Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6ta6_J.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 13.A N PRO 9.A O no hydrogen 3.023 N/A VAL 14.A N ILE 10.A O no hydrogen 2.815 N/A ILE 15.A N PHE 11.A O no hydrogen 3.049 N/A ALA 16.A N ALA 12.A O no hydrogen 2.989 N/A LEU 17.A N TRP 13.A O no hydrogen 2.917 N/A VAL 18.A N VAL 14.A O no hydrogen 2.931 N/A ILE 19.A N ILE 15.A O no hydrogen 3.048 N/A MET 20.A N ALA 16.A O no hydrogen 2.953 N/A LEU 21.A N LEU 17.A O no hydrogen 3.009 N/A ALA 22.A N VAL 18.A O no hydrogen 2.991 N/A GLY 23.A N ILE 19.A O no hydrogen 2.939 N/A GLY 24.A N MET 20.A O no hydrogen 2.942 N/A LEU 25.A N LEU 21.A O no hydrogen 2.932 N/A SER 26.A N ALA 22.A O no hydrogen 2.923 N/A SER 26.A OG ALA 22.A O no hydrogen 3.393 N/A SER 26.A OG GLY 23.A O no hydrogen 2.537 N/A ILE 27.A N GLY 23.A O no hydrogen 2.890 N/A LEU 28.A N GLY 24.A O no hydrogen 3.049 N/A SER 29.A N SER 26.A O no hydrogen 3.185 N/A ASN 33.A N ILE 390.A O no hydrogen 3.078 N/A TYR 35.A OH SER 670.A O no hydrogen 3.278 N/A ALA 39.A N GLU 673.A OE2 no hydrogen 2.589 N/A ILE 43.A N VAL 92.A O no hydrogen 2.885 N/A ALA 44.A N THR 130.A O no hydrogen 2.925 N/A VAL 45.A N ILE 90.A O no hydrogen 2.906 N/A GLN 46.A N ARG 128.A O no hydrogen 2.879 N/A VAL 47.A N MET 88.A O no hydrogen 2.998 N/A TYR 49.A N GLY 86.A O no hydrogen 2.590 N/A SER 53.A N THR 56.A OG1 no hydrogen 2.715 N/A SER 53.A OG GLU 55.A OE1 no hydrogen 2.953 N/A SER 53.A OG THR 56.A OG1 no hydrogen 3.094 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.796 N/A THR 56.A N SER 53.A OG no hydrogen 3.184 N/A THR 56.A OG1 SER 53.A O no hydrogen 2.869 N/A THR 56.A OG1 SER 53.A OG no hydrogen 3.094 N/A VAL 57.A N SER 53.A O no hydrogen 3.287 N/A GLN 58.A N ALA 54.A O no hydrogen 2.912 N/A ASP 59.A N GLU 55.A O no hydrogen 2.881 N/A THR 60.A N VAL 57.A O no hydrogen 3.286 N/A THR 60.A OG1 THR 56.A O no hydrogen 2.280 N/A VAL 61.A N VAL 57.A O no hydrogen 2.949 N/A VAL 62.A N VAL 57.A O no hydrogen 3.401 N/A VAL 64.A N VAL 61.A O no hydrogen 3.309 N/A ILE 65.A N VAL 61.A O no hydrogen 2.998 N/A GLU 66.A N VAL 62.A O no hydrogen 2.923 N/A MET 69.A N GLU 66.A O no hydrogen 3.382 N/A ARG 76.A N THR 93.A O no hydrogen 2.974 N/A ARG 76.A NH2 GLU 95.A OE1 no hydrogen 3.440 N/A TYR 77.A N THR 93.A O no hydrogen 3.019 N/A SER 79.A N THR 91.A O no hydrogen 2.936 N/A SER 79.A OG THR 91.A OG1 no hydrogen 2.814 N/A SER 80.A N ARG 817.A O no hydrogen 2.910 N/A SER 80.A OG ARG 817.A O no hydrogen 3.517 N/A GLU 81.A N THR 89.A O no hydrogen 2.882 N/A SER 82.A N LEU 815.A O no hydrogen 2.864 N/A SER 82.A OG ALA 54.A O no hydrogen 3.167 N/A SER 82.A OG LEU 815.A O no hydrogen 3.524 N/A ASN 83.A N SER 87.A O no hydrogen 2.952 N/A ASN 83.A ND2 SER 87.A O no hydrogen 3.226 N/A SER 87.A OG ASP 85.A OD1 no hydrogen 3.193 N/A MET 88.A N VAL 47.A O no hydrogen 2.903 N/A THR 89.A N GLU 81.A O no hydrogen 2.996 N/A ILE 90.A N VAL 45.A O no hydrogen 2.933 N/A THR 91.A N SER 79.A O no hydrogen 2.886 N/A THR 91.A OG1 SER 79.A O no hydrogen 3.539 N/A THR 91.A OG1 SER 79.A OG no hydrogen 2.814 N/A VAL 92.A N ILE 43.A O no hydrogen 2.874 N/A THR 93.A N TYR 77.A O no hydrogen 2.885 N/A THR 93.A OG1 TYR 77.A O no hydrogen 3.379 N/A PHE 94.A N PRO 41.A O no hydrogen 2.934 N/A GLU 95.A N ASN 74.A O no hydrogen 2.900 N/A GLN 96.A NE2 ILE 38.A O no hydrogen 2.654 N/A THR 98.A OG1 ASP 99.A O no hydrogen 3.390 N/A ILE 102.A N ASP 99.A OD1 no hydrogen 3.448 N/A GLN 104.A N PRO 100.A O no hydrogen 2.887 N/A VAL 105.A N ASP 101.A O no hydrogen 2.894 N/A GLN 106.A N ILE 102.A O no hydrogen 2.938 N/A GLN 106.A NE2 ASP 73.A OD1 no hydrogen 2.696 N/A VAL 107.A N ALA 103.A O no hydrogen 2.992 N/A GLN 108.A N GLN 104.A O no hydrogen 2.847 N/A ASN 109.A N VAL 105.A O no hydrogen 2.880 N/A LYS 110.A N GLN 106.A O no hydrogen 3.011 N/A LEU 111.A N VAL 107.A O no hydrogen 2.940 N/A GLN 112.A N GLN 108.A O no hydrogen 2.813 N/A LEU 113.A N ASN 109.A O no hydrogen 3.004 N/A ALA 114.A N LYS 110.A O no hydrogen 3.002 N/A ALA 114.A N LEU 111.A O no hydrogen 3.216 N/A LEU 117.A N ALA 114.A O no hydrogen 2.954 N/A LEU 118.A N THR 115.A O no hydrogen 3.390 N/A GLN 123.A N PRO 119.A O no hydrogen 3.219 N/A GLN 123.A NE2 PRO 119.A O no hydrogen 2.860 N/A ARG 124.A N GLN 120.A O no hydrogen 2.937 N/A ARG 124.A NH1 TYR 757.A O no hydrogen 2.513 N/A ARG 124.A NH2 VAL 758.A O no hydrogen 3.215 N/A GLN 125.A N VAL 122.A O no hydrogen 3.290 N/A GLN 125.A NE2 SER 48.A O no hydrogen 3.196 N/A ARG 128.A N GLN 46.A O no hydrogen 2.949 N/A THR 130.A N ALA 44.A O no hydrogen 2.895 N/A THR 130.A OG1 ALA 44.A O no hydrogen 3.375 N/A MET 138.A N ILE 291.A O no hydrogen 3.011 N/A VAL 139.A N TYR 327.A O no hydrogen 3.354 N/A VAL 140.A N ILE 289.A O no hydrogen 2.925 N/A GLY 141.A N VAL 324.A O no hydrogen 2.931 N/A VAL 142.A N SER 287.A O no hydrogen 2.821 N/A VAL 143.A N LYS 322.A O no hydrogen 2.885 N/A SER 144.A N PRO 285.A O no hydrogen 2.913 N/A SER 144.A OG ASP 146.A OD1 no hydrogen 3.555 N/A THR 145.A N GLY 320.A O no hydrogen 2.500 N/A THR 145.A OG1 GLY 320.A O no hydrogen 2.841 N/A SER 148.A N ASP 146.A OD1 no hydrogen 3.403 N/A SER 148.A OG ASP 146.A OD1 no hydrogen 3.091 N/A SER 148.A OG ASP 146.A OD2 no hydrogen 3.426 N/A MET 149.A N SER 144.A OG no hydrogen 3.085 N/A THR 150.A OG1 GLU 152.A OE1 no hydrogen 3.001 N/A LYS 151.A N THR 150.A OG1 no hydrogen 2.548 N/A SER 155.A N LYS 151.A O no hydrogen 2.940 N/A SER 155.A OG LYS 151.A O no hydrogen 3.059 N/A SER 155.A OG GLU 152.A O no hydrogen 2.653 N/A SER 155.A OG SER 180.A O no hydrogen 2.715 N/A ASN 156.A N GLU 152.A O no hydrogen 2.888 N/A TYR 157.A N ASP 153.A O no hydrogen 2.900 N/A ILE 158.A N LEU 154.A O no hydrogen 2.963 N/A VAL 159.A N SER 155.A O no hydrogen 2.932 N/A SER 160.A N ASN 156.A O no hydrogen 2.908 N/A SER 160.A OG ASN 156.A O no hydrogen 3.364 N/A SER 160.A OG TYR 157.A O no hydrogen 3.543 N/A SER 160.A OG ASN 161.A OD1 no hydrogen 2.311 N/A ASN 161.A N TYR 157.A O no hydrogen 2.938 N/A ILE 162.A N ILE 158.A O no hydrogen 3.183 N/A ASP 164.A N ASP 164.A OD1 no hydrogen 2.323 N/A SER 167.A N GLN 163.A O no hydrogen 3.349 N/A SER 167.A OG GLN 163.A O no hydrogen 2.513 N/A SER 167.A OG ASP 164.A O no hydrogen 2.686 N/A ARG 168.A N ASP 164.A O no hydrogen 2.967 N/A THR 169.A N LEU 166.A O no hydrogen 3.358 N/A THR 169.A OG1 LEU 166.A O no hydrogen 2.370 N/A GLY 173.A N LYS 292.A O no hydrogen 3.471 N/A GLN 176.A N ALA 290.A O no hydrogen 2.947 N/A PHE 178.A N GLY 288.A O no hydrogen 2.935 N/A GLN 181.A N SER 180.A OG no hydrogen 2.473 N/A TYR 182.A N ASN 156.A OD1 no hydrogen 2.679 N/A SER 183.A N GLY 271.A O no hydrogen 2.880 N/A SER 183.A OG TYR 182.A O no hydrogen 2.893 N/A MET 184.A N ARG 769.A O no hydrogen 2.885 N/A ARG 185.A NH1 GLY 272.A O no hydrogen 3.280 N/A TRP 187.A N ASP 267.A O no hydrogen 2.883 N/A LEU 188.A N GLN 773.A O no hydrogen 2.814 N/A ASP 189.A N VAL 265.A O no hydrogen 3.360 N/A LYS 192.A N ASP 189.A OD1 no hydrogen 3.123 N/A LEU 193.A N ASP 189.A O no hydrogen 3.360 N/A ASN 194.A N PRO 190.A O no hydrogen 2.929 N/A SER 195.A N ALA 191.A O no hydrogen 2.888 N/A SER 195.A OG LYS 192.A O no hydrogen 2.729 N/A TYR 196.A N LYS 192.A O no hydrogen 2.933 N/A TYR 196.A OH ASP 264.A OD2 no hydrogen 3.072 N/A LEU 198.A N LEU 193.A O no hydrogen 2.876 N/A ASP 202.A N THR 199.A O no hydrogen 3.132 N/A VAL 203.A N THR 199.A O no hydrogen 3.464 N/A SER 204.A N PRO 200.A O no hydrogen 2.944 N/A SER 205.A N GLY 201.A O no hydrogen 2.929 N/A SER 205.A OG GLY 201.A O no hydrogen 3.211 N/A SER 205.A OG ASP 202.A O no hydrogen 2.833 N/A ALA 206.A N ASP 202.A O no hydrogen 2.893 N/A ILE 207.A N VAL 203.A O no hydrogen 2.942 N/A GLN 208.A N SER 204.A O no hydrogen 2.936 N/A ALA 209.A N SER 205.A O no hydrogen 2.913 N/A ALA 209.A N ALA 206.A O no hydrogen 3.282 N/A GLN 210.A N ALA 206.A O no hydrogen 2.919 N/A GLN 210.A NE2 LEU 250.A O no hydrogen 2.475 N/A ASN 211.A N ILE 207.A O no hydrogen 2.939 N/A ASN 211.A ND2 ASP 760.A O no hydrogen 2.926 N/A ILE 214.A N LYS 237.A O no hydrogen 3.244 N/A SER 216.A OG ILE 234.A O no hydrogen 2.687 N/A LEU 219.A N ALA 232.A O no hydrogen 2.863 N/A GLN 228.A N VAL 225.A O no hydrogen 3.385 N/A GLN 228.A NE2 LEU 230.A O no hydrogen 2.511 N/A ILE 234.A N GLY 217.A O no hydrogen 2.933 N/A ARG 239.A NH1 ASP 760.A O no hydrogen 3.397 N/A LEU 240.A N ASN 211.A OD1 no hydrogen 2.802 N/A GLN 241.A N GLN 245.A OE1 no hydrogen 2.950 N/A THR 242.A N GLN 245.A OE1 no hydrogen 3.013 N/A THR 242.A OG1 GLU 244.A OE1 no hydrogen 2.366 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.928 N/A GLU 247.A N ALA 243.A O no hydrogen 2.905 N/A ILE 249.A N PHE 246.A O no hydrogen 3.329 N/A LEU 250.A N GLN 210.A OE1 no hydrogen 3.066 N/A LEU 251.A N VAL 260.A O no hydrogen 2.927 N/A ASN 254.A N SER 258.A O no hydrogen 2.894 N/A ASN 254.A ND2 SER 258.A OG no hydrogen 2.997 N/A GLY 257.A N ASN 254.A O no hydrogen 2.957 N/A SER 258.A N ASP 256.A OD2 no hydrogen 3.393 N/A SER 258.A OG ASP 256.A OD2 no hydrogen 3.321 N/A VAL 260.A N LYS 252.A O no hydrogen 2.892 N/A ARG 261.A NH1 ASN 248.A O no hydrogen 2.797 N/A VAL 265.A N ASP 264.A OD1 no hydrogen 2.719 N/A ASP 267.A N TRP 187.A O no hydrogen 2.895 N/A GLY 269.A N ARG 185.A O no hydrogen 2.959 N/A GLY 271.A N SER 183.A O no hydrogen 2.890 N/A GLY 272.A N TYR 275.A OH no hydrogen 2.758 N/A SER 276.A N ASP 274.A OD1 no hydrogen 2.882 N/A SER 276.A OG ASP 274.A OD1 no hydrogen 2.787 N/A ASN 278.A N THR 613.A O no hydrogen 2.928 N/A GLN 280.A N THR 611.A O no hydrogen 2.864 N/A GLN 280.A NE2 GLN 588.A OE1 no hydrogen 2.651 N/A PHE 281.A N SER 284.A O no hydrogen 2.553 N/A ASN 282.A N VAL 609.A O no hydrogen 3.212 N/A ASN 282.A ND2 SER 608.A OG no hydrogen 2.576 N/A SER 287.A N VAL 142.A O no hydrogen 2.945 N/A ILE 289.A N VAL 140.A O no hydrogen 2.919 N/A ALA 290.A N GLN 176.A O no hydrogen 2.896 N/A ILE 291.A N MET 138.A O no hydrogen 2.876 N/A LYS 292.A N ASP 174.A O no hydrogen 2.942 N/A ALA 294.A N GLY 171.A O no hydrogen 2.854 N/A LEU 300.A N ASN 298.A OD1 no hydrogen 3.487 N/A THR 302.A N ASP 301.A OD1 no hydrogen 2.699 N/A THR 302.A OG1 LYS 170.A O no hydrogen 2.359 N/A ALA 303.A N ALA 299.A O no hydrogen 2.943 N/A LYS 304.A N LEU 300.A O no hydrogen 3.000 N/A ALA 305.A N ASP 301.A O no hydrogen 2.841 N/A ILE 306.A N THR 302.A O no hydrogen 2.932 N/A ARG 307.A N ALA 303.A O no hydrogen 3.000 N/A GLN 308.A N LYS 304.A O no hydrogen 2.901 N/A THR 309.A N ALA 305.A O no hydrogen 2.890 N/A ILE 310.A N ILE 306.A O no hydrogen 3.019 N/A ALA 311.A N ARG 307.A O no hydrogen 2.924 N/A ASN 312.A N GLN 308.A O no hydrogen 2.914 N/A PHE 316.A N LEU 313.A O no hydrogen 3.314 N/A MET 317.A N GLU 314.A O no hydrogen 3.358 N/A LYS 322.A N VAL 143.A O no hydrogen 2.888 N/A VAL 324.A N GLY 141.A O no hydrogen 2.909 N/A THR 329.A OG1 LEU 137.A O no hydrogen 3.081 N/A THR 330.A N ASP 328.A OD1 no hydrogen 2.653 N/A THR 330.A OG1 ASP 328.A OD1 no hydrogen 2.367 N/A SER 334.A N THR 330.A O no hydrogen 2.987 N/A SER 334.A OG THR 330.A O no hydrogen 3.109 N/A SER 334.A OG PRO 331.A O no hydrogen 2.853 N/A ALA 335.A N PRO 331.A O no hydrogen 2.866 N/A SER 336.A N VAL 332.A O no hydrogen 2.903 N/A ILE 337.A N VAL 333.A O no hydrogen 3.011 N/A HIS 338.A N SER 334.A O no hydrogen 2.953 N/A GLU 339.A N ALA 335.A O no hydrogen 2.828 N/A VAL 340.A N SER 336.A O no hydrogen 2.977 N/A VAL 341.A N ILE 337.A O no hydrogen 3.057 N/A LYS 342.A N HIS 338.A O no hydrogen 2.945 N/A THR 343.A N GLU 339.A O no hydrogen 2.906 N/A LEU 344.A N VAL 340.A O no hydrogen 2.981 N/A GLY 345.A N VAL 341.A O no hydrogen 3.013 N/A GLU 346.A N LYS 342.A O no hydrogen 2.925 N/A ALA 347.A N THR 343.A O no hydrogen 2.893 N/A ILE 348.A N LEU 344.A O no hydrogen 2.946 N/A LEU 349.A N GLY 345.A O no hydrogen 3.031 N/A LEU 350.A N GLU 346.A O no hydrogen 2.938 N/A VAL 351.A N ALA 347.A O no hydrogen 2.936 N/A PHE 352.A N ILE 348.A O no hydrogen 2.948 N/A LEU 353.A N LEU 349.A O no hydrogen 2.986 N/A VAL 354.A N LEU 350.A O no hydrogen 2.905 N/A MET 355.A N VAL 351.A O no hydrogen 2.960 N/A LEU 357.A N LEU 353.A O no hydrogen 2.907 N/A PHE 358.A N VAL 354.A O no hydrogen 2.943 N/A LEU 359.A N MET 355.A O no hydrogen 2.887 N/A GLN 360.A N TYR 356.A O no hydrogen 2.856 N/A GLN 360.A NE2 LEU 357.A O no hydrogen 2.442 N/A THR 365.A OG1 PHE 362.A O no hydrogen 3.117 N/A LEU 366.A N ARG 363.A O no hydrogen 2.964 N/A ILE 367.A N ALA 364.A O no hydrogen 2.982 N/A THR 369.A OG1 LEU 366.A O no hydrogen 2.860 N/A ILE 370.A N LEU 366.A O no hydrogen 2.988 N/A ALA 371.A N PRO 368.A O no hydrogen 2.914 N/A VAL 372.A N PRO 368.A O no hydrogen 2.700 N/A LEU 377.A N PRO 373.A O no hydrogen 3.130 N/A GLY 378.A N VAL 374.A O no hydrogen 3.300 N/A THR 379.A N VAL 375.A O no hydrogen 3.168 N/A THR 379.A OG1 SER 476.A OG no hydrogen 2.480 N/A PHE 380.A N LEU 377.A O no hydrogen 2.963 N/A GLY 381.A N GLY 378.A O no hydrogen 2.972 N/A VAL 382.A N THR 379.A O no hydrogen 3.034 N/A LEU 383.A N THR 379.A O no hydrogen 3.340 N/A ALA 384.A N PHE 380.A O no hydrogen 3.284 N/A ALA 384.A N GLY 381.A O no hydrogen 2.974 N/A ALA 385.A N VAL 382.A O no hydrogen 2.947 N/A PHE 386.A N VAL 382.A O no hydrogen 2.874 N/A SER 389.A OG PRO 31.A O no hydrogen 2.401 N/A SER 389.A OG ILE 390.A O no hydrogen 3.269 N/A ILE 390.A N PRO 31.A O no hydrogen 3.297 N/A ASN 391.A N THR 394.A OG1 no hydrogen 2.902 N/A THR 392.A N GLN 34.A O no hydrogen 3.033 N/A THR 392.A OG1 GLN 34.A O no hydrogen 3.088 N/A LEU 393.A N ASN 391.A OD1 no hydrogen 3.176 N/A THR 394.A N ASN 391.A OD1 no hydrogen 2.718 N/A THR 394.A OG1 ASN 391.A O no hydrogen 3.331 N/A THR 394.A OG1 ASN 391.A OD1 no hydrogen 2.705 N/A GLY 397.A N LEU 393.A O no hydrogen 2.871 N/A GLY 397.A N THR 394.A O no hydrogen 3.102 N/A MET 398.A N THR 394.A O no hydrogen 2.955 N/A VAL 399.A N MET 395.A O no hydrogen 2.940 N/A ALA 401.A N GLY 397.A O no hydrogen 2.933 N/A ILE 402.A N MET 398.A O no hydrogen 2.989 N/A LEU 405.A N ALA 401.A O no hydrogen 2.925 N/A VAL 406.A N ILE 402.A O no hydrogen 2.930 N/A ASP 407.A N GLY 403.A O no hydrogen 2.996 N/A ILE 410.A N VAL 406.A O no hydrogen 2.991 N/A ILE 410.A N ASP 407.A O no hydrogen 3.199 N/A VAL 411.A N ASP 407.A O no hydrogen 3.005 N/A GLU 414.A N ILE 410.A O no hydrogen 2.955 N/A ASN 415.A N VAL 411.A O no hydrogen 2.974 N/A VAL 416.A N VAL 412.A O no hydrogen 2.977 N/A GLU 417.A N VAL 413.A O no hydrogen 2.967 N/A ARG 418.A N GLU 414.A O no hydrogen 2.912 N/A VAL 419.A N ASN 415.A O no hydrogen 2.986 N/A MET 420.A N VAL 416.A O no hydrogen 2.972 N/A ALA 421.A N GLU 417.A O no hydrogen 2.905 N/A GLU 422.A N ARG 418.A O no hydrogen 2.896 N/A GLU 423.A N VAL 419.A O no hydrogen 2.934 N/A GLY 424.A N MET 420.A O no hydrogen 2.989 N/A ALA 430.A N SER 426.A O no hydrogen 2.664 N/A ALA 431.A N PRO 427.A O no hydrogen 2.915 N/A ARG 432.A N ARG 428.A O no hydrogen 2.966 N/A LYS 433.A N GLU 429.A O no hydrogen 2.878 N/A SER 434.A N ALA 430.A O no hydrogen 2.842 N/A SER 434.A OG ALA 430.A O no hydrogen 2.934 N/A SER 434.A OG ALA 431.A O no hydrogen 3.188 N/A MET 435.A N ALA 431.A O no hydrogen 2.968 N/A GLY 436.A N LYS 433.A O no hydrogen 3.232 N/A GLN 437.A N GLN 437.A OE1 no hydrogen 3.191 N/A ILE 438.A N MET 435.A O no hydrogen 3.092 N/A LEU 442.A N ILE 438.A O no hydrogen 2.912 N/A VAL 443.A N GLN 439.A O no hydrogen 2.926 N/A GLY 444.A N GLY 440.A O no hydrogen 3.300 N/A ILE 445.A N ALA 441.A O no hydrogen 2.924 N/A VAL 448.A N GLY 444.A O no hydrogen 2.964 N/A LEU 449.A N ILE 445.A O no hydrogen 2.883 N/A LEU 449.A N ALA 446.A O no hydrogen 3.261 N/A SER 450.A N ALA 446.A O no hydrogen 2.928 N/A SER 450.A OG ALA 446.A O no hydrogen 2.916 N/A PHE 453.A N SER 450.A O no hydrogen 2.815 N/A LEU 454.A N SER 450.A O no hydrogen 3.311 N/A ALA 457.A N PHE 453.A O no hydrogen 2.782 N/A PHE 458.A N PRO 455.A O no hydrogen 2.959 N/A SER 462.A OG ILE 38.A O no hydrogen 3.139 N/A THR 463.A OG1 GLY 460.A O no hydrogen 3.249 N/A GLY 464.A N GLY 461.A O no hydrogen 3.348 N/A ILE 466.A N THR 463.A O no hydrogen 3.311 N/A TYR 467.A N THR 463.A O no hydrogen 2.916 N/A ARG 468.A N GLY 464.A O no hydrogen 2.906 N/A ARG 468.A NH1 ALA 457.A O no hydrogen 3.033 N/A ARG 468.A NH1 PHE 459.A O no hydrogen 3.386 N/A PHE 470.A N TYR 467.A O no hydrogen 3.340 N/A SER 471.A N TYR 467.A O no hydrogen 2.948 N/A SER 471.A OG TYR 467.A O no hydrogen 3.375 N/A ILE 474.A N PHE 470.A O no hydrogen 3.021 N/A ILE 474.A N SER 471.A O no hydrogen 3.289 N/A VAL 475.A N SER 471.A O no hydrogen 2.920 N/A SER 476.A N ILE 472.A O no hydrogen 2.942 N/A SER 476.A OG THR 379.A OG1 no hydrogen 2.480 N/A SER 476.A OG ILE 472.A O no hydrogen 2.935 N/A MET 478.A N ILE 474.A O no hydrogen 2.968 N/A ALA 479.A N VAL 475.A O no hydrogen 2.927 N/A LEU 480.A N SER 476.A O no hydrogen 2.955 N/A SER 481.A N ALA 477.A O no hydrogen 2.867 N/A SER 481.A OG ASP 408.A OD1 no hydrogen 2.805 N/A SER 481.A OG MET 478.A O no hydrogen 2.586 N/A VAL 482.A N MET 478.A O no hydrogen 2.900 N/A ILE 483.A N ALA 479.A O no hydrogen 3.097 N/A VAL 484.A N LEU 480.A O no hydrogen 2.975 N/A ALA 485.A N SER 481.A O no hydrogen 2.844 N/A LEU 486.A N VAL 482.A O no hydrogen 2.927 N/A ILE 487.A N ILE 483.A O no hydrogen 3.040 N/A LEU 488.A N VAL 484.A O no hydrogen 2.863 N/A THR 489.A OG1 ALA 485.A O no hydrogen 3.161 N/A LEU 492.A N LEU 488.A O no hydrogen 2.706 N/A CYS 493.A N THR 489.A O no hydrogen 2.922 N/A CYS 493.A SG PRO 490.A O no hydrogen 3.240 N/A ALA 494.A N PRO 490.A O no hydrogen 2.909 N/A THR 495.A N ALA 491.A O no hydrogen 2.949 N/A MET 496.A N LEU 492.A O no hydrogen 3.047 N/A LYS 502.A NZ ILE 500.A O no hydrogen 3.021 N/A ASP 504.A N LYS 502.A O no hydrogen 3.087 N/A HIS 505.A N GLU 507.A OE2 no hydrogen 3.021 N/A HIS 505.A ND1 GLY 503.A O no hydrogen 3.011 N/A GLY 506.A N ASP 504.A OD2 no hydrogen 3.295 N/A HIS 508.A N ASP 504.A OD2 no hydrogen 3.117 N/A HIS 508.A ND1 ASP 504.A OD1 no hydrogen 2.638 N/A LYS 509.A N ASP 504.A OD1 no hydrogen 2.695 N/A LYS 509.A N ASP 504.A OD2 no hydrogen 3.358 N/A LYS 509.A NZ GLN 360.A OE1 no hydrogen 3.192 N/A PHE 516.A N PHE 513.A O no hydrogen 3.169 N/A ARG 518.A N GLY 514.A O no hydrogen 2.976 N/A MET 519.A N TRP 515.A O no hydrogen 2.833 N/A PHE 520.A N PHE 516.A O no hydrogen 2.867 N/A LEU 521.A N ASN 517.A O no hydrogen 2.951 N/A SER 522.A N ARG 518.A O no hydrogen 2.891 N/A SER 522.A OG ARG 518.A O no hydrogen 3.527 N/A SER 522.A OG MET 519.A O no hydrogen 2.697 N/A THR 523.A N MET 519.A O no hydrogen 2.876 N/A THR 523.A OG1 MET 519.A O no hydrogen 2.749 N/A THR 523.A OG1 PHE 520.A O no hydrogen 2.858 N/A THR 524.A N PHE 520.A O no hydrogen 2.931 N/A HIS 525.A N LEU 521.A O no hydrogen 2.956 N/A GLY 526.A N SER 522.A O no hydrogen 2.901 N/A TYR 527.A N THR 523.A O no hydrogen 2.872 N/A TYR 527.A OH ILE 1017.A O no hydrogen 2.622 N/A GLU 528.A N THR 524.A O no hydrogen 2.915 N/A ARG 529.A N HIS 525.A O no hydrogen 2.954 N/A GLY 530.A N GLY 526.A O no hydrogen 2.879 N/A VAL 531.A N TYR 527.A O no hydrogen 2.935 N/A ALA 532.A N GLU 528.A O no hydrogen 2.944 N/A SER 533.A N ARG 529.A O no hydrogen 2.890 N/A SER 533.A OG ARG 529.A O no hydrogen 3.435 N/A SER 533.A OG GLY 530.A O no hydrogen 2.466 N/A ILE 534.A N GLY 530.A O no hydrogen 2.958 N/A LEU 535.A N VAL 531.A O no hydrogen 2.870 N/A LYS 536.A N SER 533.A O no hydrogen 3.270 N/A ILE 544.A N PRO 540.A O no hydrogen 2.912 N/A VAL 546.A N LEU 542.A O no hydrogen 2.907 N/A VAL 547.A N LEU 543.A O no hydrogen 2.941 N/A ILE 548.A N ILE 544.A O no hydrogen 2.897 N/A VAL 549.A N TYR 545.A O no hydrogen 2.904 N/A GLY 551.A N ILE 548.A O no hydrogen 3.256 N/A MET 552.A N VAL 549.A O no hydrogen 3.207 N/A ILE 553.A N ALA 550.A O no hydrogen 3.284 N/A TRP 554.A N ALA 550.A O no hydrogen 2.943 N/A MET 555.A N GLY 551.A O no hydrogen 2.917 N/A THR 557.A OG1 TRP 554.A O no hydrogen 2.782 N/A ARG 558.A N TRP 554.A O no hydrogen 2.932 N/A ILE 559.A N MET 555.A O no hydrogen 3.252 N/A ALA 562.A N ASN 922.A O no hydrogen 2.608 N/A LEU 564.A N ASP 923.A OD1 no hydrogen 3.217 N/A GLN 569.A NE2 PRO 669.A O no hydrogen 2.950 N/A GLY 570.A N ASP 568.A OD2 no hydrogen 3.342 N/A LEU 572.A N ILE 629.A O no hydrogen 2.950 N/A PHE 573.A N PHE 666.A O no hydrogen 2.950 N/A ALA 574.A N ALA 627.A O no hydrogen 2.956 N/A GLN 575.A N PHE 664.A O no hydrogen 2.896 N/A VAL 576.A N GLY 625.A O no hydrogen 2.850 N/A THR 578.A OG1 SER 623.A O no hydrogen 3.199 N/A SER 582.A OG SER 583.A O no hydrogen 3.029 N/A ARG 586.A NE ASP 660.A OD1 no hydrogen 3.195 N/A ARG 586.A NE ASP 660.A OD2 no hydrogen 3.538 N/A ARG 586.A NH2 ASP 660.A OD1 no hydrogen 2.994 N/A THR 587.A OG1 ALA 584.A O no hydrogen 3.173 N/A THR 587.A OG1 THR 613.A OG1 no hydrogen 2.703 N/A THR 587.A OG1 GLN 622.A O no hydrogen 3.560 N/A GLN 588.A N ALA 584.A O no hydrogen 2.911 N/A GLN 588.A NE2 GLN 280.A OE1 no hydrogen 3.475 N/A VAL 589.A N GLU 585.A O no hydrogen 2.902 N/A VAL 590.A N ARG 586.A O no hydrogen 2.996 N/A VAL 591.A N THR 587.A O no hydrogen 2.936 N/A ASP 592.A N GLN 588.A O no hydrogen 2.950 N/A SER 593.A N VAL 589.A O no hydrogen 2.938 N/A MET 594.A N VAL 590.A O no hydrogen 2.973 N/A ARG 595.A N VAL 591.A O no hydrogen 3.032 N/A GLU 596.A N ASP 592.A O no hydrogen 2.939 N/A TYR 597.A N SER 593.A O no hydrogen 2.890 N/A LEU 598.A N MET 594.A O no hydrogen 2.992 N/A GLU 600.A N GLU 600.A OE1 no hydrogen 2.925 N/A SER 603.A OG GLU 600.A O no hydrogen 3.473 N/A SER 604.A OG ASN 642.A OD1 no hydrogen 3.426 N/A SER 605.A N GLU 602.A O no hydrogen 3.160 N/A SER 605.A OG ASN 642.A OD1 no hydrogen 2.874 N/A VAL 606.A N GLU 602.A O no hydrogen 3.225 N/A SER 607.A N MET 630.A O no hydrogen 2.821 N/A SER 608.A N MET 630.A O no hydrogen 2.939 N/A SER 608.A OG VAL 609.A O no hydrogen 3.521 N/A PHE 610.A N PHE 628.A O no hydrogen 2.893 N/A THR 611.A N GLN 280.A O no hydrogen 2.976 N/A VAL 612.A N MET 626.A O no hydrogen 2.909 N/A THR 613.A N ASN 278.A O no hydrogen 2.874 N/A THR 613.A OG1 THR 587.A OG1 no hydrogen 2.703 N/A GLY 614.A N SER 624.A O no hydrogen 2.935 N/A ASN 616.A ND2 VAL 576.A O no hydrogen 3.286 N/A PHE 617.A N ASN 616.A OD1 no hydrogen 2.556 N/A GLY 621.A N GLY 614.A O no hydrogen 3.432 N/A SER 624.A OG GLY 621.A O no hydrogen 3.390 N/A GLY 625.A N VAL 576.A O no hydrogen 2.989 N/A MET 626.A N VAL 612.A O no hydrogen 2.909 N/A ALA 627.A N ALA 574.A O no hydrogen 2.857 N/A PHE 628.A N PHE 610.A O no hydrogen 2.905 N/A ILE 629.A N LEU 572.A O no hydrogen 2.940 N/A MET 630.A N SER 608.A O no hydrogen 2.916 N/A LEU 631.A N GLY 570.A O no hydrogen 2.539 N/A LYS 632.A N SER 605.A O no hydrogen 2.853 N/A LYS 632.A NZ SER 603.A O no hydrogen 2.411 N/A GLU 635.A N GLU 635.A OE1 no hydrogen 2.823 N/A GLU 636.A N PRO 633.A O no hydrogen 2.885 N/A ARG 637.A NE LYS 632.A O no hydrogen 2.449 N/A ARG 637.A NH1 ASN 642.A O no hydrogen 2.951 N/A ARG 637.A NH2 ASP 568.A OD2 no hydrogen 2.440 N/A ARG 637.A NH2 LYS 632.A O no hydrogen 3.366 N/A GLU 641.A N GLU 641.A OE1 no hydrogen 2.732 N/A SER 643.A OG GLY 640.A O no hydrogen 3.473 N/A VAL 644.A N ASP 568.A OD1 no hydrogen 2.980 N/A LEU 647.A N SER 643.A O no hydrogen 3.244 N/A ALA 648.A N VAL 644.A O no hydrogen 2.905 N/A LYS 649.A N PHE 645.A O no hydrogen 2.877 N/A ARG 650.A N GLU 646.A O no hydrogen 2.937 N/A ARG 650.A NE GLU 646.A OE1 no hydrogen 3.346 N/A ARG 650.A NH2 GLU 646.A OE1 no hydrogen 3.533 N/A ALA 651.A N LEU 647.A O no hydrogen 2.880 N/A HIS 654.A N ARG 650.A O no hydrogen 2.924 N/A PHE 656.A N GLN 652.A O no hydrogen 2.845 N/A PHE 658.A N PHE 656.A O no hydrogen 2.787 N/A MET 662.A N GLN 577.A O no hydrogen 2.906 N/A PHE 664.A N GLN 575.A O no hydrogen 2.887 N/A PHE 666.A N PHE 573.A O no hydrogen 2.900 N/A SER 670.A OG PRO 565.A O no hydrogen 2.289 N/A LEU 674.A N VAL 671.A O no hydrogen 3.364 N/A LEU 682.A N ILE 826.A O no hydrogen 2.886 N/A PHE 683.A N SER 857.A O no hydrogen 2.891 N/A LEU 684.A N MET 824.A O no hydrogen 2.873 N/A GLN 685.A N GLY 855.A O no hydrogen 2.867 N/A GLN 685.A NE2 TYR 818.A O no hydrogen 2.638 N/A ASP 686.A N PRO 822.A O no hydrogen 2.893 N/A GLN 687.A N GLY 853.A O no hydrogen 3.148 N/A GLN 687.A NE2 GLN 685.A OE1 no hydrogen 3.523 N/A ALA 688.A N GLY 853.A O no hydrogen 3.173 N/A VAL 690.A N ASP 686.A OD1 no hydrogen 2.998 N/A GLU 693.A N GLU 693.A OE1 no hydrogen 2.805 N/A LEU 696.A N HIS 692.A O no hydrogen 2.902 N/A GLN 697.A N GLU 693.A O no hydrogen 2.914 N/A ALA 698.A N VAL 694.A O no hydrogen 2.910 N/A ARG 699.A N LEU 695.A O no hydrogen 2.885 N/A ASN 700.A N LEU 696.A O no hydrogen 2.937 N/A LYS 701.A N GLN 697.A O no hydrogen 2.902 N/A PHE 702.A N ALA 698.A O no hydrogen 2.897 N/A LEU 703.A N ARG 699.A O no hydrogen 2.885 N/A MET 704.A N ASN 700.A O no hydrogen 2.936 N/A LEU 705.A N LYS 701.A O no hydrogen 2.954 N/A ALA 706.A N PHE 702.A O no hydrogen 2.885 N/A ALA 707.A N LEU 703.A O no hydrogen 2.914 N/A ALA 711.A N ASN 709.A OD1 no hydrogen 2.945 N/A GLN 713.A N GLU 829.A O no hydrogen 3.035 N/A GLN 713.A NE2 PRO 830.A O no hydrogen 3.500 N/A ARG 716.A N LEU 827.A O no hydrogen 2.900 N/A ARG 716.A NH1 ARG 714.A O no hydrogen 3.014 N/A ASN 718.A N GLU 825.A O no hydrogen 2.910 N/A GLU 723.A N GLY 811.A O no hydrogen 2.868 N/A GLN 725.A N GLU 809.A O no hydrogen 2.872 N/A GLU 729.A N THR 805.A O no hydrogen 2.872 N/A ASP 731.A N PHE 803.A O no hydrogen 3.029 N/A LYS 734.A NZ ALA 802.A O no hydrogen 2.943 N/A ALA 735.A N ASP 731.A O no hydrogen 2.804 N/A SER 736.A N ASP 732.A O no hydrogen 2.911 N/A SER 736.A OG ASP 732.A O no hydrogen 2.660 N/A SER 736.A OG GLU 733.A O no hydrogen 3.071 N/A ALA 737.A N GLU 733.A O no hydrogen 2.877 N/A LEU 738.A N LYS 734.A O no hydrogen 2.922 N/A GLY 739.A N SER 736.A O no hydrogen 3.191 N/A VAL 740.A N ALA 735.A O no hydrogen 3.206 N/A SER 741.A OG ASP 744.A OD1 no hydrogen 2.457 N/A ASN 746.A N LEU 742.A O no hydrogen 2.952 N/A SER 747.A N ALA 743.A O no hydrogen 2.895 N/A SER 747.A OG ALA 743.A O no hydrogen 3.509 N/A SER 747.A OG ASP 744.A O no hydrogen 2.862 N/A THR 748.A N ASP 744.A O no hydrogen 2.862 N/A THR 748.A OG1 ASP 744.A O no hydrogen 2.399 N/A VAL 749.A N ILE 745.A O no hydrogen 2.980 N/A SER 750.A N ASN 746.A O no hydrogen 2.934 N/A SER 750.A OG ASN 746.A O no hydrogen 3.014 N/A SER 750.A OG SER 747.A O no hydrogen 3.083 N/A ILE 751.A N SER 747.A O no hydrogen 2.907 N/A ALA 752.A N THR 748.A O no hydrogen 2.922 N/A TYR 757.A OH ASP 760.A OD1 no hydrogen 2.400 N/A VAL 758.A N VAL 770.A O no hydrogen 2.956 N/A PHE 761.A N LYS 768.A O no hydrogen 3.119 N/A ASP 763.A N ARG 766.A O no hydrogen 2.716 N/A ARG 766.A N ASP 763.A O no hydrogen 2.954 N/A LYS 768.A N PHE 761.A O no hydrogen 3.006 N/A ARG 769.A NH1 GLN 125.A O no hydrogen 3.112 N/A ARG 769.A NH2 GLN 273.A OE1 no hydrogen 2.531 N/A ARG 769.A NH2 TYR 771.A OH no hydrogen 3.464 N/A VAL 770.A N ASN 759.A O no hydrogen 3.205 N/A TYR 771.A N MET 184.A O no hydrogen 3.276 N/A TYR 771.A OH GLN 273.A OE1 no hydrogen 3.211 N/A GLN 773.A N ILE 186.A O no hydrogen 3.457 N/A GLN 773.A NE2 TRP 753.A O no hydrogen 3.293 N/A GLY 774.A N ALA 752.A O no hydrogen 3.118 N/A ARG 775.A N LEU 188.A O no hydrogen 2.676 N/A ARG 775.A NE ASP 777.A OD1 no hydrogen 2.997 N/A ARG 775.A NH2 ASP 777.A OD1 no hydrogen 3.306 N/A ARG 779.A N PRO 776.A O no hydrogen 2.955 N/A MET 780.A N ASP 784.A OD2 no hydrogen 3.179 N/A ASN 781.A N ASP 784.A OD2 no hydrogen 2.620 N/A LEU 785.A N PRO 782.A O no hydrogen 2.954 N/A SER 786.A N ASP 783.A O no hydrogen 2.949 N/A SER 786.A OG ASP 783.A O no hydrogen 2.441 N/A LYS 787.A N ASP 784.A O no hydrogen 2.939 N/A VAL 790.A N VAL 798.A O no hydrogen 2.953 N/A ARG 791.A NH1 GLN 197.A O no hydrogen 2.907 N/A ARG 791.A NH1 ASP 202.A OD2 no hydrogen 3.083 N/A ARG 791.A NH2 ASP 202.A OD1 no hydrogen 3.569 N/A ARG 791.A NH2 ASP 202.A OD2 no hydrogen 2.664 N/A ASN 792.A N GLU 796.A O no hydrogen 2.905 N/A ASN 792.A ND2 GLU 796.A OE1 no hydrogen 3.004 N/A ASP 793.A N GLY 739.A O no hydrogen 3.102 N/A LYS 794.A NZ ASP 793.A OD2 no hydrogen 3.044 N/A GLY 795.A N ASN 792.A OD1 no hydrogen 2.939 N/A GLU 796.A N ASN 792.A OD1 no hydrogen 2.536 N/A VAL 798.A N VAL 790.A O no hydrogen 2.864 N/A PHE 803.A N PHE 800.A O no hydrogen 2.947 N/A THR 805.A N GLU 729.A O no hydrogen 2.955 N/A THR 805.A OG1 GLU 729.A OE2 no hydrogen 2.310 N/A LYS 807.A N LYS 727.A O no hydrogen 2.908 N/A LYS 807.A NZ GLU 729.A OE1 no hydrogen 2.870 N/A GLU 809.A N GLN 725.A O no hydrogen 2.866 N/A GLY 811.A N GLU 723.A O no hydrogen 2.925 N/A LEU 815.A N SER 82.A O no hydrogen 2.961 N/A ARG 817.A N SER 80.A O no hydrogen 2.896 N/A TYR 818.A N VAL 821.A O no hydrogen 2.937 N/A ASN 819.A N ILE 78.A O no hydrogen 3.132 N/A VAL 821.A N TYR 818.A O no hydrogen 3.372 N/A ALA 823.A N GLU 816.A O no hydrogen 3.226 N/A MET 824.A N LEU 684.A O no hydrogen 2.923 N/A ILE 826.A N LEU 682.A O no hydrogen 2.942 N/A LEU 827.A N ARG 716.A O no hydrogen 2.926 N/A GLY 828.A N PHE 680.A O no hydrogen 2.916 N/A GLU 829.A N GLN 713.A O no hydrogen 3.104 N/A ALA 831.A N ALA 711.A O no hydrogen 2.965 N/A LEU 834.A N ALA 831.A O no hydrogen 3.071 N/A SER 835.A OG ASP 838.A OD1 no hydrogen 2.355 N/A ASP 838.A N SER 835.A OG no hydrogen 3.264 N/A MET 840.A N SER 836.A O no hydrogen 2.923 N/A ALA 841.A N GLY 837.A O no hydrogen 2.899 N/A ALA 842.A N ASP 838.A O no hydrogen 2.872 N/A VAL 843.A N ALA 839.A O no hydrogen 2.939 N/A GLU 844.A N MET 840.A O no hydrogen 2.917 N/A GLU 844.A N ALA 841.A O no hydrogen 3.241 N/A GLU 845.A N GLU 845.A OE1 no hydrogen 3.125 N/A ILE 846.A N VAL 843.A O no hydrogen 3.084 N/A LYS 848.A N GLU 845.A O no hydrogen 2.933 N/A LYS 848.A NZ GLU 844.A O no hydrogen 3.537 N/A GLN 849.A N ILE 846.A O no hydrogen 2.926 N/A GLY 855.A N GLN 685.A O no hydrogen 2.894 N/A GLY 855.A N GLN 687.A OE1 no hydrogen 3.186 N/A SER 857.A N PHE 683.A O no hydrogen 2.911 N/A SER 857.A OG GLN 685.A OE1 no hydrogen 2.322 N/A THR 859.A OG1 TYR 77.A OH no hydrogen 3.219 N/A GLY 860.A N TYR 77.A OH no hydrogen 3.252 N/A SER 862.A OG ASP 681.A O no hydrogen 2.877 N/A SER 862.A OG ASP 681.A OD1 no hydrogen 3.133 N/A SER 862.A OG THR 859.A O no hydrogen 2.533 N/A TYR 863.A N GLY 860.A O no hydrogen 3.274 N/A GLU 864.A N GLU 864.A OE1 no hydrogen 2.879 N/A ARG 866.A N TYR 863.A O no hydrogen 3.133 N/A LEU 867.A N GLU 864.A O no hydrogen 3.414 N/A SER 868.A N GLU 864.A O no hydrogen 2.900 N/A SER 868.A OG GLU 864.A O no hydrogen 2.661 N/A TYR 876.A OH GLN 927.A OE1 no hydrogen 3.369 N/A SER 879.A N LEU 875.A O no hydrogen 2.898 N/A SER 879.A OG TYR 876.A O no hydrogen 2.553 N/A LEU 880.A N TYR 876.A O no hydrogen 2.986 N/A LEU 881.A N ALA 877.A O no hydrogen 2.951 N/A VAL 882.A N LEU 878.A O no hydrogen 2.911 N/A VAL 883.A N SER 879.A O no hydrogen 3.007 N/A PHE 884.A N LEU 880.A O no hydrogen 2.957 N/A LEU 885.A N LEU 881.A O no hydrogen 2.951 N/A CYS 886.A N VAL 882.A O no hydrogen 2.886 N/A CYS 886.A SG GLY 444.A O no hydrogen 4.005 N/A LEU 887.A N VAL 883.A O no hydrogen 2.985 N/A ALA 888.A N PHE 884.A O no hydrogen 2.929 N/A ALA 889.A N LEU 885.A O no hydrogen 2.865 N/A LEU 890.A N CYS 886.A O no hydrogen 2.960 N/A TYR 891.A N LEU 887.A O no hydrogen 2.987 N/A GLU 892.A N ALA 888.A O no hydrogen 3.153 N/A SER 895.A N SER 893.A OG no hydrogen 3.100 N/A SER 899.A N SER 895.A O no hydrogen 3.219 N/A SER 899.A N ILE 896.A O no hydrogen 2.943 N/A SER 899.A OG ILE 896.A O no hydrogen 2.446 N/A VAL 900.A N ILE 896.A O no hydrogen 2.880 N/A MET 901.A N PRO 897.A O no hydrogen 3.252 N/A LEU 902.A N SER 899.A O no hydrogen 2.941 N/A VAL 903.A N VAL 900.A O no hydrogen 2.967 N/A VAL 904.A N MET 901.A O no hydrogen 2.981 N/A LEU 906.A N VAL 903.A O no hydrogen 2.898 N/A GLY 910.A N GLY 907.A O no hydrogen 2.981 N/A LEU 912.A N ILE 909.A O no hydrogen 2.993 N/A THR 915.A OG1 LEU 912.A O no hydrogen 2.318 N/A SER 916.A N LEU 912.A O no hydrogen 3.196 N/A MET 917.A N LEU 913.A O no hydrogen 2.517 N/A ARG 918.A N THR 915.A O no hydrogen 2.942 N/A LEU 920.A N THR 915.A O no hydrogen 3.058 N/A SER 921.A OG PRO 560.A O no hydrogen 2.363 N/A SER 921.A OG ASN 922.A O no hydrogen 3.176 N/A ASN 922.A N PRO 560.A O no hydrogen 3.003 N/A VAL 924.A N ASP 923.A OD1 no hydrogen 2.792 N/A GLN 927.A N ASP 923.A O no hydrogen 2.858 N/A GLN 927.A NE2 ASP 923.A O no hydrogen 3.691 N/A VAL 928.A N VAL 924.A O no hydrogen 2.963 N/A GLY 929.A N PHE 925.A O no hydrogen 2.921 N/A LEU 930.A N PHE 926.A O no hydrogen 2.941 N/A LEU 931.A N GLN 927.A O no hydrogen 2.897 N/A THR 932.A N VAL 928.A O no hydrogen 2.928 N/A THR 932.A OG1 VAL 928.A O no hydrogen 2.897 N/A THR 932.A OG1 GLY 929.A O no hydrogen 2.763 N/A THR 933.A N GLY 929.A O no hydrogen 2.921 N/A ILE 934.A N LEU 930.A O no hydrogen 2.950 N/A GLY 935.A N LEU 931.A O no hydrogen 2.936 N/A LEU 936.A N THR 932.A O no hydrogen 2.943 N/A SER 937.A N THR 933.A O no hydrogen 2.903 N/A SER 937.A OG THR 933.A O no hydrogen 3.012 N/A SER 937.A OG ILE 934.A O no hydrogen 3.264 N/A LYS 939.A NZ ASP 407.A OD1 no hydrogen 3.207 N/A LYS 939.A NZ THR 976.A OG1 no hydrogen 3.079 N/A ILE 942.A N ALA 938.A O no hydrogen 2.961 N/A LEU 943.A N LYS 939.A O no hydrogen 2.998 N/A VAL 945.A N ALA 941.A O no hydrogen 2.951 N/A GLU 946.A N ILE 942.A O no hydrogen 2.937 N/A PHE 947.A N LEU 943.A O no hydrogen 2.973 N/A ALA 948.A N ILE 944.A O no hydrogen 2.904 N/A LYS 949.A N VAL 945.A O no hydrogen 2.913 N/A GLU 950.A N GLU 946.A O no hydrogen 2.969 N/A LEU 951.A N PHE 947.A O no hydrogen 2.989 N/A HIS 952.A N ALA 948.A O no hydrogen 2.916 N/A HIS 952.A ND1 LYS 956.A O no hydrogen 2.715 N/A GLU 953.A N LYS 949.A O no hydrogen 2.884 N/A GLN 954.A N GLU 950.A O no hydrogen 2.983 N/A GLN 954.A NE2 LEU 951.A O no hydrogen 3.600 N/A GLY 955.A N HIS 952.A O no hydrogen 3.329 N/A LYS 956.A N HIS 952.A O no hydrogen 3.294 N/A GLY 957.A N GLU 960.A OE2 no hydrogen 2.930 N/A GLU 960.A N GLU 960.A OE1 no hydrogen 2.942 N/A ALA 961.A N GLY 957.A O no hydrogen 3.056 N/A ALA 962.A N ILE 958.A O no hydrogen 2.911 N/A ILE 963.A N VAL 959.A O no hydrogen 2.958 N/A GLU 964.A N GLU 960.A O no hydrogen 2.960 N/A ALA 965.A N ALA 961.A O no hydrogen 2.886 N/A CYS 966.A N ALA 962.A O no hydrogen 2.972 N/A CYS 966.A SG ALA 962.A O no hydrogen 3.365 N/A CYS 966.A SG ILE 963.A O no hydrogen 3.265 N/A ARG 967.A N ILE 963.A O no hydrogen 2.952 N/A ARG 967.A NE GLU 964.A OE1 no hydrogen 3.511 N/A ARG 967.A NE GLU 964.A OE2 no hydrogen 3.017 N/A ARG 967.A NH2 GLU 964.A OE2 no hydrogen 2.519 N/A MET 968.A N GLU 964.A O no hydrogen 2.874 N/A ARG 969.A N ALA 965.A O no hydrogen 2.918 N/A ARG 971.A NH2 PHE 358.A O no hydrogen 2.362 N/A VAL 974.A N LEU 970.A O no hydrogen 3.397 N/A MET 975.A N ARG 971.A O no hydrogen 3.013 N/A THR 976.A N PRO 972.A O no hydrogen 2.870 N/A THR 976.A OG1 PRO 972.A O no hydrogen 3.014 N/A THR 976.A OG1 ILE 973.A O no hydrogen 2.566 N/A SER 977.A N ILE 973.A O no hydrogen 2.913 N/A SER 977.A OG ILE 973.A O no hydrogen 2.618 N/A SER 977.A OG THR 1013.A OG1 no hydrogen 2.980 N/A LEU 978.A N VAL 974.A O no hydrogen 3.007 N/A PHE 980.A N THR 976.A O no hydrogen 2.933 N/A ILE 981.A N SER 977.A O no hydrogen 3.047 N/A LEU 982.A N LEU 978.A O no hydrogen 2.922 N/A GLY 983.A N ALA 979.A O no hydrogen 2.884 N/A GLY 983.A N PHE 980.A O no hydrogen 3.208 N/A VAL 984.A N PHE 980.A O no hydrogen 3.004 N/A VAL 985.A N ILE 981.A O no hydrogen 2.913 N/A ALA 988.A N VAL 984.A O no hydrogen 3.336 N/A ILE 989.A N VAL 985.A O no hydrogen 2.960 N/A SER 990.A OG LEU 987.A O no hydrogen 2.925 N/A SER 990.A OG GLN 998.A OE1 no hydrogen 3.019 N/A GLY 996.A N GLU 567.A OE1 no hydrogen 2.496 N/A GLN 998.A N GLY 994.A O no hydrogen 3.126 N/A HIS 999.A N SER 995.A O no hydrogen 2.900 N/A HIS 999.A NE2 SER 990.A O no hydrogen 2.429 N/A ILE 1001.A N SER 997.A O no hydrogen 2.930 N/A GLY 1002.A N GLN 998.A O no hydrogen 2.907 N/A THR 1003.A N HIS 999.A O no hydrogen 2.963 N/A THR 1003.A OG1 HIS 999.A O no hydrogen 3.060 N/A VAL 1005.A N ILE 1001.A O no hydrogen 2.950 N/A ILE 1006.A N GLY 1002.A O no hydrogen 2.969 N/A GLY 1008.A N GLY 1004.A O no hydrogen 2.945 N/A MET 1009.A N VAL 1005.A O no hydrogen 2.931 N/A VAL 1010.A N ILE 1006.A O no hydrogen 2.946 N/A ALA 1012.A N GLY 1008.A O no hydrogen 2.954 N/A THR 1013.A OG1 SER 977.A OG no hydrogen 2.980 N/A PHE 1018.A N LEU 1015.A O no hydrogen 3.288 N/A TRP 1019.A NE1 TYR 541.A O no hydrogen 2.546 N/A PHE 1023.A N TRP 1019.A O no hydrogen 2.751 N/A TYR 1024.A N PRO 1021.A O no hydrogen 3.137 N/A SER 1028.A OG SER 1028.A O no hydrogen 2.364 N/A THR 1029.A OG1 ALA 1026.A O no hydrogen 2.661 N/A