydrogen 3.431 N/A LEU 204.A N TYR 201.A O no hydrogen 2.968 N/A GLN 208.A N LEU 204.A O no hydrogen 3.009 N/A GLN 208.A NE2 ASN 231.A OD1 no hydrogen 3.529 N/A ILE 209.A N ILE 230.A O no hydrogen 3.117 N/A VAL 211.A N LEU 228.A O no hydrogen 3.037 N/A VAL 212.A N PRO 302.A O no hydrogen 2.842 N/A TRP 214.A NE1 ASN 303.A OD1 no hydrogen 2.917 N/A LYS 223.A NZ ILE 788.A O no hydrogen 3.394 N/A GLN 224.A N VAL 215.A O no hydrogen 3.072 N/A TYR 226.A OH GLN 224.A OE1 no hydrogen 2.878 N/A HIS 232.A N GLY 207.A O no hydrogen 3.032 N/A CYS 234.A N ASN 231.A O no hydrogen 3.326 N/A CYS 234.A SG ASN 231.A O no hydrogen 3.605 N/A VAL 235.A N GLN 238.A OE1 no hydrogen 3.200 N/A VAL 239.A N VAL 235.A O no hydrogen 3.097 N/A ILE 240.A N PRO 236.A O no hydrogen 2.826 N/A ALA 241.A N GLU 237.A O no hydrogen 3.138 N/A GLU 242.A N GLN 238.A O no hydrogen 3.325 N/A ALA 243.A N VAL 239.A O no hydrogen 3.190 N/A ILE 244.A N ILE 240.A O no hydrogen 3.045 N/A ARG 245.A N ALA 241.A O no hydrogen 2.583 N/A LYS 246.A N GLU 242.A O no hydrogen 3.108 N/A LYS 247.A N ALA 243.A O no hydrogen 2.885 N/A THR 248.A N ILE 244.A O no hydrogen 2.873 N/A THR 248.A N ARG 245.A O no hydrogen 3.072 N/A THR 248.A OG1 ILE 244.A O no hydrogen 2.684 N/A ARG 249.A N ARG 245.A O no hydrogen 2.798 N/A LEU 252.A N SER 250.A OG no hydrogen 3.236 N/A GLN 257.A N SER 254.A OG no hydrogen 3.046 N/A LEU 258.A N SER 254.A O no hydrogen 3.102 N/A LEU 258.A N SER 255.A O no hydrogen 3.037 N/A LYS 259.A N SER 255.A O no hydrogen 3.201 N/A LEU 260.A N GLU 256.A O no hydrogen 3.359 N/A CYS 261.A N GLN 257.A O no hydrogen 3.242 N/A CYS 261.A SG GLN 257.A O no hydrogen 3.618 N/A VAL 262.A N LEU 258.A O no hydrogen 2.830 N/A LEU 263.A N LYS 259.A O no hydrogen 3.379 N/A TYR 265.A N VAL 262.A O no hydrogen 2.946 N/A LYS 268.A N TYR 265.A O no hydrogen 3.145 N/A ILE 270.A N MET 307.A O no hydrogen 2.650 N/A LYS 272.A N MET 305.A O no hydrogen 2.930 N/A LYS 272.A NZ VAL 273.A O no hydrogen 3.292 N/A LYS 272.A NZ CYS 276.A O no hydrogen 3.079 N/A LYS 272.A NZ ASP 787.A OD1 no hydrogen 3.299 N/A LYS 272.A NZ ASP 787.A OD2 no hydrogen 2.866 N/A VAL 273.A N GLU 278.A O no hydrogen 3.116 N/A CYS 274.A N ASN 303.A O no hydrogen 2.947 N/A CYS 274.A SG ASN 303.A O no hydrogen 2.842 N/A CYS 274.A SG LEU 304.A O no hydrogen 2.864 N/A GLY 275.A N ASP 787.A OD1 no hydrogen 2.995 N/A ASP 277.A N ALA 758.A O no hydrogen 2.927 N/A GLU 278.A N CYS 276.A O no hydrogen 2.953 N/A PHE 280.A N LEU 271.A O no hydrogen 2.927 N/A GLU 282.A N TYR 289.A OH no hydrogen 3.154 N/A TYR 284.A N GLU 282.A O no hydrogen 2.799 N/A LEU 286.A N CYS 234.A O no hydrogen 3.318 N/A SER 287.A N HIS 232.A O no hydrogen 3.358 N/A SER 287.A OG HIS 232.A ND1 no hydrogen 2.776 N/A SER 287.A OG HIS 232.A O no hydrogen 3.126 N/A GLN 288.A N PRO 285.A O no hydrogen 2.757 N/A GLN 288.A NE2 SER 192.A O no hydrogen 3.401 N/A TYR 289.A N LEU 286.A O no hydrogen 3.068 N/A TYR 289.A OH GLU 282.A O no hydrogen 2.682 N/A LYS 290.A N ASN 189.A O no hydrogen 2.883 N/A LYS 290.A NZ ASP 626.A OD1 no hydrogen 3.333 N/A ARG 293.A N TYR 289.A O no hydrogen 3.479 N/A ARG 293.A NE SER 287.A O no hydrogen 2.905 N/A ARG 293.A NH1 SER 193.A O no hydrogen 3.537 N/A ARG 293.A NH2 SER 193.A O no hydrogen 3.156 N/A ARG 293.A NH2 SER 287.A O no hydrogen 3.157 N/A SER 294.A N LYS 290.A O no hydrogen 2.871 N/A SER 294.A OG LYS 290.A O no hydrogen 2.807 N/A CYS 295.A N TYR 291.A O no hydrogen 3.024 N/A CYS 295.A SG TYR 291.A O no hydrogen 3.312 N/A ILE 296.A N ILE 292.A O no hydrogen 2.923 N/A MET 297.A N ARG 293.A O no hydrogen 3.271 N/A LEU 298.A N SER 294.A O no hydrogen 2.848 N/A ARG 300.A N CYS 295.A O no hydrogen 2.699 N/A ASN 303.A N TYR 291.A OH no hydrogen 3.014 N/A LEU 304.A N VAL 212.A O no hydrogen 3.027 N/A MET 305.A N LYS 272.A O no hydrogen 3.225 N/A LEU 306.A N TRP 214.A O no hydrogen 2.897 N/A MET 307.A N ILE 270.A O no hydrogen 2.905 N/A LYS 309.A N LYS 268.A O no hydrogen 2.888 N/A LYS 309.A NZ GLY 267.A O no hydrogen 3.422 N/A SER 311.A OG ALA 308.A O no hydrogen 3.284 N/A LEU 312.A N ALA 308.A O no hydrogen 3.040 N/A TYR 313.A N LYS 309.A O no hydrogen 2.636 N/A SER 314.A N GLU 310.A O no hydrogen 2.732 N/A SER 314.A OG SER 311.A O no hydrogen 3.453 N/A GLN 315.A N LEU 312.A O no hydrogen 2.765 N/A CYS 320.A N ASP 319.A OD1 no hydrogen 2.910 N/A CYS 320.A SG MET 318.A O no hydrogen 3.444 N/A TYR 326.A OH GLU 689.A OE2 no hydrogen 3.246 N/A SER 327.A N SER 325.A O no hydrogen 2.916 N/A THR 329.A OG1 GLU 328.A O no hydrogen 2.863 N/A THR 331.A N GLU 328.A O no hydrogen 3.012 N/A THR 331.A OG1 SER 330.A O no hydrogen 2.801 N/A LYS 332.A NZ PHE 480.A O no hydrogen 3.284 N/A LEU 334.A N LYS 485.A O no hydrogen 2.766 N/A TRP 335.A N SER 333.A OG no hydrogen 3.001 N/A VAL 336.A N SER 333.A O no hydrogen 3.053 N/A ILE 337.A N LEU 334.A O no hydrogen 3.217 N/A LEU 341.A N ILE 398.A O no hydrogen 3.302 N/A ARG 342.A NE ASP 478.A OD2 no hydrogen 2.644 N/A ARG 342.A NH2 ASP 478.A OD1 no hydrogen 3.284 N/A ILE 343.A N LEU 394.A O no hydrogen 2.966 N/A LYS 344.A N GLU 476.A O no hydrogen 2.819 N/A ILE 345.A N GLU 392.A O no hydrogen 3.230 N/A LEU 346.A N GLU 474.A O no hydrogen 3.335 N/A ILE 358.A N ASN 354.A O no hydrogen 2.942 N/A ASP 359.A N VAL 416.A O no hydrogen 2.985 N/A LYS 360.A N VAL 416.A O no hydrogen 3.272 N/A TYR 362.A N CYS 414.A O no hydrogen 3.312 N/A TYR 362.A OH HIS 419.A ND1 no hydrogen 3.387 N/A VAL 363.A N ASN 379.A OD1 no hydrogen 3.099 N/A ARG 364.A N SER 412.A O no hydrogen 2.881 N/A THR 365.A N ASN 377.A O no hydrogen 2.958 N/A THR 365.A OG1 ASN 377.A O no hydrogen 2.531 N/A THR 365.A OG1 TYR 396.A OH no hydrogen 3.056 N/A TYR 368.A N ARG 408.A O no hydrogen 2.697 N/A TYR 368.A OH ASP 376.A OD1 no hydrogen 3.031 N/A HIS 369.A N GLY 371.A O no hydrogen 2.668 N/A THR 380.A N GLU 392.A OE2 no hydrogen 3.396 N/A THR 380.A OG1 GLU 392.A OE1 no hydrogen 3.556 N/A THR 380.A OG1 GLU 392.A OE2 no hydrogen 2.662 N/A CYS 385.A SG ILE 358.A O no hydrogen 3.659 N/A CYS 385.A SG ASP 359.A O no hydrogen 3.570 N/A TRP 390.A N LEU 346.A O no hydrogen 2.960 N/A LEU 394.A N ILE 343.A O no hydrogen 2.685 N/A TYR 396.A N LEU 341.A O no hydrogen 2.958 N/A TYR 396.A OH THR 365.A OG1 no hydrogen 3.056 N/A ILE 398.A N TYR 396.A O no hydrogen 2.862 N/A ILE 400.A N SER 339.A O no hydrogen 2.993 N/A ASP 402.A N TYR 399.A O no hydrogen 3.096 N/A LEU 403.A N ILE 400.A O no hydrogen 3.333 N/A ARG 405.A NE ASP 434.A OD1 no hydrogen 3.036 N/A ARG 405.A NH1 ARG 405.A O no hydrogen 2.779 N/A ARG 405.A NH1 TYR 644.A OH no hydrogen 2.694 N/A ARG 405.A NH2 ASP 431.A O no hydrogen 2.991 N/A ARG 405.A NH2 ASP 434.A OD1 no hydrogen 2.928 N/A ARG 405.A NH2 TYR 644.A OH no hydrogen 3.376 N/A ALA 407.A N PRO 404.A O no hydrogen 2.881 N/A ARG 408.A N TYR 368.A O no hydrogen 3.098 N/A ARG 408.A NH2 PRO 458.A O no hydrogen 2.403 N/A LEU 409.A N ILE 427.A O no hydrogen 2.884 N/A CYS 410.A N GLY 366.A O no hydrogen 2.974 N/A LEU 411.A N GLY 425.A O no hydrogen 3.190 N/A SER 412.A N ARG 364.A O no hydrogen 3.119 N/A SER 412.A OG LEU 455.A O no hydrogen 2.718 N/A CYS 414.A N TYR 362.A O no hydrogen 2.814 N/A CYS 414.A SG SER 412.A O no hydrogen 3.836 N/A CYS 414.A SG SER 412.A OG no hydrogen 3.369 N/A CYS 414.A SG LEU 455.A O no hydrogen 3.947 N/A SER 415.A N CYS 420.A O no hydrogen 2.693 N/A VAL 416.A N LYS 360.A O no hydrogen 2.739 N/A LEU 422.A N ILE 413.A O no hydrogen 2.713 N/A TRP 424.A N TRP 446.A O no hydrogen 3.090 N/A GLY 425.A N LEU 411.A O no hydrogen 3.165 N/A ASN 426.A ND2 ASN 457.A O no hydrogen 3.299 N/A ASN 426.A ND2 GLY 460.A O no hydrogen 3.218 N/A ILE 427.A N LEU 409.A O no hydrogen 2.910 N/A ASN 428.A ND2 GLN 643.A O no hydrogen 3.405 N/A LEU 429.A N ALA 407.A O no hydrogen 3.079 N/A ASP 431.A N THR 435.A O no hydrogen 3.064 N/A TYR 432.A OH ASP 157.A OD2 no hydrogen 2.515 N/A THR 433.A N ASP 431.A OD1 no hydrogen 2.694 N/A THR 433.A OG1 ASP 431.A OD1 no hydrogen 2.614 N/A THR 433.A OG1 ASP 431.A OD2 no hydrogen 3.082 N/A THR 433.A OG1 THR 435.A OG1 no hydrogen 3.012 N/A ASP 434.A N ASP 431.A O no hydrogen 3.051 N/A THR 435.A N ASP 431.A OD1 no hydrogen 3.091 N/A THR 435.A OG1 THR 433.A OG1 no hydrogen 3.012 N/A LEU 436.A N VAL 484.A O no hydrogen 3.099 N/A VAL 437.A N LEU 429.A O no hydrogen 2.857 N/A GLY 439.A N PHE 477.A O no hydrogen 2.982 N/A MET 441.A N LEU 475.A O no hydrogen 2.922 N/A LEU 445.A N PRO 471.A O no hydrogen 2.759 N/A TRP 446.A N TRP 424.A O no hydrogen 2.754 N/A TRP 446.A NE1 GLY 463.A O no hydrogen 3.304 N/A GLY 460.A N ASN 457.A OD1 no hydrogen 3.222 N/A THR 462.A OG1 ASN 428.A OD1 no hydrogen 2.894 N/A GLY 463.A N ASN 426.A O no hydrogen 2.946 N/A ASN 465.A N ASN 444.A O no hydrogen 2.825 N/A ASN 465.A ND2 LEU 445.A O no hydrogen 3.320 N/A ASN 467.A N ASN 465.A OD1 no hydrogen 2.629 N/A THR 470.A N LYS 468.A O no hydrogen 2.660 N/A THR 470.A OG1 ASN 467.A O no hydrogen 2.703 N/A THR 470.A OG1 LYS 468.A O no hydrogen 3.517 N/A LEU 473.A N LEU 443.A O no hydrogen 3.113 N/A GLU 474.A N CYS 347.A O no hydrogen 3.304 N/A LEU 475.A N MET 441.A O no hydrogen 3.008 N/A GLU 476.A N LYS 344.A O no hydrogen 2.772 N/A PHE 477.A N GLY 439.A O no hydrogen 2.625 N/A TRP 479.A N ASP 478.A OD1 no hydrogen 3.247 N/A SER 481.A OG PHE 480.A O no hydrogen 2.754 N/A SER 482.A OG SER 481.A O no hydrogen 2.579 N/A LYS 485.A NZ THR 433.A O no hydrogen 3.530 N/A PHE 486.A N ASP 434.A O no hydrogen 3.009 N/A ILE 492.A N ASP 488.A O no hydrogen 3.144 N/A GLU 493.A N MET 489.A O no hydrogen 2.686 N/A GLU 494.A N SER 490.A O no hydrogen 3.252 N/A HIS 495.A N VAL 491.A O no hydrogen 3.356 N/A HIS 495.A NE2 ASP 578.A OD1 no hydrogen 3.256 N/A ALA 496.A N ILE 492.A O no hydrogen 3.010 N/A ASN 497.A N GLU 493.A O no hydrogen 2.868 N/A TRP 498.A N GLU 494.A O no hydrogen 2.850 N/A SER 499.A N HIS 495.A O no hydrogen 2.975 N/A SER 499.A OG HIS 495.A O no hydrogen 2.985 N/A SER 499.A OG ASP 578.A OD2 no hydrogen 3.263 N/A VAL 500.A N ALA 496.A O no hydrogen 2.904 N/A SER 501.A N ASN 497.A O no hydrogen 3.362 N/A SER 501.A OG ASN 497.A O no hydrogen 3.340 N/A ARG 502.A N TRP 498.A O no hydrogen 2.931 N/A ARG 502.A NH1 ASP 578.A OD2 no hydrogen 2.834 N/A GLU 503.A N SER 499.A O no hydrogen 3.311 N/A ALA 504.A N VAL 500.A O no hydrogen 3.341 N/A PHE 506.A N GLU 503.A O no hydrogen 3.228 N/A SER 507.A OG GLY 505.A O no hydrogen 2.994 N/A SER 514.A OG ASN 515.A OD1 no hydrogen 3.141 N/A ASN 515.A N ASN 515.A OD1 no hydrogen 2.642 N/A ARG 516.A N LEU 513.A O no hydrogen 2.499 N/A GLU 522.A N ASP 520.A OD1 no hydrogen 2.928 N/A ASP 527.A N ARG 524.A O no hydrogen 3.143 N/A LYS 528.A N ARG 524.A O no hydrogen 3.127 N/A GLU 529.A N GLU 525.A O no hydrogen 3.253 N/A GLN 530.A N ASN 526.A O no hydrogen 3.123 N/A LEU 531.A N ASP 527.A O no hydrogen 2.900 N/A LYS 532.A NZ TYR 557.A OH no hydrogen 3.510 N/A ALA 533.A N GLU 529.A O no hydrogen 3.271 N/A ILE 534.A N GLN 530.A O no hydrogen 3.218 N/A SER 535.A N LEU 531.A O no hydrogen 2.895 N/A THR 536.A N LYS 532.A O no hydrogen 3.149 N/A THR 536.A OG1 ALA 533.A O no hydrogen 2.738 N/A ARG 537.A N ILE 534.A O no hydrogen 2.912 N/A ARG 537.A NE SER 541.A OG no hydrogen 3.310 N/A ARG 537.A NH1 GLU 547.A OE1 no hydrogen 2.611 N/A ARG 537.A NH1 GLU 547.A OE2 no hydrogen 3.371 N/A ARG 537.A NH2 SER 541.A O no hydrogen 3.475 N/A LEU 540.A N ASP 538.A OD2 no hydrogen 3.115 N/A SER 541.A N ASP 538.A O no hydrogen 3.214 N/A SER 541.A OG ASP 538.A O no hydrogen 2.776 N/A SER 541.A OG ASP 538.A OD1 no hydrogen 3.536 N/A SER 541.A OG SER 541.A O no hydrogen 2.552 N/A THR 544.A N GLU 547.A OE2 no hydrogen 3.028 N/A THR 544.A OG1 GLU 547.A OE2 no hydrogen 3.343 N/A GLN 546.A N GLN 546.A OE1 no hydrogen 2.713 N/A GLU 547.A N THR 544.A OG1 no hydrogen 3.143 N/A LYS 548.A N THR 544.A O no hydrogen 2.708 N/A LYS 548.A NZ GLU 545.A OE2 no hydrogen 3.339 N/A ASP 549.A N GLU 545.A O no hydrogen 2.968 N/A PHE 550.A N GLN 546.A O no hydrogen 2.756 N/A LEU 551.A N GLU 547.A O no hydrogen 2.755 N/A TRP 552.A N LYS 548.A O no hydrogen 2.803 N/A SER 553.A N ASP 549.A O no hydrogen 2.772 N/A SER 553.A OG SER 514.A O no hydrogen 3.294 N/A SER 553.A OG ASP 549.A O no hydrogen 2.847 N/A SER 553.A OG PHE 550.A O no hydrogen 2.601 N/A HIS 554.A N PHE 550.A O no hydrogen 3.197 N/A HIS 554.A ND1 PHE 550.A O no hydrogen 3.136 N/A ARG 555.A N TRP 552.A O no hydrogen 3.156 N/A ARG 555.A NE GLN 582.A OE1 no hydrogen 3.217 N/A ARG 555.A NH1 TRP 552.A O no hydrogen 2.672 N/A ARG 555.A NH2 GLU 503.A OE2 no hydrogen 3.253 N/A ARG 555.A NH2 GLN 582.A OE1 no hydrogen 2.835 N/A CYS 558.A N HIS 554.A O no hydrogen 3.045 N/A CYS 558.A SG HIS 554.A O no hydrogen 3.780 N/A THR 560.A N TYR 557.A O no hydrogen 2.876 N/A THR 560.A OG1 TYR 557.A O no hydrogen 3.127 N/A ILE 561.A N CYS 558.A O no hydrogen 3.066 N/A GLU 563.A N GLU 563.A OE1 no hydrogen 3.045 N/A ILE 564.A N ILE 561.A O no hydrogen 2.916 N/A LEU 565.A N PRO 562.A O no hydrogen 2.917 N/A LYS 567.A N ILE 564.A O no hydrogen 2.712 N/A LYS 567.A NZ ARG 537.A O no hydrogen 2.719 N/A LEU 568.A N ILE 564.A O no hydrogen 3.092 N/A LEU 569.A N LEU 565.A O no hydrogen 2.834 N/A SER 571.A N LEU 568.A O no hydrogen 2.734 N/A SER 571.A OG LYS 567.A O no hydrogen 2.825 N/A VAL 572.A N LEU 568.A O no hydrogen 3.198 N/A LYS 573.A N GLU 579.A OE1 no hydrogen 3.481 N/A TRP 574.A NE1 LEU 569.A O no hydrogen 3.068 N/A SER 576.A N LYS 573.A O no hydrogen 3.041 N/A ARG 577.A N ASP 402.A OD1 no hydrogen 3.471 N/A VAL 580.A N SER 576.A O no hydrogen 2.861 N/A ALA 581.A N ARG 577.A O no hydrogen 2.853 N/A GLN 582.A NE2 GLU 503.A OE1 no hydrogen 3.327 N/A GLN 582.A NE2 ASP 578.A O no hydrogen 3.494 N/A MET 583.A N GLU 579.A O no hydrogen 3.064 N/A TYR 584.A N VAL 580.A O no hydrogen 2.929 N/A TYR 584.A OH ASP 608.A OD1 no hydrogen 2.845 N/A TYR 584.A OH ASP 608.A OD2 no hydrogen 3.397 N/A CYS 585.A N GLN 582.A O no hydrogen 3.043 N/A CYS 585.A SG ALA 581.A O no hydrogen 3.359 N/A LEU 586.A N GLN 582.A O no hydrogen 3.234 N/A LEU 586.A N MET 583.A O no hydrogen 3.059 N/A VAL 587.A N MET 583.A O no hydrogen 3.022 N/A LYS 588.A N TYR 584.A O no hydrogen 3.145 N/A LYS 588.A NZ GLU 493.A OE1 no hydrogen 3.428 N/A ASP 589.A N LEU 586.A O no hydrogen 3.017 N/A TRP 590.A N VAL 587.A O no hydrogen 3.432 N/A TRP 590.A NE1 PRO 562.A O no hydrogen 3.125 N/A GLN 597.A N LYS 594.A O no hydrogen 2.749 N/A ALA 598.A N LYS 594.A O no hydrogen 2.927 N/A MET 599.A N PRO 595.A O no hydrogen 2.841 N/A LEU 601.A N ALA 598.A O no hydrogen 2.959 N/A LEU 602.A N MET 599.A O no hydrogen 3.288 N/A ASP 603.A N GLU 600.A O no hydrogen 2.981 N/A ASN 605.A N ASP 603.A OD1 no hydrogen 2.765 N/A TYR 606.A N ASP 603.A O no hydrogen 3.272 N/A TYR 606.A OH PRO 566.A O no hydrogen 2.662 N/A MET 610.A N ASP 608.A OD2 no hydrogen 3.050 N/A ARG 612.A N ASP 608.A O no hydrogen 3.118 N/A ARG 612.A NE TYR 606.A O no hydrogen 3.106 N/A ARG 612.A NH2 LEU 602.A O no hydrogen 2.487 N/A ARG 612.A NH2 ASP 603.A O no hydrogen 3.177 N/A GLY 613.A N PRO 609.A O no hydrogen 2.774 N/A PHE 614.A N MET 610.A O no hydrogen 3.086 N/A ALA 615.A N VAL 611.A O no hydrogen 2.976 N/A VAL 616.A N ARG 612.A O no hydrogen 3.184 N/A ARG 617.A N GLY 613.A O no hydrogen 2.816 N/A ARG 617.A NH2 VAL 587.A O no hydrogen 3.446 N/A CYS 618.A N PHE 614.A O no hydrogen 2.826 N/A CYS 618.A SG PHE 614.A O no hydrogen 3.560 N/A LEU 619.A N ALA 615.A O no hydrogen 3.086 N/A GLU 620.A N VAL 616.A O no hydrogen 2.943 N/A LYS 621.A N ARG 617.A O no hydrogen 3.283 N/A LYS 621.A N CYS 618.A O no hydrogen 2.978 N/A TYR 622.A N CYS 618.A O no hydrogen 2.990 N/A LEU 623.A N LEU 619.A O no hydrogen 3.060 N/A LYS 627.A N THR 624.A OG1 no hydrogen 3.195 N/A LEU 628.A N THR 624.A O no hydrogen 2.829 N/A SER 629.A OG ASP 626.A O no hydrogen 3.199 N/A GLN 630.A N ASP 626.A O no hydrogen 3.391 N/A TYR 631.A N LYS 627.A O no hydrogen 3.400 N/A TYR 631.A OH GLU 596.A OE2 no hydrogen 2.826 N/A GLN 634.A N GLN 634.A OE1 no hydrogen 2.911 N/A GLN 634.A NE2 GLN 814.A OE1 no hydrogen 2.673 N/A LEU 635.A N TYR 631.A O no hydrogen 3.093 N/A LEU 635.A N LEU 632.A O no hydrogen 3.241 N/A VAL 636.A N LEU 632.A O no hydrogen 3.000 N/A GLN 637.A N ILE 633.A O no hydrogen 3.044 N/A GLN 637.A NE2 GLU 674.A OE2 no hydrogen 3.172 N/A VAL 638.A N GLN 634.A O no hydrogen 3.005 N/A LEU 639.A N VAL 636.A O no hydrogen 3.308 N/A LYS 640.A N GLN 637.A O no hydrogen 3.071 N/A LYS 640.A NZ GLN 637.A OE1 no hydrogen 3.152 N/A LYS 640.A NZ GLU 674.A OE2 no hydrogen 3.418 N/A TYR 641.A N VAL 638.A O no hydrogen 3.200 N/A GLU 642.A N LEU 639.A O no hydrogen 2.731 N/A GLN 643.A NE2 ASN 428.A OD1 no hydrogen 3.445 N/A TYR 644.A OH PHE 430.A O no hydrogen 2.619 N/A LEU 645.A N GLU 154.A OE2 no hydrogen 3.071 N/A ARG 651.A N ASN 647.A O no hydrogen 3.411 N/A ARG 651.A NE ASP 646.A OD1 no hydrogen 2.968 N/A ARG 651.A NH2 ASN 161.A O no hydrogen 2.968 N/A ARG 651.A NH2 ASP 646.A OD2 no hydrogen 2.881 N/A PHE 652.A N LEU 648.A O no hydrogen 2.860 N/A LEU 653.A N LEU 649.A O no hydrogen 3.139 N/A LEU 654.A N VAL 650.A O no hydrogen 2.871 N/A LYS 655.A N ARG 651.A O no hydrogen 3.314 N/A LYS 655.A NZ GLU 168.A OE1 no hydrogen 2.731 N/A LYS 656.A N PHE 652.A O no hydrogen 3.048 N/A LYS 656.A NZ ASP 625.A OD1 no hydrogen 3.265 N/A ALA 657.A N LEU 653.A O no hydrogen 2.854 N/A LEU 658.A N LEU 654.A O no hydrogen 3.126 N/A THR 659.A N LYS 656.A O no hydrogen 3.074 N/A THR 659.A OG1 LYS 655.A O no hydrogen 3.326 N/A ASN 660.A ND2 ASP 625.A OD2 no hydrogen 3.016 N/A GLN 661.A N TYR 184.A O no hydrogen 3.081 N/A ARG 662.A N ASN 660.A OD1 no hydrogen 2.851 N/A ARG 662.A NH1 PRO 187.A O no hydrogen 3.306 N/A ARG 662.A NH2 PRO 187.A O no hydrogen 2.876 N/A ILE 663.A N ASN 660.A OD1 no hydrogen 3.161 N/A GLY 664.A N ASN 660.A O no hydrogen 3.062 N/A HIS 665.A N GLN 661.A O no hydrogen 3.014 N/A HIS 665.A NE2 PRO 754.A O no hydrogen 2.739 N/A PHE 667.A N ILE 663.A O no hydrogen 2.805 N/A PHE 668.A N GLY 664.A O no hydrogen 2.947 N/A TRP 669.A N HIS 665.A O no hydrogen 3.327 N/A TRP 669.A NE1 GLN 705.A OE1 no hydrogen 2.885 N/A HIS 670.A N PHE 666.A O no hydrogen 2.823 N/A LEU 671.A N PHE 667.A O no hydrogen 3.295 N/A LYS 672.A N PHE 668.A O no hydrogen 2.770 N/A LYS 672.A NZ ALA 139.A O no hydrogen 2.845 N/A SER 673.A N TRP 669.A O no hydrogen 2.705 N/A GLU 674.A N LEU 671.A O no hydrogen 2.948 N/A MET 675.A N LYS 672.A O no hydrogen 3.217 N/A ASN 677.A N GLU 674.A O no hydrogen 3.012 N/A THR 679.A N ASN 677.A OD1 no hydrogen 3.406 N/A VAL 680.A N ASN 677.A O no hydrogen 2.896 N/A SER 681.A N ASN 677.A O no hydrogen 3.007 N/A SER 681.A OG MET 675.A O no hydrogen 3.090 N/A SER 681.A OG ASN 677.A O no hydrogen 3.137 N/A ARG 683.A NH1 GLU 642.A O no hydrogen 3.412 N/A ARG 683.A NH2 GLU 642.A O no hydrogen 2.959 N/A ARG 683.A NH2 TYR 644.A O no hydrogen 2.722 N/A PHE 684.A N VAL 680.A O no hydrogen 2.826 N/A GLY 685.A N SER 681.A O no hydrogen 2.719 N/A LEU 686.A N GLN 682.A O no hydrogen 2.892 N/A LEU 687.A N ARG 683.A O no hydrogen 3.089 N/A LEU 688.A N PHE 684.A O no hydrogen 2.885 N/A GLU 689.A N GLY 685.A O no hydrogen 2.959 N/A SER 690.A N LEU 686.A O no hydrogen 3.178 N/A SER 690.A OG LEU 686.A O no hydrogen 2.999 N/A SER 690.A OG LEU 687.A O no hydrogen 3.163 N/A TYR 691.A N LEU 687.A O no hydrogen 3.009 N/A CYS 692.A N LEU 688.A O no hydrogen 2.836 N/A CYS 692.A SG LEU 688.A O no hydrogen 3.257 N/A ARG 693.A N GLU 689.A O no hydrogen 2.953 N/A ARG 693.A NH1 ASN 133.A OD1 no hydrogen 3.532 N/A ARG 693.A NH2 ASN 133.A OD1 no hydrogen 2.788 N/A ARG 693.A NH2 GLU 689.A OE2 no hydrogen 3.104 N/A ALA 694.A N SER 690.A O no hydrogen 3.114 N/A ALA 694.A N TYR 691.A O no hydrogen 3.047 N/A CYS 695.A N TYR 691.A O no hydrogen 2.818 N/A CYS 695.A SG CYS 692.A O no hydrogen 3.805 N/A TYR 698.A OH HIS 665.A ND1 no hydrogen 2.527 N/A LYS 700.A N MET 697.A O no hydrogen 2.741 N/A LEU 702.A N TYR 698.A O no hydrogen 2.698 N/A ASN 703.A N LEU 699.A O no hydrogen 2.737 N/A ASN 703.A ND2 GLU 135.A O no hydrogen 3.160 N/A ARG 704.A N LYS 700.A O no hydrogen 3.308 N/A GLN 705.A N HIS 701.A O no hydrogen 3.182 N/A GLN 705.A NE2 TYR 698.A OH no hydrogen 3.277 N/A VAL 706.A N LEU 702.A O no hydrogen 2.763 N/A GLU 707.A N ASN 703.A O no hydrogen 2.940 N/A ALA 708.A N ARG 704.A O no hydrogen 2.991 N/A MET 709.A N GLN 705.A O no hydrogen 3.062 N/A GLU 710.A N VAL 706.A O no hydrogen 3.140 N/A LYS 711.A N GLU 707.A O no hydrogen 3.261 N/A LYS 711.A NZ ASP 743.A OD2 no hydrogen 3.096 N/A LEU 712.A N ALA 708.A O no hydrogen 3.143 N/A ILE 713.A N MET 709.A O no hydrogen 2.737 N/A ASN 714.A N GLU 710.A O no hydrogen 3.032 N/A LEU 715.A N LYS 711.A O no hydrogen 2.889 N/A THR 716.A N LEU 712.A O no hydrogen 3.097 N/A THR 716.A OG1 LEU 712.A O no hydrogen 2.858 N/A THR 716.A OG1 ILE 713.A O no hydrogen 3.184 N/A ASP 717.A N ILE 713.A O no hydrogen 3.031 N/A ILE 718.A N ASN 714.A O no hydrogen 3.091 N/A LEU 719.A N LEU 715.A O no hydrogen 3.120 N/A LYS 720.A N THR 716.A O no hydrogen 2.803 N/A LYS 720.A NZ ASN 802.A O no hydrogen 2.747 N/A GLN 721.A N ILE 718.A O no hydrogen 3.025 N/A GLN 728.A NE2 ILE 771.A O no hydrogen 2.673 N/A GLN 731.A N THR 727.A O no hydrogen 2.938 N/A GLN 731.A NE2 LYS 723.A O no hydrogen 2.735 N/A MET 732.A N GLN 728.A O no hydrogen 2.725 N/A LYS 733.A N LYS 729.A O no hydrogen 3.052 N/A PHE 734.A N VAL 730.A O no hydrogen 2.952 N/A LEU 735.A N GLN 731.A O no hydrogen 2.791 N/A VAL 736.A N MET 732.A O no hydrogen 3.194 N/A GLU 737.A N LYS 733.A O no hydrogen 3.042 N/A GLN 738.A N PHE 734.A O no hydrogen 3.076 N/A MET 739.A N LEU 735.A O no hydrogen 2.979 N/A ARG 740.A N VAL 736.A O no hydrogen 3.041 N/A ARG 741.A N GLN 738.A O no hydrogen 3.050 N/A ARG 741.A NH1 GLU 58.A OE1 no hydrogen 3.247 N/A ARG 741.A NH1 GLU 58.A OE2 no hydrogen 3.345 N/A PHE 744.A N ARG 741.A O no hydrogen 3.135 N/A MET 745.A N ARG 741.A O no hydrogen 2.988 N/A ASP 746.A N PRO 742.A O no hydrogen 2.684 N/A ALA 747.A N ASP 743.A O no hydrogen 3.113 N/A LEU 748.A N PHE 744.A O no hydrogen 2.742 N/A PHE 751.A N LEU 761.A O no hydrogen 3.001 N/A SER 753.A N HIS 759.A O no hydrogen 3.300 N/A ASN 756.A N SER 753.A O no hydrogen 3.157 N/A ASN 756.A N SER 753.A OG no hydrogen 2.891 N/A ALA 758.A N ASN 756.A OD1 no hydrogen 2.842 N/A HIS 759.A N ASN 756.A O no hydrogen 2.995 N/A LEU 761.A N PHE 751.A O no hydrogen 2.681 N/A ARG 765.A N ASN 782.A O no hydrogen 3.186 N/A GLU 768.A N ARG 765.A O no hydrogen 3.211 N/A CYS 769.A N ARG 765.A O no hydrogen 3.261 N/A CYS 769.A N LEU 766.A O no hydrogen 3.267 N/A CYS 769.A SG ARG 765.A O no hydrogen 3.348 N/A CYS 769.A SG ASN 782.A O no hydrogen 3.925 N/A ARG 770.A N TRP 780.A O no hydrogen 2.882 N/A ARG 770.A NH1 GLU 768.A O no hydrogen 3.350 N/A MET 772.A N PRO 778.A O no hydrogen 3.211 N/A LYS 776.A N SER 774.A OG no hydrogen 2.968 N/A LYS 776.A NZ ASP 804.A OD1 no hydrogen 2.615 N/A ARG 777.A N SER 774.A O no hydrogen 3.265 N/A ARG 777.A NE GLN 731.A OE1 no hydrogen 2.725 N/A ARG 777.A NH1 SER 774.A O no hydrogen 2.630 N/A ARG 777.A NH2 GLN 728.A OE1 no hydrogen 2.752 N/A ARG 777.A NH2 GLN 731.A OE1 no hydrogen 2.467 N/A LEU 779.A N PHE 800.A O no hydrogen 2.819 N/A TRP 780.A N ARG 770.A O no hydrogen 2.704 N/A TRP 780.A NE1 GLU 797.A OE2 no hydrogen 3.120 N/A LEU 781.A N ILE 798.A O no hydrogen 3.328 N/A ASN 782.A ND2 GLU 797.A OE2 no hydrogen 2.762 N/A TRP 783.A N ASN 796.A O no hydrogen 2.698 N/A TRP 783.A NE1 LEU 748.A O no hydrogen 2.697 N/A GLU 784.A N ASN 763.A O no hydrogen 2.721 N/A ASN 785.A N GLN 794.A O no hydrogen 2.990 N/A MET 789.A N ASP 787.A OD1 no hydrogen 2.939 N/A ASN 795.A ND2 ASN 782.A OD1 no hydrogen 2.525 N/A ASN 796.A N TRP 783.A O no hydrogen 2.883 N/A ILE 798.A N LEU 781.A O no hydrogen 3.262 N/A ILE 799.A N ILE 847.A O no hydrogen 2.862 N/A PHE 800.A N LEU 779.A O no hydrogen 3.004 N/A LYS 801.A N GLY 845.A O no hydrogen 3.008 N/A LYS 801.A NZ ASP 804.A OD2 no hydrogen 3.042 N/A ASN 802.A ND2 THR 716.A OG1 no hydrogen 3.091 N/A ASN 802.A ND2 ASP 717.A OD1 no hydrogen 2.696 N/A GLY 803.A N CYS 843.A O no hydrogen 2.931 N/A ARG 807.A NH1 ASP 805.A OD1 no hydrogen 3.001 N/A GLN 808.A NE2 ASP 805.A OD2 no hydrogen 2.931 N/A MET 810.A N LEU 806.A O no hydrogen 2.963 N/A LEU 811.A N ARG 807.A O no hydrogen 3.266 N/A THR 812.A N GLN 808.A O no hydrogen 3.096 N/A LEU 813.A N ASP 809.A O no hydrogen 2.922 N/A GLN 814.A N MET 810.A O no hydrogen 2.989 N/A GLN 814.A NE2 GLN 634.A OE1 no hydrogen 3.036 N/A ILE 815.A N LEU 811.A O no hydrogen 2.785 N/A ILE 816.A N THR 812.A O no hydrogen 2.740 N/A ARG 817.A N LEU 813.A O no hydrogen 2.953 N/A ILE 818.A N GLN 814.A O no hydrogen 3.136 N/A MET 819.A N ILE 815.A O no hydrogen 2.838 N/A GLU 820.A N ILE 816.A O no hydrogen 2.819 N/A ASN 821.A N ARG 817.A O no hydrogen 3.138 N/A ASN 821.A ND2 GLN 630.A OE1 no hydrogen 3.380 N/A ILE 822.A N ILE 818.A O no hydrogen 2.918 N/A TRP 823.A N MET 819.A O no hydrogen 2.970 N/A TRP 823.A NE1 ALA 986.A O no hydrogen 3.084 N/A GLN 824.A N GLU 820.A O no hydrogen 2.846 N/A GLN 824.A NE2 HIS 199.A NE2 no hydrogen 3.429 N/A ASN 825.A N ASN 821.A O no hydrogen 2.937 N/A ASN 825.A ND2 ASN 821.A O no hydrogen 2.832 N/A GLN 826.A N TRP 823.A O no hydrogen 3.226 N/A ARG 831.A NE ASP 829.A OD2 no hydrogen 3.053 N/A MET 832.A N LEU 830.A O no hydrogen 3.224 N/A TYR 835.A N LEU 833.A O no hydrogen 2.752 N/A GLY 836.A N GLU 848.A OE2 no hydrogen 2.736 N/A CYS 837.A SG LEU 806.A O no hydrogen 4.014 N/A LEU 838.A N LEU 846.A O no hydrogen 2.899 N/A SER 839.A OG GLY 841.A O no hydrogen 3.232 N/A SER 839.A OG VAL 844.A O no hydrogen 3.346 N/A ILE 840.A N VAL 844.A O no hydrogen 2.974 N/A CYS 843.A SG ASP 842.A OD1 no hydrogen 3.714 N/A LEU 846.A N LEU 838.A O no hydrogen 2.927 N/A ILE 847.A N ILE 799.A O no hydrogen 2.935 N/A GLU 848.A N GLY 836.A O no hydrogen 2.865 N/A SER 853.A OG VAL 850.A O no hydrogen 3.555 N/A HIS 854.A N VAL 922.A O no hydrogen 3.190 N/A THR 855.A N GLN 858.A OE1 no hydrogen 3.125 N/A THR 855.A OG1 GLN 858.A OE1 no hydrogen 2.882 N/A ILE 856.A N ILE 920.A O no hydrogen 3.148 N/A MET 857.A N ASN 917.A O no hydrogen 3.165 N/A GLN 858.A N THR 855.A O no hydrogen 2.724 N/A ILE 859.A N THR 855.A O no hydrogen 3.227 N/A GLN 860.A N ILE 856.A O no hydrogen 2.936 N/A CYS 861.A N MET 857.A O no hydrogen 2.744 N/A CYS 861.A SG MET 857.A O no hydrogen 3.218 N/A LYS 862.A N GLN 858.A O no hydrogen 2.769 N/A GLY 863.A N ILE 859.A O no hydrogen 3.061 N/A THR 875.A N ASN 872.A O no hydrogen 3.133 N/A THR 875.A OG1 ASN 872.A O no hydrogen 2.716 N/A GLN 878.A N HIS 874.A O no hydrogen 2.658 N/A TRP 879.A N THR 875.A O no hydrogen 2.582 N/A LEU 880.A N LEU 876.A O no hydrogen 2.838 N/A LYS 881.A N HIS 877.A O no hydrogen 2.805 N/A ASP 882.A N GLN 878.A O no hydrogen 2.901 N/A LYS 883.A N LEU 880.A O no hydrogen 3.099 N/A ASN 884.A N LEU 880.A O no hydrogen 2.964 N/A ALA 892.A N ILE 888.A O no hydrogen 3.014 N/A ILE 893.A N TYR 889.A O no hydrogen 3.087 N/A ASP 894.A N ASP 890.A O no hydrogen 3.375 N/A LEU 895.A N ALA 891.A O no hydrogen 3.038 N/A PHE 896.A N ALA 892.A O no hydrogen 3.067 N/A THR 897.A N ILE 893.A O no hydrogen 2.816 N/A THR 897.A OG1 ILE 893.A O no hydrogen 2.584 N/A ARG 898.A N ASP 894.A O no hydrogen 2.798 N/A ARG 898.A NE ASP 894.A OD1 no hydrogen 3.191 N/A ARG 898.A NE ASP 894.A OD2 no hydrogen 3.119 N/A ARG 898.A NH1 ASP 829.A O no hydrogen 3.083 N/A SER 899.A N LEU 895.A O no hydrogen 2.741 N/A SER 899.A OG LEU 895.A O no hydrogen 2.934 N/A SER 899.A OG PHE 896.A O no hydrogen 3.124 N/A SER 899.A OG LEU 928.A O no hydrogen 3.553 N/A CYS 900.A N PHE 896.A O no hydrogen 2.827 N/A ALA 901.A N THR 897.A O no hydrogen 3.097 N/A GLY 902.A N ARG 898.A O no hydrogen 3.355 N/A TYR 903.A N SER 899.A O no hydrogen 2.916 N/A TYR 903.A OH LEU 833.A O no hydrogen 3.105 N/A CYS 904.A N ALA 901.A O no hydrogen 3.266 N/A CYS 904.A SG PHE 953.A O no hydrogen 3.806 N/A VAL 905.A N ALA 901.A O no hydrogen 3.112 N/A ALA 906.A N GLY 902.A O no hydrogen 2.946 N/A PHE 908.A N CYS 904.A O no hydrogen 3.014 N/A ILE 909.A N VAL 905.A O no hydrogen 3.009 N/A LEU 910.A N ALA 906.A O no hydrogen 2.848 N/A GLY 911.A N THR 907.A O no hydrogen 2.723 N/A GLY 913.A N PHE 933.A O no hydrogen 2.783 N/A ARG 915.A N PRO 952.A O no hydrogen 2.860 N/A ARG 915.A NE GLY 913.A O no hydrogen 2.999 N/A ARG 915.A NH1 ILE 931.A O no hydrogen 2.908 N/A ARG 915.A NH2 GLY 913.A O no hydrogen 3.081 N/A ARG 915.A NH2 ASP 932.A O no hydrogen 3.165 N/A HIS 916.A N ASN 919.A OD1 no hydrogen 3.406 N/A SER 918.A OG HIS 916.A NE2 no hydrogen 2.875 N/A ASN 919.A N HIS 916.A O no hydrogen 3.130 N/A ASN 919.A ND2 ASP 914.A O no hydrogen 3.431 N/A MET 921.A N PHE 929.A O no hydrogen 2.980 N/A VAL 922.A N HIS 854.A O no hydrogen 2.798 N/A LYS 923.A N GLN 927.A O no hydrogen 2.914 N/A LYS 923.A NZ ASP 925.A OD1 no hydrogen 2.920 N/A LYS 923.A NZ GLN 927.A OE1 no hydrogen 2.887 N/A ASP 924.A N ASN 852.A O no hydrogen 3.413 N/A GLY 926.A N LYS 923.A O no hydrogen 2.672 N/A GLN 927.A NE2 ARG 831.A O no hydrogen 2.697 N/A LEU 928.A N SER 899.A OG no hydrogen 2.910 N/A PHE 929.A N MET 921.A O no hydrogen 2.924 N/A ILE 931.A N ASN 919.A O no hydrogen 3.144 N/A HIS 935.A ND1 GLU 1011.A OE2 no hydrogen 2.740 N/A LYS 941.A N ASP 938.A O no hydrogen 3.349 N/A LYS 942.A N HIS 939.A O no hydrogen 3.330 N/A ARG 948.A NH1 LYS 940.A O no hydrogen 3.351 N/A ARG 948.A NH2 ASP 938.A OD1 no hydrogen 2.599 N/A ARG 950.A NH1 ILE 912.A O no hydrogen 3.052 N/A ARG 950.A NH1 ASP 914.A OD1 no hydrogen 3.119 N/A ARG 950.A NH2 GLY 911.A O no hydrogen 3.213 N/A ARG 950.A NH2 ILE 912.A O no hydrogen 3.323 N/A ARG 950.A NH2 ASP 938.A OD1 no hydrogen 2.951 N/A PHE 959.A N THR 956.A O no hydrogen 3.299 N/A LEU 960.A N THR 956.A O no hydrogen 3.378 N/A ILE 961.A N GLN 957.A O no hydrogen 2.891 N/A ILE 963.A N PHE 959.A O no hydrogen 2.900 N/A SER 964.A N LEU 960.A O no hydrogen 3.116 N/A SER 964.A OG LEU 960.A O no hydrogen 3.031 N/A ALA 967.A N SER 964.A O no hydrogen 2.912 N/A LYS 972.A N GLU 969.A O no hydrogen 3.258 N/A LYS 972.A NZ GLU 969.A OE1 no hydrogen 3.331 N/A THR 973.A OG1 CYS 970.A O no hydrogen 3.501 N/A PHE 976.A N THR 973.A OG1 no hydrogen 3.085 N/A GLU 977.A N THR 973.A O no hydrogen 3.163 N/A ARG 978.A N ARG 974.A O no hydrogen 2.767 N/A ARG 978.A NH2 GLU 975.A OE1 no hydrogen 3.184 N/A PHE 979.A N GLU 975.A O no hydrogen 3.282 N/A GLN 980.A N PHE 976.A O no hydrogen 2.963 N/A GLN 980.A NE2 GLY 1049.A O no hydrogen 2.977 N/A GLU 981.A N GLU 977.A O no hydrogen 3.050 N/A MET 982.A N ARG 978.A O no hydrogen 3.100 N/A MET 982.A N PHE 979.A O no hydrogen 2.741 N/A CYS 983.A N PHE 979.A O no hydrogen 3.065 N/A CYS 983.A SG ALA 901.A O no hydrogen 3.974 N/A CYS 983.A SG PHE 979.A O no hydrogen 4.024 N/A TYR 984.A N GLN 980.A O no hydrogen 3.003 N/A LYS 985.A N GLU 981.A O no hydrogen 3.206 N/A ALA 986.A N MET 982.A O no hydrogen 2.759 N/A TYR 987.A N CYS 983.A O no hydrogen 2.941 N/A TYR 987.A OH THR 1024.A O no hydrogen 2.646 N/A LEU 988.A N TYR 984.A O no hydrogen 3.232 N/A ALA 989.A N LYS 985.A O no hydrogen 3.207 N/A ILE 990.A N ALA 986.A O no hydrogen 3.239 N/A ARG 991.A N TYR 987.A O no hydrogen 3.278 N/A ARG 991.A NE LEU 1025.A O no hydrogen 2.983 N/A ARG 991.A NE ALA 1026.A O no hydrogen 3.071 N/A ARG 991.A NH2 ALA 1026.A O no hydrogen 2.670 N/A GLN 992.A N LEU 988.A O no hydrogen 3.192 N/A HIS 993.A N ILE 990.A O no hydrogen 3.114 N/A ALA 994.A N ARG 991.A O no hydrogen 3.411 N/A LEU 996.A N HIS 993.A O no hydrogen 2.961 N/A ILE 998.A N ALA 994.A O no hydrogen 3.115 N/A ASN 999.A N ASN 995.A O no hydrogen 2.948 N/A LEU 1000.A N LEU 996.A O no hydrogen 2.762 N/A PHE 1001.A N PHE 997.A O no hydrogen 3.079 N/A SER 1002.A N ILE 998.A O no hydrogen 2.652 N/A SER 1002.A OG ILE 998.A O no hydrogen 2.831 N/A MET 1003.A N ASN 999.A O no hydrogen 3.028 N/A MET 1004.A N PHE 1001.A O no hydrogen 3.054 N/A LEU 1005.A N SER 1002.A O no hydrogen 3.425 N/A SER 1007.A OG MET 1004.A O no hydrogen 2.723 N/A MET 1009.A N SER 1007.A O no hydrogen 2.760 N/A GLU 1011.A N GLU 1011.A OE1 no hydrogen 2.849 N/A LEU 1012.A N MET 1009.A O no hydrogen 2.983 N/A GLN 1013.A N ASP 1017.A OD2 no hydrogen 2.661 N/A SER 1014.A N ASP 1017.A OD2 no hydrogen 2.796 N/A SER 1014.A OG ASP 1016.A OD1 no hydrogen 3.098 N/A ASP 1017.A N SER 1014.A O no hydrogen 2.666 N/A ALA 1019.A N ASP 1016.A O no hydrogen 2.833 N/A TYR 1020.A N ASP 1017.A O no hydrogen 3.318 N/A ILE 1021.A N ILE 1018.A O no hydrogen 3.239 N/A ARG 1022.A N ALA 1019.A O no hydrogen 3.045 N/A ARG 1022.A NE ASP 538.A OD2 no hydrogen 3.061 N/A ARG 1022.A NH1 ASP 1028.A OD1 no hydrogen 3.248 N/A ARG 1022.A NH1 ASP 1028.A OD2 no hydrogen 3.366 N/A ARG 1022.A NH2 ASP 538.A OD1 no hydrogen 2.898 N/A ARG 1022.A NH2 ASP 1028.A OD1 no hydrogen 3.107 N/A THR 1024.A N TYR 1020.A O no hydrogen 3.203 N/A THR 1024.A OG1 PHE 908.A O no hydrogen 3.163 N/A LEU 1025.A N ILE 1021.A O no hydrogen 3.322 N/A ALA 1026.A N LYS 1023.A O no hydrogen 2.901 N/A LEU 1027.A N ARG 1022.A O no hydrogen 3.291 N/A GLN 1032.A NE2 GLU 1036.A OE2 no hydrogen 2.685 N/A GLU 1033.A N THR 1030.A OG1 no hydrogen 3.396 N/A ALA 1034.A N THR 1030.A O no hydrogen 2.839 N/A LEU 1035.A N GLU 1031.A O no hydrogen 2.902 N/A GLU 1036.A N GLN 1032.A O no hydrogen 3.428 N/A TYR 1037.A N GLU 1033.A O no hydrogen 2.656 N/A TYR 1037.A OH GLU 949.A OE1 no hydrogen 2.606 N/A PHE 1038.A N ALA 1034.A O no hydrogen 2.835 N/A MET 1039.A N LEU 1035.A O no hydrogen 3.011 N/A LYS 1040.A N GLU 1036.A O no hydrogen 2.772 N/A GLN 1041.A N TYR 1037.A O no hydrogen 2.892 N/A MET 1042.A N PHE 1038.A O no hydrogen 2.775 N/A ASN 1043.A N MET 1039.A O no hydrogen 2.623 N/A ASP 1044.A N LYS 1040.A O no hydrogen 3.126 N/A HIS 1046.A N ASN 1043.A O no hydrogen 2.871 N/A HIS 1047.A N ASN 1043.A O no hydrogen 2.573 N/A HIS 1047.A ND1 ASP 1044.A O no hydrogen 2.937 N/A GLY 1048.A N ASN 1043.A OD1 no hydrogen 2.915 N/A THR 1051.A OG1 TRP 1050.A O no hydrogen 2.676 N/A