#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dnl s SER 420 N 0.00 6.35 -0.66 1.61 0.01 -1.26 -4.91 113.70 114.84 2dnl s SER 420 Ca 0.00 -1.83 -0.17 0.00 1.31 0.00 0.00 55.95 55.26 2dnl s SER 420 Cb 0.00 -2.27 0.13 0.00 0.21 0.00 0.00 66.02 64.09 2dnl s SER 420 CO 0.00 -0.95 0.72 -0.55 0.41 0.00 0.00 173.24 172.88 2dnl s SER 421 N 3.34 6.34 0.87 2.44 0.15 -1.26 -4.98 113.70 120.60 2dnl s SER 421 Ca 0.13 -1.79 0.00 0.00 0.70 0.00 0.00 55.95 54.99 2dnl s SER 421 Cb -0.21 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 2dnl s SER 421 CO 0.01 -0.97 0.00 0.61 1.20 0.00 0.00 173.24 174.09 2dnl n GLY 422 N 5.06 3.05 2.72 9.45 0.00 -1.26 -4.44 105.19 119.78 2dnl n GLY 422 Ca -0.03 0.07 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 2dnl n GLY 422 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dnl s SER 423 N -4.00 0.95 -0.26 1.61 0.01 -1.26 -5.12 113.70 105.63 2dnl s SER 423 Ca 0.00 0.03 0.01 0.00 1.31 0.00 0.00 55.95 57.30 2dnl s SER 423 Cb 0.00 -0.19 0.07 0.00 0.21 0.00 0.00 66.02 66.11 2dnl s SER 423 CO 0.00 -0.20 -0.03 -0.55 0.41 0.00 0.00 173.24 172.87 2dnl s SER 424 N 1.82 4.01 0.00 2.44 0.15 -1.26 -5.08 113.70 115.78 2dnl s SER 424 Ca 0.01 -1.36 0.00 0.00 0.70 0.00 0.00 55.95 55.30 2dnl s SER 424 Cb -0.12 -1.21 0.00 0.00 -1.71 0.00 0.00 66.02 62.97 2dnl s SER 424 CO -0.03 -0.27 0.00 0.61 1.20 0.00 0.00 173.24 174.75 2dnl n GLY 425 N 4.63 1.78 3.37 9.45 0.00 -1.26 -4.76 105.19 118.40 2dnl n GLY 425 Ca -0.09 0.07 -0.16 0.00 0.00 0.00 0.00 46.02 45.84 2dnl n GLY 425 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dnl s SER 426 N -2.91 1.09 0.10 1.61 0.15 -1.26 -4.83 113.70 107.66 2dnl s SER 426 Ca 0.00 -1.56 0.01 0.00 0.70 0.00 0.00 55.95 55.10 2dnl s SER 426 Cb 0.00 0.58 -0.22 0.00 -1.71 0.00 0.00 66.02 64.67 2dnl s SER 426 CO 0.00 -1.13 1.22 0.03 1.20 0.00 0.00 173.24 174.56 2dnl h ARG 427 N 2.19 0.16 -6.86 5.44 3.08 -1.86 -3.46 114.38 113.08 2dnl h ARG 427 Ca -0.28 -0.25 -0.54 0.00 0.07 0.00 0.00 59.98 58.98 2dnl h ARG 427 Cb 1.24 0.09 0.10 0.00 0.08 0.00 0.00 29.97 31.48 2dnl h ARG 427 CO 0.39 1.10 0.80 1.17 -1.07 0.00 0.00 179.97 182.36 2dnl n LYS 428 N -3.48 2.64 -4.85 0.04 4.81 -1.25 -3.71 118.16 112.36 2dnl n LYS 428 Ca -0.05 0.93 -0.25 0.00 -0.87 0.00 0.00 58.31 58.07 2dnl n LYS 428 Cb 0.96 -2.67 -0.16 0.00 0.02 0.00 0.00 35.03 33.19 2dnl n LYS 428 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2dnl s VAL 429 N -0.63 1.42 -0.40 3.15 1.01 0.22 -1.64 120.40 123.53 2dnl s VAL 429 Ca 0.58 -0.74 -0.16 0.00 0.00 0.00 0.00 61.98 61.66 2dnl s VAL 429 Cb -0.49 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 34.71 2dnl s VAL 429 CO 0.57 0.40 0.36 0.12 0.00 0.00 0.00 175.10 176.55 2dnl s PHE 430 N -0.24 3.21 -0.25 5.22 5.36 -0.53 -0.30 117.98 130.45 2dnl s PHE 430 Ca 0.03 -0.39 -0.06 0.00 -0.96 0.00 0.00 56.93 55.55 2dnl s PHE 430 Cb -0.09 -2.71 -0.02 0.00 -0.34 0.00 0.00 43.02 39.87 2dnl s PHE 430 CO 0.00 -0.59 0.03 0.08 -1.46 0.00 0.00 175.22 173.29 2dnl s VAL 431 N 1.91 3.91 0.19 3.12 1.01 -0.38 -0.82 120.40 129.33 2dnl s VAL 431 Ca 0.09 -0.37 0.10 0.00 0.00 0.00 0.00 61.98 61.80 2dnl s VAL 431 Cb -0.18 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 2dnl s VAL 431 CO 0.12 0.33 -0.14 -0.83 0.00 0.00 0.00 175.10 174.58 2dnl s GLY 432 N 1.55 1.73 -0.01 4.51 0.00 -0.83 -1.09 107.32 113.17 2dnl s GLY 432 Ca 0.06 -1.54 -0.00 0.00 0.00 0.00 0.00 44.72 43.24 2dnl s GLY 432 CO 0.01 -1.57 0.01 0.61 0.00 0.00 0.00 173.10 172.17 2dnl n GLY 433 N 0.05 0.78 3.79 0.20 0.00 0.11 -1.95 105.19 108.17 2dnl n GLY 433 Ca -0.11 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 2dnl n GLY 433 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dnl s LEU 434 N -1.38 4.45 0.41 0.99 1.43 -1.24 -4.67 118.68 118.68 2dnl s LEU 434 Ca 0.00 1.59 -0.23 0.00 -1.03 0.00 0.00 54.13 54.46 2dnl s LEU 434 Cb -0.00 -3.54 -0.12 0.00 0.03 0.00 0.00 46.19 42.55 2dnl s LEU 434 CO 0.01 0.09 0.68 -2.65 0.23 0.00 0.00 176.35 174.70 2dnl n PRO 435 N 1.06 0.76 0.00 1.29 -0.02 -1.26 -4.36 135.00 132.47 2dnl n PRO 435 Ca -0.03 0.28 0.15 0.00 -2.02 0.00 0.00 63.50 61.88 2dnl n PRO 435 Cb 0.50 -1.64 0.88 0.00 -0.02 0.00 0.00 33.50 33.22 2dnl n PRO 435 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2dnl n PRO 436 N 0.46 1.00 -2.14 0.52 -0.04 -1.26 -3.43 135.00 130.11 2dnl n PRO 436 Ca 0.11 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.54 2dnl n PRO 436 Cb 0.39 -1.47 0.05 0.00 -0.04 0.00 0.00 33.50 32.44 2dnl n PRO 436 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dnl n ASP 437 N -0.97 2.12 -4.39 3.54 8.00 -1.26 -5.07 116.55 118.53 2dnl n ASP 437 Ca 0.22 -2.55 -0.32 0.00 0.71 0.00 0.00 54.79 52.85 2dnl n ASP 437 Cb 0.10 -0.41 -0.14 0.00 -0.02 0.00 0.00 41.12 40.64 2dnl n ASP 437 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2dnl s ILE 438 N -3.01 2.80 0.53 0.53 2.07 -1.22 -4.82 121.20 118.07 2dnl s ILE 438 Ca 0.35 -0.79 0.05 0.00 -1.41 0.00 0.00 60.65 58.84 2dnl s ILE 438 Cb 0.36 -2.11 0.05 0.00 0.13 0.00 0.00 42.46 40.89 2dnl s ILE 438 CO -0.06 0.56 0.73 -1.81 -1.91 0.00 0.00 174.94 172.46 2dnl s ASP 439 N -0.23 5.25 0.00 4.50 1.11 -1.26 -4.20 116.67 121.84 2dnl s ASP 439 Ca 0.00 -0.39 0.00 0.00 0.18 0.00 0.00 52.55 52.34 2dnl s ASP 439 Cb -0.13 -0.43 0.00 0.00 1.07 0.00 0.00 42.92 43.43 2dnl s ASP 439 CO 0.03 -1.15 1.00 1.21 1.18 0.00 0.00 175.17 177.44 2dnl n GLU 440 N -2.21 0.00 -0.31 8.23 2.13 -1.26 -2.32 120.64 124.90 2dnl n GLU 440 Ca 0.11 0.67 -0.02 0.00 0.66 0.00 0.00 57.16 58.58 2dnl n GLU 440 Cb 0.60 -1.50 0.02 0.00 0.27 0.00 0.00 31.44 30.83 2dnl n GLU 440 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2dnl n ASP 441 N -2.34 -0.55 -0.20 4.31 9.92 -1.26 0.14 116.55 126.57 2dnl n ASP 441 Ca 0.00 1.38 -0.10 0.00 -0.53 0.00 0.00 54.79 55.55 2dnl n ASP 441 Cb 0.00 -0.30 -0.05 0.00 -0.64 0.00 0.00 41.12 40.13 2dnl n ASP 441 CO 0.00 0.00 0.00 -0.33 0.13 0.00 0.00 177.20 177.00 2dnl h GLU 442 N 0.00 -0.24 -0.82 -1.24 4.39 -1.91 0.13 114.58 114.89 2dnl h GLU 442 Ca 0.26 0.02 0.18 0.00 0.34 0.00 0.00 59.36 60.15 2dnl h GLU 442 Cb 0.46 0.06 -0.11 0.00 -0.10 0.00 0.00 28.75 29.05 2dnl h GLU 442 CO -0.78 -0.16 0.30 0.82 -1.16 0.00 0.00 179.01 178.03 2dnl h ILE 443 N -0.25 0.54 0.21 3.13 2.04 0.11 -1.46 117.51 121.83 2dnl h ILE 443 Ca 0.16 -0.13 0.01 0.00 1.00 0.00 0.00 64.86 65.90 2dnl h ILE 443 Cb 0.56 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2dnl h ILE 443 CO -0.68 0.07 -0.29 0.74 0.00 0.00 0.00 178.15 177.99 2dnl h THR 444 N 0.38 0.39 -0.79 -0.27 2.02 -0.25 -2.33 112.91 112.05 2dnl h THR 444 Ca 0.48 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.80 2dnl h THR 444 Cb 0.83 0.39 -0.10 0.00 -1.74 0.00 0.00 68.15 67.53 2dnl h THR 444 CO -0.49 0.00 0.35 0.00 0.37 0.00 0.00 175.52 175.75 2dnl h ALA 445 N 0.08 1.16 -0.39 6.16 0.00 -0.46 0.66 119.26 126.46 2dnl h ALA 445 Ca 0.01 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.09 2dnl h ALA 445 Cb 0.54 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2dnl h ALA 445 CO -0.11 -0.17 0.27 0.77 0.00 0.00 0.00 179.25 180.00 2dnl h SER 446 N 0.51 0.23 -0.38 0.00 0.02 -0.86 -2.21 113.55 110.86 2dnl h SER 446 Ca 0.44 0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 61.11 2dnl h SER 446 Cb 0.65 -0.05 -0.24 0.00 0.14 0.00 0.00 62.40 62.90 2dnl h SER 446 CO -0.39 0.15 -0.71 0.49 -1.14 0.00 0.00 176.83 175.23 2dnl n PHE 447 N -4.47 1.36 -0.12 3.45 3.01 0.59 -4.72 117.46 116.56 2dnl n PHE 447 Ca 0.05 -1.83 -0.22 0.00 1.01 0.00 0.00 57.45 56.46 2dnl n PHE 447 Cb 0.27 -0.29 -0.11 0.00 -0.01 0.00 0.00 39.48 39.34 2dnl n PHE 447 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 2dnl n ARG 448 N -0.83 0.64 -0.32 -1.08 3.00 0.20 -4.41 116.66 113.86 2dnl n ARG 448 Ca 0.30 0.21 0.20 0.00 -0.00 0.00 0.00 57.85 58.56 2dnl n ARG 448 Cb 0.85 -1.53 0.39 0.00 0.00 0.00 0.00 32.46 32.16 2dnl n ARG 448 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2dnl n ARG 449 N -3.64 -0.07 -0.31 -0.14 1.85 -1.26 0.19 116.66 113.28 2dnl n ARG 449 Ca -0.47 1.38 -0.04 0.00 -1.00 0.00 0.00 57.85 57.72 2dnl n ARG 449 Cb 0.95 -2.30 0.08 0.00 -1.05 0.00 0.00 32.46 30.14 2dnl n ARG 449 CO 0.00 0.00 0.00 0.74 -0.01 0.00 0.00 177.63 178.36 2dnl h PHE 450 N 0.00 1.09 0.00 2.89 0.04 -1.93 -3.48 116.94 115.55 2dnl h PHE 450 Ca 0.66 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.44 2dnl h PHE 450 Cb 1.55 -0.36 0.00 0.00 2.20 0.00 0.00 35.95 39.34 2dnl h PHE 450 CO -0.30 0.72 0.00 0.41 -0.60 0.00 0.00 178.31 178.54 2dnl n GLY 451 N -1.23 -1.42 3.66 -1.45 0.00 0.49 -4.86 105.19 100.38 2dnl n GLY 451 Ca 0.09 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.55 2dnl n GLY 451 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dnl s PRO 452 N -1.53 4.26 0.27 1.61 0.04 -1.26 -4.38 135.00 134.00 2dnl s PRO 452 Ca 0.00 1.61 0.06 0.00 0.04 0.00 0.00 61.00 62.71 2dnl s PRO 452 Cb 0.00 -3.71 -0.02 0.00 0.04 0.00 0.00 34.50 30.81 2dnl s PRO 452 CO 0.00 -0.65 0.22 1.47 0.04 0.00 0.00 177.00 178.08 2dnl n LEU 453 N 6.31 0.00 -3.81 -3.56 -0.00 -1.26 -1.14 117.00 113.55 2dnl n LEU 453 Ca 0.13 -2.51 -0.14 0.00 -0.00 0.00 0.00 56.01 53.50 2dnl n LEU 453 Cb 0.45 1.30 -0.15 0.00 -0.00 0.00 0.00 43.42 45.03 2dnl n LEU 453 CO 0.55 -0.41 -0.33 0.54 -0.00 0.00 0.00 177.39 177.74 2dnl s VAL 454 N -3.06 -0.03 -0.39 1.47 0.11 -1.21 -4.92 120.40 112.37 2dnl s VAL 454 Ca 0.31 0.12 -0.22 0.00 -2.93 0.00 0.00 61.98 59.26 2dnl s VAL 454 Cb 0.02 -0.09 0.01 0.00 -1.53 0.00 0.00 36.38 34.79 2dnl s VAL 454 CO 0.22 0.05 0.71 -0.69 -3.33 0.00 0.00 175.10 172.05 2dnl s VAL 455 N 0.64 4.79 -0.28 2.04 1.01 -1.26 -2.07 120.40 125.26 2dnl s VAL 455 Ca -0.05 0.58 0.00 0.00 0.00 0.00 0.00 61.98 62.51 2dnl s VAL 455 Cb -0.07 -4.18 0.09 0.00 0.00 0.00 0.00 36.38 32.22 2dnl s VAL 455 CO -0.02 -0.46 0.04 1.51 0.00 0.00 0.00 175.10 176.17 2dnl s ASP 456 N 1.90 3.99 0.18 3.32 -4.77 0.20 -4.99 116.67 116.50 2dnl s ASP 456 Ca 0.27 -1.52 0.02 0.00 -3.30 0.00 0.00 52.55 48.02 2dnl s ASP 456 Cb -0.14 -1.06 -0.04 0.00 -1.09 0.00 0.00 42.92 40.60 2dnl s ASP 456 CO 0.17 -0.35 0.32 -1.66 0.70 0.00 0.00 175.17 174.35 2dnl s TRP 457 N 1.46 3.48 0.63 2.11 -2.14 -1.26 -0.85 118.94 122.36 2dnl s TRP 457 Ca 0.05 0.13 -0.15 0.00 2.66 0.00 0.00 56.10 58.79 2dnl s TRP 457 Cb -0.18 -1.68 -0.02 0.00 -3.10 0.00 0.00 33.47 28.49 2dnl s TRP 457 CO -0.15 0.48 1.07 -1.25 -2.66 0.00 0.00 176.95 174.44 2dnl s PRO 458 N -3.39 3.10 -1.33 3.25 0.04 -1.26 -3.69 135.00 131.71 2dnl s PRO 458 Ca 0.35 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.60 2dnl s PRO 458 Cb -0.11 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.43 2dnl s PRO 458 CO 0.29 -0.99 0.18 0.72 0.04 0.00 0.00 177.00 177.24 2dnl n HIS 459 N -2.31 -1.07 -0.02 0.56 8.25 -1.26 -4.84 115.22 114.53 2dnl n HIS 459 Ca 0.09 0.16 -0.16 0.00 -0.26 0.00 0.00 57.72 57.55 2dnl n HIS 459 Cb 0.53 -3.50 -0.13 0.00 1.12 0.00 0.00 29.99 28.01 2dnl n HIS 459 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 2dnl h LYS 460 N -0.42 0.13 -0.33 -0.41 1.63 -1.87 -2.95 116.57 112.35 2dnl h LYS 460 Ca -0.40 -0.21 0.03 0.00 -0.85 0.00 0.00 60.65 59.23 2dnl h LYS 460 Cb 1.29 0.07 -0.05 0.00 -0.60 0.00 0.00 32.23 32.94 2dnl h LYS 460 CO 0.45 1.07 -0.32 0.00 -3.45 0.00 0.00 179.45 177.20 2dnl h ALA 461 N 0.08 -0.50 -0.36 5.00 0.00 -1.91 -1.63 119.26 119.93 2dnl h ALA 461 Ca -0.05 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2dnl h ALA 461 Cb 1.22 1.02 -0.04 0.00 0.00 0.00 0.00 17.79 20.00 2dnl h ALA 461 CO 0.06 -0.68 0.15 0.93 0.00 0.00 0.00 179.25 179.71 2dnl h GLU 462 N -0.17 0.30 -5.50 0.00 5.08 -1.99 -3.33 114.58 108.98 2dnl h GLU 462 Ca 0.05 -0.02 -0.31 0.00 -1.00 0.00 0.00 59.36 58.08 2dnl h GLU 462 Cb 0.31 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 2dnl h GLU 462 CO -0.39 0.20 0.98 0.45 -1.00 0.00 0.00 179.01 179.25 2dnl s SER 463 N -5.39 5.00 0.53 1.42 0.15 -0.61 -4.73 113.70 110.07 2dnl s SER 463 Ca -0.13 -1.48 0.20 0.00 0.70 0.00 0.00 55.95 55.24 2dnl s SER 463 Cb 0.12 -2.58 1.34 0.00 -1.71 0.00 0.00 66.02 63.18 2dnl s SER 463 CO 0.71 -3.08 2.11 0.07 1.20 0.00 0.00 173.24 174.25 2dnl h LYS 464 N 10.04 0.00 -6.90 5.44 5.09 -1.70 -3.43 116.57 125.12 2dnl h LYS 464 Ca 0.19 0.00 -0.53 0.00 0.09 0.00 0.00 60.65 60.40 2dnl h LYS 464 Cb 0.95 0.00 0.09 0.00 0.10 0.00 0.00 32.23 33.37 2dnl h LYS 464 CO 1.21 0.00 0.73 -1.12 -2.09 0.00 0.00 179.45 178.18 2dnl s SER 465 N -6.75 6.54 -0.07 7.07 0.01 -1.26 -4.87 113.70 114.36 2dnl s SER 465 Ca -0.05 2.88 -0.02 0.00 1.31 0.00 0.00 55.95 60.07 2dnl s SER 465 Cb 0.18 -2.66 -0.03 0.00 0.21 0.00 0.00 66.02 63.72 2dnl s SER 465 CO 0.68 -0.73 2.41 0.00 0.41 0.00 0.00 173.24 176.01 2dnl n TYR 466 N 0.78 0.31 -3.95 2.43 4.11 -1.26 -4.76 117.16 114.81 2dnl n TYR 466 Ca 0.01 -1.31 -0.29 0.00 -0.00 0.00 0.00 57.90 56.31 2dnl n TYR 466 Cb 0.40 -0.86 -0.16 0.00 -0.00 0.00 0.00 39.34 38.72 2dnl n TYR 466 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.86 176.80 2dnl s PHE 467 N -0.14 2.02 1.04 -3.48 0.08 -1.26 -4.51 117.98 111.74 2dnl s PHE 467 Ca 0.23 -1.26 -0.24 0.00 0.12 0.00 0.00 56.93 55.78 2dnl s PHE 467 Cb 0.13 -1.47 -0.09 0.00 -0.57 0.00 0.00 43.02 41.02 2dnl s PHE 467 CO -0.01 -0.66 -0.95 -2.30 -0.10 0.00 0.00 175.22 171.20 2dnl n PRO 468 N 4.79 -0.56 -1.69 0.24 -0.02 -1.26 -4.98 135.00 131.53 2dnl n PRO 468 Ca -0.14 -0.16 -0.30 0.00 -2.02 0.00 0.00 63.50 60.88 2dnl n PRO 468 Cb 0.48 -1.26 0.22 0.00 -0.02 0.00 0.00 33.50 32.92 2dnl n PRO 468 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2dnl s PRO 469 N -2.53 -0.24 0.15 0.52 0.04 -1.26 -4.91 135.00 126.77 2dnl s PRO 469 Ca 0.44 -0.44 -0.14 0.00 0.04 0.00 0.00 61.00 60.90 2dnl s PRO 469 Cb 0.01 -1.75 0.13 0.00 0.04 0.00 0.00 34.50 32.94 2dnl s PRO 469 CO 0.67 -3.00 1.07 1.63 0.04 0.00 0.00 177.00 177.41 2dnl n LYS 470 N -4.17 -0.19 0.00 4.56 4.01 -1.26 -4.39 118.16 116.72 2dnl n LYS 470 Ca 0.16 1.06 0.00 0.00 -0.51 0.00 0.00 58.31 59.03 2dnl n LYS 470 Cb 0.59 -1.57 0.00 0.00 -0.51 0.00 0.00 35.03 33.54 2dnl n LYS 470 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2dnl n GLY 471 N -1.30 -1.96 3.33 0.72 0.00 -1.26 -4.54 105.19 100.18 2dnl n GLY 471 Ca 0.06 0.93 0.02 0.00 0.00 0.00 0.00 46.02 47.03 2dnl n GLY 471 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dnl s TYR 472 N 0.00 -0.34 0.25 1.61 -0.85 -1.26 -0.71 117.35 116.05 2dnl s TYR 472 Ca 0.00 0.61 -0.04 0.00 -0.52 0.00 0.00 57.07 57.12 2dnl s TYR 472 Cb 0.00 0.21 -0.02 0.00 0.38 0.00 0.00 41.96 42.52 2dnl s TYR 472 CO 0.00 -0.17 0.31 0.00 -1.52 0.00 0.00 175.55 174.17 2dnl s ALA 473 N 2.08 0.72 -0.11 9.51 0.00 -0.25 -4.44 121.76 129.27 2dnl s ALA 473 Ca -0.02 -1.45 0.03 0.00 0.00 0.00 0.00 51.96 50.53 2dnl s ALA 473 Cb -0.03 1.26 0.01 0.00 0.00 0.00 0.00 23.12 24.36 2dnl s ALA 473 CO -0.16 -0.71 -0.21 -0.06 0.00 0.00 0.00 175.76 174.61 2dnl s PHE 474 N -3.88 2.42 -0.21 0.00 0.40 -0.03 -1.25 117.98 115.43 2dnl s PHE 474 Ca 0.33 -1.05 -0.08 0.00 -0.60 0.00 0.00 56.93 55.52 2dnl s PHE 474 Cb 0.03 -1.64 -0.04 0.00 0.51 0.00 0.00 43.02 41.88 2dnl s PHE 474 CO 0.14 -0.46 0.08 -0.51 0.70 0.00 0.00 175.22 175.18 2dnl s LEU 475 N 0.54 3.77 -0.84 -0.37 1.43 0.58 -0.62 118.68 123.18 2dnl s LEU 475 Ca -0.15 0.01 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 2dnl s LEU 475 Cb -0.17 -1.98 0.21 0.00 0.03 0.00 0.00 46.19 44.28 2dnl s LEU 475 CO 0.05 0.10 0.72 -0.76 0.23 0.00 0.00 176.35 176.69 2dnl s LEU 476 N 0.82 5.67 0.13 1.79 1.43 -0.88 0.73 118.68 128.37 2dnl s LEU 476 Ca 0.04 -3.37 -0.32 0.00 -1.03 0.00 0.00 54.13 49.45 2dnl s LEU 476 Cb -0.13 -1.95 -0.11 0.00 0.03 0.00 0.00 46.19 44.02 2dnl s LEU 476 CO 0.02 -0.28 1.79 0.49 0.23 0.00 0.00 176.35 178.60 2dnl n PHE 477 N 2.84 2.60 -0.13 0.29 3.72 -1.24 -3.31 117.46 122.23 2dnl n PHE 477 Ca 0.17 -0.05 -0.09 0.00 -0.05 0.00 0.00 57.45 57.43 2dnl n PHE 477 Cb 0.38 -2.69 -0.07 0.00 -0.94 0.00 0.00 39.48 36.16 2dnl n PHE 477 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 2dnl h GLN 478 N 7.89 -0.22 -6.29 -1.08 1.08 -1.49 -3.42 115.11 111.58 2dnl h GLN 478 Ca -0.46 0.01 -0.46 0.00 -1.45 0.00 0.00 58.65 56.30 2dnl h GLN 478 Cb 1.22 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 28.70 2dnl h GLN 478 CO 0.94 -0.14 -0.36 -1.21 -0.95 0.00 0.00 178.83 177.11 2dnl s GLU 479 N -4.77 3.34 -0.03 1.46 0.41 -1.26 -5.04 118.70 112.81 2dnl s GLU 479 Ca -0.09 -0.76 -0.22 0.00 -0.41 0.00 0.00 54.97 53.49 2dnl s GLU 479 Cb 0.06 -2.83 -0.24 0.00 -1.78 0.00 0.00 34.13 29.34 2dnl s GLU 479 CO 0.42 0.26 1.04 0.93 -0.49 0.00 0.00 175.26 177.41 2dnl h GLU 480 N 1.00 0.29 -0.76 1.61 5.08 -1.98 -3.33 114.58 116.49 2dnl h GLU 480 Ca -0.50 -0.33 0.12 0.00 -1.00 0.00 0.00 59.36 57.65 2dnl h GLU 480 Cb 1.24 0.10 -0.12 0.00 0.50 0.00 0.00 28.75 30.46 2dnl h GLU 480 CO 0.59 1.05 -0.29 0.43 -1.00 0.00 0.00 179.01 179.78 2dnl n SER 481 N -4.33 -0.48 -0.29 1.42 7.64 -1.26 0.13 113.62 116.45 2dnl n SER 481 Ca -0.10 1.33 0.05 0.00 1.01 0.00 0.00 58.87 61.16 2dnl n SER 481 Cb 0.62 -0.31 0.15 0.00 -1.01 0.00 0.00 64.21 63.66 2dnl n SER 481 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dnl h SER 482 N 0.00 -0.58 -0.89 6.43 4.64 -1.90 0.16 113.55 121.40 2dnl h SER 482 Ca 0.27 0.23 0.21 0.00 -0.47 0.00 0.00 61.79 62.03 2dnl h SER 482 Cb 0.46 0.45 -0.17 0.00 -0.31 0.00 0.00 62.40 62.84 2dnl h SER 482 CO -0.76 -0.25 -0.08 0.58 -0.87 0.00 0.00 176.83 175.45 2dnl h VAL 483 N 0.04 0.13 0.29 0.95 2.07 0.82 0.22 116.25 120.76 2dnl h VAL 483 Ca 0.43 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.93 2dnl h VAL 483 Cb 0.73 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.61 2dnl h VAL 483 CO -0.80 0.01 -0.14 -0.61 0.02 0.00 0.00 177.57 176.05 2dnl h GLN 484 N 0.03 -0.38 -0.98 1.57 5.75 -0.72 -1.97 115.11 118.41 2dnl h GLN 484 Ca 0.48 0.03 0.15 0.00 -0.15 0.00 0.00 58.65 59.16 2dnl h GLN 484 Cb 0.86 0.09 -0.09 0.00 1.07 0.00 0.00 27.48 29.41 2dnl h GLN 484 CO -0.86 -0.18 0.61 0.00 -2.65 0.00 0.00 178.83 175.76 2dnl h ALA 485 N 0.19 1.67 0.41 3.38 0.00 -0.67 -1.69 119.26 122.54 2dnl h ALA 485 Ca -0.04 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 2dnl h ALA 485 Cb 0.37 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2dnl h ALA 485 CO 0.07 0.04 -0.20 1.25 0.00 0.00 0.00 179.25 180.41 2dnl h LEU 486 N 0.84 -0.46 -0.01 0.00 5.85 -0.44 -2.69 115.31 118.40 2dnl h LEU 486 Ca 0.51 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 59.20 2dnl h LEU 486 Cb 0.70 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.80 2dnl h LEU 486 CO -0.29 -0.21 -0.43 0.40 -0.34 0.00 0.00 178.44 177.57 2dnl h ILE 487 N -0.70 0.14 -1.05 4.05 2.04 -0.75 0.30 117.51 121.54 2dnl h ILE 487 Ca -0.06 0.00 0.30 0.00 1.00 0.00 0.00 64.86 66.11 2dnl h ILE 487 Cb 0.50 0.14 -0.13 0.00 -0.74 0.00 0.00 36.82 36.59 2dnl h ILE 487 CO 0.09 0.00 0.63 -0.78 0.00 0.00 0.00 178.15 178.09 2dnl h ASP 488 N -0.58 0.51 0.09 1.72 3.58 -1.35 0.31 116.42 120.70 2dnl h ASP 488 Ca 0.05 0.15 -0.26 0.00 0.42 0.00 0.00 57.03 57.39 2dnl h ASP 488 Cb 0.66 0.08 0.02 0.00 1.72 0.00 0.00 39.33 41.81 2dnl h ASP 488 CO -0.32 -0.04 -1.02 0.00 -2.88 0.00 0.00 179.24 174.98 2dnl h ALA 489 N 1.75 0.19 -2.01 -0.78 0.00 -0.78 -3.43 119.26 114.19 2dnl h ALA 489 Ca 0.69 -0.70 -0.57 0.00 0.00 0.00 0.00 54.91 54.33 2dnl h ALA 489 Cb 1.63 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.44 2dnl h ALA 489 CO -0.49 0.72 1.24 0.00 0.00 0.00 0.00 179.25 180.72 2dnl n LEU 491 N 9.43 0.00 -3.82 0.00 4.77 -0.71 -4.43 117.00 122.25 2dnl n LEU 491 Ca 0.22 -0.41 -0.12 0.00 -0.03 0.00 0.00 56.01 55.67 2dnl n LEU 491 Cb 0.45 -0.61 -0.12 0.00 -2.33 0.00 0.00 43.42 40.81 2dnl n LEU 491 CO 0.66 -2.24 -0.16 -0.70 -1.33 0.00 0.00 177.39 173.63 2dnl s GLU 492 N -3.39 0.28 0.00 3.23 2.12 -1.26 -1.51 118.70 118.18 2dnl s GLU 492 Ca 0.31 0.11 0.00 0.00 0.36 0.00 0.00 54.97 55.75 2dnl s GLU 492 Cb -0.06 0.13 0.00 0.00 0.26 0.00 0.00 34.13 34.46 2dnl s GLU 492 CO 0.26 -0.05 0.00 -1.91 -0.54 0.00 0.00 175.26 173.02 2dnl n GLU 493 N 2.62 0.00 -3.36 4.30 2.13 -0.91 -4.98 120.64 120.45 2dnl n GLU 493 Ca -0.15 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.41 2dnl n GLU 493 Cb 0.58 0.00 -0.08 0.00 0.27 0.00 0.00 31.44 32.21 2dnl n GLU 493 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2dnl n ASP 494 N -2.02 2.54 0.00 4.31 2.03 -1.26 -4.87 116.55 117.29 2dnl n ASP 494 Ca 0.00 -3.18 0.00 0.00 0.52 0.00 0.00 54.79 52.13 2dnl n ASP 494 Cb 0.00 -0.66 0.00 0.00 -0.72 0.00 0.00 41.12 39.74 2dnl n ASP 494 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dnl n GLY 495 N 1.09 2.59 3.95 0.27 0.00 -1.26 -4.97 105.19 106.86 2dnl n GLY 495 Ca 0.27 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.04 2dnl n GLY 495 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dnl s LYS 496 N -0.01 3.46 0.56 1.61 1.02 -1.26 -5.11 119.74 120.01 2dnl s LYS 496 Ca 0.00 -0.59 0.04 0.00 0.02 0.00 0.00 55.97 55.43 2dnl s LYS 496 Cb 0.00 -2.90 0.06 0.00 -0.52 0.00 0.00 37.83 34.47 2dnl s LYS 496 CO 0.00 0.44 0.77 -0.51 -0.92 0.00 0.00 175.35 175.14 2dnl s LEU 497 N -3.58 3.28 -0.30 3.17 1.43 -1.26 -2.13 118.68 119.28 2dnl s LEU 497 Ca 0.35 -0.31 -0.10 0.00 -1.03 0.00 0.00 54.13 53.05 2dnl s LEU 497 Cb -0.10 -2.45 0.14 0.00 0.03 0.00 0.00 46.19 43.81 2dnl s LEU 497 CO 0.29 -1.23 0.68 -0.31 0.23 0.00 0.00 176.35 176.01 2dnl s TYR 498 N -2.73 -1.31 -0.02 0.29 2.02 -0.57 -3.97 117.35 111.06 2dnl s TYR 498 Ca 0.59 2.19 0.02 0.00 -0.37 0.00 0.00 57.07 59.50 2dnl s TYR 498 Cb -0.09 0.75 -0.03 0.00 -0.40 0.00 0.00 41.96 42.20 2dnl s TYR 498 CO 0.38 -0.66 -0.05 -1.17 -1.57 0.00 0.00 175.55 172.49 2dnl s LEU 499 N 2.86 3.29 -0.20 -1.29 2.96 -0.85 -1.73 118.68 123.71 2dnl s LEU 499 Ca -0.04 -0.06 -0.15 0.00 -0.22 0.00 0.00 54.13 53.67 2dnl s LEU 499 Cb -0.12 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.70 2dnl s LEU 499 CO -0.19 0.31 0.35 0.00 -1.32 0.00 0.00 176.35 175.50 2dnl s VAL 501 N 1.14 1.96 -0.22 0.00 -7.23 0.05 -4.81 120.40 111.28 2dnl s VAL 501 Ca 0.17 -0.88 -0.13 0.00 -1.81 0.00 0.00 61.98 59.33 2dnl s VAL 501 Cb -0.14 -1.77 -0.05 0.00 0.56 0.00 0.00 36.38 34.98 2dnl s VAL 501 CO 0.07 0.52 0.26 -0.94 -0.31 0.00 0.00 175.10 174.70 2dnl s SER 502 N 1.28 6.27 0.04 4.85 1.04 -1.26 -0.39 113.70 125.52 2dnl s SER 502 Ca 0.04 0.30 0.08 0.00 0.48 0.00 0.00 55.95 56.85 2dnl s SER 502 Cb -0.13 -2.16 -0.03 0.00 0.10 0.00 0.00 66.02 63.81 2dnl s SER 502 CO -0.11 0.02 -0.23 -0.94 0.98 0.00 0.00 173.24 172.96 2dnl s SER 503 N 0.96 2.76 0.65 7.02 1.04 0.72 -4.92 113.70 121.93 2dnl s SER 503 Ca 0.12 -0.54 0.13 0.00 0.48 0.00 0.00 55.95 56.14 2dnl s SER 503 Cb -0.14 -0.25 0.69 0.00 0.10 0.00 0.00 66.02 66.42 2dnl s SER 503 CO 0.05 0.21 1.38 -0.65 0.98 0.00 0.00 173.24 175.21 2dnl h PRO 504 N 4.90 0.00 0.00 4.02 0.11 -1.98 -2.22 132.00 136.84 2dnl h PRO 504 Ca -0.44 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.59 2dnl h PRO 504 Cb 1.15 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 2dnl h PRO 504 CO 0.44 0.00 -1.12 0.25 -0.21 0.00 0.00 178.00 177.36 2dnl n THR 505 N -2.63 1.40 -3.90 -1.15 -2.24 -1.26 -5.01 114.28 99.49 2dnl n THR 505 Ca -0.01 0.08 -0.35 0.00 -2.27 0.00 0.00 64.05 61.51 2dnl n THR 505 Cb 0.73 -2.11 -0.05 0.00 -2.10 0.00 0.00 70.33 66.79 2dnl n THR 505 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2dnl s ILE 506 N -2.66 5.45 0.99 2.28 -1.09 -0.83 -5.10 121.20 120.23 2dnl s ILE 506 Ca -0.25 -0.04 -0.13 0.00 -2.23 0.00 0.00 60.65 58.00 2dnl s ILE 506 Cb 0.05 -3.48 0.18 0.00 -1.58 0.00 0.00 42.46 37.63 2dnl s ILE 506 CO 0.36 0.43 1.12 -0.54 -1.23 0.00 0.00 174.94 175.08 2dnl s LYS 507 N -1.62 0.52 -0.84 2.79 -0.14 -1.26 -0.20 119.74 118.99 2dnl s LYS 507 Ca 0.23 0.31 -0.32 0.00 -1.36 0.00 0.00 55.97 54.83 2dnl s LYS 507 Cb -0.12 -1.76 -0.19 0.00 -1.68 0.00 0.00 37.83 34.07 2dnl s LYS 507 CO 0.14 -2.63 2.57 -0.25 -0.76 0.00 0.00 175.35 174.42 2dnl n ASP 508 N -4.07 0.69 -4.77 2.83 8.00 -1.24 -4.49 116.55 113.50 2dnl n ASP 508 Ca 0.07 0.16 -0.36 0.00 0.71 0.00 0.00 54.79 55.38 2dnl n ASP 508 Cb 0.58 -1.02 -0.07 0.00 -0.02 0.00 0.00 41.12 40.59 2dnl n ASP 508 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2dnl s LYS 509 N 8.41 3.99 -1.15 -1.24 2.47 0.48 -4.68 119.74 128.02 2dnl s LYS 509 Ca 1.28 -0.20 -0.21 0.00 -1.56 0.00 0.00 55.97 55.29 2dnl s LYS 509 Cb -1.13 -3.36 0.05 0.00 -1.46 0.00 0.00 37.83 31.93 2dnl s LYS 509 CO 0.48 0.43 1.62 -1.25 0.16 0.00 0.00 175.35 176.79 2dnl s PRO 510 N -0.00 3.69 0.30 4.03 0.04 -1.26 -0.77 135.00 141.03 2dnl s PRO 510 Ca 0.10 -1.50 -0.28 0.00 0.04 0.00 0.00 61.00 59.36 2dnl s PRO 510 Cb -0.11 -5.43 -0.09 0.00 0.04 0.00 0.00 34.50 28.91 2dnl s PRO 510 CO -0.00 -2.35 1.02 0.14 0.04 0.00 0.00 177.00 175.85 2dnl s VAL 511 N 5.08 3.80 -0.37 -0.36 -7.23 0.49 -4.78 120.40 117.03 2dnl s VAL 511 Ca 0.52 1.66 -0.29 0.00 -1.81 0.00 0.00 61.98 62.06 2dnl s VAL 511 Cb 0.02 -4.00 0.02 0.00 0.56 0.00 0.00 36.38 32.98 2dnl s VAL 511 CO -0.00 0.28 1.08 -1.58 -0.31 0.00 0.00 175.10 174.57 2dnl s GLN 512 N -1.71 3.95 -0.44 4.82 0.74 -0.82 -2.01 119.66 124.18 2dnl s GLN 512 Ca 0.47 0.88 -0.14 0.00 0.05 0.00 0.00 55.36 56.63 2dnl s GLN 512 Cb -0.26 -3.79 0.05 0.00 1.10 0.00 0.00 33.01 30.11 2dnl s GLN 512 CO 0.33 -1.04 0.34 0.42 -0.55 0.00 0.00 175.29 174.79 2dnl s ILE 513 N 3.87 5.09 -0.43 -2.34 -1.09 -1.25 -1.96 121.20 123.08 2dnl s ILE 513 Ca 0.45 -0.96 0.03 0.00 -2.23 0.00 0.00 60.65 57.95 2dnl s ILE 513 Cb -0.11 -3.97 0.12 0.00 -1.58 0.00 0.00 42.46 36.92 2dnl s ILE 513 CO 0.20 -0.46 0.18 -0.60 -1.23 0.00 0.00 174.94 173.03 2dnl s ARG 514 N 1.63 1.58 -0.94 2.79 3.52 -0.00 -4.37 118.95 123.15 2dnl s ARG 514 Ca 0.04 -2.14 -0.14 0.00 -0.13 0.00 0.00 55.73 53.36 2dnl s ARG 514 Cb -0.22 -2.97 -0.28 0.00 -1.56 0.00 0.00 34.95 29.92 2dnl s ARG 514 CO 0.07 -1.06 2.24 -2.30 -0.81 0.00 0.00 175.30 173.45 2dnl n PRO 515 N 3.70 0.16 -1.68 5.12 -0.02 -1.26 -1.45 135.00 139.56 2dnl n PRO 515 Ca 0.05 -0.23 -0.51 0.00 -2.02 0.00 0.00 63.50 60.79 2dnl n PRO 515 Cb 0.36 -1.76 -0.06 0.00 -0.02 0.00 0.00 33.50 32.03 2dnl n PRO 515 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 2dnl n TRP 516 N 9.31 2.16 -4.69 6.00 -0.00 -0.65 -4.69 117.44 124.88 2dnl n TRP 516 Ca 0.62 0.26 -0.31 0.00 -0.00 0.00 0.00 57.50 58.07 2dnl n TRP 516 Cb 0.22 -2.55 -0.08 0.00 -0.00 0.00 0.00 31.31 28.89 2dnl n TRP 516 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 2dnl s ASN 517 N 3.14 3.82 -0.14 5.87 2.20 -1.26 -4.12 114.94 124.44 2dnl s ASN 517 Ca 0.92 -1.60 0.17 0.00 -0.94 0.00 0.00 52.86 51.40 2dnl s ASN 517 Cb -0.83 0.35 -0.24 0.00 -2.00 0.00 0.00 41.25 38.53 2dnl s ASN 517 CO 0.54 -0.79 0.29 0.00 -2.94 0.00 0.00 177.10 174.19 2dnl n LEU 518 N -1.14 0.29 -3.60 3.54 -0.00 -1.26 -5.00 117.00 109.82 2dnl n LEU 518 Ca -0.14 0.14 -0.03 0.00 -0.00 0.00 0.00 56.01 55.97 2dnl n LEU 518 Cb 0.67 0.37 -0.02 0.00 -0.00 0.00 0.00 43.42 44.44 2dnl n LEU 518 CO 0.40 0.43 1.00 -0.55 -0.00 0.00 0.00 177.39 178.67 2dnl s SER 519 N -5.64 -0.13 0.02 1.45 0.15 -1.26 -5.09 113.70 103.19 2dnl s SER 519 Ca -0.08 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 56.53 2dnl s SER 519 Cb 0.07 0.17 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 2dnl s SER 519 CO 0.83 -0.28 0.00 -0.90 1.20 0.00 0.00 173.24 174.09 2dnl n ASP 520 N -0.20 0.02 -4.71 5.45 5.75 -1.26 -4.81 116.55 116.79 2dnl n ASP 520 Ca -0.02 0.02 -0.42 0.00 -0.01 0.00 0.00 54.79 54.36 2dnl n ASP 520 Cb 0.59 0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.66 2dnl n ASP 520 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2dnl s SER 521 N -5.03 6.88 -0.29 -1.12 1.04 -1.26 -4.99 113.70 108.94 2dnl s SER 521 Ca 0.00 2.24 -0.26 0.00 0.48 0.00 0.00 55.95 58.42 2dnl s SER 521 Cb 0.00 -2.58 0.17 0.00 0.10 0.00 0.00 66.02 63.70 2dnl s SER 521 CO 0.00 -0.62 1.28 -0.62 0.98 0.00 0.00 173.24 174.26 2dnl s ASP 522 N 1.18 -0.20 -0.04 7.02 2.15 -1.26 -5.17 116.67 120.36 2dnl s ASP 522 Ca 0.63 0.36 -0.00 0.00 0.43 0.00 0.00 52.55 53.97 2dnl s ASP 522 Cb -0.35 0.36 -0.03 0.00 -0.30 0.00 0.00 42.92 42.60 2dnl s ASP 522 CO 0.30 -0.08 0.01 -0.36 -0.17 0.00 0.00 175.17 174.87 2dnl s PHE 523 N -0.03 3.15 0.02 -5.34 0.08 -1.26 -5.12 117.98 109.48 2dnl s PHE 523 Ca 0.06 0.15 -0.07 0.00 0.12 0.00 0.00 56.93 57.19 2dnl s PHE 523 Cb -0.05 -1.73 -0.00 0.00 -0.57 0.00 0.00 43.02 40.67 2dnl s PHE 523 CO -0.11 0.48 0.13 0.54 -0.10 0.00 0.00 175.22 176.16 2dnl s VAL 524 N -1.01 0.10 -1.16 -0.44 0.11 -1.26 -5.08 120.40 111.66 2dnl s VAL 524 Ca 0.17 -0.81 -0.21 0.00 -2.93 0.00 0.00 61.98 58.20 2dnl s VAL 524 Cb -0.11 -0.60 0.03 0.00 -1.53 0.00 0.00 36.38 34.16 2dnl s VAL 524 CO 0.07 -0.45 1.71 -0.04 -3.33 0.00 0.00 175.10 173.06 2dnl s MET 525 N -1.82 3.48 0.28 1.54 -1.94 -1.26 -4.83 119.30 114.76 2dnl s MET 525 Ca -0.11 -1.43 -0.05 0.00 -1.71 0.00 0.00 55.69 52.38 2dnl s MET 525 Cb -0.05 -5.39 0.52 0.00 2.01 0.00 0.00 34.83 31.92 2dnl s MET 525 CO -0.00 -2.64 1.51 -0.25 -0.01 0.00 0.00 175.02 173.63 2dnl n ASP 526 N 10.08 -0.29 -4.53 3.03 9.92 -1.26 -4.49 116.55 129.01 2dnl n ASP 526 Ca 0.43 1.66 -0.50 0.00 -0.53 0.00 0.00 54.79 55.85 2dnl n ASP 526 Cb 0.48 -0.53 -0.04 0.00 -0.64 0.00 0.00 41.12 40.39 2dnl n ASP 526 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2dnl n SER 527 N -5.54 0.58 0.00 -2.24 3.41 -1.26 -4.93 113.62 103.64 2dnl n SER 527 Ca 0.17 1.15 0.00 0.00 -0.26 0.00 0.00 58.87 59.93 2dnl n SER 527 Cb 0.55 -1.12 0.00 0.00 -0.26 0.00 0.00 64.21 63.38 2dnl n SER 527 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dnl n GLY 528 N 1.86 0.41 3.81 5.00 0.00 -1.26 -5.16 105.19 109.84 2dnl n GLY 528 Ca 0.16 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 45.02 2dnl n GLY 528 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dnl s PRO 529 N -2.00 3.99 0.25 1.61 0.04 -1.26 -5.07 135.00 132.56 2dnl s PRO 529 Ca 0.00 1.28 -0.14 0.00 0.04 0.00 0.00 61.00 62.17 2dnl s PRO 529 Cb 0.00 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.39 2dnl s PRO 529 CO 0.00 -0.26 0.52 0.45 0.04 0.00 0.00 177.00 177.75 2dnl s SER 530 N -2.03 -0.12 0.07 6.66 0.15 -1.26 -5.10 113.70 112.07 2dnl s SER 530 Ca 0.65 -0.87 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2dnl s SER 530 Cb -0.14 0.61 0.00 0.00 -1.71 0.00 0.00 66.02 64.79 2dnl s SER 530 CO 0.18 -1.18 0.00 -1.20 1.20 0.00 0.00 173.24 172.24 2dnl n SER 531 N -0.40 0.38 0.00 5.45 7.64 -1.26 -5.36 113.62 120.08 2dnl n SER 531 Ca -0.02 0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.97 2dnl n SER 531 Cb 0.61 -0.07 0.00 0.00 -1.01 0.00 0.00 64.21 63.74 2dnl n SER 531 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64