#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 4.64 0.13 -0.61 1.10 -1.26 -5.08 121.20 120.12 2kui s ILE 356 Ca 0.00 1.21 0.06 0.00 -0.51 0.00 0.00 60.65 61.41 2kui s ILE 356 Cb 0.00 -3.86 -0.04 0.00 0.15 0.00 0.00 42.46 38.71 2kui s ILE 356 CO 0.00 0.29 -0.01 -0.89 -2.11 0.00 0.00 174.94 172.22 2kui s THR 357 N -1.43 3.82 -1.08 4.00 2.01 -1.26 -5.05 115.64 116.65 2kui s THR 357 Ca 0.39 -1.22 -0.05 0.00 0.31 0.00 0.00 61.69 61.13 2kui s THR 357 Cb -0.17 -2.86 0.30 0.00 0.01 0.00 0.00 72.50 69.78 2kui s THR 357 CO 0.21 0.01 1.39 -2.11 -0.69 0.00 0.00 174.62 173.42 2kui n ARG 358 N 0.26 4.23 -3.73 4.92 0.00 -1.26 -4.96 116.66 116.12 2kui n ARG 358 Ca -0.11 -4.54 -0.35 0.00 -0.00 0.00 0.00 57.85 52.86 2kui n ARG 358 Cb 0.53 -2.51 -0.05 0.00 -0.00 0.00 0.00 32.46 30.43 2kui n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2kui s ASP 359 N -1.08 6.53 -0.06 2.89 1.01 -1.26 -4.59 116.67 120.11 2kui s ASP 359 Ca 0.31 0.62 0.05 0.00 0.71 0.00 0.00 52.55 54.24 2kui s ASP 359 Cb 0.02 -2.11 -0.02 0.00 1.01 0.00 0.00 42.92 41.82 2kui s ASP 359 CO 0.06 0.27 -0.21 0.68 0.21 0.00 0.00 175.17 176.18 2kui s VAL 360 N -1.26 2.44 -0.25 -1.27 -7.23 0.15 -4.85 120.40 108.13 2kui s VAL 360 Ca 0.26 -0.94 -0.13 0.00 -1.81 0.00 0.00 61.98 59.37 2kui s VAL 360 Cb -0.13 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.84 2kui s VAL 360 CO 0.15 0.57 0.26 -1.58 -0.31 0.00 0.00 175.10 174.19 2kui s GLN 361 N -0.33 4.04 -0.24 4.82 -0.44 -1.26 -0.54 119.66 125.70 2kui s GLN 361 Ca 0.02 -0.13 -0.14 0.00 -2.50 0.00 0.00 55.36 52.62 2kui s GLN 361 Cb -0.13 -3.61 -0.04 0.00 -1.64 0.00 0.00 33.01 27.60 2kui s GLN 361 CO 0.02 -0.12 0.31 0.08 0.50 0.00 0.00 175.29 176.08 2kui s VAL 362 N 1.57 5.24 0.37 1.34 1.01 0.36 -5.01 120.40 125.28 2kui s VAL 362 Ca 0.11 0.47 -0.28 0.00 0.00 0.00 0.00 61.98 62.29 2kui s VAL 362 Cb -0.15 -3.64 -0.10 0.00 0.00 0.00 0.00 36.38 32.49 2kui s VAL 362 CO 0.08 0.24 1.34 -2.84 0.00 0.00 0.00 175.10 173.93 2kui s PRO 363 N 1.55 4.17 0.07 2.72 0.02 -1.26 -3.77 135.00 138.50 2kui s PRO 363 Ca 0.13 2.27 -0.15 0.00 0.02 0.00 0.00 61.00 63.27 2kui s PRO 363 Cb -0.15 -2.94 -0.06 0.00 0.02 0.00 0.00 34.50 31.37 2kui s PRO 363 CO 0.08 -0.37 0.48 0.16 -0.33 0.00 0.00 177.00 177.03 2kui s ASP 364 N -0.50 6.85 -0.18 2.53 -4.77 -1.26 -4.97 116.67 114.37 2kui s ASP 364 Ca 0.52 1.04 0.14 0.00 -3.30 0.00 0.00 52.55 50.96 2kui s ASP 364 Cb -0.41 -2.28 0.37 0.00 -1.09 0.00 0.00 42.92 39.51 2kui s ASP 364 CO 0.54 0.23 1.19 0.52 0.70 0.00 0.00 175.17 178.35 2kui n VAL 365 N 1.40 2.08 -1.93 2.11 0.31 -1.26 -5.06 118.33 115.98 2kui n VAL 365 Ca -0.10 -2.85 -0.39 0.00 -0.01 0.00 0.00 64.34 60.99 2kui n VAL 365 Cb 0.52 -0.24 0.02 0.00 -0.91 0.00 0.00 33.84 33.22 2kui n VAL 365 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2kui s ARG 366 N -3.09 3.57 0.00 5.55 1.04 -1.26 -3.21 118.95 121.55 2kui s ARG 366 Ca 0.36 2.18 0.00 0.00 -1.04 0.00 0.00 55.73 57.23 2kui s ARG 366 Cb 0.33 -2.50 0.00 0.00 -2.04 0.00 0.00 34.95 30.75 2kui s ARG 366 CO -0.03 -0.83 0.00 0.41 -0.04 0.00 0.00 175.30 174.81 2kui n GLY 367 N 0.63 0.72 0.00 3.88 0.00 0.42 -4.93 105.19 105.91 2kui n GLY 367 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -2.02 0.00 -3.59 1.61 6.02 -1.20 -4.98 117.38 113.23 2kui n GLN 368 Ca 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 57.00 56.93 2kui n GLN 368 Cb 0.00 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.24 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 -0.59 -0.25 0.19 1.08 1.04 -1.26 -4.68 113.70 109.22 2kui s SER 369 Ca 0.00 -0.11 -0.10 0.00 0.48 0.00 0.00 55.95 56.22 2kui s SER 369 Cb 0.00 0.35 0.11 0.00 0.10 0.00 0.00 66.02 66.58 2kui s SER 369 CO 0.00 -0.60 1.73 0.28 0.98 0.00 0.00 173.24 175.64 2kui h SER 370 N 2.00 0.99 -0.29 7.02 0.02 -1.89 -1.71 113.55 119.71 2kui h SER 370 Ca -0.21 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.53 2kui h SER 370 Cb 1.22 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.49 2kui h SER 370 CO 0.28 0.92 0.14 0.00 -1.14 0.00 0.00 176.83 177.04 2kui h ALA 371 N 1.11 0.37 -0.44 3.77 0.00 -1.96 0.22 119.26 122.33 2kui h ALA 371 Ca 0.23 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2kui h ALA 371 Cb 0.27 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2kui h ALA 371 CO -0.01 -0.07 0.08 -0.44 0.00 0.00 0.00 179.25 178.81 2kui h ASP 372 N 0.33 0.69 -0.14 0.00 3.32 -1.92 0.15 116.42 118.85 2kui h ASP 372 Ca 0.10 -0.25 -0.02 0.00 0.02 0.00 0.00 57.03 56.87 2kui h ASP 372 Cb 0.11 -0.18 -0.00 0.00 0.22 0.00 0.00 39.33 39.47 2kui h ASP 372 CO -0.01 0.76 -0.01 0.00 -1.72 0.00 0.00 179.24 178.26 2kui h ALA 373 N 0.95 0.19 -0.54 3.45 0.00 -1.10 -2.49 119.26 119.73 2kui h ALA 373 Ca 0.14 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.73 2kui h ALA 373 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2kui h ALA 373 CO 0.01 -0.09 -0.10 0.82 0.00 0.00 0.00 179.25 179.88 2kui h ILE 374 N -0.01 1.27 -0.74 0.00 2.04 -0.49 -2.68 117.51 116.89 2kui h ILE 374 Ca 0.04 -1.25 -0.02 0.00 1.00 0.00 0.00 64.86 64.63 2kui h ILE 374 Cb 0.39 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 2kui h ILE 374 CO 0.01 0.44 0.38 0.00 0.00 0.00 0.00 178.15 178.99 2kui h ALA 375 N 0.92 0.94 -0.14 1.87 0.00 -0.65 0.35 119.26 122.56 2kui h ALA 375 Ca 0.14 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 375 Cb 0.67 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 2kui h ALA 375 CO 0.05 0.48 -0.03 1.15 0.00 0.00 0.00 179.25 180.90 2kui h THR 376 N 1.02 1.28 -0.61 0.00 2.02 -1.40 -1.72 112.91 113.50 2kui h THR 376 Ca 0.26 -0.95 -0.06 0.00 0.77 0.00 0.00 66.41 66.42 2kui h THR 376 Cb 0.07 1.63 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 2kui h THR 376 CO -0.04 0.28 0.13 -0.07 0.37 0.00 0.00 175.52 176.19 2kui h LEU 377 N -0.03 0.90 -0.56 2.58 4.07 -1.21 -2.04 115.31 119.02 2kui h LEU 377 Ca 0.04 -0.18 0.00 0.00 0.08 0.00 0.00 57.88 57.82 2kui h LEU 377 Cb 0.44 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 41.92 2kui h LEU 377 CO 0.01 0.88 0.36 -0.61 -1.08 0.00 0.00 178.44 178.01 2kui h GLN 378 N 0.91 0.75 0.00 1.13 5.75 -0.18 0.57 115.11 124.05 2kui h GLN 378 Ca 0.19 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.63 2kui h GLN 378 Cb 0.35 -0.16 -0.00 0.00 1.07 0.00 0.00 27.48 28.73 2kui h GLN 378 CO 0.00 0.51 -0.03 -0.91 -2.65 0.00 0.00 178.83 175.75 2kui h ASN 379 N 0.76 0.00 1.02 -0.69 2.35 -0.96 -1.01 115.58 117.04 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 -0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.31 2kui h ASN 379 CO -0.04 0.03 -0.39 0.54 -1.65 0.00 0.00 177.43 175.92 2kui n ARG 380 N -3.14 0.23 -0.20 0.81 5.12 -0.56 -4.93 116.66 114.00 2kui n ARG 380 Ca 0.00 0.11 0.00 0.00 -1.93 0.00 0.00 57.85 56.03 2kui n ARG 380 Cb 0.32 -1.69 0.00 0.00 -1.16 0.00 0.00 32.46 29.93 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 1.36 0.85 3.84 -0.13 0.00 -0.29 -4.65 105.19 106.16 2kui n GLY 381 Ca 0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.07 3.34 0.14 1.61 0.40 0.04 -4.23 117.98 117.21 2kui s PHE 382 Ca 0.00 1.41 -0.03 0.00 -0.60 0.00 0.00 56.93 57.72 2kui s PHE 382 Cb 0.00 -2.83 -0.05 0.00 0.51 0.00 0.00 43.02 40.65 2kui s PHE 382 CO 0.00 -0.80 0.34 0.15 0.70 0.00 0.00 175.22 175.61 2kui s LYS 383 N -4.61 3.55 -0.03 0.44 -0.14 0.54 -4.40 119.74 115.09 2kui s LYS 383 Ca 0.58 -0.23 0.03 0.00 -1.36 0.00 0.00 55.97 54.99 2kui s LYS 383 Cb -0.12 -2.89 -0.00 0.00 -1.68 0.00 0.00 37.83 33.14 2kui s LYS 383 CO 0.44 0.48 -0.12 0.96 -0.76 0.00 0.00 175.35 176.35 2kui s ILE 384 N -1.68 1.02 -0.18 2.17 -0.00 -1.25 -0.36 121.20 120.91 2kui s ILE 384 Ca 0.39 -0.50 -0.04 0.00 -0.00 0.00 0.00 60.65 60.49 2kui s ILE 384 Cb -0.12 -0.89 -0.02 0.00 -0.00 0.00 0.00 42.46 41.43 2kui s ILE 384 CO 0.27 0.30 -0.02 -0.60 -0.00 0.00 0.00 174.94 174.89 2kui s ARG 385 N 0.06 3.62 -0.27 0.37 3.52 0.44 -4.89 118.95 121.80 2kui s ARG 385 Ca -0.02 -0.53 -0.07 0.00 -0.13 0.00 0.00 55.73 54.98 2kui s ARG 385 Cb -0.09 -3.01 -0.02 0.00 -1.56 0.00 0.00 34.95 30.28 2kui s ARG 385 CO 0.01 0.09 0.08 0.99 -0.81 0.00 0.00 175.30 175.66 2kui s THR 386 N 0.77 4.26 -0.10 4.11 2.01 -1.26 0.36 115.64 125.78 2kui s THR 386 Ca -0.01 -0.32 0.04 0.00 0.31 0.00 0.00 61.69 61.72 2kui s THR 386 Cb -0.14 -3.05 0.00 0.00 0.01 0.00 0.00 72.50 69.31 2kui s THR 386 CO 0.02 0.25 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.75 2kui s LEU 387 N 1.59 2.07 -0.05 4.42 1.98 0.32 -4.97 118.68 124.04 2kui s LEU 387 Ca 0.05 -0.55 -0.02 0.00 -2.89 0.00 0.00 54.13 50.72 2kui s LEU 387 Cb -0.16 -1.38 -0.04 0.00 0.66 0.00 0.00 46.19 45.27 2kui s LEU 387 CO 0.04 0.14 0.08 -1.10 -1.89 0.00 0.00 176.35 173.62 2kui s GLN 388 N 0.42 3.14 -0.17 1.98 1.11 -1.26 -0.17 119.66 124.70 2kui s GLN 388 Ca -0.17 -0.39 0.00 0.00 0.01 0.00 0.00 55.36 54.81 2kui s GLN 388 Cb -0.18 -2.92 0.04 0.00 -1.01 0.00 0.00 33.01 28.94 2kui s GLN 388 CO 0.07 0.69 -0.08 0.15 0.01 0.00 0.00 175.29 176.13 2kui s LYS 389 N -1.40 1.79 -0.19 2.91 -0.14 0.44 -4.92 119.74 118.23 2kui s LYS 389 Ca 0.19 -0.64 -0.12 0.00 -1.36 0.00 0.00 55.97 54.04 2kui s LYS 389 Cb -0.12 -2.17 -0.05 0.00 -1.68 0.00 0.00 37.83 33.81 2kui s LYS 389 CO 0.09 -0.40 0.20 -1.25 -0.76 0.00 0.00 175.35 173.23 2kui s PRO 390 N 1.52 4.21 0.00 -1.68 0.04 -1.26 -0.27 135.00 137.56 2kui s PRO 390 Ca 0.01 -0.10 0.00 0.00 0.04 0.00 0.00 61.00 60.95 2kui s PRO 390 Cb -0.15 -3.43 0.00 0.00 0.04 0.00 0.00 34.50 30.96 2kui s PRO 390 CO -0.08 0.26 0.00 -3.47 0.04 0.00 0.00 177.00 173.75 2kui n ASP 391 N 3.59 0.00 0.19 6.66 -0.08 -0.43 -4.78 116.55 121.69 2kui n ASP 391 Ca -0.14 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.20 2kui n ASP 391 Cb 0.52 0.00 0.25 0.00 2.34 0.00 0.00 41.12 44.23 2kui n ASP 391 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 2kui h SER 392 N 0.00 0.00 0.39 1.67 0.87 -1.86 -2.84 113.55 111.78 2kui h SER 392 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2kui h SER 392 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2kui h SER 392 CO 0.00 0.34 -0.08 0.41 -0.53 0.00 0.00 176.83 176.97 2kui n THR 393 N -3.32 0.00 -3.18 2.23 -1.04 -1.26 -4.79 114.28 102.91 2kui n THR 393 Ca 0.01 -0.05 -0.39 0.00 -2.04 0.00 0.00 64.05 61.59 2kui n THR 393 Cb 0.57 -0.20 -0.06 0.00 -1.82 0.00 0.00 70.33 68.82 2kui n THR 393 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2kui s ILE 394 N -2.47 4.91 0.48 12.58 -1.09 -1.07 -5.08 121.20 129.46 2kui s ILE 394 Ca 0.30 1.27 -0.08 0.00 -2.23 0.00 0.00 60.65 59.91 2kui s ILE 394 Cb 0.20 -3.95 0.12 0.00 -1.58 0.00 0.00 42.46 37.26 2kui s ILE 394 CO 0.47 0.40 0.37 -0.81 -1.23 0.00 0.00 174.94 174.14 2kui n PRO 395 N 2.81 -2.28 -0.75 2.79 -0.04 -1.26 -4.89 135.00 131.38 2kui n PRO 395 Ca -0.06 -0.60 -0.32 0.00 -0.04 0.00 0.00 63.50 62.48 2kui n PRO 395 Cb 0.51 -0.64 0.15 0.00 -0.04 0.00 0.00 33.50 33.49 2kui n PRO 395 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 2kui n PRO 396 N -2.98 -0.35 0.00 0.54 -0.02 -1.26 -4.60 135.00 126.33 2kui n PRO 396 Ca 0.05 -0.04 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2kui n PRO 396 Cb 0.22 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.41 2kui n PRO 396 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2kui n ASP 397 N -3.55 0.00 -4.62 2.55 2.03 -1.23 -4.23 116.55 107.50 2kui n ASP 397 Ca 0.11 0.44 -0.24 0.00 0.52 0.00 0.00 54.79 55.62 2kui n ASP 397 Cb 0.52 -0.44 0.12 0.00 -0.72 0.00 0.00 41.12 40.60 2kui n ASP 397 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2kui s HIS 398 N -2.88 1.65 -0.26 -0.67 3.76 -1.26 -4.07 115.29 111.57 2kui s HIS 398 Ca 0.00 -0.17 -0.26 0.00 -0.15 0.00 0.00 55.06 54.47 2kui s HIS 398 Cb 0.00 -3.14 0.00 0.00 1.11 0.00 0.00 32.58 30.56 2kui s HIS 398 CO 0.00 -1.81 0.92 0.14 -0.85 0.00 0.00 174.74 173.14 2kui s VAL 399 N -3.23 4.75 -0.01 -0.90 -7.23 -1.26 -4.62 120.40 107.89 2kui s VAL 399 Ca 0.67 1.68 0.06 0.00 -1.81 0.00 0.00 61.98 62.58 2kui s VAL 399 Cb -0.05 -4.21 -0.24 0.00 0.56 0.00 0.00 36.38 32.43 2kui s VAL 399 CO 0.45 -0.17 0.81 0.16 -0.31 0.00 0.00 175.10 176.04 2kui h ILE 400 N 5.49 1.07 -3.96 -0.62 3.07 -1.88 0.12 117.51 120.80 2kui h ILE 400 Ca -0.22 -2.84 -0.12 0.00 1.55 0.00 0.00 64.86 63.23 2kui h ILE 400 Cb 1.08 2.59 -0.11 0.00 -0.27 0.00 0.00 36.82 40.11 2kui h ILE 400 CO 0.92 0.70 -0.28 -0.83 -1.05 0.00 0.00 178.15 177.62 2kui s GLY 401 N -5.04 0.86 0.52 0.16 0.00 -1.26 -4.27 107.32 98.28 2kui s GLY 401 Ca -0.06 -1.16 0.02 0.00 0.00 0.00 0.00 44.72 43.52 2kui s GLY 401 CO 0.83 -0.88 0.19 -1.30 0.00 0.00 0.00 173.10 171.93 2kui n THR 402 N -0.36 0.00 -3.88 0.90 -2.24 -1.26 -4.83 114.28 102.62 2kui n THR 402 Ca -0.00 -2.24 -0.35 0.00 -2.27 0.00 0.00 64.05 59.19 2kui n THR 402 Cb 0.63 0.23 -0.09 0.00 -2.10 0.00 0.00 70.33 69.00 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 -3.92 5.88 0.51 3.42 2.15 -1.26 -4.98 116.67 118.47 2kui s ASP 403 Ca 0.14 0.14 0.29 0.00 0.43 0.00 0.00 52.55 53.55 2kui s ASP 403 Cb -0.01 -2.02 1.59 0.00 -0.30 0.00 0.00 42.92 42.18 2kui s ASP 403 CO 0.09 0.17 1.88 1.55 -0.17 0.00 0.00 175.17 178.69 2kui h PRO 404 N 6.72 0.00 -0.53 4.34 0.13 -1.99 -1.15 132.00 139.52 2kui h PRO 404 Ca -0.39 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2kui h PRO 404 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.26 2kui h PRO 404 CO 0.73 0.00 0.32 0.00 -0.23 0.00 0.00 178.00 178.82 2kui h ALA 405 N 1.69 1.57 -0.40 -0.56 0.00 -1.93 -0.91 119.26 118.73 2kui h ALA 405 Ca 0.00 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 2kui h ALA 405 Cb 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 2kui h ALA 405 CO 0.00 0.38 -0.34 0.00 0.00 0.00 0.00 179.25 179.28 2kui h ALA 406 N 1.63 0.63 0.00 0.00 0.00 -1.50 -2.65 119.26 117.38 2kui h ALA 406 Ca 0.19 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2kui h ALA 406 Cb -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2kui h ALA 406 CO -0.04 0.67 0.00 0.09 0.00 0.00 0.00 179.25 179.98 2kui n ASN 407 N -4.07 0.00 -4.93 0.00 5.03 -0.54 -0.49 115.26 110.26 2kui n ASN 407 Ca -0.02 0.15 -0.27 0.00 0.87 0.00 0.00 54.58 55.31 2kui n ASN 407 Cb 0.52 -0.36 -0.03 0.00 -1.02 0.00 0.00 39.78 38.89 2kui n ASN 407 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2kui s THR 408 N -2.73 5.28 -0.34 3.41 2.01 -0.46 -4.84 115.64 117.98 2kui s THR 408 Ca 0.18 -0.50 -0.29 0.00 0.31 0.00 0.00 61.69 61.39 2kui s THR 408 Cb 0.16 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.95 2kui s THR 408 CO 0.38 -0.08 1.37 -0.44 -0.69 0.00 0.00 174.62 175.15 2kui s SER 409 N -3.08 6.52 0.39 3.53 0.01 -1.26 -4.08 113.70 115.74 2kui s SER 409 Ca 0.36 1.08 0.07 0.00 1.31 0.00 0.00 55.95 58.77 2kui s SER 409 Cb -0.11 -2.54 -0.08 0.00 0.21 0.00 0.00 66.02 63.50 2kui s SER 409 CO 0.28 -1.23 0.01 0.68 0.41 0.00 0.00 173.24 173.39 2kui s VAL 410 N 4.85 1.88 0.42 3.43 -7.23 0.30 -4.76 120.40 119.30 2kui s VAL 410 Ca 0.59 -2.01 -0.22 0.00 -1.81 0.00 0.00 61.98 58.53 2kui s VAL 410 Cb -0.16 -2.96 -0.09 0.00 0.56 0.00 0.00 36.38 33.73 2kui s VAL 410 CO 0.27 -0.01 1.01 -0.94 -0.31 0.00 0.00 175.10 175.13 2kui s SER 411 N -3.67 6.74 0.13 4.85 1.04 -1.26 0.31 113.70 121.84 2kui s SER 411 Ca 0.35 1.91 -0.31 0.00 0.48 0.00 0.00 55.95 58.38 2kui s SER 411 Cb 0.10 -2.57 -0.10 0.00 0.10 0.00 0.00 66.02 63.55 2kui s SER 411 CO 0.18 -0.50 1.71 0.00 0.98 0.00 0.00 173.24 175.61 2kui s ALA 412 N -1.86 3.77 0.00 5.32 0.00 -1.26 -2.59 121.76 125.14 2kui s ALA 412 Ca 0.61 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.96 2kui s ALA 412 Cb -0.17 -3.71 0.00 0.00 0.00 0.00 0.00 23.12 19.24 2kui s ALA 412 CO 0.22 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.33 2kui n GLY 413 N 4.04 1.60 3.95 0.00 0.00 -1.26 -4.99 105.19 108.53 2kui n GLY 413 Ca 0.16 -0.15 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 2kui n GLY 413 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2kui s ASP 414 N -2.16 3.53 -0.34 1.61 -1.08 -1.07 -4.46 116.67 112.71 2kui s ASP 414 Ca 0.00 0.12 -0.05 0.00 -0.52 0.00 0.00 52.55 52.10 2kui s ASP 414 Cb 0.00 -0.28 0.05 0.00 -1.46 0.00 0.00 42.92 41.23 2kui s ASP 414 CO 0.00 -2.45 0.09 -1.61 0.52 0.00 0.00 175.17 171.72 2kui s GLU 415 N -5.67 2.51 -0.20 4.34 2.02 -1.26 -0.34 118.70 120.12 2kui s GLU 415 Ca 0.71 -1.27 -0.09 0.00 0.02 0.00 0.00 54.97 54.35 2kui s GLU 415 Cb -0.05 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2kui s GLU 415 CO 0.50 -0.70 0.09 0.42 0.02 0.00 0.00 175.26 175.60 2kui s ILE 416 N 1.34 5.03 -0.05 -1.63 -1.09 0.51 -4.87 121.20 120.45 2kui s ILE 416 Ca -0.02 0.06 -0.24 0.00 -2.23 0.00 0.00 60.65 58.22 2kui s ILE 416 Cb -0.20 -3.29 -0.04 0.00 -1.58 0.00 0.00 42.46 37.35 2kui s ILE 416 CO 0.01 0.44 0.73 -0.89 -1.23 0.00 0.00 174.94 174.00 2kui s THR 417 N 0.48 5.00 -0.11 2.92 2.01 -1.26 -0.42 115.64 124.25 2kui s THR 417 Ca 0.05 1.51 -0.01 0.00 0.31 0.00 0.00 61.69 63.56 2kui s THR 417 Cb -0.12 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.29 2kui s THR 417 CO 0.00 0.26 -0.07 0.54 -0.69 0.00 0.00 174.62 174.66 2kui s VAL 418 N 0.71 3.62 -0.21 3.82 0.11 0.16 -4.38 120.40 124.23 2kui s VAL 418 Ca 0.39 -0.48 -0.04 0.00 -2.93 0.00 0.00 61.98 58.91 2kui s VAL 418 Cb -0.18 -2.52 -0.01 0.00 -1.53 0.00 0.00 36.38 32.13 2kui s VAL 418 CO 0.19 0.55 -0.03 0.20 -3.33 0.00 0.00 175.10 172.68 2kui s ASN 419 N -0.21 4.48 -0.18 3.54 0.02 -1.26 -0.52 114.94 120.81 2kui s ASN 419 Ca 0.03 -0.32 -0.08 0.00 -1.02 0.00 0.00 52.86 51.47 2kui s ASN 419 Cb -0.13 -1.76 -0.04 0.00 0.02 0.00 0.00 41.25 39.33 2kui s ASN 419 CO 0.03 0.02 0.08 -0.69 0.02 0.00 0.00 177.10 176.55 2kui s VAL 420 N 1.25 4.94 -0.23 1.60 1.01 0.76 -4.61 120.40 125.12 2kui s VAL 420 Ca 0.03 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.91 2kui s VAL 420 Cb -0.14 -3.22 -0.05 0.00 0.00 0.00 0.00 36.38 32.97 2kui s VAL 420 CO -0.01 0.48 0.21 -0.44 0.00 0.00 0.00 175.10 175.34 2kui s SER 421 N 0.20 6.19 0.10 3.32 0.01 -1.26 -0.42 113.70 121.85 2kui s SER 421 Ca 0.05 0.20 0.06 0.00 1.31 0.00 0.00 55.95 57.58 2kui s SER 421 Cb -0.12 -2.13 -0.04 0.00 0.21 0.00 0.00 66.02 63.94 2kui s SER 421 CO 0.00 0.03 -0.06 0.42 0.41 0.00 0.00 173.24 174.05 2kui s THR 422 N 1.12 3.66 0.00 1.44 -4.23 0.63 -3.56 115.64 114.69 2kui s THR 422 Ca 0.10 -1.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.47 2kui s THR 422 Cb -0.14 -2.73 0.00 0.00 1.34 0.00 0.00 72.50 70.98 2kui s THR 422 CO 0.05 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.86 2kui n GLY 423 N 0.64 -2.89 3.70 3.99 0.00 -1.26 -2.30 105.19 107.07 2kui n GLY 423 Ca -0.12 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 2kui n GLY 423 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2kui n PRO 424 N -0.43 2.11 -2.44 1.61 -0.02 -1.24 -1.32 135.00 133.27 2kui n PRO 424 Ca 0.00 0.74 -0.36 0.00 -2.02 0.00 0.00 63.50 61.86 2kui n PRO 424 Cb 0.00 -2.32 -0.03 0.00 -0.02 0.00 0.00 33.50 31.14 2kui n PRO 424 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2kui s GLU 425 N -1.86 3.96 0.07 -0.52 2.02 -1.26 -4.81 118.70 116.30 2kui s GLU 425 Ca 0.56 1.57 0.04 0.00 0.02 0.00 0.00 54.97 57.16 2kui s GLU 425 Cb -0.57 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.21 2kui s GLU 425 CO 0.62 -0.34 -0.12 -0.65 0.02 0.00 0.00 175.26 174.79 2kui s GLN 426 N -2.69 0.79 0.02 1.61 -0.21 -1.26 -1.51 119.66 116.41 2kui s GLN 426 Ca 0.61 -0.97 0.03 0.00 0.02 0.00 0.00 55.36 55.05 2kui s GLN 426 Cb -0.23 -0.70 -0.02 0.00 1.00 0.00 0.00 33.01 33.06 2kui s GLN 426 CO 0.29 0.14 -0.09 1.03 -2.12 0.00 0.00 175.29 174.54 2kui s ARG 427 N -1.94 0.67 0.03 2.91 1.81 0.93 -4.90 118.95 118.45 2kui s ARG 427 Ca -0.01 -0.57 -0.26 0.00 -1.72 0.00 0.00 55.73 53.17 2kui s ARG 427 Cb -0.09 -0.60 -0.05 0.00 -0.45 0.00 0.00 34.95 33.77 2kui s ARG 427 CO 0.02 0.15 0.81 -1.83 -0.68 0.00 0.00 175.30 173.76 2kui s GLU 428 N -0.91 4.53 -0.01 3.54 1.03 -1.26 0.22 118.70 125.84 2kui s GLU 428 Ca -0.01 1.14 -0.29 0.00 0.03 0.00 0.00 54.97 55.83 2kui s GLU 428 Cb -0.07 -3.39 -0.03 0.00 -0.80 0.00 0.00 34.13 29.84 2kui s GLU 428 CO 0.00 0.20 0.95 0.42 -1.33 0.00 0.00 175.26 175.50 2kui s ILE 429 N 0.21 4.89 0.46 1.83 1.01 -0.95 -4.95 121.20 123.70 2kui s ILE 429 Ca 0.41 1.98 -0.22 0.00 0.00 0.00 0.00 60.65 62.82 2kui s ILE 429 Cb -0.21 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 37.90 2kui s ILE 429 CO 0.24 0.17 1.13 -2.16 0.00 0.00 0.00 174.94 174.32 2kui s PRO 430 N 1.00 3.76 -0.58 2.79 0.04 -1.26 -4.47 135.00 136.28 2kui s PRO 430 Ca 0.50 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 62.96 2kui s PRO 430 Cb -0.21 -2.34 0.04 0.00 0.04 0.00 0.00 34.50 32.03 2kui s PRO 430 CO 0.27 -0.53 1.06 -0.51 0.04 0.00 0.00 177.00 177.33 2kui s ASP 431 N -1.50 6.36 0.36 6.66 1.11 -1.26 -4.97 116.67 123.43 2kui s ASP 431 Ca 0.64 -0.21 0.01 0.00 0.18 0.00 0.00 52.55 53.17 2kui s ASP 431 Cb -0.26 -2.49 -0.03 0.00 1.07 0.00 0.00 42.92 41.22 2kui s ASP 431 CO 0.31 -1.38 0.56 0.54 1.18 0.00 0.00 175.17 176.39 2kui s VAL 432 N 4.46 4.83 0.50 -1.27 0.11 -1.26 -5.09 120.40 122.68 2kui s VAL 432 Ca 0.35 -0.53 -0.10 0.00 -2.93 0.00 0.00 61.98 58.77 2kui s VAL 432 Cb -0.10 -3.76 -0.05 0.00 -1.53 0.00 0.00 36.38 30.93 2kui s VAL 432 CO 0.21 -0.48 0.88 -0.55 -3.33 0.00 0.00 175.10 171.83 2kui s SER 433 N -4.08 6.39 0.39 3.54 0.15 -1.26 -4.97 113.70 113.86 2kui s SER 433 Ca 0.42 1.22 0.18 0.00 0.70 0.00 0.00 55.95 58.47 2kui s SER 433 Cb -0.10 -2.37 0.77 0.00 -1.71 0.00 0.00 66.02 62.61 2kui s SER 433 CO 0.36 -0.60 1.79 0.71 1.20 0.00 0.00 173.24 176.70 2kui h THR 434 N 0.46 0.96 0.00 6.45 1.35 -1.99 -2.07 112.91 118.07 2kui h THR 434 Ca -0.46 -1.38 0.00 0.00 -0.55 0.00 0.00 66.41 64.02 2kui h THR 434 Cb 1.19 1.81 0.00 0.00 -1.73 0.00 0.00 68.15 69.43 2kui h THR 434 CO 0.62 0.35 -0.52 0.00 -0.25 0.00 0.00 175.52 175.72 2kui n LEU 435 N -3.68 0.64 -2.10 3.87 -0.00 -1.26 0.20 117.00 114.66 2kui n LEU 435 Ca -0.01 0.23 -0.23 0.00 -0.00 0.00 0.00 56.01 56.00 2kui n LEU 435 Cb 0.46 -0.22 0.04 0.00 -0.00 0.00 0.00 43.42 43.69 2kui n LEU 435 CO 0.37 -0.03 1.33 0.41 -0.00 0.00 0.00 177.39 179.46 2kui n THR 436 N -1.98 3.08 -0.35 1.47 -1.04 -0.78 -4.60 114.28 110.08 2kui n THR 436 Ca 0.04 -2.20 0.09 0.00 -2.04 0.00 0.00 64.05 59.95 2kui n THR 436 Cb 0.42 -1.32 0.27 0.00 -1.82 0.00 0.00 70.33 67.87 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 1.82 1.07 -0.70 -1.42 3.20 -1.73 0.13 116.97 119.34 2kui h TYR 437 Ca 0.39 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.25 2kui h TYR 437 Cb 0.84 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.75 2kui h TYR 437 CO 1.05 0.34 0.27 0.00 -1.64 0.00 0.00 178.16 178.17 2kui h ALA 438 N 1.58 0.92 -0.15 1.82 0.00 -1.96 -1.13 119.26 120.33 2kui h ALA 438 Ca 0.52 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 55.09 2kui h ALA 438 Cb 0.66 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2kui h ALA 438 CO -0.32 0.55 -0.54 1.49 0.00 0.00 0.00 179.25 180.42 2kui h GLU 439 N 1.01 0.44 0.05 0.00 4.81 -1.60 -2.71 114.58 116.58 2kui h GLU 439 Ca 0.23 -0.27 0.01 0.00 -0.13 0.00 0.00 59.36 59.20 2kui h GLU 439 Cb 0.23 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2kui h GLU 439 CO -0.02 0.87 -0.08 0.00 -0.73 0.00 0.00 179.01 179.05 2kui h ALA 440 N 1.07 -0.13 -0.72 2.92 0.00 -0.10 0.50 119.26 122.80 2kui h ALA 440 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2kui h ALA 440 Cb 1.06 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2kui h ALA 440 CO 0.10 -0.59 0.39 -0.39 0.00 0.00 0.00 179.25 178.75 2kui h VAL 441 N -0.17 1.21 -0.25 0.00 -1.51 -1.29 0.02 116.25 114.27 2kui h VAL 441 Ca 0.01 -0.54 0.00 0.00 -1.23 0.00 0.00 66.70 64.95 2kui h VAL 441 Cb 0.18 0.25 -0.01 0.00 -2.13 0.00 0.00 31.29 29.58 2kui h VAL 441 CO -0.05 0.24 0.16 0.50 -1.23 0.00 0.00 177.57 177.19 2kui h LYS 442 N 1.00 0.33 -0.59 5.19 1.63 -1.05 -1.10 116.57 121.99 2kui h LYS 442 Ca 0.25 -0.03 -0.07 0.00 -0.85 0.00 0.00 60.65 59.96 2kui h LYS 442 Cb 0.03 -0.07 -0.02 0.00 -0.60 0.00 0.00 32.23 31.56 2kui h LYS 442 CO -0.04 0.24 0.09 0.87 -3.45 0.00 0.00 179.45 177.16 2kui h LYS 443 N 0.33 0.95 -0.61 1.90 1.79 0.62 0.22 116.57 121.76 2kui h LYS 443 Ca 0.09 -0.24 -0.05 0.00 -2.18 0.00 0.00 60.65 58.27 2kui h LYS 443 Cb -0.01 -0.12 -0.03 0.00 -1.58 0.00 0.00 32.23 30.49 2kui h LYS 443 CO -0.02 0.89 0.17 -0.07 -1.08 0.00 0.00 179.45 179.33 2kui h LEU 444 N 0.89 0.87 -0.26 2.94 3.38 -0.84 -0.38 115.31 121.91 2kui h LEU 444 Ca 0.18 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 2kui h LEU 444 Cb 0.41 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.93 2kui h LEU 444 CO 0.01 0.83 -0.29 0.74 0.09 0.00 0.00 178.44 179.82 2kui h THR 445 N 0.90 1.31 0.00 0.22 2.02 -0.31 0.10 112.91 117.15 2kui h THR 445 Ca 0.20 -1.47 -0.03 0.00 0.77 0.00 0.00 66.41 65.87 2kui h THR 445 Cb 0.29 1.65 -0.00 0.00 -1.74 0.00 0.00 68.15 68.34 2kui h THR 445 CO -0.00 0.47 -0.17 0.00 0.37 0.00 0.00 175.52 176.18 2kui h ALA 446 N 0.68 1.37 -0.02 6.16 0.00 -0.29 -1.53 119.26 125.63 2kui h ALA 446 Ca 0.04 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2kui h ALA 446 Cb 0.86 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2kui h ALA 446 CO 0.07 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.53 2kui n ALA 447 N -2.35 2.59 0.00 0.00 0.00 -0.18 -4.93 120.51 115.64 2kui n ALA 447 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2kui n ALA 447 Cb 0.27 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 0.79 2.15 0.45 0.00 0.00 -0.58 -4.73 105.19 103.28 2kui n GLY 448 Ca 0.13 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.45 -1.61 1.61 -0.00 -1.72 -3.46 116.94 110.30 2kui h PHE 449 Ca 0.00 0.04 -0.41 0.00 -0.00 0.00 0.00 57.97 57.61 2kui h PHE 449 Cb 0.00 0.62 -0.11 0.00 -0.00 0.00 0.00 35.95 36.46 2kui h PHE 449 CO 0.00 -0.55 -0.42 0.41 -0.00 0.00 0.00 178.31 177.75 2kui n GLY 450 N -1.44 1.10 3.37 6.09 0.00 0.35 -4.88 105.19 109.78 2kui n GLY 450 Ca -0.07 -0.05 -0.40 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 -4.15 2.88 0.02 1.61 1.81 -1.26 -4.72 118.95 115.13 2kui s ARG 451 Ca 0.00 -1.04 0.04 0.00 -1.72 0.00 0.00 55.73 53.01 2kui s ARG 451 Cb 0.00 -3.67 -0.01 0.00 -0.45 0.00 0.00 34.95 30.81 2kui s ARG 451 CO 0.00 -0.65 -0.11 -0.59 -0.68 0.00 0.00 175.30 173.26 2kui s PHE 452 N 1.54 0.99 -0.07 -0.53 -0.12 -1.26 -1.37 117.98 117.16 2kui s PHE 452 Ca 0.02 -0.27 -0.00 0.00 -0.05 0.00 0.00 56.93 56.62 2kui s PHE 452 Cb -0.19 -0.61 0.03 0.00 -0.63 0.00 0.00 43.02 41.62 2kui s PHE 452 CO 0.06 -0.00 -0.02 0.21 -0.05 0.00 0.00 175.22 175.42 2kui s LYS 453 N -0.73 0.78 -0.17 1.99 2.20 -0.22 -4.93 119.74 118.65 2kui s LYS 453 Ca 0.01 0.00 -0.09 0.00 -0.36 0.00 0.00 55.97 55.54 2kui s LYS 453 Cb -0.06 -0.99 -0.05 0.00 -1.51 0.00 0.00 37.83 35.22 2kui s LYS 453 CO 0.00 -0.23 0.13 -1.14 -0.36 0.00 0.00 175.35 173.76 2kui s GLN 454 N 1.60 3.94 0.05 4.03 0.74 -1.26 0.41 119.66 129.17 2kui s GLN 454 Ca -0.00 -0.19 0.09 0.00 0.05 0.00 0.00 55.36 55.31 2kui s GLN 454 Cb -0.13 -3.34 -0.03 0.00 1.10 0.00 0.00 33.01 30.61 2kui s GLN 454 CO -0.04 0.46 -0.25 0.00 -0.55 0.00 0.00 175.29 174.91 2kui s ALA 455 N -0.10 2.33 -0.08 1.58 0.00 0.11 -4.93 121.76 120.66 2kui s ALA 455 Ca 0.10 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 50.81 2kui s ALA 455 Cb -0.11 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 2kui s ALA 455 CO 0.00 0.54 -0.15 -0.80 0.00 0.00 0.00 175.76 175.35 2kui s ASN 456 N -1.35 3.91 -0.08 0.00 0.01 -1.26 -0.44 114.94 115.74 2kui s ASN 456 Ca 0.12 -0.28 -0.10 0.00 -0.71 0.00 0.00 52.86 51.90 2kui s ASN 456 Cb -0.10 -1.13 0.02 0.00 0.41 0.00 0.00 41.25 40.45 2kui s ASN 456 CO 0.03 0.27 0.26 -0.44 -1.51 0.00 0.00 177.10 175.71 2kui s SER 457 N -0.27 -0.24 0.14 -1.22 0.01 -0.84 -4.94 113.70 106.34 2kui s SER 457 Ca 0.01 0.41 -0.31 0.00 1.31 0.00 0.00 55.95 57.37 2kui s SER 457 Cb -0.13 0.48 -0.08 0.00 0.21 0.00 0.00 66.02 66.51 2kui s SER 457 CO 0.03 -0.17 1.33 -2.84 0.41 0.00 0.00 173.24 172.00 2kui s PRO 458 N -0.21 4.37 0.37 12.44 0.02 -1.26 -0.24 135.00 150.49 2kui s PRO 458 Ca -0.03 2.01 -0.03 0.00 0.02 0.00 0.00 61.00 62.97 2kui s PRO 458 Cb -0.03 -3.24 0.01 0.00 0.02 0.00 0.00 34.50 31.26 2kui s PRO 458 CO 0.01 -0.34 0.54 0.43 -0.33 0.00 0.00 177.00 177.31 2kui n SER 459 N 3.46 -1.50 -4.52 2.53 7.64 -0.86 -4.85 113.62 115.52 2kui n SER 459 Ca 0.09 -2.93 -0.50 0.00 1.01 0.00 0.00 58.87 56.54 2kui n SER 459 Cb 0.43 2.76 -0.04 0.00 -1.01 0.00 0.00 64.21 66.35 2kui n SER 459 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2kui n THR 460 N -0.59 1.14 -0.16 0.44 5.66 -1.26 -4.72 114.28 114.79 2kui n THR 460 Ca -0.00 -0.29 0.27 0.00 -3.05 0.00 0.00 64.05 60.98 2kui n THR 460 Cb 0.61 -0.51 0.70 0.00 -1.55 0.00 0.00 70.33 69.58 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 2.56 0.03 0.00 1.09 0.13 -1.97 -0.09 132.00 133.76 2kui h PRO 461 Ca -0.40 -0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.68 2kui h PRO 461 Cb 1.38 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.50 2kui h PRO 461 CO 0.65 0.02 -0.20 1.05 -0.23 0.00 0.00 178.00 179.29 2kui h GLU 462 N 0.03 0.00 -0.01 0.86 4.11 -2.00 -2.60 114.58 114.97 2kui h GLU 462 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 2kui h GLU 462 Cb 1.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.82 2kui h GLU 462 CO -0.02 0.20 -0.62 1.28 0.07 0.00 0.00 179.01 179.91 2kui n LEU 463 N -3.36 1.71 -4.71 3.06 4.77 -0.07 -4.90 117.00 113.51 2kui n LEU 463 Ca 0.00 -0.67 -0.42 0.00 -0.03 0.00 0.00 56.01 54.89 2kui n LEU 463 Cb 0.41 -0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.47 2kui n LEU 463 CO 0.33 0.34 1.38 -0.69 -1.33 0.00 0.00 177.39 177.42 2kui s VAL 464 N -2.63 2.41 0.00 4.08 1.01 -0.98 -1.12 120.40 123.17 2kui s VAL 464 Ca 0.15 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.28 2kui s VAL 464 Cb 0.18 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.46 2kui s VAL 464 CO 0.66 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.37 2kui n GLY 465 N 4.04 0.89 3.60 4.51 0.00 -0.27 -4.99 105.19 112.98 2kui n GLY 465 Ca 0.16 0.00 -0.26 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 -0.59 1.97 0.38 1.61 3.01 -0.27 -4.90 119.74 120.95 2kui s LYS 466 Ca 0.00 -1.90 -0.24 0.00 -1.01 0.00 0.00 55.97 52.81 2kui s LYS 466 Cb 0.00 -1.79 -0.09 0.00 -1.01 0.00 0.00 37.83 34.94 2kui s LYS 466 CO 0.00 0.08 1.03 0.08 0.51 0.00 0.00 175.35 177.05 2kui s VAL 467 N -2.60 3.82 -0.20 3.17 1.01 0.13 -1.12 120.40 124.61 2kui s VAL 467 Ca 0.34 1.41 0.08 0.00 0.00 0.00 0.00 61.98 63.81 2kui s VAL 467 Cb 0.03 -3.74 -0.22 0.00 0.00 0.00 0.00 36.38 32.46 2kui s VAL 467 CO 0.18 0.03 0.06 -0.38 0.00 0.00 0.00 175.10 174.99 2kui n ILE 468 N 0.05 1.51 -3.94 2.22 5.41 0.78 -4.73 119.36 120.66 2kui n ILE 468 Ca 0.04 -0.71 0.00 0.00 1.00 0.00 0.00 62.75 63.08 2kui n ILE 468 Cb 0.50 -1.07 0.00 0.00 -0.71 0.00 0.00 39.64 38.35 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 1.96 -1.11 3.45 7.39 0.00 -1.09 -5.03 105.19 110.76 2kui n GLY 469 Ca -0.36 -1.21 -0.31 0.00 0.00 0.00 0.00 46.02 44.14 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 -2.99 2.78 0.00 2.61 -4.23 -1.26 -0.92 115.64 111.63 2kui s THR 470 Ca 0.00 -1.17 -0.25 0.00 -1.18 0.00 0.00 61.69 59.09 2kui s THR 470 Cb 0.00 -2.16 -0.14 0.00 1.34 0.00 0.00 72.50 71.53 2kui s THR 470 CO 0.00 0.35 1.07 -1.13 -0.54 0.00 0.00 174.62 174.38 2kui h ASN 471 N 4.59 -0.63 -2.98 3.99 -1.24 -1.46 -3.40 115.58 114.45 2kui h ASN 471 Ca -0.48 -0.04 -0.53 0.00 0.71 0.00 0.00 56.30 55.97 2kui h ASN 471 Cb 1.15 0.16 0.03 0.00 0.73 0.00 0.00 38.32 40.39 2kui h ASN 471 CO 0.48 -0.24 0.75 -2.16 -1.29 0.00 0.00 177.43 174.96 2kui s PRO 472 N -4.47 4.30 0.34 6.67 0.04 -1.26 -4.93 135.00 135.69 2kui s PRO 472 Ca -0.13 2.13 -0.29 0.00 0.04 0.00 0.00 61.00 62.75 2kui s PRO 472 Cb 0.02 -3.23 -0.11 0.00 0.04 0.00 0.00 34.50 31.22 2kui s PRO 472 CO 0.43 -0.46 1.48 -2.14 0.04 0.00 0.00 177.00 176.35 2kui s PRO 473 N 1.06 4.16 0.00 0.56 0.02 -1.26 -4.85 135.00 134.69 2kui s PRO 473 Ca 0.65 2.50 0.00 0.00 0.02 0.00 0.00 61.00 64.17 2kui s PRO 473 Cb -0.38 -3.01 0.00 0.00 0.02 0.00 0.00 34.50 31.13 2kui s PRO 473 CO 0.31 -0.49 0.75 0.00 -0.33 0.00 0.00 177.00 177.23 2kui n ALA 474 N 1.01 2.28 0.52 -1.55 0.00 -1.26 -1.30 120.51 120.21 2kui n ALA 474 Ca 0.03 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.53 2kui n ALA 474 Cb 0.39 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.43 1.81 -4.91 0.00 5.03 -1.26 -4.06 115.26 111.43 2kui n ASN 475 Ca 0.00 -1.41 -0.21 0.00 0.87 0.00 0.00 54.58 53.83 2kui n ASN 475 Cb 0.02 0.15 0.05 0.00 -1.02 0.00 0.00 39.78 38.99 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 -1.20 2.35 -0.44 3.52 -1.52 -0.42 -4.74 119.66 117.21 2kui s GLN 476 Ca 0.13 -0.98 -0.16 0.00 -1.95 0.00 0.00 55.36 52.40 2kui s GLN 476 Cb 0.10 -2.49 0.04 0.00 -0.22 0.00 0.00 33.01 30.44 2kui s GLN 476 CO 0.20 -0.85 0.36 0.99 -0.25 0.00 0.00 175.29 175.74 2kui s THR 477 N -2.80 5.22 -0.13 -0.19 2.01 -1.26 -2.23 115.64 116.26 2kui s THR 477 Ca 0.60 -0.76 -0.07 0.00 0.31 0.00 0.00 61.69 61.77 2kui s THR 477 Cb -0.09 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 2kui s THR 477 CO 0.39 -0.44 0.13 -0.44 -0.69 0.00 0.00 174.62 173.57 2kui s SER 478 N 2.05 6.26 0.55 3.53 0.01 0.13 -4.76 113.70 121.48 2kui s SER 478 Ca 0.06 0.41 -0.16 0.00 1.31 0.00 0.00 55.95 57.56 2kui s SER 478 Cb -0.21 -2.02 -0.06 0.00 0.21 0.00 0.00 66.02 63.94 2kui s SER 478 CO 0.09 0.38 1.02 0.00 0.41 0.00 0.00 173.24 175.14 2kui s ALA 479 N -0.83 2.92 0.39 1.44 0.00 -1.26 -0.05 121.76 124.37 2kui s ALA 479 Ca 0.14 0.28 0.27 0.00 0.00 0.00 0.00 51.96 52.65 2kui s ALA 479 Cb -0.12 -3.17 1.41 0.00 0.00 0.00 0.00 23.12 21.24 2kui s ALA 479 CO 0.03 -0.49 2.05 0.82 0.00 0.00 0.00 175.76 178.17 2kui h ILE 480 N 0.71 0.56 -0.31 0.00 5.03 -1.60 -1.24 117.51 120.66 2kui h ILE 480 Ca -0.47 -0.57 0.00 0.00 -0.12 0.00 0.00 64.86 63.70 2kui h ILE 480 Cb 1.20 1.37 0.00 0.00 -3.03 0.00 0.00 36.82 36.36 2kui h ILE 480 CO 0.60 0.12 0.00 0.35 -0.68 0.00 0.00 178.15 178.54 2kui n THR 481 N -3.62 0.41 -4.34 -0.27 -2.24 -1.26 -4.16 114.28 98.79 2kui n THR 481 Ca -0.02 -0.54 -0.34 0.00 -2.27 0.00 0.00 64.05 60.88 2kui n THR 481 Cb 0.25 0.54 -0.11 0.00 -2.10 0.00 0.00 70.33 68.91 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 -1.40 5.00 -0.18 3.42 2.47 -0.47 -5.09 114.94 118.69 2kui s ASN 482 Ca 0.34 -0.05 -0.15 0.00 0.42 0.00 0.00 52.86 53.41 2kui s ASN 482 Cb 0.19 -1.75 -0.04 0.00 -1.45 0.00 0.00 41.25 38.20 2kui s ASN 482 CO 0.27 0.21 0.38 -0.69 -3.72 0.00 0.00 177.10 173.54 2kui s VAL 483 N 0.14 5.23 -0.15 -5.21 1.01 -1.26 -4.68 120.40 115.49 2kui s VAL 483 Ca 0.00 0.68 -0.11 0.00 0.00 0.00 0.00 61.98 62.56 2kui s VAL 483 Cb -0.13 -3.71 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 2kui s VAL 483 CO 0.02 0.29 0.20 0.68 0.00 0.00 0.00 175.10 176.30 2kui s VAL 484 N 1.03 5.38 -0.21 2.92 -7.23 -0.47 -4.97 120.40 116.85 2kui s VAL 484 Ca 0.19 0.35 -0.10 0.00 -1.81 0.00 0.00 61.98 60.61 2kui s VAL 484 Cb -0.14 -3.52 -0.05 0.00 0.56 0.00 0.00 36.38 33.23 2kui s VAL 484 CO 0.07 0.49 0.14 -0.51 -0.31 0.00 0.00 175.10 174.98 2kui s ILE 485 N -0.13 5.40 -0.12 -0.62 -1.16 -1.26 -1.05 121.20 122.26 2kui s ILE 485 Ca 0.14 0.20 0.02 0.00 -0.51 0.00 0.00 60.65 60.49 2kui s ILE 485 Cb -0.12 -3.48 -0.01 0.00 0.61 0.00 0.00 42.46 39.46 2kui s ILE 485 CO 0.03 0.42 -0.18 -0.63 -2.81 0.00 0.00 174.94 171.76 2kui s ILE 486 N 0.50 2.54 -0.18 2.00 1.01 0.17 -1.01 121.20 126.23 2kui s ILE 486 Ca 0.08 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 59.85 2kui s ILE 486 Cb -0.12 -2.03 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 2kui s ILE 486 CO -0.01 0.54 -0.01 -0.51 0.00 0.00 0.00 174.94 174.95 2kui s ILE 487 N 0.47 3.98 0.13 2.92 2.07 -0.10 0.05 121.20 130.73 2kui s ILE 487 Ca -0.13 -0.31 0.07 0.00 -1.41 0.00 0.00 60.65 58.87 2kui s ILE 487 Cb -0.17 -2.78 -0.04 0.00 0.13 0.00 0.00 42.46 39.60 2kui s ILE 487 CO 0.05 0.45 -0.04 0.68 -1.91 0.00 0.00 174.94 174.17 2kui s VAL 488 N 0.72 3.62 -0.17 4.00 -7.23 0.42 -0.15 120.40 121.61 2kui s VAL 488 Ca -0.00 -1.30 -0.27 0.00 -1.81 0.00 0.00 61.98 58.60 2kui s VAL 488 Cb -0.14 -2.75 -0.01 0.00 0.56 0.00 0.00 36.38 34.04 2kui s VAL 488 CO 0.02 0.02 0.90 -0.83 -0.31 0.00 0.00 175.10 174.89 2kui s GLY 489 N -2.54 2.08 0.13 2.32 0.00 -0.28 -1.98 107.32 107.05 2kui s GLY 489 Ca 0.25 0.12 0.03 0.00 0.00 0.00 0.00 44.72 45.11 2kui s GLY 489 CO 0.17 1.80 0.22 -0.45 0.00 0.00 0.00 173.10 174.84 2kui s SER 490 N 1.16 6.07 0.73 1.64 0.15 0.67 -1.12 113.70 123.00 2kui s SER 490 Ca 0.41 0.10 0.00 0.00 0.70 0.00 0.00 55.95 57.16 2kui s SER 490 Cb -0.17 -1.76 0.14 0.00 -1.71 0.00 0.00 66.02 62.52 2kui s SER 490 CO 0.12 0.09 1.01 -0.83 1.20 0.00 0.00 173.24 174.83 2kui s GLY 491 N -3.01 1.75 0.75 9.45 0.00 -1.26 -2.04 107.32 112.95 2kui s GLY 491 Ca 0.33 -1.85 -0.12 0.00 0.00 0.00 0.00 44.72 43.08 2kui s GLY 491 CO 0.27 -1.25 1.12 2.56 0.00 0.00 0.00 173.10 175.80 2kui s PRO 492 N -5.15 2.52 -0.26 2.90 0.04 -1.26 -4.85 135.00 128.93 2kui s PRO 492 Ca 0.67 0.39 -0.20 0.00 0.04 0.00 0.00 61.00 61.91 2kui s PRO 492 Cb -0.04 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 2kui s PRO 492 CO 0.45 -1.26 0.60 0.00 0.04 0.00 0.00 177.00 176.83 2kui s ALA 493 N -3.39 3.60 0.02 8.56 0.00 -1.26 -5.02 121.76 124.26 2kui s ALA 493 Ca 0.59 -0.50 0.07 0.00 0.00 0.00 0.00 51.96 52.13 2kui s ALA 493 Cb -0.11 -3.01 -0.03 0.00 0.00 0.00 0.00 23.12 19.97 2kui s ALA 493 CO 0.51 -0.82 -0.19 0.95 0.00 0.00 0.00 175.76 176.21 2kui s THR 494 N 2.47 2.69 0.17 0.00 -4.23 -1.26 -0.36 115.64 115.13 2kui s THR 494 Ca 0.25 -1.10 -0.13 0.00 -1.18 0.00 0.00 61.69 59.53 2kui s THR 494 Cb -0.15 -2.09 0.01 0.00 1.34 0.00 0.00 72.50 71.61 2kui s THR 494 CO 0.09 0.42 0.39 -0.75 -0.54 0.00 0.00 174.62 174.23 2kui s LYS 495 N -1.17 1.24 0.16 3.99 2.20 -0.19 -4.91 119.74 121.06 2kui s LYS 495 Ca 0.13 -1.00 -0.30 0.00 -0.36 0.00 0.00 55.97 54.44 2kui s LYS 495 Cb -0.10 0.44 -0.07 0.00 -1.51 0.00 0.00 37.83 36.59 2kui s LYS 495 CO 0.03 -0.49 0.96 0.16 -0.36 0.00 0.00 175.35 175.66 2kui s ASP 496 N -2.91 7.53 0.08 1.43 -4.77 -1.26 -0.93 116.67 115.84 2kui s ASP 496 Ca 0.12 1.87 -0.30 0.00 -3.30 0.00 0.00 52.55 50.94 2kui s ASP 496 Cb 0.01 -2.60 -0.06 0.00 -1.09 0.00 0.00 42.92 39.19 2kui s ASP 496 CO -0.02 -0.00 1.14 0.27 0.70 0.00 0.00 175.17 177.25 2kui s ILE 497 N -0.42 4.13 -0.09 2.11 -4.36 -0.29 -4.89 121.20 117.39 2kui s ILE 497 Ca 0.45 1.59 -0.32 0.00 -0.26 0.00 0.00 60.65 62.11 2kui s ILE 497 Cb -0.25 -4.02 -0.10 0.00 1.25 0.00 0.00 42.46 39.34 2kui s ILE 497 CO 0.31 0.16 1.97 -0.81 0.24 0.00 0.00 174.94 176.81 2kui n PRO 498 N 3.54 2.26 -2.72 0.37 -0.04 -1.26 -1.04 135.00 136.11 2kui n PRO 498 Ca 0.07 0.80 -0.42 0.00 -0.04 0.00 0.00 63.50 63.91 2kui n PRO 498 Cb 0.47 -2.80 -0.03 0.00 -0.04 0.00 0.00 33.50 31.10 2kui n PRO 498 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2kui s ASP 499 N 4.93 6.38 -0.36 3.54 -1.08 -1.26 -4.77 116.67 124.04 2kui s ASP 499 Ca 0.94 -1.28 0.07 0.00 -0.52 0.00 0.00 52.55 51.76 2kui s ASP 499 Cb -0.59 -2.49 0.19 0.00 -1.46 0.00 0.00 42.92 38.57 2kui s ASP 499 CO 0.47 -1.45 0.61 0.54 0.52 0.00 0.00 175.17 175.86 2kui s VAL 500 N 4.33 -0.99 0.30 1.11 0.11 -1.26 -5.05 120.40 118.95 2kui s VAL 500 Ca 0.34 -0.02 0.08 0.00 -2.93 0.00 0.00 61.98 59.46 2kui s VAL 500 Cb -0.07 -0.38 -0.03 0.00 -1.53 0.00 0.00 36.38 34.36 2kui s VAL 500 CO 0.00 -0.01 0.19 0.00 -3.33 0.00 0.00 175.10 171.95 2kui s ALA 501 N 2.21 3.60 0.00 1.54 0.00 -1.26 -4.65 121.76 123.19 2kui s ALA 501 Ca 0.14 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.48 2kui s ALA 501 Cb -0.06 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2kui s ALA 501 CO -0.14 0.12 0.00 0.41 0.00 0.00 0.00 175.76 176.15 2kui n GLY 502 N -1.21 1.25 3.36 0.00 0.00 0.09 -5.02 105.19 103.67 2kui n GLY 502 Ca -0.05 -0.10 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 2kui n GLY 502 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2kui s GLN 503 N -0.56 1.41 0.39 1.61 -2.07 -1.20 -4.97 119.66 114.27 2kui s GLN 503 Ca 0.00 -1.72 -0.07 0.00 -1.82 0.00 0.00 55.36 51.75 2kui s GLN 503 Cb 0.00 -0.79 -0.05 0.00 -1.09 0.00 0.00 33.01 31.08 2kui s GLN 503 CO 0.00 -0.06 0.70 0.99 -1.32 0.00 0.00 175.29 175.60 2kui s THR 504 N -3.29 4.90 0.29 3.63 2.01 -1.26 0.18 115.64 122.10 2kui s THR 504 Ca 0.29 0.28 0.04 0.00 0.31 0.00 0.00 61.69 62.61 2kui s THR 504 Cb 0.05 -3.78 0.28 0.00 0.01 0.00 0.00 72.50 69.07 2kui s THR 504 CO 0.10 -0.55 1.75 1.62 -0.69 0.00 0.00 174.62 176.84 2kui h VAL 505 N 0.92 0.65 -0.52 3.82 3.04 -0.58 0.27 116.25 123.84 2kui h VAL 505 Ca -0.47 -0.22 -0.12 0.00 -1.01 0.00 0.00 66.70 64.88 2kui h VAL 505 Cb 1.19 -0.04 -0.02 0.00 -2.01 0.00 0.00 31.29 30.42 2kui h VAL 505 CO 0.64 0.12 -0.14 -0.78 -1.01 0.00 0.00 177.57 176.39 2kui h ASP 506 N 0.63 1.01 -0.22 3.17 3.58 -1.93 -0.60 116.42 122.07 2kui h ASP 506 Ca 0.55 -0.35 -0.11 0.00 0.42 0.00 0.00 57.03 57.55 2kui h ASP 506 Cb 0.90 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.67 2kui h ASP 506 CO -0.42 1.14 -0.28 0.58 -2.88 0.00 0.00 179.24 177.38 2kui h VAL 507 N 0.89 1.32 -0.26 2.25 2.07 -1.49 -2.76 116.25 118.27 2kui h VAL 507 Ca 0.13 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 2kui h VAL 507 Cb 0.70 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.23 2kui h VAL 507 CO 0.05 0.46 0.14 0.00 0.02 0.00 0.00 177.57 178.24 2kui h ALA 508 N 0.64 0.33 -0.44 1.67 0.00 -0.38 -1.53 119.26 119.55 2kui h ALA 508 Ca 0.03 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 2kui h ALA 508 Cb 0.85 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2kui h ALA 508 CO 0.07 -0.13 0.04 -0.56 0.00 0.00 0.00 179.25 178.67 2kui h GLN 509 N 0.31 0.69 0.30 0.00 3.07 -1.14 0.17 115.11 118.50 2kui h GLN 509 Ca 0.09 -0.15 -0.01 0.00 0.09 0.00 0.00 58.65 58.67 2kui h GLN 509 Cb 0.07 -0.10 -0.01 0.00 0.08 0.00 0.00 27.48 27.53 2kui h GLN 509 CO -0.01 0.68 -0.20 -0.22 0.09 0.00 0.00 178.83 179.16 2kui h LYS 510 N 0.66 -0.47 -0.70 0.06 3.64 -1.18 0.77 116.57 119.35 2kui h LYS 510 Ca 0.14 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 2kui h LYS 510 Cb 0.35 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 2kui h LYS 510 CO 0.01 -0.31 0.32 -0.91 -2.27 0.00 0.00 179.45 176.29 2kui h ASN 511 N -0.49 0.93 -0.20 4.20 2.35 -0.87 -0.49 115.58 121.02 2kui h ASN 511 Ca -0.03 -0.14 -0.00 0.00 -0.55 0.00 0.00 56.30 55.58 2kui h ASN 511 Cb 0.41 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2kui h ASN 511 CO 0.02 0.82 0.11 0.25 -1.65 0.00 0.00 177.43 176.97 2kui h LEU 512 N 0.98 0.24 -0.75 1.61 6.46 -0.50 -1.73 115.31 121.63 2kui h LEU 512 Ca 0.24 -0.08 -0.10 0.00 -0.12 0.00 0.00 57.88 57.82 2kui h LEU 512 Cb 0.14 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 39.99 2kui h LEU 512 CO -0.03 0.25 -0.11 0.78 -0.62 0.00 0.00 178.44 178.71 2kui h ASN 513 N 0.22 0.83 -0.03 1.25 -0.26 -0.52 -2.08 115.58 114.98 2kui h ASN 513 Ca 0.07 -0.26 -0.03 0.00 -0.56 0.00 0.00 56.30 55.52 2kui h ASN 513 Cb 0.06 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.09 2kui h ASN 513 CO -0.01 0.96 -0.05 0.58 -1.06 0.00 0.00 177.43 177.85 2kui h VAL 514 N 0.75 1.13 -0.21 2.81 2.07 -0.88 -2.62 116.25 119.30 2kui h VAL 514 Ca 0.12 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2kui h VAL 514 Cb 0.62 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.46 2kui h VAL 514 CO 0.04 0.17 0.00 -1.22 0.02 0.00 0.00 177.57 176.58 2kui n TYR 515 N -4.36 0.42 0.00 1.57 4.01 -0.67 -4.85 117.16 113.28 2kui n TYR 515 Ca -0.01 -0.18 0.00 0.00 -0.16 0.00 0.00 57.90 57.56 2kui n TYR 515 Cb 0.20 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 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 0.65 0.66 3.62 2.72 0.00 -0.99 -5.00 105.19 106.86 2kui n GLY 516 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.14 3.28 -0.55 1.61 0.08 -1.11 -4.72 117.98 114.43 2kui s PHE 517 Ca 0.00 0.73 0.22 0.00 0.12 0.00 0.00 56.93 58.00 2kui s PHE 517 Cb 0.00 -2.77 -0.17 0.00 -0.57 0.00 0.00 43.02 39.51 2kui s PHE 517 CO 0.00 -0.29 0.81 0.25 -0.10 0.00 0.00 175.22 175.89 2kui n THR 518 N 5.12 0.06 -4.04 0.64 -2.24 -1.22 -3.49 114.28 109.12 2kui n THR 518 Ca -0.03 -0.25 -0.31 0.00 -2.27 0.00 0.00 64.05 61.20 2kui n THR 518 Cb 0.49 0.40 -0.16 0.00 -2.10 0.00 0.00 70.33 68.97 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 -3.24 2.35 0.05 -0.78 1.02 -1.26 -5.04 119.74 112.84 2kui s LYS 519 Ca 0.01 -0.76 0.04 0.00 0.02 0.00 0.00 55.97 55.29 2kui s LYS 519 Cb 0.15 -2.36 -0.02 0.00 -0.52 0.00 0.00 37.83 35.08 2kui s LYS 519 CO 0.86 -0.32 -0.13 -0.59 -0.92 0.00 0.00 175.35 174.26 2kui s PHE 520 N 1.39 1.10 -0.01 3.18 -0.71 -1.26 -0.66 117.98 121.01 2kui s PHE 520 Ca 0.02 -0.41 0.03 0.00 -1.04 0.00 0.00 56.93 55.53 2kui s PHE 520 Cb -0.14 -0.64 -0.01 0.00 -1.21 0.00 0.00 43.02 41.02 2kui s PHE 520 CO -0.10 0.02 -0.10 -1.12 -1.34 0.00 0.00 175.22 172.59 2kui s SER 521 N -1.41 1.12 -0.12 1.98 0.01 0.70 -4.89 113.70 111.09 2kui s SER 521 Ca -0.02 -0.18 0.02 0.00 1.31 0.00 0.00 55.95 57.09 2kui s SER 521 Cb -0.09 -0.12 -0.00 0.00 0.21 0.00 0.00 66.02 66.02 2kui s SER 521 CO 0.01 0.11 -0.19 0.00 0.41 0.00 0.00 173.24 173.58 2kui s GLN 522 N -0.25 3.17 -0.00 12.44 1.03 -1.26 -0.40 119.66 134.39 2kui s GLN 522 Ca 0.04 -0.80 0.04 0.00 0.04 0.00 0.00 55.36 54.67 2kui s GLN 522 Cb -0.04 -2.46 -0.03 0.00 0.03 0.00 0.00 33.01 30.51 2kui s GLN 522 CO -0.00 0.14 -0.09 0.00 -2.54 0.00 0.00 175.29 172.80 2kui s ALA 523 N 0.47 2.92 -0.06 2.60 0.00 -0.33 -4.95 121.76 122.40 2kui s ALA 523 Ca -0.13 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 50.69 2kui s ALA 523 Cb -0.17 -1.07 -0.05 0.00 0.00 0.00 0.00 23.12 21.84 2kui s ALA 523 CO 0.06 0.60 0.28 -1.12 0.00 0.00 0.00 175.76 175.57 2kui s SER 524 N -1.30 6.60 0.24 0.00 0.01 -1.26 0.07 113.70 118.06 2kui s SER 524 Ca 0.16 0.71 0.10 0.00 1.31 0.00 0.00 55.95 58.23 2kui s SER 524 Cb -0.11 -2.16 -0.05 0.00 0.21 0.00 0.00 66.02 63.91 2kui s SER 524 CO 0.06 0.35 -0.19 -0.69 0.41 0.00 0.00 173.24 173.18 2kui s VAL 525 N -0.96 2.21 0.04 3.43 1.01 0.11 -4.89 120.40 121.36 2kui s VAL 525 Ca 0.19 -2.29 -0.25 0.00 0.00 0.00 0.00 61.98 59.64 2kui s VAL 525 Cb -0.14 -2.18 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 2kui s VAL 525 CO 0.09 -0.42 0.76 -1.81 0.00 0.00 0.00 175.10 173.71 2kui s ASP 526 N -3.32 7.20 0.36 3.32 1.01 -1.26 -0.30 116.67 123.68 2kui s ASP 526 Ca 0.26 1.43 -0.09 0.00 0.71 0.00 0.00 52.55 54.86 2kui s ASP 526 Cb -0.04 -2.46 0.03 0.00 1.01 0.00 0.00 42.92 41.45 2kui s ASP 526 CO 0.12 0.02 0.62 -0.44 0.21 0.00 0.00 175.17 175.70 2kui s SER 527 N -0.06 0.48 0.00 0.27 0.01 -0.53 -4.81 113.70 109.06 2kui s SER 527 Ca 0.38 -1.31 0.26 0.00 1.31 0.00 0.00 55.95 56.59 2kui s SER 527 Cb -0.20 0.75 0.67 0.00 0.21 0.00 0.00 66.02 67.45 2kui s SER 527 CO 0.23 -1.47 1.52 -2.65 0.41 0.00 0.00 173.24 171.28 2kui n PRO 528 N -0.55 0.27 -2.87 12.44 -0.02 -1.26 -3.74 135.00 139.27 2kui n PRO 528 Ca -0.03 -0.15 -0.38 0.00 -2.02 0.00 0.00 63.50 60.92 2kui n PRO 528 Cb 0.61 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.53 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 -2.83 4.61 0.88 -0.52 3.00 -1.26 -4.86 118.95 117.97 2kui s ARG 529 Ca 0.16 1.26 -0.10 0.00 0.00 0.00 0.00 55.73 57.05 2kui s ARG 529 Cb 0.18 -3.06 0.12 0.00 0.00 0.00 0.00 34.95 32.19 2kui s ARG 529 CO 0.63 0.44 1.13 -2.14 0.00 0.00 0.00 175.30 175.35 2kui s PRO 530 N -1.57 1.33 -0.04 3.54 0.02 -1.26 -2.49 135.00 134.53 2kui s PRO 530 Ca 0.43 1.40 -0.31 0.00 0.02 0.00 0.00 61.00 62.54 2kui s PRO 530 Cb -0.22 -1.77 -0.09 0.00 0.02 0.00 0.00 34.50 32.44 2kui s PRO 530 CO 0.26 -2.36 1.99 0.00 -0.33 0.00 0.00 177.00 176.56 2kui n ALA 531 N -4.04 1.41 0.00 -1.55 0.00 -1.24 -1.94 120.51 113.15 2kui n ALA 531 Ca 0.11 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2kui n ALA 531 Cb 0.52 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.31 2kui n ALA 531 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 532 N 4.73 1.61 3.72 0.00 0.00 -0.95 -4.97 105.19 109.33 2kui n GLY 532 Ca 0.23 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.84 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 4.53 -0.39 1.61 2.56 -0.82 0.19 118.70 126.38 2kui s GLU 533 Ca 0.00 1.21 -0.21 0.00 0.00 0.00 0.00 54.97 55.97 2kui s GLU 533 Cb 0.00 -3.43 0.01 0.00 2.00 0.00 0.00 34.13 32.71 2kui s GLU 533 CO 0.00 0.08 0.66 0.08 -0.56 0.00 0.00 175.26 175.52 2kui s VAL 534 N 0.62 4.84 -0.57 3.70 1.01 0.13 0.40 120.40 130.52 2kui s VAL 534 Ca 0.45 0.42 0.13 0.00 0.00 0.00 0.00 61.98 62.98 2kui s VAL 534 Cb -0.20 -4.15 0.40 0.00 0.00 0.00 0.00 36.38 32.43 2kui s VAL 534 CO 0.25 -0.45 1.33 0.41 0.00 0.00 0.00 175.10 176.63 2kui n THR 535 N 5.74 1.59 -2.40 3.92 -1.04 -0.62 -0.73 114.28 120.73 2kui n THR 535 Ca -0.01 -1.40 0.00 0.00 -2.04 0.00 0.00 64.05 60.60 2kui n THR 535 Cb 0.48 0.16 0.00 0.00 -1.82 0.00 0.00 70.33 69.15 2kui n THR 535 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2kui n GLY 536 N 0.03 -1.91 3.21 3.41 0.00 -1.10 -4.84 105.19 103.98 2kui n GLY 536 Ca 0.16 -1.23 -0.17 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.62 1.20 -0.00 2.61 -4.23 -1.26 -0.61 115.64 110.73 2kui s THR 537 Ca 0.00 -1.62 -0.24 0.00 -1.18 0.00 0.00 61.69 58.65 2kui s THR 537 Cb 0.00 -1.40 -0.16 0.00 1.34 0.00 0.00 72.50 72.28 2kui s THR 537 CO 0.00 -0.41 1.17 -1.13 -0.54 0.00 0.00 174.62 173.71 2kui h ASN 538 N 3.68 -0.34 -4.16 3.99 -1.24 -1.10 -3.43 115.58 112.98 2kui h ASN 538 Ca -0.39 -0.19 -0.49 0.00 0.71 0.00 0.00 56.30 55.94 2kui h ASN 538 Cb 1.19 0.09 0.05 0.00 0.73 0.00 0.00 38.32 40.38 2kui h ASN 538 CO 0.49 0.06 0.38 -2.16 -1.29 0.00 0.00 177.43 174.91 2kui s PRO 539 N -4.47 3.44 0.29 6.67 0.04 -1.26 -4.99 135.00 134.73 2kui s PRO 539 Ca -0.14 1.25 -0.29 0.00 0.04 0.00 0.00 61.00 61.86 2kui s PRO 539 Cb 0.02 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.41 2kui s PRO 539 CO 0.53 -0.71 1.34 -2.14 0.04 0.00 0.00 177.00 176.06 2kui s PRO 540 N -3.84 4.34 0.27 0.56 0.02 -1.26 -4.95 135.00 130.13 2kui s PRO 540 Ca 0.65 2.22 -0.29 0.00 0.02 0.00 0.00 61.00 63.59 2kui s PRO 540 Cb -0.16 -3.10 -0.10 0.00 0.02 0.00 0.00 34.50 31.16 2kui s PRO 540 CO 0.32 -0.26 1.26 0.00 -0.33 0.00 0.00 177.00 177.99 2kui s ALA 541 N -0.66 3.49 0.00 -1.55 0.00 -1.26 -2.49 121.76 119.29 2kui s ALA 541 Ca 0.53 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.61 2kui s ALA 541 Cb -0.40 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.28 2kui s ALA 541 CO 0.48 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 176.16 2kui n GLY 542 N 1.50 1.53 3.75 0.00 0.00 -0.21 -4.87 105.19 106.89 2kui n GLY 542 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.42 3.44 -0.12 2.61 2.01 -1.04 -4.44 115.64 115.68 2kui s THR 543 Ca 0.00 1.32 -0.23 0.00 0.31 0.00 0.00 61.69 63.09 2kui s THR 543 Cb 0.00 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 2kui s THR 543 CO 0.00 0.26 0.69 0.28 -0.69 0.00 0.00 174.62 175.16 2kui s THR 544 N -0.59 5.02 0.10 -0.82 -1.32 -1.26 -1.14 115.64 115.63 2kui s THR 544 Ca 0.49 1.38 -0.00 0.00 -1.21 0.00 0.00 61.69 62.35 2kui s THR 544 Cb -0.33 -4.02 -0.04 0.00 -1.51 0.00 0.00 72.50 66.60 2kui s THR 544 CO 0.40 0.18 0.00 0.68 -2.21 0.00 0.00 174.62 173.67 2kui s VAL 545 N 1.33 0.28 0.28 5.08 -7.23 -0.11 -4.87 120.40 115.16 2kui s VAL 545 Ca 0.35 -1.88 -0.30 0.00 -1.81 0.00 0.00 61.98 58.33 2kui s VAL 545 Cb -0.17 -1.80 -0.11 0.00 0.56 0.00 0.00 36.38 34.86 2kui s VAL 545 CO 0.14 -0.73 1.60 -2.84 -0.31 0.00 0.00 175.10 172.96 2kui s PRO 546 N -3.96 4.13 0.62 4.82 0.02 -1.26 -1.02 135.00 138.35 2kui s PRO 546 Ca 0.16 2.57 0.40 0.00 0.02 0.00 0.00 61.00 64.15 2kui s PRO 546 Cb 0.07 -3.03 2.05 0.00 0.02 0.00 0.00 34.50 33.61 2kui s PRO 546 CO -0.04 -0.63 2.24 -0.39 -0.33 0.00 0.00 177.00 177.85 2kui h VAL 547 N 3.44 0.03 -0.00 3.83 -1.51 -1.01 -0.96 116.25 120.06 2kui h VAL 547 Ca -0.47 -0.19 0.00 0.00 -1.23 0.00 0.00 66.70 64.82 2kui h VAL 547 Cb 1.22 1.18 0.00 0.00 -2.13 0.00 0.00 31.29 31.56 2kui h VAL 547 CO 0.81 0.00 -0.08 -0.67 -1.23 0.00 0.00 177.57 176.40 2kui n ASP 548 N -3.11 0.38 -4.81 4.19 2.03 -1.26 -3.41 116.55 110.56 2kui n ASP 548 Ca -0.02 -0.55 -0.31 0.00 0.52 0.00 0.00 54.79 54.43 2kui n ASP 548 Cb 0.15 -0.10 0.06 0.00 -0.72 0.00 0.00 41.12 40.51 2kui n ASP 548 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 2kui s SER 549 N -2.45 5.19 -0.34 1.67 0.01 -0.37 -4.79 113.70 112.62 2kui s SER 549 Ca 0.30 1.62 -0.15 0.00 1.31 0.00 0.00 55.95 59.03 2kui s SER 549 Cb 0.20 -2.46 -0.01 0.00 0.21 0.00 0.00 66.02 63.96 2kui s SER 549 CO 0.46 -1.57 0.35 -0.69 0.41 0.00 0.00 173.24 172.20 2kui s VAL 550 N -3.03 5.18 -0.02 3.43 1.01 -1.26 -4.22 120.40 121.49 2kui s VAL 550 Ca 0.59 0.03 -0.25 0.00 0.00 0.00 0.00 61.98 62.34 2kui s VAL 550 Cb -0.14 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 2kui s VAL 550 CO 0.55 -0.08 0.76 -0.63 0.00 0.00 0.00 175.10 175.70 2kui s ILE 551 N 1.99 4.91 -0.31 2.22 1.01 0.16 -4.87 121.20 126.30 2kui s ILE 551 Ca 0.11 1.60 -0.10 0.00 0.00 0.00 0.00 60.65 62.25 2kui s ILE 551 Cb -0.17 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.18 2kui s ILE 551 CO 0.11 0.28 0.17 -0.70 0.00 0.00 0.00 174.94 174.81 2kui s GLU 552 N 0.50 3.45 -0.14 2.79 2.12 -1.26 -0.22 118.70 125.94 2kui s GLU 552 Ca 0.40 -0.65 -0.06 0.00 0.36 0.00 0.00 54.97 55.02 2kui s GLU 552 Cb -0.19 -3.62 -0.04 0.00 0.26 0.00 0.00 34.13 30.54 2kui s GLU 552 CO 0.21 -0.39 0.06 -0.48 -0.54 0.00 0.00 175.26 174.13 2kui s LEU 553 N 1.65 3.88 -0.29 2.70 2.34 0.47 -0.46 118.68 128.96 2kui s LEU 553 Ca 0.05 0.18 -0.10 0.00 0.06 0.00 0.00 54.13 54.32 2kui s LEU 553 Cb -0.17 -1.95 -0.03 0.00 -0.56 0.00 0.00 46.19 43.48 2kui s LEU 553 CO 0.08 0.28 0.17 0.00 -1.06 0.00 0.00 176.35 175.81 2kui s GLN 554 N -0.26 3.69 -0.12 1.48 -2.07 0.22 -1.19 119.66 121.40 2kui s GLN 554 Ca 0.08 -0.49 -0.04 0.00 -1.82 0.00 0.00 55.36 53.09 2kui s GLN 554 Cb -0.12 -3.60 -0.04 0.00 -1.09 0.00 0.00 33.01 28.16 2kui s GLN 554 CO 0.01 -0.28 0.04 0.08 -1.32 0.00 0.00 175.29 173.83 2kui s VAL 555 N 1.70 4.62 0.46 3.63 1.01 0.11 -1.59 120.40 130.33 2kui s VAL 555 Ca 0.06 -0.12 -0.21 0.00 0.00 0.00 0.00 61.98 61.71 2kui s VAL 555 Cb -0.16 -3.00 -0.09 0.00 0.00 0.00 0.00 36.38 33.13 2kui s VAL 555 CO 0.09 0.56 1.03 -0.44 0.00 0.00 0.00 175.10 176.34 2kui s SER 556 N -0.45 6.50 0.19 3.32 0.01 0.16 0.09 113.70 123.53 2kui s SER 556 Ca 0.09 1.94 0.07 0.00 1.31 0.00 0.00 55.95 59.36 2kui s SER 556 Cb -0.12 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.51 2kui s SER 556 CO 0.02 -0.67 0.07 -1.59 0.41 0.00 0.00 173.24 171.48 2kui s LYS 557 N -3.03 2.61 0.35 12.44 -2.85 0.59 -2.24 119.74 127.61 2kui s LYS 557 Ca 0.64 -1.06 0.16 0.00 -1.00 0.00 0.00 55.97 54.71 2kui s LYS 557 Cb -0.17 -2.45 0.60 0.00 -2.06 0.00 0.00 37.83 33.74 2kui s LYS 557 CO 0.21 0.45 1.71 0.78 0.10 0.00 0.00 175.35 178.60 2kui h GLY 558 N 2.37 0.00 -3.00 0.59 0.00 -1.67 -1.40 103.07 99.96 2kui h GLY 558 Ca -0.47 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.48 2kui h GLY 558 CO 0.60 0.00 -0.47 -2.01 0.00 0.00 0.00 176.54 174.66 2kui n ASN 559 N -3.66 -5.38 -3.87 0.19 5.15 -1.25 -4.32 115.26 102.12 2kui n ASN 559 Ca -0.01 0.08 -0.10 0.00 -0.60 0.00 0.00 54.58 53.95 2kui n ASN 559 Cb 0.53 -4.52 -0.09 0.00 -0.53 0.00 0.00 39.78 35.17 2kui n ASN 559 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2kui s GLN 560 N -4.90 0.65 0.04 1.20 2.00 -1.26 -2.49 119.66 114.90 2kui s GLN 560 Ca 0.00 -0.64 -0.05 0.00 -2.00 0.00 0.00 55.36 52.67 2kui s GLN 560 Cb 0.00 0.27 -0.02 0.00 0.80 0.00 0.00 33.01 34.06 2kui s GLN 560 CO 0.00 -0.18 0.07 -0.59 -0.50 0.00 0.00 175.29 174.09 2kui s PHE 561 N -2.48 0.27 -0.23 1.67 -0.71 0.45 -4.88 117.98 112.08 2kui s PHE 561 Ca -0.06 -0.63 -0.29 0.00 -1.04 0.00 0.00 56.93 54.91 2kui s PHE 561 Cb -0.02 -0.19 0.01 0.00 -1.21 0.00 0.00 43.02 41.61 2kui s PHE 561 CO -0.04 -0.38 1.08 0.08 -1.34 0.00 0.00 175.22 174.63 2kui s VAL 562 N -2.95 4.59 -0.11 -2.49 1.01 -1.26 -0.07 120.40 119.12 2kui s VAL 562 Ca -0.02 1.92 -0.20 0.00 0.00 0.00 0.00 61.98 63.68 2kui s VAL 562 Cb 0.01 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 2kui s VAL 562 CO -0.06 -0.20 0.54 -0.32 0.00 0.00 0.00 175.10 175.06 2kui s MET 563 N 3.30 4.36 1.02 2.72 1.75 -0.81 -4.92 119.30 126.72 2kui s MET 563 Ca 0.46 0.56 -0.13 0.00 -1.25 0.00 0.00 55.69 55.33 2kui s MET 563 Cb -0.16 -3.45 0.20 0.00 2.84 0.00 0.00 34.83 34.27 2kui s MET 563 CO 0.08 0.11 1.09 -2.14 -0.65 0.00 0.00 175.02 173.52 2kui s PRO 564 N 0.73 0.24 0.25 4.11 0.02 -1.26 -0.11 135.00 138.97 2kui s PRO 564 Ca 0.29 0.51 -0.30 0.00 0.02 0.00 0.00 61.00 61.52 2kui s PRO 564 Cb -0.16 -1.72 -0.09 0.00 0.02 0.00 0.00 34.50 32.56 2kui s PRO 564 CO 0.12 -2.86 1.02 0.34 -0.33 0.00 0.00 177.00 175.29 2kui s ASP 565 N -3.39 7.45 -0.00 2.53 -1.08 -1.26 -4.69 116.67 116.22 2kui s ASP 565 Ca 0.66 2.09 0.01 0.00 -0.52 0.00 0.00 52.55 54.78 2kui s ASP 565 Cb -0.19 -2.62 0.01 0.00 -1.46 0.00 0.00 42.92 38.66 2kui s ASP 565 CO 0.58 -0.01 0.69 -0.11 0.52 0.00 0.00 175.17 176.84 2kui n LEU 566 N 1.50 0.21 -4.80 -1.34 7.94 -1.26 -5.09 117.00 114.16 2kui n LEU 566 Ca -0.01 -0.50 -0.35 0.00 -1.11 0.00 0.00 56.01 54.04 2kui n LEU 566 Cb 0.46 -0.01 -0.07 0.00 0.53 0.00 0.00 43.42 44.33 2kui n LEU 566 CO 0.52 0.12 0.65 -0.94 -1.11 0.00 0.00 177.39 176.64 2kui s SER 567 N -0.43 7.09 0.00 1.96 1.04 -1.26 -3.72 113.70 118.39 2kui s SER 567 Ca 0.01 1.75 0.00 0.00 0.48 0.00 0.00 55.95 58.19 2kui s SER 567 Cb 0.01 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2kui s SER 567 CO 0.00 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2kui n GLY 568 N -0.16 0.53 3.82 7.32 0.00 -0.66 -4.96 105.19 111.08 2kui n GLY 568 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.71 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 -0.21 4.18 0.75 1.61 1.00 -1.24 -4.69 119.30 120.69 2kui s MET 569 Ca 0.00 0.75 -0.04 0.00 0.00 0.00 0.00 55.69 56.40 2kui s MET 569 Cb 0.00 -2.97 0.13 0.00 0.00 0.00 0.00 34.83 31.98 2kui s MET 569 CO 0.00 0.47 1.04 -0.06 0.00 0.00 0.00 175.02 176.47 2kui s PHE 570 N -1.42 1.76 0.39 -0.03 0.40 -1.26 -0.06 117.98 117.77 2kui s PHE 570 Ca 0.39 -0.11 0.06 0.00 -0.60 0.00 0.00 56.93 56.68 2kui s PHE 570 Cb -0.17 -3.18 0.80 0.00 0.51 0.00 0.00 43.02 40.98 2kui s PHE 570 CO 0.20 -1.80 2.02 2.35 0.70 0.00 0.00 175.22 178.69 2kui h TRP 571 N -0.69 0.52 0.00 0.36 2.91 -1.93 0.13 115.95 117.25 2kui h TRP 571 Ca -0.39 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.63 2kui h TRP 571 Cb 1.27 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 29.75 2kui h TRP 571 CO -0.28 0.37 0.00 1.33 -1.03 0.00 0.00 178.44 178.83 2kui n VAL 572 N -4.43 0.48 -0.12 2.65 0.24 -1.26 -2.27 118.33 113.62 2kui n VAL 572 Ca 0.03 0.12 -0.21 0.00 -2.04 0.00 0.00 64.34 62.24 2kui n VAL 572 Cb 0.10 -0.78 -0.10 0.00 -1.47 0.00 0.00 33.84 31.59 2kui n VAL 572 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2kui n ASP 573 N -1.38 2.00 0.03 -1.34 8.00 -0.07 -4.53 116.55 119.26 2kui n ASP 573 Ca 0.08 0.05 -0.11 0.00 0.71 0.00 0.00 54.79 55.52 2kui n ASP 573 Cb 0.20 -0.53 -0.04 0.00 -0.02 0.00 0.00 41.12 40.72 2kui n ASP 573 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kui h ALA 574 N -0.37 -0.28 0.26 2.24 0.00 -0.40 0.67 119.26 121.38 2kui h ALA 574 Ca -0.58 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 2kui h ALA 574 Cb 1.73 0.44 0.00 0.00 0.00 0.00 0.00 17.79 19.96 2kui h ALA 574 CO -0.21 -0.73 -0.13 0.93 0.00 0.00 0.00 179.25 179.12 2kui h GLU 575 N -0.35 -0.34 -0.93 0.00 5.08 -1.77 -0.17 114.58 116.10 2kui h GLU 575 Ca 0.08 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2kui h GLU 575 Cb 0.46 0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.74 2kui h GLU 575 CO -0.25 -0.05 0.60 -1.35 -1.00 0.00 0.00 179.01 176.96 2kui h PRO 576 N -0.62 1.23 -0.15 2.33 0.11 -1.78 -2.55 132.00 130.56 2kui h PRO 576 Ca -0.04 -0.09 -0.11 0.00 0.11 0.00 0.00 66.00 65.88 2kui h PRO 576 Cb 0.44 -0.27 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 2kui h PRO 576 CO 0.06 0.83 -0.39 0.00 -0.21 0.00 0.00 178.00 178.28 2kui h ARG 577 N 1.26 0.34 -0.08 1.05 3.08 -0.83 0.50 114.38 119.71 2kui h ARG 577 Ca 0.34 -0.16 0.02 0.00 0.07 0.00 0.00 59.98 60.24 2kui h ARG 577 Cb -0.12 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2kui h ARG 577 CO -0.07 0.69 -0.03 1.25 -1.07 0.00 0.00 179.97 180.74 2kui h LEU 578 N 0.29 -0.11 -0.30 3.04 6.46 -0.60 -0.10 115.31 123.99 2kui h LEU 578 Ca 0.03 0.03 -0.08 0.00 -0.12 0.00 0.00 57.88 57.74 2kui h LEU 578 Cb 0.83 0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.81 2kui h LEU 578 CO 0.07 -0.05 -0.13 0.08 -0.62 0.00 0.00 178.44 177.79 2kui h ARG 579 N -0.02 0.62 -0.71 1.25 0.11 -1.44 0.99 114.38 115.17 2kui h ARG 579 Ca 0.04 -0.27 -0.06 0.00 0.10 0.00 0.00 59.98 59.80 2kui h ARG 579 Cb 0.09 -0.02 -0.03 0.00 1.11 0.00 0.00 29.97 31.12 2kui h ARG 579 CO -0.09 0.84 0.21 0.00 0.10 0.00 0.00 179.97 181.03 2kui h ALA 580 N 0.76 0.94 -0.03 0.08 0.00 -0.53 -2.48 119.26 117.99 2kui h ALA 580 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2kui h ALA 580 Cb 0.65 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2kui h ALA 580 CO 0.04 0.63 0.00 1.47 0.00 0.00 0.00 179.25 181.39 2kui n LEU 581 N -4.27 1.99 -1.92 0.00 -0.00 -0.08 -4.94 117.00 107.77 2kui n LEU 581 Ca 0.05 -0.68 -0.09 0.00 -0.00 0.00 0.00 56.01 55.29 2kui n LEU 581 Cb 0.23 -0.01 0.04 0.00 -0.00 0.00 0.00 43.42 43.68 2kui n LEU 581 CO 0.42 0.34 0.09 0.61 -0.00 0.00 0.00 177.39 178.84 2kui n GLY 582 N 1.23 0.23 3.70 1.47 0.00 -0.94 -4.97 105.19 105.91 2kui n GLY 582 Ca 0.17 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.15 3.16 -1.97 1.61 -0.00 0.31 -4.90 118.94 114.01 2kui s TRP 583 Ca 0.17 1.10 0.17 0.00 -0.00 0.00 0.00 56.10 57.54 2kui s TRP 583 Cb -0.08 -3.51 0.21 0.00 -0.00 0.00 0.00 33.47 30.10 2kui s TRP 583 CO 0.32 -1.72 1.12 2.41 -0.00 0.00 0.00 176.95 179.08 2kui n THR 584 N 4.39 0.24 -2.56 5.86 -1.04 -1.26 -4.82 114.28 115.09 2kui n THR 584 Ca 0.11 -0.62 -0.22 0.00 -2.04 0.00 0.00 64.05 61.28 2kui n THR 584 Cb 0.45 1.15 0.06 0.00 -1.82 0.00 0.00 70.33 70.18 2kui n THR 584 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 2kui s GLY 585 N -1.32 1.79 -0.03 3.41 0.00 -0.84 -4.84 107.32 105.49 2kui s GLY 585 Ca 0.24 -1.39 -0.16 0.00 0.00 0.00 0.00 44.72 43.41 2kui s GLY 585 CO 0.22 -1.00 0.43 1.06 0.00 0.00 0.00 173.10 173.81 2kui s MET 586 N -4.95 4.06 -0.07 2.90 -1.94 -1.26 -4.92 119.30 113.12 2kui s MET 586 Ca 0.60 0.43 -0.27 0.00 -1.71 0.00 0.00 55.69 54.75 2kui s MET 586 Cb -0.09 -3.28 -0.03 0.00 2.01 0.00 0.00 34.83 33.44 2kui s MET 586 CO 0.41 0.54 0.86 -1.17 -0.01 0.00 0.00 175.02 175.66 2kui s LEU 587 N -0.61 4.30 -0.53 -0.03 1.98 -1.26 -4.38 118.68 118.14 2kui s LEU 587 Ca 0.24 1.40 -0.18 0.00 -2.89 0.00 0.00 54.13 52.69 2kui s LEU 587 Cb -0.16 -3.34 0.08 0.00 0.66 0.00 0.00 46.19 43.42 2kui s LEU 587 CO 0.13 -0.26 0.62 -0.62 -1.89 0.00 0.00 176.35 174.32 2kui s ASP 588 N 0.98 6.20 -0.31 3.68 -1.08 -1.26 -5.00 116.67 119.88 2kui s ASP 588 Ca 0.44 -1.18 -0.04 0.00 -0.52 0.00 0.00 52.55 51.25 2kui s ASP 588 Cb -0.19 -2.28 0.04 0.00 -1.46 0.00 0.00 42.92 39.04 2kui s ASP 588 CO 0.20 -0.93 0.04 -0.75 0.52 0.00 0.00 175.17 174.25 2kui s LYS 589 N 2.48 2.58 0.00 4.34 2.47 -1.26 -4.58 119.74 125.77 2kui s LYS 589 Ca 0.12 -1.18 0.00 0.00 -1.56 0.00 0.00 55.97 53.35 2kui s LYS 589 Cb -0.22 -3.27 0.00 0.00 -1.46 0.00 0.00 37.83 32.88 2kui s LYS 589 CO 0.09 -0.60 0.00 0.41 0.16 0.00 0.00 175.35 175.41 2kui n GLY 590 N 4.71 0.70 3.87 5.54 0.00 -1.26 -5.06 105.19 113.69 2kui n GLY 590 Ca -0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.60 3.25 -0.21 4.61 0.00 -1.26 -5.05 121.76 119.50 2kui s ALA 591 Ca 0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 51.96 51.68 2kui s ALA 591 Cb 0.00 -2.84 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 2kui s ALA 591 CO 0.00 -0.17 0.41 -0.51 0.00 0.00 0.00 175.76 175.49 2kui s ASP 592 N -3.31 6.43 -0.09 0.00 1.01 -1.26 -4.80 116.67 114.64 2kui s ASP 592 Ca 0.53 0.50 0.02 0.00 0.71 0.00 0.00 52.55 54.32 2kui s ASP 592 Cb -0.10 -2.24 0.01 0.00 1.01 0.00 0.00 42.92 41.60 2kui s ASP 592 CO 0.35 -0.10 -0.15 -0.69 0.21 0.00 0.00 175.17 174.78 2kui s VAL 593 N 1.45 1.43 -0.12 -1.27 1.01 -0.41 -4.94 120.40 117.55 2kui s VAL 593 Ca 0.19 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 2kui s VAL 593 Cb -0.15 -1.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.91 2kui s VAL 593 CO 0.08 0.42 1.32 1.51 0.00 0.00 0.00 175.10 178.44 2kui s ASP 594 N 0.79 6.91 -0.01 3.32 -4.77 -1.26 -1.39 116.67 120.26 2kui s ASP 594 Ca -0.11 1.82 0.00 0.00 -3.30 0.00 0.00 52.55 50.96 2kui s ASP 594 Cb -0.16 -2.54 -0.01 0.00 -1.09 0.00 0.00 42.92 39.12 2kui s ASP 594 CO 0.02 -0.76 -0.01 0.00 0.70 0.00 0.00 175.17 175.12 2kui n ALA 595 N 6.39 1.97 -0.97 2.11 0.00 -1.26 -4.97 120.51 123.78 2kui n ALA 595 Ca 0.14 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2kui n ALA 595 Cb 0.45 0.45 0.00 0.00 0.00 0.00 0.00 19.45 20.34 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 3.39 0.92 0.29 0.00 0.00 -1.26 -1.34 105.19 107.19 2kui n GLY 596 Ca -0.02 -0.78 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 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 1.09 0.85 -0.02 0.00 -1.99 -0.51 103.07 102.49 2kui h GLY 597 Ca 0.00 -0.74 0.04 0.00 0.00 0.00 0.00 47.33 46.64 2kui h GLY 597 CO 0.00 0.68 0.62 1.76 0.00 0.00 0.00 176.54 179.61 2kui h SER 598 N 0.92 1.03 -0.01 0.19 0.02 -2.00 -2.10 113.55 111.60 2kui h SER 598 Ca 0.18 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2kui h SER 598 Cb 0.44 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.75 2kui h SER 598 CO 0.01 0.70 -0.25 0.00 -1.14 0.00 0.00 176.83 176.15 2kui n GLN 599 N -4.49 1.86 -2.58 3.45 1.13 -0.45 -5.08 117.38 111.23 2kui n GLN 599 Ca 0.13 -0.71 -0.03 0.00 -1.94 0.00 0.00 57.00 54.44 2kui n GLN 599 Cb 0.11 -1.17 -0.03 0.00 0.11 0.00 0.00 30.24 29.27 2kui n GLN 599 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 2kui n HIS 600 N -0.16 -3.76 -2.44 1.08 8.25 -0.22 -4.78 115.22 113.19 2kui n HIS 600 Ca 0.05 2.21 -0.39 0.00 -0.26 0.00 0.00 57.72 59.33 2kui n HIS 600 Cb 0.27 -3.37 -0.02 0.00 1.12 0.00 0.00 29.99 27.99 2kui n HIS 600 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2kui s ASN 601 N -0.53 6.33 0.27 0.41 4.22 -1.11 -4.69 114.94 119.85 2kui s ASN 601 Ca -0.17 -2.21 0.02 0.00 -2.14 0.00 0.00 52.86 48.35 2kui s ASN 601 Cb 0.01 -2.58 -0.05 0.00 1.28 0.00 0.00 41.25 39.91 2kui s ASN 601 CO 0.47 -1.71 0.11 0.00 -2.04 0.00 0.00 177.10 173.93 2kui s ARG 602 N 4.87 1.47 0.19 3.55 1.70 -1.26 -4.18 118.95 125.29 2kui s ARG 602 Ca 0.58 -1.81 -0.32 0.00 -0.47 0.00 0.00 55.73 53.71 2kui s ARG 602 Cb 0.03 -0.25 -0.11 0.00 -0.57 0.00 0.00 34.95 34.04 2kui s ARG 602 CO 0.09 -0.33 1.70 0.08 -1.08 0.00 0.00 175.30 175.76 2kui s VAL 603 N -3.70 2.19 -0.19 4.99 1.01 0.91 -4.17 120.40 121.44 2kui s VAL 603 Ca 0.37 0.11 -0.23 0.00 0.00 0.00 0.00 61.98 62.23 2kui s VAL 603 Cb 0.07 -3.07 -0.20 0.00 0.00 0.00 0.00 36.38 33.18 2kui s VAL 603 CO 0.15 0.01 0.35 0.58 0.00 0.00 0.00 175.10 176.18 2kui h VAL 604 N 3.91 1.11 -3.51 2.92 2.07 -0.57 -1.74 116.25 120.45 2kui h VAL 604 Ca -0.43 -2.19 -0.08 0.00 0.82 0.00 0.00 66.70 64.82 2kui h VAL 604 Cb 1.20 2.45 -0.15 0.00 -1.52 0.00 0.00 31.29 33.27 2kui h VAL 604 CO 0.95 0.38 -0.26 -0.72 0.02 0.00 0.00 177.57 177.93 2kui s TYR 605 N -2.32 -0.03 -0.20 1.57 1.13 -1.26 -4.67 117.35 111.57 2kui s TYR 605 Ca -0.26 -0.25 -0.04 0.00 -1.41 0.00 0.00 57.07 55.11 2kui s TYR 605 Cb 0.03 0.07 -0.02 0.00 -1.10 0.00 0.00 41.96 40.94 2kui s TYR 605 CO 0.60 -0.55 -0.02 1.14 -2.51 0.00 0.00 175.55 174.21 2kui s GLN 606 N -3.23 3.51 0.16 -3.49 -2.07 -1.26 -3.69 119.66 109.59 2kui s GLN 606 Ca -0.00 -0.57 -0.23 0.00 -1.82 0.00 0.00 55.36 52.74 2kui s GLN 606 Cb 0.02 -3.02 0.05 0.00 -1.09 0.00 0.00 33.01 28.96 2kui s GLN 606 CO -0.08 -0.05 1.60 -0.97 -1.32 0.00 0.00 175.29 174.47 2kui h ASN 607 N 7.67 -1.07 -3.20 12.60 -0.73 -1.14 -3.39 115.58 126.32 2kui h ASN 607 Ca -0.37 0.19 -0.58 0.00 1.87 0.00 0.00 56.30 57.41 2kui h ASN 607 Cb 1.17 0.50 -0.05 0.00 0.27 0.00 0.00 38.32 40.22 2kui h ASN 607 CO 0.60 -0.32 -0.08 -2.16 -0.37 0.00 0.00 177.43 175.10 2kui s PRO 608 N -6.00 4.16 0.51 6.67 0.05 -1.26 -5.01 135.00 134.11 2kui s PRO 608 Ca -0.15 0.65 -0.22 0.00 0.05 0.00 0.00 61.00 61.34 2kui s PRO 608 Cb 0.13 -3.26 -0.06 0.00 0.05 0.00 0.00 34.50 31.36 2kui s PRO 608 CO 0.68 0.59 1.19 -1.25 0.05 0.00 0.00 177.00 178.25 2kui s PRO 609 N -0.88 3.49 0.20 0.56 0.04 -1.26 -4.97 135.00 132.19 2kui s PRO 609 Ca 0.28 1.81 -0.30 0.00 0.04 0.00 0.00 61.00 62.83 2kui s PRO 609 Cb -0.18 -2.24 -0.09 0.00 0.04 0.00 0.00 34.50 32.02 2kui s PRO 609 CO 0.17 -0.78 1.39 0.00 0.04 0.00 0.00 177.00 177.82 2kui s ALA 610 N -1.56 3.59 0.00 8.56 0.00 -1.26 -2.42 121.76 128.67 2kui s ALA 610 Ca 0.68 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.85 2kui s ALA 610 Cb -0.29 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2kui s ALA 610 CO 0.35 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.87 2kui n GLY 611 N 2.58 0.61 3.92 0.00 0.00 0.84 -4.95 105.19 108.18 2kui n GLY 611 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.24 5.01 0.00 2.61 2.01 -1.02 -4.73 115.64 117.28 2kui s THR 612 Ca 0.00 -0.05 -0.30 0.00 0.31 0.00 0.00 61.69 61.65 2kui s THR 612 Cb 0.00 -3.81 -0.04 0.00 0.01 0.00 0.00 72.50 68.66 2kui s THR 612 CO 0.00 -0.56 1.10 -0.83 -0.69 0.00 0.00 174.62 173.65 2kui s GLY 613 N -3.71 2.52 0.04 4.40 0.00 -1.26 -1.93 107.32 107.38 2kui s GLY 613 Ca 0.44 0.65 0.08 0.00 0.00 0.00 0.00 44.72 45.89 2kui s GLY 613 CO 0.36 1.94 -0.24 -1.34 0.00 0.00 0.00 173.10 173.82 2kui s VAL 614 N 1.36 1.91 0.32 1.40 -7.23 0.90 -4.88 120.40 114.18 2kui s VAL 614 Ca 0.55 -1.27 -0.23 0.00 -1.81 0.00 0.00 61.98 59.21 2kui s VAL 614 Cb -0.24 -1.64 -0.16 0.00 0.56 0.00 0.00 36.38 34.90 2kui s VAL 614 CO 0.26 0.31 0.24 -0.46 -0.31 0.00 0.00 175.10 175.15 2kui n ASN 615 N 1.87 -2.21 0.06 4.85 2.04 -1.26 -0.41 115.26 120.20 2kui n ASN 615 Ca -0.17 0.91 0.19 0.00 -0.44 0.00 0.00 54.58 55.07 2kui n ASN 615 Cb 0.52 -0.89 0.72 0.00 -2.53 0.00 0.00 39.78 37.61 2kui n ASN 615 CO 0.00 0.00 0.00 0.08 -0.44 0.00 0.00 177.26 176.90 2kui h ARG 616 N 0.56 0.00 -0.80 -3.83 0.11 -1.82 0.68 114.38 109.28 2kui h ARG 616 Ca -0.33 0.00 0.01 0.00 0.10 0.00 0.00 59.98 59.76 2kui h ARG 616 Cb 1.41 0.00 -0.04 0.00 1.11 0.00 0.00 29.97 32.45 2kui h ARG 616 CO 0.49 0.00 0.53 0.22 0.10 0.00 0.00 179.97 181.31 2kui h ASP 617 N 0.00 0.92 0.00 0.08 3.58 -1.88 -3.47 116.42 115.65 2kui h ASP 617 Ca 0.20 -0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.63 2kui h ASP 617 Cb 0.90 -0.23 0.00 0.00 1.72 0.00 0.00 39.33 41.72 2kui h ASP 617 CO -0.00 0.67 0.00 0.61 -2.88 0.00 0.00 179.24 177.64 2kui n GLY 618 N -1.31 0.66 3.66 -0.78 0.00 0.23 -1.98 105.19 105.67 2kui n GLY 618 Ca 0.08 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 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 3.78 -0.06 -0.61 -1.16 -1.26 -4.39 121.20 115.50 2kui s ILE 619 Ca 0.00 0.95 0.04 0.00 -0.51 0.00 0.00 60.65 61.12 2kui s ILE 619 Cb 0.00 -3.62 0.00 0.00 0.61 0.00 0.00 42.46 39.45 2kui s ILE 619 CO 0.00 -0.09 -0.18 -0.51 -2.81 0.00 0.00 174.94 171.35 2kui s ILE 620 N 3.94 1.55 -0.25 2.00 2.07 -1.26 -4.94 121.20 124.32 2kui s ILE 620 Ca 0.68 -0.75 -0.14 0.00 -1.41 0.00 0.00 60.65 59.03 2kui s ILE 620 Cb -0.30 -1.35 -0.04 0.00 0.13 0.00 0.00 42.46 40.90 2kui s ILE 620 CO 0.25 0.45 0.32 -0.89 -1.91 0.00 0.00 174.94 173.16 2kui s THR 621 N 0.26 5.23 0.14 4.00 2.01 -1.26 -4.50 115.64 121.52 2kui s THR 621 Ca -0.10 0.49 0.11 0.00 0.31 0.00 0.00 61.69 62.50 2kui s THR 621 Cb -0.14 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 2kui s THR 621 CO 0.04 0.23 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.18 2kui s LEU 622 N 1.64 2.35 -0.03 4.42 1.43 -1.26 -0.46 118.68 126.77 2kui s LEU 622 Ca 0.14 -0.77 0.04 0.00 -1.03 0.00 0.00 54.13 52.51 2kui s LEU 622 Cb -0.15 -1.22 -0.00 0.00 0.03 0.00 0.00 46.19 44.85 2kui s LEU 622 CO 0.08 0.17 -0.14 -0.60 0.23 0.00 0.00 176.35 176.10 2kui s ARG 623 N -2.17 1.42 0.13 1.70 6.06 -1.24 -4.69 118.95 120.15 2kui s ARG 623 Ca 0.15 -0.48 -0.04 0.00 -2.50 0.00 0.00 55.73 52.86 2kui s ARG 623 Cb -0.10 -1.27 -0.03 0.00 0.06 0.00 0.00 34.95 33.62 2kui s ARG 623 CO 0.07 0.20 0.13 -0.59 -2.50 0.00 0.00 175.30 172.61 2kui s PHE 624 N 0.08 0.59 0.00 5.12 -0.71 -1.26 0.23 117.98 122.03 2kui s PHE 624 Ca -0.03 -0.99 0.00 0.00 -1.04 0.00 0.00 56.93 54.87 2kui s PHE 624 Cb -0.10 -0.28 0.00 0.00 -1.21 0.00 0.00 43.02 41.43 2kui s PHE 624 CO 0.01 -0.57 0.06 0.41 -1.34 0.00 0.00 175.22 173.79 2kui n GLY 625 N -0.10 1.14 0.95 1.99 0.00 -1.26 -4.78 105.19 103.13 2kui n GLY 625 Ca -0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.06 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14