#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kui s ILE 356 N 0.00 3.54 0.09 -0.61 1.10 -1.26 -5.02 121.20 119.04 2kui s ILE 356 Ca 0.00 1.53 0.03 0.00 -0.51 0.00 0.00 60.65 61.71 2kui s ILE 356 Cb 0.00 -3.98 -0.04 0.00 0.15 0.00 0.00 42.46 38.59 2kui s ILE 356 CO 0.00 0.36 0.10 -0.89 -2.11 0.00 0.00 174.94 172.40 2kui s THR 357 N -1.09 4.60 -0.66 4.00 2.01 -1.26 -5.04 115.64 118.20 2kui s THR 357 Ca 0.45 -0.78 0.01 0.00 0.31 0.00 0.00 61.69 61.67 2kui s THR 357 Cb -0.31 -3.24 0.16 0.00 0.01 0.00 0.00 72.50 69.12 2kui s THR 357 CO 0.40 0.09 0.45 0.00 -0.69 0.00 0.00 174.62 174.88 2kui s ARG 358 N -2.51 2.49 0.15 4.92 3.03 -1.26 -5.06 118.95 120.71 2kui s ARG 358 Ca 0.30 -2.87 -0.31 0.00 2.03 0.00 0.00 55.73 54.88 2kui s ARG 358 Cb -0.12 -3.58 -0.09 0.00 -1.03 0.00 0.00 34.95 30.13 2kui s ARG 358 CO 0.23 -1.19 1.48 -0.51 -1.13 0.00 0.00 175.30 174.17 2kui s ASP 359 N -0.23 6.70 0.12 -2.89 1.11 -1.26 -4.66 116.67 115.56 2kui s ASP 359 Ca 0.20 2.50 0.03 0.00 0.18 0.00 0.00 52.55 55.46 2kui s ASP 359 Cb -0.16 -2.59 -0.04 0.00 1.07 0.00 0.00 42.92 41.19 2kui s ASP 359 CO -0.07 -0.73 -0.08 0.68 1.18 0.00 0.00 175.17 176.15 2kui s VAL 360 N 0.98 0.91 -0.03 -1.27 -7.23 -0.96 -4.89 120.40 107.91 2kui s VAL 360 Ca 0.66 -1.96 -0.14 0.00 -1.81 0.00 0.00 61.98 58.74 2kui s VAL 360 Cb -0.41 -1.71 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 2kui s VAL 360 CO 0.32 -0.79 0.38 -1.10 -0.31 0.00 0.00 175.10 173.60 2kui s GLN 361 N -3.69 3.94 -0.16 4.82 -0.21 -1.26 -0.82 119.66 122.27 2kui s GLN 361 Ca 0.13 0.34 -0.14 0.00 0.02 0.00 0.00 55.36 55.71 2kui s GLN 361 Cb 0.03 -3.25 -0.05 0.00 1.00 0.00 0.00 33.01 30.74 2kui s GLN 361 CO -0.02 0.61 0.32 0.08 -2.12 0.00 0.00 175.29 174.16 2kui s VAL 362 N -0.79 5.29 0.14 1.09 1.01 -0.15 -5.00 120.40 121.98 2kui s VAL 362 Ca 0.23 0.59 -0.33 0.00 0.00 0.00 0.00 61.98 62.47 2kui s VAL 362 Cb -0.16 -3.65 -0.12 0.00 0.00 0.00 0.00 36.38 32.44 2kui s VAL 362 CO 0.11 0.37 1.72 -0.81 0.00 0.00 0.00 175.10 176.49 2kui n PRO 363 N 3.70 2.51 -2.70 2.72 -0.04 -1.26 -4.26 135.00 135.66 2kui n PRO 363 Ca -0.11 0.91 -0.42 0.00 -0.04 0.00 0.00 63.50 63.83 2kui n PRO 363 Cb 0.52 -2.74 -0.03 0.00 -0.04 0.00 0.00 33.50 31.21 2kui n PRO 363 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2kui s ASP 364 N 1.80 7.26 0.00 3.54 -1.08 -1.26 -4.90 116.67 122.03 2kui s ASP 364 Ca 0.80 1.54 0.26 0.00 -0.52 0.00 0.00 52.55 54.63 2kui s ASP 364 Cb -0.58 -2.55 1.04 0.00 -1.46 0.00 0.00 42.92 39.37 2kui s ASP 364 CO 0.37 -0.40 1.73 1.33 0.52 0.00 0.00 175.17 178.72 2kui n VAL 365 N 4.41 0.06 -1.68 1.11 0.24 -1.26 -4.91 118.33 116.30 2kui n VAL 365 Ca 0.08 -0.25 -0.40 0.00 -2.04 0.00 0.00 64.34 61.73 2kui n VAL 365 Cb 0.49 0.37 0.03 0.00 -1.47 0.00 0.00 33.84 33.25 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2kui n ARG 366 N 0.10 1.62 0.00 7.34 1.85 -1.26 -3.07 116.66 123.24 2kui n ARG 366 Ca 0.19 0.59 0.00 0.00 -1.00 0.00 0.00 57.85 57.62 2kui n ARG 366 Cb 0.32 -2.33 0.00 0.00 -1.05 0.00 0.00 32.46 29.40 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2kui n GLY 367 N 0.94 2.23 0.00 2.89 0.00 0.16 -5.00 105.19 106.41 2kui n GLY 367 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 2kui n GLY 367 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2kui n GLN 368 N -1.53 3.33 -2.96 1.61 6.02 -1.17 -4.85 117.38 117.82 2kui n GLN 368 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.00 56.80 2kui n GLN 368 Cb 0.00 0.00 0.05 0.00 1.02 0.00 0.00 30.24 31.31 2kui n GLN 368 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2kui s SER 369 N -1.00 5.23 0.14 1.08 1.04 -1.26 -0.75 113.70 118.18 2kui s SER 369 Ca 0.00 -0.61 -0.15 0.00 0.48 0.00 0.00 55.95 55.67 2kui s SER 369 Cb 0.00 -0.12 0.01 0.00 0.10 0.00 0.00 66.02 66.01 2kui s SER 369 CO 0.00 -1.18 1.69 0.77 0.98 0.00 0.00 173.24 175.50 2kui h SER 370 N 0.26 0.59 -0.27 7.02 4.64 -1.88 0.03 113.55 123.94 2kui h SER 370 Ca -0.35 -0.17 -0.03 0.00 -0.47 0.00 0.00 61.79 60.78 2kui h SER 370 Cb 1.28 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 2kui h SER 370 CO 0.43 0.59 0.07 0.00 -0.87 0.00 0.00 176.83 177.05 2kui h ALA 371 N 1.02 0.35 -0.61 5.18 0.00 -1.95 -0.05 119.26 123.20 2kui h ALA 371 Ca 0.14 -0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2kui h ALA 371 Cb 0.19 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2kui h ALA 371 CO -0.01 0.01 0.12 -0.44 0.00 0.00 0.00 179.25 178.93 2kui h ASP 372 N 0.26 0.93 -0.11 0.00 3.32 -1.92 0.26 116.42 119.15 2kui h ASP 372 Ca 0.08 -0.20 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 2kui h ASP 372 Cb 0.28 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.59 2kui h ASP 372 CO 0.00 0.91 -0.03 0.00 -1.72 0.00 0.00 179.24 178.41 2kui h ALA 373 N 1.20 0.16 -0.60 3.45 0.00 -0.80 -1.86 119.26 120.82 2kui h ALA 373 Ca 0.19 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 373 Cb 0.37 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 2kui h ALA 373 CO 0.01 -0.10 0.35 0.82 0.00 0.00 0.00 179.25 180.33 2kui h ILE 374 N -0.10 1.18 -0.75 0.00 2.04 -0.83 -2.19 117.51 116.86 2kui h ILE 374 Ca 0.03 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.51 2kui h ILE 374 Cb 0.45 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 36.85 2kui h ILE 374 CO 0.01 0.19 0.48 0.00 0.00 0.00 0.00 178.15 178.82 2kui h ALA 375 N 1.18 0.98 -0.11 1.87 0.00 -0.38 0.20 119.26 123.00 2kui h ALA 375 Ca 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2kui h ALA 375 Cb -0.01 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 2kui h ALA 375 CO -0.04 0.28 -0.03 1.15 0.00 0.00 0.00 179.25 180.61 2kui h THR 376 N 0.93 1.29 -0.64 0.00 2.02 -1.11 -1.94 112.91 113.45 2kui h THR 376 Ca 0.30 -0.95 -0.07 0.00 0.77 0.00 0.00 66.41 66.46 2kui h THR 376 Cb 0.00 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 2kui h THR 376 CO -0.11 0.27 0.13 -0.07 0.37 0.00 0.00 175.52 176.11 2kui h LEU 377 N -0.11 0.98 -0.64 2.58 3.38 -0.93 -1.64 115.31 118.93 2kui h LEU 377 Ca 0.03 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 2kui h LEU 377 Cb 0.43 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2kui h LEU 377 CO 0.01 0.96 0.17 -0.61 0.09 0.00 0.00 178.44 179.06 2kui h GLN 378 N 0.98 1.02 0.00 1.13 5.75 -0.59 -0.00 115.11 123.39 2kui h GLN 378 Ca 0.20 -0.24 -0.01 0.00 -0.15 0.00 0.00 58.65 58.46 2kui h GLN 378 Cb 0.39 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 28.80 2kui h GLN 378 CO 0.01 0.91 -0.03 -0.91 -2.65 0.00 0.00 178.83 176.16 2kui h ASN 379 N 0.94 0.00 0.86 -0.69 2.35 -0.97 -1.25 115.58 116.82 2kui h ASN 379 Ca 0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.95 2kui h ASN 379 Cb 0.34 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.71 2kui h ASN 379 CO -0.00 0.03 -0.41 0.54 -1.65 0.00 0.00 177.43 175.94 2kui n ARG 380 N -3.14 0.15 0.00 0.81 5.12 -0.65 -4.93 116.66 114.03 2kui n ARG 380 Ca 0.00 0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2kui n ARG 380 Cb 0.31 -1.62 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 2kui n ARG 380 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2kui n GLY 381 N 1.41 0.70 3.89 -0.13 0.00 -0.47 -4.91 105.19 105.68 2kui n GLY 381 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 2kui n GLY 381 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 382 N -2.00 3.30 -0.05 1.61 0.08 -0.10 -4.46 117.98 116.35 2kui s PHE 382 Ca 0.00 0.99 0.00 0.00 0.12 0.00 0.00 56.93 58.04 2kui s PHE 382 Cb 0.00 -3.06 -0.03 0.00 -0.57 0.00 0.00 43.02 39.36 2kui s PHE 382 CO 0.00 -1.17 -0.02 0.15 -0.10 0.00 0.00 175.22 174.07 2kui s LYS 383 N -5.33 2.83 0.14 0.44 -0.14 0.33 -4.23 119.74 113.79 2kui s LYS 383 Ca 0.58 -0.52 0.09 0.00 -1.36 0.00 0.00 55.97 54.75 2kui s LYS 383 Cb -0.11 -2.68 -0.04 0.00 -1.68 0.00 0.00 37.83 33.32 2kui s LYS 383 CO 0.51 0.67 -0.20 0.96 -0.76 0.00 0.00 175.35 176.52 2kui s ILE 384 N -0.92 1.82 -0.06 2.17 -0.00 -1.26 -0.32 121.20 122.63 2kui s ILE 384 Ca 0.15 -1.76 0.01 0.00 -0.00 0.00 0.00 60.65 59.04 2kui s ILE 384 Cb -0.11 -1.75 0.02 0.00 -0.00 0.00 0.00 42.46 40.62 2kui s ILE 384 CO 0.04 -0.18 -0.05 -0.60 -0.00 0.00 0.00 174.94 174.15 2kui s ARG 385 N -2.39 1.02 -0.16 0.37 3.52 0.51 -4.86 118.95 116.96 2kui s ARG 385 Ca 0.12 -0.14 0.01 0.00 -0.13 0.00 0.00 55.73 55.59 2kui s ARG 385 Cb -0.08 -1.04 0.01 0.00 -1.56 0.00 0.00 34.95 32.28 2kui s ARG 385 CO 0.06 -0.12 -0.18 0.99 -0.81 0.00 0.00 175.30 175.24 2kui s THR 386 N 1.13 2.33 -0.21 4.11 2.01 -1.26 0.18 115.64 123.94 2kui s THR 386 Ca -0.07 -0.87 -0.03 0.00 0.31 0.00 0.00 61.69 61.02 2kui s THR 386 Cb -0.14 -1.97 -0.01 0.00 0.01 0.00 0.00 72.50 70.39 2kui s THR 386 CO -0.01 0.53 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.17 2kui s LEU 387 N 1.01 2.88 -0.18 4.42 1.98 0.71 -4.96 118.68 124.53 2kui s LEU 387 Ca -0.02 -0.38 -0.16 0.00 -2.89 0.00 0.00 54.13 50.68 2kui s LEU 387 Cb -0.15 -1.72 -0.04 0.00 0.66 0.00 0.00 46.19 44.94 2kui s LEU 387 CO -0.05 0.01 0.40 -1.10 -1.89 0.00 0.00 176.35 173.72 2kui s GLN 388 N 1.32 4.21 -0.03 1.98 1.11 -1.26 -1.07 119.66 125.93 2kui s GLN 388 Ca 0.04 0.24 0.03 0.00 0.01 0.00 0.00 55.36 55.68 2kui s GLN 388 Cb -0.14 -3.51 -0.00 0.00 -1.01 0.00 0.00 33.01 28.35 2kui s GLN 388 CO -0.02 0.03 -0.11 0.15 0.01 0.00 0.00 175.29 175.34 2kui s LYS 389 N 1.10 1.10 0.96 2.91 1.02 -0.22 -4.93 119.74 121.68 2kui s LYS 389 Ca 0.20 -0.38 -0.12 0.00 0.02 0.00 0.00 55.97 55.69 2kui s LYS 389 Cb -0.15 -1.02 0.17 0.00 -0.52 0.00 0.00 37.83 36.31 2kui s LYS 389 CO 0.08 0.16 1.09 -2.14 -0.92 0.00 0.00 175.35 173.62 2kui s PRO 390 N 0.07 0.73 0.00 -1.68 0.02 -1.21 -0.23 135.00 132.70 2kui s PRO 390 Ca -0.02 0.79 0.00 0.00 0.02 0.00 0.00 61.00 61.79 2kui s PRO 390 Cb -0.08 -1.75 0.00 0.00 0.02 0.00 0.00 34.50 32.69 2kui s PRO 390 CO 0.01 -2.59 0.00 -0.25 -0.33 0.00 0.00 177.00 173.83 2kui n ASP 391 N -4.12 0.00 -0.75 2.53 9.92 -1.00 -4.77 116.55 118.35 2kui n ASP 391 Ca 0.06 0.00 0.07 0.00 -0.53 0.00 0.00 54.79 54.39 2kui n ASP 391 Cb 0.55 0.00 0.18 0.00 -0.64 0.00 0.00 41.12 41.21 2kui n ASP 391 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2kui n SER 392 N -1.84 3.05 0.00 -2.24 3.41 -1.26 -4.44 113.62 110.29 2kui n SER 392 Ca 0.00 -1.97 0.13 0.00 -0.26 0.00 0.00 58.87 56.78 2kui n SER 392 Cb 0.00 -0.26 0.66 0.00 -0.26 0.00 0.00 64.21 64.35 2kui n SER 392 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2kui n THR 393 N 0.73 0.11 -4.30 6.66 5.66 -1.26 -4.68 114.28 117.19 2kui n THR 393 Ca 0.14 0.03 -0.29 0.00 -3.05 0.00 0.00 64.05 60.88 2kui n THR 393 Cb 0.45 -0.57 -0.11 0.00 -1.55 0.00 0.00 70.33 68.56 2kui n THR 393 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 2kui s ILE 394 N -2.70 2.93 0.02 1.09 -0.00 -1.26 -5.08 121.20 116.19 2kui s ILE 394 Ca 0.22 -1.57 -0.25 0.00 -0.00 0.00 0.00 60.65 59.05 2kui s ILE 394 Cb 0.18 -2.38 -0.13 0.00 -0.00 0.00 0.00 42.46 40.14 2kui s ILE 394 CO 0.44 0.03 0.64 -2.65 -0.00 0.00 0.00 174.94 173.40 2kui n PRO 395 N 0.55 0.00 -0.68 0.37 -0.02 -1.26 -4.47 135.00 129.49 2kui n PRO 395 Ca -0.14 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.03 2kui n PRO 395 Cb 0.54 -0.92 0.17 0.00 -0.02 0.00 0.00 33.50 33.27 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2kui n PRO 396 N 0.92 -1.11 0.00 0.52 -0.02 -1.26 -0.93 135.00 133.12 2kui n PRO 396 Ca 0.13 -0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 2kui n PRO 396 Cb 0.06 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.57 2kui n PRO 396 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kui n ASP 397 N -2.70 0.00 -4.34 2.55 5.75 -1.26 -3.94 116.55 112.61 2kui n ASP 397 Ca 0.05 0.35 -0.33 0.00 -0.01 0.00 0.00 54.79 54.86 2kui n ASP 397 Cb 0.56 -0.35 -0.15 0.00 -1.03 0.00 0.00 41.12 40.14 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 2kui s HIS 398 N -2.69 2.72 -0.18 2.11 3.76 -1.26 -3.11 115.29 116.64 2kui s HIS 398 Ca 0.00 -0.68 -0.29 0.00 -0.15 0.00 0.00 55.06 53.94 2kui s HIS 398 Cb 0.00 -1.77 -0.03 0.00 1.11 0.00 0.00 32.58 31.89 2kui s HIS 398 CO 0.00 -0.21 1.51 0.14 -0.85 0.00 0.00 174.74 175.33 2kui s VAL 399 N 0.18 3.85 -0.12 -0.90 -7.23 0.07 -4.79 120.40 111.46 2kui s VAL 399 Ca -0.09 0.99 0.16 0.00 -1.81 0.00 0.00 61.98 61.23 2kui s VAL 399 Cb -0.16 -3.77 -0.24 0.00 0.56 0.00 0.00 36.38 32.78 2kui s VAL 399 CO 0.06 -0.23 0.18 -0.38 -0.31 0.00 0.00 175.10 174.41 2kui n ILE 400 N 5.95 0.79 -3.93 -0.62 2.08 -1.26 0.41 119.36 122.78 2kui n ILE 400 Ca 0.17 -0.63 -0.09 0.00 0.56 0.00 0.00 62.75 62.76 2kui n ILE 400 Cb 0.45 -0.34 -0.09 0.00 -0.75 0.00 0.00 39.64 38.92 2kui n ILE 400 CO 0.00 0.00 0.00 -0.83 0.56 0.00 0.00 176.55 176.28 2kui s GLY 401 N -4.79 0.19 0.22 7.39 0.00 -1.26 -4.67 107.32 104.40 2kui s GLY 401 Ca -0.08 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 43.96 2kui s GLY 401 CO 0.73 -0.83 0.28 -1.30 0.00 0.00 0.00 173.10 171.98 2kui n THR 402 N 0.36 0.00 -3.92 0.90 -2.24 -1.26 -4.81 114.28 103.32 2kui n THR 402 Ca -0.17 -1.24 -0.37 0.00 -2.27 0.00 0.00 64.05 60.01 2kui n THR 402 Cb 0.60 0.72 -0.06 0.00 -2.10 0.00 0.00 70.33 69.49 2kui n THR 402 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2kui s ASP 403 N -2.41 6.29 0.19 3.42 2.15 -1.26 -4.96 116.67 120.09 2kui s ASP 403 Ca 0.20 0.44 0.10 0.00 0.43 0.00 0.00 52.55 53.72 2kui s ASP 403 Cb -0.00 -2.02 0.54 0.00 -0.30 0.00 0.00 42.92 41.14 2kui s ASP 403 CO 0.14 0.40 1.22 -2.65 -0.17 0.00 0.00 175.17 174.11 2kui n PRO 404 N 2.03 0.07 -0.33 4.34 -0.02 -1.26 -2.65 135.00 137.18 2kui n PRO 404 Ca -0.20 0.51 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 2kui n PRO 404 Cb 0.55 -1.87 0.31 0.00 -0.02 0.00 0.00 33.50 32.47 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui h ALA 405 N 1.52 1.54 -0.08 3.55 0.00 -1.93 0.51 119.26 124.38 2kui h ALA 405 Ca 0.00 0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.88 2kui h ALA 405 Cb 0.31 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2kui h ALA 405 CO 0.00 -0.18 -0.57 0.00 0.00 0.00 0.00 179.25 178.50 2kui h ALA 406 N 1.66 0.89 -0.01 0.00 0.00 -1.82 -2.78 119.26 117.20 2kui h ALA 406 Ca 0.56 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2kui h ALA 406 Cb 0.95 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.66 2kui h ALA 406 CO -0.43 0.71 -0.03 0.09 0.00 0.00 0.00 179.25 179.58 2kui n ASN 407 N -3.90 0.74 -4.87 0.00 3.02 0.01 -0.98 115.26 109.28 2kui n ASN 407 Ca -0.02 -1.11 -0.30 0.00 -0.03 0.00 0.00 54.58 53.12 2kui n ASN 407 Cb 0.59 -0.01 -0.05 0.00 -0.61 0.00 0.00 39.78 39.71 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2kui s THR 408 N -2.12 5.04 -0.31 3.41 2.01 -0.27 -4.91 115.64 118.48 2kui s THR 408 Ca 0.39 -0.60 -0.29 0.00 0.31 0.00 0.00 61.69 61.50 2kui s THR 408 Cb 0.21 -3.48 -0.00 0.00 0.01 0.00 0.00 72.50 69.24 2kui s THR 408 CO 0.38 0.09 1.38 -0.44 -0.69 0.00 0.00 174.62 175.34 2kui s SER 409 N -2.61 6.55 0.41 3.53 0.01 -1.26 -4.19 113.70 116.14 2kui s SER 409 Ca 0.33 1.18 0.07 0.00 1.31 0.00 0.00 55.95 58.84 2kui s SER 409 Cb -0.12 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.49 2kui s SER 409 CO 0.26 -1.19 0.01 0.68 0.41 0.00 0.00 173.24 173.41 2kui s VAL 410 N 4.76 1.95 0.48 3.43 -7.23 -0.00 -4.75 120.40 119.03 2kui s VAL 410 Ca 0.60 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 58.57 2kui s VAL 410 Cb -0.17 -2.96 -0.09 0.00 0.56 0.00 0.00 36.38 33.72 2kui s VAL 410 CO 0.26 0.00 1.00 -0.55 -0.31 0.00 0.00 175.10 175.50 2kui s SER 411 N -3.71 6.55 0.00 4.85 0.15 -1.26 -2.28 113.70 118.00 2kui s SER 411 Ca 0.34 1.79 -0.30 0.00 0.70 0.00 0.00 55.95 58.48 2kui s SER 411 Cb 0.10 -2.54 -0.07 0.00 -1.71 0.00 0.00 66.02 61.79 2kui s SER 411 CO 0.17 -0.64 1.67 0.00 1.20 0.00 0.00 173.24 175.65 2kui s ALA 412 N -2.18 3.64 0.00 5.45 0.00 -1.26 -3.74 121.76 123.67 2kui s ALA 412 Ca 0.64 1.08 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2kui s ALA 412 Cb -0.13 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.26 2kui s ALA 412 CO 0.20 -1.28 0.00 0.41 0.00 0.00 0.00 175.76 175.09 2kui n GLY 413 N 4.10 0.59 3.42 0.00 0.00 -1.26 -5.07 105.19 106.96 2kui n GLY 413 Ca 0.17 -0.61 -0.27 0.00 0.00 0.00 0.00 46.02 45.31 2kui n GLY 413 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2kui n ASP 414 N -0.29 1.77 -4.32 1.61 -0.08 -1.25 -4.90 116.55 109.10 2kui n ASP 414 Ca 0.00 -3.18 -0.35 0.00 -1.51 0.00 0.00 54.79 49.75 2kui n ASP 414 Cb 0.13 0.86 -0.14 0.00 2.34 0.00 0.00 41.12 44.32 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2kui s GLU 415 N -3.62 3.37 -0.24 -0.67 2.02 -1.26 -0.51 118.70 117.79 2kui s GLU 415 Ca 0.16 -0.63 -0.07 0.00 0.02 0.00 0.00 54.97 54.44 2kui s GLU 415 Cb 0.01 -3.05 -0.03 0.00 0.10 0.00 0.00 34.13 31.16 2kui s GLU 415 CO 0.11 -0.21 0.06 0.42 0.02 0.00 0.00 175.26 175.66 2kui s ILE 416 N 1.49 4.31 -0.11 -1.63 -1.09 0.57 -4.95 121.20 119.77 2kui s ILE 416 Ca 0.06 -0.18 -0.17 0.00 -2.23 0.00 0.00 60.65 58.13 2kui s ILE 416 Cb -0.14 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 2kui s ILE 416 CO -0.03 0.35 0.45 0.42 -1.23 0.00 0.00 174.94 174.90 2kui s THR 417 N 1.51 5.19 -0.04 2.92 -4.23 -1.26 -0.36 115.64 119.37 2kui s THR 417 Ca 0.06 0.89 0.04 0.00 -1.18 0.00 0.00 61.69 61.50 2kui s THR 417 Cb -0.15 -3.78 -0.00 0.00 1.34 0.00 0.00 72.50 69.91 2kui s THR 417 CO 0.03 0.36 -0.16 0.54 -0.54 0.00 0.00 174.62 174.85 2kui s VAL 418 N 0.45 1.34 -0.17 2.29 0.11 0.13 -4.03 120.40 120.52 2kui s VAL 418 Ca 0.24 -0.67 -0.03 0.00 -2.93 0.00 0.00 61.98 58.60 2kui s VAL 418 Cb -0.15 -1.16 -0.02 0.00 -1.53 0.00 0.00 36.38 33.53 2kui s VAL 418 CO 0.10 0.39 -0.07 0.54 -3.33 0.00 0.00 175.10 172.73 2kui s ASN 419 N 0.06 4.35 0.04 3.54 6.03 -1.26 -0.21 114.94 127.48 2kui s ASN 419 Ca -0.04 -0.30 0.08 0.00 -1.03 0.00 0.00 52.86 51.58 2kui s ASN 419 Cb -0.11 -1.71 -0.03 0.00 -3.03 0.00 0.00 41.25 36.37 2kui s ASN 419 CO 0.02 0.09 -0.24 0.54 -2.03 0.00 0.00 177.10 175.47 2kui s VAL 420 N 0.83 1.97 -0.21 3.54 0.11 -0.23 -4.27 120.40 122.14 2kui s VAL 420 Ca -0.02 -1.29 -0.25 0.00 -2.93 0.00 0.00 61.98 57.49 2kui s VAL 420 Cb -0.15 -1.69 -0.01 0.00 -1.53 0.00 0.00 36.38 33.01 2kui s VAL 420 CO 0.01 0.34 0.85 -0.55 -3.33 0.00 0.00 175.10 172.43 2kui s SER 421 N -1.13 6.91 -0.27 3.54 0.15 -0.10 -1.05 113.70 121.74 2kui s SER 421 Ca 0.10 1.13 0.03 0.00 0.70 0.00 0.00 55.95 57.91 2kui s SER 421 Cb -0.10 -2.46 0.07 0.00 -1.71 0.00 0.00 66.02 61.83 2kui s SER 421 CO 0.02 -0.49 -0.06 0.28 1.20 0.00 0.00 173.24 174.18 2kui s THR 422 N 2.61 2.07 0.00 6.45 -1.32 0.69 -4.15 115.64 121.98 2kui s THR 422 Ca 0.37 -1.72 0.00 0.00 -1.21 0.00 0.00 61.69 59.13 2kui s THR 422 Cb -0.16 -2.28 0.00 0.00 -1.51 0.00 0.00 72.50 68.55 2kui s THR 422 CO 0.09 -0.17 0.00 0.61 -2.21 0.00 0.00 174.62 172.94 2kui n GLY 423 N 4.44 1.65 3.79 6.08 0.00 -1.26 -3.36 105.19 116.53 2kui n GLY 423 Ca -0.10 -1.73 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 2kui n GLY 423 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 424 N -3.78 2.74 0.75 1.61 0.04 -1.26 -2.39 135.00 132.71 2kui s PRO 424 Ca 0.00 1.11 -0.11 0.00 0.04 0.00 0.00 61.00 62.04 2kui s PRO 424 Cb 0.00 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.62 2kui s PRO 424 CO 0.00 -1.26 1.09 -1.21 0.04 0.00 0.00 177.00 175.66 2kui s GLU 425 N -4.75 2.50 0.07 4.56 2.02 -1.26 -4.34 118.70 117.49 2kui s GLU 425 Ca 0.61 0.62 -0.20 0.00 0.02 0.00 0.00 54.97 56.02 2kui s GLU 425 Cb -0.16 -1.97 -0.07 0.00 0.10 0.00 0.00 34.13 32.04 2kui s GLU 425 CO 0.51 -1.33 0.59 -1.14 0.02 0.00 0.00 175.26 173.92 2kui s GLN 426 N -5.21 4.26 0.08 1.61 2.00 -1.26 -4.23 119.66 116.90 2kui s GLN 426 Ca 0.59 0.78 0.07 0.00 -2.00 0.00 0.00 55.36 54.79 2kui s GLN 426 Cb -0.13 -3.26 -0.03 0.00 0.80 0.00 0.00 33.01 30.39 2kui s GLN 426 CO 0.53 0.58 -0.18 1.03 -0.50 0.00 0.00 175.29 176.76 2kui s ARG 427 N -0.93 1.02 0.15 1.67 1.81 -0.41 -4.98 118.95 117.28 2kui s ARG 427 Ca 0.30 -1.01 -0.26 0.00 -1.72 0.00 0.00 55.73 53.04 2kui s ARG 427 Cb -0.20 -1.14 -0.07 0.00 -0.45 0.00 0.00 34.95 33.09 2kui s ARG 427 CO 0.19 0.27 0.81 -2.00 -0.68 0.00 0.00 175.30 173.89 2kui s GLU 428 N -1.67 4.60 -0.26 3.54 2.12 -1.26 0.31 118.70 126.08 2kui s GLU 428 Ca 0.03 1.20 -0.26 0.00 0.36 0.00 0.00 54.97 56.30 2kui s GLU 428 Cb -0.10 -3.29 0.00 0.00 0.26 0.00 0.00 34.13 31.00 2kui s GLU 428 CO 0.03 0.48 0.89 0.42 -0.54 0.00 0.00 175.26 176.55 2kui s ILE 429 N -0.85 4.76 0.59 -3.70 1.01 -1.02 -4.90 121.20 117.10 2kui s ILE 429 Ca 0.38 1.64 -0.17 0.00 0.00 0.00 0.00 60.65 62.49 2kui s ILE 429 Cb -0.23 -4.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.01 2kui s ILE 429 CO 0.27 -0.16 1.10 -2.16 0.00 0.00 0.00 174.94 173.99 2kui s PRO 430 N 3.02 3.18 -0.44 2.79 0.04 -1.26 -4.52 135.00 137.81 2kui s PRO 430 Ca 0.38 1.45 -0.21 0.00 0.04 0.00 0.00 61.00 62.66 2kui s PRO 430 Cb -0.15 -2.00 0.02 0.00 0.04 0.00 0.00 34.50 32.42 2kui s PRO 430 CO 0.08 -0.96 0.66 -0.51 0.04 0.00 0.00 177.00 176.32 2kui s ASP 431 N -2.23 6.33 0.12 6.66 1.11 -1.26 -4.98 116.67 122.42 2kui s ASP 431 Ca 0.69 -0.31 0.09 0.00 0.18 0.00 0.00 52.55 53.20 2kui s ASP 431 Cb -0.21 -2.33 -0.04 0.00 1.07 0.00 0.00 42.92 41.41 2kui s ASP 431 CO 0.33 -0.79 -0.19 -0.69 1.18 0.00 0.00 175.17 175.01 2kui s VAL 432 N 2.87 2.77 0.58 -1.27 1.01 -1.26 -5.12 120.40 119.98 2kui s VAL 432 Ca 0.23 -1.56 -0.19 0.00 0.00 0.00 0.00 61.98 60.47 2kui s VAL 432 Cb -0.14 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 2kui s VAL 432 CO 0.19 0.08 1.14 -0.44 0.00 0.00 0.00 175.10 176.08 2kui s SER 433 N -2.18 5.48 0.39 3.32 0.01 -1.26 -4.94 113.70 114.51 2kui s SER 433 Ca 0.18 2.20 0.18 0.00 1.31 0.00 0.00 55.95 59.81 2kui s SER 433 Cb -0.10 -2.58 0.78 0.00 0.21 0.00 0.00 66.02 64.33 2kui s SER 433 CO 0.10 -1.39 1.80 0.71 0.41 0.00 0.00 173.24 174.87 2kui h THR 434 N 0.92 0.99 0.00 1.44 1.35 -1.99 -1.98 112.91 113.64 2kui h THR 434 Ca -0.50 -1.36 0.00 0.00 -0.55 0.00 0.00 66.41 64.01 2kui h THR 434 Cb 1.27 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 69.48 2kui h THR 434 CO 0.56 0.35 -0.45 0.00 -0.25 0.00 0.00 175.52 175.73 2kui n LEU 435 N -3.73 0.47 -2.63 3.87 -0.00 -1.26 -0.49 117.00 113.24 2kui n LEU 435 Ca -0.01 0.13 -0.37 0.00 -0.00 0.00 0.00 56.01 55.76 2kui n LEU 435 Cb 0.45 -0.27 0.06 0.00 -0.00 0.00 0.00 43.42 43.65 2kui n LEU 435 CO 0.37 0.06 1.50 0.41 -0.00 0.00 0.00 177.39 179.74 2kui n THR 436 N -1.64 3.60 -0.33 1.47 -1.04 -0.74 -4.75 114.28 110.84 2kui n THR 436 Ca 0.05 -3.61 0.12 0.00 -2.04 0.00 0.00 64.05 58.57 2kui n THR 436 Cb 0.36 -1.21 0.33 0.00 -1.82 0.00 0.00 70.33 67.99 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2kui h TYR 437 N 2.53 0.99 -0.68 -1.42 3.20 -1.72 -1.12 116.97 118.74 2kui h TYR 437 Ca 0.58 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.41 2kui h TYR 437 Cb 0.40 -0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 2kui h TYR 437 CO 1.30 0.29 0.15 0.00 -1.64 0.00 0.00 178.16 178.26 2kui h ALA 438 N 1.60 0.97 -0.40 1.82 0.00 -1.95 -1.49 119.26 119.82 2kui h ALA 438 Ca 0.53 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 2kui h ALA 438 Cb 0.80 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2kui h ALA 438 CO -0.30 0.66 -0.08 1.49 0.00 0.00 0.00 179.25 181.02 2kui h GLU 439 N 1.04 0.68 0.16 0.00 4.57 -1.66 -2.34 114.58 117.02 2kui h GLU 439 Ca 0.21 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2kui h GLU 439 Cb 0.39 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2kui h GLU 439 CO 0.01 0.75 -0.08 0.00 -1.18 0.00 0.00 179.01 178.51 2kui h ALA 440 N 1.28 -0.21 -0.58 2.92 0.00 -0.43 0.10 119.26 122.35 2kui h ALA 440 Ca 0.12 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2kui h ALA 440 Cb 0.51 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2kui h ALA 440 CO 0.03 -0.60 0.00 -0.39 0.00 0.00 0.00 179.25 178.30 2kui h VAL 441 N -0.26 1.26 -0.19 0.00 -1.51 -1.22 -1.76 116.25 112.57 2kui h VAL 441 Ca -0.02 -1.11 -0.11 0.00 -1.23 0.00 0.00 66.70 64.23 2kui h VAL 441 Cb 0.20 0.81 -0.01 0.00 -2.13 0.00 0.00 31.29 30.16 2kui h VAL 441 CO 0.04 0.40 -0.34 0.07 -1.23 0.00 0.00 177.57 176.50 2kui h LYS 442 N 0.91 0.41 -0.62 5.19 5.09 -1.26 -1.53 116.57 124.76 2kui h LYS 442 Ca 0.17 -0.18 -0.01 0.00 0.09 0.00 0.00 60.65 60.72 2kui h LYS 442 Cb 0.53 -0.01 -0.03 0.00 0.10 0.00 0.00 32.23 32.81 2kui h LYS 442 CO 0.03 0.70 0.35 0.87 -2.09 0.00 0.00 179.45 179.31 2kui h LYS 443 N 0.35 0.85 -0.45 0.07 1.79 -0.41 0.24 116.57 119.02 2kui h LYS 443 Ca 0.04 -0.09 -0.05 0.00 -2.18 0.00 0.00 60.65 58.37 2kui h LYS 443 Cb 0.77 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.23 2kui h LYS 443 CO 0.06 0.63 0.08 -0.07 -1.08 0.00 0.00 179.45 179.07 2kui h LEU 444 N 0.84 0.63 -0.12 2.94 4.07 -1.14 -0.96 115.31 121.57 2kui h LEU 444 Ca 0.22 -0.11 -0.07 0.00 0.08 0.00 0.00 57.88 57.99 2kui h LEU 444 Cb 0.01 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.59 2kui h LEU 444 CO -0.04 0.65 -0.22 0.74 -1.08 0.00 0.00 178.44 178.50 2kui h THR 445 N 0.66 1.38 0.00 0.22 2.02 -0.59 0.32 112.91 116.92 2kui h THR 445 Ca 0.15 -1.47 -0.00 0.00 0.77 0.00 0.00 66.41 65.85 2kui h THR 445 Cb 0.29 2.04 -0.00 0.00 -1.74 0.00 0.00 68.15 68.74 2kui h THR 445 CO 0.00 0.43 -0.00 0.00 0.37 0.00 0.00 175.52 176.32 2kui h ALA 446 N 0.54 1.00 0.00 6.16 0.00 -0.31 -0.68 119.26 125.97 2kui h ALA 446 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2kui h ALA 446 Cb 0.79 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2kui h ALA 446 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2kui n ALA 447 N -2.09 2.51 0.00 0.00 0.00 -0.39 -4.95 120.51 115.59 2kui n ALA 447 Ca -0.01 -0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2kui n ALA 447 Cb 0.20 -1.48 0.00 0.00 0.00 0.00 0.00 19.45 18.16 2kui n ALA 447 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 448 N 1.12 2.44 0.14 0.00 0.00 -0.26 -4.87 105.19 103.76 2kui n GLY 448 Ca 0.17 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.43 2kui n GLY 448 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2kui h PHE 449 N 0.00 -0.57 -2.25 1.61 -0.00 -1.70 -3.46 116.94 110.57 2kui h PHE 449 Ca 0.00 0.03 -0.38 0.00 -0.00 0.00 0.00 57.97 57.63 2kui h PHE 449 Cb 0.00 0.28 -0.05 0.00 -0.00 0.00 0.00 35.95 36.18 2kui h PHE 449 CO 0.00 -0.14 -0.45 0.41 -0.00 0.00 0.00 178.31 178.13 2kui n GLY 450 N -1.10 0.12 3.39 6.09 0.00 0.09 -4.87 105.19 108.90 2kui n GLY 450 Ca -0.00 -0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 2kui n GLY 450 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2kui s ARG 451 N -4.62 2.84 0.07 1.61 1.81 -1.26 -4.74 118.95 114.67 2kui s ARG 451 Ca 0.00 -1.08 0.02 0.00 -1.72 0.00 0.00 55.73 52.95 2kui s ARG 451 Cb 0.00 -3.76 -0.03 0.00 -0.45 0.00 0.00 34.95 30.70 2kui s ARG 451 CO 0.00 -0.71 -0.07 -0.59 -0.68 0.00 0.00 175.30 173.25 2kui s PHE 452 N 1.57 0.80 -0.09 -0.53 -0.12 -1.26 -1.43 117.98 116.91 2kui s PHE 452 Ca 0.02 -0.69 0.00 0.00 -0.05 0.00 0.00 56.93 56.21 2kui s PHE 452 Cb -0.19 -0.47 0.02 0.00 -0.63 0.00 0.00 43.02 41.75 2kui s PHE 452 CO 0.07 -0.11 -0.07 0.21 -0.05 0.00 0.00 175.22 175.27 2kui s LYS 453 N -2.65 1.35 -0.07 1.99 2.20 0.01 -4.87 119.74 117.71 2kui s LYS 453 Ca 0.01 -0.21 -0.23 0.00 -0.36 0.00 0.00 55.97 55.17 2kui s LYS 453 Cb -0.03 -1.38 -0.04 0.00 -1.51 0.00 0.00 37.83 34.87 2kui s LYS 453 CO -0.02 -0.20 0.69 -1.14 -0.36 0.00 0.00 175.35 174.32 2kui s GLN 454 N 1.47 4.43 0.00 4.03 0.74 -1.26 -0.17 119.66 128.90 2kui s GLN 454 Ca -0.00 0.86 0.01 0.00 0.05 0.00 0.00 55.36 56.28 2kui s GLN 454 Cb -0.13 -3.45 -0.01 0.00 1.10 0.00 0.00 33.01 30.52 2kui s GLN 454 CO -0.05 0.07 -0.05 0.00 -0.55 0.00 0.00 175.29 174.71 2kui s ALA 455 N 0.79 0.40 0.05 1.58 0.00 0.27 -4.94 121.76 119.91 2kui s ALA 455 Ca 0.37 -0.25 0.06 0.00 0.00 0.00 0.00 51.96 52.14 2kui s ALA 455 Cb -0.18 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 2kui s ALA 455 CO 0.18 0.08 -0.13 0.54 0.00 0.00 0.00 175.76 176.43 2kui s ASN 456 N -0.25 4.14 -0.01 0.00 2.20 -1.26 -0.18 114.94 119.59 2kui s ASN 456 Ca 0.01 -0.35 -0.13 0.00 -0.94 0.00 0.00 52.86 51.44 2kui s ASN 456 Cb -0.03 -0.77 0.02 0.00 -2.00 0.00 0.00 41.25 38.47 2kui s ASN 456 CO -0.00 0.24 0.27 -0.44 -2.94 0.00 0.00 177.10 174.23 2kui s SER 457 N -1.64 -0.14 0.19 3.54 0.01 -0.81 -4.90 113.70 109.95 2kui s SER 457 Ca 0.17 0.01 -0.31 0.00 1.31 0.00 0.00 55.95 57.13 2kui s SER 457 Cb -0.11 0.29 -0.09 0.00 0.21 0.00 0.00 66.02 66.32 2kui s SER 457 CO 0.08 -0.44 1.43 -2.16 0.41 0.00 0.00 173.24 172.56 2kui s PRO 458 N -1.40 4.29 0.32 12.44 0.04 -1.23 -0.51 135.00 148.95 2kui s PRO 458 Ca -0.13 2.22 0.04 0.00 0.04 0.00 0.00 61.00 63.16 2kui s PRO 458 Cb -0.05 -3.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.30 2kui s PRO 458 CO 0.03 -0.43 0.32 -1.12 0.04 0.00 0.00 177.00 175.84 2kui s SER 459 N 0.68 1.31 0.32 6.66 0.01 0.31 -4.81 113.70 118.18 2kui s SER 459 Ca 0.62 -1.64 -0.29 0.00 1.31 0.00 0.00 55.95 55.95 2kui s SER 459 Cb -0.40 0.57 -0.11 0.00 0.21 0.00 0.00 66.02 66.29 2kui s SER 459 CO 0.37 -1.11 1.49 0.28 0.41 0.00 0.00 173.24 174.67 2kui s THR 460 N -3.40 2.26 0.55 1.44 -1.32 -1.26 -4.67 115.64 109.24 2kui s THR 460 Ca 0.38 0.24 0.31 0.00 -1.21 0.00 0.00 61.69 61.41 2kui s THR 460 Cb 0.02 -3.16 0.46 0.00 -1.51 0.00 0.00 72.50 68.32 2kui s THR 460 CO 0.24 0.05 1.89 1.55 -2.21 0.00 0.00 174.62 176.14 2kui h PRO 461 N 4.02 0.00 -0.17 7.08 0.13 -1.92 0.86 132.00 142.00 2kui h PRO 461 Ca -0.48 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.55 2kui h PRO 461 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2kui h PRO 461 CO 0.72 0.00 -0.33 1.05 -0.23 0.00 0.00 178.00 179.21 2kui h GLU 462 N 0.00 0.34 0.00 0.86 4.11 -1.96 -3.00 114.58 114.93 2kui h GLU 462 Ca 0.38 -0.14 -0.00 0.00 0.07 0.00 0.00 59.36 59.67 2kui h GLU 462 Cb 1.59 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.82 2kui h GLU 462 CO -0.00 0.63 -1.04 1.28 0.07 0.00 0.00 179.01 179.95 2kui n LEU 463 N -4.09 0.83 -4.63 3.06 7.99 0.22 -4.92 117.00 115.46 2kui n LEU 463 Ca -0.01 0.32 -0.47 0.00 -0.01 0.00 0.00 56.01 55.84 2kui n LEU 463 Cb 0.43 -0.06 -0.04 0.00 -0.11 0.00 0.00 43.42 43.65 2kui n LEU 463 CO 0.42 -0.18 0.95 0.52 -1.51 0.00 0.00 177.39 177.58 2kui n VAL 464 N -2.67 0.67 0.00 4.08 0.31 -0.72 -1.69 118.33 118.31 2kui n VAL 464 Ca -0.00 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2kui n VAL 464 Cb 0.55 -1.23 0.00 0.00 -0.91 0.00 0.00 33.84 32.25 2kui n VAL 464 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2kui n GLY 465 N 2.36 3.43 3.71 2.92 0.00 0.15 -4.98 105.19 112.78 2kui n GLY 465 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.92 2kui n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kui s LYS 466 N -0.93 2.26 0.36 1.61 3.01 -0.68 -4.92 119.74 120.45 2kui s LYS 466 Ca 0.00 -1.68 -0.26 0.00 -1.01 0.00 0.00 55.97 53.02 2kui s LYS 466 Cb 0.00 -2.06 -0.09 0.00 -1.01 0.00 0.00 37.83 34.67 2kui s LYS 466 CO 0.00 0.06 1.12 0.08 0.51 0.00 0.00 175.35 177.12 2kui s VAL 467 N -2.49 3.40 -0.16 3.17 1.01 0.36 -1.10 120.40 124.58 2kui s VAL 467 Ca 0.38 1.22 0.13 0.00 0.00 0.00 0.00 61.98 63.71 2kui s VAL 467 Cb -0.00 -3.70 -0.24 0.00 0.00 0.00 0.00 36.38 32.44 2kui s VAL 467 CO 0.22 0.15 0.21 -0.38 0.00 0.00 0.00 175.10 175.29 2kui n ILE 468 N 0.38 1.48 -2.68 2.22 2.08 0.84 -4.76 119.36 118.92 2kui n ILE 468 Ca 0.03 -0.80 0.00 0.00 0.56 0.00 0.00 62.75 62.54 2kui n ILE 468 Cb 0.47 -0.80 0.00 0.00 -0.75 0.00 0.00 39.64 38.56 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2kui n GLY 469 N 1.77 -0.24 3.40 7.39 0.00 -1.11 -5.02 105.19 111.38 2kui n GLY 469 Ca -0.30 -1.40 -0.32 0.00 0.00 0.00 0.00 46.02 43.99 2kui n GLY 469 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2kui s THR 470 N -2.87 2.62 0.03 2.61 -1.32 -1.26 -1.03 115.64 114.42 2kui s THR 470 Ca 0.00 -0.89 -0.25 0.00 -1.21 0.00 0.00 61.69 59.34 2kui s THR 470 Cb 0.00 -1.99 -0.18 0.00 -1.51 0.00 0.00 72.50 68.83 2kui s THR 470 CO 0.00 0.58 1.47 -1.13 -2.21 0.00 0.00 174.62 173.33 2kui h ASN 471 N 5.52 -0.09 -3.09 8.08 -0.73 -1.54 -3.40 115.58 120.33 2kui h ASN 471 Ca -0.43 -0.22 -0.53 0.00 1.87 0.00 0.00 56.30 56.99 2kui h ASN 471 Cb 1.15 0.02 0.02 0.00 0.27 0.00 0.00 38.32 39.78 2kui h ASN 471 CO 0.49 0.17 0.68 -2.84 -0.37 0.00 0.00 177.43 175.56 2kui s PRO 472 N -5.17 4.35 0.25 6.67 0.02 -1.26 -4.95 135.00 134.91 2kui s PRO 472 Ca -0.15 2.00 -0.31 0.00 0.02 0.00 0.00 61.00 62.57 2kui s PRO 472 Cb 0.04 -3.26 -0.11 0.00 0.02 0.00 0.00 34.50 31.18 2kui s PRO 472 CO 0.64 -0.37 1.58 -2.14 -0.33 0.00 0.00 177.00 176.38 2kui s PRO 473 N 0.95 4.17 0.00 5.54 0.02 -1.26 -4.85 135.00 139.57 2kui s PRO 473 Ca 0.62 2.49 0.00 0.00 0.02 0.00 0.00 61.00 64.14 2kui s PRO 473 Cb -0.35 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.10 2kui s PRO 473 CO 0.31 -0.60 0.42 0.00 -0.33 0.00 0.00 177.00 176.80 2kui n ALA 474 N 2.77 1.94 0.34 -1.55 0.00 -1.26 -1.24 120.51 121.52 2kui n ALA 474 Ca 0.10 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.60 2kui n ALA 474 Cb 0.38 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 18.75 2kui n ALA 474 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2kui n ASN 475 N -0.17 1.19 -4.97 0.00 4.13 -1.26 -4.49 115.26 109.69 2kui n ASN 475 Ca 0.00 -0.48 -0.23 0.00 1.68 0.00 0.00 54.58 55.55 2kui n ASN 475 Cb 0.06 1.20 0.03 0.00 -1.54 0.00 0.00 39.78 39.53 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2kui s GLN 476 N -2.36 2.27 -0.10 3.52 -1.52 -0.37 -4.92 119.66 116.18 2kui s GLN 476 Ca 0.01 -1.84 -0.03 0.00 -1.95 0.00 0.00 55.36 51.55 2kui s GLN 476 Cb 0.08 -2.38 -0.03 0.00 -0.22 0.00 0.00 33.01 30.46 2kui s GLN 476 CO 0.48 -0.76 0.01 0.95 -0.25 0.00 0.00 175.29 175.72 2kui s THR 477 N -2.73 4.36 0.11 -0.19 -4.23 -1.26 -2.42 115.64 109.28 2kui s THR 477 Ca 0.48 -0.22 0.09 0.00 -1.18 0.00 0.00 61.69 60.86 2kui s THR 477 Cb -0.04 -2.86 -0.04 0.00 1.34 0.00 0.00 72.50 70.90 2kui s THR 477 CO 0.30 0.58 -0.20 -0.94 -0.54 0.00 0.00 174.62 173.82 2kui s SER 478 N -0.62 3.75 0.58 3.99 1.04 0.15 -4.91 113.70 117.67 2kui s SER 478 Ca 0.10 -0.59 -0.12 0.00 0.48 0.00 0.00 55.95 55.82 2kui s SER 478 Cb -0.12 -0.47 -0.05 0.00 0.10 0.00 0.00 66.02 65.48 2kui s SER 478 CO 0.02 0.18 0.99 0.00 0.98 0.00 0.00 173.24 175.42 2kui s ALA 479 N -1.11 3.13 -0.15 5.32 0.00 -1.26 -1.29 121.76 126.40 2kui s ALA 479 Ca 0.17 -0.07 0.29 0.00 0.00 0.00 0.00 51.96 52.36 2kui s ALA 479 Cb -0.10 -3.03 1.22 0.00 0.00 0.00 0.00 23.12 21.20 2kui s ALA 479 CO 0.09 -0.53 1.87 0.82 0.00 0.00 0.00 175.76 178.01 2kui h ILE 480 N 0.06 0.00 -0.17 0.00 1.08 -1.92 -1.41 117.51 115.15 2kui h ILE 480 Ca -0.45 -0.37 0.00 0.00 -0.39 0.00 0.00 64.86 63.65 2kui h ILE 480 Cb 1.19 1.24 0.00 0.00 -3.07 0.00 0.00 36.82 36.18 2kui h ILE 480 CO 0.62 0.00 0.00 0.35 -0.69 0.00 0.00 178.15 178.43 2kui n THR 481 N -2.70 0.20 -3.58 -0.27 -2.24 -1.26 -4.02 114.28 100.42 2kui n THR 481 Ca 0.01 -0.60 -0.37 0.00 -2.27 0.00 0.00 64.05 60.82 2kui n THR 481 Cb 0.26 1.30 -0.06 0.00 -2.10 0.00 0.00 70.33 69.72 2kui n THR 481 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2kui s ASN 482 N -1.79 6.56 -0.33 3.42 2.47 -0.53 -5.06 114.94 119.68 2kui s ASN 482 Ca 0.32 0.66 -0.13 0.00 0.42 0.00 0.00 52.86 54.13 2kui s ASN 482 Cb 0.21 -2.19 -0.02 0.00 -1.45 0.00 0.00 41.25 37.80 2kui s ASN 482 CO 0.31 0.22 0.23 -0.69 -3.72 0.00 0.00 177.10 173.45 2kui s VAL 483 N -0.27 5.29 -0.14 -5.21 1.01 -1.26 -4.54 120.40 115.28 2kui s VAL 483 Ca 0.19 -0.11 -0.08 0.00 0.00 0.00 0.00 61.98 61.97 2kui s VAL 483 Cb -0.14 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 2kui s VAL 483 CO 0.07 0.05 0.15 0.68 0.00 0.00 0.00 175.10 176.05 2kui s VAL 484 N 1.74 5.46 -0.21 2.92 -7.23 -0.52 -4.92 120.40 117.65 2kui s VAL 484 Ca 0.07 0.23 -0.10 0.00 -1.81 0.00 0.00 61.98 60.36 2kui s VAL 484 Cb -0.17 -3.44 -0.05 0.00 0.56 0.00 0.00 36.38 33.28 2kui s VAL 484 CO 0.11 0.56 0.14 -0.51 -0.31 0.00 0.00 175.10 175.09 2kui s ILE 485 N -0.58 5.39 -0.15 -0.62 -1.16 -1.26 -0.80 121.20 122.01 2kui s ILE 485 Ca 0.13 0.19 -0.02 0.00 -0.51 0.00 0.00 60.65 60.44 2kui s ILE 485 Cb -0.12 -3.48 -0.02 0.00 0.61 0.00 0.00 42.46 39.45 2kui s ILE 485 CO 0.02 0.41 -0.09 -0.63 -2.81 0.00 0.00 174.94 171.84 2kui s ILE 486 N 0.59 3.30 -0.17 2.00 1.01 0.76 -1.18 121.20 127.51 2kui s ILE 486 Ca 0.08 -0.56 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 2kui s ILE 486 Cb -0.12 -2.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 2kui s ILE 486 CO 0.00 0.50 -0.06 -0.51 0.00 0.00 0.00 174.94 174.87 2kui s ILE 487 N 0.54 3.55 0.07 2.92 2.07 -0.20 -0.57 121.20 129.59 2kui s ILE 487 Ca -0.06 -0.47 0.03 0.00 -1.41 0.00 0.00 60.65 58.74 2kui s ILE 487 Cb -0.15 -2.56 -0.04 0.00 0.13 0.00 0.00 42.46 39.84 2kui s ILE 487 CO 0.03 0.47 0.07 0.68 -1.91 0.00 0.00 174.94 174.29 2kui s VAL 488 N 0.73 4.52 -0.12 4.00 -7.23 0.75 -0.11 120.40 122.93 2kui s VAL 488 Ca -0.03 -0.74 -0.26 0.00 -1.81 0.00 0.00 61.98 59.15 2kui s VAL 488 Cb -0.15 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.61 2kui s VAL 488 CO 0.02 0.15 0.83 -0.83 -0.31 0.00 0.00 175.10 174.95 2kui s GLY 489 N -2.31 2.33 0.11 2.32 0.00 -0.26 -1.92 107.32 107.58 2kui s GLY 489 Ca 0.28 0.13 0.02 0.00 0.00 0.00 0.00 44.72 45.15 2kui s GLY 489 CO 0.21 1.57 -0.05 -0.45 0.00 0.00 0.00 173.10 174.37 2kui s SER 490 N 1.05 1.10 0.00 1.64 0.15 0.33 -0.67 113.70 117.30 2kui s SER 490 Ca 0.40 -1.03 0.00 0.00 0.70 0.00 0.00 55.95 56.02 2kui s SER 490 Cb -0.17 0.11 0.00 0.00 -1.71 0.00 0.00 66.02 64.24 2kui s SER 490 CO 0.16 -0.49 0.00 0.61 1.20 0.00 0.00 173.24 174.72 2kui n GLY 491 N -0.06 3.24 3.79 9.45 0.00 -1.26 -0.53 105.19 119.82 2kui n GLY 491 Ca -0.11 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.16 2kui n GLY 491 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2kui s PRO 492 N -2.24 2.90 -0.27 1.61 0.02 -1.26 -4.94 135.00 130.81 2kui s PRO 492 Ca 0.00 1.25 -0.09 0.00 0.02 0.00 0.00 61.00 62.19 2kui s PRO 492 Cb 0.00 -1.97 -0.03 0.00 0.02 0.00 0.00 34.50 32.52 2kui s PRO 492 CO 0.00 -1.16 0.12 0.00 -0.33 0.00 0.00 177.00 175.63 2kui s ALA 493 N -2.53 3.27 0.01 -1.55 0.00 -1.26 -4.57 121.76 115.14 2kui s ALA 493 Ca 0.64 -1.18 0.07 0.00 0.00 0.00 0.00 51.96 51.49 2kui s ALA 493 Cb -0.18 -2.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.67 2kui s ALA 493 CO 0.44 -0.60 -0.20 0.95 0.00 0.00 0.00 175.76 176.35 2kui s THR 494 N 1.65 2.65 0.01 0.00 -4.23 -1.26 -0.65 115.64 113.81 2kui s THR 494 Ca 0.06 -1.10 -0.10 0.00 -1.18 0.00 0.00 61.69 59.37 2kui s THR 494 Cb -0.16 -2.06 0.01 0.00 1.34 0.00 0.00 72.50 71.63 2kui s THR 494 CO 0.06 0.43 0.21 -0.54 -0.54 0.00 0.00 174.62 174.24 2kui s LYS 495 N -1.13 0.61 0.03 3.99 -0.14 0.56 -4.92 119.74 118.72 2kui s LYS 495 Ca 0.13 -0.42 -0.22 0.00 -1.36 0.00 0.00 55.97 54.10 2kui s LYS 495 Cb -0.10 0.26 -0.06 0.00 -1.68 0.00 0.00 37.83 36.25 2kui s LYS 495 CO 0.03 -0.17 0.66 0.16 -0.76 0.00 0.00 175.35 175.27 2kui s ASP 496 N -1.62 7.08 -0.14 2.83 -4.77 -1.26 -0.46 116.67 118.33 2kui s ASP 496 Ca -0.11 1.29 -0.29 0.00 -3.30 0.00 0.00 52.55 50.13 2kui s ASP 496 Cb -0.05 -2.41 -0.02 0.00 -1.09 0.00 0.00 42.92 39.36 2kui s ASP 496 CO 0.00 0.09 1.25 0.27 0.70 0.00 0.00 175.17 177.49 2kui s ILE 497 N -0.25 4.27 0.69 2.11 -4.36 -0.40 -4.86 121.20 118.40 2kui s ILE 497 Ca 0.34 1.55 -0.11 0.00 -0.26 0.00 0.00 60.65 62.17 2kui s ILE 497 Cb -0.19 -4.00 0.00 0.00 1.25 0.00 0.00 42.46 39.52 2kui s ILE 497 CO 0.20 -0.11 1.06 -2.16 0.24 0.00 0.00 174.94 174.16 2kui s PRO 498 N 3.26 2.98 -0.99 0.37 0.04 -1.26 0.21 135.00 139.61 2kui s PRO 498 Ca 0.55 0.95 -0.23 0.00 0.04 0.00 0.00 61.00 62.30 2kui s PRO 498 Cb -0.22 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.35 2kui s PRO 498 CO 0.16 -1.06 1.55 0.34 0.04 0.00 0.00 177.00 178.03 2kui s ASP 499 N -3.80 6.21 0.00 6.66 -1.08 -1.26 -4.73 116.67 118.67 2kui s ASP 499 Ca 0.58 -1.26 0.21 0.00 -0.52 0.00 0.00 52.55 51.56 2kui s ASP 499 Cb -0.14 -2.57 0.53 0.00 -1.46 0.00 0.00 42.92 39.29 2kui s ASP 499 CO 0.55 -1.77 1.45 0.55 0.52 0.00 0.00 175.17 176.46 2kui n VAL 500 N 7.08 0.62 -2.40 1.11 3.14 -1.26 -4.77 118.33 121.86 2kui n VAL 500 Ca 0.34 -0.73 -0.40 0.00 -2.96 0.00 0.00 64.34 60.59 2kui n VAL 500 Cb 0.50 0.60 -0.01 0.00 -1.06 0.00 0.00 33.84 33.87 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui n ALA 501 N 1.23 3.40 -1.72 1.55 0.00 -1.26 -3.72 120.51 120.00 2kui n ALA 501 Ca 0.20 -3.70 -0.01 0.00 0.00 0.00 0.00 53.44 49.93 2kui n ALA 501 Cb 0.52 -3.58 -0.00 0.00 0.00 0.00 0.00 19.45 16.39 2kui n ALA 501 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 502 N 5.35 -0.46 2.75 0.00 0.00 -1.19 -4.86 105.19 106.78 2kui n GLY 502 Ca 0.49 -0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.43 2kui n GLY 502 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2kui n GLN 503 N -0.03 0.78 -3.17 1.61 10.64 -1.24 -5.02 117.38 120.95 2kui n GLN 503 Ca -0.02 -1.76 -0.27 0.00 -1.83 0.00 0.00 57.00 53.11 2kui n GLN 503 Cb 0.33 2.07 -0.02 0.00 -0.86 0.00 0.00 30.24 31.76 2kui n GLN 503 CO 0.00 0.00 0.00 -0.08 -1.83 0.00 0.00 177.06 175.15 2kui s THR 504 N -2.42 5.00 0.28 -0.39 -1.32 -1.26 -0.54 115.64 114.99 2kui s THR 504 Ca 0.14 0.02 0.01 0.00 -1.21 0.00 0.00 61.69 60.66 2kui s THR 504 Cb -0.03 -3.79 0.28 0.00 -1.51 0.00 0.00 72.50 67.45 2kui s THR 504 CO 0.10 -0.49 1.82 1.62 -2.21 0.00 0.00 174.62 175.47 2kui h VAL 505 N 0.99 0.89 -0.63 5.08 3.04 -0.50 0.24 116.25 125.36 2kui h VAL 505 Ca -0.48 -0.32 -0.00 0.00 -1.01 0.00 0.00 66.70 64.88 2kui h VAL 505 Cb 1.20 -0.14 -0.03 0.00 -2.01 0.00 0.00 31.29 30.31 2kui h VAL 505 CO 0.64 0.17 0.38 -0.78 -1.01 0.00 0.00 177.57 176.97 2kui h ASP 506 N 0.94 0.76 0.28 3.17 1.82 -1.93 0.08 116.42 121.54 2kui h ASP 506 Ca 0.50 -0.06 -0.25 0.00 -0.39 0.00 0.00 57.03 56.83 2kui h ASP 506 Cb 0.54 -0.19 0.01 0.00 0.68 0.00 0.00 39.33 40.36 2kui h ASP 506 CO -0.28 0.60 -1.05 0.58 -1.61 0.00 0.00 179.24 177.47 2kui h VAL 507 N 0.86 1.37 -0.09 2.25 2.07 -1.62 -2.69 116.25 118.39 2kui h VAL 507 Ca 0.23 -2.49 -0.00 0.00 0.82 0.00 0.00 66.70 65.25 2kui h VAL 507 Cb -0.02 2.53 -0.00 0.00 -1.52 0.00 0.00 31.29 32.27 2kui h VAL 507 CO -0.04 0.75 0.04 0.00 0.02 0.00 0.00 177.57 178.34 2kui h ALA 508 N 0.58 0.12 -0.39 1.67 0.00 -0.31 0.73 119.26 121.67 2kui h ALA 508 Ca -0.12 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 2kui h ALA 508 Cb 1.71 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.45 2kui h ALA 508 CO 0.19 -0.30 -0.05 -0.56 0.00 0.00 0.00 179.25 178.53 2kui h GLN 509 N 0.01 0.64 -0.35 0.00 3.07 -1.05 0.51 115.11 117.94 2kui h GLN 509 Ca 0.03 -0.17 -0.03 0.00 0.09 0.00 0.00 58.65 58.57 2kui h GLN 509 Cb 0.15 -0.07 -0.01 0.00 0.08 0.00 0.00 27.48 27.62 2kui h GLN 509 CO -0.00 0.69 0.10 -0.22 0.09 0.00 0.00 178.83 179.49 2kui h LYS 510 N 0.60 0.54 -0.63 0.06 1.63 -1.16 -0.59 116.57 117.02 2kui h LYS 510 Ca 0.12 -0.12 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 2kui h LYS 510 Cb 0.45 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.98 2kui h LYS 510 CO 0.02 0.57 0.31 -0.91 -3.45 0.00 0.00 179.45 176.00 2kui h ASN 511 N 0.41 0.82 -0.71 4.20 2.35 -0.35 -1.61 115.58 120.69 2kui h ASN 511 Ca 0.11 -0.13 0.01 0.00 -0.55 0.00 0.00 56.30 55.74 2kui h ASN 511 Cb 0.26 -0.21 -0.04 0.00 0.05 0.00 0.00 38.32 38.39 2kui h ASN 511 CO -0.00 0.72 0.47 -0.07 -1.65 0.00 0.00 177.43 176.90 2kui h LEU 512 N 0.87 0.82 -1.06 1.61 3.38 -0.61 -1.14 115.31 119.18 2kui h LEU 512 Ca 0.22 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 2kui h LEU 512 Cb 0.11 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2kui h LEU 512 CO -0.03 0.59 0.31 0.78 0.09 0.00 0.00 178.44 180.18 2kui h ASN 513 N 0.96 0.88 -0.47 -0.43 -0.26 -0.73 0.11 115.58 115.65 2kui h ASN 513 Ca 0.26 -0.10 -0.02 0.00 -0.56 0.00 0.00 56.30 55.88 2kui h ASN 513 Cb -0.11 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 36.90 2kui h ASN 513 CO -0.06 0.76 0.23 0.58 -1.06 0.00 0.00 177.43 177.88 2kui h VAL 514 N 0.97 1.18 0.00 2.81 2.07 -0.30 -1.89 116.25 121.09 2kui h VAL 514 Ca 0.23 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2kui h VAL 514 Cb 0.13 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2kui h VAL 514 CO -0.03 0.21 0.00 1.88 0.02 0.00 0.00 177.57 179.65 2kui h TYR 515 N 0.71 0.00 0.00 1.57 0.05 -0.19 -3.46 116.97 115.65 2kui h TYR 515 Ca 0.18 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.96 2kui h TYR 515 Cb 0.10 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.84 2kui h TYR 515 CO 0.01 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.53 2kui n GLY 516 N 0.92 1.19 3.67 3.88 0.00 -0.70 -5.02 105.19 109.13 2kui n GLY 516 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.00 2.40 -0.17 1.61 0.08 -0.08 -4.60 117.98 115.23 2kui s PHE 517 Ca 0.00 0.50 -0.03 0.00 0.12 0.00 0.00 56.93 57.52 2kui s PHE 517 Cb 0.00 -3.80 -0.23 0.00 -0.57 0.00 0.00 43.02 38.42 2kui s PHE 517 CO 0.00 -3.17 0.17 0.25 -0.10 0.00 0.00 175.22 172.37 2kui n THR 518 N 5.13 1.68 -3.76 0.64 -2.24 -0.57 -3.75 114.28 111.40 2kui n THR 518 Ca 0.15 -0.63 -0.37 0.00 -2.27 0.00 0.00 64.05 60.93 2kui n THR 518 Cb 0.43 -1.60 -0.13 0.00 -2.10 0.00 0.00 70.33 66.93 2kui n THR 518 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2kui s LYS 519 N -2.55 3.10 0.08 -0.78 1.02 -1.24 -5.05 119.74 114.33 2kui s LYS 519 Ca -0.26 -0.85 0.05 0.00 0.02 0.00 0.00 55.97 54.93 2kui s LYS 519 Cb 0.07 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.99 2kui s LYS 519 CO 0.71 -0.44 -0.14 -0.59 -0.92 0.00 0.00 175.35 173.98 2kui s PHE 520 N 1.50 1.23 0.02 3.18 -0.12 -1.26 -0.50 117.98 122.04 2kui s PHE 520 Ca 0.03 -0.50 0.07 0.00 -0.05 0.00 0.00 56.93 56.47 2kui s PHE 520 Cb -0.17 -0.68 -0.02 0.00 -0.63 0.00 0.00 43.02 41.52 2kui s PHE 520 CO 0.02 0.07 -0.20 -1.12 -0.05 0.00 0.00 175.22 173.94 2kui s SER 521 N -1.97 2.34 -0.19 1.98 0.01 0.94 -4.88 113.70 111.93 2kui s SER 521 Ca 0.01 -0.45 -0.00 0.00 1.31 0.00 0.00 55.95 56.82 2kui s SER 521 Cb -0.08 -0.22 0.01 0.00 0.21 0.00 0.00 66.02 65.95 2kui s SER 521 CO 0.02 0.18 -0.16 0.00 0.41 0.00 0.00 173.24 173.70 2kui s GLN 522 N -0.89 3.07 -0.09 12.44 -2.07 -1.26 -0.07 119.66 130.78 2kui s GLN 522 Ca 0.07 -0.79 0.01 0.00 -1.82 0.00 0.00 55.36 52.83 2kui s GLN 522 Cb -0.08 -2.69 0.02 0.00 -1.09 0.00 0.00 33.01 29.16 2kui s GLN 522 CO 0.01 -0.22 -0.13 0.00 -1.32 0.00 0.00 175.29 173.63 2kui s ALA 523 N 1.33 1.46 -0.12 2.60 0.00 -0.14 -4.98 121.76 121.91 2kui s ALA 523 Ca 0.05 -0.58 -0.06 0.00 0.00 0.00 0.00 51.96 51.37 2kui s ALA 523 Cb -0.14 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 2kui s ALA 523 CO -0.10 -0.08 0.11 -1.12 0.00 0.00 0.00 175.76 174.56 2kui s SER 524 N 1.02 6.09 0.10 0.00 0.01 -1.26 -0.01 113.70 119.66 2kui s SER 524 Ca -0.07 0.36 0.09 0.00 1.31 0.00 0.00 55.95 57.64 2kui s SER 524 Cb -0.15 -1.94 -0.04 0.00 0.21 0.00 0.00 66.02 64.10 2kui s SER 524 CO -0.01 0.37 -0.22 0.68 0.41 0.00 0.00 173.24 174.46 2kui s VAL 525 N -0.79 1.85 0.23 3.43 -7.23 -0.11 -4.84 120.40 112.94 2kui s VAL 525 Ca 0.13 -1.56 -0.30 0.00 -1.81 0.00 0.00 61.98 58.45 2kui s VAL 525 Cb -0.12 -1.66 -0.09 0.00 0.56 0.00 0.00 36.38 35.07 2kui s VAL 525 CO 0.03 0.01 1.29 1.51 -0.31 0.00 0.00 175.10 177.63 2kui s ASP 526 N -1.86 6.91 0.19 4.85 -4.77 -1.26 -0.15 116.67 120.58 2kui s ASP 526 Ca 0.08 2.44 -0.23 0.00 -3.30 0.00 0.00 52.55 51.54 2kui s ASP 526 Cb -0.10 -2.62 0.05 0.00 -1.09 0.00 0.00 42.92 39.16 2kui s ASP 526 CO 0.04 -0.49 0.80 -0.94 0.70 0.00 0.00 175.17 175.29 2kui s SER 527 N 0.06 -0.29 0.00 2.11 1.04 -0.51 -4.85 113.70 111.26 2kui s SER 527 Ca 0.54 -0.39 0.10 0.00 0.48 0.00 0.00 55.95 56.67 2kui s SER 527 Cb -0.37 0.59 0.57 0.00 0.10 0.00 0.00 66.02 66.92 2kui s SER 527 CO 0.41 -1.07 1.26 -2.65 0.98 0.00 0.00 173.24 172.18 2kui n PRO 528 N -0.43 0.87 -3.69 4.02 -0.02 -1.26 -4.37 135.00 130.12 2kui n PRO 528 Ca -0.07 0.00 -0.37 0.00 -2.02 0.00 0.00 63.50 61.04 2kui n PRO 528 Cb 0.61 -1.17 -0.06 0.00 -0.02 0.00 0.00 33.50 32.86 2kui n PRO 528 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2kui s ARG 529 N -2.00 3.68 0.89 -0.52 3.00 -1.26 -5.03 118.95 117.71 2kui s ARG 529 Ca 0.14 0.14 -0.11 0.00 0.00 0.00 0.00 55.73 55.90 2kui s ARG 529 Cb 0.07 -3.19 0.13 0.00 0.00 0.00 0.00 34.95 31.96 2kui s ARG 529 CO 0.11 0.72 1.11 -1.25 0.00 0.00 0.00 175.30 176.00 2kui s PRO 530 N -1.14 1.25 -0.03 3.54 0.04 -1.26 -3.08 135.00 134.32 2kui s PRO 530 Ca 0.21 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 2kui s PRO 530 Cb -0.14 -1.77 -0.06 0.00 0.04 0.00 0.00 34.50 32.56 2kui s PRO 530 CO 0.10 -2.39 1.67 0.00 0.04 0.00 0.00 177.00 176.42 2kui s ALA 531 N -2.74 3.62 0.00 8.56 0.00 -1.23 -2.21 121.76 127.75 2kui s ALA 531 Ca 0.65 0.99 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2kui s ALA 531 Cb -0.21 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.17 2kui s ALA 531 CO 0.58 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 175.39 2kui n GLY 532 N 4.12 0.97 3.69 0.00 0.00 -1.11 -4.93 105.19 107.93 2kui n GLY 532 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2kui n GLY 532 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2kui s GLU 533 N 0.00 4.27 -0.44 1.61 2.56 -0.94 0.28 118.70 126.04 2kui s GLU 533 Ca 0.00 2.03 -0.28 0.00 0.00 0.00 0.00 54.97 56.72 2kui s GLU 533 Cb 0.00 -3.55 0.03 0.00 2.00 0.00 0.00 34.13 32.61 2kui s GLU 533 CO 0.00 -0.59 1.06 0.08 -0.56 0.00 0.00 175.26 175.26 2kui s VAL 534 N 2.31 4.35 -0.46 3.70 1.01 0.29 0.23 120.40 131.84 2kui s VAL 534 Ca 0.65 1.21 0.23 0.00 0.00 0.00 0.00 61.98 64.07 2kui s VAL 534 Cb -0.33 -4.51 -0.15 0.00 0.00 0.00 0.00 36.38 31.39 2kui s VAL 534 CO 0.28 -0.84 0.91 1.07 0.00 0.00 0.00 175.10 176.52 2kui n THR 535 N 6.50 0.19 -1.59 3.92 5.66 -0.41 -3.16 114.28 125.40 2kui n THR 535 Ca 0.10 -0.33 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 2kui n THR 535 Cb 0.48 0.13 0.00 0.00 -1.55 0.00 0.00 70.33 69.40 2kui n THR 535 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2kui n GLY 536 N 1.33 -1.43 3.27 1.09 0.00 -0.87 -4.88 105.19 103.69 2kui n GLY 536 Ca 0.01 -1.01 -0.17 0.00 0.00 0.00 0.00 46.02 44.85 2kui n GLY 536 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 537 N -2.49 1.38 -0.06 2.61 -4.23 -1.26 -0.04 115.64 111.56 2kui s THR 537 Ca 0.00 -1.91 -0.23 0.00 -1.18 0.00 0.00 61.69 58.37 2kui s THR 537 Cb 0.00 -1.73 -0.17 0.00 1.34 0.00 0.00 72.50 71.94 2kui s THR 537 CO 0.00 -0.54 0.93 -1.13 -0.54 0.00 0.00 174.62 173.34 2kui h ASN 538 N 3.12 -0.13 -3.58 3.99 -0.73 -1.13 -3.43 115.58 113.69 2kui h ASN 538 Ca -0.39 -0.44 -0.52 0.00 1.87 0.00 0.00 56.30 56.83 2kui h ASN 538 Cb 1.20 0.03 0.02 0.00 0.27 0.00 0.00 38.32 39.84 2kui h ASN 538 CO 0.56 0.46 0.54 -2.84 -0.37 0.00 0.00 177.43 175.78 2kui s PRO 539 N -3.44 4.52 0.37 6.67 0.02 -1.26 -4.97 135.00 136.91 2kui s PRO 539 Ca -0.14 1.87 -0.28 0.00 0.02 0.00 0.00 61.00 62.47 2kui s PRO 539 Cb 0.00 -3.22 -0.11 0.00 0.02 0.00 0.00 34.50 31.19 2kui s PRO 539 CO 0.53 -0.02 1.47 -2.30 -0.33 0.00 0.00 177.00 176.35 2kui n PRO 540 N 2.11 2.64 -2.16 5.54 -0.02 -1.26 -4.94 135.00 136.91 2kui n PRO 540 Ca 0.03 0.92 -0.40 0.00 -2.02 0.00 0.00 63.50 62.03 2kui n PRO 540 Cb 0.45 -2.64 -0.02 0.00 -0.02 0.00 0.00 33.50 31.26 2kui n PRO 540 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui s ALA 541 N -1.10 3.37 0.00 3.55 0.00 -1.26 -2.46 121.76 123.86 2kui s ALA 541 Ca 0.53 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.67 2kui s ALA 541 Cb -0.48 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.19 2kui s ALA 541 CO 0.64 -0.63 0.00 0.41 0.00 0.00 0.00 175.76 176.18 2kui n GLY 542 N 0.77 0.89 3.70 0.00 0.00 0.13 -4.94 105.19 105.74 2kui n GLY 542 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 2kui n GLY 542 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 543 N -2.20 3.88 -0.18 2.61 2.01 -1.03 -4.66 115.64 116.07 2kui s THR 543 Ca 0.00 1.29 -0.26 0.00 0.31 0.00 0.00 61.69 63.03 2kui s THR 543 Cb 0.00 -3.83 -0.01 0.00 0.01 0.00 0.00 72.50 68.67 2kui s THR 543 CO 0.00 0.04 0.86 0.28 -0.69 0.00 0.00 174.62 175.11 2kui s THR 544 N 1.87 4.85 0.06 -0.82 -1.32 -1.26 -1.27 115.64 117.75 2kui s THR 544 Ca 0.61 1.69 0.00 0.00 -1.21 0.00 0.00 61.69 62.78 2kui s THR 544 Cb -0.30 -4.16 -0.04 0.00 -1.51 0.00 0.00 72.50 66.49 2kui s THR 544 CO 0.26 -0.00 -0.05 0.68 -2.21 0.00 0.00 174.62 173.31 2kui s VAL 545 N 2.28 0.39 0.60 5.08 -7.23 0.39 -4.92 120.40 117.00 2kui s VAL 545 Ca 0.39 -1.64 -0.18 0.00 -1.81 0.00 0.00 61.98 58.74 2kui s VAL 545 Cb -0.16 -1.29 -0.03 0.00 0.56 0.00 0.00 36.38 35.45 2kui s VAL 545 CO 0.12 -0.82 1.19 -2.16 -0.31 0.00 0.00 175.10 173.12 2kui s PRO 546 N -3.28 2.97 0.67 4.82 0.04 -1.26 -0.33 135.00 138.62 2kui s PRO 546 Ca 0.03 1.77 0.44 0.00 0.04 0.00 0.00 61.00 63.29 2kui s PRO 546 Cb 0.03 -1.93 2.42 0.00 0.04 0.00 0.00 34.50 35.05 2kui s PRO 546 CO -0.06 -1.20 2.37 -0.39 0.04 0.00 0.00 177.00 177.77 2kui h VAL 547 N 0.82 0.02 -0.29 -0.36 -1.51 -1.19 -0.67 116.25 113.07 2kui h VAL 547 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 2kui h VAL 547 Cb 1.29 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 2kui h VAL 547 CO 0.55 0.00 0.00 -0.67 -1.23 0.00 0.00 177.57 176.22 2kui n ASP 548 N -3.11 2.63 -4.54 4.19 2.03 -1.26 -1.51 116.55 114.98 2kui n ASP 548 Ca -0.03 -1.88 -0.29 0.00 0.52 0.00 0.00 54.79 53.12 2kui n ASP 548 Cb 0.07 -0.19 0.18 0.00 -0.72 0.00 0.00 41.12 40.46 2kui n ASP 548 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 2kui s SER 549 N -1.51 2.54 -0.37 1.67 0.15 -0.26 -4.57 113.70 111.35 2kui s SER 549 Ca 0.35 0.98 -0.13 0.00 0.70 0.00 0.00 55.95 57.85 2kui s SER 549 Cb 0.20 -1.53 0.00 0.00 -1.71 0.00 0.00 66.02 62.99 2kui s SER 549 CO 0.29 -3.16 0.25 -0.69 1.20 0.00 0.00 173.24 171.12 2kui s VAL 550 N -3.09 5.10 -0.26 4.45 1.01 -1.26 -3.59 120.40 122.76 2kui s VAL 550 Ca 0.66 -0.48 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 2kui s VAL 550 Cb -0.16 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2kui s VAL 550 CO 0.56 -0.14 0.16 -0.63 0.00 0.00 0.00 175.10 175.05 2kui s ILE 551 N 1.67 5.14 -0.31 2.22 1.09 0.35 -4.96 121.20 126.41 2kui s ILE 551 Ca 0.05 0.11 -0.11 0.00 -1.10 0.00 0.00 60.65 59.60 2kui s ILE 551 Cb -0.18 -3.42 -0.02 0.00 -1.06 0.00 0.00 42.46 37.78 2kui s ILE 551 CO 0.09 0.30 0.18 -0.70 -0.10 0.00 0.00 174.94 174.71 2kui s GLU 552 N 1.48 3.48 -0.13 2.79 2.12 -1.26 -0.04 118.70 127.13 2kui s GLU 552 Ca 0.07 -0.63 -0.12 0.00 0.36 0.00 0.00 54.97 54.65 2kui s GLU 552 Cb -0.15 -3.63 -0.05 0.00 0.26 0.00 0.00 34.13 30.56 2kui s GLU 552 CO 0.08 -0.38 0.25 -0.51 -0.54 0.00 0.00 175.26 174.16 2kui s LEU 553 N 1.66 4.31 -0.31 2.70 1.02 0.89 -0.48 118.68 128.47 2kui s LEU 553 Ca 0.05 0.53 -0.09 0.00 0.02 0.00 0.00 54.13 54.64 2kui s LEU 553 Cb -0.17 -2.29 0.00 0.00 0.02 0.00 0.00 46.19 43.75 2kui s LEU 553 CO 0.08 0.22 0.14 -1.10 0.02 0.00 0.00 176.35 175.72 2kui s GLN 554 N -0.17 3.22 0.02 1.70 -0.21 0.95 -0.96 119.66 124.21 2kui s GLN 554 Ca 0.16 -0.79 -0.01 0.00 0.02 0.00 0.00 55.36 54.74 2kui s GLN 554 Cb -0.13 -3.54 -0.04 0.00 1.00 0.00 0.00 33.01 30.30 2kui s GLN 554 CO 0.05 -0.45 0.15 0.08 -2.12 0.00 0.00 175.29 172.99 2kui s VAL 555 N 1.58 5.12 0.06 1.09 1.01 0.99 -1.29 120.40 128.96 2kui s VAL 555 Ca 0.04 -0.37 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 2kui s VAL 555 Cb -0.17 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 2kui s VAL 555 CO 0.05 0.25 1.11 -0.44 0.00 0.00 0.00 175.10 176.07 2kui s SER 556 N -2.11 7.21 -0.20 3.32 0.01 0.14 -0.94 113.70 121.12 2kui s SER 556 Ca 0.29 1.90 -0.19 0.00 1.31 0.00 0.00 55.95 59.26 2kui s SER 556 Cb -0.13 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.50 2kui s SER 556 CO 0.21 -0.36 0.56 -0.75 0.41 0.00 0.00 173.24 173.30 2kui s LYS 557 N 0.84 4.19 0.14 12.44 2.47 0.79 -2.77 119.74 137.84 2kui s LYS 557 Ca 0.55 0.48 -0.13 0.00 -1.56 0.00 0.00 55.97 55.31 2kui s LYS 557 Cb -0.26 -3.57 -0.00 0.00 -1.46 0.00 0.00 37.83 32.53 2kui s LYS 557 CO 0.29 -0.19 1.57 0.78 0.16 0.00 0.00 175.35 177.97 2kui h GLY 558 N 8.07 0.89 -0.89 5.54 0.00 -1.74 -1.36 103.07 113.58 2kui h GLY 558 Ca -0.33 -0.69 -0.31 0.00 0.00 0.00 0.00 47.33 46.01 2kui h GLY 558 CO 0.75 0.63 -0.29 -2.01 0.00 0.00 0.00 176.54 175.62 2kui n ASN 559 N -4.34 -4.80 -4.15 0.19 5.15 -1.26 -4.60 115.26 101.45 2kui n ASN 559 Ca -0.00 0.33 -0.12 0.00 -0.60 0.00 0.00 54.58 54.18 2kui n ASN 559 Cb 0.33 -3.67 -0.11 0.00 -0.53 0.00 0.00 39.78 35.81 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 2kui s GLN 560 N -3.45 0.78 0.10 1.20 -0.21 -1.26 -0.40 119.66 116.41 2kui s GLN 560 Ca 0.00 -1.15 0.03 0.00 0.02 0.00 0.00 55.36 54.26 2kui s GLN 560 Cb 0.00 -0.35 -0.04 0.00 1.00 0.00 0.00 33.01 33.63 2kui s GLN 560 CO 0.00 0.03 -0.09 -0.59 -2.12 0.00 0.00 175.29 172.52 2kui s PHE 561 N -2.72 1.05 -0.04 0.91 -0.71 0.19 -4.83 117.98 111.82 2kui s PHE 561 Ca 0.05 -0.71 -0.30 0.00 -1.04 0.00 0.00 56.93 54.93 2kui s PHE 561 Cb -0.01 -0.57 -0.04 0.00 -1.21 0.00 0.00 43.02 41.19 2kui s PHE 561 CO -0.02 -0.02 1.30 0.08 -1.34 0.00 0.00 175.22 175.23 2kui s VAL 562 N -2.76 4.01 -0.10 -2.49 1.01 -1.26 -0.25 120.40 118.57 2kui s VAL 562 Ca 0.08 1.35 -0.11 0.00 0.00 0.00 0.00 61.98 63.30 2kui s VAL 562 Cb -0.01 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 2kui s VAL 562 CO -0.01 -0.02 0.25 -0.32 0.00 0.00 0.00 175.10 175.00 2kui s MET 563 N 2.49 3.78 1.13 2.72 1.75 -0.87 -4.93 119.30 125.37 2kui s MET 563 Ca 0.60 0.07 -0.14 0.00 -1.25 0.00 0.00 55.69 54.97 2kui s MET 563 Cb -0.27 -3.26 0.26 0.00 2.84 0.00 0.00 34.83 34.40 2kui s MET 563 CO 0.23 0.62 1.05 -2.14 -0.65 0.00 0.00 175.02 174.14 2kui s PRO 564 N -0.68 -0.60 0.07 4.11 0.02 -1.26 -1.06 135.00 135.60 2kui s PRO 564 Ca 0.17 0.56 -0.28 0.00 0.02 0.00 0.00 61.00 61.48 2kui s PRO 564 Cb -0.14 -1.61 -0.05 0.00 0.02 0.00 0.00 34.50 32.72 2kui s PRO 564 CO 0.06 -3.44 0.87 -0.51 -0.33 0.00 0.00 177.00 173.66 2kui s ASP 565 N -3.05 7.36 0.00 2.53 1.11 -1.26 -4.53 116.67 118.84 2kui s ASP 565 Ca 0.67 1.63 0.00 0.00 0.18 0.00 0.00 52.55 55.03 2kui s ASP 565 Cb -0.21 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.25 2kui s ASP 565 CO 0.61 -0.04 0.00 0.18 1.18 0.00 0.00 175.17 177.09 2kui n LEU 566 N 2.88 0.00 -4.76 1.23 7.99 -1.26 -5.04 117.00 118.04 2kui n LEU 566 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 56.01 55.60 2kui n LEU 566 Cb 0.50 0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.77 2kui n LEU 566 CO 0.49 0.00 0.87 -0.94 -1.51 0.00 0.00 177.39 176.30 2kui s SER 567 N -2.57 7.08 -0.03 -1.43 1.04 -1.26 -3.52 113.70 113.02 2kui s SER 567 Ca 0.00 2.40 -0.00 0.00 0.48 0.00 0.00 55.95 58.83 2kui s SER 567 Cb 0.00 -2.63 0.00 0.00 0.10 0.00 0.00 66.02 63.49 2kui s SER 567 CO 0.00 -0.30 0.02 0.61 0.98 0.00 0.00 173.24 174.55 2kui n GLY 568 N 1.23 0.89 3.36 7.32 0.00 -1.26 -5.04 105.19 111.69 2kui n GLY 568 Ca 0.00 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.24 2kui n GLY 568 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 569 N -4.96 1.36 0.12 1.61 1.00 -1.23 -5.04 119.30 112.16 2kui s MET 569 Ca 0.01 -1.49 -0.05 0.00 0.00 0.00 0.00 55.69 54.15 2kui s MET 569 Cb -0.01 0.35 -0.06 0.00 0.00 0.00 0.00 34.83 35.12 2kui s MET 569 CO 0.01 -0.50 0.37 -0.06 0.00 0.00 0.00 175.02 174.84 2kui s PHE 570 N -4.07 3.50 0.50 -0.03 0.08 -1.26 -1.32 117.98 115.37 2kui s PHE 570 Ca 0.33 0.58 0.20 0.00 0.12 0.00 0.00 56.93 58.16 2kui s PHE 570 Cb 0.04 -2.02 1.32 0.00 -0.57 0.00 0.00 43.02 41.79 2kui s PHE 570 CO 0.11 0.46 2.11 2.35 -0.10 0.00 0.00 175.22 180.15 2kui h TRP 571 N 3.02 0.00 0.00 0.36 2.91 -0.54 0.90 115.95 122.60 2kui h TRP 571 Ca -0.47 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.54 2kui h TRP 571 Cb 1.17 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.82 2kui h TRP 571 CO 0.62 0.07 -0.06 -0.24 -1.03 0.00 0.00 178.44 177.81 2kui h VAL 572 N 0.00 0.15 0.00 2.65 3.04 -1.94 -2.63 116.25 117.52 2kui h VAL 572 Ca -0.00 -0.72 -0.35 0.00 -1.01 0.00 0.00 66.70 64.62 2kui h VAL 572 Cb 0.14 1.63 -0.07 0.00 -2.01 0.00 0.00 31.29 30.99 2kui h VAL 572 CO 0.01 0.06 -2.31 -0.67 -1.01 0.00 0.00 177.57 173.64 2kui n ASP 573 N -3.17 0.45 -0.14 3.17 -0.08 -0.26 -4.50 116.55 112.01 2kui n ASP 573 Ca 0.01 -0.01 -0.07 0.00 -1.51 0.00 0.00 54.79 53.21 2kui n ASP 573 Cb 0.36 0.86 0.02 0.00 2.34 0.00 0.00 41.12 44.70 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2kui h ALA 574 N 0.86 0.56 0.74 -1.67 0.00 -0.66 -1.68 119.26 117.41 2kui h ALA 574 Ca -0.52 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.34 2kui h ALA 574 Cb 2.15 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2kui h ALA 574 CO 0.02 -0.05 -0.38 0.93 0.00 0.00 0.00 179.25 179.77 2kui h GLU 575 N 0.53 -0.99 -0.58 0.00 5.08 -1.70 -0.88 114.58 116.04 2kui h GLU 575 Ca 0.17 0.07 0.05 0.00 -1.00 0.00 0.00 59.36 58.65 2kui h GLU 575 Cb 0.00 0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.44 2kui h GLU 575 CO -0.07 -0.66 0.39 -1.00 -1.00 0.00 0.00 179.01 176.66 2kui h PRO 576 N -1.02 0.57 -0.22 2.33 0.13 -1.78 -1.03 132.00 130.98 2kui h PRO 576 Ca -0.10 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 65.01 2kui h PRO 576 Cb 0.80 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.78 2kui h PRO 576 CO 0.15 0.38 0.12 -0.09 -0.23 0.00 0.00 178.00 178.32 2kui h ARG 577 N 0.59 0.24 -0.41 0.86 9.65 -1.09 0.11 114.38 124.32 2kui h ARG 577 Ca 0.25 -0.01 -0.12 0.00 -1.10 0.00 0.00 59.98 58.99 2kui h ARG 577 Cb 0.23 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.74 2kui h ARG 577 CO -0.07 0.16 -0.23 1.37 2.80 0.00 0.00 179.97 183.99 2kui h LEU 578 N 0.25 0.86 -0.17 3.80 8.10 -0.34 -1.45 115.31 126.36 2kui h LEU 578 Ca 0.09 -0.32 -0.02 0.00 0.11 0.00 0.00 57.88 57.74 2kui h LEU 578 Cb 0.01 -0.24 -0.01 0.00 -0.44 0.00 0.00 40.66 39.99 2kui h LEU 578 CO -0.05 1.06 0.03 0.03 -4.11 0.00 0.00 178.44 175.39 2kui h ARG 579 N 0.73 0.28 0.00 0.17 2.47 -0.99 -1.41 114.38 115.63 2kui h ARG 579 Ca 0.10 -0.07 0.00 0.00 -1.26 0.00 0.00 59.98 58.74 2kui h ARG 579 Cb 0.77 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.06 2kui h ARG 579 CO 0.06 0.44 0.00 0.00 0.56 0.00 0.00 179.97 181.04 2kui h ALA 580 N 0.82 1.00 -0.00 0.04 0.00 -0.73 -1.46 119.26 118.94 2kui h ALA 580 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2kui h ALA 580 Cb 0.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 2kui h ALA 580 CO 0.00 0.00 -0.27 -0.11 0.00 0.00 0.00 179.25 178.88 2kui n LEU 581 N -2.64 0.34 -1.35 0.00 7.94 -0.55 -4.93 117.00 115.81 2kui n LEU 581 Ca 0.02 0.16 -0.07 0.00 -1.11 0.00 0.00 56.01 55.01 2kui n LEU 581 Cb 0.28 -0.32 0.02 0.00 0.53 0.00 0.00 43.42 43.93 2kui n LEU 581 CO 0.24 0.08 0.06 0.61 -1.11 0.00 0.00 177.39 177.26 2kui n GLY 582 N 1.46 0.44 3.74 -3.96 0.00 -0.55 -5.01 105.19 101.33 2kui n GLY 582 Ca 0.07 -0.42 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 2kui n GLY 582 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2kui s TRP 583 N -2.99 3.77 -0.24 1.61 -0.00 -0.55 -5.02 118.94 115.52 2kui s TRP 583 Ca 0.16 1.58 -0.03 0.00 -0.00 0.00 0.00 56.10 57.81 2kui s TRP 583 Cb -0.07 -2.88 0.11 0.00 -0.00 0.00 0.00 33.47 30.63 2kui s TRP 583 CO 0.19 0.28 0.25 -0.08 -0.00 0.00 0.00 176.95 177.59 2kui s THR 584 N -0.14 -0.35 0.00 5.86 -1.32 -1.26 -4.81 115.64 113.61 2kui s THR 584 Ca 0.41 -0.27 0.00 0.00 -1.21 0.00 0.00 61.69 60.62 2kui s THR 584 Cb -0.22 -0.80 0.00 0.00 -1.51 0.00 0.00 72.50 69.97 2kui s THR 584 CO 0.25 -0.31 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 2kui n GLY 585 N 5.32 3.30 3.48 6.08 0.00 -1.26 -4.76 105.19 117.33 2kui n GLY 585 Ca -0.04 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.00 2kui n GLY 585 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 586 N 1.53 3.68 -0.14 1.61 -1.94 -1.26 -5.07 119.30 117.71 2kui s MET 586 Ca 0.00 -0.49 -0.16 0.00 -1.71 0.00 0.00 55.69 53.33 2kui s MET 586 Cb 0.00 -3.12 -0.04 0.00 2.01 0.00 0.00 34.83 33.68 2kui s MET 586 CO 0.00 0.04 0.39 -1.17 -0.01 0.00 0.00 175.02 174.27 2kui s LEU 587 N 0.94 4.26 -0.37 -0.03 2.96 -1.26 -4.66 118.68 120.53 2kui s LEU 587 Ca 0.02 0.67 -0.14 0.00 -0.22 0.00 0.00 54.13 54.46 2kui s LEU 587 Cb -0.14 -2.54 -0.00 0.00 0.50 0.00 0.00 46.19 44.00 2kui s LEU 587 CO 0.02 0.05 0.30 -0.62 -1.32 0.00 0.00 176.35 174.78 2kui s ASP 588 N 0.53 6.11 -0.45 3.68 2.15 -1.26 -5.02 116.67 122.41 2kui s ASP 588 Ca 0.21 -0.56 -0.21 0.00 0.43 0.00 0.00 52.55 52.42 2kui s ASP 588 Cb -0.14 -2.16 0.03 0.00 -0.30 0.00 0.00 42.92 40.35 2kui s ASP 588 CO 0.07 -0.35 0.65 -0.75 -0.17 0.00 0.00 175.17 174.63 2kui s LYS 589 N 1.79 3.26 0.00 4.34 2.47 -1.26 -4.79 119.74 125.56 2kui s LYS 589 Ca 0.07 -0.42 0.00 0.00 -1.56 0.00 0.00 55.97 54.06 2kui s LYS 589 Cb -0.18 -3.97 0.00 0.00 -1.46 0.00 0.00 37.83 32.22 2kui s LYS 589 CO 0.11 -1.05 0.00 0.41 0.16 0.00 0.00 175.35 174.98 2kui n GLY 590 N 5.05 1.10 3.01 5.54 0.00 -1.26 -5.07 105.19 113.56 2kui n GLY 590 Ca -0.02 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 2kui n GLY 590 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kui s ALA 591 N -4.00 0.23 -0.01 4.61 0.00 -1.26 -5.12 121.76 116.21 2kui s ALA 591 Ca 0.00 -0.69 -0.25 0.00 0.00 0.00 0.00 51.96 51.02 2kui s ALA 591 Cb 0.00 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2kui s ALA 591 CO 0.00 -0.17 0.77 0.16 0.00 0.00 0.00 175.76 176.52 2kui s ASP 592 N -1.66 7.14 -0.10 0.00 -4.77 -1.26 -4.86 116.67 111.16 2kui s ASP 592 Ca -0.12 1.37 0.03 0.00 -3.30 0.00 0.00 52.55 50.53 2kui s ASP 592 Cb -0.08 -2.46 0.01 0.00 -1.09 0.00 0.00 42.92 39.30 2kui s ASP 592 CO -0.02 -0.08 -0.18 -0.69 0.70 0.00 0.00 175.17 174.90 2kui s VAL 593 N 0.44 1.67 -0.53 2.11 1.01 0.39 -4.90 120.40 120.59 2kui s VAL 593 Ca 0.40 -0.77 -0.28 0.00 0.00 0.00 0.00 61.98 61.32 2kui s VAL 593 Cb -0.19 -1.49 0.02 0.00 0.00 0.00 0.00 36.38 34.72 2kui s VAL 593 CO 0.22 0.47 1.26 -0.62 0.00 0.00 0.00 175.10 176.43 2kui s ASP 594 N 0.70 6.40 0.00 3.32 -1.08 -1.26 -2.04 116.67 122.71 2kui s ASP 594 Ca -0.12 0.32 0.00 0.00 -0.52 0.00 0.00 52.55 52.23 2kui s ASP 594 Cb -0.16 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 2kui s ASP 594 CO 0.03 -1.48 0.36 0.00 0.52 0.00 0.00 175.17 174.59 2kui n ALA 595 N 8.62 1.57 0.00 3.66 0.00 -1.26 -5.05 120.51 128.06 2kui n ALA 595 Ca 0.11 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2kui n ALA 595 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2kui n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 596 N -0.03 2.48 0.37 0.00 0.00 -1.26 -4.57 105.19 102.17 2kui n GLY 596 Ca 0.00 -1.58 0.06 0.00 0.00 0.00 0.00 46.02 44.50 2kui n GLY 596 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2kui h GLY 597 N 0.00 1.49 2.00 -0.02 0.00 -1.99 0.87 103.07 105.43 2kui h GLY 597 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 2kui h GLY 597 CO 0.00 0.22 -0.01 1.76 0.00 0.00 0.00 176.54 178.51 2kui h SER 598 N 1.01 0.00 -0.01 0.19 0.02 -2.02 -1.77 113.55 110.96 2kui h SER 598 Ca 0.45 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.40 2kui h SER 598 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 2kui h SER 598 CO -0.21 0.01 -0.09 0.00 -1.14 0.00 0.00 176.83 175.40 2kui n GLN 599 N -3.75 1.22 -0.05 3.45 1.13 0.21 -4.62 117.38 114.97 2kui n GLN 599 Ca -0.03 -1.10 -0.16 0.00 -1.94 0.00 0.00 57.00 53.78 2kui n GLN 599 Cb 0.09 -1.23 -0.07 0.00 0.11 0.00 0.00 30.24 29.15 2kui n GLN 599 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2kui h HIS 600 N 2.23 0.85 -0.64 1.08 3.86 -0.40 -3.09 115.15 119.04 2kui h HIS 600 Ca 0.00 -0.34 -0.36 0.00 -1.16 0.00 0.00 60.37 58.51 2kui h HIS 600 Cb 0.52 -0.15 -0.19 0.00 1.06 0.00 0.00 27.41 28.65 2kui h HIS 600 CO 0.00 1.13 0.46 -1.71 0.86 0.00 0.00 177.93 178.66 2kui n ASN 601 N -4.16 4.29 -4.36 2.45 2.85 -1.26 -2.43 115.26 112.65 2kui n ASN 601 Ca -0.07 -3.09 -0.31 0.00 -0.11 0.00 0.00 54.58 51.00 2kui n ASN 601 Cb 0.60 -0.79 -0.15 0.00 1.24 0.00 0.00 39.78 40.68 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2kui s ARG 602 N -2.19 2.08 0.09 1.20 3.52 -1.17 0.20 118.95 122.68 2kui s ARG 602 Ca 0.38 -0.95 -0.31 0.00 -0.13 0.00 0.00 55.73 54.72 2kui s ARG 602 Cb 0.31 -2.09 -0.06 0.00 -1.56 0.00 0.00 34.95 31.55 2kui s ARG 602 CO 0.05 0.55 1.23 0.08 -0.81 0.00 0.00 175.30 176.40 2kui s VAL 603 N -0.72 3.84 -0.13 7.11 1.01 -0.44 -3.85 120.40 127.23 2kui s VAL 603 Ca 0.11 1.36 -0.19 0.00 0.00 0.00 0.00 61.98 63.26 2kui s VAL 603 Cb -0.10 -3.87 -0.17 0.00 0.00 0.00 0.00 36.38 32.24 2kui s VAL 603 CO 0.01 0.13 0.51 0.58 0.00 0.00 0.00 175.10 176.32 2kui h VAL 604 N 4.33 1.19 -3.22 2.92 2.07 -0.63 -3.37 116.25 119.54 2kui h VAL 604 Ca -0.42 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.19 2kui h VAL 604 Cb 1.21 2.26 -0.10 0.00 -1.52 0.00 0.00 31.29 33.14 2kui h VAL 604 CO 0.81 0.40 0.08 -0.72 0.02 0.00 0.00 177.57 178.16 2kui s TYR 605 N -2.00 -0.20 -0.00 1.57 1.13 -1.26 -4.79 117.35 111.80 2kui s TYR 605 Ca -0.13 -0.13 0.06 0.00 -1.41 0.00 0.00 57.07 55.46 2kui s TYR 605 Cb -0.02 0.45 -0.03 0.00 -1.10 0.00 0.00 41.96 41.26 2kui s TYR 605 CO 0.46 -0.93 -0.18 1.14 -2.51 0.00 0.00 175.55 173.53 2kui s GLN 606 N -3.85 2.24 0.04 -3.49 -2.07 -1.26 -3.81 119.66 107.45 2kui s GLN 606 Ca 0.08 -0.86 -0.26 0.00 -1.82 0.00 0.00 55.36 52.50 2kui s GLN 606 Cb -0.01 -2.24 -0.17 0.00 -1.09 0.00 0.00 33.01 29.49 2kui s GLN 606 CO -0.04 0.57 1.46 -0.97 -1.32 0.00 0.00 175.29 175.00 2kui h ASN 607 N 4.97 -0.23 -3.61 12.60 -1.24 -1.19 -3.44 115.58 123.44 2kui h ASN 607 Ca -0.47 -0.15 -0.51 0.00 0.71 0.00 0.00 56.30 55.88 2kui h ASN 607 Cb 1.15 0.06 -0.03 0.00 0.73 0.00 0.00 38.32 40.23 2kui h ASN 607 CO 0.49 0.02 0.03 -2.16 -1.29 0.00 0.00 177.43 174.52 2kui s PRO 608 N -5.28 3.98 0.19 6.67 0.05 -1.26 -4.97 135.00 134.38 2kui s PRO 608 Ca -0.15 0.58 -0.30 0.00 0.05 0.00 0.00 61.00 61.18 2kui s PRO 608 Cb 0.03 -2.57 -0.09 0.00 0.05 0.00 0.00 34.50 31.93 2kui s PRO 608 CO 0.62 0.25 1.30 -2.14 0.05 0.00 0.00 177.00 177.07 2kui s PRO 609 N -2.75 4.40 0.21 0.56 0.02 -1.26 -4.97 135.00 131.20 2kui s PRO 609 Ca 0.50 2.03 -0.30 0.00 0.02 0.00 0.00 61.00 63.25 2kui s PRO 609 Cb -0.12 -3.20 -0.09 0.00 0.02 0.00 0.00 34.50 31.11 2kui s PRO 609 CO 0.19 -0.24 1.34 0.00 -0.33 0.00 0.00 177.00 177.96 2kui s ALA 610 N 0.14 3.55 0.00 -1.55 0.00 -1.26 -2.32 121.76 120.33 2kui s ALA 610 Ca 0.56 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.69 2kui s ALA 610 Cb -0.36 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.26 2kui s ALA 610 CO 0.38 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.96 2kui n GLY 611 N 2.38 1.03 3.84 0.00 0.00 -0.22 -5.00 105.19 107.22 2kui n GLY 611 Ca 0.07 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.87 2kui n GLY 611 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2kui s THR 612 N -3.24 4.31 0.07 2.61 2.01 -0.98 -4.76 115.64 115.66 2kui s THR 612 Ca 0.00 -1.37 -0.31 0.00 0.31 0.00 0.00 61.69 60.32 2kui s THR 612 Cb 0.00 -3.38 -0.06 0.00 0.01 0.00 0.00 72.50 69.06 2kui s THR 612 CO 0.00 -0.31 1.24 -0.83 -0.69 0.00 0.00 174.62 174.02 2kui s GLY 613 N -3.88 2.32 0.03 4.40 0.00 -1.26 -2.04 107.32 106.89 2kui s GLY 613 Ca 0.35 0.90 0.08 0.00 0.00 0.00 0.00 44.72 46.05 2kui s GLY 613 CO 0.26 2.10 -0.23 -1.34 0.00 0.00 0.00 173.10 173.89 2kui s VAL 614 N 1.07 2.40 0.78 1.40 -7.23 0.65 -4.82 120.40 114.65 2kui s VAL 614 Ca 0.60 -1.27 -0.17 0.00 -1.81 0.00 0.00 61.98 59.33 2kui s VAL 614 Cb -0.31 -1.95 -0.11 0.00 0.56 0.00 0.00 36.38 34.57 2kui s VAL 614 CO 0.29 0.38 -0.20 -0.46 -0.31 0.00 0.00 175.10 174.81 2kui n ASN 615 N 1.77 -3.89 0.18 4.85 6.94 -1.26 -0.63 115.26 123.21 2kui n ASN 615 Ca -0.17 0.43 0.17 0.00 -0.02 0.00 0.00 54.58 55.00 2kui n ASN 615 Cb 0.52 -0.93 0.81 0.00 -2.36 0.00 0.00 39.78 37.82 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -1.03 0.00 0.00 177.26 176.31 2kui h ARG 616 N -0.61 0.00 -0.51 -3.83 0.11 -1.09 0.29 114.38 108.75 2kui h ARG 616 Ca -0.43 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.56 2kui h ARG 616 Cb 1.35 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.41 2kui h ARG 616 CO 0.34 0.00 -0.03 0.22 0.10 0.00 0.00 179.97 180.60 2kui h ASP 617 N 0.00 0.85 0.00 0.08 3.58 -1.88 -3.47 116.42 115.57 2kui h ASP 617 Ca 0.11 -0.23 0.00 0.00 0.42 0.00 0.00 57.03 57.33 2kui h ASP 617 Cb 0.58 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.40 2kui h ASP 617 CO -0.00 0.93 0.00 0.61 -2.88 0.00 0.00 179.24 177.90 2kui n GLY 618 N -0.52 0.60 3.65 -0.78 0.00 0.10 -4.48 105.19 103.76 2kui n GLY 618 Ca 0.02 -0.76 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 2kui n GLY 618 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2kui s ILE 619 N -2.00 3.68 -0.09 -0.61 -1.16 -1.26 -4.90 121.20 114.86 2kui s ILE 619 Ca 0.00 0.81 0.01 0.00 -0.51 0.00 0.00 60.65 60.95 2kui s ILE 619 Cb 0.00 -3.57 0.02 0.00 0.61 0.00 0.00 42.46 39.52 2kui s ILE 619 CO 0.00 -0.13 -0.10 -0.51 -2.81 0.00 0.00 174.94 171.39 2kui s ILE 620 N 4.35 1.10 -0.19 2.00 -1.16 -1.26 -4.70 121.20 121.34 2kui s ILE 620 Ca 0.71 -0.39 -0.07 0.00 -0.51 0.00 0.00 60.65 60.40 2kui s ILE 620 Cb -0.30 -1.06 -0.04 0.00 0.61 0.00 0.00 42.46 41.68 2kui s ILE 620 CO 0.28 0.37 0.05 -0.89 -2.81 0.00 0.00 174.94 171.93 2kui s THR 621 N 1.22 4.49 0.12 4.00 2.01 -1.26 -4.82 115.64 121.41 2kui s THR 621 Ca -0.04 -0.13 0.10 0.00 0.31 0.00 0.00 61.69 61.93 2kui s THR 621 Cb -0.14 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 2kui s THR 621 CO -0.03 0.43 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.32 2kui s LEU 622 N 0.69 2.31 0.03 4.42 1.02 -1.26 -0.55 118.68 125.34 2kui s LEU 622 Ca 0.02 -0.73 0.01 0.00 0.02 0.00 0.00 54.13 53.45 2kui s LEU 622 Cb -0.13 -1.16 -0.02 0.00 0.02 0.00 0.00 46.19 44.90 2kui s LEU 622 CO 0.02 0.16 -0.05 -0.13 0.02 0.00 0.00 176.35 176.36 2kui s ARG 623 N -2.00 0.41 0.34 1.70 0.52 -1.25 -4.73 118.95 113.93 2kui s ARG 623 Ca 0.12 -0.59 0.06 0.00 -0.52 0.00 0.00 55.73 54.81 2kui s ARG 623 Cb -0.10 -0.16 -0.07 0.00 0.52 0.00 0.00 34.95 35.14 2kui s ARG 623 CO 0.06 0.02 -0.02 -0.59 0.02 0.00 0.00 175.30 174.79 2kui s PHE 624 N -1.17 2.19 0.00 -0.53 -0.71 -1.26 0.15 117.98 116.66 2kui s PHE 624 Ca -0.10 -0.72 0.00 0.00 -1.04 0.00 0.00 56.93 55.07 2kui s PHE 624 Cb -0.08 -1.39 0.00 0.00 -1.21 0.00 0.00 43.02 40.34 2kui s PHE 624 CO -0.00 0.31 0.00 0.41 -1.34 0.00 0.00 175.22 174.60 2kui n GLY 625 N -0.75 -0.76 0.00 1.99 0.00 -1.02 -4.49 105.19 100.16 2kui n GLY 625 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14