#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 4.21 0.55 -0.61 1.10 -1.26 -4.99 121.20 120.20 2kui s ILE 356 Ca 0.00 1.51 -0.19 0.00 -0.51 0.00 0.00 60.65 61.46 2kui s ILE 356 Cb 0.00 -3.97 -0.05 0.00 0.15 0.00 0.00 42.46 38.58 2kui s ILE 356 CO 0.00 -0.07 1.11 -0.89 -2.11 0.00 0.00 174.94 172.99 2kui s THR 357 N 2.86 3.27 -0.00 4.00 2.01 -1.26 -4.94 115.64 121.59 2kui s THR 357 Ca 0.56 0.76 0.11 0.00 0.31 0.00 0.00 61.69 63.44 2kui s THR 357 Cb -0.24 -3.29 -0.17 0.00 0.01 0.00 0.00 72.50 68.80 2kui s THR 357 CO 0.19 -0.20 1.03 0.03 -0.69 0.00 0.00 174.62 174.98 2kui h ARG 358 N 1.10 0.00 -6.06 4.92 2.47 -1.98 -3.45 114.38 111.37 2kui h ARG 358 Ca -0.49 0.00 -0.59 0.00 -1.26 0.00 0.00 59.98 57.63 2kui h ARG 358 Cb 1.25 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.54 2kui h ARG 358 CO 0.57 0.67 -0.39 -0.51 0.56 0.00 0.00 179.97 180.87 2kui s ASP 359 N -6.35 6.43 0.00 7.04 1.01 -1.26 -4.86 116.67 118.68 2kui s ASP 359 Ca -0.01 0.43 0.06 0.00 0.71 0.00 0.00 52.55 53.74 2kui s ASP 359 Cb 0.09 -2.03 -0.03 0.00 1.01 0.00 0.00 42.92 41.96 2kui s ASP 359 CO 0.81 0.09 -0.17 0.68 0.21 0.00 0.00 175.17 176.79 2kui s VAL 360 N -1.62 2.82 -0.29 -1.27 -7.23 0.11 -4.71 120.40 108.21 2kui s VAL 360 Ca 0.38 -1.02 -0.16 0.00 -1.81 0.00 0.00 61.98 59.38 2kui s VAL 360 Cb -0.12 -2.14 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 2kui s VAL 360 CO 0.26 0.45 0.40 -1.58 -0.31 0.00 0.00 175.10 174.32 2kui s GLN 361 N -1.13 3.90 -0.05 4.82 -0.44 -1.26 -0.43 119.66 125.08 2kui s GLN 361 Ca 0.13 -0.03 -0.10 0.00 -2.50 0.00 0.00 55.36 52.86 2kui s GLN 361 Cb -0.10 -3.70 -0.05 0.00 -1.64 0.00 0.00 33.01 27.52 2kui s GLN 361 CO 0.03 -0.37 0.26 0.08 0.50 0.00 0.00 175.29 175.80 2kui s VAL 362 N 2.12 5.29 0.40 1.34 1.01 -0.36 -5.02 120.40 125.20 2kui s VAL 362 Ca 0.15 0.42 -0.26 0.00 0.00 0.00 0.00 61.98 62.29 2kui s VAL 362 Cb -0.16 -3.54 -0.09 0.00 0.00 0.00 0.00 36.38 32.59 2kui s VAL 362 CO 0.11 0.55 1.28 -2.16 0.00 0.00 0.00 175.10 174.87 2kui s PRO 363 N -1.22 3.98 0.00 2.72 0.04 -1.26 -3.51 135.00 135.75 2kui s PRO 363 Ca 0.21 2.10 -0.10 0.00 0.04 0.00 0.00 61.00 63.25 2kui s PRO 363 Cb -0.14 -2.74 -0.05 0.00 0.04 0.00 0.00 34.50 31.61 2kui s PRO 363 CO 0.10 -0.47 0.32 0.34 0.04 0.00 0.00 177.00 177.33 2kui s ASP 364 N -0.80 6.61 0.00 6.66 -1.08 -1.26 -4.84 116.67 121.96 2kui s ASP 364 Ca 0.57 0.72 0.15 0.00 -0.52 0.00 0.00 52.55 53.47 2kui s ASP 364 Cb -0.37 -2.16 -0.09 0.00 -1.46 0.00 0.00 42.92 38.85 2kui s ASP 364 CO 0.47 0.28 0.72 0.55 0.52 0.00 0.00 175.17 177.71 2kui n VAL 365 N 1.41 0.00 -1.62 1.11 3.14 -1.26 -5.00 118.33 116.11 2kui n VAL 365 Ca -0.13 -0.24 -0.39 0.00 -2.96 0.00 0.00 64.34 60.62 2kui n VAL 365 Cb 0.53 1.09 0.03 0.00 -1.06 0.00 0.00 33.84 34.43 2kui n VAL 365 CO 0.00 0.00 0.00 -2.11 -6.46 0.00 0.00 176.83 168.26 2kui n ARG 366 N -0.77 1.20 0.00 1.45 -4.01 -1.26 -3.62 116.66 109.65 2kui n ARG 366 Ca 0.05 0.44 0.00 0.00 -1.04 0.00 0.00 57.85 57.30 2kui n ARG 366 Cb 0.27 -2.14 0.00 0.00 -3.04 0.00 0.00 32.46 27.55 2kui n ARG 366 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2kui n GLY 367 N 1.19 0.68 0.00 2.89 0.00 0.71 -4.98 105.19 105.68 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 -1.46 3.99 -3.67 1.61 6.02 -1.23 -4.92 117.38 117.73 2kui n GLN 368 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.71 2kui n GLN 368 Cb 0.00 0.00 -0.03 0.00 1.02 0.00 0.00 30.24 31.23 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 0.93 6.41 0.33 1.08 1.04 -1.26 -0.77 113.70 121.47 2kui s SER 369 Ca 0.00 0.46 0.04 0.00 0.48 0.00 0.00 55.95 56.92 2kui s SER 369 Cb 0.00 -2.03 0.65 0.00 0.10 0.00 0.00 66.02 64.74 2kui s SER 369 CO 0.00 -0.03 1.93 -1.28 0.98 0.00 0.00 173.24 174.85 2kui h SER 370 N 2.18 0.77 -0.18 7.02 0.87 -0.99 0.19 113.55 123.41 2kui h SER 370 Ca -0.47 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.06 2kui h SER 370 Cb 1.18 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.98 2kui h SER 370 CO 0.69 0.49 0.00 0.00 -0.53 0.00 0.00 176.83 177.49 2kui h ALA 371 N 1.56 0.25 -0.18 6.23 0.00 -1.94 0.23 119.26 125.42 2kui h ALA 371 Ca 0.35 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2kui h ALA 371 Cb 0.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2kui h ALA 371 CO -0.13 -0.04 -0.46 0.22 0.00 0.00 0.00 179.25 178.84 2kui h ASP 372 N 0.08 0.48 0.12 0.00 3.58 -1.85 0.82 116.42 119.65 2kui h ASP 372 Ca 0.05 -0.23 -0.01 0.00 0.42 0.00 0.00 57.03 57.27 2kui h ASP 372 Cb 0.38 -0.13 0.00 0.00 1.72 0.00 0.00 39.33 41.29 2kui h ASP 372 CO 0.01 0.87 -0.06 0.00 -2.88 0.00 0.00 179.24 177.18 2kui h ALA 373 N 1.15 -0.17 -0.73 -0.78 0.00 -0.42 0.18 119.26 118.48 2kui h ALA 373 Ca 0.02 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 2kui h ALA 373 Cb 0.95 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2kui h ALA 373 CO 0.08 -0.51 0.23 0.82 0.00 0.00 0.00 179.25 179.87 2kui h ILE 374 N -0.34 1.26 -0.32 0.00 2.04 -0.50 -2.37 117.51 117.30 2kui h ILE 374 Ca -0.02 -0.91 0.02 0.00 1.00 0.00 0.00 64.86 64.95 2kui h ILE 374 Cb 0.27 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 2kui h ILE 374 CO 0.03 0.36 0.16 0.00 0.00 0.00 0.00 178.15 178.70 2kui h ALA 375 N 1.11 0.39 -0.22 1.87 0.00 -0.58 0.26 119.26 122.10 2kui h ALA 375 Ca 0.24 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 2kui h ALA 375 Cb 0.31 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2kui h ALA 375 CO -0.01 -0.21 0.09 1.15 0.00 0.00 0.00 179.25 180.27 2kui h THR 376 N 0.34 1.16 -0.65 0.00 2.02 -0.83 -0.93 112.91 114.03 2kui h THR 376 Ca 0.13 -0.49 -0.05 0.00 0.77 0.00 0.00 66.41 66.77 2kui h THR 376 Cb 0.03 1.08 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 2kui h THR 376 CO -0.08 0.16 0.20 -0.07 0.37 0.00 0.00 175.52 176.10 2kui h LEU 377 N 0.21 0.95 -0.61 2.58 3.38 -1.02 -1.83 115.31 118.96 2kui h LEU 377 Ca 0.07 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.80 2kui h LEU 377 Cb 0.17 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2kui h LEU 377 CO -0.01 0.90 0.25 -0.61 0.09 0.00 0.00 178.44 179.07 2kui h GLN 378 N 0.94 0.91 0.00 1.13 5.75 -0.31 0.14 115.11 123.68 2kui h GLN 378 Ca 0.21 -0.16 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 2kui h GLN 378 Cb 0.30 -0.15 -0.00 0.00 1.07 0.00 0.00 27.48 28.70 2kui h GLN 378 CO -0.01 0.77 -0.01 -0.91 -2.65 0.00 0.00 178.83 176.02 2kui h ASN 379 N 0.85 0.00 0.85 -0.69 2.35 -0.79 -0.88 115.58 117.27 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 0.19 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.56 2kui h ASN 379 CO -0.02 0.01 -0.57 0.54 -1.65 0.00 0.00 177.43 175.74 2kui n ARG 380 N -3.12 0.25 -0.33 0.81 5.12 -0.72 -4.94 116.66 113.73 2kui n ARG 380 Ca -0.00 0.08 0.00 0.00 -1.93 0.00 0.00 57.85 56.00 2kui n ARG 380 Cb 0.27 -1.66 0.00 0.00 -1.16 0.00 0.00 32.46 29.91 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 0.81 3.90 -0.13 0.00 -0.34 -4.85 105.19 105.94 2kui n GLY 381 Ca 0.04 -0.24 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2kui n GLY 381 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 382 N -2.00 3.49 0.07 1.61 0.40 0.40 -4.37 117.98 117.58 2kui s PHE 382 Ca 0.00 0.82 -0.12 0.00 -0.60 0.00 0.00 56.93 57.03 2kui s PHE 382 Cb 0.00 -2.27 -0.06 0.00 0.51 0.00 0.00 43.02 41.20 2kui s PHE 382 CO 0.00 -0.04 0.43 0.15 0.70 0.00 0.00 175.22 176.46 2kui s LYS 383 N -3.98 3.84 0.04 0.44 -0.14 -0.49 -4.18 119.74 115.28 2kui s LYS 383 Ca 0.47 0.30 0.05 0.00 -1.36 0.00 0.00 55.97 55.43 2kui s LYS 383 Cb -0.10 -3.04 -0.02 0.00 -1.68 0.00 0.00 37.83 32.98 2kui s LYS 383 CO 0.34 0.58 -0.14 0.96 -0.76 0.00 0.00 175.35 176.33 2kui s ILE 384 N -1.33 1.08 -0.09 2.17 -0.00 -1.26 -0.56 121.20 121.21 2kui s ILE 384 Ca 0.32 -1.01 0.02 0.00 -0.00 0.00 0.00 60.65 59.97 2kui s ILE 384 Cb -0.15 -0.99 0.02 0.00 -0.00 0.00 0.00 42.46 41.34 2kui s ILE 384 CO 0.17 -0.02 -0.12 -0.60 -0.00 0.00 0.00 174.94 174.37 2kui s ARG 385 N -1.17 1.79 -0.18 0.37 3.52 0.28 -4.87 118.95 118.70 2kui s ARG 385 Ca 0.01 -0.42 -0.01 0.00 -0.13 0.00 0.00 55.73 55.18 2kui s ARG 385 Cb -0.08 -1.56 -0.00 0.00 -1.56 0.00 0.00 34.95 31.75 2kui s ARG 385 CO 0.01 -0.05 -0.12 0.99 -0.81 0.00 0.00 175.30 175.32 2kui s THR 386 N 0.95 2.87 -0.21 4.11 2.01 -1.26 0.11 115.64 124.22 2kui s THR 386 Ca -0.09 -0.69 -0.04 0.00 0.31 0.00 0.00 61.69 61.19 2kui s THR 386 Cb -0.15 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 70.10 2kui s THR 386 CO 0.00 0.49 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.17 2kui s LEU 387 N 1.02 3.00 -0.05 4.42 1.98 0.71 -4.96 118.68 124.81 2kui s LEU 387 Ca -0.01 -0.33 -0.19 0.00 -2.89 0.00 0.00 54.13 50.71 2kui s LEU 387 Cb -0.15 -1.76 -0.05 0.00 0.66 0.00 0.00 46.19 44.89 2kui s LEU 387 CO -0.02 0.01 0.53 -1.10 -1.89 0.00 0.00 176.35 173.87 2kui s GLN 388 N 1.33 4.27 0.02 1.98 1.11 -1.26 -0.30 119.66 126.81 2kui s GLN 388 Ca 0.04 0.59 0.01 0.00 0.01 0.00 0.00 55.36 56.01 2kui s GLN 388 Cb -0.14 -3.36 -0.01 0.00 -1.01 0.00 0.00 33.01 28.48 2kui s GLN 388 CO -0.01 0.33 -0.05 0.15 0.01 0.00 0.00 175.29 175.72 2kui s LYS 389 N -0.00 0.41 -0.15 2.91 1.02 0.07 -4.95 119.74 119.05 2kui s LYS 389 Ca 0.28 -0.45 -0.07 0.00 0.02 0.00 0.00 55.97 55.75 2kui s LYS 389 Cb -0.17 -0.25 -0.04 0.00 -0.52 0.00 0.00 37.83 36.85 2kui s LYS 389 CO 0.14 0.05 0.11 -1.25 -0.92 0.00 0.00 175.35 173.49 2kui s PRO 390 N -0.87 3.68 0.00 -1.68 0.04 -1.26 -0.64 135.00 134.26 2kui s PRO 390 Ca -0.05 -0.22 0.00 0.00 0.04 0.00 0.00 61.00 60.77 2kui s PRO 390 Cb -0.06 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.27 2kui s PRO 390 CO -0.00 0.57 0.00 -3.47 0.04 0.00 0.00 177.00 174.14 2kui n ASP 391 N 2.65 0.00 0.00 6.66 2.03 0.51 -4.56 116.55 123.84 2kui n ASP 391 Ca -0.18 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.13 2kui n ASP 391 Cb 0.54 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.94 2kui n ASP 391 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 2kui n SER 392 N 2.21 1.66 0.06 1.67 2.88 -1.26 -3.51 113.62 117.33 2kui n SER 392 Ca 0.00 -0.13 -0.07 0.00 -1.33 0.00 0.00 58.87 57.34 2kui n SER 392 Cb 0.00 0.59 -0.11 0.00 -0.75 0.00 0.00 64.21 63.94 2kui n SER 392 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kui h THR 393 N 0.00 1.71 -3.42 2.46 1.03 -1.99 -3.39 112.91 109.30 2kui h THR 393 Ca 0.00 -3.38 -0.59 0.00 -0.01 0.00 0.00 66.41 62.43 2kui h THR 393 Cb 0.00 2.82 -0.10 0.00 -1.07 0.00 0.00 68.15 69.81 2kui h THR 393 CO 0.00 0.97 -0.08 0.27 -0.01 0.00 0.00 175.52 176.67 2kui s ILE 394 N -2.74 5.14 0.55 0.00 -0.00 -1.26 -5.05 121.20 117.83 2kui s ILE 394 Ca 0.01 0.94 -0.16 0.00 -0.00 0.00 0.00 60.65 61.44 2kui s ILE 394 Cb 0.10 -3.83 -0.06 0.00 -0.00 0.00 0.00 42.46 38.67 2kui s ILE 394 CO 0.82 0.23 1.01 -2.16 -0.00 0.00 0.00 174.94 174.83 2kui s PRO 395 N 1.31 3.75 1.10 0.37 0.04 -1.26 -4.63 135.00 135.67 2kui s PRO 395 Ca 0.24 1.00 -0.16 0.00 0.04 0.00 0.00 61.00 62.12 2kui s PRO 395 Cb -0.15 -2.10 0.13 0.00 0.04 0.00 0.00 34.50 32.42 2kui s PRO 395 CO 0.10 -0.44 0.30 -2.30 0.04 0.00 0.00 177.00 174.69 2kui n PRO 396 N -1.81 -1.54 0.00 0.56 -0.02 -1.24 -1.68 135.00 129.26 2kui n PRO 396 Ca 0.07 -0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.13 2kui n PRO 396 Cb 0.54 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 2kui n PRO 396 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2kui n ASP 397 N -2.34 0.00 -4.59 2.55 5.75 -1.21 -4.30 116.55 112.41 2kui n ASP 397 Ca 0.02 0.17 -0.43 0.00 -0.01 0.00 0.00 54.79 54.55 2kui n ASP 397 Cb 0.59 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 40.49 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 -2.17 2.77 -0.22 2.11 3.76 -1.26 -0.26 115.29 120.02 2kui s HIS 398 Ca 0.00 0.61 -0.26 0.00 -0.15 0.00 0.00 55.06 55.27 2kui s HIS 398 Cb 0.00 -4.43 -0.00 0.00 1.11 0.00 0.00 32.58 29.25 2kui s HIS 398 CO 0.00 -1.34 0.87 0.14 -0.85 0.00 0.00 174.74 173.56 2kui s VAL 399 N 4.53 4.82 -0.05 -0.90 -7.23 0.05 -4.91 120.40 116.72 2kui s VAL 399 Ca 0.46 1.67 0.13 0.00 -1.81 0.00 0.00 61.98 62.42 2kui s VAL 399 Cb -0.07 -4.16 -0.13 0.00 0.56 0.00 0.00 36.38 32.58 2kui s VAL 399 CO 0.30 -0.06 1.06 0.16 -0.31 0.00 0.00 175.10 176.25 2kui h ILE 400 N 5.37 1.00 -3.76 -0.62 -2.65 -1.91 0.20 117.51 115.15 2kui h ILE 400 Ca -0.24 -2.60 -0.10 0.00 1.03 0.00 0.00 64.86 62.94 2kui h ILE 400 Cb 1.10 2.44 -0.16 0.00 -2.05 0.00 0.00 36.82 38.15 2kui h ILE 400 CO 0.88 0.57 -0.42 -0.83 0.03 0.00 0.00 178.15 178.38 2kui s GLY 401 N -4.76 0.11 0.14 0.16 0.00 -1.26 -4.21 107.32 97.50 2kui s GLY 401 Ca -0.01 -0.54 0.02 0.00 0.00 0.00 0.00 44.72 44.20 2kui s GLY 401 CO 0.80 -0.71 0.09 -1.30 0.00 0.00 0.00 173.10 171.98 2kui n THR 402 N 0.32 0.00 -3.61 0.90 -2.24 -1.26 -4.50 114.28 103.88 2kui n THR 402 Ca -0.17 -0.96 -0.36 0.00 -2.27 0.00 0.00 64.05 60.30 2kui n THR 402 Cb 0.61 0.43 -0.08 0.00 -2.10 0.00 0.00 70.33 69.18 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 -1.95 6.32 0.00 3.42 2.15 -1.15 -4.94 116.67 120.53 2kui s ASP 403 Ca 0.13 0.37 0.00 0.00 0.43 0.00 0.00 52.55 53.48 2kui s ASP 403 Cb 0.01 -2.14 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 2kui s ASP 403 CO 0.09 0.12 0.44 -2.65 -0.17 0.00 0.00 175.17 173.00 2kui n PRO 404 N 3.67 0.00 -0.31 4.34 -0.02 -1.26 -2.56 135.00 138.86 2kui n PRO 404 Ca -0.13 0.05 0.19 0.00 -2.02 0.00 0.00 63.50 61.59 2kui n PRO 404 Cb 0.52 -1.52 0.46 0.00 -0.02 0.00 0.00 33.50 32.94 2kui n PRO 404 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2kui h ALA 405 N 1.52 2.08 -0.03 3.55 0.00 -1.92 -0.17 119.26 124.29 2kui h ALA 405 Ca 0.00 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2kui h ALA 405 Cb 0.03 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2kui h ALA 405 CO 0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 179.25 178.80 2kui h ALA 406 N 1.62 0.02 -0.01 0.00 0.00 -1.81 -2.20 119.26 116.89 2kui h ALA 406 Ca 0.55 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2kui h ALA 406 Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 2kui h ALA 406 CO -0.28 -0.50 0.00 0.09 0.00 0.00 0.00 179.25 178.56 2kui n ASN 407 N -5.11 0.39 -4.85 0.00 5.03 -0.36 -1.22 115.26 109.13 2kui n ASN 407 Ca -0.06 -1.14 -0.32 0.00 0.87 0.00 0.00 54.58 53.92 2kui n ASN 407 Cb 0.05 -0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 38.75 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 -2.00 4.71 -0.37 3.41 2.01 -0.22 -4.77 115.64 118.41 2kui s THR 408 Ca 0.45 0.89 -0.29 0.00 0.31 0.00 0.00 61.69 63.05 2kui s THR 408 Cb 0.21 -3.61 0.01 0.00 0.01 0.00 0.00 72.50 69.12 2kui s THR 408 CO 0.36 -0.18 1.34 -0.44 -0.69 0.00 0.00 174.62 175.00 2kui s SER 409 N -2.30 6.51 0.34 3.53 0.01 -1.26 -4.05 113.70 116.49 2kui s SER 409 Ca 0.53 0.97 0.05 0.00 1.31 0.00 0.00 55.95 58.81 2kui s SER 409 Cb -0.10 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.52 2kui s SER 409 CO 0.18 -1.26 0.04 0.68 0.41 0.00 0.00 173.24 173.29 2kui s VAL 410 N 4.87 1.43 0.27 3.43 -7.23 0.43 -4.66 120.40 118.94 2kui s VAL 410 Ca 0.58 -2.01 -0.29 0.00 -1.81 0.00 0.00 61.98 58.45 2kui s VAL 410 Cb -0.14 -2.81 -0.09 0.00 0.56 0.00 0.00 36.38 33.89 2kui s VAL 410 CO 0.28 -0.03 1.01 -0.55 -0.31 0.00 0.00 175.10 175.50 2kui s SER 411 N -3.54 7.41 -0.26 4.85 0.15 -1.26 0.06 113.70 121.12 2kui s SER 411 Ca 0.36 2.07 -0.30 0.00 0.70 0.00 0.00 55.95 58.78 2kui s SER 411 Cb 0.09 -2.61 -0.07 0.00 -1.71 0.00 0.00 66.02 61.72 2kui s SER 411 CO 0.16 -0.02 2.23 0.00 1.20 0.00 0.00 173.24 176.80 2kui n ALA 412 N 1.19 1.60 0.00 5.45 0.00 -1.26 -3.40 120.51 124.09 2kui n ALA 412 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2kui n ALA 412 Cb 0.47 -2.85 0.00 0.00 0.00 0.00 0.00 19.45 17.07 2kui n ALA 412 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 413 N 5.97 0.76 3.87 0.00 0.00 -1.26 -5.00 105.19 109.53 2kui n GLY 413 Ca 0.33 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.47 4.59 -0.39 1.61 2.15 -1.22 -4.72 116.67 117.21 2kui s ASP 414 Ca 0.00 -1.24 -0.21 0.00 0.43 0.00 0.00 52.55 51.53 2kui s ASP 414 Cb 0.00 0.28 0.01 0.00 -0.30 0.00 0.00 42.92 42.91 2kui s ASP 414 CO 0.00 -1.00 0.69 -1.61 -0.17 0.00 0.00 175.17 173.08 2kui s GLU 415 N -4.20 3.55 -0.37 4.34 0.41 -1.26 -1.39 118.70 119.78 2kui s GLU 415 Ca 0.33 -0.03 -0.09 0.00 -0.41 0.00 0.00 54.97 54.77 2kui s GLU 415 Cb -0.01 -3.87 0.04 0.00 -1.78 0.00 0.00 34.13 28.51 2kui s GLU 415 CO 0.20 -0.89 0.17 0.42 -0.49 0.00 0.00 175.26 174.67 2kui s ILE 416 N 2.91 4.16 -0.06 -1.63 -1.09 0.27 -4.95 121.20 120.81 2kui s ILE 416 Ca 0.26 -1.07 -0.21 0.00 -2.23 0.00 0.00 60.65 57.40 2kui s ILE 416 Cb -0.14 -3.37 -0.04 0.00 -1.58 0.00 0.00 42.46 37.33 2kui s ILE 416 CO 0.18 -0.25 0.62 0.42 -1.23 0.00 0.00 174.94 174.67 2kui s THR 417 N 1.46 5.05 -0.05 2.92 -4.23 -1.26 -0.55 115.64 118.98 2kui s THR 417 Ca 0.00 1.28 0.03 0.00 -1.18 0.00 0.00 61.69 61.83 2kui s THR 417 Cb -0.20 -3.96 0.00 0.00 1.34 0.00 0.00 72.50 69.68 2kui s THR 417 CO 0.04 0.31 -0.15 0.54 -0.54 0.00 0.00 174.62 174.82 2kui s VAL 418 N 0.52 1.30 -0.18 2.29 0.11 0.12 -2.91 120.40 121.64 2kui s VAL 418 Ca 0.33 -0.62 -0.13 0.00 -2.93 0.00 0.00 61.98 58.64 2kui s VAL 418 Cb -0.17 -1.14 -0.05 0.00 -1.53 0.00 0.00 36.38 33.49 2kui s VAL 418 CO 0.16 0.38 0.25 0.54 -3.33 0.00 0.00 175.10 173.10 2kui s ASN 419 N 0.28 6.34 0.02 3.54 2.20 -1.26 -0.21 114.94 125.85 2kui s ASN 419 Ca -0.08 0.39 0.05 0.00 -0.94 0.00 0.00 52.86 52.27 2kui s ASN 419 Cb -0.13 -2.15 -0.02 0.00 -2.00 0.00 0.00 41.25 36.95 2kui s ASN 419 CO 0.03 0.10 -0.14 0.54 -2.94 0.00 0.00 177.10 174.68 2kui s VAL 420 N 0.60 1.13 -0.10 3.54 0.11 0.59 -4.92 120.40 121.35 2kui s VAL 420 Ca 0.14 -0.88 0.04 0.00 -2.93 0.00 0.00 61.98 58.34 2kui s VAL 420 Cb -0.13 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.72 2kui s VAL 420 CO 0.03 0.11 -0.23 -0.44 -3.33 0.00 0.00 175.10 171.24 2kui s SER 421 N -0.88 3.15 -0.29 3.54 0.01 -0.68 -0.75 113.70 117.81 2kui s SER 421 Ca 0.03 -0.54 0.02 0.00 1.31 0.00 0.00 55.95 56.77 2kui s SER 421 Cb -0.07 -1.42 0.07 0.00 0.21 0.00 0.00 66.02 64.81 2kui s SER 421 CO 0.01 0.16 -0.04 0.28 0.41 0.00 0.00 173.24 174.05 2kui s THR 422 N 0.34 2.34 0.04 1.44 -1.32 0.19 -3.29 115.64 115.38 2kui s THR 422 Ca -0.18 -1.81 0.00 0.00 -1.21 0.00 0.00 61.69 58.49 2kui s THR 422 Cb -0.18 -2.48 0.00 0.00 -1.51 0.00 0.00 72.50 68.34 2kui s THR 422 CO 0.09 -0.21 0.00 0.61 -2.21 0.00 0.00 174.62 172.90 2kui n GLY 423 N 4.41 -3.08 3.87 6.08 0.00 -1.26 -4.38 105.19 110.83 2kui n GLY 423 Ca -0.09 -1.15 -0.30 0.00 0.00 0.00 0.00 46.02 44.47 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 -5.55 3.74 0.58 1.61 0.04 -1.23 -0.36 135.00 133.83 2kui s PRO 424 Ca 0.00 0.59 -0.03 0.00 0.04 0.00 0.00 61.00 61.59 2kui s PRO 424 Cb 0.00 -2.27 0.02 0.00 0.04 0.00 0.00 34.50 32.29 2kui s PRO 424 CO 0.00 -0.22 0.85 -1.21 0.04 0.00 0.00 177.00 176.46 2kui s GLU 425 N -4.32 2.73 0.19 4.56 2.02 -1.26 -4.66 118.70 117.96 2kui s GLU 425 Ca 0.53 -0.30 0.08 0.00 0.02 0.00 0.00 54.97 55.31 2kui s GLU 425 Cb -0.10 -2.35 -0.04 0.00 0.10 0.00 0.00 34.13 31.73 2kui s GLU 425 CO 0.38 -0.73 -0.17 -0.65 0.02 0.00 0.00 175.26 174.12 2kui s GLN 426 N -4.91 1.32 0.25 1.61 -0.21 -1.26 -3.86 119.66 112.60 2kui s GLN 426 Ca 0.55 -1.49 0.06 0.00 0.02 0.00 0.00 55.36 54.50 2kui s GLN 426 Cb -0.10 -1.28 -0.05 0.00 1.00 0.00 0.00 33.01 32.57 2kui s GLN 426 CO 0.42 0.24 -0.07 1.03 -2.12 0.00 0.00 175.29 174.79 2kui s ARG 427 N -3.13 1.47 0.16 2.91 1.81 0.97 -4.83 118.95 118.31 2kui s ARG 427 Ca 0.19 -1.72 -0.26 0.00 -1.72 0.00 0.00 55.73 52.21 2kui s ARG 427 Cb -0.04 -1.08 -0.08 0.00 -0.45 0.00 0.00 34.95 33.31 2kui s ARG 427 CO 0.07 0.06 0.82 -1.83 -0.68 0.00 0.00 175.30 173.74 2kui s GLU 428 N -3.72 4.62 -0.20 3.54 -1.05 -1.26 0.16 118.70 120.78 2kui s GLU 428 Ca 0.28 1.23 -0.19 0.00 -0.15 0.00 0.00 54.97 56.14 2kui s GLU 428 Cb 0.03 -3.29 -0.03 0.00 -0.44 0.00 0.00 34.13 30.40 2kui s GLU 428 CO 0.10 0.49 0.54 0.42 0.95 0.00 0.00 175.26 177.76 2kui s ILE 429 N -0.90 5.09 0.32 1.83 1.01 -0.98 -4.90 121.20 122.68 2kui s ILE 429 Ca 0.38 0.99 -0.28 0.00 0.00 0.00 0.00 60.65 61.74 2kui s ILE 429 Cb -0.23 -3.86 -0.10 0.00 0.01 0.00 0.00 42.46 38.28 2kui s ILE 429 CO 0.27 0.16 1.17 -2.84 0.00 0.00 0.00 174.94 173.70 2kui s PRO 430 N 1.74 4.42 0.63 2.79 0.02 -1.26 -4.43 135.00 138.91 2kui s PRO 430 Ca 0.25 1.92 -0.04 0.00 0.02 0.00 0.00 61.00 63.15 2kui s PRO 430 Cb -0.15 -3.03 0.04 0.00 0.02 0.00 0.00 34.50 31.37 2kui s PRO 430 CO 0.10 -0.02 0.91 0.16 -0.33 0.00 0.00 177.00 177.82 2kui s ASP 431 N -0.84 5.17 0.19 2.53 -4.77 -1.26 -4.95 116.67 112.74 2kui s ASP 431 Ca 0.49 0.41 -0.16 0.00 -3.30 0.00 0.00 52.55 49.99 2kui s ASP 431 Cb -0.34 -1.23 0.02 0.00 -1.09 0.00 0.00 42.92 40.28 2kui s ASP 431 CO 0.44 -1.31 0.48 0.54 0.70 0.00 0.00 175.17 176.01 2kui s VAL 432 N -3.04 0.03 0.43 2.11 0.11 -1.26 -5.06 120.40 113.73 2kui s VAL 432 Ca 0.57 -0.92 -0.22 0.00 -2.93 0.00 0.00 61.98 58.48 2kui s VAL 432 Cb -0.11 -1.65 -0.09 0.00 -1.53 0.00 0.00 36.38 33.01 2kui s VAL 432 CO 0.43 -0.15 1.03 -0.44 -3.33 0.00 0.00 175.10 172.64 2kui s SER 433 N -2.90 6.65 0.43 3.54 0.01 -1.26 -4.96 113.70 115.22 2kui s SER 433 Ca 0.11 1.94 0.18 0.00 1.31 0.00 0.00 55.95 59.50 2kui s SER 433 Cb -0.00 -2.57 0.99 0.00 0.21 0.00 0.00 66.02 64.65 2kui s SER 433 CO -0.02 -0.56 1.92 0.71 0.41 0.00 0.00 173.24 175.70 2kui h THR 434 N 1.94 0.98 0.00 1.44 1.35 -1.98 -1.54 112.91 115.10 2kui h THR 434 Ca -0.49 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.42 2kui h THR 434 Cb 1.21 1.54 0.00 0.00 -1.73 0.00 0.00 68.15 69.17 2kui h THR 434 CO 0.61 0.25 0.00 0.17 -0.25 0.00 0.00 175.52 176.30 2kui h LEU 435 N 0.00 0.00 -4.54 3.87 8.10 -1.89 0.16 115.31 121.00 2kui h LEU 435 Ca -0.00 0.00 -0.60 0.00 0.11 0.00 0.00 57.88 57.39 2kui h LEU 435 Cb 0.52 0.00 -0.22 0.00 -0.44 0.00 0.00 40.66 40.52 2kui h LEU 435 CO 0.03 0.00 0.70 0.41 -4.11 0.00 0.00 178.44 175.47 2kui n THR 436 N -2.43 3.40 -0.32 0.15 -1.04 -0.58 -4.67 114.28 108.79 2kui n THR 436 Ca 0.05 -3.34 0.12 0.00 -2.04 0.00 0.00 64.05 58.84 2kui n THR 436 Cb 0.44 -1.39 0.34 0.00 -1.82 0.00 0.00 70.33 67.90 2kui n THR 436 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 2kui h TYR 437 N 2.74 0.96 -0.89 -1.42 3.20 -1.75 -0.72 116.97 119.09 2kui h TYR 437 Ca 0.47 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.36 2kui h TYR 437 Cb 0.49 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2kui h TYR 437 CO 1.29 0.30 0.50 0.00 -1.64 0.00 0.00 178.16 178.61 2kui h ALA 438 N 1.60 1.21 -0.19 1.82 0.00 -1.96 -1.72 119.26 120.02 2kui h ALA 438 Ca 0.51 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 55.16 2kui h ALA 438 Cb 0.78 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2kui h ALA 438 CO -0.28 0.65 -0.48 1.49 0.00 0.00 0.00 179.25 180.63 2kui h GLU 439 N 1.24 0.50 0.11 0.00 4.81 -1.56 -2.83 114.58 116.84 2kui h GLU 439 Ca 0.31 -0.28 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2kui h GLU 439 Cb 0.00 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 2kui h GLU 439 CO -0.05 0.87 -0.06 0.00 -0.73 0.00 0.00 179.01 179.03 2kui h ALA 440 N 1.09 -0.16 -0.60 2.92 0.00 -0.41 0.93 119.26 123.02 2kui h ALA 440 Ca 0.02 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2kui h ALA 440 Cb 0.98 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 2kui h ALA 440 CO 0.09 -0.59 0.05 -0.39 0.00 0.00 0.00 179.25 178.41 2kui h VAL 441 N -0.17 1.26 -0.22 0.00 -1.51 -1.37 -0.15 116.25 114.09 2kui h VAL 441 Ca -0.01 -1.06 -0.11 0.00 -1.23 0.00 0.00 66.70 64.29 2kui h VAL 441 Cb 0.14 0.74 -0.01 0.00 -2.13 0.00 0.00 31.29 30.03 2kui h VAL 441 CO 0.01 0.39 -0.32 0.07 -1.23 0.00 0.00 177.57 176.49 2kui h LYS 442 N 0.94 0.45 -0.64 5.19 5.09 -1.26 -1.64 116.57 124.70 2kui h LYS 442 Ca 0.18 -0.19 -0.04 0.00 0.09 0.00 0.00 60.65 60.69 2kui h LYS 442 Cb 0.48 -0.02 -0.03 0.00 0.10 0.00 0.00 32.23 32.76 2kui h LYS 442 CO 0.02 0.72 0.25 0.87 -2.09 0.00 0.00 179.45 179.22 2kui h LYS 443 N 0.39 0.96 -0.25 0.07 1.79 -0.28 -1.39 116.57 117.86 2kui h LYS 443 Ca 0.05 -0.18 -0.04 0.00 -2.18 0.00 0.00 60.65 58.30 2kui h LYS 443 Cb 0.76 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 2kui h LYS 443 CO 0.06 0.81 -0.03 -0.07 -1.08 0.00 0.00 179.45 179.14 2kui h LEU 444 N 0.90 0.35 -0.23 2.94 3.38 -0.77 -0.50 115.31 121.38 2kui h LEU 444 Ca 0.21 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2kui h LEU 444 Cb 0.22 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2kui h LEU 444 CO -0.02 0.44 -0.26 0.74 0.09 0.00 0.00 178.44 179.43 2kui h THR 445 N 0.36 1.32 0.00 0.22 2.02 -0.82 0.62 112.91 116.64 2kui h THR 445 Ca 0.08 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 65.82 2kui h THR 445 Cb 0.30 1.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.43 2kui h THR 445 CO 0.01 0.45 0.00 0.00 0.37 0.00 0.00 175.52 176.35 2kui h ALA 446 N 0.66 1.00 -0.01 6.16 0.00 -0.79 -2.02 119.26 124.25 2kui h ALA 446 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2kui h ALA 446 Cb 0.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2kui h ALA 446 CO 0.06 0.00 -0.03 0.00 0.00 0.00 0.00 179.25 179.28 2kui n ALA 447 N -1.82 2.66 0.00 0.00 0.00 -0.24 -4.98 120.51 116.13 2kui n ALA 447 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.10 2kui n ALA 447 Cb 0.26 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 2.28 0.20 0.00 0.00 -0.76 -4.68 105.19 103.37 2kui n GLY 448 Ca 0.19 -0.69 -0.06 0.00 0.00 0.00 0.00 46.02 45.46 2kui n GLY 448 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2kui h PHE 449 N 0.00 -0.80 -1.19 1.61 -5.15 -1.73 -3.46 116.94 106.22 2kui h PHE 449 Ca 0.00 0.05 -0.38 0.00 -0.20 0.00 0.00 57.97 57.43 2kui h PHE 449 Cb 0.00 0.38 -0.13 0.00 0.22 0.00 0.00 35.95 36.42 2kui h PHE 449 CO 0.00 -0.20 -0.37 0.41 -2.00 0.00 0.00 178.31 176.15 2kui n GLY 450 N -1.15 1.46 3.41 6.09 0.00 0.19 -4.89 105.19 110.30 2kui n GLY 450 Ca -0.01 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 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 -3.81 2.94 0.12 1.61 1.81 -1.26 -4.76 118.95 115.60 2kui s ARG 451 Ca 0.00 -1.02 -0.04 0.00 -1.72 0.00 0.00 55.73 52.96 2kui s ARG 451 Cb 0.00 -3.80 -0.03 0.00 -0.45 0.00 0.00 34.95 30.68 2kui s ARG 451 CO 0.00 -0.68 0.12 -0.59 -0.68 0.00 0.00 175.30 173.46 2kui s PHE 452 N 1.60 0.61 -0.19 -0.53 -0.12 -1.26 -1.05 117.98 117.05 2kui s PHE 452 Ca 0.03 -1.02 -0.08 0.00 -0.05 0.00 0.00 56.93 55.81 2kui s PHE 452 Cb -0.19 -0.31 0.08 0.00 -0.63 0.00 0.00 43.02 41.97 2kui s PHE 452 CO 0.08 -0.55 0.42 0.21 -0.05 0.00 0.00 175.22 175.32 2kui s LYS 453 N -3.99 0.35 -0.10 1.99 2.47 -0.67 -4.88 119.74 114.91 2kui s LYS 453 Ca 0.18 0.93 -0.23 0.00 -1.56 0.00 0.00 55.97 55.29 2kui s LYS 453 Cb 0.06 0.18 -0.03 0.00 -1.46 0.00 0.00 37.83 36.58 2kui s LYS 453 CO -0.02 -0.21 0.68 -1.14 0.16 0.00 0.00 175.35 174.82 2kui s GLN 454 N 2.11 4.38 -0.03 4.03 0.74 -1.26 -0.01 119.66 129.63 2kui s GLN 454 Ca -0.05 0.82 0.06 0.00 0.05 0.00 0.00 55.36 56.24 2kui s GLN 454 Cb -0.10 -3.48 -0.01 0.00 1.10 0.00 0.00 33.01 30.51 2kui s GLN 454 CO -0.13 -0.01 -0.23 0.00 -0.55 0.00 0.00 175.29 174.37 2kui s ALA 455 N 1.08 1.93 -0.10 1.58 0.00 0.82 -4.95 121.76 122.12 2kui s ALA 455 Ca 0.35 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 51.36 2kui s ALA 455 Cb -0.17 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.39 2kui s ALA 455 CO 0.16 0.43 -0.14 -0.80 0.00 0.00 0.00 175.76 175.40 2kui s ASN 456 N -0.35 3.96 -0.08 0.00 0.01 -1.26 -0.29 114.94 116.93 2kui s ASN 456 Ca 0.04 -0.30 -0.17 0.00 -0.71 0.00 0.00 52.86 51.72 2kui s ASN 456 Cb -0.11 -1.35 0.04 0.00 0.41 0.00 0.00 41.25 40.24 2kui s ASN 456 CO 0.01 0.22 0.40 -0.44 -1.51 0.00 0.00 177.10 175.78 2kui s SER 457 N 0.01 -0.36 0.02 -1.22 0.01 -0.98 -4.96 113.70 106.22 2kui s SER 457 Ca -0.04 0.51 -0.30 0.00 1.31 0.00 0.00 55.95 57.43 2kui s SER 457 Cb -0.14 0.59 -0.07 0.00 0.21 0.00 0.00 66.02 66.61 2kui s SER 457 CO 0.04 -0.33 1.68 -2.16 0.41 0.00 0.00 173.24 172.89 2kui s PRO 458 N -0.59 4.19 0.40 12.44 0.04 -1.24 -0.20 135.00 150.03 2kui s PRO 458 Ca -0.07 2.30 0.06 0.00 0.04 0.00 0.00 61.00 63.32 2kui s PRO 458 Cb -0.04 -3.81 -0.02 0.00 0.04 0.00 0.00 34.50 30.67 2kui s PRO 458 CO 0.03 -0.80 0.20 -1.12 0.04 0.00 0.00 177.00 175.36 2kui s SER 459 N 2.98 2.49 0.25 6.66 0.01 -1.03 -4.85 113.70 120.21 2kui s SER 459 Ca 0.75 -1.76 -0.31 0.00 1.31 0.00 0.00 55.95 55.94 2kui s SER 459 Cb -0.37 0.60 -0.13 0.00 0.21 0.00 0.00 66.02 66.33 2kui s SER 459 CO 0.32 -1.03 1.35 1.07 0.41 0.00 0.00 173.24 175.36 2kui n THR 460 N -0.85 1.17 -0.17 1.44 5.66 -1.26 -4.68 114.28 115.59 2kui n THR 460 Ca -0.01 -0.29 0.28 0.00 -3.05 0.00 0.00 64.05 60.98 2kui n THR 460 Cb 0.64 -1.42 0.72 0.00 -1.55 0.00 0.00 70.33 68.72 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 3.77 0.00 0.00 1.09 0.13 -1.95 0.25 132.00 135.28 2kui h PRO 461 Ca -0.45 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 2kui h PRO 461 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 2kui h PRO 461 CO 0.72 0.00 -0.19 1.05 -0.23 0.00 0.00 178.00 179.36 2kui h GLU 462 N 0.00 0.00 -0.01 0.86 9.09 -2.02 -2.86 114.58 119.64 2kui h GLU 462 Ca 0.42 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.83 2kui h GLU 462 Cb 1.70 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.80 2kui h GLU 462 CO -0.00 0.19 -0.54 1.28 0.05 0.00 0.00 179.01 179.98 2kui n LEU 463 N -3.22 1.67 -4.71 3.06 7.99 0.80 -4.81 117.00 117.79 2kui n LEU 463 Ca 0.02 -0.62 -0.42 0.00 -0.01 0.00 0.00 56.01 54.97 2kui n LEU 463 Cb 0.51 -0.02 -0.03 0.00 -0.11 0.00 0.00 43.42 43.76 2kui n LEU 463 CO 0.34 0.32 1.38 -0.69 -1.51 0.00 0.00 177.39 177.24 2kui s VAL 464 N -2.59 2.41 0.00 4.08 1.01 -0.77 -1.05 120.40 123.49 2kui s VAL 464 Ca 0.17 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2kui s VAL 464 Cb 0.18 -3.09 0.00 0.00 0.00 0.00 0.00 36.38 33.47 2kui s VAL 464 CO 0.62 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.34 2kui n GLY 465 N 4.04 1.36 3.40 4.51 0.00 0.19 -4.95 105.19 113.74 2kui n GLY 465 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.30 1.46 0.36 1.61 -0.14 -0.22 -4.69 119.74 117.83 2kui s LYS 466 Ca 0.00 -1.56 -0.27 0.00 -1.36 0.00 0.00 55.97 52.78 2kui s LYS 466 Cb 0.00 -1.57 -0.09 0.00 -1.68 0.00 0.00 37.83 34.49 2kui s LYS 466 CO 0.00 0.31 1.17 0.08 -0.76 0.00 0.00 175.35 176.15 2kui s VAL 467 N -2.18 3.19 -0.15 3.17 1.01 0.55 -0.73 120.40 125.26 2kui s VAL 467 Ca 0.22 1.07 0.17 0.00 0.00 0.00 0.00 61.98 63.44 2kui s VAL 467 Cb -0.06 -3.63 -0.25 0.00 0.00 0.00 0.00 36.38 32.45 2kui s VAL 467 CO 0.10 0.16 0.26 -0.38 0.00 0.00 0.00 175.10 175.23 2kui n ILE 468 N 0.44 1.31 -2.92 2.22 5.41 0.76 -4.75 119.36 121.85 2kui n ILE 468 Ca 0.02 -0.81 0.00 0.00 1.00 0.00 0.00 62.75 62.96 2kui n ILE 468 Cb 0.45 -0.55 0.00 0.00 -0.71 0.00 0.00 39.64 38.84 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 1.66 -0.77 3.44 7.39 0.00 -1.24 -5.04 105.19 110.62 2kui n GLY 469 Ca -0.26 -1.41 -0.32 0.00 0.00 0.00 0.00 46.02 44.02 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 -2.73 2.84 0.05 2.61 -4.23 -1.26 -2.95 115.64 109.97 2kui s THR 470 Ca 0.00 -0.81 -0.25 0.00 -1.18 0.00 0.00 61.69 59.45 2kui s THR 470 Cb 0.00 -2.09 -0.17 0.00 1.34 0.00 0.00 72.50 71.58 2kui s THR 470 CO 0.00 0.59 1.55 -1.13 -0.54 0.00 0.00 174.62 175.09 2kui h ASN 471 N 5.39 -0.09 -4.10 3.99 -1.24 -1.64 -3.42 115.58 114.46 2kui h ASN 471 Ca -0.46 -0.15 -0.47 0.00 0.71 0.00 0.00 56.30 55.93 2kui h ASN 471 Cb 1.15 0.02 0.03 0.00 0.73 0.00 0.00 38.32 40.25 2kui h ASN 471 CO 0.50 0.10 0.38 -2.84 -1.29 0.00 0.00 177.43 174.28 2kui s PRO 472 N -5.48 3.71 0.13 6.67 0.02 -1.26 -4.97 135.00 133.82 2kui s PRO 472 Ca -0.14 1.31 -0.31 0.00 0.02 0.00 0.00 61.00 61.88 2kui s PRO 472 Cb 0.04 -2.08 -0.10 0.00 0.02 0.00 0.00 34.50 32.38 2kui s PRO 472 CO 0.65 -0.50 1.71 -2.14 -0.33 0.00 0.00 177.00 176.40 2kui s PRO 473 N -3.43 4.16 0.00 5.54 0.02 -1.26 -4.87 135.00 135.17 2kui s PRO 473 Ca 0.66 2.49 0.21 0.00 0.02 0.00 0.00 61.00 64.38 2kui s PRO 473 Cb -0.16 -3.41 0.81 0.00 0.02 0.00 0.00 34.50 31.77 2kui s PRO 473 CO 0.24 -0.75 1.58 0.00 -0.33 0.00 0.00 177.00 177.74 2kui n ALA 474 N 4.99 2.53 -0.05 -1.55 0.00 -1.26 -3.12 120.51 122.04 2kui n ALA 474 Ca 0.16 -0.49 0.05 0.00 0.00 0.00 0.00 53.44 53.17 2kui n ALA 474 Cb 0.38 -1.11 0.13 0.00 0.00 0.00 0.00 19.45 18.85 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 0.23 2.71 -4.37 0.00 4.13 -1.26 -4.28 115.26 112.42 2kui n ASN 475 Ca 0.16 -1.90 -0.30 0.00 1.68 0.00 0.00 54.58 54.23 2kui n ASN 475 Cb 0.31 -0.18 -0.07 0.00 -1.54 0.00 0.00 39.78 38.30 2kui n ASN 475 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2kui s GLN 476 N -0.98 2.10 -0.30 3.52 -1.52 -1.18 -4.88 119.66 116.42 2kui s GLN 476 Ca 0.20 -2.33 -0.21 0.00 -1.95 0.00 0.00 55.36 51.08 2kui s GLN 476 Cb 0.11 -0.99 -0.01 0.00 -0.22 0.00 0.00 33.01 31.90 2kui s GLN 476 CO 0.15 -0.48 0.65 0.99 -0.25 0.00 0.00 175.29 176.35 2kui s THR 477 N -3.05 4.92 0.11 -0.19 2.01 -1.26 -2.31 115.64 115.87 2kui s THR 477 Ca 0.13 0.92 0.10 0.00 0.31 0.00 0.00 61.69 63.14 2kui s THR 477 Cb 0.01 -4.01 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 2kui s THR 477 CO 0.09 -0.14 -0.24 -0.44 -0.69 0.00 0.00 174.62 173.19 2kui s SER 478 N 1.62 3.45 0.58 3.53 0.01 0.12 -4.79 113.70 118.22 2kui s SER 478 Ca 0.26 -0.66 -0.17 0.00 1.31 0.00 0.00 55.95 56.69 2kui s SER 478 Cb -0.15 -0.33 -0.04 0.00 0.21 0.00 0.00 66.02 65.71 2kui s SER 478 CO 0.12 0.20 1.07 0.00 0.41 0.00 0.00 173.24 175.03 2kui s ALA 479 N -1.02 2.72 0.41 1.44 0.00 -1.26 -0.02 121.76 124.02 2kui s ALA 479 Ca 0.14 0.50 0.22 0.00 0.00 0.00 0.00 51.96 52.83 2kui s ALA 479 Cb -0.10 -3.26 1.22 0.00 0.00 0.00 0.00 23.12 20.98 2kui s ALA 479 CO 0.06 -0.79 2.01 0.82 0.00 0.00 0.00 175.76 177.87 2kui h ILE 480 N 0.66 0.81 -0.23 0.00 5.03 -1.94 -1.22 117.51 120.63 2kui h ILE 480 Ca -0.48 -0.67 0.00 0.00 -0.12 0.00 0.00 64.86 63.60 2kui h ILE 480 Cb 1.23 1.40 0.00 0.00 -3.03 0.00 0.00 36.82 36.42 2kui h ILE 480 CO 0.57 0.17 0.00 0.35 -0.68 0.00 0.00 178.15 178.56 2kui n THR 481 N -3.87 0.29 -3.97 -0.27 -2.24 -1.26 -4.21 114.28 98.75 2kui n THR 481 Ca -0.02 -0.42 -0.35 0.00 -2.27 0.00 0.00 64.05 61.00 2kui n THR 481 Cb 0.27 0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 68.82 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 -1.46 5.68 -0.21 3.42 2.47 -0.46 -5.08 114.94 119.30 2kui s ASN 482 Ca 0.32 0.09 -0.12 0.00 0.42 0.00 0.00 52.86 53.57 2kui s ASN 482 Cb 0.17 -1.98 -0.05 0.00 -1.45 0.00 0.00 41.25 37.95 2kui s ASN 482 CO 0.25 0.17 0.21 0.54 -3.72 0.00 0.00 177.10 174.55 2kui s VAL 483 N 0.41 5.34 -0.24 -5.21 0.11 -1.26 -4.58 120.40 114.97 2kui s VAL 483 Ca 0.04 0.32 -0.14 0.00 -2.93 0.00 0.00 61.98 59.27 2kui s VAL 483 Cb -0.12 -3.55 -0.04 0.00 -1.53 0.00 0.00 36.38 31.14 2kui s VAL 483 CO 0.00 0.36 0.31 0.68 -3.33 0.00 0.00 175.10 173.13 2kui s VAL 484 N 0.82 5.24 -0.13 2.04 -7.23 -0.22 -4.89 120.40 116.03 2kui s VAL 484 Ca 0.11 0.49 -0.18 0.00 -1.81 0.00 0.00 61.98 60.58 2kui s VAL 484 Cb -0.13 -3.64 -0.04 0.00 0.56 0.00 0.00 36.38 33.13 2kui s VAL 484 CO 0.03 0.25 0.48 -0.51 -0.31 0.00 0.00 175.10 175.04 2kui s ILE 485 N 1.47 5.18 -0.18 -0.62 -1.16 -1.26 -1.68 121.20 122.95 2kui s ILE 485 Ca 0.14 0.94 0.01 0.00 -0.51 0.00 0.00 60.65 61.23 2kui s ILE 485 Cb -0.15 -3.82 0.02 0.00 0.61 0.00 0.00 42.46 39.13 2kui s ILE 485 CO 0.08 0.30 -0.19 -0.63 -2.81 0.00 0.00 174.94 171.69 2kui s ILE 486 N 0.80 2.11 -0.21 2.00 1.01 0.99 -1.51 121.20 126.39 2kui s ILE 486 Ca 0.25 -0.95 -0.08 0.00 0.00 0.00 0.00 60.65 59.87 2kui s ILE 486 Cb -0.15 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.38 2kui s ILE 486 CO 0.10 0.51 0.09 -0.51 0.00 0.00 0.00 174.94 175.13 2kui s ILE 487 N 1.29 4.88 -0.11 2.92 2.07 -1.15 -0.13 121.20 130.97 2kui s ILE 487 Ca 0.04 0.01 -0.02 0.00 -1.41 0.00 0.00 60.65 59.27 2kui s ILE 487 Cb -0.13 -3.23 -0.03 0.00 0.13 0.00 0.00 42.46 39.19 2kui s ILE 487 CO -0.12 0.41 -0.02 0.54 -1.91 0.00 0.00 174.94 173.84 2kui s VAL 488 N 0.74 4.12 0.02 4.00 0.11 0.61 -0.17 120.40 129.83 2kui s VAL 488 Ca 0.05 -0.30 -0.30 0.00 -2.93 0.00 0.00 61.98 58.49 2kui s VAL 488 Cb -0.13 -2.75 -0.05 0.00 -1.53 0.00 0.00 36.38 31.91 2kui s VAL 488 CO 0.02 0.56 1.25 -0.83 -3.33 0.00 0.00 175.10 172.77 2kui s GLY 489 N -0.40 2.20 0.25 6.54 0.00 0.09 -2.31 107.32 113.69 2kui s GLY 489 Ca 0.07 0.82 0.10 0.00 0.00 0.00 0.00 44.72 45.71 2kui s GLY 489 CO 0.02 2.19 -0.10 -0.45 0.00 0.00 0.00 173.10 174.76 2kui s SER 490 N 1.31 4.12 -0.37 1.64 0.15 0.72 0.56 113.70 121.83 2kui s SER 490 Ca 0.59 -0.77 -0.04 0.00 0.70 0.00 0.00 55.95 56.44 2kui s SER 490 Cb -0.29 -0.61 0.20 0.00 -1.71 0.00 0.00 66.02 63.60 2kui s SER 490 CO 0.27 0.04 0.97 -0.83 1.20 0.00 0.00 173.24 174.89 2kui s GLY 491 N -3.40 -1.63 -0.27 9.45 0.00 -1.26 -2.47 107.32 107.75 2kui s GLY 491 Ca 0.29 0.60 -0.29 0.00 0.00 0.00 0.00 44.72 45.32 2kui s GLY 491 CO 0.17 4.13 1.64 -4.14 0.00 0.00 0.00 173.10 174.90 2kui s PRO 492 N 1.37 3.65 -0.56 2.90 0.02 -1.26 -4.87 135.00 136.25 2kui s PRO 492 Ca 0.21 1.52 -0.06 0.00 0.02 0.00 0.00 61.00 62.69 2kui s PRO 492 Cb 0.06 -4.07 -0.08 0.00 0.02 0.00 0.00 34.50 30.42 2kui s PRO 492 CO -0.11 -1.47 3.09 0.00 -0.33 0.00 0.00 177.00 178.18 2kui n ALA 493 N 8.96 6.64 -2.47 -1.55 0.00 -1.26 -4.87 120.51 125.97 2kui n ALA 493 Ca 0.20 -2.78 -0.30 0.00 0.00 0.00 0.00 53.44 50.56 2kui n ALA 493 Cb 0.46 -2.48 -0.12 0.00 0.00 0.00 0.00 19.45 17.31 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 -0.18 2.78 0.04 0.00 -4.23 -1.26 -0.32 115.64 112.47 2kui s THR 494 Ca 0.63 -1.40 -0.08 0.00 -1.18 0.00 0.00 61.69 59.66 2kui s THR 494 Cb 0.30 -2.23 -0.00 0.00 1.34 0.00 0.00 72.50 71.91 2kui s THR 494 CO -0.10 0.19 0.15 -0.75 -0.54 0.00 0.00 174.62 173.58 2kui s LYS 495 N -1.87 0.66 -0.21 3.99 2.20 0.52 -4.89 119.74 120.14 2kui s LYS 495 Ca 0.16 -0.70 -0.20 0.00 -0.36 0.00 0.00 55.97 54.87 2kui s LYS 495 Cb -0.10 0.27 -0.03 0.00 -1.51 0.00 0.00 37.83 36.46 2kui s LYS 495 CO 0.08 -0.18 0.61 -0.51 -0.36 0.00 0.00 175.35 174.99 2kui s ASP 496 N -2.14 6.64 0.15 1.43 1.01 -1.26 -0.92 116.67 121.58 2kui s ASP 496 Ca -0.05 0.77 -0.30 0.00 0.71 0.00 0.00 52.55 53.69 2kui s ASP 496 Cb -0.01 -2.33 -0.07 0.00 1.01 0.00 0.00 42.92 41.52 2kui s ASP 496 CO -0.04 -0.27 0.97 0.27 0.21 0.00 0.00 175.17 176.30 2kui s ILE 497 N 1.97 4.31 0.39 0.77 -4.36 -0.23 -4.89 121.20 119.16 2kui s ILE 497 Ca 0.27 2.03 -0.04 0.00 -0.26 0.00 0.00 60.65 62.65 2kui s ILE 497 Cb -0.16 -4.30 0.08 0.00 1.25 0.00 0.00 42.46 39.34 2kui s ILE 497 CO 0.10 0.37 0.53 -0.81 0.24 0.00 0.00 174.94 175.36 2kui n PRO 498 N 2.37 -0.21 -3.50 0.37 -0.04 -1.26 -0.29 135.00 132.44 2kui n PRO 498 Ca 0.01 -1.03 -0.34 0.00 -0.04 0.00 0.00 63.50 62.10 2kui n PRO 498 Cb 0.48 -0.48 -0.05 0.00 -0.04 0.00 0.00 33.50 33.41 2kui n PRO 498 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2kui s ASP 499 N -3.01 6.65 -0.39 3.54 -4.77 -1.26 -4.57 116.67 112.86 2kui s ASP 499 Ca 0.32 0.86 0.01 0.00 -3.30 0.00 0.00 52.55 50.44 2kui s ASP 499 Cb -0.01 -2.20 0.12 0.00 -1.09 0.00 0.00 42.92 39.74 2kui s ASP 499 CO 0.22 0.07 0.18 -0.69 0.70 0.00 0.00 175.17 175.65 2kui s VAL 500 N -1.57 1.35 -0.20 2.11 1.01 -1.26 -5.04 120.40 116.80 2kui s VAL 500 Ca 0.39 -2.20 -0.04 0.00 0.00 0.00 0.00 61.98 60.13 2kui s VAL 500 Cb -0.13 -1.97 0.10 0.00 0.00 0.00 0.00 36.38 34.38 2kui s VAL 500 CO 0.20 -0.80 0.30 0.00 0.00 0.00 0.00 175.10 174.80 2kui s ALA 501 N 0.77 -0.69 0.00 5.51 0.00 -1.26 -3.13 121.76 122.96 2kui s ALA 501 Ca 0.15 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.83 2kui s ALA 501 Cb -0.22 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.52 2kui s ALA 501 CO -0.08 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.02 2kui n GLY 502 N 5.35 1.36 3.25 0.00 0.00 -1.04 -5.03 105.19 109.08 2kui n GLY 502 Ca -0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.18 1.11 0.32 1.61 -0.21 -1.26 -5.00 119.66 116.05 2kui s GLN 503 Ca 0.00 -1.39 -0.02 0.00 0.02 0.00 0.00 55.36 53.97 2kui s GLN 503 Cb 0.00 0.31 -0.04 0.00 1.00 0.00 0.00 33.01 34.27 2kui s GLN 503 CO 0.00 -0.37 0.55 -0.08 -2.12 0.00 0.00 175.29 173.27 2kui s THR 504 N -4.05 5.07 0.27 -0.19 -1.32 -1.26 -0.54 115.64 113.62 2kui s THR 504 Ca 0.25 -0.21 -0.01 0.00 -1.21 0.00 0.00 61.69 60.52 2kui s THR 504 Cb 0.06 -3.80 0.27 0.00 -1.51 0.00 0.00 72.50 67.51 2kui s THR 504 CO 0.04 -0.45 1.84 1.62 -2.21 0.00 0.00 174.62 175.46 2kui h VAL 505 N 1.02 0.96 -0.75 5.08 3.04 -1.76 0.12 116.25 123.96 2kui h VAL 505 Ca -0.49 -0.35 0.04 0.00 -1.01 0.00 0.00 66.70 64.90 2kui h VAL 505 Cb 1.20 -0.14 -0.05 0.00 -2.01 0.00 0.00 31.29 30.30 2kui h VAL 505 CO 0.64 0.18 0.47 0.44 -1.01 0.00 0.00 177.57 178.29 2kui h ASP 506 N 1.01 0.76 0.29 3.17 5.19 -1.94 0.11 116.42 125.01 2kui h ASP 506 Ca 0.47 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.64 2kui h ASP 506 Cb 0.39 -0.16 0.01 0.00 0.18 0.00 0.00 39.33 39.75 2kui h ASP 506 CO -0.24 0.52 -1.01 0.58 -3.12 0.00 0.00 179.24 175.97 2kui h VAL 507 N 0.90 1.38 -0.07 -1.35 2.07 -1.73 -2.72 116.25 114.73 2kui h VAL 507 Ca 0.31 -2.46 -0.00 0.00 0.82 0.00 0.00 66.70 65.36 2kui h VAL 507 Cb 0.05 2.47 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2kui h VAL 507 CO -0.12 0.74 0.04 0.00 0.02 0.00 0.00 177.57 178.25 2kui h ALA 508 N 0.64 0.09 -0.58 1.67 0.00 -0.26 0.50 119.26 121.32 2kui h ALA 508 Ca -0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2kui h ALA 508 Cb 1.66 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.39 2kui h ALA 508 CO 0.18 -0.38 0.19 -0.56 0.00 0.00 0.00 179.25 178.68 2kui h GLN 509 N 0.04 0.87 -0.36 0.00 3.07 -0.83 -0.93 115.11 116.96 2kui h GLN 509 Ca 0.03 -0.16 -0.02 0.00 0.09 0.00 0.00 58.65 58.59 2kui h GLN 509 Cb 0.06 -0.14 -0.02 0.00 0.08 0.00 0.00 27.48 27.47 2kui h GLN 509 CO -0.00 0.74 0.17 -0.22 0.09 0.00 0.00 178.83 179.60 2kui h LYS 510 N 0.84 0.53 -0.12 0.06 3.11 -1.13 0.22 116.57 120.08 2kui h LYS 510 Ca 0.19 -0.08 -0.00 0.00 -2.81 0.00 0.00 60.65 57.95 2kui h LYS 510 Cb 0.24 -0.09 -0.01 0.00 -1.00 0.00 0.00 32.23 31.37 2kui h LYS 510 CO -0.01 0.49 0.06 -0.91 -2.81 0.00 0.00 179.45 176.26 2kui h ASN 511 N 0.44 0.15 -0.79 4.20 2.35 -0.32 -0.80 115.58 120.82 2kui h ASN 511 Ca 0.12 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 2kui h ASN 511 Cb 0.14 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.43 2kui h ASN 511 CO -0.01 0.22 0.35 -0.07 -1.65 0.00 0.00 177.43 176.27 2kui h LEU 512 N 0.07 1.06 -0.82 1.61 -0.00 -1.04 -0.39 115.31 115.80 2kui h LEU 512 Ca 0.04 -0.15 -0.08 0.00 -0.00 0.00 0.00 57.88 57.69 2kui h LEU 512 Cb 0.11 -0.27 -0.02 0.00 -0.00 0.00 0.00 40.66 40.47 2kui h LEU 512 CO -0.01 0.92 0.01 0.78 -0.00 0.00 0.00 178.44 180.14 2kui h ASN 513 N 1.13 0.86 0.59 -0.43 -0.26 -0.73 -0.67 115.58 116.07 2kui h ASN 513 Ca 0.27 -0.22 -0.06 0.00 -0.56 0.00 0.00 56.30 55.73 2kui h ASN 513 Cb 0.16 -0.23 -0.01 0.00 -1.06 0.00 0.00 38.32 37.18 2kui h ASN 513 CO -0.03 0.92 -0.31 0.58 -1.06 0.00 0.00 177.43 177.53 2kui h VAL 514 N 0.83 0.91 -0.00 2.81 2.07 -0.63 -1.88 116.25 120.35 2kui h VAL 514 Ca 0.16 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.49 2kui h VAL 514 Cb 0.48 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 31.96 2kui h VAL 514 CO 0.02 0.30 -0.01 -1.22 0.02 0.00 0.00 177.57 176.68 2kui n TYR 515 N -3.72 0.00 0.00 1.57 4.01 -0.20 -4.86 117.16 113.96 2kui n TYR 515 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 2kui n TYR 515 Cb 0.41 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.36 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 1.11 0.34 3.59 2.72 0.00 -0.71 -5.02 105.19 107.22 2kui n GLY 516 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 2kui n GLY 516 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2kui s PHE 517 N -2.00 3.01 -0.13 1.61 0.08 -0.36 -4.54 117.98 115.65 2kui s PHE 517 Ca 0.00 0.67 0.17 0.00 0.12 0.00 0.00 56.93 57.89 2kui s PHE 517 Cb 0.00 -3.81 -0.11 0.00 -0.57 0.00 0.00 43.02 38.53 2kui s PHE 517 CO 0.00 -0.94 0.89 1.15 -0.10 0.00 0.00 175.22 176.22 2kui h THR 518 N 5.93 0.50 -3.27 0.64 2.02 -1.29 -3.21 112.91 114.23 2kui h THR 518 Ca -0.23 -1.96 -0.66 0.00 0.77 0.00 0.00 66.41 64.32 2kui h THR 518 Cb 1.08 2.04 -0.30 0.00 -1.74 0.00 0.00 68.15 69.22 2kui h THR 518 CO 1.01 0.29 -0.80 -0.54 0.37 0.00 0.00 175.52 175.85 2kui s LYS 519 N -2.95 3.22 0.11 6.66 1.02 -1.18 -4.99 119.74 121.63 2kui s LYS 519 Ca -0.02 -0.74 0.06 0.00 0.02 0.00 0.00 55.97 55.28 2kui s LYS 519 Cb 0.09 -2.65 -0.03 0.00 -0.52 0.00 0.00 37.83 34.72 2kui s LYS 519 CO 0.80 0.00 -0.14 -0.59 -0.92 0.00 0.00 175.35 174.50 2kui s PHE 520 N 0.86 1.35 0.01 3.18 -0.71 -1.26 -0.77 117.98 120.63 2kui s PHE 520 Ca -0.04 -0.53 -0.02 0.00 -1.04 0.00 0.00 56.93 55.30 2kui s PHE 520 Cb -0.15 -0.72 -0.01 0.00 -1.21 0.00 0.00 43.02 40.93 2kui s PHE 520 CO -0.01 0.11 0.02 -1.12 -1.34 0.00 0.00 175.22 172.88 2kui s SER 521 N -2.22 0.13 -0.11 1.98 0.01 -0.07 -4.88 113.70 108.53 2kui s SER 521 Ca 0.05 -0.29 0.02 0.00 1.31 0.00 0.00 55.95 57.04 2kui s SER 521 Cb -0.06 0.11 -0.01 0.00 0.21 0.00 0.00 66.02 66.27 2kui s SER 521 CO 0.03 -0.23 -0.18 0.00 0.41 0.00 0.00 173.24 173.26 2kui s GLN 522 N -1.04 3.15 -0.26 12.44 -2.07 -1.26 -0.18 119.66 130.45 2kui s GLN 522 Ca -0.11 -0.78 -0.08 0.00 -1.82 0.00 0.00 55.36 52.57 2kui s GLN 522 Cb -0.07 -2.46 -0.03 0.00 -1.09 0.00 0.00 33.01 29.36 2kui s GLN 522 CO -0.00 0.24 0.09 0.00 -1.32 0.00 0.00 175.29 174.29 2kui s ALA 523 N 0.25 3.21 -0.24 2.60 0.00 0.77 -4.94 121.76 123.41 2kui s ALA 523 Ca -0.12 -1.14 -0.20 0.00 0.00 0.00 0.00 51.96 50.50 2kui s ALA 523 Cb -0.16 -2.14 -0.02 0.00 0.00 0.00 0.00 23.12 20.79 2kui s ALA 523 CO 0.07 -0.52 0.61 -1.12 0.00 0.00 0.00 175.76 174.80 2kui s SER 524 N 1.63 6.59 0.17 0.00 0.01 -1.26 -0.20 113.70 120.64 2kui s SER 524 Ca 0.06 0.72 0.10 0.00 1.31 0.00 0.00 55.95 58.14 2kui s SER 524 Cb -0.15 -2.33 -0.04 0.00 0.21 0.00 0.00 66.02 63.70 2kui s SER 524 CO 0.05 -0.32 -0.23 0.68 0.41 0.00 0.00 173.24 173.83 2kui s VAL 525 N 2.25 2.15 0.02 3.43 -7.23 -0.00 -4.96 120.40 116.05 2kui s VAL 525 Ca 0.26 -1.93 -0.20 0.00 -1.81 0.00 0.00 61.98 58.30 2kui s VAL 525 Cb -0.16 -1.99 -0.06 0.00 0.56 0.00 0.00 36.38 34.74 2kui s VAL 525 CO 0.09 -0.14 0.58 1.51 -0.31 0.00 0.00 175.10 176.83 2kui s ASP 526 N -2.53 7.00 0.21 4.85 -4.77 -1.26 -0.11 116.67 120.05 2kui s ASP 526 Ca 0.17 1.19 -0.15 0.00 -3.30 0.00 0.00 52.55 50.46 2kui s ASP 526 Cb -0.08 -2.36 0.01 0.00 -1.09 0.00 0.00 42.92 39.40 2kui s ASP 526 CO 0.08 0.15 0.49 -0.44 0.70 0.00 0.00 175.17 176.15 2kui s SER 527 N -0.46 -0.16 0.00 2.11 0.01 -0.66 -4.85 113.70 109.69 2kui s SER 527 Ca 0.30 -0.70 0.21 0.00 1.31 0.00 0.00 55.95 57.07 2kui s SER 527 Cb -0.19 0.57 1.13 0.00 0.21 0.00 0.00 66.02 67.75 2kui s SER 527 CO 0.18 -1.08 1.66 -0.81 0.41 0.00 0.00 173.24 173.59 2kui n PRO 528 N -0.34 0.43 -3.01 12.44 -0.04 -1.26 -4.22 135.00 138.99 2kui n PRO 528 Ca -0.06 0.06 -0.40 0.00 -0.04 0.00 0.00 63.50 63.06 2kui n PRO 528 Cb 0.62 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.53 2kui n PRO 528 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2kui s ARG 529 N -2.37 4.48 0.45 0.54 3.00 -1.26 -4.96 118.95 118.83 2kui s ARG 529 Ca 0.24 1.03 -0.24 0.00 0.00 0.00 0.00 55.73 56.76 2kui s ARG 529 Cb 0.14 -3.36 -0.09 0.00 0.00 0.00 0.00 34.95 31.64 2kui s ARG 529 CO 0.29 0.29 1.20 -0.35 0.00 0.00 0.00 175.30 176.74 2kui n PRO 530 N 2.80 1.69 -1.67 3.54 -0.04 -1.26 -3.23 135.00 136.84 2kui n PRO 530 Ca -0.03 0.61 -0.49 0.00 -0.04 0.00 0.00 63.50 63.55 2kui n PRO 530 Cb 0.50 -2.32 -0.05 0.00 -0.04 0.00 0.00 33.50 31.59 2kui n PRO 530 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2kui n ALA 531 N -0.52 0.63 0.00 0.55 0.00 -1.25 -2.06 120.51 117.86 2kui n ALA 531 Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2kui n ALA 531 Cb 0.41 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.52 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 3.68 2.03 3.69 0.00 0.00 -0.54 -4.86 105.19 109.18 2kui n GLY 532 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.28 4.35 -0.42 1.61 2.56 -0.88 -2.02 118.70 123.62 2kui s GLU 533 Ca 0.00 1.74 -0.27 0.00 0.00 0.00 0.00 54.97 56.44 2kui s GLU 533 Cb 0.00 -3.54 0.02 0.00 2.00 0.00 0.00 34.13 32.62 2kui s GLU 533 CO 0.00 -0.45 1.00 0.08 -0.56 0.00 0.00 175.26 175.33 2kui s VAL 534 N 2.13 4.43 -0.52 3.70 1.01 0.30 -0.08 120.40 131.37 2kui s VAL 534 Ca 0.58 1.12 0.24 0.00 0.00 0.00 0.00 61.98 63.92 2kui s VAL 534 Cb -0.27 -4.45 0.31 0.00 0.00 0.00 0.00 36.38 31.97 2kui s VAL 534 CO 0.24 -0.76 1.63 0.00 0.00 0.00 0.00 175.10 176.21 2kui h THR 535 N 6.01 0.00 0.00 3.92 1.03 -1.02 -2.76 112.91 120.09 2kui h THR 535 Ca -0.23 -0.85 0.00 0.00 -0.01 0.00 0.00 66.41 65.32 2kui h THR 535 Cb 1.07 1.83 0.00 0.00 -1.07 0.00 0.00 68.15 69.98 2kui h THR 535 CO 1.04 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 177.16 2kui n GLY 536 N 1.16 -1.36 3.49 2.99 0.00 -1.18 -4.77 105.19 105.52 2kui n GLY 536 Ca 0.04 -1.15 -0.27 0.00 0.00 0.00 0.00 46.02 44.64 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 2.75 -0.10 2.61 -4.23 -1.26 -0.13 115.64 112.29 2kui s THR 537 Ca 0.00 -1.82 -0.19 0.00 -1.18 0.00 0.00 61.69 58.49 2kui s THR 537 Cb 0.00 -2.33 -0.16 0.00 1.34 0.00 0.00 72.50 71.35 2kui s THR 537 CO 0.00 -0.09 0.64 -1.13 -0.54 0.00 0.00 174.62 173.50 2kui h ASN 538 N 3.14 -0.06 -2.96 3.99 -1.24 -1.28 -3.42 115.58 113.75 2kui h ASN 538 Ca -0.47 -0.53 -0.54 0.00 0.71 0.00 0.00 56.30 55.48 2kui h ASN 538 Cb 1.20 0.02 0.01 0.00 0.73 0.00 0.00 38.32 40.27 2kui h ASN 538 CO 0.50 0.65 0.78 -2.16 -1.29 0.00 0.00 177.43 175.91 2kui s PRO 539 N -2.53 4.31 0.75 6.67 0.04 -1.26 -4.99 135.00 137.98 2kui s PRO 539 Ca -0.12 1.97 -0.13 0.00 0.04 0.00 0.00 61.00 62.76 2kui s PRO 539 Cb -0.01 -3.46 0.05 0.00 0.04 0.00 0.00 34.50 31.11 2kui s PRO 539 CO 0.45 -0.51 1.14 -1.25 0.04 0.00 0.00 177.00 176.88 2kui s PRO 540 N 1.92 2.18 0.34 0.56 0.04 -1.26 -4.94 135.00 133.84 2kui s PRO 540 Ca 0.63 1.49 -0.29 0.00 0.04 0.00 0.00 61.00 62.88 2kui s PRO 540 Cb -0.33 -1.87 -0.11 0.00 0.04 0.00 0.00 34.50 32.24 2kui s PRO 540 CO 0.28 -1.75 1.47 0.00 0.04 0.00 0.00 177.00 177.04 2kui s ALA 541 N -2.39 3.60 0.00 8.56 0.00 -1.26 -2.28 121.76 127.98 2kui s ALA 541 Ca 0.68 1.50 0.00 0.00 0.00 0.00 0.00 51.96 54.14 2kui s ALA 541 Cb -0.23 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2kui s ALA 541 CO 0.48 -0.94 0.00 0.41 0.00 0.00 0.00 175.76 175.71 2kui n GLY 542 N 0.97 0.38 3.72 0.00 0.00 0.60 -5.00 105.19 105.87 2kui n GLY 542 Ca 0.03 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 -2.13 4.14 -0.24 2.61 2.01 -0.97 -4.78 115.64 116.28 2kui s THR 543 Ca 0.00 1.68 -0.15 0.00 0.31 0.00 0.00 61.69 63.53 2kui s THR 543 Cb 0.00 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 2kui s THR 543 CO 0.00 0.21 0.39 -0.89 -0.69 0.00 0.00 174.62 173.64 2kui s THR 544 N 0.39 5.18 0.06 -0.82 2.01 -1.26 -1.07 115.64 120.13 2kui s THR 544 Ca 0.52 0.63 0.01 0.00 0.31 0.00 0.00 61.69 63.16 2kui s THR 544 Cb -0.27 -3.71 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 2kui s THR 544 CO 0.31 0.19 -0.05 0.68 -0.69 0.00 0.00 174.62 175.07 2kui s VAL 545 N 1.79 0.38 0.35 3.82 -7.23 -0.10 -4.89 120.40 114.53 2kui s VAL 545 Ca 0.17 -1.53 -0.28 0.00 -1.81 0.00 0.00 61.98 58.52 2kui s VAL 545 Cb -0.15 -1.15 -0.11 0.00 0.56 0.00 0.00 36.38 35.53 2kui s VAL 545 CO 0.09 -0.76 1.40 -2.84 -0.31 0.00 0.00 175.10 172.68 2kui s PRO 546 N -2.99 4.23 0.61 4.82 0.02 -1.26 -0.36 135.00 140.08 2kui s PRO 546 Ca 0.01 2.40 0.39 0.00 0.02 0.00 0.00 61.00 63.82 2kui s PRO 546 Cb 0.00 -3.02 1.94 0.00 0.02 0.00 0.00 34.50 33.44 2kui s PRO 546 CO -0.05 -0.37 2.20 -0.39 -0.33 0.00 0.00 177.00 178.06 2kui h VAL 547 N 3.01 0.04 0.00 3.83 -1.51 -0.95 -0.92 116.25 119.75 2kui h VAL 547 Ca -0.50 -0.25 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 2kui h VAL 547 Cb 1.23 1.23 0.00 0.00 -2.13 0.00 0.00 31.29 31.63 2kui h VAL 547 CO 0.65 0.01 0.00 -0.78 -1.23 0.00 0.00 177.57 176.22 2kui h ASP 548 N 0.00 0.00 -3.84 4.19 3.58 -1.80 -0.63 116.42 117.93 2kui h ASP 548 Ca -0.00 0.00 -0.44 0.00 0.42 0.00 0.00 57.03 57.01 2kui h ASP 548 Cb 0.23 0.00 0.18 0.00 1.72 0.00 0.00 39.33 41.46 2kui h ASP 548 CO 0.00 0.00 0.36 -0.44 -2.88 0.00 0.00 179.24 176.28 2kui s SER 549 N -5.48 2.44 -0.21 2.28 0.01 -0.35 -4.51 113.70 107.87 2kui s SER 549 Ca 0.07 0.28 -0.07 0.00 1.31 0.00 0.00 55.95 57.54 2kui s SER 549 Cb 0.08 -0.30 -0.03 0.00 0.21 0.00 0.00 66.02 65.98 2kui s SER 549 CO 0.61 -3.16 0.05 -0.69 0.41 0.00 0.00 173.24 170.46 2kui s VAL 550 N -3.73 4.40 -0.13 3.43 1.01 -1.25 -3.09 120.40 121.04 2kui s VAL 550 Ca 0.75 -0.16 -0.05 0.00 0.00 0.00 0.00 61.98 62.53 2kui s VAL 550 Cb -0.04 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 2kui s VAL 550 CO 0.54 0.40 0.04 0.27 0.00 0.00 0.00 175.10 176.35 2kui s ILE 551 N 1.00 4.64 -0.25 2.22 -0.00 0.05 -4.95 121.20 123.91 2kui s ILE 551 Ca 0.03 -0.11 -0.07 0.00 -0.00 0.00 0.00 60.65 60.51 2kui s ILE 551 Cb -0.14 -3.02 -0.02 0.00 -0.00 0.00 0.00 42.46 39.28 2kui s ILE 551 CO 0.03 0.55 0.06 -0.70 -0.00 0.00 0.00 174.94 174.88 2kui s GLU 552 N -0.40 3.60 -0.16 0.37 2.12 -1.26 -0.89 118.70 122.08 2kui s GLU 552 Ca 0.09 -0.51 -0.07 0.00 0.36 0.00 0.00 54.97 54.83 2kui s GLU 552 Cb -0.12 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.93 2kui s GLU 552 CO 0.02 -0.20 0.10 -0.51 -0.54 0.00 0.00 175.26 174.12 2kui s LEU 553 N 1.60 4.09 -0.23 2.70 2.01 0.75 -0.72 118.68 128.88 2kui s LEU 553 Ca 0.06 0.25 -0.17 0.00 0.01 0.00 0.00 54.13 54.29 2kui s LEU 553 Cb -0.15 -2.02 -0.03 0.00 0.01 0.00 0.00 46.19 44.00 2kui s LEU 553 CO 0.03 0.27 0.44 -1.10 1.01 0.00 0.00 176.35 177.00 2kui s GLN 554 N -0.20 4.11 -0.13 1.70 1.11 0.82 -0.16 119.66 126.91 2kui s GLN 554 Ca 0.09 0.23 -0.01 0.00 0.01 0.00 0.00 55.36 55.68 2kui s GLN 554 Cb -0.12 -3.60 -0.02 0.00 -1.01 0.00 0.00 33.01 28.26 2kui s GLN 554 CO 0.01 -0.20 -0.10 0.08 0.01 0.00 0.00 175.29 175.09 2kui s VAL 555 N 1.81 3.30 0.05 1.09 1.01 0.72 -0.46 120.40 127.91 2kui s VAL 555 Ca 0.19 -0.57 -0.21 0.00 0.00 0.00 0.00 61.98 61.39 2kui s VAL 555 Cb -0.15 -2.40 -0.06 0.00 0.00 0.00 0.00 36.38 33.76 2kui s VAL 555 CO 0.09 0.52 0.62 -0.44 0.00 0.00 0.00 175.10 175.89 2kui s SER 556 N 0.31 7.07 0.19 3.32 0.01 0.88 -0.82 113.70 124.65 2kui s SER 556 Ca -0.08 1.27 -0.12 0.00 1.31 0.00 0.00 55.95 58.34 2kui s SER 556 Cb -0.15 -2.39 -0.07 0.00 0.21 0.00 0.00 66.02 63.62 2kui s SER 556 CO 0.05 0.17 0.54 -1.59 0.41 0.00 0.00 173.24 172.82 2kui s LYS 557 N -0.61 3.87 0.22 12.44 -2.85 0.84 -1.47 119.74 132.18 2kui s LYS 557 Ca 0.31 0.36 0.16 0.00 -1.00 0.00 0.00 55.97 55.80 2kui s LYS 557 Cb -0.19 -2.78 0.01 0.00 -2.06 0.00 0.00 37.83 32.81 2kui s LYS 557 CO 0.19 0.39 1.26 0.78 0.10 0.00 0.00 175.35 178.07 2kui h GLY 558 N 3.01 0.00 0.00 0.59 0.00 -1.72 -1.76 103.07 103.19 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 0.68 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.92 2kui n ASN 559 N -3.11 0.00 -4.33 0.19 3.02 -1.26 -4.56 115.26 105.22 2kui n ASN 559 Ca -0.01 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.23 2kui n ASN 559 Cb 0.75 0.00 -0.15 0.00 -0.61 0.00 0.00 39.78 39.77 2kui n ASN 559 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2kui s GLN 560 N 0.00 2.00 0.09 3.52 -0.21 -1.26 -2.30 119.66 121.51 2kui s GLN 560 Ca 0.00 -0.99 0.07 0.00 0.02 0.00 0.00 55.36 54.46 2kui s GLN 560 Cb 0.00 -2.03 -0.03 0.00 1.00 0.00 0.00 33.01 31.95 2kui s GLN 560 CO 0.00 0.54 -0.19 -0.59 -2.12 0.00 0.00 175.29 172.94 2kui s PHE 561 N -0.69 1.59 0.03 0.91 -0.12 0.75 -4.69 117.98 115.76 2kui s PHE 561 Ca 0.11 -0.43 -0.30 0.00 -0.05 0.00 0.00 56.93 56.25 2kui s PHE 561 Cb -0.10 -0.88 -0.09 0.00 -0.63 0.00 0.00 43.02 41.31 2kui s PHE 561 CO 0.00 0.15 1.96 0.28 -0.05 0.00 0.00 175.22 177.57 2kui n VAL 562 N 1.19 0.74 -3.68 -2.49 0.31 -1.26 0.07 118.33 113.21 2kui n VAL 562 Ca -0.20 -0.13 -0.37 0.00 -0.01 0.00 0.00 64.34 63.63 2kui n VAL 562 Cb 0.54 -2.27 -0.06 0.00 -0.91 0.00 0.00 33.84 31.13 2kui n VAL 562 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2kui s MET 563 N 4.35 3.82 1.04 5.55 1.75 -0.47 -4.90 119.30 130.44 2kui s MET 563 Ca 0.89 0.08 -0.13 0.00 -1.25 0.00 0.00 55.69 55.28 2kui s MET 563 Cb -0.46 -3.27 0.21 0.00 2.84 0.00 0.00 34.83 34.16 2kui s MET 563 CO 0.43 0.60 1.08 -2.14 -0.65 0.00 0.00 175.02 174.34 2kui s PRO 564 N -0.61 0.07 0.11 4.11 0.02 -1.26 -0.80 135.00 136.64 2kui s PRO 564 Ca 0.18 0.50 -0.31 0.00 0.02 0.00 0.00 61.00 61.38 2kui s PRO 564 Cb -0.14 -1.70 -0.08 0.00 0.02 0.00 0.00 34.50 32.61 2kui s PRO 564 CO 0.06 -2.97 1.43 -0.51 -0.33 0.00 0.00 177.00 174.68 2kui s ASP 565 N -3.35 6.78 -0.04 2.53 1.11 -1.26 -4.68 116.67 117.76 2kui s ASP 565 Ca 0.66 2.37 0.09 0.00 0.18 0.00 0.00 52.55 55.85 2kui s ASP 565 Cb -0.19 -2.58 0.23 0.00 1.07 0.00 0.00 42.92 41.45 2kui s ASP 565 CO 0.59 -0.70 1.18 0.18 1.18 0.00 0.00 175.17 177.60 2kui n LEU 566 N 4.12 2.70 -4.78 1.23 4.77 -1.26 -5.02 117.00 118.75 2kui n LEU 566 Ca 0.12 -2.25 -0.37 0.00 -0.03 0.00 0.00 56.01 53.48 2kui n LEU 566 Cb 0.42 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 41.23 2kui n LEU 566 CO 0.59 0.65 0.66 -0.44 -1.33 0.00 0.00 177.39 177.52 2kui s SER 567 N -1.32 7.29 0.00 -1.43 0.01 -1.26 -3.90 113.70 113.09 2kui s SER 567 Ca 0.19 1.85 0.00 0.00 1.31 0.00 0.00 55.95 59.31 2kui s SER 567 Cb 0.13 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.78 2kui s SER 567 CO 0.08 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.24 2kui n GLY 568 N 0.53 0.53 3.70 3.44 0.00 -1.26 -5.02 105.19 107.11 2kui n GLY 568 Ca 0.02 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.81 2kui n GLY 568 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2kui s MET 569 N -0.03 2.32 0.32 1.61 0.00 -1.25 -4.95 119.30 117.31 2kui s MET 569 Ca 0.00 -1.55 0.07 0.00 0.00 0.00 0.00 55.69 54.21 2kui s MET 569 Cb 0.00 -2.14 -0.02 0.00 0.00 0.00 0.00 34.83 32.67 2kui s MET 569 CO 0.00 0.16 0.33 -0.06 0.00 0.00 0.00 175.02 175.46 2kui s PHE 570 N -2.42 3.03 0.48 3.16 0.40 -1.26 -0.95 117.98 120.43 2kui s PHE 570 Ca 0.36 -0.23 0.16 0.00 -0.60 0.00 0.00 56.93 56.62 2kui s PHE 570 Cb -0.03 -1.77 1.15 0.00 0.51 0.00 0.00 43.02 42.88 2kui s PHE 570 CO 0.22 0.20 2.07 2.35 0.70 0.00 0.00 175.22 180.76 2kui h TRP 571 N 1.18 0.00 0.00 0.36 7.01 0.08 0.91 115.95 125.49 2kui h TRP 571 Ca -0.46 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.54 2kui h TRP 571 Cb 1.25 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.31 2kui h TRP 571 CO 0.50 0.10 0.00 -0.39 -2.79 0.00 0.00 178.44 175.86 2kui h VAL 572 N 0.00 0.00 0.02 2.65 -1.51 -1.95 -1.74 116.25 113.72 2kui h VAL 572 Ca -0.00 -0.29 -0.36 0.00 -1.23 0.00 0.00 66.70 64.82 2kui h VAL 572 Cb 0.18 1.08 -0.06 0.00 -2.13 0.00 0.00 31.29 30.36 2kui h VAL 572 CO 0.01 0.00 -2.25 0.47 -1.23 0.00 0.00 177.57 174.57 2kui n ASP 573 N -2.31 1.12 -0.30 4.19 8.00 -0.05 -4.43 116.55 122.77 2kui n ASP 573 Ca 0.02 0.05 -0.04 0.00 0.71 0.00 0.00 54.79 55.53 2kui n ASP 573 Cb 0.26 0.07 0.07 0.00 -0.02 0.00 0.00 41.12 41.51 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 0.53 1.03 0.44 2.24 0.00 -0.33 -1.85 119.26 121.33 2kui h ALA 574 Ca -0.50 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.30 2kui h ALA 574 Cb 2.06 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.53 2kui h ALA 574 CO 0.01 0.49 -0.23 0.93 0.00 0.00 0.00 179.25 180.46 2kui h GLU 575 N 1.11 -0.59 -0.72 0.00 5.08 -1.55 0.17 114.58 118.07 2kui h GLU 575 Ca 0.29 0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.71 2kui h GLU 575 Cb -0.04 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2kui h GLU 575 CO -0.05 -0.39 0.48 -1.35 -1.00 0.00 0.00 179.01 176.69 2kui h PRO 576 N -0.61 0.92 -0.25 2.33 0.11 -1.77 -2.25 132.00 130.48 2kui h PRO 576 Ca -0.06 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.01 2kui h PRO 576 Cb 0.48 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 2kui h PRO 576 CO 0.09 0.61 0.13 -0.09 -0.21 0.00 0.00 178.00 178.53 2kui h ARG 577 N 0.94 0.27 -0.50 1.05 9.65 -0.99 -1.12 114.38 123.68 2kui h ARG 577 Ca 0.27 -0.02 -0.10 0.00 -1.10 0.00 0.00 59.98 59.03 2kui h ARG 577 Cb -0.05 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 2kui h ARG 577 CO -0.07 0.18 -0.09 1.37 2.80 0.00 0.00 179.97 184.16 2kui h LEU 578 N 0.28 0.95 -0.67 3.80 8.10 -0.32 -2.30 115.31 125.15 2kui h LEU 578 Ca 0.10 -0.35 -0.08 0.00 0.11 0.00 0.00 57.88 57.66 2kui h LEU 578 Cb 0.01 -0.26 -0.03 0.00 -0.44 0.00 0.00 40.66 39.95 2kui h LEU 578 CO -0.06 1.07 0.09 0.03 -4.11 0.00 0.00 178.44 175.47 2kui h ARG 579 N 0.80 1.12 -0.51 0.17 3.08 -1.30 0.14 114.38 117.87 2kui h ARG 579 Ca 0.13 -0.31 -0.09 0.00 0.07 0.00 0.00 59.98 59.78 2kui h ARG 579 Cb 0.65 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 2kui h ARG 579 CO 0.04 1.03 -0.05 0.00 -1.07 0.00 0.00 179.97 179.92 2kui h ALA 580 N 1.04 0.94 -0.00 0.04 0.00 -0.99 -2.90 119.26 117.39 2kui h ALA 580 Ca 0.20 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2kui h ALA 580 Cb 0.47 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2kui h ALA 580 CO 0.02 0.63 -0.48 1.28 0.00 0.00 0.00 179.25 180.70 2kui n LEU 581 N -4.18 0.73 -2.35 0.00 7.99 -0.88 -4.94 117.00 113.37 2kui n LEU 581 Ca 0.02 -0.14 -0.14 0.00 -0.01 0.00 0.00 56.01 55.74 2kui n LEU 581 Cb 0.35 -0.19 0.05 0.00 -0.11 0.00 0.00 43.42 43.52 2kui n LEU 581 CO 0.43 0.16 0.15 0.61 -1.51 0.00 0.00 177.39 177.23 2kui n GLY 582 N 1.45 0.06 3.74 -0.72 0.00 -0.21 -4.99 105.19 104.52 2kui n GLY 582 Ca 0.07 -0.12 -0.40 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.19 3.80 -0.39 1.61 -0.00 0.31 -5.02 118.94 116.05 2kui s TRP 583 Ca 0.34 1.66 0.04 0.00 -0.00 0.00 0.00 56.10 58.14 2kui s TRP 583 Cb -0.15 -2.93 0.16 0.00 -0.00 0.00 0.00 33.47 30.55 2kui s TRP 583 CO 0.43 0.27 0.41 -0.08 -0.00 0.00 0.00 176.95 177.99 2kui s THR 584 N -0.18 -0.30 0.00 5.86 -1.32 -1.26 -4.73 115.64 113.71 2kui s THR 584 Ca 0.42 -1.25 0.00 0.00 -1.21 0.00 0.00 61.69 59.65 2kui s THR 584 Cb -0.22 -0.68 0.00 0.00 -1.51 0.00 0.00 72.50 70.08 2kui s THR 584 CO 0.27 -0.63 0.00 0.61 -2.21 0.00 0.00 174.62 172.66 2kui n GLY 585 N 3.88 1.73 2.77 6.08 0.00 -1.25 -4.83 105.19 113.56 2kui n GLY 585 Ca 0.15 -0.08 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 2kui n GLY 585 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2kui s MET 586 N 1.97 0.36 -0.22 1.61 -1.94 -1.26 -5.02 119.30 114.80 2kui s MET 586 Ca 0.00 0.14 -0.22 0.00 -1.71 0.00 0.00 55.69 53.90 2kui s MET 586 Cb 0.00 -0.68 -0.02 0.00 2.01 0.00 0.00 34.83 36.14 2kui s MET 586 CO 0.00 -0.23 0.72 -1.17 -0.01 0.00 0.00 175.02 174.32 2kui s LEU 587 N 1.61 4.11 -0.24 -0.03 1.98 -1.26 -4.56 118.68 120.29 2kui s LEU 587 Ca -0.01 0.91 0.02 0.00 -2.89 0.00 0.00 54.13 52.15 2kui s LEU 587 Cb -0.13 -3.02 0.05 0.00 0.66 0.00 0.00 46.19 43.76 2kui s LEU 587 CO -0.03 -0.39 -0.10 -0.62 -1.89 0.00 0.00 176.35 173.32 2kui s ASP 588 N 1.31 4.01 -0.31 3.68 2.15 -1.26 -5.05 116.67 121.19 2kui s ASP 588 Ca 0.31 -1.19 -0.03 0.00 0.43 0.00 0.00 52.55 52.07 2kui s ASP 588 Cb -0.16 -1.39 0.05 0.00 -0.30 0.00 0.00 42.92 41.12 2kui s ASP 588 CO 0.09 -0.18 0.02 -1.59 -0.17 0.00 0.00 175.17 173.35 2kui s LYS 589 N 1.25 2.50 -0.17 4.34 0.00 -1.26 -4.36 119.74 122.04 2kui s LYS 589 Ca -0.06 -1.23 -0.15 0.00 0.00 0.00 0.00 55.97 54.54 2kui s LYS 589 Cb -0.19 -3.25 -0.10 0.00 0.00 0.00 0.00 37.83 34.30 2kui s LYS 589 CO -0.06 -0.62 -0.03 0.41 0.00 0.00 0.00 175.35 175.05 2kui n GLY 590 N 4.68 -0.89 3.10 0.59 0.00 -1.26 -4.94 105.19 106.46 2kui n GLY 590 Ca -0.13 -0.05 -0.25 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.58 1.38 -0.19 4.61 0.00 -1.26 -5.10 121.76 118.62 2kui s ALA 591 Ca -0.21 -0.59 -0.23 0.00 0.00 0.00 0.00 51.96 50.92 2kui s ALA 591 Cb 0.04 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 2kui s ALA 591 CO 0.38 0.23 0.73 -0.51 0.00 0.00 0.00 175.76 176.59 2kui s ASP 592 N 0.15 6.81 -0.06 0.00 1.11 -1.26 -4.84 116.67 118.57 2kui s ASP 592 Ca -0.05 0.99 0.01 0.00 0.18 0.00 0.00 52.55 53.67 2kui s ASP 592 Cb -0.12 -2.40 0.02 0.00 1.07 0.00 0.00 42.92 41.50 2kui s ASP 592 CO 0.02 -0.35 -0.06 -0.69 1.18 0.00 0.00 175.17 175.27 2kui s VAL 593 N 2.13 0.70 -0.45 -1.27 1.01 0.09 -4.92 120.40 117.69 2kui s VAL 593 Ca 0.33 -0.17 -0.27 0.00 0.00 0.00 0.00 61.98 61.87 2kui s VAL 593 Cb -0.16 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.52 2kui s VAL 593 CO 0.11 0.28 1.00 -0.62 0.00 0.00 0.00 175.10 175.87 2kui s ASP 594 N 1.19 6.57 0.00 3.32 2.15 -1.26 -1.82 116.67 126.82 2kui s ASP 594 Ca -0.06 0.31 0.00 0.00 0.43 0.00 0.00 52.55 53.23 2kui s ASP 594 Cb -0.14 -2.49 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 2kui s ASP 594 CO -0.02 -1.09 0.32 0.00 -0.17 0.00 0.00 175.17 174.21 2kui n ALA 595 N 7.35 1.16 0.00 3.66 0.00 -1.26 -5.05 120.51 126.37 2kui n ALA 595 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.20 2kui n ALA 595 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.94 2kui n ALA 595 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2kui n GLY 596 N -0.05 2.86 0.37 0.00 0.00 -1.26 -4.65 105.19 102.46 2kui n GLY 596 Ca 0.00 -1.87 0.09 0.00 0.00 0.00 0.00 46.02 44.25 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 1.14 2.00 -0.02 0.00 -2.00 0.25 103.07 104.44 2kui h GLY 597 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2kui h GLY 597 CO 0.00 0.16 -0.09 1.76 0.00 0.00 0.00 176.54 178.37 2kui h SER 598 N 0.75 0.00 0.04 0.19 0.02 -2.03 -2.43 113.55 110.09 2kui h SER 598 Ca 0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.35 2kui h SER 598 Cb 0.51 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.05 2kui h SER 598 CO -0.17 0.09 -1.27 0.00 -1.14 0.00 0.00 176.83 174.34 2kui n GLN 599 N -3.50 0.20 -3.05 3.45 1.13 0.83 -4.64 117.38 111.81 2kui n GLN 599 Ca -0.02 -0.06 -0.39 0.00 -1.94 0.00 0.00 57.00 54.59 2kui n GLN 599 Cb 0.22 -1.51 -0.06 0.00 0.11 0.00 0.00 30.24 29.00 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 -3.16 3.80 0.00 1.08 3.76 -0.81 -0.80 115.29 119.17 2kui s HIS 600 Ca 0.03 1.47 0.00 0.00 -0.15 0.00 0.00 55.06 56.41 2kui s HIS 600 Cb 0.15 -2.73 0.00 0.00 1.11 0.00 0.00 32.58 31.11 2kui s HIS 600 CO 0.87 0.41 0.00 0.09 -0.85 0.00 0.00 174.74 175.26 2kui n ASN 601 N 2.23 0.00 -4.78 1.40 3.02 -1.26 -4.85 115.26 111.02 2kui n ASN 601 Ca -0.05 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.11 2kui n ASN 601 Cb 0.50 -0.99 -0.06 0.00 -0.61 0.00 0.00 39.78 38.63 2kui n ASN 601 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2kui s ARG 602 N 0.00 4.39 0.04 3.52 3.00 -1.23 0.83 118.95 129.50 2kui s ARG 602 Ca 0.00 0.94 -0.30 0.00 -1.00 0.00 0.00 55.73 55.36 2kui s ARG 602 Cb 0.00 -3.28 -0.05 0.00 0.00 0.00 0.00 34.95 31.62 2kui s ARG 602 CO 0.00 0.52 1.19 0.08 0.00 0.00 0.00 175.30 177.08 2kui s VAL 603 N -0.82 4.12 -0.17 7.11 1.01 -0.12 -4.03 120.40 127.51 2kui s VAL 603 Ca 0.33 1.52 -0.22 0.00 0.00 0.00 0.00 61.98 63.61 2kui s VAL 603 Cb -0.21 -3.97 -0.19 0.00 0.00 0.00 0.00 36.38 32.01 2kui s VAL 603 CO 0.22 0.10 0.40 0.58 0.00 0.00 0.00 175.10 176.40 2kui h VAL 604 N 4.60 1.14 -3.69 2.92 2.07 -0.43 -3.38 116.25 119.48 2kui h VAL 604 Ca -0.41 -2.07 -0.09 0.00 0.82 0.00 0.00 66.70 64.96 2kui h VAL 604 Cb 1.21 2.36 -0.15 0.00 -1.52 0.00 0.00 31.29 33.19 2kui h VAL 604 CO 0.82 0.39 -0.37 -0.72 0.02 0.00 0.00 177.57 177.71 2kui s TYR 605 N -2.23 0.10 -0.21 1.57 1.13 -1.26 -4.91 117.35 111.54 2kui s TYR 605 Ca -0.21 -0.44 -0.03 0.00 -1.41 0.00 0.00 57.07 54.97 2kui s TYR 605 Cb 0.01 -0.04 -0.00 0.00 -1.10 0.00 0.00 41.96 40.83 2kui s TYR 605 CO 0.56 -0.50 -0.08 1.14 -2.51 0.00 0.00 175.55 174.16 2kui s GLN 606 N -3.35 3.32 0.14 -3.49 -2.07 -1.26 -3.91 119.66 109.04 2kui s GLN 606 Ca 0.01 -0.66 -0.23 0.00 -1.82 0.00 0.00 55.36 52.66 2kui s GLN 606 Cb 0.03 -2.91 0.00 0.00 -1.09 0.00 0.00 33.01 29.04 2kui s GLN 606 CO -0.08 -0.16 1.64 -0.97 -1.32 0.00 0.00 175.29 174.40 2kui h ASN 607 N 7.96 -0.68 -3.26 12.60 -1.24 -1.31 -3.36 115.58 126.28 2kui h ASN 607 Ca -0.41 0.12 -0.59 0.00 0.71 0.00 0.00 56.30 56.13 2kui h ASN 607 Cb 1.16 0.32 -0.08 0.00 0.73 0.00 0.00 38.32 40.45 2kui h ASN 607 CO 0.61 -0.26 0.57 -2.84 -1.29 0.00 0.00 177.43 174.21 2kui s PRO 608 N -6.10 4.16 0.49 6.67 0.02 -1.26 -5.01 135.00 133.97 2kui s PRO 608 Ca -0.15 0.99 -0.23 0.00 0.02 0.00 0.00 61.00 61.63 2kui s PRO 608 Cb 0.11 -3.66 -0.06 0.00 0.02 0.00 0.00 34.50 30.90 2kui s PRO 608 CO 0.68 -0.60 1.30 -2.14 -0.33 0.00 0.00 177.00 175.91 2kui s PRO 609 N 3.01 3.49 0.16 5.54 0.02 -1.26 -4.95 135.00 141.01 2kui s PRO 609 Ca 0.37 2.11 -0.31 0.00 0.02 0.00 0.00 61.00 63.20 2kui s PRO 609 Cb -0.15 -2.41 -0.09 0.00 0.02 0.00 0.00 34.50 31.87 2kui s PRO 609 CO 0.08 -0.87 1.42 0.00 -0.33 0.00 0.00 177.00 177.31 2kui s ALA 610 N -1.35 3.62 0.00 -1.55 0.00 -1.26 -1.44 121.76 119.78 2kui s ALA 610 Ca 0.66 1.20 0.00 0.00 0.00 0.00 0.00 51.96 53.82 2kui s ALA 610 Cb -0.37 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.20 2kui s ALA 610 CO 0.45 -0.65 0.00 0.41 0.00 0.00 0.00 175.76 175.97 2kui n GLY 611 N 3.19 3.03 3.92 0.00 0.00 0.02 -4.94 105.19 110.41 2kui n GLY 611 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.69 5.00 0.01 2.61 2.01 -0.52 -4.72 115.64 117.34 2kui s THR 612 Ca 0.00 -0.06 -0.26 0.00 0.31 0.00 0.00 61.69 61.68 2kui s THR 612 Cb 0.00 -3.83 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 2kui s THR 612 CO 0.00 -0.60 0.79 -0.83 -0.69 0.00 0.00 174.62 173.29 2kui s GLY 613 N -3.82 2.78 -0.01 4.40 0.00 -1.26 -1.37 107.32 108.04 2kui s GLY 613 Ca 0.44 0.30 0.05 0.00 0.00 0.00 0.00 44.72 45.50 2kui s GLY 613 CO 0.37 1.22 -0.14 -1.34 0.00 0.00 0.00 173.10 173.21 2kui s VAL 614 N 0.31 3.12 0.99 1.40 -7.23 0.11 -4.63 120.40 114.47 2kui s VAL 614 Ca 0.41 -0.87 -0.14 0.00 -1.81 0.00 0.00 61.98 59.57 2kui s VAL 614 Cb -0.20 -2.28 0.06 0.00 0.56 0.00 0.00 36.38 34.52 2kui s VAL 614 CO 0.23 0.47 0.36 -0.46 -0.31 0.00 0.00 175.10 175.39 2kui n ASN 615 N 1.92 -2.07 0.26 4.85 6.94 -1.25 -0.18 115.26 125.72 2kui n ASN 615 Ca -0.16 0.24 0.16 0.00 -0.02 0.00 0.00 54.58 54.79 2kui n ASN 615 Cb 0.52 -1.17 0.89 0.00 -2.36 0.00 0.00 39.78 37.66 2kui n ASN 615 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 2kui h ARG 616 N -1.69 0.00 0.00 -3.83 -0.00 -1.86 0.17 114.38 107.16 2kui h ARG 616 Ca -0.46 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 58.93 2kui h ARG 616 Cb 1.30 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.25 2kui h ARG 616 CO 0.35 0.00 -0.45 -0.44 0.00 0.00 0.00 179.97 179.44 2kui h ASP 617 N 0.00 0.00 -0.35 7.04 3.32 -1.90 -3.47 116.42 121.06 2kui h ASP 617 Ca 0.04 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 2kui h ASP 617 Cb 0.23 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 2kui h ASP 617 CO -0.00 0.45 -0.12 0.61 -1.72 0.00 0.00 179.24 178.46 2kui n GLY 618 N -0.01 0.77 3.65 2.75 0.00 0.58 -3.93 105.19 109.01 2kui n GLY 618 Ca -0.01 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.23 3.72 -0.06 -0.61 -1.16 -1.26 -4.78 121.20 114.81 2kui s ILE 619 Ca 0.00 0.85 0.04 0.00 -0.51 0.00 0.00 60.65 61.03 2kui s ILE 619 Cb 0.00 -3.59 0.00 0.00 0.61 0.00 0.00 42.46 39.48 2kui s ILE 619 CO 0.00 -0.12 -0.17 0.27 -2.81 0.00 0.00 174.94 172.11 2kui s ILE 620 N 4.24 1.43 -0.27 2.00 -5.25 -1.26 -4.85 121.20 117.23 2kui s ILE 620 Ca 0.70 -0.70 -0.12 0.00 -0.99 0.00 0.00 60.65 59.54 2kui s ILE 620 Cb -0.30 -1.25 -0.05 0.00 2.95 0.00 0.00 42.46 43.82 2kui s ILE 620 CO 0.27 0.42 0.26 -0.89 -1.79 0.00 0.00 174.94 173.20 2kui s THR 621 N 0.22 5.26 0.36 8.37 2.01 -1.26 -4.57 115.64 126.03 2kui s THR 621 Ca -0.08 0.32 0.09 0.00 0.31 0.00 0.00 61.69 62.33 2kui s THR 621 Cb -0.13 -3.59 -0.07 0.00 0.01 0.00 0.00 72.50 68.72 2kui s THR 621 CO 0.03 0.22 -0.07 -1.48 -0.69 0.00 0.00 174.62 172.64 2kui s LEU 622 N 1.82 2.77 -0.03 4.42 0.05 -1.26 -0.76 118.68 125.70 2kui s LEU 622 Ca 0.10 -1.22 -0.10 0.00 0.05 0.00 0.00 54.13 52.96 2kui s LEU 622 Cb -0.16 -1.00 0.01 0.00 -2.05 0.00 0.00 46.19 43.00 2kui s LEU 622 CO 0.10 -0.25 0.21 -0.60 -0.55 0.00 0.00 176.35 175.26 2kui s ARG 623 N -3.63 0.47 0.15 1.48 3.52 -1.25 -4.55 118.95 115.13 2kui s ARG 623 Ca 0.33 -0.13 -0.00 0.00 -0.13 0.00 0.00 55.73 55.80 2kui s ARG 623 Cb 0.04 0.21 -0.04 0.00 -1.56 0.00 0.00 34.95 33.59 2kui s ARG 623 CO 0.17 -0.11 0.05 -0.59 -0.81 0.00 0.00 175.30 174.01 2kui s PHE 624 N -0.91 0.97 0.00 5.12 -0.12 -1.26 0.37 117.98 122.14 2kui s PHE 624 Ca -0.10 -1.20 0.00 0.00 -0.05 0.00 0.00 56.93 55.58 2kui s PHE 624 Cb -0.05 -0.54 0.00 0.00 -0.63 0.00 0.00 43.02 41.80 2kui s PHE 624 CO 0.02 -0.46 0.00 0.41 -0.05 0.00 0.00 175.22 175.14 2kui n GLY 625 N -0.14 -1.00 0.00 1.99 0.00 0.02 -4.66 105.19 101.40 2kui n GLY 625 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2kui n GLY 625 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14