#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 4.25 0.33 -0.61 1.10 -1.26 -4.98 121.20 120.03 2kui s ILE 356 Ca 0.00 1.59 -0.28 0.00 -0.51 0.00 0.00 60.65 61.44 2kui s ILE 356 Cb 0.00 -4.02 -0.10 0.00 0.15 0.00 0.00 42.46 38.50 2kui s ILE 356 CO 0.00 0.03 1.19 0.42 -2.11 0.00 0.00 174.94 174.47 2kui s THR 357 N 1.96 3.11 -0.40 4.00 -4.23 -1.26 -5.00 115.64 113.83 2kui s THR 357 Ca 0.56 1.08 0.03 0.00 -1.18 0.00 0.00 61.69 62.18 2kui s THR 357 Cb -0.25 -3.67 0.16 0.00 1.34 0.00 0.00 72.50 70.08 2kui s THR 357 CO 0.23 0.22 0.38 0.00 -0.54 0.00 0.00 174.62 174.92 2kui s ARG 358 N -1.78 0.75 0.05 3.99 1.04 -1.26 -5.13 118.95 116.62 2kui s ARG 358 Ca 0.49 -1.31 0.03 0.00 -1.04 0.00 0.00 55.73 53.91 2kui s ARG 358 Cb -0.35 -0.92 -0.04 0.00 -2.04 0.00 0.00 34.95 31.60 2kui s ARG 358 CO 0.45 -1.27 0.02 -0.51 -0.04 0.00 0.00 175.30 173.95 2kui s ASP 359 N 0.93 5.20 0.22 -2.89 1.11 -1.26 -4.66 116.67 115.30 2kui s ASP 359 Ca 0.23 -0.07 0.05 0.00 0.18 0.00 0.00 52.55 52.94 2kui s ASP 359 Cb -0.10 -1.32 -0.05 0.00 1.07 0.00 0.00 42.92 42.52 2kui s ASP 359 CO -0.07 0.21 -0.05 0.68 1.18 0.00 0.00 175.17 177.12 2kui s VAL 360 N -1.25 1.26 -0.04 -1.27 -7.23 0.56 -4.71 120.40 107.73 2kui s VAL 360 Ca 0.24 -2.08 -0.15 0.00 -1.81 0.00 0.00 61.98 58.19 2kui s VAL 360 Cb -0.12 -2.22 -0.05 0.00 0.56 0.00 0.00 36.38 34.55 2kui s VAL 360 CO 0.16 -0.44 0.39 -1.10 -0.31 0.00 0.00 175.10 173.80 2kui s GLN 361 N -3.79 4.00 -0.14 4.82 -0.21 -1.26 -0.11 119.66 122.97 2kui s GLN 361 Ca 0.25 0.36 -0.11 0.00 0.02 0.00 0.00 55.36 55.89 2kui s GLN 361 Cb 0.04 -3.27 -0.05 0.00 1.00 0.00 0.00 33.01 30.73 2kui s GLN 361 CO 0.07 0.56 0.21 0.08 -2.12 0.00 0.00 175.29 174.09 2kui s VAL 362 N -0.64 5.37 0.07 1.09 1.01 0.72 -5.00 120.40 123.02 2kui s VAL 362 Ca 0.23 0.36 -0.31 0.00 0.00 0.00 0.00 61.98 62.26 2kui s VAL 362 Cb -0.16 -3.52 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 2kui s VAL 362 CO 0.11 0.50 1.33 -2.84 0.00 0.00 0.00 175.10 174.20 2kui s PRO 363 N -0.21 4.35 0.22 2.72 0.02 -1.26 -4.22 135.00 136.62 2kui s PRO 363 Ca 0.14 1.94 0.08 0.00 0.02 0.00 0.00 61.00 63.18 2kui s PRO 363 Cb -0.12 -3.36 -0.04 0.00 0.02 0.00 0.00 34.50 31.00 2kui s PRO 363 CO 0.03 -0.41 0.07 0.16 -0.33 0.00 0.00 177.00 176.52 2kui s ASP 364 N 1.27 5.02 -0.08 2.53 1.47 -1.26 -4.97 116.67 120.65 2kui s ASP 364 Ca 0.62 -0.40 0.16 0.00 1.18 0.00 0.00 52.55 54.11 2kui s ASP 364 Cb -0.33 -1.13 0.32 0.00 -0.34 0.00 0.00 42.92 41.44 2kui s ASP 364 CO 0.29 0.02 1.15 1.33 0.68 0.00 0.00 175.17 178.64 2kui n VAL 365 N -0.70 0.89 -2.08 2.11 0.24 -1.26 -5.08 118.33 112.44 2kui n VAL 365 Ca -0.08 -1.61 -0.36 0.00 -2.04 0.00 0.00 64.34 60.24 2kui n VAL 365 Cb 0.57 0.37 0.02 0.00 -1.47 0.00 0.00 33.84 33.33 2kui n VAL 365 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2kui s ARG 366 N -1.32 3.26 0.00 7.34 1.81 -1.26 -3.61 118.95 125.17 2kui s ARG 366 Ca 0.28 1.84 0.00 0.00 -1.72 0.00 0.00 55.73 56.13 2kui s ARG 366 Cb 0.29 -2.11 0.00 0.00 -0.45 0.00 0.00 34.95 32.68 2kui s ARG 366 CO -0.08 -0.98 0.00 0.41 -0.68 0.00 0.00 175.30 173.97 2kui n GLY 367 N 0.47 0.71 0.00 -3.53 0.00 -0.09 -5.02 105.19 97.73 2kui n GLY 367 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.30 3.68 -2.84 1.61 6.02 -1.19 -4.87 117.38 118.50 2kui n GLN 368 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.73 2kui n GLN 368 Cb 0.00 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.26 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 0.30 6.18 0.33 1.08 1.04 -1.26 -0.44 113.70 120.94 2kui s SER 369 Ca 0.00 0.73 0.04 0.00 0.48 0.00 0.00 55.95 57.20 2kui s SER 369 Cb 0.00 -2.09 0.59 0.00 0.10 0.00 0.00 66.02 64.62 2kui s SER 369 CO 0.00 -0.55 1.88 0.77 0.98 0.00 0.00 173.24 176.32 2kui h SER 370 N 0.34 0.54 -0.16 7.02 4.64 -1.88 -1.64 113.55 122.42 2kui h SER 370 Ca -0.47 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.73 2kui h SER 370 Cb 1.22 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.16 2kui h SER 370 CO 0.61 0.58 0.01 0.00 -0.87 0.00 0.00 176.83 177.16 2kui h ALA 371 N 1.50 0.21 -0.40 5.18 0.00 -1.93 0.34 119.26 124.16 2kui h ALA 371 Ca 0.13 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2kui h ALA 371 Cb 0.28 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2kui h ALA 371 CO 0.00 -0.11 -0.08 0.22 0.00 0.00 0.00 179.25 179.29 2kui h ASP 372 N 0.03 0.75 -0.49 0.00 1.82 -1.93 0.11 116.42 116.70 2kui h ASP 372 Ca 0.05 -0.35 -0.06 0.00 -0.39 0.00 0.00 57.03 56.27 2kui h ASP 372 Cb 0.35 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.13 2kui h ASP 372 CO 0.01 0.93 0.07 0.00 -1.61 0.00 0.00 179.24 178.63 2kui h ALA 373 N 0.85 0.66 -0.18 -0.78 0.00 -1.20 -0.58 119.26 118.03 2kui h ALA 373 Ca 0.10 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 2kui h ALA 373 Cb 0.59 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2kui h ALA 373 CO 0.04 0.40 -0.16 0.82 0.00 0.00 0.00 179.25 180.34 2kui h ILE 374 N 0.70 1.33 -0.58 0.00 2.04 -0.22 -2.75 117.51 118.03 2kui h ILE 374 Ca 0.15 -1.31 0.02 0.00 1.00 0.00 0.00 64.86 64.72 2kui h ILE 374 Cb 0.41 1.79 -0.04 0.00 -0.74 0.00 0.00 36.82 38.25 2kui h ILE 374 CO 0.01 0.39 0.35 0.00 0.00 0.00 0.00 178.15 178.91 2kui h ALA 375 N 0.64 0.74 -0.23 1.87 0.00 -0.60 0.20 119.26 121.89 2kui h ALA 375 Ca 0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2kui h ALA 375 Cb 0.69 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2kui h ALA 375 CO 0.04 0.09 0.04 1.15 0.00 0.00 0.00 179.25 180.56 2kui h THR 376 N 0.70 1.23 -0.65 0.00 2.02 -1.17 -1.23 112.91 113.81 2kui h THR 376 Ca 0.23 -0.76 -0.04 0.00 0.77 0.00 0.00 66.41 66.61 2kui h THR 376 Cb 0.01 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2kui h THR 376 CO -0.09 0.24 0.23 -0.07 0.37 0.00 0.00 175.52 176.20 2kui h LEU 377 N 0.18 0.90 -0.95 2.58 -0.00 -1.13 -1.51 115.31 115.39 2kui h LEU 377 Ca 0.07 -0.14 -0.05 0.00 -0.00 0.00 0.00 57.88 57.76 2kui h LEU 377 Cb 0.32 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.72 2kui h LEU 377 CO 0.00 0.82 0.19 -0.61 -0.00 0.00 0.00 178.44 178.84 2kui h GLN 378 N 0.95 0.96 0.00 1.13 5.75 -0.45 -0.09 115.11 123.35 2kui h GLN 378 Ca 0.22 -0.19 -0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2kui h GLN 378 Cb 0.22 -0.15 -0.00 0.00 1.07 0.00 0.00 27.48 28.63 2kui h GLN 378 CO -0.01 0.83 -0.06 -0.91 -2.65 0.00 0.00 178.83 176.02 2kui h ASN 379 N 0.92 0.00 1.23 -0.69 2.35 -0.52 -1.47 115.58 117.41 2kui h ASN 379 Ca 0.21 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.96 2kui h ASN 379 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 2kui h ASN 379 CO -0.01 0.06 -0.18 0.54 -1.65 0.00 0.00 177.43 176.19 2kui n ARG 380 N -3.20 0.23 -0.12 0.81 5.12 -0.45 -4.90 116.66 114.15 2kui n ARG 380 Ca 0.00 0.15 0.00 0.00 -1.93 0.00 0.00 57.85 56.07 2kui n ARG 380 Cb 0.33 -1.73 0.00 0.00 -1.16 0.00 0.00 32.46 29.90 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 1.34 0.79 3.86 -0.13 0.00 -0.55 -4.87 105.19 105.63 2kui n GLY 381 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.10 3.45 0.22 1.61 0.40 -0.18 -4.55 117.98 116.84 2kui s PHE 382 Ca 0.00 1.00 -0.01 0.00 -0.60 0.00 0.00 56.93 57.32 2kui s PHE 382 Cb 0.00 -2.35 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 2kui s PHE 382 CO 0.00 0.26 0.42 0.15 0.70 0.00 0.00 175.22 176.75 2kui s LYS 383 N -2.69 3.53 0.01 0.44 -0.14 0.66 -3.72 119.74 117.83 2kui s LYS 383 Ca 0.47 -0.31 0.04 0.00 -1.36 0.00 0.00 55.97 54.82 2kui s LYS 383 Cb -0.12 -2.80 -0.01 0.00 -1.68 0.00 0.00 37.83 33.22 2kui s LYS 383 CO 0.20 0.36 -0.13 0.96 -0.76 0.00 0.00 175.35 175.98 2kui s ILE 384 N -1.93 1.01 -0.09 2.17 -0.00 -1.26 0.02 121.20 121.12 2kui s ILE 384 Ca 0.39 -0.68 0.02 0.00 -0.00 0.00 0.00 60.65 60.38 2kui s ILE 384 Cb -0.11 -0.87 0.01 0.00 -0.00 0.00 0.00 42.46 41.49 2kui s ILE 384 CO 0.30 0.18 -0.16 -0.60 -0.00 0.00 0.00 174.94 174.66 2kui s ARG 385 N -0.57 2.18 -0.17 0.37 3.52 0.24 -4.84 118.95 119.68 2kui s ARG 385 Ca 0.04 -0.56 -0.01 0.00 -0.13 0.00 0.00 55.73 55.07 2kui s ARG 385 Cb -0.06 -1.80 -0.00 0.00 -1.56 0.00 0.00 34.95 31.53 2kui s ARG 385 CO 0.00 0.00 -0.13 0.99 -0.81 0.00 0.00 175.30 175.35 2kui s THR 386 N 0.78 2.79 -0.13 4.11 2.01 -1.26 0.17 115.64 124.12 2kui s THR 386 Ca -0.11 -0.71 -0.01 0.00 0.31 0.00 0.00 61.69 61.16 2kui s THR 386 Cb -0.16 -2.20 -0.02 0.00 0.01 0.00 0.00 72.50 70.13 2kui s THR 386 CO 0.02 0.50 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.59 2kui s LEU 387 N 1.01 2.92 0.01 4.42 2.01 0.80 -4.96 118.68 124.89 2kui s LEU 387 Ca -0.01 -0.24 0.07 0.00 0.01 0.00 0.00 54.13 53.96 2kui s LEU 387 Cb -0.15 -1.67 -0.02 0.00 0.01 0.00 0.00 46.19 44.36 2kui s LEU 387 CO -0.02 0.19 -0.22 0.00 1.01 0.00 0.00 176.35 177.30 2kui s GLN 388 N 0.23 1.66 -0.05 1.70 0.00 -1.26 -0.50 119.66 121.45 2kui s GLN 388 Ca -0.06 -0.88 0.02 0.00 -0.00 0.00 0.00 55.36 54.43 2kui s GLN 388 Cb -0.15 -1.69 0.01 0.00 0.00 0.00 0.00 33.01 31.18 2kui s GLN 388 CO 0.04 0.45 -0.08 0.15 0.00 0.00 0.00 175.29 175.85 2kui s LYS 389 N -0.83 1.17 -0.05 9.60 -0.14 -0.47 -4.92 119.74 124.10 2kui s LYS 389 Ca 0.09 -0.26 -0.26 0.00 -1.36 0.00 0.00 55.97 54.17 2kui s LYS 389 Cb -0.09 -1.05 -0.03 0.00 -1.68 0.00 0.00 37.83 34.98 2kui s LYS 389 CO 0.00 0.00 0.83 -1.25 -0.76 0.00 0.00 175.35 174.18 2kui s PRO 390 N 0.65 4.47 0.00 -1.68 0.04 -1.26 -1.32 135.00 135.90 2kui s PRO 390 Ca -0.11 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.05 2kui s PRO 390 Cb -0.14 -3.47 0.00 0.00 0.04 0.00 0.00 34.50 30.94 2kui s PRO 390 CO 0.02 -0.03 0.00 -3.47 0.04 0.00 0.00 177.00 173.55 2kui n ASP 391 N 4.02 0.00 0.00 6.66 2.03 -0.20 -4.63 116.55 124.43 2kui n ASP 391 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2kui n ASP 391 Cb 0.51 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 2kui n ASP 391 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2kui n SER 392 N 0.00 0.23 0.08 1.67 7.64 -1.26 -4.52 113.62 117.46 2kui n SER 392 Ca 0.00 -1.04 -0.03 0.00 1.01 0.00 0.00 58.87 58.81 2kui n SER 392 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 2kui n SER 392 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2kui h THR 393 N 1.21 1.19 -3.23 0.44 1.35 -1.96 -3.46 112.91 108.44 2kui h THR 393 Ca 0.00 -2.76 -0.54 0.00 -0.55 0.00 0.00 66.41 62.56 2kui h THR 393 Cb 0.53 2.57 -0.02 0.00 -1.73 0.00 0.00 68.15 69.49 2kui h THR 393 CO 0.00 0.68 -0.19 0.27 -0.25 0.00 0.00 175.52 176.03 2kui s ILE 394 N -2.82 5.05 0.01 6.82 -0.00 -1.26 -5.01 121.20 123.99 2kui s ILE 394 Ca 0.01 0.14 -0.39 0.00 -0.00 0.00 0.00 60.65 60.41 2kui s ILE 394 Cb 0.09 -3.67 -0.19 0.00 -0.00 0.00 0.00 42.46 38.69 2kui s ILE 394 CO 0.79 -0.14 1.20 -2.65 -0.00 0.00 0.00 174.94 174.13 2kui n PRO 395 N -0.42 0.42 -0.70 0.37 -0.02 -1.26 -4.54 135.00 128.85 2kui n PRO 395 Ca -0.01 0.15 -0.31 0.00 -2.02 0.00 0.00 63.50 61.31 2kui n PRO 395 Cb 0.53 -1.71 0.18 0.00 -0.02 0.00 0.00 33.50 32.48 2kui n PRO 395 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2kui s PRO 396 N 0.34 0.74 0.00 0.52 0.04 -1.26 0.03 135.00 135.41 2kui s PRO 396 Ca 0.89 1.41 0.00 0.00 0.04 0.00 0.00 61.00 63.34 2kui s PRO 396 Cb -1.16 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 31.67 2kui s PRO 396 CO 0.54 -2.78 0.89 -0.40 0.04 0.00 0.00 177.00 175.30 2kui n ASP 397 N -4.32 0.00 -4.63 6.66 5.75 -1.21 -4.06 116.55 114.75 2kui n ASP 397 Ca 0.10 0.39 -0.38 0.00 -0.01 0.00 0.00 54.79 54.89 2kui n ASP 397 Cb 0.52 -0.39 -0.09 0.00 -1.03 0.00 0.00 41.12 40.13 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 -2.78 3.28 -0.28 2.11 3.76 -1.26 -3.06 115.29 117.07 2kui s HIS 398 Ca 0.00 0.30 -0.29 0.00 -0.15 0.00 0.00 55.06 54.92 2kui s HIS 398 Cb 0.00 -2.42 0.01 0.00 1.11 0.00 0.00 32.58 31.28 2kui s HIS 398 CO 0.00 -0.08 1.17 0.14 -0.85 0.00 0.00 174.74 175.12 2kui s VAL 399 N 1.55 4.38 -0.13 -0.90 -7.23 0.42 -4.78 120.40 113.70 2kui s VAL 399 Ca 0.11 1.60 0.16 0.00 -1.81 0.00 0.00 61.98 62.04 2kui s VAL 399 Cb -0.15 -4.25 -0.23 0.00 0.56 0.00 0.00 36.38 32.31 2kui s VAL 399 CO 0.08 -0.38 0.15 2.30 -0.31 0.00 0.00 175.10 176.94 2kui n ILE 400 N 5.82 0.86 -3.88 -0.62 -5.35 -1.26 -0.91 119.36 114.01 2kui n ILE 400 Ca 0.13 -0.64 -0.09 0.00 -0.27 0.00 0.00 62.75 61.88 2kui n ILE 400 Cb 0.46 -0.39 -0.08 0.00 -1.74 0.00 0.00 39.64 37.90 2kui n ILE 400 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2kui s GLY 401 N -4.82 0.11 0.31 3.28 0.00 -1.26 -4.67 107.32 100.27 2kui s GLY 401 Ca -0.08 -0.52 -0.09 0.00 0.00 0.00 0.00 44.72 44.03 2kui s GLY 401 CO 0.71 -0.69 0.56 2.41 0.00 0.00 0.00 173.10 176.09 2kui n THR 402 N 0.38 0.00 -3.68 0.90 -1.04 -1.26 -4.51 114.28 105.06 2kui n THR 402 Ca -0.17 -0.99 -0.36 0.00 -2.04 0.00 0.00 64.05 60.49 2kui n THR 402 Cb 0.60 0.82 -0.07 0.00 -1.82 0.00 0.00 70.33 69.86 2kui n THR 402 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2kui s ASP 403 N -2.69 6.32 0.00 8.00 1.01 -1.04 -4.95 116.67 123.32 2kui s ASP 403 Ca 0.16 0.37 0.00 0.00 0.71 0.00 0.00 52.55 53.79 2kui s ASP 403 Cb -0.03 -2.12 0.00 0.00 1.01 0.00 0.00 42.92 41.78 2kui s ASP 403 CO 0.12 0.19 0.31 -0.81 0.21 0.00 0.00 175.17 175.19 2kui n PRO 404 N 3.28 0.38 -0.18 8.23 -0.04 -1.26 -4.12 135.00 141.29 2kui n PRO 404 Ca -0.15 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.39 2kui n PRO 404 Cb 0.52 -1.27 0.38 0.00 -0.04 0.00 0.00 33.50 33.10 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui h ALA 405 N 1.77 1.77 -0.12 0.55 0.00 -1.92 0.49 119.26 121.81 2kui h ALA 405 Ca 0.00 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2kui h ALA 405 Cb 0.31 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2kui h ALA 405 CO 0.00 0.10 -0.53 0.00 0.00 0.00 0.00 179.25 178.82 2kui h ALA 406 N 1.62 0.88 -0.01 0.00 0.00 -1.88 -2.70 119.26 117.17 2kui h ALA 406 Ca 0.32 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2kui h ALA 406 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2kui h ALA 406 CO -0.11 0.68 -0.05 0.09 0.00 0.00 0.00 179.25 179.85 2kui n ASN 407 N -3.94 1.11 -4.89 0.00 4.13 -0.03 -0.20 115.26 111.44 2kui n ASN 407 Ca -0.02 -1.23 -0.32 0.00 1.68 0.00 0.00 54.58 54.68 2kui n ASN 407 Cb 0.57 0.01 -0.05 0.00 -1.54 0.00 0.00 39.78 38.78 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2kui s THR 408 N -2.13 5.16 -0.36 3.41 2.01 -0.07 -4.89 115.64 118.75 2kui s THR 408 Ca 0.36 0.14 -0.29 0.00 0.31 0.00 0.00 61.69 62.22 2kui s THR 408 Cb 0.21 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 69.10 2kui s THR 408 CO 0.39 0.11 1.39 -0.94 -0.69 0.00 0.00 174.62 174.88 2kui s SER 409 N -2.23 6.44 0.34 3.53 1.04 -1.26 -4.27 113.70 117.29 2kui s SER 409 Ca 0.38 1.00 0.07 0.00 0.48 0.00 0.00 55.95 57.88 2kui s SER 409 Cb -0.13 -2.54 -0.07 0.00 0.10 0.00 0.00 66.02 63.39 2kui s SER 409 CO 0.22 -1.31 -0.02 0.68 0.98 0.00 0.00 173.24 173.80 2kui s VAL 410 N 5.09 1.74 0.40 5.02 -7.23 0.85 -4.59 120.40 121.67 2kui s VAL 410 Ca 0.60 -2.08 -0.23 0.00 -1.81 0.00 0.00 61.98 58.46 2kui s VAL 410 Cb -0.15 -2.72 -0.09 0.00 0.56 0.00 0.00 36.38 33.98 2kui s VAL 410 CO 0.29 -0.13 1.01 -0.44 -0.31 0.00 0.00 175.10 175.52 2kui s SER 411 N -3.56 6.85 -0.30 4.85 0.01 -1.26 -0.32 113.70 119.97 2kui s SER 411 Ca 0.33 1.92 -0.28 0.00 1.31 0.00 0.00 55.95 59.23 2kui s SER 411 Cb 0.06 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 2kui s SER 411 CO 0.15 -0.43 1.98 0.00 0.41 0.00 0.00 173.24 175.36 2kui s ALA 412 N -1.78 2.76 0.00 1.44 0.00 -1.26 -3.58 121.76 119.34 2kui s ALA 412 Ca 0.58 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.98 2kui s ALA 412 Cb -0.18 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 18.88 2kui s ALA 412 CO 0.23 -2.77 0.00 0.41 0.00 0.00 0.00 175.76 173.63 2kui n GLY 413 N 5.58 0.73 0.00 0.00 0.00 -1.26 -5.07 105.19 105.17 2kui n GLY 413 Ca 0.26 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 1.56 -4.45 1.61 2.03 -1.23 -4.85 116.55 111.21 2kui n ASP 414 Ca 0.00 -0.76 -0.33 0.00 0.52 0.00 0.00 54.79 54.22 2kui n ASP 414 Cb 0.00 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.27 2kui n ASP 414 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2kui s GLU 415 N -1.19 2.77 -0.33 -0.67 2.02 -1.26 -0.24 118.70 119.80 2kui s GLU 415 Ca 0.00 -0.68 -0.06 0.00 0.02 0.00 0.00 54.97 54.25 2kui s GLU 415 Cb 0.00 -2.46 0.04 0.00 0.10 0.00 0.00 34.13 31.81 2kui s GLU 415 CO 0.00 0.51 0.08 0.42 0.02 0.00 0.00 175.26 176.29 2kui s ILE 416 N -0.43 3.67 -0.02 -1.63 -1.09 0.10 -4.93 121.20 116.88 2kui s ILE 416 Ca 0.05 -1.11 -0.26 0.00 -2.23 0.00 0.00 60.65 57.11 2kui s ILE 416 Cb -0.12 -3.05 -0.04 0.00 -1.58 0.00 0.00 42.46 37.67 2kui s ILE 416 CO 0.02 -0.12 0.80 0.42 -1.23 0.00 0.00 174.94 174.83 2kui s THR 417 N 1.39 4.91 -0.04 2.92 -4.23 -1.26 -0.59 115.64 118.74 2kui s THR 417 Ca -0.02 1.68 0.04 0.00 -1.18 0.00 0.00 61.69 62.21 2kui s THR 417 Cb -0.19 -4.14 -0.00 0.00 1.34 0.00 0.00 72.50 69.50 2kui s THR 417 CO 0.02 0.25 -0.15 0.54 -0.54 0.00 0.00 174.62 174.74 2kui s VAL 418 N 0.63 1.30 -0.22 2.29 0.11 0.13 -2.51 120.40 122.13 2kui s VAL 418 Ca 0.42 -0.64 -0.07 0.00 -2.93 0.00 0.00 61.98 58.76 2kui s VAL 418 Cb -0.19 -1.12 -0.03 0.00 -1.53 0.00 0.00 36.38 33.50 2kui s VAL 418 CO 0.22 0.38 0.06 0.54 -3.33 0.00 0.00 175.10 172.98 2kui s ASN 419 N 0.09 5.32 0.13 3.54 6.03 -1.26 -0.14 114.94 128.65 2kui s ASN 419 Ca -0.04 -0.09 0.08 0.00 -1.03 0.00 0.00 52.86 51.78 2kui s ASN 419 Cb -0.11 -1.93 -0.04 0.00 -3.03 0.00 0.00 41.25 36.14 2kui s ASN 419 CO 0.02 0.06 -0.18 0.68 -2.03 0.00 0.00 177.10 175.65 2kui s VAL 420 N 1.05 1.66 -0.20 3.54 -7.23 0.35 -4.69 120.40 114.88 2kui s VAL 420 Ca 0.04 -1.70 -0.11 0.00 -1.81 0.00 0.00 61.98 58.40 2kui s VAL 420 Cb -0.14 -1.63 -0.05 0.00 0.56 0.00 0.00 36.38 35.12 2kui s VAL 420 CO 0.03 -0.22 0.16 -0.55 -0.31 0.00 0.00 175.10 174.21 2kui s SER 421 N -2.27 6.24 0.33 4.85 0.15 0.10 -1.36 113.70 121.74 2kui s SER 421 Ca 0.10 0.27 -0.01 0.00 0.70 0.00 0.00 55.95 57.00 2kui s SER 421 Cb -0.08 -2.11 -0.04 0.00 -1.71 0.00 0.00 66.02 62.09 2kui s SER 421 CO 0.05 0.16 0.55 0.42 1.20 0.00 0.00 173.24 175.62 2kui s THR 422 N 0.43 5.08 0.00 6.45 -4.23 -0.43 -3.28 115.64 119.66 2kui s THR 422 Ca 0.09 -0.29 0.00 0.00 -1.18 0.00 0.00 61.69 60.31 2kui s THR 422 Cb -0.11 -3.82 0.00 0.00 1.34 0.00 0.00 72.50 69.90 2kui s THR 422 CO -0.01 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.19 2kui n GLY 423 N -1.54 -3.00 3.78 3.99 0.00 -1.26 -2.63 105.19 104.53 2kui n GLY 423 Ca -0.04 -0.72 -0.33 0.00 0.00 0.00 0.00 46.02 44.93 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 0.00 2.96 0.84 1.61 0.04 -1.26 -1.03 135.00 138.16 2kui s PRO 424 Ca 0.00 1.36 -0.12 0.00 0.04 0.00 0.00 61.00 62.28 2kui s PRO 424 Cb 0.00 -1.97 0.10 0.00 0.04 0.00 0.00 34.50 32.66 2kui s PRO 424 CO 0.00 -1.11 1.11 -1.21 0.04 0.00 0.00 177.00 175.83 2kui s GLU 425 N -4.04 1.73 0.23 4.56 2.02 -1.26 -4.76 118.70 117.18 2kui s GLU 425 Ca 0.66 0.53 0.09 0.00 0.02 0.00 0.00 54.97 56.27 2kui s GLU 425 Cb -0.20 -1.89 -0.04 0.00 0.10 0.00 0.00 34.13 32.10 2kui s GLU 425 CO 0.39 -1.84 -0.03 -0.65 0.02 0.00 0.00 175.26 173.15 2kui s GLN 426 N -5.19 2.23 0.15 1.61 -0.21 -1.26 -4.35 119.66 112.64 2kui s GLN 426 Ca 0.62 -1.33 0.10 0.00 0.02 0.00 0.00 55.36 54.76 2kui s GLN 426 Cb -0.15 -2.18 -0.04 0.00 1.00 0.00 0.00 33.01 31.64 2kui s GLN 426 CO 0.54 0.40 -0.23 1.03 -2.12 0.00 0.00 175.29 174.91 2kui s ARG 427 N -3.32 1.35 0.15 2.91 1.81 0.80 -4.85 118.95 117.80 2kui s ARG 427 Ca 0.29 -1.38 -0.26 0.00 -1.72 0.00 0.00 55.73 52.66 2kui s ARG 427 Cb -0.07 -1.65 -0.08 0.00 -0.45 0.00 0.00 34.95 32.70 2kui s ARG 427 CO 0.18 0.37 0.81 -1.83 -0.68 0.00 0.00 175.30 174.15 2kui s GLU 428 N -2.38 4.61 -0.18 3.54 -1.05 -1.26 -0.09 118.70 121.89 2kui s GLU 428 Ca 0.15 1.22 -0.25 0.00 -0.15 0.00 0.00 54.97 55.93 2kui s GLU 428 Cb -0.08 -3.29 -0.01 0.00 -0.44 0.00 0.00 34.13 30.30 2kui s GLU 428 CO 0.07 0.49 0.85 0.42 0.95 0.00 0.00 175.26 178.03 2kui s ILE 429 N -0.87 4.86 0.54 1.83 1.01 -0.65 -4.93 121.20 122.99 2kui s ILE 429 Ca 0.38 1.66 -0.19 0.00 0.00 0.00 0.00 60.65 62.49 2kui s ILE 429 Cb -0.23 -4.15 -0.06 0.00 0.01 0.00 0.00 42.46 38.03 2kui s ILE 429 CO 0.27 -0.00 1.11 -2.16 0.00 0.00 0.00 174.94 174.16 2kui s PRO 430 N 2.31 3.40 -0.00 2.79 0.04 -1.26 -4.38 135.00 137.89 2kui s PRO 430 Ca 0.38 1.55 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 2kui s PRO 430 Cb -0.16 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 2kui s PRO 430 CO 0.11 -0.80 0.96 0.16 0.04 0.00 0.00 177.00 177.47 2kui s ASP 431 N -1.88 7.34 0.12 6.66 -4.77 -1.26 -4.93 116.67 117.95 2kui s ASP 431 Ca 0.71 1.63 0.07 0.00 -3.30 0.00 0.00 52.55 51.66 2kui s ASP 431 Cb -0.22 -2.56 -0.04 0.00 -1.09 0.00 0.00 42.92 39.01 2kui s ASP 431 CO 0.27 -0.24 -0.18 -0.69 0.70 0.00 0.00 175.17 175.03 2kui s VAL 432 N 0.97 1.55 0.39 2.11 1.01 -1.26 -5.12 120.40 120.04 2kui s VAL 432 Ca 0.51 -1.63 -0.26 0.00 0.00 0.00 0.00 61.98 60.60 2kui s VAL 432 Cb -0.21 -1.54 -0.09 0.00 0.00 0.00 0.00 36.38 34.55 2kui s VAL 432 CO 0.27 -0.23 1.18 -0.55 0.00 0.00 0.00 175.10 175.77 2kui s SER 433 N -2.18 6.56 0.40 3.32 0.15 -1.26 -4.93 113.70 115.76 2kui s SER 433 Ca 0.08 2.37 0.16 0.00 0.70 0.00 0.00 55.95 59.26 2kui s SER 433 Cb -0.08 -2.62 0.86 0.00 -1.71 0.00 0.00 66.02 62.47 2kui s SER 433 CO 0.04 -0.65 1.86 0.71 1.20 0.00 0.00 173.24 176.40 2kui h THR 434 N 2.40 1.07 0.00 6.45 1.35 -1.99 -1.29 112.91 120.91 2kui h THR 434 Ca -0.49 -1.15 0.00 0.00 -0.55 0.00 0.00 66.41 64.22 2kui h THR 434 Cb 1.23 1.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2kui h THR 434 CO 0.63 0.31 0.00 0.00 -0.25 0.00 0.00 175.52 176.21 2kui n LEU 435 N -3.93 0.43 -3.61 3.87 -0.00 -1.26 0.06 117.00 112.55 2kui n LEU 435 Ca -0.02 0.54 -0.39 0.00 -0.00 0.00 0.00 56.01 56.15 2kui n LEU 435 Cb 0.39 -0.41 0.00 0.00 -0.00 0.00 0.00 43.42 43.40 2kui n LEU 435 CO 0.37 -0.12 1.10 0.35 -0.00 0.00 0.00 177.39 179.09 2kui n THR 436 N -1.91 5.29 -0.30 1.47 -2.24 -0.48 -4.76 114.28 111.35 2kui n THR 436 Ca 0.06 -5.88 0.05 0.00 -2.27 0.00 0.00 64.05 56.01 2kui n THR 436 Cb 0.38 -1.69 0.25 0.00 -2.10 0.00 0.00 70.33 67.17 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 2kui h TYR 437 N 4.32 1.03 -0.76 4.78 3.20 -1.74 -0.01 116.97 127.80 2kui h TYR 437 Ca 0.38 0.03 0.01 0.00 3.14 0.00 0.00 58.73 62.28 2kui h TYR 437 Cb 0.44 -0.34 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 2kui h TYR 437 CO 1.16 0.52 0.50 0.00 -1.64 0.00 0.00 178.16 178.69 2kui h ALA 438 N 1.52 0.96 -0.16 1.82 0.00 -1.94 -1.20 119.26 120.26 2kui h ALA 438 Ca 0.40 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.11 2kui h ALA 438 Cb 0.26 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2kui h ALA 438 CO -0.16 0.38 -0.53 1.49 0.00 0.00 0.00 179.25 180.43 2kui h GLU 439 N 1.03 0.45 0.14 0.00 4.57 -1.79 -2.24 114.58 116.74 2kui h GLU 439 Ca 0.28 -0.27 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2kui h GLU 439 Cb -0.12 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.50 2kui h GLU 439 CO -0.06 0.86 -0.07 0.00 -1.18 0.00 0.00 179.01 178.57 2kui h ALA 440 N 1.08 -0.19 -0.54 2.92 0.00 -0.16 0.35 119.26 122.73 2kui h ALA 440 Ca 0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2kui h ALA 440 Cb 1.04 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 2kui h ALA 440 CO 0.09 -0.59 0.17 -0.39 0.00 0.00 0.00 179.25 178.54 2kui h VAL 441 N -0.22 1.21 -0.23 0.00 -1.51 -1.27 -0.53 116.25 113.70 2kui h VAL 441 Ca -0.02 -0.71 0.00 0.00 -1.23 0.00 0.00 66.70 64.75 2kui h VAL 441 Cb 0.17 0.61 -0.01 0.00 -2.13 0.00 0.00 31.29 29.93 2kui h VAL 441 CO 0.03 0.27 0.15 0.50 -1.23 0.00 0.00 177.57 177.30 2kui h LYS 442 N 0.78 0.31 -0.48 5.19 1.63 -0.98 -1.48 116.57 121.53 2kui h LYS 442 Ca 0.18 -0.02 -0.11 0.00 -0.85 0.00 0.00 60.65 59.85 2kui h LYS 442 Cb 0.22 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 2kui h LYS 442 CO -0.01 0.20 -0.13 0.87 -3.45 0.00 0.00 179.45 176.94 2kui h LYS 443 N 0.31 0.90 -0.38 1.90 1.79 0.26 0.11 116.57 121.46 2kui h LYS 443 Ca 0.09 -0.33 -0.05 0.00 -2.18 0.00 0.00 60.65 58.18 2kui h LYS 443 Cb -0.03 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.54 2kui h LYS 443 CO -0.02 0.97 0.04 -0.07 -1.08 0.00 0.00 179.45 179.29 2kui h LEU 444 N 0.80 0.54 -0.38 2.94 4.07 -0.99 -1.08 115.31 121.21 2kui h LEU 444 Ca 0.13 -0.10 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 2kui h LEU 444 Cb 0.66 -0.14 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 2kui h LEU 444 CO 0.05 0.59 -0.17 0.74 -1.08 0.00 0.00 178.44 178.56 2kui h THR 445 N 0.56 1.28 0.00 0.22 2.02 -0.49 0.88 112.91 117.38 2kui h THR 445 Ca 0.12 -1.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.00 2kui h THR 445 Cb 0.30 1.31 -0.00 0.00 -1.74 0.00 0.00 68.15 68.02 2kui h THR 445 CO 0.01 0.43 -0.03 0.00 0.37 0.00 0.00 175.52 176.29 2kui h ALA 446 N 0.81 1.01 -0.14 6.16 0.00 -0.40 -2.72 119.26 123.98 2kui h ALA 446 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2kui h ALA 446 Cb 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2kui h ALA 446 CO 0.05 0.04 0.00 0.00 0.00 0.00 0.00 179.25 179.35 2kui n ALA 447 N -2.11 2.53 0.00 0.00 0.00 -0.45 -4.99 120.51 115.49 2kui n ALA 447 Ca 0.01 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2kui n ALA 447 Cb 0.33 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 1.16 2.16 0.33 0.00 0.00 -1.03 -4.70 105.19 103.10 2kui n GLY 448 Ca 0.17 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.43 -1.52 1.61 -5.15 -1.69 -3.46 116.94 105.30 2kui h PHE 449 Ca 0.00 0.09 -0.40 0.00 -0.20 0.00 0.00 57.97 57.46 2kui h PHE 449 Cb 0.00 0.71 -0.12 0.00 0.22 0.00 0.00 35.95 36.77 2kui h PHE 449 CO 0.00 -0.30 -0.41 0.41 -2.00 0.00 0.00 178.31 176.01 2kui n GLY 450 N -1.21 1.18 3.49 6.09 0.00 0.29 -4.87 105.19 110.17 2kui n GLY 450 Ca 0.01 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 -4.08 3.16 0.03 1.61 1.81 -1.26 -4.76 118.95 115.47 2kui s ARG 451 Ca 0.00 -0.77 0.01 0.00 -1.72 0.00 0.00 55.73 53.26 2kui s ARG 451 Cb 0.00 -3.93 -0.02 0.00 -0.45 0.00 0.00 34.95 30.54 2kui s ARG 451 CO 0.00 -0.74 -0.06 -0.59 -0.68 0.00 0.00 175.30 173.23 2kui s PHE 452 N 1.97 0.49 0.01 -0.53 -0.12 -1.26 -0.95 117.98 117.59 2kui s PHE 452 Ca 0.10 -0.49 0.02 0.00 -0.05 0.00 0.00 56.93 56.51 2kui s PHE 452 Cb -0.18 -0.31 -0.01 0.00 -0.63 0.00 0.00 43.02 41.90 2kui s PHE 452 CO 0.12 -0.12 -0.06 0.21 -0.05 0.00 0.00 175.22 175.32 2kui s LYS 453 N -1.46 0.43 -0.17 1.99 2.20 -0.58 -4.91 119.74 117.25 2kui s LYS 453 Ca -0.12 -0.32 -0.02 0.00 -0.36 0.00 0.00 55.97 55.15 2kui s LYS 453 Cb -0.10 -0.36 -0.01 0.00 -1.51 0.00 0.00 37.83 35.85 2kui s LYS 453 CO -0.00 0.09 -0.09 -1.14 -0.36 0.00 0.00 175.35 173.85 2kui s GLN 454 N -0.48 3.42 -0.04 4.03 0.74 -1.26 0.19 119.66 126.26 2kui s GLN 454 Ca -0.01 -0.64 0.05 0.00 0.05 0.00 0.00 55.36 54.81 2kui s GLN 454 Cb -0.04 -2.81 -0.01 0.00 1.10 0.00 0.00 33.01 31.25 2kui s GLN 454 CO -0.00 0.06 -0.21 0.00 -0.55 0.00 0.00 175.29 174.58 2kui s ALA 455 N 0.79 1.84 -0.03 1.58 0.00 0.88 -4.96 121.76 121.85 2kui s ALA 455 Ca -0.03 -0.88 0.04 0.00 0.00 0.00 0.00 51.96 51.08 2kui s ALA 455 Cb -0.15 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.38 2kui s ALA 455 CO 0.01 0.36 -0.12 -0.80 0.00 0.00 0.00 175.76 175.21 2kui s ASN 456 N -0.14 4.19 -0.06 0.00 -0.87 -1.26 -0.25 114.94 116.54 2kui s ASN 456 Ca -0.02 -0.20 -0.06 0.00 -1.57 0.00 0.00 52.86 51.02 2kui s ASN 456 Cb -0.12 -0.90 0.02 0.00 -0.02 0.00 0.00 41.25 40.23 2kui s ASN 456 CO 0.02 0.32 0.17 -0.44 -2.57 0.00 0.00 177.10 174.60 2kui s SER 457 N -0.97 -0.17 0.02 -1.22 0.01 -0.77 -4.93 113.70 105.67 2kui s SER 457 Ca 0.13 0.33 -0.30 0.00 1.31 0.00 0.00 55.95 57.42 2kui s SER 457 Cb -0.11 0.34 -0.07 0.00 0.21 0.00 0.00 66.02 66.39 2kui s SER 457 CO 0.03 -0.07 1.70 -2.16 0.41 0.00 0.00 173.24 173.15 2kui s PRO 458 N 0.06 4.18 0.37 12.44 0.04 -1.25 -0.83 135.00 150.01 2kui s PRO 458 Ca -0.00 2.32 0.06 0.00 0.04 0.00 0.00 61.00 63.42 2kui s PRO 458 Cb -0.01 -3.81 -0.02 0.00 0.04 0.00 0.00 34.50 30.69 2kui s PRO 458 CO 0.00 -0.80 0.23 -1.12 0.04 0.00 0.00 177.00 175.35 2kui s SER 459 N 3.01 2.25 0.37 6.66 0.01 -0.05 -4.86 113.70 121.09 2kui s SER 459 Ca 0.76 -1.76 -0.28 0.00 1.31 0.00 0.00 55.95 55.98 2kui s SER 459 Cb -0.38 0.58 -0.11 0.00 0.21 0.00 0.00 66.02 66.32 2kui s SER 459 CO 0.33 -1.04 1.48 1.07 0.41 0.00 0.00 173.24 175.49 2kui n THR 460 N -0.78 1.95 -0.12 1.44 5.66 -1.26 -4.72 114.28 116.46 2kui n THR 460 Ca 0.02 -0.49 0.26 0.00 -3.05 0.00 0.00 64.05 60.79 2kui n THR 460 Cb 0.63 -1.95 0.72 0.00 -1.55 0.00 0.00 70.33 68.18 2kui n THR 460 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 175.07 173.57 2kui h PRO 461 N 3.01 0.00 -0.48 1.09 0.13 -1.93 0.39 132.00 134.21 2kui h PRO 461 Ca -0.50 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.55 2kui h PRO 461 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 2kui h PRO 461 CO 0.65 0.00 -0.01 1.05 -0.23 0.00 0.00 178.00 179.46 2kui h GLU 462 N 0.00 0.81 0.00 0.86 4.11 -1.96 -2.77 114.58 115.62 2kui h GLU 462 Ca 0.37 -0.22 0.00 0.00 0.07 0.00 0.00 59.36 59.58 2kui h GLU 462 Cb 1.58 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.74 2kui h GLU 462 CO -0.00 0.82 -0.75 1.28 0.07 0.00 0.00 179.01 180.42 2kui n LEU 463 N -4.21 0.67 -4.71 3.06 7.99 0.06 -4.83 117.00 115.04 2kui n LEU 463 Ca 0.02 0.16 -0.42 0.00 -0.01 0.00 0.00 56.01 55.76 2kui n LEU 463 Cb 0.31 -0.16 -0.03 0.00 -0.11 0.00 0.00 43.42 43.43 2kui n LEU 463 CO 0.42 -0.03 1.41 -0.69 -1.51 0.00 0.00 177.39 176.99 2kui s VAL 464 N -3.18 2.23 0.00 4.08 1.01 -0.82 -1.39 120.40 122.34 2kui s VAL 464 Ca 0.05 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.07 2kui s VAL 464 Cb 0.14 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.50 2kui s VAL 464 CO 0.74 0.00 0.00 0.61 0.00 0.00 0.00 175.10 176.46 2kui n GLY 465 N 4.08 1.25 3.53 4.51 0.00 -0.07 -4.95 105.19 113.54 2kui n GLY 465 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.77 1.78 0.38 1.61 3.01 -0.49 -4.83 119.74 120.44 2kui s LYS 466 Ca 0.00 -1.96 -0.26 0.00 -1.01 0.00 0.00 55.97 52.74 2kui s LYS 466 Cb 0.00 -1.43 -0.09 0.00 -1.01 0.00 0.00 37.83 35.30 2kui s LYS 466 CO 0.00 0.00 1.12 0.08 0.51 0.00 0.00 175.35 177.06 2kui s VAL 467 N -2.84 3.39 -0.18 3.17 1.01 0.11 -1.34 120.40 123.72 2kui s VAL 467 Ca 0.33 1.17 0.10 0.00 0.00 0.00 0.00 61.98 63.58 2kui s VAL 467 Cb 0.06 -3.66 -0.23 0.00 0.00 0.00 0.00 36.38 32.56 2kui s VAL 467 CO 0.16 0.11 0.12 -0.38 0.00 0.00 0.00 175.10 175.11 2kui n ILE 468 N 0.24 1.50 -2.74 2.22 5.41 0.80 -4.74 119.36 122.05 2kui n ILE 468 Ca 0.03 -0.74 0.00 0.00 1.00 0.00 0.00 62.75 63.04 2kui n ILE 468 Cb 0.47 -0.98 0.00 0.00 -0.71 0.00 0.00 39.64 38.42 2kui n ILE 468 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2kui n GLY 469 N 1.89 -1.74 3.48 7.39 0.00 -1.20 -5.04 105.19 109.97 2kui n GLY 469 Ca -0.34 -1.20 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 2kui n GLY 469 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2kui s THR 470 N -2.71 2.84 -0.03 2.61 -4.23 -1.26 -1.41 115.64 111.44 2kui s THR 470 Ca 0.00 -1.35 -0.26 0.00 -1.18 0.00 0.00 61.69 58.90 2kui s THR 470 Cb 0.00 -2.26 -0.21 0.00 1.34 0.00 0.00 72.50 71.38 2kui s THR 470 CO 0.00 0.21 1.25 -1.13 -0.54 0.00 0.00 174.62 174.40 2kui h ASN 471 N 4.09 0.00 -3.04 3.99 -0.73 -1.39 -3.39 115.58 115.10 2kui h ASN 471 Ca -0.49 -0.51 -0.55 0.00 1.87 0.00 0.00 56.30 56.62 2kui h ASN 471 Cb 1.16 -0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.74 2kui h ASN 471 CO 0.47 0.51 0.73 -2.84 -0.37 0.00 0.00 177.43 175.93 2kui s PRO 472 N -4.17 4.34 0.25 6.67 0.02 -1.26 -4.98 135.00 135.87 2kui s PRO 472 Ca -0.16 1.76 -0.30 0.00 0.02 0.00 0.00 61.00 62.31 2kui s PRO 472 Cb 0.01 -3.55 -0.11 0.00 0.02 0.00 0.00 34.50 30.87 2kui s PRO 472 CO 0.68 -0.47 1.58 -2.14 -0.33 0.00 0.00 177.00 176.31 2kui s PRO 473 N 2.21 4.16 0.00 5.54 0.02 -1.26 -4.86 135.00 140.81 2kui s PRO 473 Ca 0.58 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.10 2kui s PRO 473 Cb -0.27 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.19 2kui s PRO 473 CO 0.23 -0.60 0.50 0.00 -0.33 0.00 0.00 177.00 176.80 2kui n ALA 474 N 2.73 2.19 0.43 -1.55 0.00 -1.26 -1.50 120.51 121.54 2kui n ALA 474 Ca 0.10 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.59 2kui n ALA 474 Cb 0.38 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.08 0.68 -4.64 0.00 5.03 -1.26 -4.35 115.26 110.63 2kui n ASN 475 Ca 0.00 -0.67 -0.24 0.00 0.87 0.00 0.00 54.58 54.54 2kui n ASN 475 Cb 0.13 1.04 0.11 0.00 -1.02 0.00 0.00 39.78 40.05 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2kui s GLN 476 N -2.03 1.63 -0.30 3.52 -1.52 -0.56 -4.76 119.66 115.64 2kui s GLN 476 Ca 0.03 -0.97 -0.07 0.00 -1.95 0.00 0.00 55.36 52.40 2kui s GLN 476 Cb 0.08 -2.27 0.01 0.00 -0.22 0.00 0.00 33.01 30.60 2kui s GLN 476 CO 0.42 -1.51 0.09 0.99 -0.25 0.00 0.00 175.29 175.03 2kui s THR 477 N -3.21 4.08 0.07 -0.19 2.01 -1.26 -1.63 115.64 115.51 2kui s THR 477 Ca 0.66 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 62.08 2kui s THR 477 Cb -0.06 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.31 2kui s THR 477 CO 0.45 0.08 -0.10 -0.94 -0.69 0.00 0.00 174.62 173.42 2kui s SER 478 N 1.52 4.41 0.80 3.53 1.04 0.87 -4.79 113.70 121.08 2kui s SER 478 Ca 0.03 -0.32 -0.10 0.00 0.48 0.00 0.00 55.95 56.04 2kui s SER 478 Cb -0.17 -0.89 0.07 0.00 0.10 0.00 0.00 66.02 65.13 2kui s SER 478 CO 0.03 0.21 1.10 0.00 0.98 0.00 0.00 173.24 175.56 2kui s ALA 479 N -1.13 2.12 -0.36 5.32 0.00 -1.26 -0.14 121.76 126.31 2kui s ALA 479 Ca 0.20 0.29 0.24 0.00 0.00 0.00 0.00 51.96 52.69 2kui s ALA 479 Cb -0.11 -3.29 1.08 0.00 0.00 0.00 0.00 23.12 20.79 2kui s ALA 479 CO 0.11 -1.93 1.73 0.82 0.00 0.00 0.00 175.76 176.50 2kui h ILE 480 N -1.25 0.00 -0.34 0.00 5.03 -1.93 -0.49 117.51 118.53 2kui h ILE 480 Ca -0.44 -0.20 0.00 0.00 -0.12 0.00 0.00 64.86 64.11 2kui h ILE 480 Cb 1.24 0.90 0.00 0.00 -3.03 0.00 0.00 36.82 35.93 2kui h ILE 480 CO 0.50 0.00 0.00 0.35 -0.68 0.00 0.00 178.15 178.32 2kui n THR 481 N -2.32 0.53 -2.98 -0.27 -2.24 -1.26 -4.00 114.28 101.74 2kui n THR 481 Ca 0.01 -0.76 -0.40 0.00 -2.27 0.00 0.00 64.05 60.62 2kui n THR 481 Cb 0.19 0.93 -0.04 0.00 -2.10 0.00 0.00 70.33 69.31 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 -1.31 7.04 -0.17 3.42 3.84 -0.20 -5.02 114.94 122.55 2kui s ASN 482 Ca 0.33 1.26 -0.18 0.00 0.21 0.00 0.00 52.86 54.48 2kui s ASN 482 Cb 0.19 -2.44 -0.04 0.00 -0.55 0.00 0.00 41.25 38.41 2kui s ASN 482 CO 0.27 -0.16 0.49 -0.69 -2.79 0.00 0.00 177.10 174.21 2kui s VAL 483 N 0.96 5.15 -0.25 -5.21 1.01 -1.26 -4.45 120.40 116.34 2kui s VAL 483 Ca 0.40 0.94 -0.07 0.00 0.00 0.00 0.00 61.98 63.24 2kui s VAL 483 Cb -0.18 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2kui s VAL 483 CO 0.19 0.24 0.07 -0.69 0.00 0.00 0.00 175.10 174.91 2kui s VAL 484 N 1.21 4.27 -0.23 2.92 1.01 -0.13 -4.86 120.40 124.60 2kui s VAL 484 Ca 0.24 -0.18 -0.15 0.00 0.00 0.00 0.00 61.98 61.89 2kui s VAL 484 Cb -0.15 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 2kui s VAL 484 CO 0.10 0.34 0.36 -0.51 0.00 0.00 0.00 175.10 175.39 2kui s ILE 485 N 1.60 5.21 -0.20 2.22 -1.16 -1.26 -1.52 121.20 126.09 2kui s ILE 485 Ca 0.06 0.61 -0.08 0.00 -0.51 0.00 0.00 60.65 60.73 2kui s ILE 485 Cb -0.15 -3.69 -0.04 0.00 0.61 0.00 0.00 42.46 39.18 2kui s ILE 485 CO 0.03 0.23 0.09 -0.63 -2.81 0.00 0.00 174.94 171.86 2kui s ILE 486 N 1.51 4.96 -0.18 2.00 1.09 0.13 -0.87 121.20 129.84 2kui s ILE 486 Ca 0.16 0.03 -0.04 0.00 -1.10 0.00 0.00 60.65 59.71 2kui s ILE 486 Cb -0.15 -3.26 -0.02 0.00 -1.06 0.00 0.00 42.46 37.97 2kui s ILE 486 CO 0.08 0.42 -0.03 -0.51 -0.10 0.00 0.00 174.94 174.80 2kui s ILE 487 N 0.61 3.76 0.11 2.92 2.07 -0.50 -0.08 121.20 130.09 2kui s ILE 487 Ca 0.05 -0.39 0.05 0.00 -1.41 0.00 0.00 60.65 58.95 2kui s ILE 487 Cb -0.13 -2.67 -0.04 0.00 0.13 0.00 0.00 42.46 39.75 2kui s ILE 487 CO 0.01 0.46 0.01 0.68 -1.91 0.00 0.00 174.94 174.19 2kui s VAL 488 N 0.75 3.96 -0.06 4.00 -7.23 0.65 -0.14 120.40 122.32 2kui s VAL 488 Ca -0.01 -1.10 -0.21 0.00 -1.81 0.00 0.00 61.98 58.84 2kui s VAL 488 Cb -0.14 -2.92 -0.04 0.00 0.56 0.00 0.00 36.38 33.83 2kui s VAL 488 CO 0.02 0.05 0.60 -0.83 -0.31 0.00 0.00 175.10 174.64 2kui s GLY 489 N -2.50 2.55 0.18 2.32 0.00 -0.45 -1.84 107.32 107.59 2kui s GLY 489 Ca 0.26 0.01 0.09 0.00 0.00 0.00 0.00 44.72 45.09 2kui s GLY 489 CO 0.19 0.93 -0.19 -0.56 0.00 0.00 0.00 173.10 173.46 2kui s SER 490 N 0.43 2.91 0.00 1.64 0.01 -0.01 -0.89 113.70 117.79 2kui s SER 490 Ca 0.32 -0.89 0.00 0.00 1.31 0.00 0.00 55.95 56.69 2kui s SER 490 Cb -0.17 -0.19 0.00 0.00 0.21 0.00 0.00 66.02 65.87 2kui s SER 490 CO 0.16 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.41 2kui n GLY 491 N 0.16 1.37 3.82 3.44 0.00 -1.26 -0.87 105.19 111.85 2kui n GLY 491 Ca -0.12 -0.19 -0.33 0.00 0.00 0.00 0.00 46.02 45.38 2kui n GLY 491 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2kui s PRO 492 N -0.02 4.04 -1.41 1.61 0.04 -1.26 -4.73 135.00 133.27 2kui s PRO 492 Ca 0.00 1.12 -0.11 0.00 0.04 0.00 0.00 61.00 62.05 2kui s PRO 492 Cb 0.00 -2.15 0.07 0.00 0.04 0.00 0.00 34.50 32.47 2kui s PRO 492 CO 0.00 -0.19 2.25 0.00 0.04 0.00 0.00 177.00 179.09 2kui n ALA 493 N -1.01 5.99 -2.48 8.56 0.00 -1.26 -4.90 120.51 125.40 2kui n ALA 493 Ca 0.07 -4.00 -0.27 0.00 0.00 0.00 0.00 53.44 49.24 2kui n ALA 493 Cb 0.54 -3.22 -0.11 0.00 0.00 0.00 0.00 19.45 16.66 2kui n ALA 493 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2kui s THR 494 N 1.47 2.70 -0.01 0.00 -4.23 -1.26 -1.55 115.64 112.75 2kui s THR 494 Ca 0.49 -1.83 -0.15 0.00 -1.18 0.00 0.00 61.69 59.02 2kui s THR 494 Cb 0.14 -2.30 0.02 0.00 1.34 0.00 0.00 72.50 71.70 2kui s THR 494 CO -0.05 -0.08 0.31 -0.75 -0.54 0.00 0.00 174.62 173.51 2kui s LYS 495 N -2.65 0.68 0.18 3.99 2.20 0.67 -4.86 119.74 119.96 2kui s LYS 495 Ca 0.22 -0.21 -0.28 0.00 -0.36 0.00 0.00 55.97 55.33 2kui s LYS 495 Cb -0.09 0.30 -0.08 0.00 -1.51 0.00 0.00 37.83 36.46 2kui s LYS 495 CO 0.12 -0.19 0.87 0.16 -0.36 0.00 0.00 175.35 175.95 2kui s ASP 496 N -1.39 7.51 -0.30 1.43 -4.77 -1.26 -0.68 116.67 117.22 2kui s ASP 496 Ca -0.13 1.79 -0.18 0.00 -3.30 0.00 0.00 52.55 50.73 2kui s ASP 496 Cb -0.05 -2.56 -0.02 0.00 -1.09 0.00 0.00 42.92 39.20 2kui s ASP 496 CO 0.04 0.14 0.52 0.27 0.70 0.00 0.00 175.17 176.83 2kui s ILE 497 N -0.94 5.04 0.12 2.11 -4.36 -0.65 -4.95 121.20 117.57 2kui s ILE 497 Ca 0.40 0.66 -0.10 0.00 -0.26 0.00 0.00 60.65 61.35 2kui s ILE 497 Cb -0.24 -3.88 -0.06 0.00 1.25 0.00 0.00 42.46 39.52 2kui s ILE 497 CO 0.29 -0.04 0.45 -2.16 0.24 0.00 0.00 174.94 173.72 2kui s PRO 498 N 2.36 3.80 -0.82 0.37 0.04 -1.26 0.21 135.00 139.70 2kui s PRO 498 Ca 0.20 0.22 -0.24 0.00 0.04 0.00 0.00 61.00 61.23 2kui s PRO 498 Cb -0.15 -2.91 0.06 0.00 0.04 0.00 0.00 34.50 31.53 2kui s PRO 498 CO 0.11 0.49 1.22 0.16 0.04 0.00 0.00 177.00 179.02 2kui s ASP 499 N -1.93 6.31 -0.31 6.66 -4.77 -1.26 -4.73 116.67 116.66 2kui s ASP 499 Ca 0.37 -1.06 0.11 0.00 -3.30 0.00 0.00 52.55 48.67 2kui s ASP 499 Cb -0.13 -2.50 0.77 0.00 -1.09 0.00 0.00 42.92 39.96 2kui s ASP 499 CO 0.20 -1.55 1.80 0.55 0.70 0.00 0.00 175.17 176.87 2kui n VAL 500 N 6.27 2.91 -1.69 2.11 3.14 -1.26 -4.96 118.33 124.85 2kui n VAL 500 Ca 0.12 -1.60 -0.29 0.00 -2.96 0.00 0.00 64.34 59.61 2kui n VAL 500 Cb 0.49 -0.34 0.13 0.00 -1.06 0.00 0.00 33.84 33.06 2kui n VAL 500 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2kui s ALA 501 N -2.95 2.06 0.00 1.55 0.00 -1.26 -4.43 121.76 116.74 2kui s ALA 501 Ca 0.55 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.82 2kui s ALA 501 Cb 0.44 -2.96 0.00 0.00 0.00 0.00 0.00 23.12 20.59 2kui s ALA 501 CO 0.14 -2.18 0.00 0.41 0.00 0.00 0.00 175.76 174.13 2kui n GLY 502 N -2.73 1.10 3.39 0.00 0.00 0.13 -4.97 105.19 102.10 2kui n GLY 502 Ca 0.09 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.73 2kui n GLY 502 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2kui s GLN 503 N -0.61 1.68 0.74 1.61 -0.21 -1.22 -4.95 119.66 116.69 2kui s GLN 503 Ca 0.00 -1.97 -0.11 0.00 0.02 0.00 0.00 55.36 53.30 2kui s GLN 503 Cb 0.00 -0.29 0.03 0.00 1.00 0.00 0.00 33.01 33.75 2kui s GLN 503 CO 0.00 -0.43 1.09 0.95 -2.12 0.00 0.00 175.29 174.79 2kui s THR 504 N -3.48 3.38 0.24 -0.19 -4.23 -1.26 -0.03 115.64 110.07 2kui s THR 504 Ca 0.33 0.45 -0.04 0.00 -1.18 0.00 0.00 61.69 61.25 2kui s THR 504 Cb 0.05 -3.34 0.21 0.00 1.34 0.00 0.00 72.50 70.77 2kui s THR 504 CO 0.17 -0.58 1.73 -0.37 -0.54 0.00 0.00 174.62 175.02 2kui h VAL 505 N -0.81 0.65 -0.41 2.29 -1.51 -1.49 0.20 116.25 115.17 2kui h VAL 505 Ca -0.46 -0.15 -0.11 0.00 -1.23 0.00 0.00 66.70 64.76 2kui h VAL 505 Cb 1.26 0.18 -0.01 0.00 -2.13 0.00 0.00 31.29 30.59 2kui h VAL 505 CO 0.62 0.08 -0.16 -0.78 -1.23 0.00 0.00 177.57 176.10 2kui h ASP 506 N 0.43 0.86 -0.08 4.19 3.58 -1.92 -1.56 116.42 121.92 2kui h ASP 506 Ca 0.41 -0.39 -0.07 0.00 0.42 0.00 0.00 57.03 57.40 2kui h ASP 506 Cb 0.62 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 41.44 2kui h ASP 506 CO -0.41 1.05 -0.24 0.58 -2.88 0.00 0.00 179.24 177.34 2kui h VAL 507 N 0.65 1.42 -0.74 2.25 2.07 -1.73 -1.87 116.25 118.30 2kui h VAL 507 Ca 0.10 -1.61 -0.05 0.00 0.82 0.00 0.00 66.70 65.95 2kui h VAL 507 Cb 0.71 2.27 -0.03 0.00 -1.52 0.00 0.00 31.29 32.71 2kui h VAL 507 CO 0.05 0.46 0.26 0.00 0.02 0.00 0.00 177.57 178.36 2kui h ALA 508 N 0.45 0.97 -0.65 1.67 0.00 -0.66 -1.60 119.26 119.43 2kui h ALA 508 Ca -0.01 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.70 2kui h ALA 508 Cb 0.87 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 2kui h ALA 508 CO 0.05 0.63 0.43 0.37 0.00 0.00 0.00 179.25 180.73 2kui h GLN 509 N 1.09 0.86 -0.01 0.00 4.15 -1.24 0.18 115.11 120.13 2kui h GLN 509 Ca 0.24 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.62 2kui h GLN 509 Cb 0.27 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 2kui h GLN 509 CO -0.01 0.57 -0.07 -0.22 -1.93 0.00 0.00 178.83 177.16 2kui h LYS 510 N 0.88 -0.11 -0.28 1.69 3.64 -0.99 -0.31 116.57 121.10 2kui h LYS 510 Ca 0.24 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2kui h LYS 510 Cb -0.10 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 2kui h LYS 510 CO -0.05 -0.08 0.13 -0.91 -2.27 0.00 0.00 179.45 176.27 2kui h ASN 511 N -0.12 0.36 -0.96 4.20 2.35 -0.78 -0.64 115.58 120.00 2kui h ASN 511 Ca 0.03 -0.13 0.01 0.00 -0.55 0.00 0.00 56.30 55.66 2kui h ASN 511 Cb 0.16 -0.09 -0.05 0.00 0.05 0.00 0.00 38.32 38.38 2kui h ASN 511 CO -0.08 0.40 0.64 -0.07 -1.65 0.00 0.00 177.43 176.67 2kui h LEU 512 N 0.31 1.10 -0.93 1.61 -0.00 -0.82 -2.03 115.31 114.55 2kui h LEU 512 Ca 0.09 -0.03 -0.06 0.00 -0.00 0.00 0.00 57.88 57.89 2kui h LEU 512 Cb 0.13 -0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 40.49 2kui h LEU 512 CO -0.01 0.79 0.15 0.78 -0.00 0.00 0.00 178.44 180.15 2kui h ASN 513 N 1.30 0.88 0.08 -0.43 -0.26 -0.59 -1.55 115.58 115.00 2kui h ASN 513 Ca 0.35 -0.17 -0.03 0.00 -0.56 0.00 0.00 56.30 55.90 2kui h ASN 513 Cb -0.14 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 36.88 2kui h ASN 513 CO -0.08 0.85 -0.10 0.58 -1.06 0.00 0.00 177.43 177.62 2kui h VAL 514 N 0.90 1.10 -0.09 2.81 2.07 -0.42 -0.80 116.25 121.82 2kui h VAL 514 Ca 0.20 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2kui h VAL 514 Cb 0.31 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 2kui h VAL 514 CO -0.00 0.13 0.00 -1.22 0.02 0.00 0.00 177.57 176.50 2kui n TYR 515 N -4.39 0.12 0.00 1.57 4.01 -0.67 -4.83 117.16 112.98 2kui n TYR 515 Ca -0.02 -0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2kui n TYR 515 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 2kui n TYR 515 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kui n GLY 516 N 0.76 1.02 3.49 2.72 0.00 -0.31 -4.96 105.19 107.90 2kui n GLY 516 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.31 3.30 -2.33 1.61 0.08 -0.72 -4.68 117.98 112.93 2kui s PHE 517 Ca 0.00 -1.93 0.22 0.00 0.12 0.00 0.00 56.93 55.35 2kui s PHE 517 Cb 0.00 -4.41 0.81 0.00 -0.57 0.00 0.00 43.02 38.86 2kui s PHE 517 CO 0.00 -1.50 1.59 0.25 -0.10 0.00 0.00 175.22 175.46 2kui n THR 518 N 5.10 0.17 -3.76 0.64 -2.24 -1.26 -2.95 114.28 109.98 2kui n THR 518 Ca 0.38 -0.33 -0.37 0.00 -2.27 0.00 0.00 64.05 61.45 2kui n THR 518 Cb 0.44 0.41 -0.13 0.00 -2.10 0.00 0.00 70.33 68.96 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 -1.83 2.95 0.12 -0.78 1.02 -1.26 -5.03 119.74 114.93 2kui s LYS 519 Ca 0.34 -0.95 0.05 0.00 0.02 0.00 0.00 55.97 55.42 2kui s LYS 519 Cb 0.18 -3.39 -0.04 0.00 -0.52 0.00 0.00 37.83 34.06 2kui s LYS 519 CO 0.28 -0.51 -0.11 -0.59 -0.92 0.00 0.00 175.35 173.50 2kui s PHE 520 N 1.47 1.22 0.02 3.18 -0.12 -1.26 -1.46 117.98 121.03 2kui s PHE 520 Ca 0.01 -0.66 0.01 0.00 -0.05 0.00 0.00 56.93 56.25 2kui s PHE 520 Cb -0.18 -0.64 -0.01 0.00 -0.63 0.00 0.00 43.02 41.56 2kui s PHE 520 CO 0.02 0.07 -0.05 -1.12 -0.05 0.00 0.00 175.22 174.09 2kui s SER 521 N -2.68 0.59 -0.09 1.98 0.01 0.07 -4.84 113.70 108.75 2kui s SER 521 Ca 0.10 -0.33 0.03 0.00 1.31 0.00 0.00 55.95 57.06 2kui s SER 521 Cb -0.02 0.01 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 2kui s SER 521 CO 0.01 -0.11 -0.19 -1.10 0.41 0.00 0.00 173.24 172.26 2kui s GLN 522 N -0.90 2.94 -0.00 12.44 -1.52 -1.26 0.10 119.66 131.46 2kui s GLN 522 Ca -0.06 -0.79 0.06 0.00 -1.95 0.00 0.00 55.36 52.62 2kui s GLN 522 Cb -0.06 -2.39 -0.02 0.00 -0.22 0.00 0.00 33.01 30.32 2kui s GLN 522 CO -0.00 0.32 -0.20 0.00 -0.25 0.00 0.00 175.29 175.15 2kui s ALA 523 N 0.04 1.69 -0.22 6.09 0.00 -0.34 -4.96 121.76 124.06 2kui s ALA 523 Ca -0.07 -0.91 -0.05 0.00 0.00 0.00 0.00 51.96 50.93 2kui s ALA 523 Cb -0.15 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 2kui s ALA 523 CO 0.05 0.41 -0.01 -1.12 0.00 0.00 0.00 175.76 175.08 2kui s SER 524 N -0.63 4.54 0.32 0.00 0.01 -1.26 -0.03 113.70 116.65 2kui s SER 524 Ca 0.08 -0.33 0.09 0.00 1.31 0.00 0.00 55.95 57.10 2kui s SER 524 Cb -0.08 -1.79 -0.06 0.00 0.21 0.00 0.00 66.02 64.30 2kui s SER 524 CO -0.00 -0.01 -0.11 0.68 0.41 0.00 0.00 173.24 174.21 2kui s VAL 525 N 1.43 2.19 -0.02 3.43 -7.23 0.54 -4.96 120.40 115.77 2kui s VAL 525 Ca 0.05 -2.23 -0.19 0.00 -1.81 0.00 0.00 61.98 57.81 2kui s VAL 525 Cb -0.14 -2.56 -0.05 0.00 0.56 0.00 0.00 36.38 34.18 2kui s VAL 525 CO -0.01 -0.25 0.52 1.51 -0.31 0.00 0.00 175.10 176.56 2kui s ASP 526 N -3.57 6.87 0.38 4.85 -4.77 -1.26 -0.46 116.67 118.71 2kui s ASP 526 Ca 0.32 1.04 -0.15 0.00 -3.30 0.00 0.00 52.55 50.45 2kui s ASP 526 Cb 0.01 -2.32 0.06 0.00 -1.09 0.00 0.00 42.92 39.59 2kui s ASP 526 CO 0.15 0.14 0.82 -1.20 0.70 0.00 0.00 175.17 175.78 2kui n SER 527 N 2.67 -2.26 0.14 2.11 7.64 -0.88 -4.85 113.62 118.20 2kui n SER 527 Ca -0.09 -2.54 0.12 0.00 1.01 0.00 0.00 58.87 57.37 2kui n SER 527 Cb 0.51 3.76 0.10 0.00 -1.01 0.00 0.00 64.21 67.58 2kui n SER 527 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2kui h PRO 528 N 0.00 0.00 -6.77 1.43 0.11 -1.78 -3.37 132.00 121.62 2kui h PRO 528 Ca -0.33 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.26 2kui h PRO 528 Cb 1.24 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.39 2kui h PRO 528 CO 0.42 0.00 0.63 1.03 -0.21 0.00 0.00 178.00 179.87 2kui s ARG 529 N -3.27 4.41 0.48 1.05 0.52 -1.26 -4.62 118.95 116.25 2kui s ARG 529 Ca 0.04 2.09 -0.23 0.00 -0.52 0.00 0.00 55.73 57.10 2kui s ARG 529 Cb 0.08 -3.15 -0.08 0.00 0.52 0.00 0.00 34.95 32.33 2kui s ARG 529 CO 0.73 -0.17 1.22 -0.35 0.02 0.00 0.00 175.30 176.74 2kui n PRO 530 N 1.78 1.66 -2.00 3.54 -0.04 -1.26 -2.41 135.00 136.26 2kui n PRO 530 Ca 0.03 0.60 -0.43 0.00 -0.04 0.00 0.00 63.50 63.66 2kui n PRO 530 Cb 0.43 -2.36 -0.03 0.00 -0.04 0.00 0.00 33.50 31.50 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui s ALA 531 N -1.27 3.29 0.00 0.55 0.00 -1.22 -2.33 121.76 120.77 2kui s ALA 531 Ca 0.66 0.64 0.00 0.00 0.00 0.00 0.00 51.96 53.26 2kui s ALA 531 Cb -0.48 -3.86 0.00 0.00 0.00 0.00 0.00 23.12 18.78 2kui s ALA 531 CO 0.54 -1.94 0.00 0.41 0.00 0.00 0.00 175.76 174.78 2kui n GLY 532 N 4.70 1.34 3.71 0.00 0.00 -1.16 -4.91 105.19 108.86 2kui n GLY 532 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 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 4.47 -0.57 1.61 2.12 -0.98 -1.16 118.70 124.19 2kui s GLU 533 Ca 0.00 1.16 -0.26 0.00 0.36 0.00 0.00 54.97 56.23 2kui s GLU 533 Cb 0.00 -3.47 0.04 0.00 0.26 0.00 0.00 34.13 30.95 2kui s GLU 533 CO 0.00 -0.06 1.07 0.08 -0.54 0.00 0.00 175.26 175.81 2kui s VAL 534 N 1.14 4.20 -0.56 3.70 1.01 0.95 -1.43 120.40 129.41 2kui s VAL 534 Ca 0.44 0.57 0.24 0.00 0.00 0.00 0.00 61.98 63.24 2kui s VAL 534 Cb -0.19 -4.64 0.20 0.00 0.00 0.00 0.00 36.38 31.75 2kui s VAL 534 CO 0.22 -1.24 1.51 0.74 0.00 0.00 0.00 175.10 176.32 2kui h THR 535 N 6.08 0.00 0.00 3.92 2.02 -1.39 0.36 112.91 123.90 2kui h THR 535 Ca -0.26 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.24 2kui h THR 535 Cb 1.06 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.98 2kui h THR 535 CO 1.14 0.00 0.00 0.61 0.37 0.00 0.00 175.52 177.64 2kui n GLY 536 N 1.25 -0.67 3.32 2.16 0.00 -1.15 -4.38 105.19 105.72 2kui n GLY 536 Ca 0.04 -0.80 -0.17 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.00 1.60 -0.06 2.61 -4.23 -1.26 -0.47 115.64 110.83 2kui s THR 537 Ca 0.00 -2.18 -0.25 0.00 -1.18 0.00 0.00 61.69 58.09 2kui s THR 537 Cb 0.00 -2.00 -0.20 0.00 1.34 0.00 0.00 72.50 71.64 2kui s THR 537 CO 0.00 -0.63 1.02 -1.13 -0.54 0.00 0.00 174.62 173.34 2kui h ASN 538 N 2.61 -0.06 -2.99 3.99 -1.24 -1.41 -3.43 115.58 113.05 2kui h ASN 538 Ca -0.38 -0.55 -0.53 0.00 0.71 0.00 0.00 56.30 55.56 2kui h ASN 538 Cb 1.21 0.02 0.04 0.00 0.73 0.00 0.00 38.32 40.32 2kui h ASN 538 CO 0.62 0.55 0.79 -2.16 -1.29 0.00 0.00 177.43 175.95 2kui s PRO 539 N -3.53 4.27 0.42 6.67 0.04 -1.26 -4.96 135.00 136.66 2kui s PRO 539 Ca -0.15 2.23 -0.26 0.00 0.04 0.00 0.00 61.00 62.85 2kui s PRO 539 Cb 0.00 -3.19 -0.09 0.00 0.04 0.00 0.00 34.50 31.27 2kui s PRO 539 CO 0.61 -0.50 1.42 -2.14 0.04 0.00 0.00 177.00 176.42 2kui s PRO 540 N 0.87 3.84 0.38 0.56 0.02 -1.26 -4.96 135.00 134.45 2kui s PRO 540 Ca 0.66 2.40 -0.27 0.00 0.02 0.00 0.00 61.00 63.81 2kui s PRO 540 Cb -0.40 -2.75 -0.09 0.00 0.02 0.00 0.00 34.50 31.27 2kui s PRO 540 CO 0.33 -0.69 1.29 0.00 -0.33 0.00 0.00 177.00 177.61 2kui s ALA 541 N -1.19 3.34 0.00 -1.55 0.00 -1.26 -2.40 121.76 118.70 2kui s ALA 541 Ca 0.58 1.22 0.00 0.00 0.00 0.00 0.00 51.96 53.77 2kui s ALA 541 Cb -0.43 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.21 2kui s ALA 541 CO 0.56 -0.73 0.00 0.41 0.00 0.00 0.00 175.76 176.00 2kui n GLY 542 N 0.71 3.39 3.75 0.00 0.00 0.13 -4.97 105.19 108.20 2kui n GLY 542 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.94 3.86 -0.22 2.61 2.01 -1.01 -4.68 115.64 115.28 2kui s THR 543 Ca 0.00 1.71 -0.16 0.00 0.31 0.00 0.00 61.69 63.55 2kui s THR 543 Cb 0.00 -4.09 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 2kui s THR 543 CO 0.00 0.35 0.42 -0.89 -0.69 0.00 0.00 174.62 173.80 2kui s THR 544 N -0.65 5.17 0.16 -0.82 2.01 -1.26 -1.64 115.64 118.61 2kui s THR 544 Ca 0.46 0.72 0.06 0.00 0.31 0.00 0.00 61.69 63.25 2kui s THR 544 Cb -0.29 -3.74 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2kui s THR 544 CO 0.36 0.22 -0.13 0.68 -0.69 0.00 0.00 174.62 175.05 2kui s VAL 545 N 1.54 1.41 0.43 3.82 -7.23 0.15 -4.88 120.40 115.64 2kui s VAL 545 Ca 0.19 -1.98 -0.25 0.00 -1.81 0.00 0.00 61.98 58.13 2kui s VAL 545 Cb -0.15 -1.79 -0.08 0.00 0.56 0.00 0.00 36.38 34.92 2kui s VAL 545 CO 0.08 -0.57 1.28 -2.84 -0.31 0.00 0.00 175.10 172.74 2kui s PRO 546 N -3.31 3.86 0.54 4.82 0.02 -1.26 -0.24 135.00 139.44 2kui s PRO 546 Ca 0.16 2.09 0.35 0.00 0.02 0.00 0.00 61.00 63.62 2kui s PRO 546 Cb -0.01 -2.66 1.66 0.00 0.02 0.00 0.00 34.50 33.51 2kui s PRO 546 CO 0.03 -0.56 2.06 -0.39 -0.33 0.00 0.00 177.00 177.81 2kui h VAL 547 N 2.28 0.00 -0.01 3.83 -1.51 -1.62 -0.98 116.25 118.24 2kui h VAL 547 Ca -0.50 -0.28 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2kui h VAL 547 Cb 1.25 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 31.63 2kui h VAL 547 CO 0.62 0.00 -0.08 -0.67 -1.23 0.00 0.00 177.57 176.21 2kui n ASP 548 N -2.93 0.97 -4.90 4.19 2.03 -1.26 -4.71 116.55 109.94 2kui n ASP 548 Ca -0.01 -1.11 -0.28 0.00 0.52 0.00 0.00 54.79 53.92 2kui n ASP 548 Cb 0.20 0.01 -0.02 0.00 -0.72 0.00 0.00 41.12 40.60 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 -2.21 6.38 -0.09 1.67 0.15 -0.37 -5.04 113.70 114.19 2kui s SER 549 Ca 0.35 0.87 -0.12 0.00 0.70 0.00 0.00 55.95 57.75 2kui s SER 549 Cb 0.21 -2.22 -0.05 0.00 -1.71 0.00 0.00 66.02 62.25 2kui s SER 549 CO 0.41 -0.40 0.29 -0.69 1.20 0.00 0.00 173.24 174.05 2kui s VAL 550 N -2.42 5.27 -0.06 4.45 1.01 -1.26 -4.62 120.40 122.76 2kui s VAL 550 Ca 0.47 0.55 0.03 0.00 0.00 0.00 0.00 61.98 63.02 2kui s VAL 550 Cb -0.10 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 2kui s VAL 550 CO 0.36 0.53 -0.13 -0.63 0.00 0.00 0.00 175.10 175.23 2kui s ILE 551 N -0.54 3.14 -0.26 2.22 1.09 -0.54 -4.97 121.20 121.34 2kui s ILE 551 Ca 0.19 -0.68 -0.10 0.00 -1.10 0.00 0.00 60.65 58.96 2kui s ILE 551 Cb -0.14 -2.25 -0.04 0.00 -1.06 0.00 0.00 42.46 38.97 2kui s ILE 551 CO 0.07 0.58 0.14 -0.70 -0.10 0.00 0.00 174.94 174.94 2kui s GLU 552 N -0.59 3.88 -0.13 2.79 2.12 -1.26 -0.75 118.70 124.76 2kui s GLU 552 Ca 0.08 -0.36 -0.14 0.00 0.36 0.00 0.00 54.97 54.91 2kui s GLU 552 Cb -0.11 -3.52 -0.05 0.00 0.26 0.00 0.00 34.13 30.70 2kui s GLU 552 CO 0.01 -0.13 0.32 -0.51 -0.54 0.00 0.00 175.26 174.41 2kui s LEU 553 N 1.56 4.29 -0.24 2.70 1.02 0.11 -0.98 118.68 127.14 2kui s LEU 553 Ca 0.07 0.60 -0.07 0.00 0.02 0.00 0.00 54.13 54.75 2kui s LEU 553 Cb -0.15 -2.42 -0.03 0.00 0.02 0.00 0.00 46.19 43.61 2kui s LEU 553 CO 0.08 0.14 0.06 0.00 0.02 0.00 0.00 176.35 176.64 2kui s GLN 554 N 0.18 3.62 -0.15 1.70 -2.07 0.38 -1.20 119.66 122.12 2kui s GLN 554 Ca 0.18 -0.49 -0.09 0.00 -1.82 0.00 0.00 55.36 53.14 2kui s GLN 554 Cb -0.14 -3.28 -0.04 0.00 -1.09 0.00 0.00 33.01 28.46 2kui s GLN 554 CO 0.06 -0.18 0.15 0.08 -1.32 0.00 0.00 175.29 174.08 2kui s VAL 555 N 1.58 5.45 0.22 3.63 1.01 0.95 -1.10 120.40 132.13 2kui s VAL 555 Ca 0.06 0.24 -0.10 0.00 0.00 0.00 0.00 61.98 62.18 2kui s VAL 555 Cb -0.15 -3.45 -0.07 0.00 0.00 0.00 0.00 36.38 32.71 2kui s VAL 555 CO 0.03 0.54 0.55 -0.44 0.00 0.00 0.00 175.10 175.78 2kui s SER 556 N -0.42 6.66 0.02 3.32 0.01 -0.51 -0.34 113.70 122.44 2kui s SER 556 Ca 0.13 0.95 0.01 0.00 1.31 0.00 0.00 55.95 58.34 2kui s SER 556 Cb -0.12 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 63.84 2kui s SER 556 CO 0.02 -0.05 0.06 -1.59 0.41 0.00 0.00 173.24 172.09 2kui s LYS 557 N -2.68 2.93 0.21 12.44 -2.85 0.39 -2.99 119.74 127.18 2kui s LYS 557 Ca 0.46 -0.58 0.16 0.00 -1.00 0.00 0.00 55.97 55.01 2kui s LYS 557 Cb -0.12 -2.77 0.00 0.00 -2.06 0.00 0.00 37.83 32.89 2kui s LYS 557 CO 0.21 0.62 1.21 0.78 0.10 0.00 0.00 175.35 178.26 2kui h GLY 558 N 3.91 0.00 0.00 0.59 0.00 -1.63 -2.34 103.07 103.60 2kui h GLY 558 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2kui h GLY 558 CO 0.62 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.86 2kui n ASN 559 N -3.07 -2.66 -3.77 0.19 3.02 -1.26 -4.45 115.26 103.26 2kui n ASN 559 Ca -0.02 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.40 2kui n ASN 559 Cb 0.75 -1.69 -0.11 0.00 -0.61 0.00 0.00 39.78 38.12 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2kui s GLN 560 N -0.79 0.41 0.00 3.52 2.00 -1.26 -0.76 119.66 122.78 2kui s GLN 560 Ca 0.00 0.30 -0.06 0.00 -2.00 0.00 0.00 55.36 53.60 2kui s GLN 560 Cb 0.00 0.19 -0.00 0.00 0.80 0.00 0.00 33.01 34.00 2kui s GLN 560 CO 0.00 -0.07 0.11 -0.59 -0.50 0.00 0.00 175.29 174.24 2kui s PHE 561 N -0.12 0.07 -0.24 1.67 -0.71 0.28 -4.89 117.98 114.04 2kui s PHE 561 Ca -0.03 -0.18 -0.27 0.00 -1.04 0.00 0.00 56.93 55.41 2kui s PHE 561 Cb -0.03 -0.07 0.00 0.00 -1.21 0.00 0.00 43.02 41.72 2kui s PHE 561 CO 0.01 -0.26 0.94 0.54 -1.34 0.00 0.00 175.22 175.10 2kui s VAL 562 N -1.34 4.75 -0.14 -2.49 0.11 -1.26 0.00 120.40 120.03 2kui s VAL 562 Ca -0.14 1.78 -0.11 0.00 -2.93 0.00 0.00 61.98 60.57 2kui s VAL 562 Cb -0.08 -4.22 -0.05 0.00 -1.53 0.00 0.00 36.38 30.51 2kui s VAL 562 CO 0.01 -0.14 0.23 -0.32 -3.33 0.00 0.00 175.10 171.55 2kui s MET 563 N 3.04 3.98 1.11 1.54 1.75 -1.07 -4.95 119.30 124.71 2kui s MET 563 Ca 0.39 -0.00 -0.13 0.00 -1.25 0.00 0.00 55.69 54.71 2kui s MET 563 Cb -0.15 -3.33 0.25 0.00 2.84 0.00 0.00 34.83 34.44 2kui s MET 563 CO 0.07 0.46 1.05 -2.14 -0.65 0.00 0.00 175.02 173.81 2kui s PRO 564 N -0.16 -0.51 0.14 4.11 0.02 -1.26 -0.01 135.00 137.33 2kui s PRO 564 Ca 0.15 0.71 -0.31 0.00 0.02 0.00 0.00 61.00 61.57 2kui s PRO 564 Cb -0.13 -1.61 -0.08 0.00 0.02 0.00 0.00 34.50 32.70 2kui s PRO 564 CO 0.04 -3.42 1.38 0.34 -0.33 0.00 0.00 177.00 175.01 2kui s ASP 565 N -2.85 6.83 0.00 2.53 2.15 -1.26 -3.94 116.67 120.14 2kui s ASP 565 Ca 0.67 2.36 0.05 0.00 0.43 0.00 0.00 52.55 56.06 2kui s ASP 565 Cb -0.23 -2.59 0.09 0.00 -0.30 0.00 0.00 42.92 39.89 2kui s ASP 565 CO 0.62 -0.63 0.91 0.18 -0.17 0.00 0.00 175.17 176.08 2kui n LEU 566 N 3.62 0.09 -4.79 -1.34 4.77 -1.26 -5.00 117.00 113.09 2kui n LEU 566 Ca 0.10 -1.32 -0.36 0.00 -0.03 0.00 0.00 56.01 54.41 2kui n LEU 566 Cb 0.42 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.45 2kui n LEU 566 CO 0.59 0.62 0.66 -0.44 -1.33 0.00 0.00 177.39 177.49 2kui s SER 567 N -0.96 7.13 0.00 -1.43 0.01 -1.26 -4.11 113.70 113.08 2kui s SER 567 Ca 0.07 1.82 0.00 0.00 1.31 0.00 0.00 55.95 59.15 2kui s SER 567 Cb 0.08 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.74 2kui s SER 567 CO -0.03 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2kui n GLY 568 N 0.17 0.73 2.02 3.44 0.00 -1.26 -5.05 105.19 105.24 2kui n GLY 568 Ca 0.04 -0.70 -0.13 0.00 0.00 0.00 0.00 46.02 45.23 2kui n GLY 568 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2kui n MET 569 N -0.79 1.01 -4.20 1.61 2.00 -1.26 -4.89 117.12 110.61 2kui n MET 569 Ca 0.00 -1.79 -0.26 0.00 0.00 0.00 0.00 57.70 55.66 2kui n MET 569 Cb 0.43 0.14 -0.07 0.00 0.00 0.00 0.00 33.22 33.72 2kui n MET 569 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2kui s PHE 570 N -1.34 2.87 0.50 2.03 0.08 -1.26 -1.26 117.98 119.61 2kui s PHE 570 Ca 0.19 -0.14 0.15 0.00 0.12 0.00 0.00 56.93 57.25 2kui s PHE 570 Cb -0.02 -1.37 1.20 0.00 -0.57 0.00 0.00 43.02 42.27 2kui s PHE 570 CO 0.12 0.53 2.13 2.35 -0.10 0.00 0.00 175.22 180.26 2kui h TRP 571 N 2.45 0.09 0.00 0.36 7.01 -1.03 0.10 115.95 124.93 2kui h TRP 571 Ca -0.47 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 60.53 2kui h TRP 571 Cb 1.21 -0.03 -0.00 0.00 -2.10 0.00 0.00 29.16 28.24 2kui h TRP 571 CO 0.62 0.05 -0.03 -0.24 -2.79 0.00 0.00 178.44 176.06 2kui h VAL 572 N 0.09 0.17 0.00 2.65 3.04 -1.95 -0.86 116.25 119.39 2kui h VAL 572 Ca 0.03 -0.27 -0.37 0.00 -1.01 0.00 0.00 66.70 65.08 2kui h VAL 572 Cb 0.01 1.22 -0.06 0.00 -2.01 0.00 0.00 31.29 30.44 2kui h VAL 572 CO -0.01 0.03 -2.37 -0.67 -1.01 0.00 0.00 177.57 173.55 2kui n ASP 573 N -3.27 2.09 -0.08 3.17 2.03 -0.22 -4.54 116.55 115.73 2kui n ASP 573 Ca -0.02 -0.05 -0.10 0.00 0.52 0.00 0.00 54.79 55.14 2kui n ASP 573 Cb 0.17 -0.44 -0.03 0.00 -0.72 0.00 0.00 41.12 40.10 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kui h ALA 574 N -0.16 0.35 0.11 -1.67 0.00 -0.60 -2.44 119.26 114.84 2kui h ALA 574 Ca -0.55 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.27 2kui h ALA 574 Cb 1.78 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 19.42 2kui h ALA 574 CO -0.14 -0.07 -0.31 1.49 0.00 0.00 0.00 179.25 180.22 2kui h GLU 575 N 0.29 -0.50 0.00 0.00 4.57 -1.42 -1.57 114.58 115.95 2kui h GLU 575 Ca 0.09 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 2kui h GLU 575 Cb 0.15 0.11 -0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2kui h GLU 575 CO -0.01 -0.34 -0.06 -1.00 -1.18 0.00 0.00 179.01 176.43 2kui h PRO 576 N -0.52 0.00 -0.36 0.92 0.13 -1.79 -2.91 132.00 127.48 2kui h PRO 576 Ca 0.03 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 65.19 2kui h PRO 576 Cb 0.56 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.66 2kui h PRO 576 CO -0.19 0.06 0.17 0.00 -0.23 0.00 0.00 178.00 177.81 2kui h ARG 577 N 0.00 0.35 -0.90 0.86 2.47 -0.78 0.11 114.38 116.48 2kui h ARG 577 Ca -0.00 -0.02 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 2kui h ARG 577 Cb 0.11 -0.08 -0.04 0.00 -1.65 0.00 0.00 29.97 28.31 2kui h ARG 577 CO 0.01 0.23 0.53 -0.07 0.56 0.00 0.00 179.97 181.22 2kui h LEU 578 N 0.36 1.10 -0.22 3.04 4.07 -1.29 0.19 115.31 122.55 2kui h LEU 578 Ca 0.15 -0.08 -0.02 0.00 0.08 0.00 0.00 57.88 58.01 2kui h LEU 578 Cb 0.07 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.52 2kui h LEU 578 CO -0.11 0.85 0.05 0.03 -1.08 0.00 0.00 178.44 178.18 2kui h ARG 579 N 1.25 0.36 -0.26 1.13 3.08 -1.30 -1.30 114.38 117.34 2kui h ARG 579 Ca 0.32 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 60.18 2kui h ARG 579 Cb -0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.96 2kui h ARG 579 CO -0.06 0.48 -0.27 0.00 -1.07 0.00 0.00 179.97 179.06 2kui h ALA 580 N 0.86 1.05 -0.00 0.04 0.00 -0.37 -2.91 119.26 117.93 2kui h ALA 580 Ca 0.07 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2kui h ALA 580 Cb 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2kui h ALA 580 CO 0.00 0.58 -0.06 1.28 0.00 0.00 0.00 179.25 181.05 2kui n LEU 581 N -4.11 0.11 -1.37 0.00 4.77 0.02 -4.89 117.00 111.53 2kui n LEU 581 Ca -0.00 0.30 -0.07 0.00 -0.03 0.00 0.00 56.01 56.21 2kui n LEU 581 Cb 0.42 -0.35 0.02 0.00 -2.33 0.00 0.00 43.42 41.18 2kui n LEU 581 CO 0.43 0.02 0.07 0.61 -1.33 0.00 0.00 177.39 177.19 2kui n GLY 582 N 1.38 0.53 3.74 -0.72 0.00 -1.09 -4.99 105.19 104.05 2kui n GLY 582 Ca 0.11 -0.42 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.09 3.42 -0.33 1.61 -0.00 -0.51 -5.01 118.94 115.03 2kui s TRP 583 Ca 0.16 1.46 0.01 0.00 -0.00 0.00 0.00 56.10 57.73 2kui s TRP 583 Cb -0.07 -3.43 0.14 0.00 -0.00 0.00 0.00 33.47 30.11 2kui s TRP 583 CO 0.20 -1.17 0.32 0.99 -0.00 0.00 0.00 176.95 177.30 2kui s THR 584 N -0.29 -0.33 0.00 5.86 2.01 -1.26 -4.90 115.64 116.74 2kui s THR 584 Ca 0.51 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.73 2kui s THR 584 Cb -0.33 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.32 2kui s THR 584 CO 0.38 -0.56 0.00 0.61 -0.69 0.00 0.00 174.62 174.37 2kui n GLY 585 N 4.77 3.33 3.48 4.40 0.00 -1.21 -4.68 105.19 115.29 2kui n GLY 585 Ca 0.04 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 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 3.51 3.23 -0.13 1.61 -1.94 -1.26 -5.01 119.30 119.30 2kui s MET 586 Ca 0.00 -0.59 -0.00 0.00 -1.71 0.00 0.00 55.69 53.39 2kui s MET 586 Cb 0.00 -2.69 -0.01 0.00 2.01 0.00 0.00 34.83 34.13 2kui s MET 586 CO 0.00 0.39 -0.14 -1.17 -0.01 0.00 0.00 175.02 174.09 2kui s LEU 587 N -0.07 2.67 -0.52 -0.03 2.96 -1.26 -2.39 118.68 120.03 2kui s LEU 587 Ca -0.00 -0.35 -0.14 0.00 -0.22 0.00 0.00 54.13 53.41 2kui s LEU 587 Cb -0.13 -1.60 0.13 0.00 0.50 0.00 0.00 46.19 45.08 2kui s LEU 587 CO 0.03 0.15 0.46 -0.62 -1.32 0.00 0.00 176.35 175.06 2kui s ASP 588 N 0.43 6.08 -0.30 3.68 2.15 -0.90 -5.00 116.67 122.81 2kui s ASP 588 Ca -0.10 -1.81 -0.02 0.00 0.43 0.00 0.00 52.55 51.04 2kui s ASP 588 Cb -0.16 -2.16 0.05 0.00 -0.30 0.00 0.00 42.92 40.34 2kui s ASP 588 CO 0.05 -0.82 -0.00 -0.75 -0.17 0.00 0.00 175.17 173.48 2kui s LYS 589 N 1.55 2.49 0.00 4.34 2.20 -1.26 -3.82 119.74 125.24 2kui s LYS 589 Ca 0.04 -1.23 0.00 0.00 -0.36 0.00 0.00 55.97 54.42 2kui s LYS 589 Cb -0.29 -3.18 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 2kui s LYS 589 CO 0.02 -0.60 0.00 0.41 -0.36 0.00 0.00 175.35 174.82 2kui n GLY 590 N 4.64 1.37 3.94 5.54 0.00 -1.26 -5.09 105.19 114.32 2kui n GLY 590 Ca -0.13 -1.73 -0.27 0.00 0.00 0.00 0.00 46.02 43.89 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 -3.40 3.96 0.50 4.61 0.00 -1.26 -5.08 121.76 121.08 2kui s ALA 591 Ca 0.00 -1.02 -0.20 0.00 0.00 0.00 0.00 51.96 50.74 2kui s ALA 591 Cb 0.00 -1.77 -0.08 0.00 0.00 0.00 0.00 23.12 21.27 2kui s ALA 591 CO 0.00 0.56 1.07 0.16 0.00 0.00 0.00 175.76 177.55 2kui s ASP 592 N -3.16 6.19 -0.03 0.00 -4.77 -1.26 -4.93 116.67 108.71 2kui s ASP 592 Ca 0.34 2.01 0.00 0.00 -3.30 0.00 0.00 52.55 51.60 2kui s ASP 592 Cb -0.11 -2.57 0.03 0.00 -1.09 0.00 0.00 42.92 39.18 2kui s ASP 592 CO 0.28 -0.89 0.01 -0.69 0.70 0.00 0.00 175.17 174.58 2kui s VAL 593 N -1.91 0.10 -0.54 2.11 1.01 0.12 -4.91 120.40 116.39 2kui s VAL 593 Ca 0.68 0.12 -0.28 0.00 0.00 0.00 0.00 61.98 62.50 2kui s VAL 593 Cb -0.19 -0.21 0.02 0.00 0.00 0.00 0.00 36.38 36.00 2kui s VAL 593 CO 0.22 0.12 1.31 -1.81 0.00 0.00 0.00 175.10 174.95 2kui s ASP 594 N 1.00 6.32 0.00 3.32 1.11 -1.26 -2.18 116.67 124.98 2kui s ASP 594 Ca -0.10 0.33 0.00 0.00 0.18 0.00 0.00 52.55 52.97 2kui s ASP 594 Cb -0.13 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.31 2kui s ASP 594 CO -0.02 -1.55 0.00 0.00 1.18 0.00 0.00 175.17 174.78 2kui n ALA 595 N 8.91 1.37 0.00 5.23 0.00 -1.26 -5.06 120.51 129.70 2kui n ALA 595 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 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 1.71 3.77 0.36 0.00 0.00 -1.26 -4.86 105.19 104.91 2kui n GLY 596 Ca 0.00 -1.73 0.09 0.00 0.00 0.00 0.00 46.02 44.38 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 0.89 2.00 -0.02 0.00 -1.99 0.04 103.07 103.99 2kui h GLY 597 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 2kui h GLY 597 CO 0.00 0.16 -0.06 1.76 0.00 0.00 0.00 176.54 178.40 2kui h SER 598 N 0.63 0.00 0.00 0.19 0.02 -2.03 -2.38 113.55 109.98 2kui h SER 598 Ca 0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2kui h SER 598 Cb 0.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.00 2kui h SER 598 CO -0.12 0.06 -0.80 0.00 -1.14 0.00 0.00 176.83 174.83 2kui n GLN 599 N -3.67 2.15 -2.62 3.45 1.13 -0.08 -4.84 117.38 112.89 2kui n GLN 599 Ca -0.02 -0.02 -0.41 0.00 -1.94 0.00 0.00 57.00 54.60 2kui n GLN 599 Cb 0.16 -1.18 -0.04 0.00 0.11 0.00 0.00 30.24 29.30 2kui n GLN 599 CO 0.00 0.00 0.00 -1.01 -1.44 0.00 0.00 177.06 174.61 2kui s HIS 600 N -2.40 3.67 0.00 1.08 3.76 -0.71 -0.18 115.29 120.50 2kui s HIS 600 Ca 0.04 1.65 0.00 0.00 -0.15 0.00 0.00 55.06 56.60 2kui s HIS 600 Cb 0.10 -3.19 0.00 0.00 1.11 0.00 0.00 32.58 30.61 2kui s HIS 600 CO 0.57 -0.29 0.00 -1.71 -0.85 0.00 0.00 174.74 172.46 2kui n ASN 601 N 2.99 0.00 -4.88 1.40 5.15 -1.23 -4.82 115.26 113.88 2kui n ASN 601 Ca 0.04 0.00 -0.32 0.00 -0.60 0.00 0.00 54.58 53.70 2kui n ASN 601 Cb 0.48 -0.21 -0.05 0.00 -0.53 0.00 0.00 39.78 39.47 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 2kui s ARG 602 N 0.00 3.79 0.25 1.20 3.52 -1.25 -0.35 118.95 126.10 2kui s ARG 602 Ca 0.00 0.24 -0.30 0.00 -0.13 0.00 0.00 55.73 55.54 2kui s ARG 602 Cb 0.00 -2.69 -0.11 0.00 -1.56 0.00 0.00 34.95 30.60 2kui s ARG 602 CO 0.00 0.34 1.55 0.54 -0.81 0.00 0.00 175.30 176.93 2kui s VAL 603 N -1.78 2.35 -0.20 7.11 0.11 -0.39 -4.25 120.40 123.35 2kui s VAL 603 Ca 0.46 0.28 -0.19 0.00 -2.93 0.00 0.00 61.98 59.61 2kui s VAL 603 Cb -0.11 -3.18 -0.19 0.00 -1.53 0.00 0.00 36.38 31.36 2kui s VAL 603 CO 0.21 0.04 0.18 0.52 -3.33 0.00 0.00 175.10 172.72 2kui n VAL 604 N 2.73 1.57 -3.70 2.04 0.31 0.12 -4.87 118.33 116.53 2kui n VAL 604 Ca 0.09 -0.15 -0.13 0.00 -0.01 0.00 0.00 64.34 64.14 2kui n VAL 604 Cb 0.38 -1.98 -0.07 0.00 -0.91 0.00 0.00 33.84 31.26 2kui n VAL 604 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 2kui s TYR 605 N -2.41 -0.24 -0.02 3.52 1.13 -1.26 -5.00 117.35 113.08 2kui s TYR 605 Ca -0.29 0.27 0.05 0.00 -1.41 0.00 0.00 57.07 55.70 2kui s TYR 605 Cb 0.07 0.17 -0.01 0.00 -1.10 0.00 0.00 41.96 41.08 2kui s TYR 605 CO 0.61 -0.50 -0.17 1.14 -2.51 0.00 0.00 175.55 174.12 2kui s GLN 606 N -1.97 1.47 0.03 -3.49 -2.07 -1.26 -3.29 119.66 109.08 2kui s GLN 606 Ca -0.09 -0.62 -0.11 0.00 -1.82 0.00 0.00 55.36 52.72 2kui s GLN 606 Cb -0.02 -1.40 -0.06 0.00 -1.09 0.00 0.00 33.01 30.45 2kui s GLN 606 CO 0.01 0.36 1.18 -0.97 -1.32 0.00 0.00 175.29 174.55 2kui h ASN 607 N 5.78 -0.45 -3.23 12.60 -0.73 -0.98 -3.41 115.58 125.17 2kui h ASN 607 Ca -0.36 0.04 -0.59 0.00 1.87 0.00 0.00 56.30 57.26 2kui h ASN 607 Cb 1.15 0.15 -0.08 0.00 0.27 0.00 0.00 38.32 39.81 2kui h ASN 607 CO 0.48 -0.21 -0.19 -2.16 -0.37 0.00 0.00 177.43 174.98 2kui s PRO 608 N -3.90 4.20 0.20 6.67 0.04 -1.26 -5.02 135.00 135.93 2kui s PRO 608 Ca -0.06 0.38 -0.30 0.00 0.04 0.00 0.00 61.00 61.06 2kui s PRO 608 Cb 0.01 -3.37 -0.09 0.00 0.04 0.00 0.00 34.50 31.10 2kui s PRO 608 CO 0.19 0.33 1.28 -2.14 0.04 0.00 0.00 177.00 176.70 2kui s PRO 609 N 0.09 4.41 0.10 0.56 0.02 -1.26 -4.97 135.00 133.95 2kui s PRO 609 Ca 0.24 2.01 -0.31 0.00 0.02 0.00 0.00 61.00 62.96 2kui s PRO 609 Cb -0.15 -3.20 -0.08 0.00 0.02 0.00 0.00 34.50 31.09 2kui s PRO 609 CO 0.10 -0.21 1.38 0.00 -0.33 0.00 0.00 177.00 177.94 2kui s ALA 610 N 0.02 3.58 0.00 -1.55 0.00 -1.26 -1.55 121.76 121.00 2kui s ALA 610 Ca 0.55 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2kui s ALA 610 Cb -0.36 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.23 2kui s ALA 610 CO 0.38 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.93 2kui n GLY 611 N 3.49 0.57 3.60 0.00 0.00 0.99 -4.56 105.19 109.28 2kui n GLY 611 Ca 0.11 0.00 -0.27 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 -2.00 2.18 0.01 2.61 2.01 -0.59 -4.86 115.64 115.00 2kui s THR 612 Ca 0.00 -2.05 -0.30 0.00 0.31 0.00 0.00 61.69 59.65 2kui s THR 612 Cb 0.00 -2.85 -0.06 0.00 0.01 0.00 0.00 72.50 69.61 2kui s THR 612 CO 0.00 -0.10 1.36 -0.83 -0.69 0.00 0.00 174.62 174.36 2kui s GLY 613 N -3.69 1.95 -0.03 4.40 0.00 -1.26 -2.59 107.32 106.10 2kui s GLY 613 Ca 0.34 0.88 -0.00 0.00 0.00 0.00 0.00 44.72 45.94 2kui s GLY 613 CO 0.18 2.42 0.03 -1.34 0.00 0.00 0.00 173.10 174.39 2kui s VAL 614 N 2.11 4.44 0.83 1.40 -7.23 0.10 -4.81 120.40 117.24 2kui s VAL 614 Ca 0.63 -0.42 -0.11 0.00 -1.81 0.00 0.00 61.98 60.27 2kui s VAL 614 Cb -0.31 -2.97 0.09 0.00 0.56 0.00 0.00 36.38 33.75 2kui s VAL 614 CO 0.27 0.43 1.10 0.54 -0.31 0.00 0.00 175.10 177.13 2kui s ASN 615 N -1.43 3.91 0.52 4.85 4.22 -1.26 -0.55 114.94 125.19 2kui s ASN 615 Ca 0.19 1.84 0.27 0.00 -2.14 0.00 0.00 52.86 53.01 2kui s ASN 615 Cb -0.12 -2.47 1.38 0.00 1.28 0.00 0.00 41.25 41.33 2kui s ASN 615 CO 0.09 -2.41 1.94 0.08 -2.04 0.00 0.00 177.10 174.75 2kui h ARG 616 N -1.39 0.06 -0.23 3.55 -0.00 -1.30 0.27 114.38 115.34 2kui h ARG 616 Ca -0.45 -0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 59.35 2kui h ARG 616 Cb 1.25 -0.01 -0.00 0.00 -0.00 0.00 0.00 29.97 31.20 2kui h ARG 616 CO 0.50 0.04 -0.56 -0.44 -0.00 0.00 0.00 179.97 179.51 2kui h ASP 617 N 0.06 0.77 0.00 0.08 5.19 -1.86 -3.47 116.42 117.20 2kui h ASP 617 Ca 0.35 -0.42 0.00 0.00 -0.62 0.00 0.00 57.03 56.34 2kui h ASP 617 Cb 1.30 -0.22 0.00 0.00 0.18 0.00 0.00 39.33 40.59 2kui h ASP 617 CO -0.03 1.17 0.00 0.61 -3.12 0.00 0.00 179.24 177.87 2kui n GLY 618 N 0.32 0.61 3.67 2.75 0.00 0.08 -3.32 105.19 109.30 2kui n GLY 618 Ca -0.04 -0.78 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 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 3.47 -0.12 -0.61 -1.16 -1.26 -4.79 121.20 114.73 2kui s ILE 619 Ca 0.00 0.71 0.01 0.00 -0.51 0.00 0.00 60.65 60.86 2kui s ILE 619 Cb 0.00 -3.46 0.02 0.00 0.61 0.00 0.00 42.46 39.63 2kui s ILE 619 CO 0.00 -0.04 -0.13 -0.51 -2.81 0.00 0.00 174.94 171.45 2kui s ILE 620 N 3.44 1.37 -0.19 2.00 1.10 -1.00 -4.59 121.20 123.33 2kui s ILE 620 Ca 0.72 -0.54 -0.02 0.00 -0.51 0.00 0.00 60.65 60.30 2kui s ILE 620 Cb -0.35 -1.29 -0.00 0.00 0.15 0.00 0.00 42.46 40.98 2kui s ILE 620 CO 0.30 0.42 -0.11 -0.89 -2.11 0.00 0.00 174.94 172.55 2kui s THR 621 N 1.25 2.88 0.07 4.00 2.01 -1.26 -2.13 115.64 122.45 2kui s THR 621 Ca -0.02 -0.67 0.00 0.00 0.31 0.00 0.00 61.69 61.31 2kui s THR 621 Cb -0.14 -2.26 -0.04 0.00 0.01 0.00 0.00 72.50 70.07 2kui s THR 621 CO -0.05 0.48 -0.04 -1.48 -0.69 0.00 0.00 174.62 172.84 2kui s LEU 622 N 1.21 2.48 0.04 4.42 -0.00 -1.25 -0.26 118.68 125.33 2kui s LEU 622 Ca 0.02 -0.98 0.02 0.00 -0.00 0.00 0.00 54.13 53.20 2kui s LEU 622 Cb -0.14 0.09 -0.02 0.00 -0.00 0.00 0.00 46.19 46.12 2kui s LEU 622 CO -0.05 -0.53 -0.08 -0.60 -0.00 0.00 0.00 176.35 175.09 2kui s ARG 623 N -3.76 0.56 0.09 1.48 6.06 -1.21 -4.68 118.95 117.48 2kui s ARG 623 Ca 0.08 -0.75 -0.02 0.00 -2.50 0.00 0.00 55.73 52.53 2kui s ARG 623 Cb 0.06 -0.36 -0.03 0.00 0.06 0.00 0.00 34.95 34.68 2kui s ARG 623 CO -0.08 0.07 0.04 -0.59 -2.50 0.00 0.00 175.30 172.24 2kui s PHE 624 N -1.30 0.59 0.00 5.12 -0.71 -1.26 0.16 117.98 120.57 2kui s PHE 624 Ca -0.09 -1.06 0.00 0.00 -1.04 0.00 0.00 56.93 54.74 2kui s PHE 624 Cb -0.10 -0.37 0.00 0.00 -1.21 0.00 0.00 43.02 41.34 2kui s PHE 624 CO 0.01 -0.46 0.00 0.41 -1.34 0.00 0.00 175.22 173.84 2kui n GLY 625 N 0.01 1.64 0.00 1.99 0.00 0.75 -4.59 105.19 104.98 2kui n GLY 625 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14