#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b8e n GLU 416 N 0.00 1.03 -0.45 0.00 0.28 -1.26 -4.85 120.64 115.39 2b8e n GLU 416 Ca 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.16 56.96 2b8e n GLU 416 Cb 0.00 -0.88 -0.06 0.00 1.43 0.00 0.00 31.44 31.93 2b8e n GLU 416 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 2b8e n LYS 417 N -2.05 0.90 -2.45 3.44 5.02 -1.26 -4.89 118.16 116.87 2b8e n LYS 417 Ca 0.00 -0.36 -0.41 0.00 -2.02 0.00 0.00 58.31 55.52 2b8e n LYS 417 Cb 0.38 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 2b8e n LYS 417 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2b8e s VAL 418 N 1.58 3.60 -0.07 -0.18 -7.23 -1.26 -4.82 120.40 112.02 2b8e s VAL 418 Ca 0.24 1.46 0.13 0.00 -1.81 0.00 0.00 61.98 62.00 2b8e s VAL 418 Cb 0.12 -3.93 -0.20 0.00 0.56 0.00 0.00 36.38 32.93 2b8e s VAL 418 CO 0.00 0.29 0.31 0.35 -0.31 0.00 0.00 175.10 175.74 2b8e n THR 419 N 1.89 0.00 -3.75 5.32 -2.24 0.30 -4.90 114.28 110.91 2b8e n THR 419 Ca 0.02 -0.29 -0.12 0.00 -2.27 0.00 0.00 64.05 61.38 2b8e n THR 419 Cb 0.45 0.28 -0.12 0.00 -2.10 0.00 0.00 70.33 68.84 2b8e n THR 419 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b8e s ALA 420 N -2.84 -0.68 -0.13 6.98 0.00 -0.57 -1.43 121.76 123.08 2b8e s ALA 420 Ca -0.04 0.94 0.02 0.00 0.00 0.00 0.00 51.96 52.88 2b8e s ALA 420 Cb 0.08 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.64 2b8e s ALA 420 CO 0.54 -0.17 -0.19 0.08 0.00 0.00 0.00 175.76 176.02 2b8e s VAL 421 N 0.67 2.41 -0.10 0.00 1.01 0.25 -0.70 120.40 123.94 2b8e s VAL 421 Ca -0.04 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.10 2b8e s VAL 421 Cb -0.06 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2b8e s VAL 421 CO -0.04 0.54 -0.22 0.27 0.00 0.00 0.00 175.10 175.65 2b8e s ILE 422 N 0.62 1.91 -0.12 2.22 -4.36 -0.53 -0.86 121.20 120.08 2b8e s ILE 422 Ca -0.10 -0.93 -0.07 0.00 -0.26 0.00 0.00 60.65 59.28 2b8e s ILE 422 Cb -0.16 -1.67 -0.04 0.00 1.25 0.00 0.00 42.46 41.84 2b8e s ILE 422 CO 0.03 0.53 0.15 -0.36 0.24 0.00 0.00 174.94 175.52 2b8e s PHE 423 N 0.43 3.60 -0.05 1.37 0.40 -0.13 -1.01 117.98 122.58 2b8e s PHE 423 Ca -0.17 0.54 -0.30 0.00 -0.60 0.00 0.00 56.93 56.40 2b8e s PHE 423 Cb -0.17 -1.95 -0.02 0.00 0.51 0.00 0.00 43.02 41.38 2b8e s PHE 423 CO 0.07 0.73 1.04 0.34 0.70 0.00 0.00 175.22 178.10 2b8e s ASP 424 N -1.01 7.25 0.16 1.36 3.68 0.13 -1.82 116.67 126.43 2b8e s ASP 424 Ca 0.15 1.65 -0.14 0.00 2.13 0.00 0.00 52.55 56.33 2b8e s ASP 424 Cb -0.12 -2.56 0.04 0.00 -1.45 0.00 0.00 42.92 38.83 2b8e s ASP 424 CO 0.04 -0.40 1.76 0.50 0.13 0.00 0.00 175.17 177.20 2b8e h LYS 425 N 7.02 0.69 0.00 4.34 3.11 -1.69 -3.31 116.57 126.73 2b8e h LYS 425 Ca -0.36 -0.08 0.00 0.00 -2.81 0.00 0.00 60.65 57.40 2b8e h LYS 425 Cb 1.18 -0.13 0.00 0.00 -1.00 0.00 0.00 32.23 32.28 2b8e h LYS 425 CO 0.82 0.55 0.00 2.41 -2.81 0.00 0.00 179.45 180.42 2b8e n THR 426 N -4.65 0.00 -1.19 1.00 -1.04 -1.26 -2.39 114.28 104.75 2b8e n THR 426 Ca 0.02 1.33 -0.25 0.00 -2.04 0.00 0.00 64.05 63.11 2b8e n THR 426 Cb 0.09 -2.30 0.03 0.00 -1.82 0.00 0.00 70.33 66.33 2b8e n THR 426 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2b8e n GLY 427 N -0.84 4.66 2.08 3.41 0.00 -1.26 -3.74 105.19 109.50 2b8e n GLY 427 Ca 0.00 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.38 2b8e n GLY 427 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2b8e n THR 428 N 0.11 0.00 0.15 2.61 -1.04 -1.24 -4.11 114.28 110.75 2b8e n THR 428 Ca 0.43 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.50 2b8e n THR 428 Cb 0.57 -0.18 0.05 0.00 -1.82 0.00 0.00 70.33 68.95 2b8e n THR 428 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2b8e h LEU 429 N 0.00 0.00 -9.72 -4.42 3.38 -1.58 -3.46 115.31 99.51 2b8e h LEU 429 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 2b8e h LEU 429 Cb 0.00 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.66 2b8e h LEU 429 CO 0.00 0.31 -0.57 0.42 0.09 0.00 0.00 178.44 178.69 2b8e s THR 430 N -3.07 3.05 -2.00 0.22 -4.23 -1.00 -0.71 115.64 107.90 2b8e s THR 430 Ca 0.04 -1.78 0.10 0.00 -1.18 0.00 0.00 61.69 58.86 2b8e s THR 430 Cb 0.07 -2.93 0.29 0.00 1.34 0.00 0.00 72.50 71.27 2b8e s THR 430 CO 0.73 -0.22 1.18 2.29 -0.54 0.00 0.00 174.62 178.06 2b8e n LYS 431 N -1.06 0.73 -0.90 3.99 0.00 -0.69 -4.66 118.16 115.56 2b8e n LYS 431 Ca -0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.24 2b8e n LYS 431 Cb 0.61 -1.21 -0.01 0.00 -0.00 0.00 0.00 35.03 34.41 2b8e n LYS 431 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2b8e n GLY 432 N 0.33 0.24 2.76 2.58 0.00 -1.25 -4.89 105.19 104.97 2b8e n GLY 432 Ca 0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 2b8e n GLY 432 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2b8e n LYS 433 N 0.36 2.24 -1.73 1.61 2.85 -1.26 -5.03 118.16 117.20 2b8e n LYS 433 Ca -0.03 -4.56 -0.42 0.00 -1.05 0.00 0.00 58.31 52.25 2b8e n LYS 433 Cb 0.42 -2.30 -0.01 0.00 -0.65 0.00 0.00 35.03 32.49 2b8e n LYS 433 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2b8e n PRO 434 N 1.58 2.44 -4.11 -1.58 -0.04 -1.26 -4.81 135.00 127.22 2b8e n PRO 434 Ca 0.24 0.86 -0.13 0.00 -0.04 0.00 0.00 63.50 64.43 2b8e n PRO 434 Cb 0.37 -2.57 -0.11 0.00 -0.04 0.00 0.00 33.50 31.15 2b8e n PRO 434 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2b8e s GLU 435 N -1.05 0.66 0.08 0.54 2.12 -0.31 -4.64 118.70 116.10 2b8e s GLU 435 Ca 0.61 -0.94 -0.30 0.00 0.36 0.00 0.00 54.97 54.70 2b8e s GLU 435 Cb -0.54 -0.38 -0.06 0.00 0.26 0.00 0.00 34.13 33.41 2b8e s GLU 435 CO 0.54 0.06 1.18 0.08 -0.54 0.00 0.00 175.26 176.58 2b8e s VAL 436 N -1.91 4.01 -0.00 3.70 1.01 -1.26 -0.89 120.40 125.06 2b8e s VAL 436 Ca -0.03 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.45 2b8e s VAL 436 Cb -0.06 -3.96 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 2b8e s VAL 436 CO -0.00 0.14 0.00 0.35 0.00 0.00 0.00 175.10 175.59 2b8e n THR 437 N 3.61 0.00 -3.86 3.92 -2.24 -0.29 -4.92 114.28 110.51 2b8e n THR 437 Ca 0.08 -0.04 -0.12 0.00 -2.27 0.00 0.00 64.05 61.70 2b8e n THR 437 Cb 0.46 0.53 -0.13 0.00 -2.10 0.00 0.00 70.33 69.10 2b8e n THR 437 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2b8e s ASP 438 N -1.94 -0.04 -0.25 3.42 1.11 -1.13 -4.99 116.67 112.85 2b8e s ASP 438 Ca -0.00 0.06 -0.01 0.00 0.18 0.00 0.00 52.55 52.78 2b8e s ASP 438 Cb 0.00 0.14 0.07 0.00 1.07 0.00 0.00 42.92 44.21 2b8e s ASP 438 CO 0.01 -0.07 0.03 -0.76 1.18 0.00 0.00 175.17 175.55 2b8e s LEU 439 N -0.19 2.14 -0.55 1.23 1.43 -1.26 -1.81 118.68 119.66 2b8e s LEU 439 Ca -0.02 -1.26 0.01 0.00 -1.03 0.00 0.00 54.13 51.83 2b8e s LEU 439 Cb -0.02 -0.92 0.14 0.00 0.03 0.00 0.00 46.19 45.43 2b8e s LEU 439 CO 0.00 -0.32 0.32 -0.69 0.23 0.00 0.00 176.35 175.89 2b8e s VAL 440 N 1.59 3.04 0.07 -1.59 1.01 0.90 -4.89 120.40 120.52 2b8e s VAL 440 Ca 0.01 -3.11 -0.23 0.00 0.00 0.00 0.00 61.98 58.65 2b8e s VAL 440 Cb -0.18 -3.05 -0.06 0.00 0.00 0.00 0.00 36.38 33.09 2b8e s VAL 440 CO -0.13 -0.82 0.70 -2.16 0.00 0.00 0.00 175.10 172.69 2b8e s PRO 441 N -0.12 4.43 -0.10 2.72 0.04 -1.26 0.33 135.00 141.03 2b8e s PRO 441 Ca 0.17 0.96 0.18 0.00 0.04 0.00 0.00 61.00 62.34 2b8e s PRO 441 Cb -0.23 -3.32 -0.24 0.00 0.04 0.00 0.00 34.50 30.75 2b8e s PRO 441 CO -0.02 0.42 0.36 1.28 0.04 0.00 0.00 177.00 179.08 2b8e n LEU 442 N 2.34 0.28 -4.00 -3.56 4.77 0.99 -4.89 117.00 112.94 2b8e n LEU 442 Ca -0.05 0.13 -0.21 0.00 -0.03 0.00 0.00 56.01 55.85 2b8e n LEU 442 Cb 0.50 0.30 -0.16 0.00 -2.33 0.00 0.00 43.42 41.73 2b8e n LEU 442 CO 0.45 0.34 -0.44 0.20 -1.33 0.00 0.00 177.39 176.61 2b8e s ASN 443 N -5.47 1.29 0.28 -1.43 0.02 -1.10 -5.05 114.94 103.48 2b8e s ASN 443 Ca -0.08 -0.20 0.00 0.00 -1.02 0.00 0.00 52.86 51.56 2b8e s ASN 443 Cb 0.08 -0.39 0.00 0.00 0.02 0.00 0.00 41.25 40.96 2b8e s ASN 443 CO 0.84 0.06 0.00 0.61 0.02 0.00 0.00 177.10 178.63 2b8e n GLY 444 N 3.38 -1.47 3.96 0.66 0.00 -1.26 -4.88 105.19 105.58 2b8e n GLY 444 Ca -0.19 -1.26 -0.19 0.00 0.00 0.00 0.00 46.02 44.37 2b8e n GLY 444 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2b8e s ASP 445 N -4.00 5.27 0.17 1.61 3.84 -1.26 -4.85 116.67 117.45 2b8e s ASP 445 Ca 0.00 -0.67 -0.15 0.00 -0.00 0.00 0.00 52.55 51.73 2b8e s ASP 445 Cb 0.00 -0.38 0.11 0.00 -1.38 0.00 0.00 42.92 41.27 2b8e s ASP 445 CO 0.00 -0.85 1.75 -0.33 -0.00 0.00 0.00 175.17 175.74 2b8e h GLU 446 N 0.71 0.31 -0.89 2.11 5.08 -1.92 -1.81 114.58 118.17 2b8e h GLU 446 Ca -0.39 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 57.96 2b8e h GLU 446 Cb 1.28 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 2b8e h GLU 446 CO 0.50 0.21 0.58 -0.09 -1.00 0.00 0.00 179.01 179.20 2b8e h ARG 447 N 0.32 1.17 -0.18 2.33 2.43 -1.98 0.02 114.38 118.49 2b8e h ARG 447 Ca 0.20 -0.07 -0.11 0.00 -0.81 0.00 0.00 59.98 59.19 2b8e h ARG 447 Cb 0.19 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 2b8e h ARG 447 CO -0.20 0.78 -0.35 1.49 -1.51 0.00 0.00 179.97 180.18 2b8e h GLU 448 N 1.20 0.39 -0.45 0.20 4.57 -1.89 -0.28 114.58 118.32 2b8e h GLU 448 Ca 0.32 -0.17 -0.05 0.00 -1.18 0.00 0.00 59.36 58.29 2b8e h GLU 448 Cb -0.13 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.43 2b8e h GLU 448 CO -0.07 0.69 0.09 1.25 -1.18 0.00 0.00 179.01 179.78 2b8e h LEU 449 N 0.33 0.70 -0.32 1.64 5.85 -0.41 -2.09 115.31 121.01 2b8e h LEU 449 Ca 0.04 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.50 2b8e h LEU 449 Cb 0.77 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 2b8e h LEU 449 CO 0.06 0.77 0.17 0.25 -0.34 0.00 0.00 178.44 179.35 2b8e h LEU 450 N 0.60 0.41 0.37 2.25 6.46 -0.67 -2.63 115.31 122.09 2b8e h LEU 450 Ca 0.14 -0.09 -0.02 0.00 -0.12 0.00 0.00 57.88 57.79 2b8e h LEU 450 Cb 0.36 -0.10 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 2b8e h LEU 450 CO 0.01 0.38 -0.19 -0.09 -0.62 0.00 0.00 178.44 177.93 2b8e h ARG 451 N 0.40 -0.49 -0.00 1.25 2.43 -0.95 0.12 114.38 117.15 2b8e h ARG 451 Ca 0.11 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.35 2b8e h ARG 451 Cb 0.07 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.67 2b8e h ARG 451 CO -0.02 -0.33 -0.38 -0.07 -1.51 0.00 0.00 179.97 177.67 2b8e h LEU 452 N -0.51 -1.15 -0.13 3.80 3.38 -1.38 -1.44 115.31 117.88 2b8e h LEU 452 Ca -0.05 0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.11 2b8e h LEU 452 Cb 0.39 0.45 -0.05 0.00 0.09 0.00 0.00 40.66 41.55 2b8e h LEU 452 CO 0.07 -0.43 -0.14 0.00 0.09 0.00 0.00 178.44 178.03 2b8e h ALA 453 N 0.08 -0.06 -0.55 1.53 0.00 -1.38 -1.14 119.26 117.74 2b8e h ALA 453 Ca 0.05 0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.06 2b8e h ALA 453 Cb 0.62 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2b8e h ALA 453 CO -0.30 -0.59 0.37 0.00 0.00 0.00 0.00 179.25 178.72 2b8e h ALA 454 N 0.89 1.76 -0.20 0.00 0.00 -0.48 0.30 119.26 121.53 2b8e h ALA 454 Ca 0.09 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 2b8e h ALA 454 Cb 0.31 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2b8e h ALA 454 CO -0.24 0.17 -0.41 0.82 0.00 0.00 0.00 179.25 179.60 2b8e h ILE 455 N 0.60 1.33 0.00 0.00 2.04 -0.58 -1.16 117.51 119.74 2b8e h ILE 455 Ca 0.23 -1.64 -0.02 0.00 1.00 0.00 0.00 64.86 64.43 2b8e h ILE 455 Cb 0.15 1.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2b8e h ILE 455 CO -0.06 0.51 -0.10 0.00 0.00 0.00 0.00 178.15 178.49 2b8e h ALA 456 N 0.60 1.02 -0.01 1.87 0.00 -0.66 -3.03 119.26 119.03 2b8e h ALA 456 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2b8e h ALA 456 Cb 1.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 2b8e h ALA 456 CO 0.09 0.13 -0.45 -1.91 0.00 0.00 0.00 179.25 177.12 2b8e n GLU 457 N -3.24 1.15 0.23 0.00 4.07 0.04 -4.54 120.64 118.36 2b8e n GLU 457 Ca 0.00 -0.92 0.16 0.00 -0.06 0.00 0.00 57.16 56.35 2b8e n GLU 457 Cb 0.37 -1.48 0.85 0.00 -0.06 0.00 0.00 31.44 31.12 2b8e n GLU 457 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 2b8e h ARG 458 N 2.24 0.00 -0.48 5.31 2.43 -1.08 -2.50 114.38 120.30 2b8e h ARG 458 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2b8e h ARG 458 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2b8e h ARG 458 CO 0.00 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 179.00 2b8e n ARG 459 N -3.83 3.63 -4.46 0.20 5.12 -1.26 -4.92 116.66 111.13 2b8e n ARG 459 Ca 0.00 -2.82 -0.34 0.00 -1.93 0.00 0.00 57.85 52.77 2b8e n ARG 459 Cb 0.26 -1.87 -0.13 0.00 -1.16 0.00 0.00 32.46 29.57 2b8e n ARG 459 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2b8e s SER 460 N -1.19 4.58 -0.51 0.55 0.15 -0.94 -5.01 113.70 111.33 2b8e s SER 460 Ca 0.45 -0.19 -0.01 0.00 0.70 0.00 0.00 55.95 56.90 2b8e s SER 460 Cb 0.32 -1.74 0.35 0.00 -1.71 0.00 0.00 66.02 63.25 2b8e s SER 460 CO 0.17 0.16 2.02 -1.84 1.20 0.00 0.00 173.24 174.95 2b8e n GLU 461 N 3.61 2.29 -4.11 5.44 0.00 -1.26 -4.42 120.64 122.19 2b8e n GLU 461 Ca -0.18 -2.53 -0.28 0.00 0.00 0.00 0.00 57.16 54.18 2b8e n GLU 461 Cb 0.52 -1.99 -0.06 0.00 0.00 0.00 0.00 31.44 29.91 2b8e n GLU 461 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.13 176.12 2b8e s HIS 462 N -2.94 3.07 0.23 -1.84 3.76 -1.26 -4.98 115.29 111.32 2b8e s HIS 462 Ca 0.50 -0.03 -0.07 0.00 -0.15 0.00 0.00 55.06 55.32 2b8e s HIS 462 Cb 0.39 -1.50 0.37 0.00 1.11 0.00 0.00 32.58 32.95 2b8e s HIS 462 CO -0.00 0.51 1.74 -1.00 -0.85 0.00 0.00 174.74 175.14 2b8e h PRO 463 N 2.76 0.44 -0.39 8.40 0.13 -1.99 0.15 132.00 141.51 2b8e h PRO 463 Ca -0.47 -0.03 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 2b8e h PRO 463 Cb 1.19 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 2b8e h PRO 463 CO 0.62 0.29 0.04 0.82 -0.23 0.00 0.00 178.00 179.54 2b8e h ILE 464 N 0.45 1.25 0.05 -3.56 5.03 -1.96 -1.16 117.51 117.60 2b8e h ILE 464 Ca 0.36 -0.91 0.02 0.00 -0.12 0.00 0.00 64.86 64.21 2b8e h ILE 464 Cb 0.49 1.09 -0.03 0.00 -3.03 0.00 0.00 36.82 35.34 2b8e h ILE 464 CO -0.35 0.31 -0.17 0.00 -0.68 0.00 0.00 178.15 177.27 2b8e h ALA 465 N 0.90 -0.24 -0.46 1.87 0.00 -1.69 -2.20 119.26 117.44 2b8e h ALA 465 Ca 0.11 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2b8e h ALA 465 Cb 0.41 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 2b8e h ALA 465 CO 0.01 -0.67 0.06 0.93 0.00 0.00 0.00 179.25 179.58 2b8e h GLU 466 N -0.30 0.73 -0.30 0.00 5.08 -0.65 -1.92 114.58 117.21 2b8e h GLU 466 Ca 0.04 -0.16 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 2b8e h GLU 466 Cb 0.34 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2b8e h GLU 466 CO -0.13 0.70 0.20 0.00 -1.00 0.00 0.00 179.01 178.78 2b8e h ALA 467 N 1.37 0.38 -0.12 3.43 0.00 -0.92 0.34 119.26 123.75 2b8e h ALA 467 Ca 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2b8e h ALA 467 Cb 0.34 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2b8e h ALA 467 CO 0.01 -0.16 0.06 0.82 0.00 0.00 0.00 179.25 179.98 2b8e h ILE 468 N 0.40 1.11 -0.42 0.00 2.04 -1.00 -0.28 117.51 119.35 2b8e h ILE 468 Ca 0.11 -0.31 0.02 0.00 1.00 0.00 0.00 64.86 65.68 2b8e h ILE 468 Cb -0.04 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.12 2b8e h ILE 468 CO -0.03 0.10 0.25 0.58 0.00 0.00 0.00 178.15 179.05 2b8e h VAL 469 N 0.08 1.05 -0.32 1.67 2.07 -1.15 -1.68 116.25 117.96 2b8e h VAL 469 Ca 0.04 -0.18 0.07 0.00 0.82 0.00 0.00 66.70 67.45 2b8e h VAL 469 Cb 0.10 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.30 2b8e h VAL 469 CO -0.01 0.09 -0.09 0.11 0.02 0.00 0.00 177.57 177.69 2b8e h LYS 470 N 0.51 -0.02 -0.44 1.57 6.56 0.07 -0.29 116.57 124.53 2b8e h LYS 470 Ca 0.17 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.75 2b8e h LYS 470 Cb 0.00 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.64 2b8e h LYS 470 CO -0.07 -0.01 0.24 -0.22 -2.06 0.00 0.00 179.45 177.33 2b8e h LYS 471 N -0.02 0.60 -0.07 3.15 1.63 -0.67 0.37 116.57 121.56 2b8e h LYS 471 Ca 0.16 -0.05 -0.17 0.00 -0.85 0.00 0.00 60.65 59.73 2b8e h LYS 471 Cb 0.26 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.75 2b8e h LYS 471 CO -0.34 0.44 -0.69 0.00 -3.45 0.00 0.00 179.45 175.41 2b8e h ALA 472 N 1.66 0.69 -0.03 5.00 0.00 -0.35 -2.31 119.26 123.92 2b8e h ALA 472 Ca 0.16 -0.59 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 2b8e h ALA 472 Cb 0.01 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2b8e h ALA 472 CO -0.03 0.76 -0.05 -0.07 0.00 0.00 0.00 179.25 179.87 2b8e h LEU 473 N 0.23 0.10 -1.35 0.00 -0.00 -0.55 0.08 115.31 113.82 2b8e h LEU 473 Ca -0.02 -0.52 0.22 0.00 -0.00 0.00 0.00 57.88 57.55 2b8e h LEU 473 Cb 1.24 -0.03 -0.08 0.00 -0.00 0.00 0.00 40.66 41.79 2b8e h LEU 473 CO 0.11 0.60 0.62 -0.08 -0.00 0.00 0.00 178.44 179.70 2b8e h GLU 474 N -0.40 0.48 -0.70 1.13 4.81 -0.91 0.51 114.58 119.50 2b8e h GLU 474 Ca 0.00 -0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 2b8e h GLU 474 Cb 0.58 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.82 2b8e h GLU 474 CO 0.01 0.32 0.07 0.72 -0.73 0.00 0.00 179.01 179.40 2b8e n HIS 475 N -4.60 1.83 -2.08 0.92 8.25 -0.87 -4.93 115.22 113.73 2b8e n HIS 475 Ca 0.22 -0.72 -0.20 0.00 -0.26 0.00 0.00 57.72 56.75 2b8e n HIS 475 Cb 0.72 -0.49 -0.04 0.00 1.12 0.00 0.00 29.99 31.30 2b8e n HIS 475 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2b8e n GLY 476 N 0.34 0.46 3.69 -1.41 0.00 0.17 -4.96 105.19 103.48 2b8e n GLY 476 Ca 0.26 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 2b8e n GLY 476 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b8e s ILE 477 N -2.89 4.89 0.12 -0.61 1.01 0.01 -5.01 121.20 118.72 2b8e s ILE 477 Ca 0.00 1.76 -0.30 0.00 0.00 0.00 0.00 60.65 62.11 2b8e s ILE 477 Cb 0.00 -4.19 -0.06 0.00 0.01 0.00 0.00 42.46 38.22 2b8e s ILE 477 CO 0.00 0.08 1.10 -0.70 0.00 0.00 0.00 174.94 175.42 2b8e s GLU 478 N 1.71 4.56 -0.06 2.79 2.12 -1.26 -4.55 118.70 124.01 2b8e s GLU 478 Ca 0.43 1.67 0.05 0.00 0.36 0.00 0.00 54.97 57.48 2b8e s GLU 478 Cb -0.18 -3.32 -0.02 0.00 0.26 0.00 0.00 34.13 30.87 2b8e s GLU 478 CO 0.17 -0.01 -0.20 -0.51 -0.54 0.00 0.00 175.26 174.17 2b8e s LEU 479 N 0.16 2.36 0.00 2.70 1.43 -1.26 -5.05 118.68 119.02 2b8e s LEU 479 Ca 0.52 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 53.21 2b8e s LEU 479 Cb -0.28 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.53 2b8e s LEU 479 CO 0.32 0.27 0.33 0.61 0.23 0.00 0.00 176.35 178.12 2b8e n GLY 480 N 2.78 -0.04 3.18 -3.19 0.00 -1.26 -5.09 105.19 101.56 2b8e n GLY 480 Ca -0.17 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.65 2b8e n GLY 480 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b8e s GLU 481 N -3.45 3.10 0.61 1.61 0.41 -1.26 -4.85 118.70 114.87 2b8e s GLU 481 Ca 0.21 -0.78 -0.17 0.00 -0.41 0.00 0.00 54.97 53.82 2b8e s GLU 481 Cb -0.01 -2.67 -0.02 0.00 -1.78 0.00 0.00 34.13 29.64 2b8e s GLU 481 CO 0.14 -0.19 1.12 -1.25 -0.49 0.00 0.00 175.26 174.59 2b8e s PRO 482 N 1.29 3.01 0.00 0.39 0.04 -1.26 -5.01 135.00 133.46 2b8e s PRO 482 Ca 0.04 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.56 2b8e s PRO 482 Cb -0.14 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2b8e s PRO 482 CO -0.09 -1.10 0.00 0.39 0.04 0.00 0.00 177.00 176.24 2b8e n GLU 483 N -1.98 0.00 -2.93 4.56 1.02 -1.26 -4.85 120.64 115.19 2b8e n GLU 483 Ca 0.11 0.15 -0.41 0.00 -0.02 0.00 0.00 57.16 56.98 2b8e n GLU 483 Cb 0.52 -0.55 -0.05 0.00 -0.02 0.00 0.00 31.44 31.34 2b8e n GLU 483 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2b8e s LYS 484 N -0.46 4.20 -0.09 3.49 1.02 -1.26 -5.00 119.74 121.64 2b8e s LYS 484 Ca 0.00 0.89 -0.00 0.00 0.02 0.00 0.00 55.97 56.87 2b8e s LYS 484 Cb 0.00 -3.63 0.02 0.00 -0.52 0.00 0.00 37.83 33.71 2b8e s LYS 484 CO 0.00 -0.45 -0.06 0.08 -0.92 0.00 0.00 175.35 174.00 2b8e s VAL 485 N 2.60 0.88 -0.26 3.17 1.01 -1.26 -2.06 120.40 124.48 2b8e s VAL 485 Ca 0.34 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.13 2b8e s VAL 485 Cb -0.16 -0.91 0.06 0.00 0.00 0.00 0.00 36.38 35.37 2b8e s VAL 485 CO 0.09 0.34 -0.10 -0.70 0.00 0.00 0.00 175.10 174.72 2b8e s GLU 486 N 1.57 2.25 -0.25 2.72 2.12 0.01 -4.99 118.70 122.13 2b8e s GLU 486 Ca 0.01 -1.34 -0.14 0.00 0.36 0.00 0.00 54.97 53.86 2b8e s GLU 486 Cb -0.13 -2.90 -0.04 0.00 0.26 0.00 0.00 34.13 31.31 2b8e s GLU 486 CO -0.06 -0.57 0.33 0.08 -0.54 0.00 0.00 175.26 174.50 2b8e s VAL 487 N 1.11 5.22 -0.41 3.70 1.01 -1.26 -0.71 120.40 129.05 2b8e s VAL 487 Ca -0.09 0.49 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 2b8e s VAL 487 Cb -0.20 -3.66 0.11 0.00 0.00 0.00 0.00 36.38 32.63 2b8e s VAL 487 CO -0.05 0.22 0.22 -0.63 0.00 0.00 0.00 175.10 174.86 2b8e s ILE 488 N 1.72 3.49 0.12 2.22 1.01 0.93 -5.01 121.20 125.68 2b8e s ILE 488 Ca 0.14 -1.93 -0.35 0.00 0.00 0.00 0.00 60.65 58.51 2b8e s ILE 488 Cb -0.15 -3.34 -0.16 0.00 0.01 0.00 0.00 42.46 38.82 2b8e s ILE 488 CO 0.09 -0.66 1.33 0.00 0.00 0.00 0.00 174.94 175.70 2b8e n ALA 489 N 4.67 -0.59 -1.20 9.38 0.00 -1.26 -1.20 120.51 130.31 2b8e n ALA 489 Ca -0.04 0.49 -0.05 0.00 0.00 0.00 0.00 53.44 53.84 2b8e n ALA 489 Cb 0.41 -2.10 -0.02 0.00 0.00 0.00 0.00 19.45 17.74 2b8e n ALA 489 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b8e n GLY 490 N 2.49 0.77 2.02 0.00 0.00 -1.26 -4.79 105.19 104.42 2b8e n GLY 490 Ca 0.17 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.38 2b8e n GLY 490 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2b8e n GLU 491 N -2.79 0.00 0.00 1.61 1.02 -0.34 -4.97 120.64 115.17 2b8e n GLU 491 Ca -0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 2b8e n GLU 491 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.61 2b8e n GLU 491 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b8e n GLY 492 N 0.17 0.06 3.01 0.62 0.00 -0.52 -0.85 105.19 107.68 2b8e n GLY 492 Ca 0.00 -1.13 -0.09 0.00 0.00 0.00 0.00 46.02 44.80 2b8e n GLY 492 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b8e s VAL 493 N -4.00 0.17 -0.19 1.61 0.11 -0.31 -0.05 120.40 117.74 2b8e s VAL 493 Ca 0.00 -1.14 0.00 0.00 -2.93 0.00 0.00 61.98 57.92 2b8e s VAL 493 Cb 0.00 -0.58 0.04 0.00 -1.53 0.00 0.00 36.38 34.31 2b8e s VAL 493 CO 0.00 -0.61 -0.08 -0.69 -3.33 0.00 0.00 175.10 170.39 2b8e s VAL 494 N -2.04 1.43 -0.21 2.04 1.01 0.11 -1.96 120.40 120.77 2b8e s VAL 494 Ca -0.10 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 2b8e s VAL 494 Cb -0.06 -1.56 0.06 0.00 0.00 0.00 0.00 36.38 34.83 2b8e s VAL 494 CO -0.03 0.14 -0.01 0.00 0.00 0.00 0.00 175.10 175.20 2b8e s ALA 495 N 1.49 1.46 -1.36 5.51 0.00 -0.16 -0.81 121.76 127.89 2b8e s ALA 495 Ca -0.01 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 50.86 2b8e s ALA 495 Cb -0.16 -1.30 0.00 0.00 0.00 0.00 0.00 23.12 21.67 2b8e s ALA 495 CO -0.08 -1.18 0.45 -0.25 0.00 0.00 0.00 175.76 174.70 2b8e n ASP 496 N 4.87 -1.48 0.00 0.00 10.43 -0.87 -0.80 116.55 128.69 2b8e n ASP 496 Ca -0.10 -1.09 0.00 0.00 2.57 0.00 0.00 54.79 56.16 2b8e n ASP 496 Cb 0.46 -2.70 0.00 0.00 1.84 0.00 0.00 41.12 40.72 2b8e n ASP 496 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2b8e n GLY 497 N -2.05 1.38 3.67 0.44 0.00 -1.26 -5.01 105.19 102.37 2b8e n GLY 497 Ca -0.25 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 2b8e n GLY 497 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b8e s ILE 498 N -3.66 4.85 -0.07 -0.61 -1.09 0.02 -3.85 121.20 116.80 2b8e s ILE 498 Ca 0.00 -0.02 0.01 0.00 -2.23 0.00 0.00 60.65 58.41 2b8e s ILE 498 Cb 0.00 -3.16 -0.03 0.00 -1.58 0.00 0.00 42.46 37.69 2b8e s ILE 498 CO 0.00 0.49 -0.08 -0.76 -1.23 0.00 0.00 174.94 173.36 2b8e s LEU 499 N 0.09 3.09 -0.24 2.97 1.43 0.18 -0.99 118.68 125.21 2b8e s LEU 499 Ca 0.06 -0.06 -0.03 0.00 -1.03 0.00 0.00 54.13 53.07 2b8e s LEU 499 Cb -0.12 -1.66 0.10 0.00 0.03 0.00 0.00 46.19 44.54 2b8e s LEU 499 CO 0.01 0.36 0.22 -0.69 0.23 0.00 0.00 176.35 176.47 2b8e s VAL 500 N -0.77 -0.29 -0.07 -1.59 1.01 -0.83 -0.55 120.40 117.30 2b8e s VAL 500 Ca 0.12 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.79 2b8e s VAL 500 Cb -0.11 -0.79 0.00 0.00 0.00 0.00 0.00 36.38 35.48 2b8e s VAL 500 CO 0.01 -0.36 0.00 0.61 0.00 0.00 0.00 175.10 175.37 2b8e n GLY 501 N 5.30 -0.58 1.33 4.51 0.00 -0.98 -1.16 105.19 113.61 2b8e n GLY 501 Ca -0.05 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 2b8e n GLY 501 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2b8e n ASN 502 N 0.00 0.25 0.23 1.61 0.23 -0.03 -0.67 115.26 116.88 2b8e n ASN 502 Ca 0.00 -1.28 0.08 0.00 -0.53 0.00 0.00 54.58 52.85 2b8e n ASN 502 Cb 0.00 -0.29 0.57 0.00 -2.08 0.00 0.00 39.78 37.98 2b8e n ASN 502 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 2b8e h LYS 503 N 0.00 0.00 0.09 -3.83 5.09 -1.93 -2.59 116.57 113.40 2b8e h LYS 503 Ca -0.13 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.60 2b8e h LYS 503 Cb 0.41 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.75 2b8e h LYS 503 CO 0.11 0.19 -0.04 -0.09 -2.09 0.00 0.00 179.45 177.54 2b8e h ARG 504 N 0.00 -0.11 -0.95 0.07 2.43 -1.93 -0.03 114.38 113.86 2b8e h ARG 504 Ca -0.00 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2b8e h ARG 504 Cb 0.41 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 2b8e h ARG 504 CO 0.03 0.07 0.00 -0.11 -1.51 0.00 0.00 179.97 178.45 2b8e n LEU 505 N -5.06 0.00 0.00 3.80 7.94 -0.98 -0.80 117.00 121.90 2b8e n LEU 505 Ca -0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.82 2b8e n LEU 505 Cb 0.14 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.09 2b8e n LEU 505 CO 0.33 0.00 0.00 -1.84 -1.11 0.00 0.00 177.39 174.77 2b8e n GLU 507 N 0.68 0.00 -0.19 1.96 -0.00 -0.03 -2.17 120.64 120.89 2b8e n GLU 507 Ca 0.00 0.00 0.30 0.00 -0.00 0.00 0.00 57.16 57.46 2b8e n GLU 507 Cb 0.00 0.00 0.71 0.00 -0.00 0.00 0.00 31.44 32.15 2b8e n GLU 507 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2b8e h ASP 508 N 0.00 0.00 -0.45 -1.84 3.45 -1.22 0.45 116.42 116.81 2b8e h ASP 508 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 2b8e h ASP 508 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 2b8e h ASP 508 CO 0.00 0.00 0.00 0.49 -1.57 0.00 0.00 179.24 178.16 2b8e n PHE 509 N -3.94 0.92 -1.95 4.55 3.72 -0.92 -4.96 117.46 114.86 2b8e n PHE 509 Ca 0.20 -0.61 -0.14 0.00 -0.05 0.00 0.00 57.45 56.85 2b8e n PHE 509 Cb 1.10 -0.15 -0.03 0.00 -0.94 0.00 0.00 39.48 39.47 2b8e n PHE 509 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2b8e n GLY 510 N 0.58 0.41 3.67 1.37 0.00 0.16 -4.99 105.19 106.38 2b8e n GLY 510 Ca 0.19 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 2b8e n GLY 510 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b8e s VAL 511 N -2.64 5.08 0.21 1.61 1.01 -1.26 -5.01 120.40 119.40 2b8e s VAL 511 Ca 0.00 1.06 -0.30 0.00 0.00 0.00 0.00 61.98 62.74 2b8e s VAL 511 Cb 0.00 -3.88 -0.09 0.00 0.00 0.00 0.00 36.38 32.41 2b8e s VAL 511 CO 0.00 0.17 1.23 0.00 0.00 0.00 0.00 175.10 176.51 2b8e s ALA 512 N 1.58 3.47 -0.21 5.51 0.00 -1.26 -4.32 121.76 126.53 2b8e s ALA 512 Ca 0.26 1.02 0.01 0.00 0.00 0.00 0.00 51.96 53.26 2b8e s ALA 512 Cb -0.16 -3.43 0.03 0.00 0.00 0.00 0.00 23.12 19.56 2b8e s ALA 512 CO 0.10 -0.43 -0.16 0.08 0.00 0.00 0.00 175.76 175.36 2b8e s VAL 513 N -0.15 2.17 0.69 0.00 1.01 -1.26 -4.57 120.40 118.29 2b8e s VAL 513 Ca 0.53 -1.17 -0.10 0.00 0.00 0.00 0.00 61.98 61.23 2b8e s VAL 513 Cb -0.34 -2.05 0.02 0.00 0.00 0.00 0.00 36.38 34.00 2b8e s VAL 513 CO 0.39 0.33 1.06 -0.94 0.00 0.00 0.00 175.10 175.93 2b8e s SER 514 N 1.23 5.44 0.37 3.32 1.04 -1.26 -4.84 113.70 119.00 2b8e s SER 514 Ca 0.00 1.04 0.09 0.00 0.48 0.00 0.00 55.95 57.56 2b8e s SER 514 Cb -0.16 -1.86 0.73 0.00 0.10 0.00 0.00 66.02 64.83 2b8e s SER 514 CO -0.10 -1.31 1.88 0.78 0.98 0.00 0.00 173.24 175.47 2b8e h ASN 515 N -0.58 0.23 -0.19 7.02 -0.26 -2.00 0.59 115.58 120.40 2b8e h ASN 515 Ca -0.45 -0.05 -0.01 0.00 -0.56 0.00 0.00 56.30 55.22 2b8e h ASN 515 Cb 1.26 -0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 38.45 2b8e h ASN 515 CO 0.63 0.42 0.07 -0.33 -1.06 0.00 0.00 177.43 177.17 2b8e h GLU 516 N 0.22 0.29 0.01 0.81 3.07 -1.99 0.47 114.58 117.47 2b8e h GLU 516 Ca 0.04 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.85 2b8e h GLU 516 Cb 0.44 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 2b8e h GLU 516 CO 0.03 0.37 -0.00 0.28 -1.40 0.00 0.00 179.01 178.29 2b8e h VAL 517 N 0.14 1.13 -0.30 3.13 2.07 -1.76 -0.92 116.25 119.75 2b8e h VAL 517 Ca 0.06 -0.43 0.06 0.00 0.82 0.00 0.00 66.70 67.21 2b8e h VAL 517 Cb 0.20 1.42 -0.06 0.00 -1.52 0.00 0.00 31.29 31.33 2b8e h VAL 517 CO -0.00 0.11 -0.08 -0.08 0.02 0.00 0.00 177.57 177.53 2b8e h GLU 518 N -0.20 -0.02 -0.18 1.57 4.57 0.34 0.20 114.58 120.87 2b8e h GLU 518 Ca -0.00 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.19 2b8e h GLU 518 Cb 0.19 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2b8e h GLU 518 CO 0.00 -0.01 0.07 -0.07 -1.18 0.00 0.00 179.01 177.82 2b8e h LEU 519 N -0.02 0.09 -0.71 1.64 3.38 0.05 0.16 115.31 119.91 2b8e h LEU 519 Ca 0.14 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.22 2b8e h LEU 519 Cb 0.24 -0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 2b8e h LEU 519 CO -0.31 0.08 0.36 0.00 0.09 0.00 0.00 178.44 178.66 2b8e h ALA 520 N 1.10 0.98 -0.45 1.53 0.00 -0.62 0.11 119.26 121.91 2b8e h ALA 520 Ca 0.07 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2b8e h ALA 520 Cb 0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2b8e h ALA 520 CO -0.07 -0.03 0.28 1.25 0.00 0.00 0.00 179.25 180.69 2b8e h LEU 521 N 0.62 0.53 -0.48 0.00 5.85 0.04 -2.32 115.31 119.55 2b8e h LEU 521 Ca 0.34 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.96 2b8e h LEU 521 Cb 0.34 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 2b8e h LEU 521 CO -0.26 0.41 0.07 -0.33 -0.34 0.00 0.00 178.44 177.99 2b8e h GLU 522 N 0.60 0.81 -0.15 1.25 3.07 0.33 -1.74 114.58 118.74 2b8e h GLU 522 Ca 0.16 -0.22 0.02 0.00 -0.50 0.00 0.00 59.36 58.82 2b8e h GLU 522 Cb -0.03 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 27.77 2b8e h GLU 522 CO -0.03 0.82 -0.00 -0.22 -1.40 0.00 0.00 179.01 178.18 2b8e h LYS 523 N 0.68 0.05 -1.00 2.33 3.64 -0.60 0.62 116.57 122.29 2b8e h LYS 523 Ca 0.15 -0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.57 2b8e h LYS 523 Cb 0.41 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 2b8e h LYS 523 CO 0.01 0.03 0.65 -0.07 -2.27 0.00 0.00 179.45 177.80 2b8e h LEU 524 N 0.05 1.06 -0.62 5.20 3.38 -1.31 -1.19 115.31 121.89 2b8e h LEU 524 Ca 0.07 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2b8e h LEU 524 Cb 0.09 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 2b8e h LEU 524 CO -0.12 0.71 0.16 -0.33 0.09 0.00 0.00 178.44 178.95 2b8e h GLU 525 N 1.22 0.99 -0.17 1.13 5.08 -0.58 -1.47 114.58 120.79 2b8e h GLU 525 Ca 0.41 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.56 2b8e h GLU 525 Cb 0.07 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 2b8e h GLU 525 CO -0.14 0.90 0.12 -0.09 -1.00 0.00 0.00 179.01 178.79 2b8e h ARG 526 N 0.91 0.13 -0.89 2.33 2.43 0.25 0.29 114.38 119.83 2b8e h ARG 526 Ca 0.20 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.36 2b8e h ARG 526 Cb 0.34 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 2b8e h ARG 526 CO 0.00 0.09 0.00 0.39 -1.51 0.00 0.00 179.97 178.94 2b8e n GLU 527 N -4.51 0.87 -3.40 0.20 1.02 -0.57 -4.65 120.64 109.60 2b8e n GLU 527 Ca 0.00 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.95 2b8e n GLU 527 Cb 0.16 -1.40 0.06 0.00 -0.02 0.00 0.00 31.44 30.24 2b8e n GLU 527 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2b8e n ALA 528 N 0.11 -2.41 -2.36 0.62 0.00 0.99 -5.02 120.51 112.45 2b8e n ALA 528 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 2b8e n ALA 528 Cb 0.24 -4.74 -0.10 0.00 0.00 0.00 0.00 19.45 14.84 2b8e n ALA 528 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2b8e s LYS 529 N -4.98 0.58 -0.19 0.00 1.02 -1.13 -4.64 119.74 110.40 2b8e s LYS 529 Ca 0.37 -1.08 -0.08 0.00 0.02 0.00 0.00 55.97 55.20 2b8e s LYS 529 Cb -0.07 0.07 -0.04 0.00 -0.52 0.00 0.00 37.83 37.26 2b8e s LYS 529 CO 0.77 -0.07 0.09 0.99 -0.92 0.00 0.00 175.35 176.21 2b8e s THR 530 N -3.14 5.04 -0.01 2.17 2.01 -0.28 -4.17 115.64 117.25 2b8e s THR 530 Ca 0.02 0.06 0.07 0.00 0.31 0.00 0.00 61.69 62.14 2b8e s THR 530 Cb 0.02 -3.28 -0.02 0.00 0.01 0.00 0.00 72.50 69.23 2b8e s THR 530 CO -0.06 0.45 -0.22 0.00 -0.69 0.00 0.00 174.62 174.10 2b8e s ALA 531 N 0.37 1.86 0.15 7.40 0.00 -1.26 -0.12 121.76 130.15 2b8e s ALA 531 Ca 0.05 -0.98 0.10 0.00 0.00 0.00 0.00 51.96 51.14 2b8e s ALA 531 Cb -0.12 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.50 2b8e s ALA 531 CO -0.01 0.45 -0.24 0.14 0.00 0.00 0.00 175.76 176.10 2b8e s VAL 532 N -0.55 2.14 0.01 0.00 -7.23 0.13 -4.80 120.40 110.10 2b8e s VAL 532 Ca 0.09 -1.82 -0.08 0.00 -1.81 0.00 0.00 61.98 58.37 2b8e s VAL 532 Cb -0.09 -1.94 -0.05 0.00 0.56 0.00 0.00 36.38 34.87 2b8e s VAL 532 CO -0.01 -0.04 0.28 -0.63 -0.31 0.00 0.00 175.10 174.40 2b8e s ILE 533 N -1.35 5.27 -0.15 -0.62 1.01 0.15 -1.58 121.20 123.93 2b8e s ILE 533 Ca 0.15 0.25 0.01 0.00 0.00 0.00 0.00 60.65 61.06 2b8e s ILE 533 Cb -0.09 -3.57 0.00 0.00 0.01 0.00 0.00 42.46 38.81 2b8e s ILE 533 CO 0.07 0.39 -0.17 -0.69 0.00 0.00 0.00 174.94 174.54 2b8e s VAL 534 N -1.28 2.55 0.07 2.92 1.01 -0.48 -2.32 120.40 122.88 2b8e s VAL 534 Ca 0.27 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.53 2b8e s VAL 534 Cb -0.13 -2.07 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 2b8e s VAL 534 CO 0.15 0.52 -0.25 0.00 0.00 0.00 0.00 175.10 175.52 2b8e s ALA 535 N 0.80 2.15 -0.10 5.51 0.00 0.28 0.92 121.76 131.32 2b8e s ALA 535 Ca -0.06 -1.28 -0.05 0.00 0.00 0.00 0.00 51.96 50.57 2b8e s ALA 535 Cb -0.15 -0.41 0.04 0.00 0.00 0.00 0.00 23.12 22.60 2b8e s ALA 535 CO -0.00 0.49 0.23 0.50 0.00 0.00 0.00 175.76 176.98 2b8e s ARG 536 N -1.49 0.20 -1.53 0.00 3.52 0.47 -0.64 118.95 119.48 2b8e s ARG 536 Ca 0.11 0.47 -0.04 0.00 -0.13 0.00 0.00 55.73 56.15 2b8e s ARG 536 Cb -0.10 -0.09 0.00 0.00 -1.56 0.00 0.00 34.95 33.21 2b8e s ARG 536 CO 0.03 -0.14 0.47 0.09 -0.81 0.00 0.00 175.30 174.95 2b8e n ASN 537 N 4.01 -5.90 -0.29 -2.12 5.03 -1.25 -2.16 115.26 112.59 2b8e n ASN 537 Ca -0.23 -0.23 -0.04 0.00 0.87 0.00 0.00 54.58 54.95 2b8e n ASN 537 Cb 0.54 -4.75 -0.02 0.00 -1.02 0.00 0.00 39.78 34.53 2b8e n ASN 537 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2b8e n GLY 538 N -1.41 0.66 3.08 7.41 0.00 -1.26 -5.02 105.19 108.65 2b8e n GLY 538 Ca -0.13 -0.47 -0.11 0.00 0.00 0.00 0.00 46.02 45.31 2b8e n GLY 538 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2b8e s ARG 539 N -1.76 0.58 0.06 1.61 1.70 -0.92 -4.53 118.95 115.69 2b8e s ARG 539 Ca 0.00 -0.92 -0.31 0.00 -0.47 0.00 0.00 55.73 54.03 2b8e s ARG 539 Cb 0.00 -0.18 -0.06 0.00 -0.57 0.00 0.00 34.95 34.14 2b8e s ARG 539 CO 0.00 0.01 1.31 0.08 -1.08 0.00 0.00 175.30 175.62 2b8e s VAL 540 N -2.14 3.74 -0.17 4.99 1.01 -1.26 -0.39 120.40 126.17 2b8e s VAL 540 Ca -0.04 1.21 0.04 0.00 0.00 0.00 0.00 61.98 63.19 2b8e s VAL 540 Cb -0.05 -3.78 -0.22 0.00 0.00 0.00 0.00 36.38 32.33 2b8e s VAL 540 CO -0.02 0.07 0.16 -0.62 0.00 0.00 0.00 175.10 174.69 2b8e n GLU 541 N 4.36 0.69 -3.50 2.72 -0.58 0.26 -4.73 120.64 119.85 2b8e n GLU 541 Ca 0.11 0.18 0.00 0.00 -0.42 0.00 0.00 57.16 57.03 2b8e n GLU 541 Cb 0.44 -1.62 0.00 0.00 -0.57 0.00 0.00 31.44 29.69 2b8e n GLU 541 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2b8e n GLY 542 N 1.97 -1.38 3.28 0.62 0.00 -1.16 -0.00 105.19 108.51 2b8e n GLY 542 Ca -0.34 -1.03 -0.27 0.00 0.00 0.00 0.00 46.02 44.38 2b8e n GLY 542 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b8e s ILE 543 N -2.91 1.80 -0.08 -0.61 1.01 0.15 -1.38 121.20 119.18 2b8e s ILE 543 Ca 0.00 -1.26 0.02 0.00 0.00 0.00 0.00 60.65 59.40 2b8e s ILE 543 Cb 0.00 -1.56 0.02 0.00 0.01 0.00 0.00 42.46 40.93 2b8e s ILE 543 CO 0.00 0.24 -0.11 -0.63 0.00 0.00 0.00 174.94 174.44 2b8e s ILE 544 N -0.81 1.09 -0.07 2.92 1.01 -0.61 -0.07 121.20 124.65 2b8e s ILE 544 Ca 0.09 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.33 2b8e s ILE 544 Cb -0.09 -1.03 -0.03 0.00 0.01 0.00 0.00 42.46 41.32 2b8e s ILE 544 CO 0.02 0.35 -0.11 0.00 0.00 0.00 0.00 174.94 175.20 2b8e s ALA 545 N 0.95 2.77 -0.00 9.38 0.00 -0.75 -0.69 121.76 133.41 2b8e s ALA 545 Ca -0.09 -0.93 0.08 0.00 0.00 0.00 0.00 51.96 51.02 2b8e s ALA 545 Cb -0.15 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 2b8e s ALA 545 CO 0.00 0.50 -0.25 0.08 0.00 0.00 0.00 175.76 176.09 2b8e s VAL 546 N -0.54 2.14 0.15 0.00 1.01 0.83 -1.13 120.40 122.86 2b8e s VAL 546 Ca 0.08 -1.17 0.10 0.00 0.00 0.00 0.00 61.98 60.98 2b8e s VAL 546 Cb -0.12 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 2b8e s VAL 546 CO 0.02 0.52 -0.22 -0.55 0.00 0.00 0.00 175.10 174.86 2b8e s SER 547 N -0.81 2.94 -0.47 3.32 0.15 -0.07 -1.13 113.70 117.63 2b8e s SER 547 Ca 0.11 -0.80 0.03 0.00 0.70 0.00 0.00 55.95 55.99 2b8e s SER 547 Cb -0.10 -0.19 0.16 0.00 -1.71 0.00 0.00 66.02 64.18 2b8e s SER 547 CO 0.00 0.07 0.34 -0.62 1.20 0.00 0.00 173.24 174.23 2b8e s ASP 548 N -2.37 2.73 -0.03 5.45 3.68 -1.26 -1.16 116.67 123.71 2b8e s ASP 548 Ca 0.14 -3.05 -0.40 0.00 2.13 0.00 0.00 52.55 51.37 2b8e s ASP 548 Cb -0.08 -0.79 -0.20 0.00 -1.45 0.00 0.00 42.92 40.40 2b8e s ASP 548 CO 0.07 -0.19 1.13 0.35 0.13 0.00 0.00 175.17 176.67 2b8e n THR 549 N 2.93 0.00 -1.93 1.71 -2.24 -1.26 -4.63 114.28 108.85 2b8e n THR 549 Ca 0.22 -0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.62 2b8e n THR 549 Cb 0.41 -0.12 0.03 0.00 -2.10 0.00 0.00 70.33 68.56 2b8e n THR 549 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2b8e s LEU 550 N 0.27 3.79 0.58 3.22 1.43 -1.26 -1.71 118.68 125.00 2b8e s LEU 550 Ca 0.91 2.56 -0.19 0.00 -1.03 0.00 0.00 54.13 56.38 2b8e s LEU 550 Cb -1.25 -4.41 -0.04 0.00 0.03 0.00 0.00 46.19 40.52 2b8e s LEU 550 CO 0.58 -1.52 1.18 -0.54 0.23 0.00 0.00 176.35 176.28 2b8e s LYS 551 N -3.05 3.09 0.37 1.70 1.02 0.11 -4.70 119.74 118.27 2b8e s LYS 551 Ca 0.73 1.74 0.08 0.00 0.02 0.00 0.00 55.97 58.54 2b8e s LYS 551 Cb -0.35 -1.95 0.71 0.00 -0.52 0.00 0.00 37.83 35.71 2b8e s LYS 551 CO 0.40 -1.09 1.89 1.05 -0.92 0.00 0.00 175.35 176.68 2b8e h GLU 552 N 0.96 0.33 0.00 1.68 -0.00 -1.93 -1.89 114.58 113.72 2b8e h GLU 552 Ca -0.50 -0.08 0.00 0.00 -0.00 0.00 0.00 59.36 58.78 2b8e h GLU 552 Cb 1.28 -0.04 0.00 0.00 -0.00 0.00 0.00 28.75 29.99 2b8e h GLU 552 CO 0.56 0.45 0.00 -1.13 -0.00 0.00 0.00 179.01 178.88 2b8e n SER 553 N -4.26 0.00 0.48 3.06 3.41 -1.26 -4.24 113.62 110.81 2b8e n SER 553 Ca -0.00 -0.62 -0.20 0.00 -0.26 0.00 0.00 58.87 57.79 2b8e n SER 553 Cb 0.27 -0.11 -0.09 0.00 -0.26 0.00 0.00 64.21 64.02 2b8e n SER 553 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b8e h ALA 554 N 3.68 -1.32 0.14 7.33 0.00 -1.64 -2.02 119.26 125.43 2b8e h ALA 554 Ca 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2b8e h ALA 554 Cb 0.11 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2b8e h ALA 554 CO 0.00 -1.24 -0.07 -0.22 0.00 0.00 0.00 179.25 177.72 2b8e h LYS 555 N -1.25 -0.18 -0.46 0.00 3.64 -1.78 -2.28 116.57 114.26 2b8e h LYS 555 Ca -0.12 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.33 2b8e h LYS 555 Cb 0.97 0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 32.78 2b8e h LYS 555 CO 0.18 -0.08 0.14 -1.00 -2.27 0.00 0.00 179.45 176.41 2b8e h PRO 556 N -0.23 0.29 -0.40 1.90 0.13 -1.79 -1.15 132.00 130.74 2b8e h PRO 556 Ca -0.02 -0.02 0.02 0.00 -0.87 0.00 0.00 66.00 65.12 2b8e h PRO 556 Cb 0.18 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.22 2b8e h PRO 556 CO 0.03 0.19 0.27 0.00 -0.23 0.00 0.00 178.00 178.26 2b8e h ALA 557 N 1.32 1.80 -0.07 -0.56 0.00 -1.29 -2.46 119.26 117.99 2b8e h ALA 557 Ca 0.22 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 2b8e h ALA 557 Cb 0.24 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2b8e h ALA 557 CO -0.24 0.16 -0.09 0.28 0.00 0.00 0.00 179.25 179.36 2b8e h VAL 558 N 0.47 1.38 0.16 0.00 2.07 -0.65 -3.10 116.25 116.58 2b8e h VAL 558 Ca 0.16 -1.28 0.02 0.00 0.82 0.00 0.00 66.70 66.41 2b8e h VAL 558 Cb 0.06 2.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.86 2b8e h VAL 558 CO -0.04 0.36 -0.36 1.56 0.02 0.00 0.00 177.57 179.11 2b8e h GLN 559 N -0.26 -0.59 -0.49 1.57 4.20 -0.90 -2.27 115.11 116.36 2b8e h GLN 559 Ca 0.01 0.04 0.10 0.00 0.06 0.00 0.00 58.65 58.86 2b8e h GLN 559 Cb 0.62 0.14 -0.10 0.00 0.30 0.00 0.00 27.48 28.43 2b8e h GLN 559 CO 0.02 -0.40 -0.18 1.49 -0.67 0.00 0.00 178.83 179.09 2b8e h GLU 560 N -0.62 -0.07 -0.29 1.46 4.22 -1.55 -0.45 114.58 117.28 2b8e h GLU 560 Ca 0.02 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 59.46 2b8e h GLU 560 Cb 0.63 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2b8e h GLU 560 CO -0.19 -0.05 0.16 -0.07 -2.18 0.00 0.00 179.01 176.68 2b8e h LEU 561 N -0.07 0.35 -0.28 1.64 3.38 -1.44 -2.25 115.31 116.63 2b8e h LEU 561 Ca 0.23 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 2b8e h LEU 561 Cb 0.43 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 2b8e h LEU 561 CO -0.54 0.29 -0.20 0.11 0.09 0.00 0.00 178.44 178.18 2b8e h LYS 562 N 0.40 0.64 -2.35 1.13 1.57 -0.53 -2.04 116.57 115.38 2b8e h LYS 562 Ca 0.11 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2b8e h LYS 562 Cb 0.02 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2b8e h LYS 562 CO -0.02 0.90 0.16 0.54 -0.57 0.00 0.00 179.45 180.46 2b8e n ARG 563 N -4.36 0.00 0.00 3.15 5.12 -0.52 -4.03 116.66 116.03 2b8e n ARG 563 Ca -0.04 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.88 2b8e n ARG 563 Cb 0.41 -1.41 0.00 0.00 -1.16 0.00 0.00 32.46 30.30 2b8e n ARG 563 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2b8e n GLY 565 N 2.24 1.00 3.69 -0.13 0.00 -1.17 -5.12 105.19 105.71 2b8e n GLY 565 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2b8e n GLY 565 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b8e s ILE 566 N 0.00 4.89 0.37 -0.61 1.01 -0.78 -4.93 121.20 121.15 2b8e s ILE 566 Ca 0.00 1.77 -0.27 0.00 0.00 0.00 0.00 60.65 62.15 2b8e s ILE 566 Cb 0.00 -4.19 -0.09 0.00 0.01 0.00 0.00 42.46 38.18 2b8e s ILE 566 CO 0.00 0.10 1.23 -0.54 0.00 0.00 0.00 174.94 175.73 2b8e s LYS 567 N 1.57 4.20 -0.12 2.79 1.02 -0.52 -3.85 119.74 124.83 2b8e s LYS 567 Ca 0.43 2.01 0.01 0.00 0.02 0.00 0.00 55.97 58.45 2b8e s LYS 567 Cb -0.18 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.27 2b8e s LYS 567 CO 0.18 -0.25 -0.15 0.08 -0.92 0.00 0.00 175.35 174.29 2b8e s VAL 568 N -1.27 1.54 0.00 3.17 1.01 -1.26 0.84 120.40 124.44 2b8e s VAL 568 Ca 0.53 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2b8e s VAL 568 Cb -0.35 -1.42 0.00 0.00 0.00 0.00 0.00 36.38 34.61 2b8e s VAL 568 CO 0.45 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.61 2b8e n GLY 569 N 4.42 5.43 3.64 4.51 0.00 -0.04 0.14 105.19 123.28 2b8e n GLY 569 Ca -0.18 -1.21 -0.07 0.00 0.00 0.00 0.00 46.02 44.56 2b8e n GLY 569 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b8e s ILE 571 N 1.28 0.00 0.09 -0.61 1.01 -0.75 -0.96 121.20 121.25 2b8e s ILE 571 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 60.65 60.56 2b8e s ILE 571 Cb 0.00 -1.00 0.00 0.00 0.01 0.00 0.00 42.46 41.47 2b8e s ILE 571 CO 0.00 0.00 0.20 0.28 0.00 0.00 0.00 174.94 175.42 2b8e s THR 572 N 1.50 0.14 -1.06 2.92 -1.32 -0.57 -1.84 115.64 115.41 2b8e s THR 572 Ca -0.09 -1.12 0.24 0.00 -1.21 0.00 0.00 61.69 59.51 2b8e s THR 572 Cb -0.05 -1.30 -0.04 0.00 -1.51 0.00 0.00 72.50 69.61 2b8e s THR 572 CO -0.18 -0.62 1.29 0.61 -2.21 0.00 0.00 174.62 173.52 2b8e n GLY 573 N -0.01 -1.14 3.69 6.08 0.00 -1.25 -0.93 105.19 111.63 2b8e n GLY 573 Ca -0.15 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 2b8e n GLY 573 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b8e s ASP 574 N -2.97 3.09 0.62 1.61 1.11 -1.26 -3.65 116.67 115.22 2b8e s ASP 574 Ca 0.11 1.45 -0.18 0.00 0.18 0.00 0.00 52.55 54.11 2b8e s ASP 574 Cb 0.17 -2.12 -0.02 0.00 1.07 0.00 0.00 42.92 42.02 2b8e s ASP 574 CO 0.73 -2.87 1.22 0.54 1.18 0.00 0.00 175.17 175.97 2b8e s ASN 575 N -3.34 4.94 0.15 0.27 2.20 -1.26 -0.39 114.94 117.52 2b8e s ASN 575 Ca 0.64 2.42 -0.17 0.00 -0.94 0.00 0.00 52.86 54.81 2b8e s ASN 575 Cb -0.19 -2.60 0.07 0.00 -2.00 0.00 0.00 41.25 36.53 2b8e s ASN 575 CO 0.58 -1.76 1.72 -0.50 -2.94 0.00 0.00 177.10 174.19 2b8e h TRP 576 N 0.64 0.04 -0.92 1.54 4.06 -1.94 0.11 115.95 119.47 2b8e h TRP 576 Ca -0.50 0.02 0.13 0.00 2.06 0.00 0.00 58.89 60.60 2b8e h TRP 576 Cb 1.30 0.03 -0.09 0.00 -1.00 0.00 0.00 29.16 29.41 2b8e h TRP 576 CO 0.46 -0.03 0.54 0.00 -3.56 0.00 0.00 178.44 175.85 2b8e h ARG 577 N 0.14 0.81 -0.25 0.49 3.08 -1.92 0.67 114.38 117.40 2b8e h ARG 577 Ca 0.16 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.04 2b8e h ARG 577 Cb 0.21 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 2b8e h ARG 577 CO -0.25 0.53 -0.33 1.03 -1.07 0.00 0.00 179.97 179.89 2b8e h SER 578 N 0.83 0.72 -0.62 7.04 0.87 -1.34 -2.37 113.55 118.67 2b8e h SER 578 Ca 0.47 -0.50 -0.05 0.00 -1.23 0.00 0.00 61.79 60.48 2b8e h SER 578 Cb 0.54 -0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 62.27 2b8e h SER 578 CO -0.30 1.08 0.19 0.00 -0.53 0.00 0.00 176.83 177.27 2b8e h ALA 579 N 0.66 0.82 0.24 6.23 0.00 0.28 -1.90 119.26 125.59 2b8e h ALA 579 Ca 0.03 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 2b8e h ALA 579 Cb 0.91 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2b8e h ALA 579 CO 0.08 0.49 -0.20 1.49 0.00 0.00 0.00 179.25 181.11 2b8e h GLU 580 N 0.90 -0.44 -0.52 0.00 4.57 0.35 0.17 114.58 119.61 2b8e h GLU 580 Ca 0.20 0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.51 2b8e h GLU 580 Cb 0.30 0.10 -0.09 0.00 -0.16 0.00 0.00 28.75 28.90 2b8e h GLU 580 CO -0.01 -0.29 -0.04 0.00 -1.18 0.00 0.00 179.01 177.50 2b8e h ALA 581 N 0.26 0.46 -0.85 2.92 0.00 -1.28 0.79 119.26 121.56 2b8e h ALA 581 Ca -0.01 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2b8e h ALA 581 Cb 0.41 0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.46 2b8e h ALA 581 CO -0.02 -0.41 0.55 0.82 0.00 0.00 0.00 179.25 180.19 2b8e h ILE 582 N 0.08 1.16 -0.51 0.00 1.08 -0.90 -2.01 117.51 116.42 2b8e h ILE 582 Ca 0.26 -0.37 -0.01 0.00 -0.39 0.00 0.00 64.86 64.35 2b8e h ILE 582 Cb 0.41 -0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.11 2b8e h ILE 582 CO -0.47 0.20 0.26 -1.28 -0.69 0.00 0.00 178.15 176.17 2b8e h SER 583 N 1.09 0.62 0.93 1.72 0.87 0.16 -1.81 113.55 117.13 2b8e h SER 583 Ca 0.33 -0.05 -0.08 0.00 -1.23 0.00 0.00 61.79 60.76 2b8e h SER 583 Cb -0.04 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 2b8e h SER 583 CO -0.10 0.52 -0.38 0.03 -0.53 0.00 0.00 176.83 176.37 2b8e h ARG 584 N 0.70 0.00 0.16 2.24 3.08 -0.32 0.13 114.38 120.37 2b8e h ARG 584 Ca 0.18 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.91 2b8e h ARG 584 Cb 0.05 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.11 2b8e h ARG 584 CO -0.03 0.38 -1.53 1.49 -1.07 0.00 0.00 179.97 179.21 2b8e h GLU 585 N 0.00 0.34 -0.65 0.04 4.81 -1.16 -3.32 114.58 114.64 2b8e h GLU 585 Ca -0.00 -0.57 0.00 0.00 -0.13 0.00 0.00 59.36 58.65 2b8e h GLU 585 Cb 0.94 0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.54 2b8e h GLU 585 CO 0.05 1.23 0.00 1.28 -0.73 0.00 0.00 179.01 180.84 2b8e n LEU 586 N -3.54 3.93 -3.98 1.64 4.77 -0.72 -4.94 117.00 114.15 2b8e n LEU 586 Ca -0.17 -1.97 -0.26 0.00 -0.03 0.00 0.00 56.01 53.58 2b8e n LEU 586 Cb 1.06 -0.50 -0.08 0.00 -2.33 0.00 0.00 43.42 41.57 2b8e n LEU 586 CO 0.53 0.79 -0.38 0.59 -1.33 0.00 0.00 177.39 177.59 2b8e n ASN 587 N 1.17 0.64 -4.78 -1.43 3.02 -0.03 -4.84 115.26 109.01 2b8e n ASN 587 Ca 0.22 -1.04 -0.34 0.00 -0.03 0.00 0.00 54.58 53.39 2b8e n ASN 587 Cb 0.69 -1.29 0.02 0.00 -0.61 0.00 0.00 39.78 38.58 2b8e n ASN 587 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2b8e s LEU 588 N -6.59 3.59 0.14 3.41 1.43 -0.83 -4.96 118.68 114.86 2b8e s LEU 588 Ca 0.01 2.03 0.21 0.00 -1.03 0.00 0.00 54.13 55.36 2b8e s LEU 588 Cb -0.01 -4.56 -0.08 0.00 0.03 0.00 0.00 46.19 41.57 2b8e s LEU 588 CO 0.81 -1.31 0.90 0.47 0.23 0.00 0.00 176.35 177.46 2b8e n ASP 589 N -1.77 0.71 -3.84 2.29 8.00 0.12 -4.92 116.55 117.14 2b8e n ASP 589 Ca 0.10 0.28 -0.12 0.00 0.71 0.00 0.00 54.79 55.77 2b8e n ASP 589 Cb 0.52 0.64 -0.11 0.00 -0.02 0.00 0.00 41.12 42.15 2b8e n ASP 589 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2b8e s LEU 590 N -5.31 1.43 -0.10 0.64 2.96 -1.07 -4.98 118.68 112.26 2b8e s LEU 590 Ca -0.02 0.10 -0.04 0.00 -0.22 0.00 0.00 54.13 53.96 2b8e s LEU 590 Cb 0.10 0.63 0.05 0.00 0.50 0.00 0.00 46.19 47.47 2b8e s LEU 590 CO 0.81 -0.20 0.18 -0.69 -1.32 0.00 0.00 176.35 175.14 2b8e s VAL 591 N -0.56 -0.30 -0.34 1.68 1.01 -1.26 -4.20 120.40 116.44 2b8e s VAL 591 Ca -0.06 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.28 2b8e s VAL 591 Cb -0.04 -0.33 0.10 0.00 0.00 0.00 0.00 36.38 36.11 2b8e s VAL 591 CO 0.01 0.14 0.05 -0.63 0.00 0.00 0.00 175.10 174.67 2b8e s ILE 592 N 2.32 2.12 0.47 2.22 1.09 -1.26 -5.06 121.20 123.11 2b8e s ILE 592 Ca 0.03 -2.24 0.08 0.00 -1.10 0.00 0.00 60.65 57.42 2b8e s ILE 592 Cb -0.12 -2.57 0.03 0.00 -1.06 0.00 0.00 42.46 38.73 2b8e s ILE 592 CO -0.06 -0.60 0.58 0.00 -0.10 0.00 0.00 174.94 174.75 2b8e s ALA 593 N 0.98 4.48 -1.52 9.38 0.00 -1.26 -1.50 121.76 132.32 2b8e s ALA 593 Ca 0.11 -1.81 -0.13 0.00 0.00 0.00 0.00 51.96 50.12 2b8e s ALA 593 Cb -0.19 -1.39 0.08 0.00 0.00 0.00 0.00 23.12 21.62 2b8e s ALA 593 CO -0.10 -0.44 1.00 0.39 0.00 0.00 0.00 175.76 176.62 2b8e n GLU 594 N -1.89 -5.78 -3.50 0.00 1.02 0.48 -4.88 120.64 106.09 2b8e n GLU 594 Ca 0.08 0.62 -0.38 0.00 -0.02 0.00 0.00 57.16 57.47 2b8e n GLU 594 Cb 0.61 -5.54 -0.09 0.00 -0.02 0.00 0.00 31.44 26.41 2b8e n GLU 594 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2b8e s VAL 595 N -3.29 5.26 0.53 2.62 1.01 -0.11 -4.92 120.40 121.50 2b8e s VAL 595 Ca 0.66 0.47 -0.20 0.00 0.00 0.00 0.00 61.98 62.91 2b8e s VAL 595 Cb -0.33 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.37 2b8e s VAL 595 CO 0.81 0.28 1.16 -0.76 0.00 0.00 0.00 175.10 176.60 2b8e s LEU 596 N 1.28 3.81 0.42 3.92 2.01 -1.26 -3.82 118.68 125.04 2b8e s LEU 596 Ca 0.14 2.27 0.22 0.00 0.01 0.00 0.00 54.13 56.77 2b8e s LEU 596 Cb -0.14 -4.48 1.19 0.00 0.01 0.00 0.00 46.19 42.76 2b8e s LEU 596 CO 0.07 -1.22 1.78 1.55 1.01 0.00 0.00 176.35 179.53 2b8e h PRO 597 N 1.37 0.31 0.00 1.29 0.13 -1.98 0.46 132.00 133.57 2b8e h PRO 597 Ca -0.50 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2b8e h PRO 597 Cb 1.27 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2b8e h PRO 597 CO 0.57 0.20 -0.19 0.45 -0.23 0.00 0.00 178.00 178.81 2b8e h HIS 598 N 0.31 0.00 0.00 1.56 3.86 -1.97 -3.24 115.15 115.67 2b8e h HIS 598 Ca 0.59 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.74 2b8e h HIS 598 Cb 1.65 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 30.11 2b8e h HIS 598 CO -0.00 0.00 -0.30 1.96 0.86 0.00 0.00 177.93 180.45 2b8e h GLN 599 N 0.00 0.00 -0.53 2.45 4.20 -0.45 -3.36 115.11 117.42 2b8e h GLN 599 Ca 0.00 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.82 2b8e h GLN 599 Cb 0.93 0.00 -0.10 0.00 0.30 0.00 0.00 27.48 28.62 2b8e h GLN 599 CO 0.00 0.29 -0.07 0.87 -0.67 0.00 0.00 178.83 179.25 2b8e h LYS 600 N 0.00 0.05 -0.38 1.46 1.57 -1.47 0.17 116.57 117.96 2b8e h LYS 600 Ca -0.00 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.80 2b8e h LYS 600 Cb 1.23 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.50 2b8e h LYS 600 CO 0.04 0.03 0.20 0.77 -0.57 0.00 0.00 179.45 179.92 2b8e h SER 601 N 0.05 0.30 -0.24 0.86 0.02 -1.80 -1.03 113.55 111.71 2b8e h SER 601 Ca 0.26 0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 2b8e h SER 601 Cb 0.41 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2b8e h SER 601 CO -0.50 0.22 0.13 1.05 -1.14 0.00 0.00 176.83 176.59 2b8e h GLU 602 N 0.41 0.33 -0.29 3.45 9.09 -1.45 -1.21 114.58 124.90 2b8e h GLU 602 Ca 0.16 -0.04 0.02 0.00 0.05 0.00 0.00 59.36 59.56 2b8e h GLU 602 Cb 0.06 -0.07 -0.02 0.00 -1.65 0.00 0.00 28.75 27.07 2b8e h GLU 602 CO -0.10 0.29 0.20 0.93 0.05 0.00 0.00 179.01 180.37 2b8e h GLU 603 N 0.28 0.31 0.18 1.06 4.39 -0.43 -0.89 114.58 119.48 2b8e h GLU 603 Ca 0.08 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 2b8e h GLU 603 Cb 0.05 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 2b8e h GLU 603 CO -0.01 0.20 -0.09 0.28 -1.16 0.00 0.00 179.01 178.23 2b8e h VAL 604 N 0.32 0.94 -0.16 3.13 2.07 -0.61 -2.82 116.25 119.12 2b8e h VAL 604 Ca 0.12 -0.81 0.05 0.00 0.82 0.00 0.00 66.70 66.87 2b8e h VAL 604 Cb 0.08 1.40 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 2b8e h VAL 604 CO -0.03 0.18 0.19 0.11 0.02 0.00 0.00 177.57 178.04 2b8e h LYS 605 N -0.66 0.00 -0.24 1.57 6.56 -0.68 0.57 116.57 123.69 2b8e h LYS 605 Ca -0.02 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.40 2b8e h LYS 605 Cb 0.48 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.13 2b8e h LYS 605 CO 0.04 0.00 -0.52 -0.22 -2.06 0.00 0.00 179.45 176.69 2b8e h LYS 606 N 0.00 0.70 -0.00 3.15 3.64 -0.99 -3.02 116.57 120.05 2b8e h LYS 606 Ca 0.08 -0.43 -0.17 0.00 -1.27 0.00 0.00 60.65 58.86 2b8e h LYS 606 Cb 0.45 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 2b8e h LYS 606 CO -0.00 1.05 -0.79 -0.07 -2.27 0.00 0.00 179.45 177.36 2b8e h LEU 607 N 0.54 0.03 0.00 5.20 3.38 -0.70 -3.00 115.31 120.76 2b8e h LEU 607 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2b8e h LEU 607 Cb 1.09 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.83 2b8e h LEU 607 CO 0.11 0.81 0.00 0.00 0.09 0.00 0.00 178.44 179.45 2b8e n GLN 608 N -3.61 0.17 -0.60 1.13 6.02 -0.40 -0.33 117.38 119.76 2b8e n GLN 608 Ca -0.01 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.07 2b8e n GLN 608 Cb 0.76 -1.50 0.34 0.00 1.02 0.00 0.00 30.24 30.87 2b8e n GLN 608 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b8e n ALA 609 N -1.00 3.09 0.14 -1.58 0.00 -1.13 -4.60 120.51 115.43 2b8e n ALA 609 Ca 0.04 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.82 2b8e n ALA 609 Cb 0.02 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.51 2b8e n ALA 609 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2b8e n LYS 610 N 0.92 0.00 -4.41 0.00 0.00 0.55 -5.14 118.16 110.09 2b8e n LYS 610 Ca 0.25 0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 58.32 2b8e n LYS 610 Cb 0.89 0.00 -0.09 0.00 -0.00 0.00 0.00 35.03 35.83 2b8e n LYS 610 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2b8e s GLU 611 N -2.00 1.93 -0.51 -1.58 2.56 -0.34 -5.08 118.70 113.68 2b8e s GLU 611 Ca 0.00 -1.69 -0.23 0.00 0.00 0.00 0.00 54.97 53.05 2b8e s GLU 611 Cb 0.00 -1.90 0.04 0.00 2.00 0.00 0.00 34.13 34.27 2b8e s GLU 611 CO 0.00 0.29 0.84 0.08 -0.56 0.00 0.00 175.26 175.91 2b8e s VAL 612 N -2.47 4.55 0.10 3.70 1.01 -1.26 -4.00 120.40 122.03 2b8e s VAL 612 Ca 0.31 0.23 -0.18 0.00 0.00 0.00 0.00 61.98 62.35 2b8e s VAL 612 Cb -0.04 -4.43 -0.07 0.00 0.00 0.00 0.00 36.38 31.85 2b8e s VAL 612 CO 0.17 -0.93 0.57 0.54 0.00 0.00 0.00 175.10 175.46 2b8e s VAL 613 N 3.53 4.76 -0.25 2.92 0.11 -1.26 -0.54 120.40 129.68 2b8e s VAL 613 Ca 0.28 1.11 -0.01 0.00 -2.93 0.00 0.00 61.98 60.43 2b8e s VAL 613 Cb -0.13 -3.85 0.03 0.00 -1.53 0.00 0.00 36.38 30.90 2b8e s VAL 613 CO 0.20 0.44 -0.08 0.00 -3.33 0.00 0.00 175.10 172.32 2b8e s ALA 614 N -1.24 2.64 -0.25 1.54 0.00 0.12 -2.66 121.76 121.91 2b8e s ALA 614 Ca 0.32 -1.50 -0.12 0.00 0.00 0.00 0.00 51.96 50.67 2b8e s ALA 614 Cb -0.18 -1.63 -0.05 0.00 0.00 0.00 0.00 23.12 21.26 2b8e s ALA 614 CO 0.19 -0.85 0.21 0.12 0.00 0.00 0.00 175.76 175.43 2b8e s PHE 615 N 1.28 3.29 -0.33 0.00 5.36 -0.63 -1.46 117.98 125.50 2b8e s PHE 615 Ca -0.01 0.25 -0.08 0.00 -0.96 0.00 0.00 56.93 56.12 2b8e s PHE 615 Cb -0.17 -2.35 0.02 0.00 -0.34 0.00 0.00 43.02 40.17 2b8e s PHE 615 CO -0.05 -0.03 0.13 0.08 -1.46 0.00 0.00 175.22 173.88 2b8e s VAL 616 N 1.38 4.20 0.24 3.12 1.01 -0.18 -1.38 120.40 128.78 2b8e s VAL 616 Ca 0.09 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2b8e s VAL 616 Cb -0.15 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.98 2b8e s VAL 616 CO 0.07 -0.05 0.08 0.61 0.00 0.00 0.00 175.10 175.81 2b8e n GLY 617 N 4.91 3.62 0.61 4.51 0.00 0.33 0.21 105.19 119.38 2b8e n GLY 617 Ca -0.13 -2.05 0.04 0.00 0.00 0.00 0.00 46.02 43.88 2b8e n GLY 617 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2b8e n ASP 618 N -1.71 1.74 0.00 1.61 3.85 -1.26 -0.88 116.55 119.90 2b8e n ASP 618 Ca -0.04 -2.06 0.00 0.00 -0.71 0.00 0.00 54.79 51.98 2b8e n ASP 618 Cb 0.35 -0.25 0.00 0.00 -1.35 0.00 0.00 41.12 39.87 2b8e n ASP 618 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2b8e n GLY 619 N 0.84 1.41 0.00 6.12 0.00 -1.26 -4.63 105.19 107.67 2b8e n GLY 619 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2b8e n GLY 619 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2b8e n ILE 620 N 0.00 0.00 -0.44 -0.61 -5.35 -1.26 -3.77 119.36 107.93 2b8e n ILE 620 Ca 0.00 0.42 0.39 0.00 -0.27 0.00 0.00 62.75 63.29 2b8e n ILE 620 Cb 0.00 -1.37 0.73 0.00 -1.74 0.00 0.00 39.64 37.26 2b8e n ILE 620 CO 0.00 0.00 0.00 0.78 -1.76 0.00 0.00 176.55 175.57 2b8e h ASN 621 N 0.00 0.08 -0.58 7.28 4.21 -2.01 -1.11 115.58 123.45 2b8e h ASN 621 Ca 0.00 0.03 -0.42 0.00 1.21 0.00 0.00 56.30 57.11 2b8e h ASN 621 Cb 0.00 0.02 -0.33 0.00 -1.12 0.00 0.00 38.32 36.89 2b8e h ASN 621 CO 0.00 -0.01 -0.72 -0.90 -1.29 0.00 0.00 177.43 174.51 2b8e n ASP 622 N -4.24 4.21 0.06 5.81 3.85 -1.26 -4.87 116.55 120.11 2b8e n ASP 622 Ca 0.32 -3.79 -0.12 0.00 -0.71 0.00 0.00 54.79 50.49 2b8e n ASP 622 Cb 1.42 -0.39 -0.06 0.00 -1.35 0.00 0.00 41.12 40.74 2b8e n ASP 622 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2b8e h ALA 623 N 1.90 -0.54 -0.95 2.12 0.00 -1.29 -2.41 119.26 118.10 2b8e h ALA 623 Ca 0.29 -0.03 0.23 0.00 0.00 0.00 0.00 54.91 55.41 2b8e h ALA 623 Cb 1.41 0.63 -0.07 0.00 0.00 0.00 0.00 17.79 19.77 2b8e h ALA 623 CO 0.60 -0.88 0.63 -1.00 0.00 0.00 0.00 179.25 178.60 2b8e h PRO 624 N -0.51 0.31 -0.02 0.00 0.13 -1.89 0.23 132.00 130.25 2b8e h PRO 624 Ca 0.06 -0.02 -0.17 0.00 -0.87 0.00 0.00 66.00 65.00 2b8e h PRO 624 Cb 0.60 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.64 2b8e h PRO 624 CO -0.29 0.21 -0.76 0.00 -0.23 0.00 0.00 178.00 176.93 2b8e h ALA 625 N 1.59 0.68 -0.29 -0.56 0.00 -1.81 -0.50 119.26 118.38 2b8e h ALA 625 Ca 0.50 -0.65 -0.12 0.00 0.00 0.00 0.00 54.91 54.63 2b8e h ALA 625 Cb 1.38 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 2b8e h ALA 625 CO -0.17 0.86 -0.30 -0.07 0.00 0.00 0.00 179.25 179.57 2b8e h LEU 626 N 0.11 0.76 -0.85 0.00 4.07 -0.18 -2.45 115.31 116.78 2b8e h LEU 626 Ca -0.02 -0.47 -0.12 0.00 0.08 0.00 0.00 57.88 57.35 2b8e h LEU 626 Cb 1.34 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.85 2b8e h LEU 626 CO 0.11 1.08 -0.40 0.00 -1.08 0.00 0.00 178.44 178.15 2b8e h ALA 627 N 0.70 1.02 -0.39 1.53 0.00 -0.88 -3.20 119.26 118.04 2b8e h ALA 627 Ca 0.04 -0.42 -0.14 0.00 0.00 0.00 0.00 54.91 54.40 2b8e h ALA 627 Cb 0.87 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2b8e h ALA 627 CO 0.07 0.61 -0.30 0.37 0.00 0.00 0.00 179.25 180.00 2b8e h GLN 628 N 0.30 0.85 -7.22 0.00 5.75 -0.99 -3.45 115.11 110.35 2b8e h GLN 628 Ca 0.03 -0.40 -0.51 0.00 -0.15 0.00 0.00 58.65 57.62 2b8e h GLN 628 Cb 0.84 -0.01 0.12 0.00 1.07 0.00 0.00 27.48 29.50 2b8e h GLN 628 CO 0.07 1.04 0.36 0.00 -2.65 0.00 0.00 178.83 177.64 2b8e s ALA 629 N -4.49 2.31 0.12 3.38 0.00 -0.93 -4.91 121.76 117.24 2b8e s ALA 629 Ca -0.10 0.56 -0.20 0.00 0.00 0.00 0.00 51.96 52.22 2b8e s ALA 629 Cb 0.12 -3.35 -0.06 0.00 0.00 0.00 0.00 23.12 19.83 2b8e s ALA 629 CO 0.86 -1.55 1.74 -0.44 0.00 0.00 0.00 175.76 176.37 2b8e h ASP 630 N -0.33 0.03 -3.34 0.00 3.32 -1.84 -3.39 116.42 110.87 2b8e h ASP 630 Ca -0.46 0.02 -0.67 0.00 0.02 0.00 0.00 57.03 55.94 2b8e h ASP 630 Cb 1.25 0.02 -0.35 0.00 0.22 0.00 0.00 39.33 40.48 2b8e h ASP 630 CO 0.52 0.04 -0.82 -0.22 -1.72 0.00 0.00 179.24 177.04 2b8e s LEU 631 N -10.26 2.65 -0.27 1.55 2.96 -1.09 -4.71 118.68 109.50 2b8e s LEU 631 Ca -0.13 -0.85 -0.10 0.00 -0.22 0.00 0.00 54.13 52.83 2b8e s LEU 631 Cb 0.09 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 45.19 2b8e s LEU 631 CO 0.68 -0.07 0.17 -0.83 -1.32 0.00 0.00 176.35 174.98 2b8e s GLY 632 N 1.26 1.90 -0.13 7.98 0.00 -1.25 -1.60 107.32 115.48 2b8e s GLY 632 Ca 0.01 -1.09 0.01 0.00 0.00 0.00 0.00 44.72 43.65 2b8e s GLY 632 CO -0.09 0.62 -0.14 -0.42 0.00 0.00 0.00 173.10 173.06 2b8e s ILE 633 N 1.70 1.51 0.10 0.90 1.01 -0.48 -0.23 121.20 125.71 2b8e s ILE 633 Ca 0.07 -0.62 0.03 0.00 0.00 0.00 0.00 60.65 60.14 2b8e s ILE 633 Cb -0.16 -1.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 2b8e s ILE 633 CO 0.09 0.45 0.11 0.00 0.00 0.00 0.00 174.94 175.59 2b8e s ALA 634 N 1.28 3.60 0.03 9.38 0.00 -0.07 -0.51 121.76 135.47 2b8e s ALA 634 Ca -0.00 -1.06 0.02 0.00 0.00 0.00 0.00 51.96 50.92 2b8e s ALA 634 Cb -0.14 -1.45 -0.02 0.00 0.00 0.00 0.00 23.12 21.52 2b8e s ALA 634 CO -0.07 0.68 -0.07 0.08 0.00 0.00 0.00 175.76 176.38 2b8e s VAL 635 N -1.50 0.53 0.00 0.00 1.01 -0.05 -0.98 120.40 119.40 2b8e s VAL 635 Ca 0.30 -0.81 0.00 0.00 0.00 0.00 0.00 61.98 61.47 2b8e s VAL 635 Cb -0.12 -0.55 0.00 0.00 0.00 0.00 0.00 36.38 35.72 2b8e s VAL 635 CO 0.23 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.73 2b8e n GLY 636 N 1.94 1.76 3.57 4.51 0.00 -0.22 -4.51 105.19 112.25 2b8e n GLY 636 Ca -0.19 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.32 2b8e n GLY 636 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2b8e n ASP 647 N 0.00 1.19 -3.96 1.61 -0.08 -1.24 -4.49 116.55 109.58 2b8e n ASP 647 Ca 0.00 1.14 -0.15 0.00 -1.51 0.00 0.00 54.79 54.27 2b8e n ASP 647 Cb 0.00 -1.17 -0.14 0.00 2.34 0.00 0.00 41.12 42.15 2b8e n ASP 647 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2b8e s ILE 648 N -0.02 0.37 -0.15 5.18 1.01 0.68 -4.95 121.20 123.31 2b8e s ILE 648 Ca 0.78 -0.29 0.02 0.00 0.00 0.00 0.00 60.65 61.15 2b8e s ILE 648 Cb -0.92 -0.33 0.01 0.00 0.01 0.00 0.00 42.46 41.23 2b8e s ILE 648 CO 0.51 0.04 -0.21 -0.69 0.00 0.00 0.00 174.94 174.59 2b8e s VAL 649 N -0.26 2.06 -0.32 2.92 1.01 -1.26 -0.89 120.40 123.66 2b8e s VAL 649 Ca 0.00 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 2b8e s VAL 649 Cb -0.03 -1.83 0.06 0.00 0.00 0.00 0.00 36.38 34.58 2b8e s VAL 649 CO -0.00 0.55 0.04 -0.76 0.00 0.00 0.00 175.10 174.92 2b8e s LEU 650 N 0.96 4.19 0.14 3.92 1.43 -0.16 -4.98 118.68 124.18 2b8e s LEU 650 Ca -0.03 -1.46 -0.18 0.00 -1.03 0.00 0.00 54.13 51.42 2b8e s LEU 650 Cb -0.15 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.35 2b8e s LEU 650 CO -0.05 -0.32 1.73 0.40 0.23 0.00 0.00 176.35 178.34 2b8e h ILE 651 N 6.46 0.86 -3.89 -0.59 5.03 -1.86 -0.55 117.51 122.97 2b8e h ILE 651 Ca -0.19 -0.04 -0.52 0.00 -0.12 0.00 0.00 64.86 63.99 2b8e h ILE 651 Cb 1.06 0.72 0.07 0.00 -3.03 0.00 0.00 36.82 35.63 2b8e h ILE 651 CO 0.56 0.02 0.62 -0.60 -0.68 0.00 0.00 178.15 178.08 2b8e s ARG 652 N -6.18 4.30 0.00 2.37 3.52 -1.26 -3.01 118.95 118.68 2b8e s ARG 652 Ca -0.13 2.18 0.29 0.00 -0.13 0.00 0.00 55.73 57.94 2b8e s ARG 652 Cb 0.11 -3.01 1.21 0.00 -1.56 0.00 0.00 34.95 31.69 2b8e s ARG 652 CO 0.69 -0.23 1.88 -0.40 -0.81 0.00 0.00 175.30 176.44 2b8e n ASP 653 N 0.68 0.14 -4.63 -2.12 3.85 -1.26 -3.96 116.55 109.25 2b8e n ASP 653 Ca 0.01 0.08 -0.43 0.00 -0.71 0.00 0.00 54.79 53.74 2b8e n ASP 653 Cb 0.42 -0.28 -0.03 0.00 -1.35 0.00 0.00 41.12 39.88 2b8e n ASP 653 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2b8e s ASP 654 N -2.82 6.17 0.61 -1.12 3.68 -1.26 -4.84 116.67 117.09 2b8e s ASP 654 Ca 0.19 1.93 0.41 0.00 2.13 0.00 0.00 52.55 57.21 2b8e s ASP 654 Cb 0.19 -2.53 2.20 0.00 -1.45 0.00 0.00 42.92 41.34 2b8e s ASP 654 CO 0.53 -1.38 2.24 -0.07 0.13 0.00 0.00 175.17 176.62 2b8e h LEU 655 N 12.27 0.00 -1.76 -1.34 3.38 -1.86 -1.75 115.31 124.24 2b8e h LEU 655 Ca -0.39 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.62 2b8e h LEU 655 Cb 1.19 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.92 2b8e h LEU 655 CO 0.98 0.00 0.24 0.03 0.09 0.00 0.00 178.44 179.78 2b8e h ARG 656 N 0.00 0.29 -0.89 1.13 3.08 -1.88 0.69 114.38 116.80 2b8e h ARG 656 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2b8e h ARG 656 Cb 0.01 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 2b8e h ARG 656 CO 0.00 0.20 0.57 -0.44 -1.07 0.00 0.00 179.97 179.23 2b8e h ASP 657 N 0.30 1.05 -0.38 7.04 5.19 -1.68 0.28 116.42 128.22 2b8e h ASP 657 Ca 0.15 -0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.51 2b8e h ASP 657 Cb 0.23 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.46 2b8e h ASP 657 CO -0.03 0.78 0.21 0.58 -3.12 0.00 0.00 179.24 177.66 2b8e h VAL 658 N 1.22 1.14 -0.18 -1.35 2.07 -1.04 -0.12 116.25 117.99 2b8e h VAL 658 Ca 0.32 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 2b8e h VAL 658 Cb -0.10 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 2b8e h VAL 658 CO -0.07 0.14 0.08 0.58 0.02 0.00 0.00 177.57 178.32 2b8e h VAL 659 N 0.48 1.15 -0.78 2.57 2.07 -0.75 -2.29 116.25 118.71 2b8e h VAL 659 Ca 0.13 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2b8e h VAL 659 Cb 0.05 1.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 2b8e h VAL 659 CO -0.02 0.14 0.49 0.00 0.02 0.00 0.00 177.57 178.20 2b8e h ALA 660 N 0.93 1.40 -0.49 1.67 0.00 -0.24 -1.84 119.26 120.69 2b8e h ALA 660 Ca 0.06 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 2b8e h ALA 660 Cb 0.15 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2b8e h ALA 660 CO -0.01 0.53 -0.10 0.00 0.00 0.00 0.00 179.25 179.68 2b8e h ALA 661 N 1.48 0.89 -0.47 0.00 0.00 -0.84 -2.83 119.26 117.49 2b8e h ALA 661 Ca 0.28 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2b8e h ALA 661 Cb -0.08 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 2b8e h ALA 661 CO -0.06 0.64 -0.12 0.82 0.00 0.00 0.00 179.25 180.53 2b8e h ILE 662 N 0.81 1.26 0.00 0.00 2.04 -0.87 -2.13 117.51 118.63 2b8e h ILE 662 Ca 0.13 -1.22 0.00 0.00 1.00 0.00 0.00 64.86 64.77 2b8e h ILE 662 Cb 0.62 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2b8e h ILE 662 CO 0.04 0.42 0.00 0.00 0.00 0.00 0.00 178.15 178.61 2b8e n GLN 663 N -4.15 0.24 -3.51 2.37 6.02 -0.74 -4.69 117.38 112.91 2b8e n GLN 663 Ca 0.01 0.00 -0.24 0.00 -0.01 0.00 0.00 57.00 56.76 2b8e n GLN 663 Cb 0.38 -1.23 0.05 0.00 1.02 0.00 0.00 30.24 30.47 2b8e n GLN 663 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 2b8e n LEU 664 N 0.59 -3.94 0.00 1.08 4.77 -0.81 -5.06 117.00 113.62 2b8e n LEU 664 Ca 0.00 -0.86 0.00 0.00 -0.03 0.00 0.00 56.01 55.12 2b8e n LEU 664 Cb 0.08 -2.68 0.00 0.00 -2.33 0.00 0.00 43.42 38.49 2b8e n LEU 664 CO 0.00 0.25 0.00 -1.54 -1.33 0.00 0.00 177.39 174.77