Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8w41_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 5.A N GLY 17.A O no hydrogen 2.334 N/A TRP 6.A N PHE 47.A O no hydrogen 2.629 N/A ALA 7.A N GLN 15.A O no hydrogen 2.849 N/A THR 11.A OG1 HIS 9.A NE2 no hydrogen 3.045 N/A PHE 14.A N ASP 12.A O no hydrogen 2.821 N/A GLN 15.A N ALA 7.A O no hydrogen 2.905 N/A GLN 15.A NE2 PRO 8.A O no hydrogen 2.737 N/A GLY 17.A N VAL 5.A O no hydrogen 2.650 N/A VAL 20.A N THR 28.A O no hydrogen 3.160 N/A GLY 23.A N SER 26.A O no hydrogen 2.660 N/A LEU 27.A N ALA 41.A O no hydrogen 2.969 N/A THR 28.A OG1 ASP 21.A OD2 no hydrogen 3.099 N/A ILE 29.A N PHE 39.A O no hydrogen 3.123 N/A GLU 30.A N ASN 18.A O no hydrogen 3.055 N/A GLY 36.A N GLU 30.A OE2 no hydrogen 2.723 N/A LYS 37.A N GLN 34.A O no hydrogen 3.098 N/A THR 38.A OG1 GLU 30.A OE1 no hydrogen 2.684 N/A THR 38.A OG1 GLY 36.A O no hydrogen 3.200 N/A GLN 45.A N LEU 42.A O no hydrogen 3.308 N/A PHE 47.A N TRP 6.A O no hydrogen 3.059 N/A LYS 54.A NZ SER 53.A OG no hydrogen 3.013 N/A VAL 57.A N ASN 74.A OD1 no hydrogen 3.334 N/A ASN 60.A N TYR 87.A O no hydrogen 3.051 N/A CYS 61.A SG MET 670.A O no hydrogen 3.974 N/A SER 62.A N ASP 59.A O no hydrogen 2.993 N/A SER 62.A OG ASP 59.A O no hydrogen 2.434 N/A LEU 63.A N ASN 60.A O no hydrogen 2.942 N/A TYR 65.A N GLU 50.A OE1 no hydrogen 3.383 N/A THR 70.A N ASN 67.A OD1 no hydrogen 3.330 N/A THR 70.A OG1 TYR 65.A O no hydrogen 3.147 N/A THR 70.A OG1 ASN 67.A O no hydrogen 2.955 N/A THR 70.A OG1 ASN 67.A OD1 no hydrogen 2.353 N/A LEU 71.A N ASN 67.A O no hydrogen 3.159 N/A LEU 72.A N GLU 68.A O no hydrogen 2.950 N/A HIS 73.A N ALA 69.A O no hydrogen 2.922 N/A HIS 73.A NE2 SER 53.A O no hydrogen 2.929 N/A ASN 74.A N THR 70.A O no hydrogen 2.867 N/A ASN 74.A ND2 VAL 57.A O no hydrogen 2.992 N/A ASN 74.A ND2 ASN 60.A OD1 no hydrogen 2.400 N/A ILE 75.A N LEU 71.A O no hydrogen 3.003 N/A LYS 76.A N LEU 72.A O no hydrogen 2.925 N/A VAL 77.A N HIS 73.A O no hydrogen 2.923 N/A ARG 78.A N ASN 74.A O no hydrogen 2.972 N/A ARG 78.A NE TYR 85.A O no hydrogen 3.238 N/A ARG 78.A NE THR 86.A OG1 no hydrogen 3.324 N/A ARG 78.A NH2 TYR 85.A O no hydrogen 2.833 N/A TYR 79.A N ILE 75.A O no hydrogen 2.747 N/A SER 80.A OG VAL 77.A O no hydrogen 3.133 N/A LYS 81.A N ARG 78.A O no hydrogen 3.201 N/A ASP 82.A N TYR 79.A O no hydrogen 3.266 N/A ARG 83.A N ARG 78.A O no hydrogen 3.115 N/A TYR 85.A OH TYR 105.A OH no hydrogen 2.609 N/A THR 86.A N ILE 93.A O no hydrogen 2.941 N/A TYR 87.A N GLU 58.A O no hydrogen 3.234 N/A VAL 88.A N ILE 91.A O no hydrogen 2.649 N/A ALA 89.A N ASP 59.A OD1 no hydrogen 3.213 N/A ASN 90.A N VAL 88.A O no hydrogen 2.651 N/A ILE 91.A N VAL 88.A O no hydrogen 3.029 N/A LEU 92.A N PHE 634.A O no hydrogen 3.353 N/A ILE 93.A N THR 86.A O no hydrogen 2.887 N/A ALA 94.A N ARG 636.A O no hydrogen 2.984 N/A ASN 96.A N ILE 638.A O no hydrogen 3.082 N/A TYR 98.A N ASN 96.A OD1 no hydrogen 3.251 N/A TYR 98.A OH GLY 152.A O no hydrogen 3.147 N/A TYR 105.A OH TYR 85.A OH no hydrogen 2.609 N/A SER 107.A OG GLU 168.A OE1 no hydrogen 3.472 N/A ALA 109.A N SER 106.A O no hydrogen 2.892 N/A ILE 110.A N SER 106.A O no hydrogen 3.193 N/A LYS 111.A N SER 107.A O no hydrogen 2.735 N/A SER 112.A N ALA 109.A O no hydrogen 3.013 N/A SER 112.A OG ALA 109.A O no hydrogen 2.817 N/A GLN 114.A NE2 SER 169.A OG no hydrogen 3.097 N/A GLY 115.A N ASP 130.A OD1 no hydrogen 2.814 N/A LYS 116.A N TYR 113.A O no hydrogen 3.108 N/A SER 117.A OG THR 120.A OG1 no hydrogen 3.204 N/A THR 120.A N SER 117.A O no hydrogen 3.051 N/A THR 120.A OG1 SER 117.A O no hydrogen 3.489 N/A THR 120.A OG1 SER 117.A OG no hydrogen 3.204 N/A PHE 126.A N HIS 124.A ND1 no hydrogen 3.481 N/A ALA 127.A N HIS 124.A O no hydrogen 2.926 N/A ALA 129.A N VAL 125.A O no hydrogen 2.983 N/A ASP 130.A N PHE 126.A O no hydrogen 2.841 N/A LYS 131.A N ALA 127.A O no hydrogen 2.844 N/A LYS 131.A NZ ASN 90.A O no hydrogen 3.397 N/A ALA 132.A N ILE 128.A O no hydrogen 2.871 N/A PHE 133.A N ALA 129.A O no hydrogen 2.918 N/A ARG 134.A N ASP 130.A O no hydrogen 2.842 N/A ARG 134.A NH2 LYS 116.A O no hydrogen 3.233 N/A ASP 135.A N LYS 131.A O no hydrogen 2.880 N/A MET 136.A N ALA 132.A O no hydrogen 2.917 N/A LYS 137.A N PHE 133.A O no hydrogen 2.893 N/A VAL 138.A N ARG 134.A O no hydrogen 2.904 N/A LEU 139.A N ASP 135.A O no hydrogen 3.096 N/A GLN 143.A N PHE 435.A O no hydrogen 3.073 N/A SER 144.A OG GLY 631.A O no hydrogen 3.323 N/A ILE 145.A N GLY 437.A O no hydrogen 3.147 N/A ILE 146.A N SER 633.A O no hydrogen 3.052 N/A SER 148.A N ILE 635.A O no hydrogen 3.134 N/A SER 151.A N PHE 444.A O no hydrogen 2.996 N/A LYS 155.A NZ GLY 149.A O no hydrogen 2.865 N/A THR 156.A OG1 SER 202.A OG no hydrogen 2.623 N/A THR 156.A OG1 ASP 440.A OD2 no hydrogen 2.779 N/A ASN 158.A ND2 GLY 154.A O no hydrogen 2.342 N/A THR 159.A N LYS 155.A O no hydrogen 2.911 N/A THR 159.A OG1 LYS 155.A O no hydrogen 3.106 N/A LYS 160.A N THR 156.A O no hydrogen 2.890 N/A LYS 160.A NZ GLU 188.A OE1 no hydrogen 3.376 N/A PHE 161.A N GLU 157.A O no hydrogen 2.958 N/A VAL 162.A N ASN 158.A O no hydrogen 2.905 N/A LEU 163.A N THR 159.A O no hydrogen 2.937 N/A ARG 164.A N LYS 160.A O no hydrogen 2.874 N/A ARG 164.A NH1 TYR 105.A O no hydrogen 2.785 N/A TYR 165.A N PHE 161.A O no hydrogen 2.945 N/A TYR 165.A OH ASP 130.A OD1 no hydrogen 2.638 N/A TYR 165.A OH TYR 170.A OH no hydrogen 3.055 N/A LEU 166.A N VAL 162.A O no hydrogen 2.927 N/A THR 167.A N LEU 163.A O no hydrogen 2.921 N/A THR 167.A OG1 LEU 163.A O no hydrogen 2.580 N/A THR 167.A OG1 ARG 164.A O no hydrogen 3.249 N/A GLU 168.A N ARG 164.A O no hydrogen 2.883 N/A GLU 168.A N TYR 165.A O no hydrogen 3.227 N/A SER 169.A N TYR 165.A O no hydrogen 2.904 N/A SER 169.A OG TYR 165.A O no hydrogen 3.496 N/A TYR 170.A OH ASP 130.A OD1 no hydrogen 2.329 N/A TYR 170.A OH TYR 165.A OH no hydrogen 3.055 N/A THR 172.A N GLN 174.A OE1 no hydrogen 3.072 N/A THR 172.A OG1 GLN 174.A OE1 no hydrogen 2.174 N/A GLN 174.A N GLN 174.A OE1 no hydrogen 2.518 N/A ARG 179.A N ASP 175.A O no hydrogen 2.924 N/A ILE 180.A N ILE 176.A O no hydrogen 2.940 N/A GLU 182.A N ASP 178.A O no hydrogen 2.938 N/A ALA 183.A N ARG 179.A O no hydrogen 2.869 N/A ASN 184.A N VAL 181.A O no hydrogen 2.981 N/A LEU 186.A N ALA 183.A O no hydrogen 3.143 N/A LEU 187.A N ALA 183.A O no hydrogen 3.336 N/A GLU 188.A N ASN 184.A O no hydrogen 2.846 N/A ALA 189.A N PRO 185.A O no hydrogen 2.895 N/A PHE 190.A N LEU 186.A O no hydrogen 3.009 N/A ASN 192.A ND2 GLY 191.A O no hydrogen 2.748 N/A ASN 192.A ND2 SER 201.A O no hydrogen 3.576 N/A ALA 193.A N SER 201.A O no hydrogen 3.175 N/A LYS 194.A NZ GLU 239.A O no hydrogen 3.355 N/A THR 195.A OG1 ASN 198.A O no hydrogen 3.086 N/A ARG 197.A NE TYR 446.A O no hydrogen 3.219 N/A ASN 198.A N THR 195.A OG1 no hydrogen 3.079 N/A ASN 199.A ND2 ASP 306.A OD1 no hydrogen 3.282 N/A ASN 200.A N ASN 198.A OD1 no hydrogen 2.540 N/A SER 201.A N ALA 193.A O no hydrogen 2.677 N/A SER 201.A OG THR 195.A OG1 no hydrogen 3.166 N/A SER 202.A OG THR 156.A OG1 no hydrogen 2.623 N/A ARG 203.A N GLY 191.A O no hydrogen 3.363 N/A ARG 203.A NE GLU 229.A OE1 no hydrogen 2.275 N/A ARG 203.A NH1 GLU 445.A OE1 no hydrogen 2.316 N/A ARG 203.A NH1 GLU 445.A OE2 no hydrogen 3.208 N/A ARG 203.A NH2 GLU 445.A OE2 no hydrogen 2.585 N/A GLY 205.A N TYR 226.A O no hydrogen 3.201 N/A LYS 206.A N ASP 440.A O no hydrogen 3.003 N/A PHE 207.A N SER 224.A O no hydrogen 3.281 N/A GLU 209.A N PHE 222.A O no hydrogen 3.014 N/A ILE 210.A N ILE 436.A O no hydrogen 3.179 N/A HIS 211.A ND1 SER 432.A OG no hydrogen 2.504 N/A HIS 211.A NE2 GLU 209.A OE1 no hydrogen 3.199 N/A PHE 212.A N TYR 434.A O no hydrogen 2.814 N/A ASN 213.A N SER 217.A O no hydrogen 3.029 N/A SER 216.A N ASN 213.A O no hydrogen 3.286 N/A SER 217.A N ASN 213.A OD1 no hydrogen 2.541 N/A VAL 219.A N HIS 211.A O no hydrogen 2.992 N/A VAL 223.A N ASN 424.A OD1 no hydrogen 2.741 N/A TYR 226.A N GLY 205.A O no hydrogen 2.955 N/A GLU 229.A N ARG 203.A O no hydrogen 3.203 N/A LYS 230.A NZ LEU 228.A O no hydrogen 2.561 N/A ARG 232.A NH1 GLU 229.A OE2 no hydrogen 2.504 N/A CYS 234.A N SER 231.A O no hydrogen 3.444 N/A CYS 234.A SG TYR 271.A OH no hydrogen 3.730 N/A CYS 234.A SG ASP 405.A O no hydrogen 3.291 N/A VAL 235.A N SER 231.A O no hydrogen 3.183 N/A GLN 236.A NE2 ASN 242.A OD1 no hydrogen 2.868 N/A ARG 241.A N LYS 194.A O no hydrogen 3.294 N/A ARG 241.A NH1 ASP 311.A OD2 no hydrogen 3.282 N/A ASN 242.A N TYR 247.A OH no hydrogen 3.061 N/A TYR 243.A OH GLU 229.A O no hydrogen 2.130 N/A HIS 244.A N ASN 192.A O no hydrogen 3.074 N/A PHE 246.A N TYR 243.A O no hydrogen 3.232 N/A TYR 247.A N HIS 244.A O no hydrogen 2.780 N/A ARG 248.A N HIS 244.A O no hydrogen 2.711 N/A LEU 249.A N ILE 245.A O no hydrogen 3.130 N/A CYS 250.A SG PHE 246.A O no hydrogen 3.198 N/A CYS 250.A SG SER 264.A O no hydrogen 4.047 N/A ALA 251.A N TYR 247.A O no hydrogen 2.896 N/A GLY 252.A N LEU 249.A O no hydrogen 3.372 N/A ALA 253.A N LEU 249.A O no hydrogen 2.980 N/A ILE 257.A N ASP 256.A OD1 no hydrogen 2.759 N/A ARG 258.A N SER 254.A O no hydrogen 2.808 N/A GLU 259.A N GLU 255.A O no hydrogen 2.955 N/A LYS 260.A N ASP 256.A O no hydrogen 2.876 N/A LEU 261.A N ILE 257.A O no hydrogen 3.029 N/A LEU 263.A N ARG 258.A O no hydrogen 3.394 N/A SER 264.A OG SER 265.A O no hydrogen 3.433 N/A SER 265.A OG ASP 267.A OD1 no hydrogen 2.307 N/A ASN 268.A N SER 265.A O no hydrogen 2.938 N/A ASN 268.A ND2 SER 264.A OG no hydrogen 2.984 N/A PHE 269.A N PRO 266.A O no hydrogen 3.378 N/A ARG 270.A NE ASP 349.A OD1 no hydrogen 3.124 N/A ARG 270.A NH2 ASP 349.A OD2 no hydrogen 2.445 N/A TYR 271.A OH ASP 405.A OD1 no hydrogen 2.637 N/A LEU 272.A N PHE 269.A O no hydrogen 3.225 N/A ASN 273.A N PHE 269.A O no hydrogen 3.154 N/A ASN 273.A ND2 ASP 267.A O no hydrogen 2.451 N/A ARG 274.A NH2 CYS 234.A O no hydrogen 2.620 N/A GLY 275.A N LEU 272.A O no hydrogen 3.018 N/A CYS 276.A N GLU 240.A O no hydrogen 3.211 N/A ARG 278.A NE GLU 297.A OE1 no hydrogen 2.726 N/A PHE 280.A N ASP 311.A OD2 no hydrogen 2.544 N/A ASN 282.A N ASP 310.A OD2 no hydrogen 2.837 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.583 N/A THR 285.A OG1 ASN 282.A O no hydrogen 2.883 N/A THR 285.A OG1 ASP 310.A OD1 no hydrogen 3.162 N/A THR 285.A OG1 ASP 310.A OD2 no hydrogen 2.633 N/A ASP 286.A N ASN 282.A O no hydrogen 2.524 N/A LYS 287.A N LYS 283.A O no hydrogen 2.940 N/A GLN 288.A N GLU 284.A O no hydrogen 2.915 N/A ILE 289.A N THR 285.A O no hydrogen 3.084 N/A ARG 293.A N LEU 290.A O no hydrogen 3.193 N/A ARG 293.A NE CYS 250.A O no hydrogen 3.355 N/A ARG 293.A NH1 ASN 292.A OD1 no hydrogen 3.384 N/A ARG 293.A NH2 SER 254.A O no hydrogen 2.975 N/A LYS 294.A N GLN 291.A O no hydrogen 3.263 N/A LYS 294.A NZ ASP 286.A O no hydrogen 2.923 N/A LYS 294.A NZ ASP 286.A OD1 no hydrogen 2.899 N/A GLU 297.A N SER 295.A OG no hydrogen 3.402 N/A TYR 298.A N SER 295.A O no hydrogen 2.950 N/A TYR 298.A OH ASP 286.A OD1 no hydrogen 2.563 N/A LEU 299.A N SER 295.A O no hydrogen 3.359 N/A LYS 300.A N PRO 296.A O no hydrogen 2.922 N/A ALA 301.A N GLU 297.A O no hydrogen 2.935 N/A SER 303.A OG ALA 281.A O no hydrogen 3.097 N/A LYS 305.A NZ ALA 281.A O no hydrogen 2.313 N/A LYS 305.A NZ SER 303.A OG no hydrogen 2.752 N/A LEU 308.A N ASP 306.A OD2 no hydrogen 3.260 N/A ASP 310.A N ASP 314.A OD2 no hydrogen 2.612 N/A ASP 311.A N PHE 280.A O no hydrogen 2.651 N/A ASP 314.A N ASP 310.A O no hydrogen 2.427 N/A PHE 315.A N ASP 311.A O no hydrogen 2.889 N/A ILE 316.A N HIS 312.A O no hydrogen 3.034 N/A ARG 317.A N GLY 313.A O no hydrogen 2.861 N/A ARG 317.A NE ASP 314.A OD1 no hydrogen 3.378 N/A MET 318.A N ASP 314.A O no hydrogen 2.851 N/A CYS 319.A N PHE 315.A O no hydrogen 2.865 N/A CYS 319.A SG PHE 315.A O no hydrogen 3.445 N/A THR 320.A N ILE 316.A O no hydrogen 3.025 N/A THR 320.A OG1 ILE 316.A O no hydrogen 3.430 N/A THR 320.A OG1 ARG 317.A O no hydrogen 2.349 N/A ALA 321.A N ARG 317.A O no hydrogen 2.853 N/A MET 322.A N MET 318.A O no hydrogen 2.819 N/A LYS 323.A N CYS 319.A O no hydrogen 2.977 N/A LYS 324.A N THR 320.A O no hydrogen 2.862 N/A ILE 325.A N ALA 321.A O no hydrogen 2.876 N/A GLY 326.A N LYS 323.A O no hydrogen 3.297 N/A LEU 327.A N MET 322.A O no hydrogen 2.751 N/A GLU 331.A N ASP 328.A OD1 no hydrogen 2.703 N/A LYS 332.A N ASP 328.A O no hydrogen 3.104 N/A LEU 333.A N ASP 329.A O no hydrogen 2.892 N/A ASP 334.A N GLU 330.A O no hydrogen 2.905 N/A LEU 335.A N GLU 331.A O no hydrogen 2.955 N/A PHE 336.A N LYS 332.A O no hydrogen 2.981 N/A ARG 337.A N LEU 333.A O no hydrogen 2.808 N/A ARG 337.A NH2 ASP 598.A OD2 no hydrogen 2.402 N/A VAL 338.A N ASP 334.A O no hydrogen 2.984 N/A VAL 339.A N LEU 335.A O no hydrogen 2.976 N/A ALA 340.A N PHE 336.A O no hydrogen 2.912 N/A GLY 341.A N ARG 337.A O no hydrogen 2.854 N/A VAL 342.A N VAL 338.A O no hydrogen 2.950 N/A LEU 343.A N VAL 339.A O no hydrogen 2.924 N/A HIS 344.A N ALA 340.A O no hydrogen 2.890 N/A LEU 345.A N GLY 341.A O no hydrogen 3.005 N/A GLY 346.A N LEU 343.A O no hydrogen 3.321 N/A ASN 347.A N HIS 344.A O no hydrogen 2.621 N/A ASN 347.A ND2 ASN 268.A O no hydrogen 2.966 N/A GLU 351.A N ASN 361.A O no hydrogen 2.563 N/A ALA 353.A N GLY 359.A O no hydrogen 2.699 N/A SER 357.A OG SER 357.A O no hydrogen 2.601 N/A CYS 360.A SG THR 389.A O no hydrogen 3.488 N/A CYS 360.A SG LEU 395.A O no hydrogen 3.135 N/A CYS 360.A SG LYS 396.A O no hydrogen 3.603 N/A ASN 361.A N GLU 351.A O no hydrogen 2.602 N/A SER 366.A OG LYS 363.A O no hydrogen 3.031 N/A ALA 367.A N ASN 364.A O no hydrogen 3.320 N/A GLN 368.A NE2 TYR 372.A OH no hydrogen 2.709 N/A SER 369.A OG HIS 344.A O no hydrogen 3.406 N/A LEU 370.A N SER 366.A O no hydrogen 2.659 N/A GLU 371.A N ALA 367.A O no hydrogen 3.176 N/A TYR 372.A N GLN 368.A O no hydrogen 2.935 N/A CYS 373.A N SER 369.A O no hydrogen 2.841 N/A ALA 374.A N LEU 370.A O no hydrogen 2.928 N/A GLU 375.A N GLU 371.A O no hydrogen 2.940 N/A LEU 376.A N TYR 372.A O no hydrogen 2.903 N/A LEU 377.A N CYS 373.A O no hydrogen 2.991 N/A LEU 379.A N ALA 374.A O no hydrogen 2.688 N/A ASP 382.A N ASP 380.A OD1 no hydrogen 3.266 N/A ASP 383.A N ASP 380.A OD2 no hydrogen 3.396 N/A LEU 384.A N ASP 380.A O no hydrogen 2.730 N/A ARG 385.A N GLN 381.A O no hydrogen 2.957 N/A ARG 385.A NH1 ASP 382.A OD1 no hydrogen 2.203 N/A VAL 386.A N ASP 382.A O no hydrogen 2.973 N/A SER 387.A N ASP 383.A O no hydrogen 2.916 N/A SER 387.A OG ASP 383.A O no hydrogen 3.372 N/A SER 387.A OG LEU 384.A O no hydrogen 2.605 N/A LEU 388.A N LEU 384.A O no hydrogen 2.969 N/A THR 389.A N ARG 385.A O no hydrogen 2.863 N/A THR 389.A OG1 ARG 385.A O no hydrogen 2.286 N/A THR 390.A OG1 VAL 386.A O no hydrogen 3.275 N/A ARG 391.A N VAL 393.A O no hydrogen 2.946 N/A VAL 393.A N ARG 391.A O no hydrogen 3.236 N/A LYS 396.A N GLN 399.A OE1 no hydrogen 2.387 N/A ALA 400.A N LYS 396.A O no hydrogen 2.689 N/A ASN 401.A N VAL 397.A O no hydrogen 2.916 N/A ASN 402.A N GLU 398.A O no hydrogen 2.924 N/A ALA 403.A N GLN 399.A O no hydrogen 2.852 N/A ARG 404.A N ALA 400.A O no hydrogen 2.945 N/A ARG 404.A NH1 GLY 346.A O no hydrogen 2.403 N/A ASP 405.A N ASN 401.A O no hydrogen 2.946 N/A ALA 406.A N ASN 402.A O no hydrogen 2.837 N/A LEU 407.A N ALA 403.A O no hydrogen 2.987 N/A ALA 408.A N ARG 404.A O no hydrogen 2.981 N/A LYS 409.A N ASP 405.A O no hydrogen 2.872 N/A THR 410.A N ALA 406.A O no hydrogen 2.968 N/A THR 410.A OG1 ALA 406.A O no hydrogen 3.125 N/A THR 410.A OG1 LEU 407.A O no hydrogen 2.696 N/A VAL 411.A N LEU 407.A O no hydrogen 2.945 N/A TYR 412.A N ALA 408.A O no hydrogen 2.952 N/A TYR 412.A OH PHE 190.A O no hydrogen 2.898 N/A SER 413.A N LYS 409.A O no hydrogen 2.900 N/A HIS 414.A N THR 410.A O no hydrogen 2.994 N/A HIS 414.A ND1 THR 410.A O no hydrogen 2.990 N/A LEU 415.A N VAL 411.A O no hydrogen 2.868 N/A PHE 416.A N TYR 412.A O no hydrogen 2.924 N/A ASP 417.A N SER 413.A O no hydrogen 2.961 N/A HIS 418.A N HIS 414.A O no hydrogen 2.883 N/A VAL 419.A N LEU 415.A O no hydrogen 2.936 N/A VAL 420.A N PHE 416.A O no hydrogen 2.929 N/A ASN 421.A N ASP 417.A O no hydrogen 2.912 N/A ARG 422.A N HIS 418.A O no hydrogen 2.899 N/A ARG 422.A NH1 ILE 325.A O no hydrogen 3.570 N/A ARG 422.A NH1 ARG 422.A O no hydrogen 3.504 N/A ARG 422.A NH2 GLY 326.A O no hydrogen 2.690 N/A VAL 423.A N VAL 419.A O no hydrogen 2.937 N/A ASN 424.A N VAL 420.A O no hydrogen 2.885 N/A ASN 424.A ND2 VAL 223.A O no hydrogen 3.164 N/A GLN 425.A N ASN 421.A O no hydrogen 2.949 N/A CYS 426.A N ARG 422.A O no hydrogen 2.932 N/A CYS 426.A N VAL 423.A O no hydrogen 3.062 N/A CYS 426.A SG ILE 325.A O no hydrogen 3.052 N/A CYS 426.A SG ARG 422.A O no hydrogen 3.014 N/A SER 432.A OG HIS 211.A ND1 no hydrogen 2.504 N/A SER 433.A N PHE 212.A O no hydrogen 3.128 N/A SER 433.A OG GLU 214.A OE2 no hydrogen 2.715 N/A TYR 434.A N PHE 212.A O no hydrogen 3.488 N/A ILE 436.A N ILE 210.A O no hydrogen 3.257 N/A GLY 437.A N GLN 143.A O no hydrogen 2.989 N/A VAL 438.A N VAL 208.A O no hydrogen 3.200 N/A LEU 439.A N ILE 145.A O no hydrogen 3.290 N/A ASP 440.A N LYS 206.A O no hydrogen 2.985 N/A GLU 445.A N ASN 458.A OD1 no hydrogen 2.974 N/A PHE 447.A N ASN 450.A OD1 no hydrogen 2.620 N/A HIS 449.A ND1 GLU 573.A OE2 no hydrogen 3.080 N/A ASN 450.A ND2 PHE 447.A O no hydrogen 2.991 N/A ASN 450.A ND2 CYS 571.A O no hydrogen 2.619 N/A SER 451.A N GLN 454.A OE1 no hydrogen 3.100 N/A GLU 453.A N GLU 453.A OE1 no hydrogen 2.733 N/A GLN 454.A N GLN 454.A OE1 no hydrogen 2.675 N/A PHE 455.A N SER 451.A O no hydrogen 3.089 N/A CYS 456.A N PHE 452.A O no hydrogen 2.920 N/A CYS 456.A SG PHE 452.A O no hydrogen 3.124 N/A ILE 457.A N GLU 453.A O no hydrogen 2.918 N/A ASN 458.A N GLN 454.A O no hydrogen 2.909 N/A ASN 458.A ND2 GLU 445.A O no hydrogen 2.952 N/A ASN 458.A ND2 TYR 572.A OH no hydrogen 2.294 N/A TYR 459.A N PHE 455.A O no hydrogen 2.908 N/A TYR 459.A OH GLU 503.A OE1 no hydrogen 3.152 N/A CYS 460.A N CYS 456.A O no hydrogen 2.909 N/A ASN 461.A N ILE 457.A O no hydrogen 2.968 N/A ASN 461.A ND2 ALA 442.A O no hydrogen 3.130 N/A ASN 461.A ND2 ILE 457.A O no hydrogen 2.450 N/A GLU 462.A N ASN 458.A O no hydrogen 2.846 N/A LYS 463.A N TYR 459.A O no hydrogen 2.997 N/A LYS 463.A NZ GLU 503.A OE1 no hydrogen 2.340 N/A LEU 464.A N CYS 460.A O no hydrogen 2.996 N/A GLN 465.A N ASN 461.A O no hydrogen 2.919 N/A GLN 465.A NE2 SER 661.A O no hydrogen 2.818 N/A GLN 466.A N GLU 462.A O no hydrogen 2.924 N/A GLN 466.A NE2 GLN 466.A O no hydrogen 2.741 N/A PHE 467.A N LYS 463.A O no hydrogen 2.878 N/A PHE 468.A N LEU 464.A O no hydrogen 2.933 N/A ASN 469.A N GLN 465.A O no hydrogen 2.909 N/A ASN 469.A ND2 VAL 493.A O no hydrogen 3.269 N/A GLU 470.A N GLN 466.A O no hydrogen 2.928 N/A ARG 471.A N PHE 467.A O no hydrogen 2.889 N/A ARG 471.A NH2 THR 630.A O no hydrogen 3.257 N/A ILE 472.A N PHE 468.A O no hydrogen 2.958 N/A LEU 473.A N ASN 469.A O no hydrogen 2.877 N/A LYS 474.A N ASN 469.A O no hydrogen 2.981 N/A LYS 474.A NZ TYR 492.A OH no hydrogen 2.675 N/A GLU 475.A N GLU 470.A O no hydrogen 2.665 N/A GLN 477.A N LEU 473.A O no hydrogen 2.856 N/A GLN 477.A NE2 VAL 490.A O no hydrogen 2.722 N/A GLU 478.A N LYS 474.A O no hydrogen 2.926 N/A LEU 479.A N GLU 475.A O no hydrogen 2.888 N/A TYR 480.A N GLU 476.A O no hydrogen 2.883 N/A TYR 480.A OH TYR 674.A O no hydrogen 2.568 N/A GLN 481.A N GLN 477.A O no hydrogen 2.920 N/A LYS 482.A N GLU 478.A O no hydrogen 2.955 N/A GLU 483.A N LEU 479.A O no hydrogen 2.934 N/A GLY 484.A N GLN 481.A O no hydrogen 2.767 N/A LEU 485.A N TYR 480.A O no hydrogen 3.252 N/A GLN 496.A NE2 GLN 466.A OE1 no hydrogen 2.442 N/A CYS 498.A N ASN 495.A O no hydrogen 2.913 N/A CYS 498.A N ASP 497.A OD1 no hydrogen 2.810 N/A CYS 498.A SG HIS 565.A ND1 no hydrogen 3.620 N/A ILE 499.A N ASN 495.A O no hydrogen 3.322 N/A ASP 500.A N GLN 496.A O no hydrogen 2.932 N/A LEU 501.A N ASP 497.A O no hydrogen 2.853 N/A ILE 502.A N CYS 498.A O no hydrogen 2.964 N/A GLU 503.A N ILE 499.A O no hydrogen 2.945 N/A ILE 509.A N LEU 501.A O no hydrogen 2.908 N/A LEU 510.A N ILE 502.A O no hydrogen 3.115 N/A ILE 512.A N GLY 508.A O no hydrogen 2.988 N/A LEU 513.A N ILE 509.A O no hydrogen 2.886 N/A ASP 514.A N LEU 510.A O no hydrogen 2.879 N/A GLU 515.A N ASP 511.A O no hydrogen 2.891 N/A GLU 516.A N ILE 512.A O no hydrogen 2.875 N/A ASN 517.A N LEU 513.A O no hydrogen 2.914 N/A ARG 518.A N ASP 514.A O no hydrogen 2.927 N/A LEU 519.A N GLU 516.A O no hydrogen 3.255 N/A SER 523.A N GLU 516.A OE2 no hydrogen 2.286 N/A GLN 525.A N GLN 525.A OE1 no hydrogen 2.957 N/A HIS 526.A N SER 523.A OG no hydrogen 2.951 N/A PHE 527.A N SER 523.A O no hydrogen 3.195 N/A THR 528.A N ASP 524.A O no hydrogen 3.005 N/A THR 528.A OG1 ASP 524.A O no hydrogen 2.964 N/A THR 528.A OG1 THR 574.A OG1 no hydrogen 2.399 N/A SER 529.A N GLN 525.A O no hydrogen 2.914 N/A SER 529.A OG GLN 525.A O no hydrogen 3.249 N/A SER 529.A OG HIS 526.A O no hydrogen 2.565 N/A ALA 530.A N HIS 526.A O no hydrogen 2.847 N/A VAL 531.A N PHE 527.A O no hydrogen 2.954 N/A HIS 532.A N THR 528.A O no hydrogen 2.971 N/A HIS 532.A NE2 ASP 557.A O no hydrogen 2.712 N/A GLN 533.A N ALA 530.A O no hydrogen 3.018 N/A LYS 534.A N ALA 530.A O no hydrogen 2.911 N/A LYS 534.A NZ LEU 506.A O no hydrogen 2.888 N/A HIS 535.A N VAL 531.A O no hydrogen 3.253 N/A HIS 535.A NE2 VAL 507.A O no hydrogen 2.170 N/A ARG 540.A N HIS 538.A ND1 no hydrogen 3.532 N/A ARG 540.A NE ASP 497.A OD1 no hydrogen 2.970 N/A ARG 540.A NE ASP 497.A OD2 no hydrogen 2.767 N/A ARG 540.A NH2 ASP 494.A O no hydrogen 3.317 N/A ARG 540.A NH2 ASP 497.A OD1 no hydrogen 3.358 N/A THR 542.A N ILE 562.A O no hydrogen 2.658 N/A THR 542.A OG1 ILE 562.A O no hydrogen 2.765 N/A LYS 546.A N ILE 543.A O no hydrogen 3.003 N/A SER 547.A N PRO 544.A O no hydrogen 3.142 N/A SER 547.A OG LEU 549.A O no hydrogen 3.565 N/A LYS 548.A NZ GLU 975.A OE1 no hydrogen 3.287 N/A ARG 553.A NH1 SER 547.A O no hydrogen 2.628 N/A ARG 553.A NH2 SER 547.A O no hydrogen 3.360 N/A ASN 554.A N VAL 551.A O no hydrogen 3.412 N/A ILE 555.A N HIS 552.A O no hydrogen 3.088 N/A ARG 556.A NH2 ASP 558.A OD2 no hydrogen 3.091 N/A GLU 559.A N ARG 556.A O no hydrogen 3.362 N/A PHE 561.A N TYR 572.A O no hydrogen 3.168 N/A ILE 562.A N THR 542.A O no hydrogen 2.750 N/A ILE 563.A N VAL 570.A O no hydrogen 3.335 N/A ARG 564.A N ARG 540.A O no hydrogen 3.019 N/A ARG 564.A NE PHE 539.A O no hydrogen 2.963 N/A ARG 564.A NE ARG 540.A O no hydrogen 2.981 N/A ARG 564.A NH1 PHE 539.A O no hydrogen 2.178 N/A ARG 564.A NH2 GLU 975.A OE2 no hydrogen 3.462 N/A HIS 565.A N ILE 563.A O no hydrogen 3.111 N/A HIS 565.A N GLY 568.A O no hydrogen 2.721 N/A HIS 565.A NE2 TYR 572.A OH no hydrogen 3.328 N/A PHE 566.A N GLU 462.A OE1 no hydrogen 3.362 N/A GLY 568.A N HIS 565.A O no hydrogen 3.341 N/A VAL 570.A N ILE 563.A O no hydrogen 3.243 N/A TYR 572.A N PHE 561.A O no hydrogen 2.868 N/A TYR 572.A OH GLN 454.A O no hydrogen 3.301 N/A TYR 572.A OH HIS 565.A NE2 no hydrogen 3.328 N/A THR 574.A N GLU 559.A O no hydrogen 2.492 N/A THR 574.A OG1 THR 528.A OG1 no hydrogen 2.399 N/A GLN 576.A N ASP 524.A OD2 no hydrogen 3.163 N/A VAL 578.A N ASP 524.A OD1 no hydrogen 3.062 N/A LYS 580.A N GLN 576.A O no hydrogen 3.186 N/A ASN 581.A N PHE 577.A O no hydrogen 2.911 N/A ASN 581.A ND2 PHE 577.A O no hydrogen 2.232 N/A ASN 582.A N GLU 579.A O no hydrogen 3.123 N/A ASP 583.A N ILE 610.A O no hydrogen 3.036 N/A ALA 584.A N ASN 582.A OD1 no hydrogen 3.068 N/A SER 588.A N HIS 586.A ND1 no hydrogen 2.868 N/A SER 588.A OG HIS 586.A ND1 no hydrogen 3.239 N/A LEU 589.A N HIS 586.A O no hydrogen 3.113 N/A GLU 590.A N HIS 586.A O no hydrogen 3.398 N/A SER 591.A N MET 587.A O no hydrogen 2.894 N/A SER 591.A OG MET 587.A O no hydrogen 2.695 N/A SER 591.A OG SER 588.A O no hydrogen 2.523 N/A LEU 592.A N SER 588.A O no hydrogen 2.853 N/A ILE 593.A N LEU 589.A O no hydrogen 2.930 N/A ILE 593.A N GLU 590.A O no hydrogen 3.330 N/A CYS 594.A N GLU 590.A O no hydrogen 2.950 N/A CYS 594.A SG GLU 590.A O no hydrogen 3.324 N/A CYS 594.A SG GLU 590.A OE2 no hydrogen 3.005 N/A SER 596.A N ILE 593.A O no hydrogen 2.964 N/A SER 596.A OG LEU 377.A O no hydrogen 2.632 N/A SER 596.A OG GLY 378.A O no hydrogen 2.639 N/A ARG 597.A N GLY 378.A O no hydrogen 2.861 N/A PHE 600.A N ASP 598.A OD1 no hydrogen 3.398 N/A ARG 602.A N ASP 598.A O no hydrogen 3.489 N/A GLU 603.A N LYS 599.A O no hydrogen 2.941 N/A LEU 604.A N PHE 600.A O no hydrogen 2.842 N/A PHE 605.A N ILE 601.A O no hydrogen 3.045 N/A GLU 606.A N ARG 602.A O no hydrogen 2.891 N/A VAL 612.A N ASN 581.A O no hydrogen 2.468 N/A ASN 614.A N SER 611.A OG no hydrogen 3.221 N/A LYS 615.A N SER 611.A O no hydrogen 3.384 N/A PHE 616.A N VAL 612.A O no hydrogen 2.882 N/A LYS 617.A N GLY 613.A O no hydrogen 2.846 N/A LYS 617.A NZ ASP 511.A OD1 no hydrogen 3.019 N/A LYS 617.A NZ ASN 614.A OD1 no hydrogen 3.014 N/A THR 618.A N ASN 614.A O no hydrogen 2.962 N/A THR 618.A OG1 ASN 614.A O no hydrogen 3.295 N/A THR 618.A OG1 LYS 615.A O no hydrogen 2.408 N/A GLN 619.A N LYS 615.A O no hydrogen 2.931 N/A LEU 620.A N PHE 616.A O no hydrogen 2.882 N/A ASN 621.A N LYS 617.A O no hydrogen 2.908 N/A LEU 622.A N THR 618.A O no hydrogen 2.944 N/A LEU 623.A N GLN 619.A O no hydrogen 2.904 N/A LEU 624.A N LEU 620.A O no hydrogen 2.844 N/A ASP 625.A N ASN 621.A O no hydrogen 2.881 N/A LYS 626.A N LEU 622.A O no hydrogen 2.972 N/A LYS 626.A NZ GLU 209.A OE2 no hydrogen 2.670 N/A LEU 627.A N LEU 623.A O no hydrogen 2.923 N/A ARG 628.A N LEU 624.A O no hydrogen 2.814 N/A ARG 628.A NH1 GLU 470.A OE1 no hydrogen 2.626 N/A SER 629.A N ASP 625.A O no hydrogen 2.970 N/A THR 630.A N LYS 626.A O no hydrogen 3.221 N/A THR 630.A N LEU 627.A O no hydrogen 3.006 N/A THR 630.A OG1 LEU 627.A O no hydrogen 2.866 N/A THR 630.A OG1 GLY 631.A O no hydrogen 2.794 N/A GLY 631.A N SER 142.A O no hydrogen 3.094 N/A SER 633.A N SER 144.A O no hydrogen 3.077 N/A ARG 636.A N LEU 92.A O no hydrogen 2.871 N/A ARG 636.A NH2 GLN 465.A OE1 no hydrogen 2.945 N/A ARG 636.A NH2 SER 661.A OG no hydrogen 2.561 N/A CYS 637.A N SER 148.A O no hydrogen 3.169 N/A CYS 637.A SG GLY 154.A O no hydrogen 3.183 N/A ILE 638.A N ALA 94.A O no hydrogen 3.155 N/A LYS 639.A N GLN 657.A OE1 no hydrogen 3.287 N/A LYS 639.A NZ SER 151.A O no hydrogen 3.151 N/A ASN 641.A ND2 THR 645.A O no hydrogen 2.655 N/A ASN 641.A ND2 HIS 648.A O no hydrogen 2.646 N/A SER 646.A OG PRO 97.A O no hydrogen 3.339 N/A GLU 650.A N PRO 640.A O no hydrogen 3.431 N/A ALA 652.A N THR 11.A O no hydrogen 2.985 N/A LEU 655.A N GLY 651.A O no hydrogen 2.892 N/A SER 656.A N ALA 652.A O no hydrogen 2.913 N/A SER 656.A OG GLU 980.A OE1 no hydrogen 3.483 N/A GLN 657.A N GLN 653.A O no hydrogen 2.949 N/A GLN 657.A NE2 LYS 639.A O no hydrogen 3.189 N/A GLN 657.A NE2 GLN 653.A O no hydrogen 3.118 N/A LEU 658.A N ILE 654.A O no hydrogen 2.881 N/A GLN 659.A N LEU 655.A O no hydrogen 2.934 N/A GLN 659.A NE2 GLU 68.A OE1 no hydrogen 2.370 N/A CYS 660.A N SER 656.A O no hydrogen 2.917 N/A CYS 660.A SG PHE 566.A O no hydrogen 3.430 N/A CYS 660.A SG ALA 567.A O no hydrogen 3.142 N/A SER 661.A N GLN 657.A O no hydrogen 2.830 N/A GLY 662.A N GLN 659.A O no hydrogen 3.431 N/A MET 663.A N LEU 658.A O no hydrogen 3.247 N/A VAL 666.A N GLY 662.A O no hydrogen 3.143 N/A LEU 667.A N MET 663.A O no hydrogen 2.941 N/A ASP 668.A N VAL 664.A O no hydrogen 2.921 N/A LEU 669.A N SER 665.A O no hydrogen 2.896 N/A MET 670.A N VAL 666.A O no hydrogen 2.838 N/A GLN 671.A N LEU 667.A O no hydrogen 2.913 N/A GLY 672.A N LEU 669.A O no hydrogen 3.430 N/A GLY 673.A N LEU 669.A O no hydrogen 2.896 N/A TYR 674.A N TYR 480.A OH no hydrogen 2.457 N/A HIS 681.A N SER 679.A OG no hydrogen 3.057 N/A LEU 683.A N SER 679.A O no hydrogen 3.328 N/A TYR 684.A N PHE 680.A O no hydrogen 2.869 N/A TYR 684.A OH ALA 696.A O no hydrogen 3.114 N/A ASN 685.A N HIS 681.A O no hydrogen 2.926 N/A MET 686.A N GLU 682.A O no hydrogen 2.813 N/A TYR 687.A N LEU 683.A O no hydrogen 2.942 N/A TYR 687.A OH ILE 738.A O no hydrogen 2.406 N/A LYS 688.A N TYR 684.A O no hydrogen 2.885 N/A TYR 690.A N TYR 687.A O no hydrogen 2.912 N/A MET 691.A N TYR 687.A O no hydrogen 2.499 N/A LYS 694.A N ASP 693.A OD1 no hydrogen 2.695 N/A ARG 697.A N LYS 694.A O no hydrogen 3.020 N/A LEU 698.A N LEU 695.A O no hydrogen 3.277 N/A ARG 701.A N ASP 699.A OD2 no hydrogen 2.859 N/A PHE 703.A N ASP 699.A O no hydrogen 2.798 N/A CYS 704.A N PRO 700.A O no hydrogen 2.960 N/A CYS 704.A SG PHE 680.A O no hydrogen 3.582 N/A CYS 704.A SG PRO 700.A O no hydrogen 3.337 N/A LYS 705.A N ARG 701.A O no hydrogen 2.818 N/A ALA 706.A N LEU 702.A O no hydrogen 2.946 N/A LEU 707.A N PHE 703.A O no hydrogen 3.130 N/A LEU 707.A N CYS 704.A O no hydrogen 3.194 N/A PHE 708.A N LYS 705.A O no hydrogen 3.339 N/A ALA 710.A N LEU 707.A O no hydrogen 3.061 N/A GLY 712.A N LYS 709.A O no hydrogen 2.778 N/A LEU 713.A N PHE 708.A O no hydrogen 3.047 N/A ASN 716.A N ASN 714.A OD1 no hydrogen 2.331 N/A LYS 719.A NZ LEU 485.A O no hydrogen 2.766 N/A GLY 721.A N LYS 724.A O no hydrogen 2.995 N/A LEU 722.A N GLU 483.A OE2 no hydrogen 2.725 N/A THR 723.A N GLU 483.A OE2 no hydrogen 2.853 N/A THR 723.A OG1 THR 723.A O no hydrogen 2.538 N/A VAL 725.A N ALA 678.A O no hydrogen 2.510 N/A PHE 727.A N SER 676.A O no hydrogen 2.866 N/A ARG 728.A N ASP 717.A O no hydrogen 2.675 N/A ARG 728.A NH1 GLN 671.A O no hydrogen 3.132 N/A PHE 735.A N LYS 731.A O no hydrogen 3.446 N/A ASP 736.A N PHE 732.A O no hydrogen 2.976 N/A ILE 738.A N GLU 734.A O no hydrogen 2.882 N/A MET 739.A N PHE 735.A O no hydrogen 2.936 N/A LYS 740.A N GLN 737.A O no hydrogen 3.062 N/A LEU 746.A N ASP 742.A O no hydrogen 2.619 N/A ALA 747.A N PRO 743.A O no hydrogen 2.889 N/A GLU 748.A N ASP 744.A O no hydrogen 2.928 N/A LEU 749.A N HIS 745.A O no hydrogen 2.897 N/A VAL 750.A N LEU 746.A O no hydrogen 2.837 N/A LYS 751.A N ALA 747.A O no hydrogen 2.980 N/A ARG 752.A N GLU 748.A O no hydrogen 2.965 N/A ARG 752.A NE GLU 748.A OE2 no hydrogen 3.102 N/A VAL 753.A N LEU 749.A O no hydrogen 2.824 N/A ASN 754.A N VAL 750.A O no hydrogen 2.877 N/A HIS 755.A N LYS 751.A O no hydrogen 2.985 N/A TRP 756.A N ARG 752.A O no hydrogen 2.904 N/A LEU 757.A N VAL 753.A O no hydrogen 2.878 N/A THR 758.A N ASN 754.A O no hydrogen 2.948 N/A CYS 759.A N HIS 755.A O no hydrogen 2.877 N/A CYS 759.A SG HIS 755.A O no hydrogen 3.114 N/A SER 760.A N TRP 756.A O no hydrogen 2.923 N/A ARG 761.A N LEU 757.A O no hydrogen 2.911 N/A TRP 762.A N THR 758.A O no hydrogen 2.995 N/A LYS 763.A N CYS 759.A O no hydrogen 2.864 N/A LYS 764.A N SER 760.A O no hydrogen 2.868 N/A GLN 766.A N TRP 762.A O no hydrogen 2.993 N/A TRP 767.A N LYS 763.A O no hydrogen 2.891 N/A CYS 768.A N LYS 764.A O no hydrogen 2.889 N/A SER 769.A N VAL 765.A O no hydrogen 2.937 N/A LEU 770.A N GLN 766.A O no hydrogen 2.971 N/A SER 771.A N TRP 767.A O no hydrogen 2.829 N/A VAL 772.A N CYS 768.A O no hydrogen 2.910 N/A ILE 773.A N SER 769.A O no hydrogen 2.926 N/A LYS 774.A N LEU 770.A O no hydrogen 2.822 N/A LEU 775.A N SER 771.A O no hydrogen 2.898 N/A LYS 776.A N VAL 772.A O no hydrogen 2.924 N/A ASN 777.A N ILE 773.A O no hydrogen 2.908 N/A LYS 778.A N LYS 774.A O no hydrogen 2.851 N/A ILE 779.A N LEU 775.A O no hydrogen 2.870 N/A LYS 780.A N LYS 776.A O no hydrogen 2.987 N/A TYR 781.A N ASN 777.A O no hydrogen 2.872 N/A ARG 782.A N LYS 778.A O no hydrogen 2.903 N/A ALA 783.A N ILE 779.A O no hydrogen 2.837 N/A GLU 784.A N LYS 780.A O no hydrogen 2.948 N/A ALA 785.A N TYR 781.A O no hydrogen 2.879 N/A CYS 786.A N ARG 782.A O no hydrogen 2.858 N/A ILE 787.A N ALA 783.A O no hydrogen 2.870 N/A LYS 788.A N GLU 784.A O no hydrogen 2.999 N/A MET 789.A N ALA 785.A O no hydrogen 2.896 N/A GLN 790.A N CYS 786.A O no hydrogen 2.874 N/A LYS 791.A N ILE 787.A O no hydrogen 2.927 N/A THR 792.A N LYS 788.A O no hydrogen 2.996 N/A THR 792.A OG1 LYS 788.A O no hydrogen 3.113 N/A THR 792.A OG1 MET 789.A O no hydrogen 2.825 N/A ILE 793.A N MET 789.A O no hydrogen 2.959 N/A ARG 794.A N GLN 790.A O no hydrogen 2.922 N/A MET 795.A N LYS 791.A O no hydrogen 2.951 N/A TRP 796.A N THR 792.A O no hydrogen 2.912 N/A LEU 797.A N ILE 793.A O no hydrogen 2.910 N/A CYS 798.A N ARG 794.A O no hydrogen 3.005 N/A CYS 798.A SG ARG 794.A O no hydrogen 3.890 N/A LYS 799.A N TRP 796.A O no hydrogen 3.108 N/A ARG 800.A N TRP 796.A O no hydrogen 3.272 N/A ILE 806.A N HIS 802.A O no hydrogen 3.089 N/A ASP 807.A N LYS 803.A O no hydrogen 2.939 N/A GLY 808.A N PRO 804.A O no hydrogen 3.002 N/A LEU 809.A N ARG 805.A O no hydrogen 2.829 N/A VAL 810.A N ILE 806.A O no hydrogen 2.788 N/A LYS 811.A N ASP 807.A O no hydrogen 3.041 N/A VAL 812.A N GLY 808.A O no hydrogen 2.893 N/A GLY 813.A N LEU 809.A O no hydrogen 2.798 N/A THR 814.A N VAL 810.A O no hydrogen 2.929 N/A THR 814.A OG1 VAL 810.A O no hydrogen 3.008 N/A LEU 815.A N LYS 811.A O no hydrogen 3.002 N/A LYS 816.A N VAL 812.A O no hydrogen 2.846 N/A LYS 817.A N GLY 813.A O no hydrogen 2.927 N/A ARG 818.A N THR 814.A O no hydrogen 2.941 N/A LEU 819.A N LEU 815.A O no hydrogen 2.816 N/A ASP 820.A N LYS 816.A O no hydrogen 2.940 N/A LYS 821.A N LYS 817.A O no hydrogen 2.927 N/A PHE 822.A N ARG 818.A O no hydrogen 2.862 N/A ASN 823.A N LEU 819.A O no hydrogen 3.026 N/A ASN 823.A ND2 GLU 824.A OE2 no hydrogen 3.356 N/A VAL 826.A N PHE 822.A O no hydrogen 2.848 N/A SER 827.A N ASN 823.A O no hydrogen 2.949 N/A SER 827.A OG ASN 823.A O no hydrogen 3.412 N/A SER 827.A OG GLU 824.A O no hydrogen 2.247 N/A VAL 828.A N GLU 824.A O no hydrogen 2.916 N/A LEU 829.A N VAL 825.A O no hydrogen 3.039 N/A LYS 830.A NZ GLU 889.A OE2 no hydrogen 3.180 N/A LYS 830.A NZ GLU 890.A O no hydrogen 3.323 N/A LYS 830.A NZ GLU 891.A OE2 no hydrogen 2.238 N/A LYS 833.A NZ VAL 826.A O no hydrogen 2.439 N/A LYS 833.A NZ LEU 829.A O no hydrogen 2.625 N/A ASN 837.A N LYS 833.A O no hydrogen 2.922 N/A LYS 838.A N PRO 834.A O no hydrogen 2.913 N/A GLN 839.A N GLU 835.A O no hydrogen 2.934 N/A ILE 840.A N MET 836.A O no hydrogen 2.900 N/A LYS 841.A N ASN 837.A O no hydrogen 2.976 N/A ASN 842.A N LYS 838.A O no hydrogen 2.932 N/A LEU 843.A N GLN 839.A O no hydrogen 2.934 N/A GLU 844.A N ILE 840.A O no hydrogen 2.936 N/A ILE 845.A N LYS 841.A O no hydrogen 2.895 N/A SER 846.A N ASN 842.A O no hydrogen 2.922 N/A SER 846.A OG LEU 843.A O no hydrogen 2.309 N/A ILE 847.A N LEU 843.A O no hydrogen 2.914 N/A ASP 848.A N GLU 844.A O no hydrogen 2.930 N/A THR 849.A N ILE 845.A O no hydrogen 2.909 N/A THR 849.A OG1 ILE 845.A O no hydrogen 2.208 N/A THR 849.A OG1 SER 846.A O no hydrogen 2.708 N/A LEU 850.A N SER 846.A O no hydrogen 2.946 N/A MET 851.A N ILE 847.A O no hydrogen 2.905 N/A ALA 852.A N ASP 848.A O no hydrogen 2.942 N/A LYS 853.A N THR 849.A O no hydrogen 2.916 N/A ILE 854.A N LEU 850.A O no hydrogen 2.845 N/A LYS 855.A N MET 851.A O no hydrogen 2.916 N/A SER 856.A N ALA 852.A O no hydrogen 2.932 N/A SER 856.A OG ALA 852.A O no hydrogen 2.464 N/A THR 857.A OG1 LYS 853.A O no hydrogen 3.481 N/A THR 860.A N GLN 863.A OE1 no hydrogen 2.972 N/A THR 860.A OG1 GLU 862.A OE2 no hydrogen 2.487 N/A GLN 863.A N THR 860.A OG1 no hydrogen 3.086 N/A ILE 864.A N THR 860.A O no hydrogen 3.430 N/A GLN 865.A N GLN 861.A O no hydrogen 2.877 N/A LYS 866.A N GLU 862.A O no hydrogen 2.894 N/A GLU 867.A N GLN 863.A O no hydrogen 2.921 N/A TYR 868.A N ILE 864.A O no hydrogen 2.841 N/A ASP 869.A N GLN 865.A O no hydrogen 2.831 N/A ALA 870.A N LYS 866.A O no hydrogen 2.951 N/A LEU 871.A N GLU 867.A O no hydrogen 2.951 N/A VAL 872.A N TYR 868.A O no hydrogen 2.818 N/A SER 874.A N ALA 870.A O no hydrogen 2.972 N/A SER 875.A N LEU 871.A O no hydrogen 2.843 N/A GLU 876.A N VAL 872.A O no hydrogen 2.832 N/A GLU 877.A N LYS 873.A O no hydrogen 2.844 N/A LEU 878.A N SER 874.A O no hydrogen 2.920 N/A LEU 879.A N SER 875.A O no hydrogen 2.862 N/A SER 880.A N GLU 876.A O no hydrogen 2.813 N/A SER 880.A OG GLU 876.A O no hydrogen 3.125 N/A SER 880.A OG GLU 877.A O no hydrogen 2.775 N/A ALA 881.A N GLU 877.A O no hydrogen 2.881 N/A LEU 882.A N LEU 878.A O no hydrogen 2.895 N/A GLN 883.A N LEU 879.A O no hydrogen 2.840 N/A LYS 884.A N SER 880.A O no hydrogen 2.975 N/A LYS 884.A NZ SER 880.A O no hydrogen 2.890 N/A LYS 885.A N ALA 881.A O no hydrogen 2.863 N/A LYS 886.A N LEU 882.A O no hydrogen 2.832 N/A GLN 887.A N GLN 883.A O no hydrogen 2.830 N/A GLN 888.A N LYS 885.A O no hydrogen 2.853 N/A LEU 895.A N GLU 891.A O no hydrogen 2.647 N/A ARG 896.A N ALA 892.A O no hydrogen 2.875 N/A ILE 898.A N ARG 894.A O no hydrogen 2.988 N/A GLN 899.A N LEU 895.A O no hydrogen 2.794 N/A GLU 900.A N ARG 896.A O no hydrogen 2.970 N/A GLU 901.A N ARG 897.A O no hydrogen 3.014 N/A MET 902.A N ILE 898.A O no hydrogen 2.941 N/A GLU 903.A N GLN 899.A O no hydrogen 2.933 N/A LYS 904.A N GLU 900.A O no hydrogen 2.913 N/A LYS 904.A NZ GLU 900.A OE1 no hydrogen 3.049 N/A GLU 905.A N GLU 901.A O no hydrogen 2.945 N/A ARG 906.A N MET 902.A O no hydrogen 2.890 N/A LYS 907.A N GLU 903.A O no hydrogen 2.921 N/A ARG 908.A N LYS 904.A O no hydrogen 2.976 N/A ARG 909.A N GLU 905.A O no hydrogen 2.896 N/A GLU 910.A N ARG 906.A O no hydrogen 2.889 N/A GLU 911.A N LYS 907.A O no hydrogen 2.917 N/A ASP 912.A N ARG 908.A O no hydrogen 2.998 N/A GLU 913.A N ARG 909.A O no hydrogen 2.847 N/A LYS 914.A N GLU 910.A O no hydrogen 2.954 N/A ARG 915.A N GLU 911.A O no hydrogen 2.999 N/A ARG 916.A N ASP 912.A O no hydrogen 2.900 N/A ARG 917.A N GLU 913.A O no hydrogen 2.943 N/A LYS 918.A N LYS 914.A O no hydrogen 2.942 N/A LYS 918.A NZ GLU 922.A OE1 no hydrogen 3.224 N/A GLU 919.A N ARG 915.A O no hydrogen 2.922 N/A GLU 920.A N ARG 916.A O no hydrogen 2.936 N/A GLU 921.A N ARG 917.A O no hydrogen 2.910 N/A GLU 922.A N LYS 918.A O no hydrogen 2.888 N/A ARG 923.A N GLU 919.A O no hydrogen 3.002 N/A ARG 924.A N GLU 920.A O no hydrogen 2.966 N/A MET 925.A N GLU 921.A O no hydrogen 2.884 N/A LYS 926.A N ARG 923.A O no hydrogen 3.027 N/A LEU 927.A N ARG 923.A O no hydrogen 3.344 N/A LEU 927.A N ARG 924.A O no hydrogen 3.037 N/A GLU 928.A N ARG 924.A O no hydrogen 2.960 N/A MET 929.A N LYS 926.A O no hydrogen 3.300 N/A GLU 930.A N LYS 926.A O no hydrogen 2.950 N/A ALA 931.A N LEU 927.A O no hydrogen 2.850 N/A ARG 933.A N MET 929.A O no hydrogen 3.153 N/A LYS 934.A N GLU 930.A O no hydrogen 2.931 N/A GLN 935.A N ALA 931.A O no hydrogen 2.912 N/A GLU 936.A N LYS 932.A O no hydrogen 2.811 N/A GLU 937.A N ARG 933.A O no hydrogen 2.982 N/A GLU 938.A N LYS 934.A O no hydrogen 2.979 N/A GLU 939.A N GLN 935.A O no hydrogen 2.834 N/A ARG 940.A N GLU 936.A O no hydrogen 2.875 N/A LYS 941.A N GLU 937.A O no hydrogen 2.935 N/A LYS 942.A N GLU 938.A O no hydrogen 2.900 N/A ARG 943.A N GLU 939.A O no hydrogen 2.838 N/A ARG 943.A NH2 ASP 946.A OD2 no hydrogen 2.741 N/A GLU 944.A N ARG 940.A O no hydrogen 2.903 N/A ASP 945.A N LYS 941.A O no hydrogen 2.912 N/A ASP 946.A N LYS 942.A O no hydrogen 2.889 N/A GLU 947.A N ARG 943.A O no hydrogen 2.889 N/A GLU 955.A N GLN 951.A O no hydrogen 2.963 N/A ALA 956.A N ALA 952.A O no hydrogen 2.904 N/A GLN 957.A N GLU 953.A O no hydrogen 2.952 N/A LEU 958.A N VAL 954.A O no hydrogen 2.880 N/A ALA 959.A N GLU 955.A O no hydrogen 2.908 N/A GLN 961.A N GLN 957.A O no hydrogen 2.899 N/A LYS 962.A N LEU 958.A O no hydrogen 2.871 N/A LYS 962.A NZ ALA 959.A O no hydrogen 3.226 N/A LYS 962.A NZ GLU 963.A OE2 no hydrogen 2.796 N/A GLU 963.A N ALA 959.A O no hydrogen 2.947 N/A GLU 964.A N ARG 960.A O no hydrogen 2.905 N/A GLU 965.A N GLN 961.A O no hydrogen 2.868 N/A SER 966.A N LYS 962.A O no hydrogen 2.910 N/A GLN 967.A N GLU 963.A O no hydrogen 2.943 N/A GLN 967.A NE2 GLU 963.A O no hydrogen 3.033 N/A GLN 968.A N GLU 964.A O no hydrogen 2.908 N/A GLN 969.A N GLU 965.A O no hydrogen 2.866 N/A ALA 970.A N SER 966.A O no hydrogen 2.926 N/A VAL 971.A N GLN 967.A O no hydrogen 2.931 N/A LEU 972.A N GLN 968.A O no hydrogen 2.856 N/A GLU 973.A N GLN 969.A O no hydrogen 2.913 N/A GLN 974.A N ALA 970.A O no hydrogen 2.925 N/A GLU 975.A N VAL 971.A O no hydrogen 2.895 N/A ARG 976.A N LEU 972.A O no hydrogen 2.872 N/A ARG 976.A NE GLU 980.A OE2 no hydrogen 3.133 N/A ARG 977.A N GLU 973.A O no hydrogen 2.926 N/A ARG 977.A NH1 PHE 566.A O no hydrogen 3.268 N/A ASP 978.A N GLN 974.A O no hydrogen 2.902 N/A ARG 979.A N GLU 975.A O no hydrogen 2.902 N/A GLU 980.A N ARG 976.A O no hydrogen 2.893 N/A LEU 981.A N ARG 977.A O no hydrogen 2.937 N/A ALA 982.A N ASP 978.A O no hydrogen 2.899 N/A LEU 983.A N ARG 979.A O no hydrogen 2.908 N/A ARG 984.A N GLU 980.A O no hydrogen 2.920 N/A ILE 985.A N LEU 981.A O no hydrogen 2.880 N/A ALA 986.A N ALA 982.A O no hydrogen 2.929 N/A GLN 987.A N LEU 983.A O no hydrogen 2.897 N/A SER 988.A N ARG 984.A O no hydrogen 2.890 N/A SER 988.A OG ARG 984.A O no hydrogen 3.015 N/A GLU 989.A N ILE 985.A O no hydrogen 2.903 N/A ALA 990.A N ALA 986.A O no hydrogen 3.274 N/A LYS 996.A NZ SER 995.A OG no hydrogen 2.595 N/A TRP 997.A N LEU 994.A O no hydrogen 3.305 N/A TYR 999.A N ASP 21.A OD1 no hydrogen 3.063 N/A ARG 1003.A N TYR 999.A O no hydrogen 3.131 N/A ASP 1004.A N ALA 1000.A O no hydrogen 3.125 N/A THR 1005.A N GLU 1001.A O no hydrogen 2.673 N/A THR 1005.A OG1 GLU 1001.A O no hydrogen 2.846 N/A THR 1005.A OG1 LEU 1002.A O no hydrogen 3.272 N/A ASN 1007.A N ASP 1004.A O no hydrogen 2.865 N/A THR 1008.A OG1 ASP 1004.A O no hydrogen 2.744 N/A SER 1009.A OG ASP 1011.A OD1 no hydrogen 3.309 N/A CYS 1010.A SG THR 1008.A O no hydrogen 3.614 N/A LEU 1014.A N ASP 1011.A O no hydrogen 2.860 N/A ALA 1016.A N GLU 1013.A O no hydrogen 3.089 N/A CYS 1018.A N LEU 1014.A O no hydrogen 2.847 N/A CYS 1018.A SG THR 1005.A OG1 no hydrogen 3.729 N/A ARG 1019.A N LEU 1015.A O no hydrogen 3.348 N/A ARG 1019.A NH1 ASP 1092.A O no hydrogen 3.025 N/A ARG 1019.A NH2 ASP 1092.A O no hydrogen 2.927 N/A GLU 1020.A N ALA 1016.A O no hydrogen 3.151 N/A GLU 1021.A N ALA 1017.A O no hydrogen 2.757 N/A GLU 1021.A N CYS 1018.A O no hydrogen 3.139 N/A PHE 1022.A N CYS 1018.A O no hydrogen 2.920 N/A HIS 1023.A N ARG 1019.A O no hydrogen 3.016 N/A ARG 1024.A N GLU 1020.A O no hydrogen 3.062 N/A ARG 1024.A NE GLU 1020.A OE1 no hydrogen 3.132 N/A ARG 1024.A NH2 GLU 1020.A OE1 no hydrogen 2.715 N/A ARG 1025.A N GLU 1021.A O no hydrogen 2.863 N/A ARG 1025.A NH2 LEU 994.A O no hydrogen 3.040 N/A LEU 1026.A N PHE 1022.A O no hydrogen 3.159 N/A LYS 1027.A N HIS 1023.A O no hydrogen 2.872 N/A VAL 1028.A N ARG 1024.A O no hydrogen 3.033 N/A TYR 1029.A N ARG 1025.A O no hydrogen 2.937 N/A HIS 1030.A N LEU 1026.A O no hydrogen 2.889 N/A ALA 1031.A N LYS 1027.A O no hydrogen 2.880 N/A TRP 1032.A N VAL 1028.A O no hydrogen 2.956 N/A TRP 1032.A NE1 VAL 46.A O no hydrogen 2.412 N/A LYS 1033.A N TYR 1029.A O no hydrogen 2.937 N/A SER 1034.A N ALA 1031.A O no hydrogen 2.986 N/A SER 1034.A OG HIS 1030.A O no hydrogen 3.399 N/A SER 1034.A OG ALA 1031.A O no hydrogen 2.403 N/A LYS 1035.A N ALA 1031.A O no hydrogen 2.948 N/A ASN 1036.A N TRP 1032.A O no hydrogen 3.271 N/A ASN 1036.A ND2 VAL 46.A O no hydrogen 3.086 N/A ASN 1036.A ND2 TRP 1032.A O no hydrogen 3.676 N/A LYS 1037.A NZ THR 1043.A OG1 no hydrogen 3.280 N/A ARG 1039.A NH1 MET 64.A O no hydrogen 3.529 N/A LYS 1049.A NZ ASP 1078.A OD1 no hydrogen 3.361 N/A VAL 1051.A N PRO 1048.A O no hydrogen 3.114 N/A THR 1052.A N PRO 1048.A O no hydrogen 3.304 N/A ASP 1053.A N LYS 1049.A O no hydrogen 2.858 N/A ALA 1057.A N TYR 1054.A O no hydrogen 2.850 N/A GLN 1062.A N GLN 1062.A OE1 no hydrogen 2.753 N/A GLN 1062.A NE2 ASP 1092.A OD1 no hydrogen 3.443 N/A ARG 1063.A N GLN 1061.A O no hydrogen 2.718 N/A PHE 1065.A N ALA 1089.A O no hydrogen 2.811 N/A ILE 1067.A N TRP 1087.A O no hydrogen 3.213 N/A PHE 1069.A N GLY 1085.A O no hydrogen 2.933 N/A ASP 1074.A N ARG 1071.A O no hydrogen 2.472 N/A LYS 1077.A N ASP 1074.A O no hydrogen 3.247 N/A LYS 1077.A NZ ALA 1073.A O no hydrogen 2.788 N/A SER 1081.A N ASP 1078.A OD2 no hydrogen 2.599 N/A SER 1081.A OG GLN 1080.A O no hydrogen 2.577 N/A LYS 1083.A NZ GLN 1045.A O no hydrogen 3.136 N/A LYS 1084.A NZ ASP 1078.A OD2 no hydrogen 3.272 N/A LYS 1084.A NZ LYS 1083.A O no hydrogen 2.806 N/A TRP 1086.A N LEU 1102.A O no hydrogen 3.347 N/A TRP 1087.A N ILE 1067.A O no hydrogen 2.767 N/A TRP 1087.A NE1 GLN 1099.A OE1 no hydrogen 2.452 N/A TYR 1088.A OH GLN 1142.A OE1 no hydrogen 3.071 N/A ALA 1089.A N PHE 1065.A O no hydrogen 3.253 N/A HIS 1090.A N ARG 1098.A O no hydrogen 3.041 N/A PHE 1091.A N ARG 1063.A O no hydrogen 2.980 N/A ALA 1097.A N HIS 1090.A O no hydrogen 3.029 N/A ARG 1098.A N HIS 1090.A O no hydrogen 3.134 N/A GLN 1099.A NE2 GLU 1119.A O no hydrogen 2.807 N/A LEU 1111.A N GLN 1099.A O no hydrogen 3.452 N/A CYS 1121.A SG LEU 1123.A O no hydrogen 3.789 N/A GLU 1122.A N GLU 1122.A OE1 no hydrogen 2.971 N/A ASN 1124.A N GLU 1127.A OE1 no hydrogen 2.832 N/A THR 1128.A N ASN 1124.A O no hydrogen 3.010 N/A THR 1128.A OG1 LEU 1125.A O no hydrogen 2.127 N/A GLY 1129.A N LEU 1125.A O no hydrogen 2.997 N/A GLY 1129.A N GLU 1126.A O no hydrogen 2.820 N/A LEU 1130.A N THR 1128.A OG1 no hydrogen 3.417 N/A ARG 1132.A N GLY 1129.A O no hydrogen 2.682 N/A ARG 1132.A NE GLU 944.A OE1 no hydrogen 2.273 N/A LYS 1133.A NZ THR 1128.A O no hydrogen 2.694 N/A ARG 1134.A NH1 GLU 937.A OE2 no hydrogen 3.396 N/A ARG 1134.A NH1 GLU 938.A OE1 no hydrogen 3.335 N/A ARG 1134.A NH2 GLU 938.A OE1 no hydrogen 2.919 N/A ILE 1138.A N PHE 1064.A O no hydrogen 2.991 N/A GLN 1142.A N LEU 1139.A O no hydrogen 3.272 N/A PHE 1143.A N PRO 1140.A O no hydrogen 3.374 N/A GLU 1145.A N GLN 1142.A O no hydrogen 3.309 N/A ILE 1146.A N GLN 1142.A O no hydrogen 3.471 N/A TRP 1147.A N PHE 1143.A O no hydrogen 2.842 N/A GLU 1148.A N GLU 1144.A O no hydrogen 3.370 N/A ARG 1149.A N GLU 1145.A O no hydrogen 3.027 N/A ARG 1149.A NE ARG 1149.A O no hydrogen 2.930 N/A CYS 1150.A N TRP 1147.A O no hydrogen 2.909 N/A CYS 1150.A SG ILE 1146.A O no hydrogen 3.413 N/A TYR 1155.A N GLY 1151.A O no hydrogen 2.458 N/A TYR 1155.A OH ASP 1116.A OD1 no hydrogen 2.935 N/A TYR 1155.A OH ASP 1116.A OD2 no hydrogen 3.415 N/A LEU 1156.A N GLY 1152.A O no hydrogen 2.904 N/A GLN 1157.A N ILE 1153.A O no hydrogen 2.863 N/A ASN 1158.A N GLN 1154.A O no hydrogen 2.924 N/A ASN 1158.A ND2 GLN 1154.A OE1 no hydrogen 2.854 N/A ALA 1159.A N TYR 1155.A O no hydrogen 2.899 N/A ILE 1160.A N LEU 1156.A O no hydrogen 2.892 N/A GLU 1161.A N GLN 1157.A O no hydrogen 2.906 N/A SER 1162.A N ASN 1158.A O no hydrogen 2.763 N/A SER 1162.A OG ASN 1158.A O no hydrogen 2.935 N/A