#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fzp s ILE 420 N 0.00 3.82 0.01 -0.61 -5.25 -1.26 -5.00 121.20 112.90 3fzp s ILE 420 Ca 0.00 -0.42 0.04 0.00 -0.99 0.00 0.00 60.65 59.28 3fzp s ILE 420 Cb 0.00 -2.60 -0.03 0.00 2.95 0.00 0.00 42.46 42.78 3fzp s ILE 420 CO 0.00 0.57 -0.09 0.00 -1.79 0.00 0.00 174.94 173.63 3fzp s ALA 421 N -0.43 2.95 0.57 2.27 0.00 -1.26 -4.81 121.76 121.04 3fzp s ALA 421 Ca 0.07 -1.04 0.36 0.00 0.00 0.00 0.00 51.96 51.35 3fzp s ALA 421 Cb -0.12 -1.07 1.47 0.00 0.00 0.00 0.00 23.12 23.40 3fzp s ALA 421 CO 0.02 0.61 1.70 -0.09 0.00 0.00 0.00 175.76 177.99 3fzp h ARG 422 N 4.56 0.00 0.00 0.00 9.65 -1.99 0.46 114.38 127.07 3fzp h ARG 422 Ca -0.48 0.00 -0.08 0.00 -1.10 0.00 0.00 59.98 58.32 3fzp h ARG 422 Cb 1.17 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.73 3fzp h ARG 422 CO 0.53 0.00 -0.38 1.49 2.80 0.00 0.00 179.97 184.40 3fzp h GLU 423 N 0.00 0.00 0.00 0.20 4.81 -2.01 -2.65 114.58 114.93 3fzp h GLU 423 Ca 0.56 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.79 3fzp h GLU 423 Cb 2.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.85 3fzp h GLU 423 CO -0.01 0.38 0.00 -0.25 -0.73 0.00 0.00 179.01 178.41 3fzp n ASP 424 N -3.95 0.00 -4.01 1.04 8.00 0.16 -4.70 116.55 113.09 3fzp n ASP 424 Ca -0.02 -0.12 -0.29 0.00 0.71 0.00 0.00 54.79 55.07 3fzp n ASP 424 Cb 0.43 -0.29 -0.17 0.00 -0.02 0.00 0.00 41.12 41.08 3fzp n ASP 424 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3fzp s VAL 425 N -2.57 1.48 -0.09 2.53 1.01 -1.00 -0.06 120.40 121.70 3fzp s VAL 425 Ca 0.27 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.68 3fzp s VAL 425 Cb 0.19 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 3fzp s VAL 425 CO 0.44 0.44 -0.16 -0.69 0.00 0.00 0.00 175.10 175.13 3fzp s VAL 426 N 1.39 2.83 -0.16 2.92 1.01 -0.93 -4.96 120.40 122.50 3fzp s VAL 426 Ca 0.02 -0.77 -0.17 0.00 0.00 0.00 0.00 61.98 61.06 3fzp s VAL 426 Cb -0.13 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.08 3fzp s VAL 426 CO -0.08 0.56 0.43 -0.76 0.00 0.00 0.00 175.10 175.25 3fzp s LEU 427 N -0.15 4.22 -0.16 3.92 1.43 -1.26 -1.18 118.68 125.51 3fzp s LEU 427 Ca -0.02 0.66 0.01 0.00 -1.03 0.00 0.00 54.13 53.75 3fzp s LEU 427 Cb -0.14 -2.59 -0.10 0.00 0.03 0.00 0.00 46.19 43.39 3fzp s LEU 427 CO 0.04 -0.03 -0.14 0.59 0.23 0.00 0.00 176.35 177.04 3fzp n ASN 428 N 4.02 2.74 -3.86 2.29 3.02 0.17 -4.96 115.26 118.69 3fzp n ASN 428 Ca -0.08 -0.08 -0.09 0.00 -0.03 0.00 0.00 54.58 54.31 3fzp n ASN 428 Cb 0.51 -0.25 -0.04 0.00 -0.61 0.00 0.00 39.78 39.39 3fzp n ASN 428 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3fzp s ARG 429 N -2.31 1.67 0.35 3.52 1.70 -1.11 -5.01 118.95 117.75 3fzp s ARG 429 Ca -0.21 -1.24 -0.27 0.00 -0.47 0.00 0.00 55.73 53.54 3fzp s ARG 429 Cb 0.05 0.51 -0.09 0.00 -0.57 0.00 0.00 34.95 34.85 3fzp s ARG 429 CO 0.36 -0.72 1.19 0.42 -1.08 0.00 0.00 175.30 175.47 3fzp s ILE 430 N -3.83 3.12 -0.22 4.99 1.01 -1.26 -0.14 121.20 124.86 3fzp s ILE 430 Ca 0.20 1.03 -0.03 0.00 0.00 0.00 0.00 60.65 61.85 3fzp s ILE 430 Cb -0.02 -3.62 -0.13 0.00 0.01 0.00 0.00 42.46 38.70 3fzp s ILE 430 CO 0.09 0.18 -0.23 0.18 0.00 0.00 0.00 174.94 175.16 3fzp n LEU 431 N 0.54 2.47 0.00 2.97 4.77 0.14 -4.54 117.00 123.35 3fzp n LEU 431 Ca 0.02 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 3fzp n LEU 431 Cb 0.45 -0.73 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 3fzp n LEU 431 CO 0.54 0.72 0.00 0.61 -1.33 0.00 0.00 177.39 177.93 3fzp n GLY 432 N 2.11 2.61 3.64 -0.72 0.00 -0.60 -4.97 105.19 107.26 3fzp n GLY 432 Ca -0.41 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 3fzp n GLY 432 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fzp s GLU 433 N -2.00 4.06 0.57 1.61 0.41 -1.26 0.94 118.70 123.02 3fzp s GLU 433 Ca 0.00 1.31 0.03 0.00 -0.41 0.00 0.00 54.97 55.90 3fzp s GLU 433 Cb 0.00 -3.80 0.05 0.00 -1.78 0.00 0.00 34.13 28.60 3fzp s GLU 433 CO 0.00 -0.93 0.79 0.20 -0.49 0.00 0.00 175.26 174.83 3fzp s GLY 434 N 2.19 1.83 0.13 -1.39 0.00 0.12 -4.92 107.32 105.27 3fzp s GLY 434 Ca 0.52 -1.53 -0.26 0.00 0.00 0.00 0.00 44.72 43.46 3fzp s GLY 434 CO 0.18 -1.19 1.63 -2.75 0.00 0.00 0.00 173.10 170.97 3fzp h PHE 435 N 0.05 -0.75 0.00 1.90 -0.00 -1.97 -1.02 116.94 115.16 3fzp h PHE 435 Ca -0.40 0.03 0.00 0.00 -0.00 0.00 0.00 57.97 57.60 3fzp h PHE 435 Cb 1.29 0.34 0.00 0.00 -0.00 0.00 0.00 35.95 37.58 3fzp h PHE 435 CO 0.27 -0.37 0.00 1.19 -0.00 0.00 0.00 178.31 179.41 3fzp n PHE 436 N -5.39 0.00 -0.65 0.41 3.01 -1.26 -5.01 117.46 108.57 3fzp n PHE 436 Ca -0.04 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.42 3fzp n PHE 436 Cb 0.30 -0.45 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 3fzp n PHE 436 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fzp n GLY 437 N 1.21 -2.15 3.77 1.37 0.00 -0.39 0.61 105.19 109.61 3fzp n GLY 437 Ca 0.08 -1.40 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 3fzp n GLY 437 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3fzp s GLU 438 N -1.89 4.35 -0.11 1.61 2.56 -1.26 0.11 118.70 124.07 3fzp s GLU 438 Ca 0.00 1.79 -0.01 0.00 0.00 0.00 0.00 54.97 56.75 3fzp s GLU 438 Cb 0.00 -2.90 -0.03 0.00 2.00 0.00 0.00 34.13 33.20 3fzp s GLU 438 CO 0.00 -0.05 -0.06 0.08 -0.56 0.00 0.00 175.26 174.67 3fzp s VAL 439 N -1.33 3.76 0.21 3.70 1.01 0.27 -2.19 120.40 125.83 3fzp s VAL 439 Ca 0.51 -0.43 0.11 0.00 0.00 0.00 0.00 61.98 62.17 3fzp s VAL 439 Cb -0.30 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.44 3fzp s VAL 439 CO 0.39 0.55 -0.22 -0.31 0.00 0.00 0.00 175.10 175.50 3fzp s TYR 440 N -0.21 2.23 -0.06 5.22 1.51 -0.65 0.25 117.35 125.65 3fzp s TYR 440 Ca 0.03 -0.37 -0.15 0.00 -1.01 0.00 0.00 57.07 55.58 3fzp s TYR 440 Cb -0.13 -1.07 -0.05 0.00 -0.11 0.00 0.00 41.96 40.60 3fzp s TYR 440 CO 0.03 0.53 0.38 -2.00 -1.11 0.00 0.00 175.55 173.38 3fzp s GLU 441 N -2.90 4.03 0.05 -0.62 2.12 0.81 0.27 118.70 122.46 3fzp s GLU 441 Ca 0.22 0.32 -0.00 0.00 0.36 0.00 0.00 54.97 55.87 3fzp s GLU 441 Cb -0.07 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 31.02 3fzp s GLU 441 CO 0.11 0.51 0.07 0.41 -0.54 0.00 0.00 175.26 175.82 3fzp n GLY 442 N 2.40 2.95 2.91 -1.50 0.00 -0.35 0.46 105.19 112.07 3fzp n GLY 442 Ca -0.13 -1.40 -0.25 0.00 0.00 0.00 0.00 46.02 44.25 3fzp n GLY 442 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3fzp s VAL 443 N -2.50 0.89 -0.10 1.61 1.01 -0.33 -1.44 120.40 119.54 3fzp s VAL 443 Ca 0.04 -0.25 -0.11 0.00 0.00 0.00 0.00 61.98 61.66 3fzp s VAL 443 Cb -0.00 -0.90 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 3fzp s VAL 443 CO 0.03 0.33 0.25 -0.47 0.00 0.00 0.00 175.10 175.24 3fzp s TYR 444 N 1.40 3.58 -0.24 5.22 5.04 0.19 -2.18 117.35 130.36 3fzp s TYR 444 Ca -0.02 0.66 -0.06 0.00 -2.44 0.00 0.00 57.07 55.22 3fzp s TYR 444 Cb -0.13 -2.16 -0.02 0.00 0.35 0.00 0.00 41.96 39.99 3fzp s TYR 444 CO -0.04 0.54 0.02 0.99 -1.34 0.00 0.00 175.55 175.73 3fzp s THR 445 N -0.54 3.93 1.02 4.34 2.01 0.91 0.97 115.64 128.29 3fzp s THR 445 Ca 0.17 -0.31 -0.22 0.00 0.31 0.00 0.00 61.69 61.65 3fzp s THR 445 Cb -0.13 -2.82 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 3fzp s THR 445 CO 0.06 0.37 -0.69 0.59 -0.69 0.00 0.00 174.62 174.26 3fzp n ASN 446 N 4.87 -2.69 0.24 3.53 3.02 0.31 -4.83 115.26 119.72 3fzp n ASN 446 Ca -0.17 -0.09 0.13 0.00 -0.03 0.00 0.00 54.58 54.42 3fzp n ASN 446 Cb 0.51 -0.70 0.50 0.00 -0.61 0.00 0.00 39.78 39.48 3fzp n ASN 446 CO 0.00 0.00 0.00 1.12 -2.62 0.00 0.00 177.26 175.76 3fzp h HIS 447 N -1.64 0.00 -0.63 3.10 2.07 -1.94 -2.95 115.15 113.15 3fzp h HIS 447 Ca -0.42 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.10 3fzp h HIS 447 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 3fzp h HIS 447 CO -0.37 0.11 0.00 1.63 -3.07 0.00 0.00 177.93 176.23 3fzp n LYS 448 N -3.22 2.69 -0.95 5.12 5.02 -1.26 -4.95 118.16 120.61 3fzp n LYS 448 Ca 0.01 -2.36 0.00 0.00 -2.02 0.00 0.00 58.31 53.94 3fzp n LYS 448 Cb 0.40 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 3fzp n LYS 448 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fzp n GLY 449 N 1.42 0.58 3.74 0.72 0.00 -1.11 -5.01 105.19 105.53 3fzp n GLY 449 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.83 3fzp n GLY 449 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fzp s GLU 450 N -0.32 4.44 -0.36 1.61 2.02 -1.26 -4.68 118.70 120.15 3fzp s GLU 450 Ca 0.00 1.97 -0.19 0.00 0.02 0.00 0.00 54.97 56.78 3fzp s GLU 450 Cb 0.00 -3.21 0.00 0.00 0.10 0.00 0.00 34.13 31.02 3fzp s GLU 450 CO 0.00 -0.17 0.56 0.15 0.02 0.00 0.00 175.26 175.82 3fzp s LYS 451 N -0.26 3.60 -0.20 1.61 1.02 -1.26 -0.53 119.74 123.73 3fzp s LYS 451 Ca 0.54 -0.12 -0.06 0.00 0.02 0.00 0.00 55.97 56.35 3fzp s LYS 451 Cb -0.35 -3.82 -0.03 0.00 -0.52 0.00 0.00 37.83 33.11 3fzp s LYS 451 CO 0.38 -0.70 0.03 0.42 -0.92 0.00 0.00 175.35 174.56 3fzp s ILE 452 N 2.51 4.28 -0.03 2.17 -1.09 0.27 -4.93 121.20 124.39 3fzp s ILE 452 Ca 0.20 -0.20 -0.30 0.00 -2.23 0.00 0.00 60.65 58.12 3fzp s ILE 452 Cb -0.15 -2.94 -0.05 0.00 -1.58 0.00 0.00 42.46 37.75 3fzp s ILE 452 CO 0.14 0.43 1.33 0.20 -1.23 0.00 0.00 174.94 175.81 3fzp s ASN 453 N 0.81 6.92 0.16 3.58 0.01 -1.26 0.54 114.94 125.69 3fzp s ASN 453 Ca 0.02 2.00 0.05 0.00 -0.71 0.00 0.00 52.86 54.21 3fzp s ASN 453 Cb -0.14 -2.56 -0.04 0.00 0.41 0.00 0.00 41.25 38.92 3fzp s ASN 453 CO 0.02 -0.68 -0.11 0.68 -1.51 0.00 0.00 177.10 175.51 3fzp s VAL 454 N 2.39 1.25 -0.12 1.60 -7.23 -0.52 -2.39 120.40 115.37 3fzp s VAL 454 Ca 0.61 -2.08 -0.04 0.00 -1.81 0.00 0.00 61.98 58.65 3fzp s VAL 454 Cb -0.29 -1.88 -0.04 0.00 0.56 0.00 0.00 36.38 34.74 3fzp s VAL 454 CO 0.25 -0.72 0.03 0.00 -0.31 0.00 0.00 175.10 174.34 3fzp s ALA 455 N -3.28 3.37 -0.28 1.32 0.00 0.04 -1.21 121.76 121.73 3fzp s ALA 455 Ca 0.18 -0.77 -0.01 0.00 0.00 0.00 0.00 51.96 51.35 3fzp s ALA 455 Cb 0.02 -1.67 0.04 0.00 0.00 0.00 0.00 23.12 21.51 3fzp s ALA 455 CO 0.01 0.45 -0.03 0.08 0.00 0.00 0.00 175.76 176.27 3fzp s VAL 456 N -0.44 2.90 0.15 0.00 1.01 0.14 -0.68 120.40 123.48 3fzp s VAL 456 Ca 0.09 -1.24 -0.24 0.00 0.00 0.00 0.00 61.98 60.58 3fzp s VAL 456 Cb -0.12 -2.59 -0.08 0.00 0.00 0.00 0.00 36.38 33.59 3fzp s VAL 456 CO 0.02 0.03 0.74 -0.54 0.00 0.00 0.00 175.10 175.35 3fzp s LYS 457 N 1.28 4.51 0.08 2.72 1.02 0.25 -1.64 119.74 127.95 3fzp s LYS 457 Ca -0.03 1.08 0.08 0.00 0.02 0.00 0.00 55.97 57.13 3fzp s LYS 457 Cb -0.18 -3.26 -0.03 0.00 -0.52 0.00 0.00 37.83 33.83 3fzp s LYS 457 CO -0.03 0.57 -0.22 0.99 -0.92 0.00 0.00 175.35 175.75 3fzp s THR 458 N -1.10 1.80 -0.20 2.17 2.01 -0.93 -0.82 115.64 118.57 3fzp s THR 458 Ca 0.35 -1.44 -0.03 0.00 0.31 0.00 0.00 61.69 60.88 3fzp s THR 458 Cb -0.22 -1.60 -0.01 0.00 0.01 0.00 0.00 72.50 70.68 3fzp s THR 458 CO 0.25 0.09 -0.06 0.00 -0.69 0.00 0.00 174.62 174.20 3fzp n LYS 460 N 4.54 1.88 -0.56 0.00 5.02 0.20 -4.79 118.16 124.45 3fzp n LYS 460 Ca -0.18 0.69 -0.21 0.00 -2.02 0.00 0.00 58.31 56.58 3fzp n LYS 460 Cb 0.51 -2.48 -0.06 0.00 -0.02 0.00 0.00 35.03 32.98 3fzp n LYS 460 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3fzp n LYS 461 N 5.91 0.00 0.00 1.97 5.02 -1.26 -4.41 118.16 125.39 3fzp n LYS 461 Ca 0.23 -0.55 0.00 0.00 -2.02 0.00 0.00 58.31 55.97 3fzp n LYS 461 Cb 0.25 -1.87 0.00 0.00 -0.02 0.00 0.00 35.03 33.39 3fzp n LYS 461 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3fzp n ASP 462 N 6.25 0.00 -3.24 4.39 8.00 -1.26 -4.98 116.55 125.70 3fzp n ASP 462 Ca 0.22 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.62 3fzp n ASP 462 Cb 0.27 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.34 3fzp n ASP 462 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fzp n THR 464 N 5.04 0.00 -0.22 0.00 -2.24 -1.26 -1.70 114.28 113.90 3fzp n THR 464 Ca 0.11 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.90 3fzp n THR 464 Cb 0.11 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.47 3fzp n THR 464 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3fzp h LEU 465 N 0.00 0.29 0.07 3.22 4.07 -1.99 -3.33 115.31 117.64 3fzp h LEU 465 Ca 0.00 0.08 -0.00 0.00 0.08 0.00 0.00 57.88 58.04 3fzp h LEU 465 Cb 0.00 0.04 0.00 0.00 1.08 0.00 0.00 40.66 41.79 3fzp h LEU 465 CO 0.00 0.16 -0.03 -0.78 -1.08 0.00 0.00 178.44 176.71 3fzp h ASP 466 N 0.46 -0.07 1.03 -0.43 3.58 -1.72 0.65 116.42 119.91 3fzp h ASP 466 Ca 0.33 -0.42 -0.13 0.00 0.42 0.00 0.00 57.03 57.23 3fzp h ASP 466 Cb 0.41 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.46 3fzp h ASP 466 CO -0.31 0.40 -0.63 0.78 -2.88 0.00 0.00 179.24 176.60 3fzp h ASN 467 N -0.58 0.00 0.72 2.28 -0.26 -1.76 -1.95 115.58 114.04 3fzp h ASN 467 Ca -0.01 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.55 3fzp h ASN 467 Cb 0.49 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.73 3fzp h ASN 467 CO 0.01 0.63 -0.83 0.50 -1.06 0.00 0.00 177.43 176.69 3fzp h LYS 468 N 0.00 0.07 -0.09 0.81 3.64 -1.64 -0.97 116.57 118.39 3fzp h LYS 468 Ca -0.01 -0.08 -0.04 0.00 -1.27 0.00 0.00 60.65 59.26 3fzp h LYS 468 Cb 1.32 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 33.16 3fzp h LYS 468 CO 0.08 0.86 -0.08 1.05 -2.27 0.00 0.00 179.45 179.08 3fzp h GLU 469 N 0.04 0.22 -0.17 1.90 4.11 0.32 -2.83 114.58 118.17 3fzp h GLU 469 Ca -0.02 -0.11 0.01 0.00 0.07 0.00 0.00 59.36 59.30 3fzp h GLU 469 Cb 1.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 3fzp h GLU 469 CO 0.11 0.63 0.11 0.87 0.07 0.00 0.00 179.01 180.81 3fzp h LYS 470 N -0.19 0.20 -0.05 1.06 1.79 -1.21 0.02 116.57 118.18 3fzp h LYS 470 Ca 0.02 -0.01 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3fzp h LYS 470 Cb 0.59 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.19 3fzp h LYS 470 CO 0.02 0.13 0.02 0.35 -1.08 0.00 0.00 179.45 178.89 3fzp h PHE 471 N 0.20 0.08 -0.20 -1.35 3.57 -1.17 -1.80 116.94 116.28 3fzp h PHE 471 Ca 0.06 -0.01 -0.21 0.00 3.53 0.00 0.00 57.97 61.35 3fzp h PHE 471 Cb 0.01 -0.03 0.01 0.00 2.79 0.00 0.00 35.95 38.73 3fzp h PHE 471 CO -0.00 0.22 -0.71 0.52 -2.23 0.00 0.00 178.31 176.11 3fzp h MET 472 N -0.07 0.83 -0.14 1.11 2.86 -1.17 -2.45 114.93 115.89 3fzp h MET 472 Ca 0.02 -0.63 -0.05 0.00 -2.06 0.00 0.00 59.70 56.98 3fzp h MET 472 Cb 0.17 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 3fzp h MET 472 CO -0.00 1.24 -0.13 1.03 1.06 0.00 0.00 176.91 180.11 3fzp h SER 473 N 0.58 0.21 0.23 1.22 0.87 -1.02 -1.63 113.55 114.02 3fzp h SER 473 Ca -0.03 -0.04 -0.27 0.00 -1.23 0.00 0.00 61.79 60.22 3fzp h SER 473 Cb 1.33 -0.06 0.02 0.00 -0.44 0.00 0.00 62.40 63.25 3fzp h SER 473 CO 0.15 0.37 -1.12 -0.08 -0.53 0.00 0.00 176.83 175.63 3fzp h GLU 474 N 0.22 0.53 -0.90 2.24 4.81 -1.19 -2.91 114.58 117.38 3fzp h GLU 474 Ca 0.04 -0.66 0.12 0.00 -0.13 0.00 0.00 59.36 58.74 3fzp h GLU 474 Cb 0.37 0.21 -0.08 0.00 0.63 0.00 0.00 28.75 29.88 3fzp h GLU 474 CO 0.02 1.27 0.53 0.00 -0.73 0.00 0.00 179.01 180.10 3fzp h ALA 475 N 0.48 1.35 -0.05 2.92 0.00 -1.11 -1.66 119.26 121.18 3fzp h ALA 475 Ca -0.14 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.62 3fzp h ALA 475 Cb 1.78 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.45 3fzp h ALA 475 CO 0.21 0.10 -0.70 0.28 0.00 0.00 0.00 179.25 179.13 3fzp h VAL 476 N 0.83 1.35 -0.24 0.00 2.07 -1.25 0.20 116.25 119.21 3fzp h VAL 476 Ca 0.46 -2.03 0.06 0.00 0.82 0.00 0.00 66.70 66.01 3fzp h VAL 476 Cb 0.49 2.33 -0.07 0.00 -1.52 0.00 0.00 31.29 32.52 3fzp h VAL 476 CO -0.28 0.61 -0.29 0.40 0.02 0.00 0.00 177.57 178.03 3fzp h ILE 477 N 0.18 0.31 -0.09 4.57 2.04 -1.47 0.20 117.51 123.24 3fzp h ILE 477 Ca -0.07 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 3fzp h ILE 477 Cb 1.37 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 3fzp h ILE 477 CO 0.14 0.00 -0.13 0.24 0.00 0.00 0.00 178.15 178.40 3fzp h MET 478 N -0.30 0.15 -0.69 2.37 2.86 -0.99 0.86 114.93 119.19 3fzp h MET 478 Ca 0.13 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.69 3fzp h MET 478 Cb 0.51 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 32.12 3fzp h MET 478 CO -0.41 0.28 0.21 -0.22 1.06 0.00 0.00 176.91 177.83 3fzp h LYS 479 N 0.14 1.06 -0.00 1.72 3.64 -0.06 -1.48 116.57 121.60 3fzp h LYS 479 Ca 0.03 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 3fzp h LYS 479 Cb 0.32 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 3fzp h LYS 479 CO 0.02 0.91 -0.07 0.09 -2.27 0.00 0.00 179.45 178.13 3fzp n ASN 480 N -4.26 0.08 -4.73 4.20 3.02 0.13 -4.77 115.26 108.93 3fzp n ASN 480 Ca 0.06 0.32 -0.41 0.00 -0.03 0.00 0.00 54.58 54.52 3fzp n ASN 480 Cb 0.22 -0.38 -0.04 0.00 -0.61 0.00 0.00 39.78 38.98 3fzp n ASN 480 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fzp s LEU 481 N -2.95 4.44 -0.32 3.41 1.43 -0.22 -5.00 118.68 119.47 3fzp s LEU 481 Ca 0.15 1.64 -0.00 0.00 -1.03 0.00 0.00 54.13 54.89 3fzp s LEU 481 Cb 0.19 -3.47 0.13 0.00 0.03 0.00 0.00 46.19 43.07 3fzp s LEU 481 CO 0.54 -0.10 0.27 -0.62 0.23 0.00 0.00 176.35 176.67 3fzp s ASP 482 N 0.31 2.18 0.03 2.29 -1.08 -1.26 -4.83 116.67 114.31 3fzp s ASP 482 Ca 0.46 -1.37 0.06 0.00 -0.52 0.00 0.00 52.55 51.18 3fzp s ASP 482 Cb -0.22 0.17 -0.02 0.00 -1.46 0.00 0.00 42.92 41.39 3fzp s ASP 482 CO 0.27 -0.35 -0.17 -2.28 0.52 0.00 0.00 175.17 173.17 3fzp s HIS 483 N 1.81 1.45 -0.43 -5.34 2.46 -1.26 -5.03 115.29 108.95 3fzp s HIS 483 Ca 0.13 -0.34 0.14 0.00 0.47 0.00 0.00 55.06 55.46 3fzp s HIS 483 Cb -0.16 -0.88 0.75 0.00 -0.13 0.00 0.00 32.58 32.16 3fzp s HIS 483 CO -0.19 0.04 1.41 -0.35 -2.47 0.00 0.00 174.74 173.17 3fzp n PRO 484 N 2.08 0.09 -0.54 2.88 -0.04 -1.26 -2.20 135.00 136.02 3fzp n PRO 484 Ca -0.17 0.58 0.07 0.00 -0.04 0.00 0.00 63.50 63.94 3fzp n PRO 484 Cb 0.54 -1.83 0.17 0.00 -0.04 0.00 0.00 33.50 32.34 3fzp n PRO 484 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3fzp n HIS 485 N -1.99 0.00 -5.20 0.54 8.25 -1.26 -4.87 115.22 110.69 3fzp n HIS 485 Ca -0.01 -1.24 -0.30 0.00 -0.26 0.00 0.00 57.72 55.91 3fzp n HIS 485 Cb 0.05 -0.21 -0.16 0.00 1.12 0.00 0.00 29.99 30.80 3fzp n HIS 485 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3fzp s ILE 486 N -2.76 2.01 0.24 1.59 1.01 -0.93 -0.29 121.20 122.07 3fzp s ILE 486 Ca 0.35 -1.13 -0.29 0.00 0.00 0.00 0.00 60.65 59.58 3fzp s ILE 486 Cb 0.34 -1.68 -0.15 0.00 0.01 0.00 0.00 42.46 40.97 3fzp s ILE 486 CO -0.05 0.53 0.85 1.33 0.00 0.00 0.00 174.94 177.60 3fzp n VAL 487 N 2.34 1.86 -3.60 2.92 0.24 -0.71 -4.65 118.33 116.73 3fzp n VAL 487 Ca -0.16 -0.47 -0.38 0.00 -2.04 0.00 0.00 64.34 61.30 3fzp n VAL 487 Cb 0.51 -0.61 -0.11 0.00 -1.47 0.00 0.00 33.84 32.16 3fzp n VAL 487 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 3fzp s LYS 488 N -1.23 3.98 -0.15 7.34 2.20 -1.26 -4.96 119.74 125.67 3fzp s LYS 488 Ca 0.62 -0.30 -0.23 0.00 -0.36 0.00 0.00 55.97 55.70 3fzp s LYS 488 Cb -0.81 -3.64 -0.02 0.00 -1.51 0.00 0.00 37.83 31.86 3fzp s LYS 488 CO 0.58 -0.13 0.74 -1.17 -0.36 0.00 0.00 175.35 175.00 3fzp s LEU 489 N 1.62 4.21 -0.24 5.43 0.20 -1.26 -1.11 118.68 127.53 3fzp s LEU 489 Ca 0.07 1.09 -0.15 0.00 0.69 0.00 0.00 54.13 55.83 3fzp s LEU 489 Cb -0.15 -3.09 -0.16 0.00 -0.43 0.00 0.00 46.19 42.35 3fzp s LEU 489 CO 0.10 -0.28 -0.08 -0.38 -0.29 0.00 0.00 176.35 175.42 3fzp n ILE 490 N 4.43 1.55 -3.84 6.68 5.41 0.25 -4.93 119.36 128.91 3fzp n ILE 490 Ca 0.01 -0.28 -0.06 0.00 1.00 0.00 0.00 62.75 63.43 3fzp n ILE 490 Cb 0.50 -1.90 0.01 0.00 -0.71 0.00 0.00 39.64 37.54 3fzp n ILE 490 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3fzp s GLY 491 N -5.34 0.16 -0.07 7.39 0.00 -0.90 -5.01 107.32 103.55 3fzp s GLY 491 Ca -0.34 -0.44 0.02 0.00 0.00 0.00 0.00 44.72 43.97 3fzp s GLY 491 CO 0.56 0.92 -0.13 -0.42 0.00 0.00 0.00 173.10 174.03 3fzp s ILE 492 N -2.47 1.21 -0.42 0.90 1.01 -1.26 -1.03 121.20 119.13 3fzp s ILE 492 Ca 0.18 -0.52 -0.09 0.00 0.00 0.00 0.00 60.65 60.21 3fzp s ILE 492 Cb -0.04 -1.11 0.08 0.00 0.01 0.00 0.00 42.46 41.41 3fzp s ILE 492 CO 0.07 0.37 0.27 -0.63 0.00 0.00 0.00 174.94 175.03 3fzp s ILE 493 N 0.69 4.26 -0.07 2.92 1.01 0.11 -4.80 121.20 125.32 3fzp s ILE 493 Ca -0.14 -1.41 -0.25 0.00 0.00 0.00 0.00 60.65 58.85 3fzp s ILE 493 Cb -0.16 -3.62 -0.26 0.00 0.01 0.00 0.00 42.46 38.43 3fzp s ILE 493 CO 0.04 -0.53 0.93 -0.08 0.00 0.00 0.00 174.94 175.30 3fzp h GLU 494 N 8.42 0.18 -6.19 2.79 4.81 -1.91 0.34 114.58 123.01 3fzp h GLU 494 Ca -0.23 -0.24 -0.68 0.00 -0.13 0.00 0.00 59.36 58.08 3fzp h GLU 494 Cb 1.08 0.08 0.08 0.00 0.63 0.00 0.00 28.75 30.63 3fzp h GLU 494 CO 0.77 1.05 -0.01 0.39 -0.73 0.00 0.00 179.01 180.47 3fzp n GLU 495 N -4.41 0.63 -1.59 1.92 -0.58 -1.26 -4.18 120.64 111.17 3fzp n GLU 495 Ca -0.11 0.22 -0.49 0.00 -0.42 0.00 0.00 57.16 56.36 3fzp n GLU 495 Cb 0.60 -1.57 -0.04 0.00 -0.57 0.00 0.00 31.44 29.85 3fzp n GLU 495 CO 0.00 0.00 0.00 -0.85 -0.48 0.00 0.00 177.13 175.80 3fzp n GLU 496 N 1.39 1.22 -2.92 3.49 0.28 -1.26 -3.12 120.64 119.71 3fzp n GLU 496 Ca 0.16 0.44 -0.41 0.00 -0.16 0.00 0.00 57.16 57.19 3fzp n GLU 496 Cb 0.22 -1.98 -0.04 0.00 1.43 0.00 0.00 31.44 31.07 3fzp n GLU 496 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 3fzp s PRO 497 N -0.15 4.49 0.19 3.44 0.04 -1.26 -5.09 135.00 136.65 3fzp s PRO 497 Ca 0.76 1.08 -0.31 0.00 0.04 0.00 0.00 61.00 62.57 3fzp s PRO 497 Cb -0.86 -3.45 -0.10 0.00 0.04 0.00 0.00 34.50 30.13 3fzp s PRO 497 CO 0.51 0.04 1.54 0.99 0.04 0.00 0.00 177.00 180.12 3fzp s THR 498 N 0.81 2.59 -0.17 1.26 2.01 -1.18 -4.92 115.64 116.04 3fzp s THR 498 Ca 0.43 0.44 0.01 0.00 0.31 0.00 0.00 61.69 62.88 3fzp s THR 498 Cb -0.19 -3.28 0.02 0.00 0.01 0.00 0.00 72.50 69.05 3fzp s THR 498 CO 0.22 0.05 -0.20 0.26 -0.69 0.00 0.00 174.62 174.25 3fzp s TRP 499 N 0.80 2.75 -0.34 4.92 0.52 0.11 -4.07 118.94 123.64 3fzp s TRP 499 Ca 0.67 -1.55 -0.17 0.00 0.02 0.00 0.00 56.10 55.07 3fzp s TRP 499 Cb -0.44 -1.89 -0.01 0.00 -1.15 0.00 0.00 33.47 29.98 3fzp s TRP 499 CO 0.35 -0.75 0.47 0.42 0.02 0.00 0.00 176.95 177.46 3fzp s ILE 500 N 1.16 5.07 -0.40 2.03 1.01 0.00 0.09 121.20 130.16 3fzp s ILE 500 Ca 0.02 0.31 -0.17 0.00 0.00 0.00 0.00 60.65 60.80 3fzp s ILE 500 Cb -0.14 -3.90 0.01 0.00 0.01 0.00 0.00 42.46 38.44 3fzp s ILE 500 CO -0.10 -0.14 0.45 -0.63 0.00 0.00 0.00 174.94 174.52 3fzp s ILE 501 N 2.27 5.07 0.28 2.92 1.01 -0.20 0.85 121.20 133.40 3fzp s ILE 501 Ca 0.17 -0.18 0.08 0.00 0.00 0.00 0.00 60.65 60.72 3fzp s ILE 501 Cb -0.16 -4.01 -0.04 0.00 0.01 0.00 0.00 42.46 38.26 3fzp s ILE 501 CO 0.12 -0.36 0.11 -0.04 0.00 0.00 0.00 174.94 174.77 3fzp s MET 502 N 2.19 2.56 0.43 2.79 -1.94 0.14 0.87 119.30 126.36 3fzp s MET 502 Ca 0.13 -1.30 -0.25 0.00 -1.71 0.00 0.00 55.69 52.57 3fzp s MET 502 Cb -0.17 -2.33 -0.08 0.00 2.01 0.00 0.00 34.83 34.27 3fzp s MET 502 CO 0.14 0.33 1.31 -1.21 -0.01 0.00 0.00 175.02 175.58 3fzp s GLU 503 N -3.78 3.81 -0.04 2.03 2.02 -0.27 -0.78 118.70 121.70 3fzp s GLU 503 Ca 0.33 2.16 -0.19 0.00 0.02 0.00 0.00 54.97 57.29 3fzp s GLU 503 Cb -0.06 -2.65 -0.05 0.00 0.10 0.00 0.00 34.13 31.47 3fzp s GLU 503 CO 0.22 -0.63 0.55 -1.17 0.02 0.00 0.00 175.26 174.25 3fzp s LEU 504 N -2.67 4.38 -0.34 1.80 2.96 -1.01 -4.33 118.68 119.48 3fzp s LEU 504 Ca 0.60 1.05 -0.04 0.00 -0.22 0.00 0.00 54.13 55.52 3fzp s LEU 504 Cb -0.38 -2.83 0.05 0.00 0.50 0.00 0.00 46.19 43.53 3fzp s LEU 504 CO 0.48 0.09 0.08 -0.31 -1.32 0.00 0.00 176.35 175.38 3fzp s TYR 505 N -0.05 3.31 -0.77 5.38 1.51 -1.26 -4.91 117.35 120.56 3fzp s TYR 505 Ca 0.29 -1.75 0.20 0.00 -1.01 0.00 0.00 57.07 54.81 3fzp s TYR 505 Cb -0.17 -2.36 0.82 0.00 -0.11 0.00 0.00 41.96 40.14 3fzp s TYR 505 CO 0.15 -0.80 1.62 -0.35 -1.11 0.00 0.00 175.55 175.06 3fzp n PRO 506 N 4.71 0.10 -0.13 -1.71 -0.04 -1.24 -1.96 135.00 134.73 3fzp n PRO 506 Ca -0.11 0.30 0.11 0.00 -0.04 0.00 0.00 63.50 63.76 3fzp n PRO 506 Cb 0.44 -1.67 0.17 0.00 -0.04 0.00 0.00 33.50 32.39 3fzp n PRO 506 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 3fzp n TYR 507 N -1.85 0.34 -4.55 0.54 4.02 -1.01 -5.08 117.16 109.57 3fzp n TYR 507 Ca 0.03 -0.19 0.00 0.00 -0.01 0.00 0.00 57.90 57.73 3fzp n TYR 507 Cb 0.22 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.54 3fzp n TYR 507 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3fzp n GLY 508 N 1.28 0.11 3.76 2.72 0.00 -0.83 -4.69 105.19 107.54 3fzp n GLY 508 Ca 0.16 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.83 3fzp n GLY 508 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3fzp s GLU 509 N 0.00 4.64 0.20 1.61 2.02 -1.26 -0.45 118.70 125.46 3fzp s GLU 509 Ca 0.00 1.79 -0.11 0.00 0.02 0.00 0.00 54.97 56.67 3fzp s GLU 509 Cb 0.00 -3.18 0.24 0.00 0.10 0.00 0.00 34.13 31.29 3fzp s GLU 509 CO 0.00 0.21 1.74 1.25 0.02 0.00 0.00 175.26 178.48 3fzp h LEU 510 N 3.79 0.15 -0.17 1.80 5.85 -0.84 -0.41 115.31 125.48 3fzp h LEU 510 Ca -0.47 0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.37 3fzp h LEU 510 Cb 1.21 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 42.28 3fzp h LEU 510 CO 0.67 0.10 -0.06 1.23 -0.34 0.00 0.00 178.44 180.03 3fzp h GLY 511 N 0.35 0.09 0.86 3.75 0.00 -1.77 0.16 103.07 106.50 3fzp h GLY 511 Ca 0.28 0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.73 3fzp h GLY 511 CO -0.31 -0.09 0.54 0.45 0.00 0.00 0.00 176.54 177.14 3fzp h HIS 512 N -0.04 1.01 -0.31 5.60 3.86 -1.83 -2.08 115.15 121.37 3fzp h HIS 512 Ca 0.09 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.20 3fzp h HIS 512 Cb 0.17 -0.33 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 3fzp h HIS 512 CO -0.21 0.57 -0.30 -0.92 0.86 0.00 0.00 177.93 177.93 3fzp h TYR 513 N 1.04 0.74 -0.48 2.45 3.20 -0.46 -1.26 116.97 122.20 3fzp h TYR 513 Ca 0.34 -0.18 -0.12 0.00 3.14 0.00 0.00 58.73 61.91 3fzp h TYR 513 Cb 0.03 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 3fzp h TYR 513 CO -0.02 0.87 -0.16 -0.07 -1.64 0.00 0.00 178.16 177.13 3fzp h LEU 514 N 0.55 0.95 -0.23 2.82 3.38 -0.59 -2.30 115.31 119.89 3fzp h LEU 514 Ca 0.07 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 3fzp h LEU 514 Cb 0.79 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 3fzp h LEU 514 CO 0.06 1.10 0.13 -0.33 0.09 0.00 0.00 178.44 179.49 3fzp h GLU 515 N 0.83 0.32 -0.68 1.13 5.08 -0.70 -1.58 114.58 118.98 3fzp h GLU 515 Ca 0.12 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 3fzp h GLU 515 Cb 0.71 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 3fzp h GLU 515 CO 0.05 0.27 0.26 0.00 -1.00 0.00 0.00 179.01 178.60 3fzp h ARG 516 N 0.27 1.03 -0.43 2.33 2.47 -1.22 -3.23 114.38 115.60 3fzp h ARG 516 Ca 0.08 -0.19 -0.00 0.00 -1.26 0.00 0.00 59.98 58.61 3fzp h ARG 516 Cb 0.04 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.20 3fzp h ARG 516 CO -0.01 0.86 0.00 0.09 0.56 0.00 0.00 179.97 181.47 3fzp n ASN 517 N -4.37 4.90 -0.31 7.04 3.02 -0.87 -4.60 115.26 120.07 3fzp n ASN 517 Ca 0.05 -2.98 0.17 0.00 -0.03 0.00 0.00 54.58 51.79 3fzp n ASN 517 Cb 0.18 -0.62 0.35 0.00 -0.61 0.00 0.00 39.78 39.08 3fzp n ASN 517 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3fzp h LYS 518 N 2.98 0.20 0.00 3.52 3.64 -1.30 -1.14 116.57 124.47 3fzp h LYS 518 Ca 0.00 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.34 3fzp h LYS 518 Cb 1.74 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.51 3fzp h LYS 518 CO 0.37 0.13 -0.12 -0.91 -2.27 0.00 0.00 179.45 176.65 3fzp h ASN 519 N 0.21 0.00 0.00 4.20 2.35 -1.88 -3.36 115.58 117.10 3fzp h ASN 519 Ca 0.61 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.36 3fzp h ASN 519 Cb 1.31 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.68 3fzp h ASN 519 CO -0.68 0.12 -1.41 -1.54 -1.65 0.00 0.00 177.43 172.28 3fzp n SER 520 N -3.18 3.00 -4.72 5.81 3.41 -0.83 -4.97 113.62 112.14 3fzp n SER 520 Ca 0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.21 3fzp n SER 520 Cb 0.48 1.38 -0.03 0.00 -0.26 0.00 0.00 64.21 65.78 3fzp n SER 520 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3fzp s LEU 521 N -3.64 4.37 0.40 1.04 1.43 -0.49 -5.02 118.68 116.77 3fzp s LEU 521 Ca -0.03 2.52 0.08 0.00 -1.03 0.00 0.00 54.13 55.67 3fzp s LEU 521 Cb 0.05 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.66 3fzp s LEU 521 CO 0.36 -0.76 0.37 -0.54 0.23 0.00 0.00 176.35 176.02 3fzp s LYS 522 N 1.03 2.57 0.35 1.70 -0.14 -1.26 -4.99 119.74 119.01 3fzp s LYS 522 Ca 0.68 -1.49 0.05 0.00 -1.36 0.00 0.00 55.97 53.85 3fzp s LYS 522 Cb -0.41 -2.41 0.70 0.00 -1.68 0.00 0.00 37.83 34.03 3fzp s LYS 522 CO 0.32 -0.15 1.95 0.28 -0.76 0.00 0.00 175.35 176.99 3fzp h VAL 523 N 1.05 1.03 -0.65 3.17 2.07 -1.95 -1.71 116.25 119.26 3fzp h VAL 523 Ca -0.42 -0.28 0.14 0.00 0.82 0.00 0.00 66.70 66.96 3fzp h VAL 523 Cb 1.26 0.16 -0.11 0.00 -1.52 0.00 0.00 31.29 31.08 3fzp h VAL 523 CO 0.57 0.15 0.05 0.25 0.02 0.00 0.00 177.57 178.61 3fzp h LEU 524 N 0.80 -0.19 -0.29 2.57 5.85 -1.95 -0.84 115.31 121.26 3fzp h LEU 524 Ca 0.33 0.15 -0.08 0.00 0.84 0.00 0.00 57.88 59.11 3fzp h LEU 524 Cb 0.25 0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 3fzp h LEU 524 CO -0.11 -0.09 -0.15 0.74 -0.34 0.00 0.00 178.44 178.49 3fzp h THR 525 N 0.16 1.30 -0.74 1.05 2.02 -1.72 0.17 112.91 115.14 3fzp h THR 525 Ca 0.35 -1.25 0.05 0.00 0.77 0.00 0.00 66.41 66.33 3fzp h THR 525 Cb 0.57 1.50 -0.04 0.00 -1.74 0.00 0.00 68.15 68.43 3fzp h THR 525 CO -0.52 0.40 0.49 -0.07 0.37 0.00 0.00 175.52 176.18 3fzp h LEU 526 N 0.35 0.72 -0.19 2.58 3.38 -1.05 0.12 115.31 121.22 3fzp h LEU 526 Ca 0.06 -0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.81 3fzp h LEU 526 Cb 0.67 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.27 3fzp h LEU 526 CO 0.04 0.47 -0.85 0.58 0.09 0.00 0.00 178.44 178.78 3fzp h VAL 527 N 0.82 1.32 -0.38 1.22 2.07 -0.83 -2.28 116.25 118.19 3fzp h VAL 527 Ca 0.31 -2.14 -0.01 0.00 0.82 0.00 0.00 66.70 65.69 3fzp h VAL 527 Cb 0.19 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 3fzp h VAL 527 CO -0.10 0.66 0.21 0.25 0.02 0.00 0.00 177.57 178.61 3fzp h LEU 528 N 0.41 0.46 -0.51 2.57 5.85 0.01 0.94 115.31 125.05 3fzp h LEU 528 Ca -0.07 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.58 3fzp h LEU 528 Cb 1.47 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.36 3fzp h LEU 528 CO 0.16 0.41 0.33 1.88 -0.34 0.00 0.00 178.44 180.89 3fzp h TYR 529 N 0.48 0.64 -0.78 1.25 0.05 -0.72 -1.50 116.97 116.39 3fzp h TYR 529 Ca 0.13 0.01 0.10 0.00 0.05 0.00 0.00 58.73 59.03 3fzp h TYR 529 Cb 0.04 -0.22 -0.08 0.00 1.01 0.00 0.00 36.73 37.49 3fzp h TYR 529 CO -0.03 0.40 0.41 0.77 -1.05 0.00 0.00 178.16 178.67 3fzp h SER 530 N 0.69 0.55 -0.28 3.88 0.02 -1.00 -1.92 113.55 115.49 3fzp h SER 530 Ca 0.19 0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 61.10 3fzp h SER 530 Cb -0.08 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 3fzp h SER 530 CO -0.04 0.30 -0.22 0.25 -1.14 0.00 0.00 176.83 175.98 3fzp h LEU 531 N 0.68 0.67 -0.30 5.07 5.85 -0.43 -1.98 115.31 124.88 3fzp h LEU 531 Ca 0.39 -0.45 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3fzp h LEU 531 Cb 0.42 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 3fzp h LEU 531 CO -0.28 0.98 0.10 1.56 -0.34 0.00 0.00 178.44 180.46 3fzp h GLN 532 N 0.37 0.22 -0.72 1.25 4.20 -1.02 0.14 115.11 119.55 3fzp h GLN 532 Ca 0.05 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 3fzp h GLN 532 Cb 0.77 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 3fzp h GLN 532 CO 0.06 0.15 0.40 0.82 -0.67 0.00 0.00 178.83 179.59 3fzp h ILE 533 N 0.23 1.22 -0.24 2.54 1.08 -1.28 -1.98 117.51 119.07 3fzp h ILE 533 Ca 0.13 -0.53 -0.08 0.00 -0.39 0.00 0.00 64.86 63.99 3fzp h ILE 533 Cb 0.11 0.26 -0.01 0.00 -3.07 0.00 0.00 36.82 34.10 3fzp h ILE 533 CO -0.14 0.23 -0.21 0.00 -0.69 0.00 0.00 178.15 177.34 3fzp h LYS 535 N 0.40 0.96 -0.74 0.00 1.57 -0.36 0.88 116.57 119.28 3fzp h LYS 535 Ca 0.06 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3fzp h LYS 535 Cb 0.59 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.69 3fzp h LYS 535 CO 0.04 0.74 0.37 0.00 -0.57 0.00 0.00 179.45 180.03 3fzp h ALA 536 N 1.17 0.95 -0.00 3.86 0.00 -0.48 -2.25 119.26 122.51 3fzp h ALA 536 Ca 0.24 -0.14 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 3fzp h ALA 536 Cb 0.08 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 3fzp h ALA 536 CO -0.03 0.51 -0.55 0.52 0.00 0.00 0.00 179.25 179.69 3fzp h MET 537 N 1.04 0.01 -0.61 0.00 2.86 -0.64 -1.64 114.93 115.94 3fzp h MET 537 Ca 0.26 -0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.79 3fzp h MET 537 Cb 0.10 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 3fzp h MET 537 CO -0.03 0.55 -0.01 0.00 1.06 0.00 0.00 176.91 178.48 3fzp h ALA 538 N 1.44 0.82 0.30 6.32 0.00 -0.38 0.26 119.26 128.02 3fzp h ALA 538 Ca -0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3fzp h ALA 538 Cb 0.97 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 3fzp h ALA 538 CO 0.07 0.68 -0.20 -0.92 0.00 0.00 0.00 179.25 178.88 3fzp h TYR 539 N 0.99 -0.51 -0.79 0.00 3.20 -0.96 -0.79 116.97 118.11 3fzp h TYR 539 Ca 0.17 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.18 3fzp h TYR 539 Cb 0.58 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.98 3fzp h TYR 539 CO 0.04 -0.30 0.52 -0.07 -1.64 0.00 0.00 178.16 176.71 3fzp h LEU 540 N -0.48 0.47 -0.68 2.82 3.38 -1.06 -2.09 115.31 117.66 3fzp h LEU 540 Ca -0.03 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3fzp h LEU 540 Cb 0.41 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3fzp h LEU 540 CO 0.02 0.24 -0.09 -0.08 0.09 0.00 0.00 178.44 178.62 3fzp h GLU 541 N 0.50 0.93 -0.03 1.13 4.81 0.49 -1.67 114.58 120.74 3fzp h GLU 541 Ca 0.39 -0.32 0.01 0.00 -0.13 0.00 0.00 59.36 59.31 3fzp h GLU 541 Cb 0.80 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.11 3fzp h GLU 541 CO -0.14 0.98 0.03 0.66 -0.73 0.00 0.00 179.01 179.81 3fzp h SER 542 N 0.84 0.00 -0.40 1.04 4.64 -0.46 -1.95 113.55 117.26 3fzp h SER 542 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3fzp h SER 542 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3fzp h SER 542 CO 0.04 0.00 0.00 2.30 -0.87 0.00 0.00 176.83 178.30 3fzp n ILE 543 N -3.94 2.47 -4.30 0.95 -5.35 -0.70 -4.95 119.36 103.53 3fzp n ILE 543 Ca -0.02 -1.67 -0.36 0.00 -0.27 0.00 0.00 62.75 60.43 3fzp n ILE 543 Cb 0.12 -0.25 -0.05 0.00 -1.74 0.00 0.00 39.64 37.72 3fzp n ILE 543 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 3fzp n ASN 544 N -0.01 -1.80 -4.54 7.28 4.13 -0.73 -4.95 115.26 114.65 3fzp n ASN 544 Ca 0.24 -1.13 -0.35 0.00 1.68 0.00 0.00 54.58 55.03 3fzp n ASN 544 Cb 1.02 -2.26 -0.11 0.00 -1.54 0.00 0.00 39.78 36.88 3fzp n ASN 544 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3fzp s VAL 546 N 0.76 5.28 -0.19 0.00 -7.23 -1.26 -4.51 120.40 113.26 3fzp s VAL 546 Ca 0.02 0.14 -0.08 0.00 -1.81 0.00 0.00 61.98 60.25 3fzp s VAL 546 Cb -0.14 -3.41 -0.04 0.00 0.56 0.00 0.00 36.38 33.35 3fzp s VAL 546 CO 0.02 0.44 0.08 -2.28 -0.31 0.00 0.00 175.10 173.05 3fzp s HIS 547 N 0.42 3.30 -0.17 2.82 2.46 -1.26 -4.76 115.29 118.11 3fzp s HIS 547 Ca 0.07 0.16 0.17 0.00 0.47 0.00 0.00 55.06 55.93 3fzp s HIS 547 Cb -0.11 -2.10 0.46 0.00 -0.13 0.00 0.00 32.58 30.70 3fzp s HIS 547 CO -0.01 0.21 1.35 0.54 -2.47 0.00 0.00 174.74 174.35 3fzp n ARG 548 N 3.50 2.44 -3.08 2.88 1.74 -1.25 -4.63 116.66 118.26 3fzp n ARG 548 Ca -0.16 -2.78 -0.17 0.00 -0.77 0.00 0.00 57.85 53.97 3fzp n ARG 548 Cb 0.52 -1.75 -0.01 0.00 -1.02 0.00 0.00 32.46 30.20 3fzp n ARG 548 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3fzp n ASP 549 N -0.79 -0.04 -4.36 0.55 2.03 -1.26 -4.94 116.55 107.74 3fzp n ASP 549 Ca 0.20 -3.12 -0.46 0.00 0.52 0.00 0.00 54.79 51.93 3fzp n ASP 549 Cb 0.83 -0.02 -0.02 0.00 -0.72 0.00 0.00 41.12 41.18 3fzp n ASP 549 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3fzp s ILE 550 N -1.60 5.38 -0.00 5.18 1.01 -1.26 -4.81 121.20 125.10 3fzp s ILE 550 Ca 0.35 -2.23 -0.12 0.00 0.00 0.00 0.00 60.65 58.65 3fzp s ILE 550 Cb 0.31 -4.55 0.02 0.00 0.01 0.00 0.00 42.46 38.25 3fzp s ILE 550 CO -0.09 -1.15 0.26 0.00 0.00 0.00 0.00 174.94 173.96 3fzp s ALA 551 N 0.84 -0.63 0.44 9.38 0.00 -1.26 -4.34 121.76 126.20 3fzp s ALA 551 Ca 0.22 0.15 0.12 0.00 0.00 0.00 0.00 51.96 52.44 3fzp s ALA 551 Cb -0.09 0.11 1.02 0.00 0.00 0.00 0.00 23.12 24.16 3fzp s ALA 551 CO -0.09 -0.26 2.05 -0.39 0.00 0.00 0.00 175.76 177.07 3fzp h VAL 552 N 3.91 1.00 -0.15 0.00 -1.51 -1.93 0.16 116.25 117.73 3fzp h VAL 552 Ca -0.30 -0.13 0.04 0.00 -1.23 0.00 0.00 66.70 65.08 3fzp h VAL 552 Cb 1.18 0.59 -0.01 0.00 -2.13 0.00 0.00 31.29 30.92 3fzp h VAL 552 CO 0.41 0.07 0.12 -0.09 -1.23 0.00 0.00 177.57 176.85 3fzp h ARG 553 N 0.37 0.00 -0.77 5.19 2.43 -1.96 -2.88 114.38 116.77 3fzp h ARG 553 Ca 0.17 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 59.02 3fzp h ARG 553 Cb 0.21 0.00 -0.19 0.00 -0.42 0.00 0.00 29.97 29.57 3fzp h ARG 553 CO -0.04 0.00 0.36 -1.71 -1.51 0.00 0.00 179.97 177.07 3fzp n ASN 554 N -4.23 4.08 -3.86 -3.80 4.05 0.04 -4.82 115.26 106.72 3fzp n ASN 554 Ca 0.01 -3.43 -0.19 0.00 0.45 0.00 0.00 54.58 51.41 3fzp n ASN 554 Cb 0.24 -0.76 -0.16 0.00 1.23 0.00 0.00 39.78 40.33 3fzp n ASN 554 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3fzp s ILE 555 N -3.14 0.42 0.11 -1.44 1.01 -1.11 0.06 121.20 117.11 3fzp s ILE 555 Ca 0.54 -0.04 0.03 0.00 0.00 0.00 0.00 60.65 61.18 3fzp s ILE 555 Cb 0.45 -0.48 -0.04 0.00 0.01 0.00 0.00 42.46 42.40 3fzp s ILE 555 CO 0.11 0.21 0.15 -0.76 0.00 0.00 0.00 174.94 174.64 3fzp s LEU 556 N 1.07 3.97 -0.32 2.97 1.43 0.55 -0.57 118.68 127.79 3fzp s LEU 556 Ca -0.09 0.03 -0.06 0.00 -1.03 0.00 0.00 54.13 52.98 3fzp s LEU 556 Cb -0.14 -2.60 0.03 0.00 0.03 0.00 0.00 46.19 43.51 3fzp s LEU 556 CO -0.01 0.13 0.08 -0.69 0.23 0.00 0.00 176.35 176.09 3fzp s VAL 557 N -1.56 3.74 -0.04 -1.59 1.01 0.41 -1.25 120.40 121.12 3fzp s VAL 557 Ca 0.31 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 3fzp s VAL 557 Cb -0.12 -3.05 -0.31 0.00 0.00 0.00 0.00 36.38 32.91 3fzp s VAL 557 CO 0.24 -0.07 0.72 0.00 0.00 0.00 0.00 175.10 175.99 3fzp h ALA 558 N 8.20 0.14 -2.94 5.51 0.00 -1.51 -2.67 119.26 125.99 3fzp h ALA 558 Ca -0.26 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.54 3fzp h ALA 558 Cb 1.10 0.41 -0.09 0.00 0.00 0.00 0.00 17.79 19.21 3fzp h ALA 558 CO 0.60 1.01 0.13 -1.54 0.00 0.00 0.00 179.25 179.44 3fzp s SER 559 N -7.29 -0.33 0.56 0.00 1.04 -0.93 -4.62 113.70 102.13 3fzp s SER 559 Ca -0.15 -0.41 0.33 0.00 0.48 0.00 0.00 55.95 56.20 3fzp s SER 559 Cb 0.05 0.63 1.47 0.00 0.10 0.00 0.00 66.02 68.27 3fzp s SER 559 CO 0.86 -1.12 1.81 -0.65 0.98 0.00 0.00 173.24 175.12 3fzp h PRO 560 N 2.10 0.00 -0.52 4.02 0.11 -2.03 -0.55 132.00 135.12 3fzp h PRO 560 Ca -0.27 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.68 3fzp h PRO 560 Cb 1.27 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.29 3fzp h PRO 560 CO 0.33 0.00 0.13 0.39 -0.21 0.00 0.00 178.00 178.64 3fzp n GLU 561 N -3.99 3.01 -3.63 1.05 1.02 -1.26 -4.96 120.64 111.88 3fzp n GLU 561 Ca 0.19 -3.04 -0.03 0.00 -0.02 0.00 0.00 57.16 54.27 3fzp n GLU 561 Cb 1.06 -2.02 -0.05 0.00 -0.02 0.00 0.00 31.44 30.41 3fzp n GLU 561 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3fzp s VAL 563 N 2.83 2.68 -0.04 0.00 -7.23 -1.26 -1.28 120.40 116.09 3fzp s VAL 563 Ca -0.04 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 57.98 3fzp s VAL 563 Cb -0.12 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.24 3fzp s VAL 563 CO -0.18 -0.31 -0.02 -0.54 -0.31 0.00 0.00 175.10 173.75 3fzp s LYS 564 N -3.62 0.58 0.01 4.82 -0.14 -0.38 -4.62 119.74 116.40 3fzp s LYS 564 Ca 0.32 0.00 -0.30 0.00 -1.36 0.00 0.00 55.97 54.63 3fzp s LYS 564 Cb -0.03 -0.73 -0.07 0.00 -1.68 0.00 0.00 37.83 35.33 3fzp s LYS 564 CO 0.17 -0.14 1.60 -1.17 -0.76 0.00 0.00 175.35 175.06 3fzp s LEU 565 N 1.15 4.34 0.00 3.17 2.96 0.60 -0.33 118.68 130.57 3fzp s LEU 565 Ca -0.08 2.32 -0.10 0.00 -0.22 0.00 0.00 54.13 56.06 3fzp s LEU 565 Cb -0.14 -3.55 0.14 0.00 0.50 0.00 0.00 46.19 43.14 3fzp s LEU 565 CO -0.01 -0.87 0.66 0.61 -1.32 0.00 0.00 176.35 175.42 3fzp n GLY 566 N 3.98 -1.81 3.21 7.98 0.00 0.11 -1.74 105.19 116.92 3fzp n GLY 566 Ca 0.16 -1.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.15 3fzp n GLY 566 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fzp n ASP 567 N -3.66 5.33 -0.65 1.61 5.68 -1.26 -4.72 116.55 118.88 3fzp n ASP 567 Ca 0.09 -3.13 0.06 0.00 -0.50 0.00 0.00 54.79 51.30 3fzp n ASP 567 Cb 0.31 -1.27 0.11 0.00 -1.14 0.00 0.00 41.12 39.13 3fzp n ASP 567 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3fzp n PHE 568 N 2.33 0.00 0.00 2.11 0.99 -1.26 -5.13 117.46 116.50 3fzp n PHE 568 Ca 0.24 -0.89 0.00 0.00 -0.00 0.00 0.00 57.45 56.80 3fzp n PHE 568 Cb 0.38 -0.17 0.00 0.00 -1.00 0.00 0.00 39.48 38.69 3fzp n PHE 568 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3fzp n GLY 569 N -0.65 2.93 0.00 1.37 0.00 -1.26 -3.85 105.19 103.73 3fzp n GLY 569 Ca 0.12 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.41 3fzp n GLY 569 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3fzp n THR 585 N -0.85 0.00 -1.52 2.61 -1.04 -1.26 -4.88 114.28 107.35 3fzp n THR 585 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.74 3fzp n THR 585 Cb 0.00 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.35 3fzp n THR 585 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 3fzp n ARG 586 N 0.00 0.21 -1.84 -2.82 1.85 -1.26 -4.92 116.66 107.88 3fzp n ARG 586 Ca 0.00 -0.15 -0.31 0.00 -1.00 0.00 0.00 57.85 56.39 3fzp n ARG 586 Cb 0.00 -1.86 0.02 0.00 -1.05 0.00 0.00 32.46 29.57 3fzp n ARG 586 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3fzp s LEU 587 N 6.35 3.29 -1.40 2.89 1.43 -1.26 -4.94 118.68 125.04 3fzp s LEU 587 Ca 1.23 1.59 -0.14 0.00 -1.03 0.00 0.00 54.13 55.78 3fzp s LEU 587 Cb -0.77 -4.50 0.07 0.00 0.03 0.00 0.00 46.19 41.02 3fzp s LEU 587 CO 0.43 -1.12 2.07 -0.81 0.23 0.00 0.00 176.35 177.15 3fzp n PRO 588 N -2.64 3.06 -0.36 1.29 -0.04 -1.26 -4.79 135.00 130.26 3fzp n PRO 588 Ca 0.07 -2.91 0.09 0.00 -0.04 0.00 0.00 63.50 60.72 3fzp n PRO 588 Cb 0.54 -3.24 0.27 0.00 -0.04 0.00 0.00 33.50 31.02 3fzp n PRO 588 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3fzp h ILE 589 N 4.19 0.83 0.00 0.52 1.08 -1.96 -0.54 117.51 121.64 3fzp h ILE 589 Ca 0.51 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 64.67 3fzp h ILE 589 Cb 0.68 -0.15 0.00 0.00 -3.07 0.00 0.00 36.82 34.28 3fzp h ILE 589 CO 1.76 0.16 0.00 0.29 -0.69 0.00 0.00 178.15 179.67 3fzp n LYS 590 N -4.68 0.06 0.00 2.37 5.02 -1.26 -2.12 118.16 117.55 3fzp n LYS 590 Ca 0.21 0.22 0.09 0.00 -2.02 0.00 0.00 58.31 56.81 3fzp n LYS 590 Cb 0.44 -1.60 -0.04 0.00 -0.02 0.00 0.00 35.03 33.82 3fzp n LYS 590 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 3fzp n TRP 591 N -1.71 0.00 -3.67 2.13 8.01 -0.24 -4.78 117.44 117.18 3fzp n TRP 591 Ca 0.04 0.00 -0.34 0.00 -1.31 0.00 0.00 57.50 55.89 3fzp n TRP 591 Cb 0.25 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.49 3fzp n TRP 591 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 3fzp s MET 592 N -2.43 3.66 0.74 -0.99 -1.94 -0.90 -4.16 119.30 113.28 3fzp s MET 592 Ca 0.13 0.03 -0.13 0.00 -1.71 0.00 0.00 55.69 54.01 3fzp s MET 592 Cb 0.15 -3.02 0.04 0.00 2.01 0.00 0.00 34.83 34.02 3fzp s MET 592 CO 0.60 0.59 1.13 -1.54 -0.01 0.00 0.00 175.02 175.78 3fzp s SER 593 N -1.82 4.47 0.23 3.03 1.04 -1.26 -4.81 113.70 114.57 3fzp s SER 593 Ca 0.32 2.03 -0.07 0.00 0.48 0.00 0.00 55.95 58.70 3fzp s SER 593 Cb -0.13 -2.55 0.35 0.00 0.10 0.00 0.00 66.02 63.79 3fzp s SER 593 CO 0.18 -2.06 1.75 -0.65 0.98 0.00 0.00 173.24 173.44 3fzp h PRO 594 N -0.64 0.48 -0.96 4.02 0.11 -1.95 -1.50 132.00 131.55 3fzp h PRO 594 Ca -0.45 -0.03 0.07 0.00 0.11 0.00 0.00 66.00 65.70 3fzp h PRO 594 Cb 1.25 -0.11 -0.07 0.00 0.11 0.00 0.00 31.00 32.19 3fzp h PRO 594 CO 0.51 0.32 0.61 0.93 -0.21 0.00 0.00 178.00 180.16 3fzp h GLU 595 N 0.50 1.06 -0.32 1.05 3.07 -1.90 0.26 114.58 118.31 3fzp h GLU 595 Ca 0.35 -0.06 -0.17 0.00 -0.50 0.00 0.00 59.36 58.98 3fzp h GLU 595 Cb 0.44 -0.24 -0.00 0.00 -0.84 0.00 0.00 28.75 28.11 3fzp h GLU 595 CO -0.32 0.70 -0.47 0.77 -1.40 0.00 0.00 179.01 178.30 3fzp h SER 596 N 1.09 0.92 -0.16 1.42 0.02 -1.31 0.26 113.55 115.79 3fzp h SER 596 Ca 0.42 -0.46 -0.22 0.00 -0.84 0.00 0.00 61.79 60.69 3fzp h SER 596 Cb 0.21 -0.26 0.01 0.00 0.14 0.00 0.00 62.40 62.50 3fzp h SER 596 CO -0.19 1.24 -0.77 0.40 -1.14 0.00 0.00 176.83 176.37 3fzp h ILE 597 N 0.67 1.27 0.02 3.27 2.04 -0.50 -0.72 117.51 123.58 3fzp h ILE 597 Ca 0.04 -1.96 -0.00 0.00 1.00 0.00 0.00 64.86 63.94 3fzp h ILE 597 Cb 1.06 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 39.10 3fzp h ILE 597 CO 0.11 0.62 -0.01 0.78 0.00 0.00 0.00 178.15 179.65 3fzp h ASN 598 N 0.55 -0.03 -0.01 1.72 -0.26 -0.51 -3.39 115.58 113.65 3fzp h ASN 598 Ca -0.05 -0.71 0.00 0.00 -0.56 0.00 0.00 56.30 54.98 3fzp h ASN 598 Cb 1.40 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.67 3fzp h ASN 598 CO 0.16 0.76 0.00 0.49 -1.06 0.00 0.00 177.43 177.78 3fzp n PHE 599 N -4.72 0.01 -2.06 1.19 3.01 0.89 -4.98 117.46 110.80 3fzp n PHE 599 Ca -0.08 -0.41 -0.16 0.00 1.01 0.00 0.00 57.45 57.81 3fzp n PHE 599 Cb 0.36 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.76 3fzp n PHE 599 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3fzp n ARG 600 N -0.38 -1.74 -2.74 -1.08 1.74 -0.27 -4.94 116.66 107.24 3fzp n ARG 600 Ca 0.00 0.85 -0.42 0.00 -0.77 0.00 0.00 57.85 57.52 3fzp n ARG 600 Cb 0.21 -5.36 -0.03 0.00 -1.02 0.00 0.00 32.46 26.25 3fzp n ARG 600 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3fzp s ARG 601 N -4.41 4.57 -0.07 5.56 0.52 -1.15 -4.94 118.95 119.03 3fzp s ARG 601 Ca 0.00 1.38 -0.00 0.00 -0.52 0.00 0.00 55.73 56.58 3fzp s ARG 601 Cb 0.00 -3.45 0.02 0.00 0.52 0.00 0.00 34.95 32.05 3fzp s ARG 601 CO 0.00 -0.01 -0.03 -0.06 0.02 0.00 0.00 175.30 175.22 3fzp s PHE 602 N 0.86 0.90 0.28 -0.53 0.40 -1.26 -3.10 117.98 115.53 3fzp s PHE 602 Ca 0.50 -0.32 0.06 0.00 -0.60 0.00 0.00 56.93 56.57 3fzp s PHE 602 Cb -0.21 -0.87 -0.02 0.00 0.51 0.00 0.00 43.02 42.43 3fzp s PHE 602 CO 0.27 -0.33 0.25 0.25 0.70 0.00 0.00 175.22 176.37 3fzp n THR 603 N 4.75 0.00 0.18 0.64 -2.24 -1.26 -4.98 114.28 111.37 3fzp n THR 603 Ca -0.14 -1.97 0.02 0.00 -2.27 0.00 0.00 64.05 59.70 3fzp n THR 603 Cb 0.50 1.00 0.34 0.00 -2.10 0.00 0.00 70.33 70.08 3fzp n THR 603 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 3fzp h THR 604 N 1.89 1.27 -0.13 4.28 1.35 -1.95 -2.04 112.91 117.57 3fzp h THR 604 Ca -0.20 -1.34 -0.10 0.00 -0.55 0.00 0.00 66.41 64.22 3fzp h THR 604 Cb 1.00 1.73 -0.01 0.00 -1.73 0.00 0.00 68.15 69.13 3fzp h THR 604 CO 0.29 0.38 -0.35 0.00 -0.25 0.00 0.00 175.52 175.59 3fzp h ALA 605 N 1.61 1.16 -0.06 6.62 0.00 -1.93 -0.06 119.26 126.60 3fzp h ALA 605 Ca -0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.37 3fzp h ALA 605 Cb 0.69 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3fzp h ALA 605 CO 0.05 0.55 -0.66 0.66 0.00 0.00 0.00 179.25 179.85 3fzp h SER 606 N 0.23 0.28 -0.61 0.00 4.64 -1.79 -2.19 113.55 114.11 3fzp h SER 606 Ca 0.03 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 61.15 3fzp h SER 606 Cb 0.74 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.71 3fzp h SER 606 CO 0.06 0.86 0.31 0.44 -0.87 0.00 0.00 176.83 177.63 3fzp h ASP 607 N 0.17 0.80 0.12 4.97 3.32 -0.85 -0.98 116.42 123.98 3fzp h ASP 607 Ca -0.01 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 3fzp h ASP 607 Cb 1.19 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.53 3fzp h ASP 607 CO 0.10 0.68 -0.08 0.58 -1.72 0.00 0.00 179.24 178.80 3fzp h VAL 608 N 0.90 0.83 -0.48 -1.35 2.07 -0.66 0.36 116.25 117.92 3fzp h VAL 608 Ca 0.22 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.84 3fzp h VAL 608 Cb 0.08 0.83 -0.10 0.00 -1.52 0.00 0.00 31.29 30.58 3fzp h VAL 608 CO -0.03 0.00 -0.28 -0.25 0.02 0.00 0.00 177.57 177.03 3fzp h TRP 609 N -0.20 -0.73 -0.51 1.57 2.91 -1.15 -2.02 115.95 115.82 3fzp h TRP 609 Ca -0.01 0.06 -0.10 0.00 1.13 0.00 0.00 58.89 59.97 3fzp h TRP 609 Cb 0.17 0.39 -0.02 0.00 -0.51 0.00 0.00 29.16 29.19 3fzp h TRP 609 CO -0.08 -0.35 -0.09 1.98 -1.03 0.00 0.00 178.44 178.87 3fzp h MET 610 N -0.17 0.93 -1.01 2.65 4.05 -0.75 -2.05 114.93 118.59 3fzp h MET 610 Ca 0.21 -0.32 0.05 0.00 -0.28 0.00 0.00 59.70 59.37 3fzp h MET 610 Cb 0.51 -0.07 -0.06 0.00 -0.80 0.00 0.00 31.60 31.17 3fzp h MET 610 CO -0.58 0.97 0.66 0.35 0.23 0.00 0.00 176.91 178.54 3fzp h PHE 611 N 0.83 1.22 -0.57 1.39 3.57 -0.03 -0.84 116.94 122.51 3fzp h PHE 611 Ca 0.14 0.03 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 3fzp h PHE 611 Cb 0.61 -0.40 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 3fzp h PHE 611 CO 0.04 0.67 0.01 0.00 -2.23 0.00 0.00 178.31 176.80 3fzp h ALA 612 N 1.43 0.94 -0.96 2.41 0.00 -0.89 -0.99 119.26 121.20 3fzp h ALA 612 Ca 0.42 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 55.07 3fzp h ALA 612 Cb 0.08 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 3fzp h ALA 612 CO -0.15 0.64 0.63 0.28 0.00 0.00 0.00 179.25 180.65 3fzp h VAL 613 N 0.91 1.17 -0.50 0.00 2.07 -0.59 -1.70 116.25 117.61 3fzp h VAL 613 Ca 0.17 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 3fzp h VAL 613 Cb 0.51 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.10 3fzp h VAL 613 CO 0.03 0.22 0.27 0.00 0.02 0.00 0.00 177.57 178.11 3fzp h MET 615 N 0.66 0.36 -0.96 0.00 2.86 -0.79 0.40 114.93 117.46 3fzp h MET 615 Ca 0.18 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.81 3fzp h MET 615 Cb 0.05 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.57 3fzp h MET 615 CO -0.03 0.24 0.64 2.35 1.06 0.00 0.00 176.91 181.17 3fzp h TRP 616 N 0.37 1.20 -0.33 -0.22 7.01 -0.85 0.22 115.95 123.36 3fzp h TRP 616 Ca 0.41 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.42 3fzp h TRP 616 Cb 0.65 -0.40 -0.01 0.00 -2.10 0.00 0.00 29.16 27.29 3fzp h TRP 616 CO -0.20 0.74 0.12 0.93 -2.79 0.00 0.00 178.44 177.24 3fzp h GLU 617 N 1.28 0.49 0.19 2.65 5.08 -0.17 -0.72 114.58 123.38 3fzp h GLU 617 Ca 0.36 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 3fzp h GLU 617 Cb -0.10 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.07 3fzp h GLU 617 CO -0.09 0.50 -0.09 0.82 -1.00 0.00 0.00 179.01 179.15 3fzp h ILE 618 N 0.38 0.82 0.00 3.13 2.04 -0.55 0.55 117.51 123.88 3fzp h ILE 618 Ca 0.11 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.91 3fzp h ILE 618 Cb 0.20 0.85 -0.00 0.00 -0.74 0.00 0.00 36.82 37.12 3fzp h ILE 618 CO -0.01 0.01 -0.10 -0.07 0.00 0.00 0.00 178.15 177.98 3fzp h LEU 619 N -0.27 0.00 -1.36 1.44 -0.00 -0.58 -1.61 115.31 112.92 3fzp h LEU 619 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.85 3fzp h LEU 619 Cb 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.87 3fzp h LEU 619 CO 0.04 0.10 0.00 -1.20 -0.00 0.00 0.00 178.44 177.38 3fzp n SER 620 N -3.43 1.99 -2.79 -0.43 7.64 -0.28 -4.55 113.62 111.76 3fzp n SER 620 Ca -0.01 -1.99 -0.22 0.00 1.01 0.00 0.00 58.87 57.66 3fzp n SER 620 Cb 0.26 -0.24 0.02 0.00 -1.01 0.00 0.00 64.21 63.23 3fzp n SER 620 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3fzp n PHE 621 N 0.58 -1.61 -0.22 1.43 3.01 -0.61 -2.91 117.46 117.13 3fzp n PHE 621 Ca 0.13 0.32 0.00 0.00 1.01 0.00 0.00 57.45 58.91 3fzp n PHE 621 Cb 0.32 -4.27 0.00 0.00 -0.01 0.00 0.00 39.48 35.51 3fzp n PHE 621 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3fzp n GLY 622 N -1.33 0.88 3.76 1.37 0.00 0.19 -3.99 105.19 106.07 3fzp n GLY 622 Ca -0.16 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 3fzp n GLY 622 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fzp s LYS 623 N -0.64 3.46 0.26 1.61 1.02 -1.15 -4.98 119.74 119.34 3fzp s LYS 623 Ca 0.00 2.04 -0.30 0.00 0.02 0.00 0.00 55.97 57.73 3fzp s LYS 623 Cb 0.00 -2.36 -0.09 0.00 -0.52 0.00 0.00 37.83 34.86 3fzp s LYS 623 CO 0.00 -0.87 1.09 -1.14 -0.92 0.00 0.00 175.35 173.51 3fzp s GLN 624 N -2.77 4.65 0.46 1.68 0.74 -1.26 -4.62 119.66 118.54 3fzp s GLN 624 Ca 0.67 1.77 -0.23 0.00 0.05 0.00 0.00 55.36 57.62 3fzp s GLN 624 Cb -0.35 -3.21 -0.07 0.00 1.10 0.00 0.00 33.01 30.47 3fzp s GLN 624 CO 0.42 0.21 1.18 -1.25 -0.55 0.00 0.00 175.29 175.31 3fzp s PRO 625 N -1.27 3.76 -1.23 1.67 0.04 -1.26 -2.76 135.00 133.95 3fzp s PRO 625 Ca 0.45 1.81 -0.03 0.00 0.04 0.00 0.00 61.00 63.26 3fzp s PRO 625 Cb -0.31 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 31.82 3fzp s PRO 625 CO 0.39 -0.56 0.23 1.19 0.04 0.00 0.00 177.00 178.29 3fzp n PHE 626 N -0.45 -1.58 -0.03 0.56 3.72 -1.26 -4.81 117.46 113.61 3fzp n PHE 626 Ca 0.07 0.21 0.21 0.00 -0.05 0.00 0.00 57.45 57.89 3fzp n PHE 626 Cb 0.48 -3.12 0.69 0.00 -0.94 0.00 0.00 39.48 36.59 3fzp n PHE 626 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 3fzp h PHE 627 N -0.48 0.01 0.00 1.38 -5.15 -1.93 0.55 116.94 111.33 3fzp h PHE 627 Ca -0.38 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.39 3fzp h PHE 627 Cb 1.27 -0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.43 3fzp h PHE 627 CO 0.66 0.01 0.00 -2.67 -2.00 0.00 0.00 178.31 174.31 3fzp n TRP 628 N -4.36 0.00 -3.98 6.09 2.14 -1.26 -4.81 117.44 111.26 3fzp n TRP 628 Ca 0.11 0.00 -0.26 0.00 2.07 0.00 0.00 57.50 59.43 3fzp n TRP 628 Cb 0.66 -0.18 -0.03 0.00 -0.81 0.00 0.00 31.31 30.95 3fzp n TRP 628 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 3fzp s LEU 629 N -2.36 2.88 0.12 5.67 1.43 0.19 -5.14 118.68 121.47 3fzp s LEU 629 Ca 0.34 -1.16 0.03 0.00 -1.03 0.00 0.00 54.13 52.31 3fzp s LEU 629 Cb 0.20 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 45.04 3fzp s LEU 629 CO 0.41 -0.87 0.18 -1.61 0.23 0.00 0.00 176.35 174.69 3fzp s GLU 630 N -4.12 3.15 0.30 1.70 2.02 -1.26 -5.02 118.70 115.46 3fzp s GLU 630 Ca 0.35 -0.67 0.05 0.00 0.02 0.00 0.00 54.97 54.72 3fzp s GLU 630 Cb -0.00 -2.83 0.77 0.00 0.10 0.00 0.00 34.13 32.17 3fzp s GLU 630 CO 0.21 0.54 1.67 -0.91 0.02 0.00 0.00 175.26 176.79 3fzp h ASN 631 N 2.64 0.24 0.52 -0.19 4.21 -2.00 -1.37 115.58 119.63 3fzp h ASN 631 Ca -0.47 0.17 0.00 0.00 1.21 0.00 0.00 56.30 57.21 3fzp h ASN 631 Cb 1.18 0.18 0.00 0.00 -1.12 0.00 0.00 38.32 38.56 3fzp h ASN 631 CO 0.68 -0.07 0.00 0.50 -1.29 0.00 0.00 177.43 177.24 3fzp h LYS 632 N 0.32 0.00 0.00 0.81 3.64 -2.02 -2.59 116.57 116.74 3fzp h LYS 632 Ca 0.58 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.96 3fzp h LYS 632 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3fzp h LYS 632 CO -0.58 0.00 -0.56 -0.44 -2.27 0.00 0.00 179.45 175.60 3fzp h ASP 633 N 0.00 0.00 0.18 4.20 3.32 -1.65 -3.41 116.42 119.06 3fzp h ASP 633 Ca 0.00 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 3fzp h ASP 633 Cb 0.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3fzp h ASP 633 CO 0.00 0.09 -0.09 0.58 -1.72 0.00 0.00 179.24 178.10 3fzp h VAL 634 N 0.00 0.93 -0.62 -1.35 2.07 -1.55 -2.94 116.25 112.78 3fzp h VAL 634 Ca 0.00 -0.64 0.11 0.00 0.82 0.00 0.00 66.70 66.99 3fzp h VAL 634 Cb 0.75 1.30 -0.08 0.00 -1.52 0.00 0.00 31.29 31.74 3fzp h VAL 634 CO 0.00 0.14 0.18 -0.29 0.02 0.00 0.00 177.57 177.62 3fzp h ILE 635 N -0.57 0.67 -0.37 4.57 6.09 -1.79 0.29 117.51 126.41 3fzp h ILE 635 Ca -0.03 -0.11 -0.05 0.00 -1.37 0.00 0.00 64.86 63.31 3fzp h ILE 635 Cb 0.42 0.32 -0.02 0.00 0.47 0.00 0.00 36.82 38.02 3fzp h ILE 635 CO 0.04 0.06 0.03 1.23 -3.07 0.00 0.00 178.15 176.44 3fzp h GLY 636 N 0.32 0.60 0.91 8.18 0.00 -1.82 0.65 103.07 111.91 3fzp h GLY 636 Ca 0.33 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 47.27 3fzp h GLY 636 CO -0.38 0.32 0.03 -2.08 0.00 0.00 0.00 176.54 174.43 3fzp h VAL 637 N 0.54 1.25 -0.10 4.60 2.07 -0.95 -2.79 116.25 120.86 3fzp h VAL 637 Ca 0.12 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.74 3fzp h VAL 637 Cb 0.30 1.15 -0.00 0.00 -1.52 0.00 0.00 31.29 31.21 3fzp h VAL 637 CO 0.01 0.30 0.06 -0.07 0.02 0.00 0.00 177.57 177.88 3fzp h LEU 638 N 0.42 0.13 -1.53 2.57 3.38 -0.27 -2.61 115.31 117.40 3fzp h LEU 638 Ca 0.10 -0.08 0.20 0.00 0.09 0.00 0.00 57.88 58.20 3fzp h LEU 638 Cb 0.40 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 41.05 3fzp h LEU 638 CO 0.01 0.17 0.59 -0.33 0.09 0.00 0.00 178.44 178.97 3fzp h GLU 639 N 0.08 0.39 -0.38 1.13 4.39 0.32 0.33 114.58 120.83 3fzp h GLU 639 Ca 0.04 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.71 3fzp h GLU 639 Cb 0.07 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 3fzp h GLU 639 CO -0.01 0.25 0.00 0.36 -1.16 0.00 0.00 179.01 178.46 3fzp n LYS 640 N -4.50 1.64 -0.76 2.33 2.85 -1.06 -4.91 118.16 113.75 3fzp n LYS 640 Ca 0.19 -0.79 0.00 0.00 -1.05 0.00 0.00 58.31 56.66 3fzp n LYS 640 Cb 0.69 -1.30 0.00 0.00 -0.65 0.00 0.00 35.03 33.77 3fzp n LYS 640 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3fzp n GLY 641 N 0.67 0.78 3.78 2.58 0.00 0.12 -5.04 105.19 108.07 3fzp n GLY 641 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 3fzp n GLY 641 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3fzp s ASP 642 N -2.62 7.29 0.24 1.61 1.01 -1.00 -5.02 116.67 118.16 3fzp s ASP 642 Ca 0.00 1.86 0.02 0.00 0.71 0.00 0.00 52.55 55.13 3fzp s ASP 642 Cb 0.00 -2.58 -0.05 0.00 1.01 0.00 0.00 42.92 41.30 3fzp s ASP 642 CO 0.00 -0.11 0.07 -0.13 0.21 0.00 0.00 175.17 175.21 3fzp s ARG 643 N -2.10 1.35 0.26 8.23 1.81 -1.26 -4.32 118.95 122.91 3fzp s ARG 643 Ca 0.51 -1.71 -0.31 0.00 -1.72 0.00 0.00 55.73 52.50 3fzp s ARG 643 Cb -0.19 -0.30 -0.11 0.00 -0.45 0.00 0.00 34.95 33.90 3fzp s ARG 643 CO 0.24 -0.25 1.64 -0.51 -0.68 0.00 0.00 175.30 175.74 3fzp s LEU 644 N -3.29 4.36 0.79 2.53 1.43 -1.26 -4.96 118.68 118.29 3fzp s LEU 644 Ca 0.34 2.90 -0.11 0.00 -1.03 0.00 0.00 54.13 56.23 3fzp s LEU 644 Cb 0.07 -3.62 0.07 0.00 0.03 0.00 0.00 46.19 42.74 3fzp s LEU 644 CO 0.11 -0.93 1.09 -2.16 0.23 0.00 0.00 176.35 174.69 3fzp s PRO 645 N 0.18 2.13 0.01 1.29 0.04 -1.26 -4.93 135.00 132.46 3fzp s PRO 645 Ca 0.68 0.77 -0.30 0.00 0.04 0.00 0.00 61.00 62.18 3fzp s PRO 645 Cb -0.48 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.09 3fzp s PRO 645 CO 0.41 -1.62 1.41 0.21 0.04 0.00 0.00 177.00 177.46 3fzp s LYS 646 N -5.08 4.28 0.68 4.56 2.20 -1.26 -4.96 119.74 120.16 3fzp s LYS 646 Ca 0.61 1.98 -0.17 0.00 -0.36 0.00 0.00 55.97 58.03 3fzp s LYS 646 Cb -0.15 -3.57 0.01 0.00 -1.51 0.00 0.00 37.83 32.61 3fzp s LYS 646 CO 0.55 -0.58 1.26 -2.14 -0.36 0.00 0.00 175.35 174.08 3fzp s PRO 647 N 2.38 2.37 0.26 4.03 0.02 -1.26 -4.92 135.00 137.88 3fzp s PRO 647 Ca 0.64 1.94 -0.04 0.00 0.02 0.00 0.00 61.00 63.57 3fzp s PRO 647 Cb -0.32 -1.84 0.34 0.00 0.02 0.00 0.00 34.50 32.70 3fzp s PRO 647 CO 0.27 -1.70 1.91 0.22 -0.33 0.00 0.00 177.00 177.37 3fzp h ASP 648 N 0.20 1.09 -0.21 2.53 3.58 -1.93 -1.19 116.42 120.50 3fzp h ASP 648 Ca -0.50 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.94 3fzp h ASP 648 Cb 1.32 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 42.12 3fzp h ASP 648 CO 0.52 0.75 0.00 0.18 -2.88 0.00 0.00 179.24 177.81 3fzp n LEU 649 N -4.43 1.94 -4.68 2.28 4.77 -1.26 -4.89 117.00 110.73 3fzp n LEU 649 Ca 0.13 -0.82 -0.41 0.00 -0.03 0.00 0.00 56.01 54.88 3fzp n LEU 649 Cb 0.09 -0.13 -0.04 0.00 -2.33 0.00 0.00 43.42 41.00 3fzp n LEU 649 CO 0.35 0.41 0.52 0.00 -1.33 0.00 0.00 177.39 177.34 3fzp s PRO 651 N 1.69 4.07 0.40 0.00 0.02 -1.26 -4.83 135.00 135.09 3fzp s PRO 651 Ca 0.37 2.39 0.13 0.00 0.02 0.00 0.00 61.00 63.91 3fzp s PRO 651 Cb -0.17 -2.90 0.96 0.00 0.02 0.00 0.00 34.50 32.41 3fzp s PRO 651 CO 0.14 -0.49 1.92 -1.35 -0.33 0.00 0.00 177.00 176.89 3fzp h PRO 652 N 2.92 0.50 -0.49 5.54 0.11 -1.97 0.20 132.00 138.82 3fzp h PRO 652 Ca -0.50 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.54 3fzp h PRO 652 Cb 1.24 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 3fzp h PRO 652 CO 0.64 0.33 0.15 -0.24 -0.21 0.00 0.00 178.00 178.67 3fzp h VAL 653 N 0.52 1.20 0.04 3.15 3.04 -2.00 -0.42 116.25 121.77 3fzp h VAL 653 Ca 0.37 -0.66 -0.23 0.00 -1.01 0.00 0.00 66.70 65.18 3fzp h VAL 653 Cb 0.73 0.66 -0.01 0.00 -2.01 0.00 0.00 31.29 30.66 3fzp h VAL 653 CO -0.13 0.25 -1.01 0.25 -1.01 0.00 0.00 177.57 175.92 3fzp h LEU 654 N 0.70 0.33 -0.87 3.16 5.85 -1.02 -2.74 115.31 120.72 3fzp h LEU 654 Ca 0.16 -0.30 -0.09 0.00 0.84 0.00 0.00 57.88 58.50 3fzp h LEU 654 Cb 0.20 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 3fzp h LEU 654 CO -0.01 1.15 -0.12 0.22 -0.34 0.00 0.00 178.44 179.34 3fzp h TYR 655 N 0.11 0.78 -0.91 1.25 3.20 -0.68 -0.78 116.97 119.93 3fzp h TYR 655 Ca -0.07 -0.14 -0.02 0.00 3.14 0.00 0.00 58.73 61.64 3fzp h TYR 655 Cb 1.69 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 39.71 3fzp h TYR 655 CO 0.04 0.80 0.51 1.15 -1.64 0.00 0.00 178.16 179.02 3fzp h THR 656 N 0.65 1.26 -0.16 1.81 2.02 -1.04 0.24 112.91 117.69 3fzp h THR 656 Ca 0.11 -0.63 0.00 0.00 0.77 0.00 0.00 66.41 66.66 3fzp h THR 656 Cb 0.58 0.02 -0.01 0.00 -1.74 0.00 0.00 68.15 66.99 3fzp h THR 656 CO 0.04 0.29 0.10 -0.07 0.37 0.00 0.00 175.52 176.25 3fzp h LEU 657 N 1.27 0.18 -0.68 2.58 4.07 -1.15 -1.65 115.31 119.94 3fzp h LEU 657 Ca 0.32 -0.01 0.05 0.00 0.08 0.00 0.00 57.88 58.31 3fzp h LEU 657 Cb 0.01 -0.05 -0.05 0.00 1.08 0.00 0.00 40.66 41.66 3fzp h LEU 657 CO -0.05 0.14 0.40 0.24 -1.08 0.00 0.00 178.44 178.09 3fzp h MET 658 N 0.21 0.74 -0.72 1.13 2.86 -0.49 -2.09 114.93 116.56 3fzp h MET 658 Ca 0.06 -0.04 0.12 0.00 -2.06 0.00 0.00 59.70 57.78 3fzp h MET 658 Cb -0.01 -0.17 -0.09 0.00 0.06 0.00 0.00 31.60 31.39 3fzp h MET 658 CO -0.01 0.49 0.30 1.15 1.06 0.00 0.00 176.91 179.90 3fzp h THR 659 N 0.76 0.72 -0.62 2.22 2.02 -0.35 -1.51 112.91 116.15 3fzp h THR 659 Ca 0.29 -0.17 -0.08 0.00 0.77 0.00 0.00 66.41 67.23 3fzp h THR 659 Cb 0.11 0.20 -0.03 0.00 -1.74 0.00 0.00 68.15 66.70 3fzp h THR 659 CO -0.15 0.09 0.08 0.03 0.37 0.00 0.00 175.52 175.94 3fzp h ARG 660 N 0.48 1.03 -0.12 6.66 3.08 -1.00 -2.26 114.38 122.25 3fzp h ARG 660 Ca 0.38 -0.28 0.03 0.00 0.07 0.00 0.00 59.98 60.19 3fzp h ARG 660 Cb 0.52 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.45 3fzp h ARG 660 CO -0.35 0.96 0.09 0.00 -1.07 0.00 0.00 179.97 179.59 3fzp n TRP 662 N -4.48 2.25 -1.68 0.00 8.01 -0.82 -3.74 117.44 116.99 3fzp n TRP 662 Ca -0.00 -1.00 -0.45 0.00 -1.31 0.00 0.00 57.50 54.74 3fzp n TRP 662 Cb 0.21 -0.62 -0.03 0.00 -2.01 0.00 0.00 31.31 28.86 3fzp n TRP 662 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 3fzp n ASP 663 N 0.11 2.96 -0.34 -0.99 10.43 -0.92 -4.86 116.55 122.94 3fzp n ASP 663 Ca 0.35 1.12 0.06 0.00 2.57 0.00 0.00 54.79 58.89 3fzp n ASP 663 Cb 1.29 -1.44 0.24 0.00 1.84 0.00 0.00 41.12 43.04 3fzp n ASP 663 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 3fzp h TYR 664 N 4.82 1.10 -3.50 1.24 3.20 -1.92 -3.40 116.97 118.51 3fzp h TYR 664 Ca -0.45 0.03 -0.61 0.00 3.14 0.00 0.00 58.73 60.84 3fzp h TYR 664 Cb 1.26 -0.36 -0.11 0.00 1.54 0.00 0.00 36.73 39.06 3fzp h TYR 664 CO 0.59 0.51 0.32 0.34 -1.64 0.00 0.00 178.16 178.27 3fzp s ASP 665 N -5.84 6.57 0.60 -2.11 3.68 -1.26 -4.88 116.67 113.42 3fzp s ASP 665 Ca -0.12 0.46 0.32 0.00 2.13 0.00 0.00 52.55 55.34 3fzp s ASP 665 Cb 0.21 -2.38 1.90 0.00 -1.45 0.00 0.00 42.92 41.20 3fzp s ASP 665 CO 0.81 -0.63 2.26 1.55 0.13 0.00 0.00 175.17 179.28 3fzp h PRO 666 N 8.29 0.00 0.00 4.34 0.13 -1.96 -2.18 132.00 140.63 3fzp h PRO 666 Ca -0.25 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 3fzp h PRO 666 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 3fzp h PRO 666 CO 0.87 0.01 -0.26 0.77 -0.23 0.00 0.00 178.00 179.17 3fzp h SER 667 N 0.00 0.00 0.53 1.44 0.02 -1.94 -2.90 113.55 110.70 3fzp h SER 667 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3fzp h SER 667 Cb 0.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.58 3fzp h SER 667 CO 0.00 0.26 -0.47 0.47 -1.14 0.00 0.00 176.83 175.95 3fzp n ASP 668 N -3.37 0.47 -4.78 3.07 8.00 -0.82 -4.91 116.55 114.22 3fzp n ASP 668 Ca 0.00 -0.20 -0.37 0.00 0.71 0.00 0.00 54.79 54.94 3fzp n ASP 668 Cb 0.47 0.21 -0.02 0.00 -0.02 0.00 0.00 41.12 41.76 3fzp n ASP 668 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3fzp s ARG 669 N -3.00 3.96 0.97 -1.24 0.52 -1.10 -4.96 118.95 114.10 3fzp s ARG 669 Ca 0.11 1.67 -0.11 0.00 -0.52 0.00 0.00 55.73 56.88 3fzp s ARG 669 Cb 0.18 -2.49 0.18 0.00 0.52 0.00 0.00 34.95 33.34 3fzp s ARG 669 CO 0.69 -0.36 1.12 -1.25 0.02 0.00 0.00 175.30 175.52 3fzp s PRO 670 N -2.58 0.55 0.38 3.54 0.04 -1.26 -5.02 135.00 130.65 3fzp s PRO 670 Ca 0.61 1.39 -0.03 0.00 0.04 0.00 0.00 61.00 63.01 3fzp s PRO 670 Cb -0.26 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 3fzp s PRO 670 CO 0.32 -2.90 0.63 1.03 0.04 0.00 0.00 177.00 176.12 3fzp s ARG 671 N -4.60 3.54 0.49 4.56 1.81 -1.26 -4.94 118.95 118.54 3fzp s ARG 671 Ca 0.67 -0.08 0.15 0.00 -1.72 0.00 0.00 55.73 54.75 3fzp s ARG 671 Cb -0.23 -2.57 1.17 0.00 -0.45 0.00 0.00 34.95 32.87 3fzp s ARG 671 CO 0.60 0.05 2.08 0.74 -0.68 0.00 0.00 175.30 178.09 3fzp h PHE 672 N 0.79 0.17 -0.43 -0.53 0.04 -1.94 -1.28 116.94 113.77 3fzp h PHE 672 Ca -0.48 0.00 -0.13 0.00 2.80 0.00 0.00 57.97 60.16 3fzp h PHE 672 Cb 1.21 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 39.29 3fzp h PHE 672 CO 0.55 0.10 -0.22 1.79 -0.60 0.00 0.00 178.31 179.92 3fzp h THR 673 N 0.17 1.28 -0.21 -1.55 1.35 -1.91 0.53 112.91 112.57 3fzp h THR 673 Ca 0.11 -1.38 -0.12 0.00 -0.55 0.00 0.00 66.41 64.48 3fzp h THR 673 Cb 0.22 1.24 -0.01 0.00 -1.73 0.00 0.00 68.15 67.87 3fzp h THR 673 CO -0.02 0.47 -0.37 1.05 -0.25 0.00 0.00 175.52 176.40 3fzp h GLU 674 N 0.73 0.45 -0.68 4.72 4.11 -1.80 -2.94 114.58 119.17 3fzp h GLU 674 Ca 0.09 -0.21 -0.01 0.00 0.07 0.00 0.00 59.36 59.30 3fzp h GLU 674 Cb 0.79 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.00 3fzp h GLU 674 CO 0.07 0.76 0.38 -0.07 0.07 0.00 0.00 179.01 180.21 3fzp h LEU 675 N 0.38 0.84 -0.59 3.06 3.38 -0.84 -1.54 115.31 119.99 3fzp h LEU 675 Ca 0.04 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3fzp h LEU 675 Cb 0.82 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 3fzp h LEU 675 CO 0.07 0.68 0.37 0.58 0.09 0.00 0.00 178.44 180.22 3fzp h VAL 676 N 0.95 1.17 -0.16 1.22 2.07 -0.73 0.21 116.25 120.99 3fzp h VAL 676 Ca 0.24 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.40 3fzp h VAL 676 Cb 0.02 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 3fzp h VAL 676 CO -0.04 0.17 0.03 0.00 0.02 0.00 0.00 177.57 177.75 3fzp h SER 678 N 0.05 1.13 0.44 0.00 0.02 -1.11 -2.03 113.55 112.05 3fzp h SER 678 Ca 0.05 -0.12 -0.14 0.00 -0.84 0.00 0.00 61.79 60.74 3fzp h SER 678 Cb 0.28 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 3fzp h SER 678 CO 0.00 0.92 -0.62 -0.07 -1.14 0.00 0.00 176.83 175.92 3fzp h LEU 679 N 1.25 0.20 -0.72 5.07 3.38 -0.37 -1.06 115.31 123.05 3fzp h LEU 679 Ca 0.31 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.06 3fzp h LEU 679 Cb 0.07 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3fzp h LEU 679 CO -0.04 0.77 -0.08 0.28 0.09 0.00 0.00 178.44 179.45 3fzp h SER 680 N 0.13 0.89 -0.30 -0.43 0.02 -0.77 -0.57 113.55 112.52 3fzp h SER 680 Ca -0.01 -0.27 -0.02 0.00 -0.84 0.00 0.00 61.79 60.66 3fzp h SER 680 Cb 1.13 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.41 3fzp h SER 680 CO 0.09 1.00 0.11 0.44 -1.14 0.00 0.00 176.83 177.33 3fzp h ASP 681 N 0.81 0.41 -0.59 3.07 3.32 -0.82 0.24 116.42 122.86 3fzp h ASP 681 Ca 0.14 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.03 3fzp h ASP 681 Cb 0.60 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 3fzp h ASP 681 CO 0.04 0.48 0.38 0.58 -1.72 0.00 0.00 179.24 178.99 3fzp h VAL 682 N 0.33 1.11 -0.37 -1.35 2.07 -1.11 -0.03 116.25 116.89 3fzp h VAL 682 Ca 0.10 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 3fzp h VAL 682 Cb 0.20 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 3fzp h VAL 682 CO -0.01 0.14 0.16 0.22 0.02 0.00 0.00 177.57 178.10 3fzp h TYR 683 N 0.76 0.56 -0.49 1.57 3.20 -0.86 0.40 116.97 122.11 3fzp h TYR 683 Ca 0.23 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 62.00 3fzp h TYR 683 Cb -0.04 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.04 3fzp h TYR 683 CO -0.04 0.49 0.05 0.37 -1.64 0.00 0.00 178.16 177.39 3fzp h GLN 684 N 0.46 0.78 -0.53 1.82 5.75 0.28 -0.63 115.11 123.04 3fzp h GLN 684 Ca 0.13 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.40 3fzp h GLN 684 Cb 0.16 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.58 3fzp h GLN 684 CO -0.01 0.75 0.18 1.98 -2.65 0.00 0.00 178.83 179.08 3fzp h MET 685 N 0.74 0.82 -0.11 1.69 4.05 -0.67 -1.95 114.93 119.49 3fzp h MET 685 Ca 0.15 -0.17 -0.07 0.00 -0.28 0.00 0.00 59.70 59.33 3fzp h MET 685 Cb 0.37 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 3fzp h MET 685 CO 0.01 0.74 -0.26 0.93 0.23 0.00 0.00 176.91 178.56 3fzp h GLU 686 N 0.72 0.20 0.19 0.39 4.39 -0.33 0.36 114.58 120.51 3fzp h GLU 686 Ca 0.17 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.80 3fzp h GLU 686 Cb 0.26 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 3fzp h GLU 686 CO -0.01 0.46 -0.09 -0.22 -1.16 0.00 0.00 179.01 177.99 3fzp h LYS 687 N 0.18 -0.25 -0.32 2.33 3.64 -0.95 0.16 116.57 121.38 3fzp h LYS 687 Ca 0.03 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.48 3fzp h LYS 687 Cb 0.57 0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 32.39 3fzp h LYS 687 CO 0.04 0.06 -0.01 -0.44 -2.27 0.00 0.00 179.45 176.83 3fzp h ASP 688 N -0.56 -0.15 -0.85 4.20 3.32 -1.25 0.47 116.42 121.60 3fzp h ASP 688 Ca -0.03 0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.16 3fzp h ASP 688 Cb 0.42 0.14 -0.06 0.00 0.22 0.00 0.00 39.33 40.05 3fzp h ASP 688 CO 0.04 -0.04 0.52 -0.29 -1.72 0.00 0.00 179.24 177.75 3fzp h ILE 689 N 0.08 1.03 -0.43 0.35 6.09 -0.88 -1.85 117.51 121.90 3fzp h ILE 689 Ca 0.15 -0.33 -0.09 0.00 -1.37 0.00 0.00 64.86 63.22 3fzp h ILE 689 Cb 0.21 0.00 -0.02 0.00 0.47 0.00 0.00 36.82 37.48 3fzp h ILE 689 CO -0.27 0.17 -0.12 0.00 -3.07 0.00 0.00 178.15 174.87 3fzp h ALA 690 N 1.40 0.99 0.00 0.18 0.00 0.10 -3.10 119.26 118.83 3fzp h ALA 690 Ca 0.37 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fzp h ALA 690 Cb 0.18 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3fzp h ALA 690 CO -0.18 0.60 0.00 0.52 0.00 0.00 0.00 179.25 180.20 3fzp h MET 691 N 0.70 0.00 -0.00 0.00 2.86 -0.49 -3.51 114.93 114.49 3fzp h MET 691 Ca 0.12 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3fzp h MET 691 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 3fzp h MET 691 CO 0.04 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.40