#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dsk h PRO 408 N 0.00 0.00 0.00 1.61 0.13 -2.05 -3.28 132.00 128.42 2dsk h PRO 408 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2dsk h PRO 408 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2dsk h PRO 408 CO 0.00 0.20 -0.02 0.09 -0.23 0.00 0.00 178.00 178.04 2dsk n ASN 409 N -4.05 1.26 -3.57 1.44 3.02 -1.26 -5.06 115.26 107.04 2dsk n ASN 409 Ca -0.02 -1.73 -0.14 0.00 -0.03 0.00 0.00 54.58 52.65 2dsk n ASN 409 Cb 0.28 -0.04 -0.06 0.00 -0.61 0.00 0.00 39.78 39.35 2dsk n ASN 409 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dsk s ALA 410 N -0.75 -1.84 0.26 5.41 0.00 -1.24 -4.94 121.76 118.67 2dsk s ALA 410 Ca 0.02 1.57 0.07 0.00 0.00 0.00 0.00 51.96 53.63 2dsk s ALA 410 Cb 0.02 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.55 2dsk s ALA 410 CO 0.00 -0.33 0.17 -0.80 0.00 0.00 0.00 175.76 174.80 2dsk s ASN 411 N -0.74 5.34 0.36 0.00 0.01 -1.26 -0.78 114.94 117.86 2dsk s ASN 411 Ca -0.05 -0.34 -0.26 0.00 -0.71 0.00 0.00 52.86 51.50 2dsk s ASN 411 Cb -0.02 -1.28 -0.09 0.00 0.41 0.00 0.00 41.25 40.28 2dsk s ASN 411 CO 0.04 -0.05 1.09 -2.16 -1.51 0.00 0.00 177.10 174.51 2dsk s PRO 412 N -3.82 4.32 -0.17 -0.60 0.04 -1.26 -4.87 135.00 128.63 2dsk s PRO 412 Ca 0.33 1.68 -0.08 0.00 0.04 0.00 0.00 61.00 62.97 2dsk s PRO 412 Cb -0.07 -2.80 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 2dsk s PRO 412 CO 0.24 -0.04 0.09 0.42 0.04 0.00 0.00 177.00 177.74 2dsk s ILE 413 N -1.43 5.01 0.57 0.56 1.01 -1.26 -4.87 121.20 120.80 2dsk s ILE 413 Ca 0.53 0.04 -0.18 0.00 0.00 0.00 0.00 60.65 61.04 2dsk s ILE 413 Cb -0.27 -3.25 -0.07 0.00 0.01 0.00 0.00 42.46 38.88 2dsk s ILE 413 CO 0.34 0.48 0.72 -2.65 0.00 0.00 0.00 174.94 173.84 2dsk n PRO 414 N 3.24 0.69 -0.33 2.79 -0.02 -1.26 -4.88 135.00 135.23 2dsk n PRO 414 Ca -0.17 0.27 0.04 0.00 -2.02 0.00 0.00 63.50 61.62 2dsk n PRO 414 Cb 0.53 -1.90 0.22 0.00 -0.02 0.00 0.00 33.50 32.32 2dsk n PRO 414 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2dsk h GLU 415 N 0.39 1.05 -4.85 -0.52 4.57 -1.92 -3.32 114.58 109.97 2dsk h GLU 415 Ca -0.47 -0.06 -0.67 0.00 -1.18 0.00 0.00 59.36 56.98 2dsk h GLU 415 Cb 1.38 -0.24 -0.36 0.00 -0.16 0.00 0.00 28.75 29.38 2dsk h GLU 415 CO 0.49 0.69 -0.78 -1.01 -1.18 0.00 0.00 179.01 177.22 2dsk s HIS 416 N -5.96 3.26 0.27 0.92 3.76 -1.26 -4.81 115.29 111.48 2dsk s HIS 416 Ca -0.12 -2.22 0.05 0.00 -0.15 0.00 0.00 55.06 52.62 2dsk s HIS 416 Cb 0.20 -1.97 -0.06 0.00 1.11 0.00 0.00 32.58 31.87 2dsk s HIS 416 CO 0.81 -0.86 -0.03 -0.59 -0.85 0.00 0.00 174.74 173.21 2dsk s PHE 417 N 1.14 1.86 -0.21 1.40 -0.12 -0.92 -4.65 117.98 116.48 2dsk s PHE 417 Ca -0.08 -0.79 -0.00 0.00 -0.05 0.00 0.00 56.93 56.01 2dsk s PHE 417 Cb -0.20 -1.09 0.05 0.00 -0.63 0.00 0.00 43.02 41.16 2dsk s PHE 417 CO -0.04 0.17 -0.03 0.12 -0.05 0.00 0.00 175.22 175.38 2dsk s PHE 418 N -3.14 1.89 -0.49 3.49 5.36 -1.26 -1.31 117.98 122.51 2dsk s PHE 418 Ca 0.30 -1.36 0.04 0.00 -0.96 0.00 0.00 56.93 54.95 2dsk s PHE 418 Cb 0.05 -1.38 0.16 0.00 -0.34 0.00 0.00 43.02 41.51 2dsk s PHE 418 CO 0.11 -0.69 0.36 0.00 -1.46 0.00 0.00 175.22 173.55 2dsk s ALA 419 N 1.57 2.10 0.76 11.12 0.00 -0.95 -4.52 121.76 131.84 2dsk s ALA 419 Ca -0.03 -2.81 -0.14 0.00 0.00 0.00 0.00 51.96 48.99 2dsk s ALA 419 Cb -0.17 -1.78 0.06 0.00 0.00 0.00 0.00 23.12 21.23 2dsk s ALA 419 CO -0.07 -2.02 1.18 -1.25 0.00 0.00 0.00 175.76 173.59 2dsk s PRO 420 N -0.26 1.98 0.23 0.00 0.04 -1.26 -3.53 135.00 132.20 2dsk s PRO 420 Ca 0.28 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.67 2dsk s PRO 420 Cb -0.03 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.60 2dsk s PRO 420 CO -0.16 -1.93 0.99 0.71 0.04 0.00 0.00 177.00 176.66 2dsk s TYR 421 N -2.22 3.84 -0.13 0.56 1.51 -0.77 -1.27 117.35 118.86 2dsk s TYR 421 Ca 0.71 1.83 0.01 0.00 -1.01 0.00 0.00 57.07 58.61 2dsk s TYR 421 Cb -0.26 -3.09 0.02 0.00 -0.11 0.00 0.00 41.96 38.52 2dsk s TYR 421 CO 0.48 0.10 -0.15 0.42 -1.11 0.00 0.00 175.55 175.29 2dsk s ILE 422 N -0.99 1.57 -0.70 2.71 1.01 -0.51 -0.52 121.20 123.77 2dsk s ILE 422 Ca 0.43 -0.65 -0.27 0.00 0.00 0.00 0.00 60.65 60.15 2dsk s ILE 422 Cb -0.28 -1.46 0.03 0.00 0.01 0.00 0.00 42.46 40.77 2dsk s ILE 422 CO 0.34 0.46 1.26 -0.62 0.00 0.00 0.00 174.94 176.38 2dsk s ASP 423 N 1.29 6.23 0.47 3.58 -1.08 -1.26 -1.41 116.67 124.49 2dsk s ASP 423 Ca 0.01 -0.31 0.32 0.00 -0.52 0.00 0.00 52.55 52.04 2dsk s ASP 423 Cb -0.14 -2.56 1.55 0.00 -1.46 0.00 0.00 42.92 40.32 2dsk s ASP 423 CO -0.07 -1.75 1.96 0.24 0.52 0.00 0.00 175.17 176.07 2dsk h MET 424 N 9.91 0.00 0.00 4.34 2.86 -1.49 -3.01 114.93 127.54 2dsk h MET 424 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2dsk h MET 424 Cb 1.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.71 2dsk h MET 424 CO 1.26 0.00 -0.18 -1.13 1.06 0.00 0.00 176.91 177.92 2dsk n SER 425 N -2.70 0.50 -4.77 1.22 3.41 -1.26 -4.91 113.62 105.11 2dsk n SER 425 Ca -0.01 0.36 -0.41 0.00 -0.26 0.00 0.00 58.87 58.56 2dsk n SER 425 Cb 0.15 -0.39 -0.01 0.00 -0.26 0.00 0.00 64.21 63.70 2dsk n SER 425 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2dsk s LEU 426 N -3.79 4.38 0.47 1.04 1.43 -1.14 -4.90 118.68 116.16 2dsk s LEU 426 Ca 0.11 2.83 0.18 0.00 -1.03 0.00 0.00 54.13 56.22 2dsk s LEU 426 Cb 0.15 -3.65 1.15 0.00 0.03 0.00 0.00 46.19 43.86 2dsk s LEU 426 CO 0.61 -0.69 2.02 -1.28 0.23 0.00 0.00 176.35 177.25 2dsk h SER 427 N 3.43 0.00 0.83 2.29 0.87 -1.92 -1.80 113.55 117.25 2dsk h SER 427 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 2dsk h SER 427 Cb 1.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.19 2dsk h SER 427 CO 0.66 0.16 0.00 0.55 -0.53 0.00 0.00 176.83 177.68 2dsk n VAL 428 N -4.13 0.76 -1.59 2.23 3.14 -1.26 -4.90 118.33 112.59 2dsk n VAL 428 Ca -0.02 0.13 -0.63 0.00 -2.96 0.00 0.00 64.34 60.85 2dsk n VAL 428 Cb 0.24 -0.98 -0.10 0.00 -1.06 0.00 0.00 33.84 31.94 2dsk n VAL 428 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 2dsk n HIS 429 N -2.03 1.58 -3.32 1.45 -0.00 -0.68 -4.96 115.22 107.26 2dsk n HIS 429 Ca 0.03 1.04 -0.20 0.00 0.46 0.00 0.00 57.72 59.05 2dsk n HIS 429 Cb 0.26 -2.12 0.00 0.00 -0.12 0.00 0.00 29.99 28.01 2dsk n HIS 429 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 2dsk s LYS 430 N 3.25 3.08 0.47 1.57 1.02 -1.26 -5.06 119.74 122.80 2dsk s LYS 430 Ca 1.01 -0.90 -0.24 0.00 0.02 0.00 0.00 55.97 55.86 2dsk s LYS 430 Cb -1.42 -2.75 -0.07 0.00 -0.52 0.00 0.00 37.83 33.07 2dsk s LYS 430 CO 0.75 -0.04 1.32 -2.14 -0.92 0.00 0.00 175.35 174.32 2dsk s PRO 431 N -4.28 3.62 0.34 -1.68 0.02 -1.26 -4.85 135.00 126.91 2dsk s PRO 431 Ca 0.46 2.17 0.06 0.00 0.02 0.00 0.00 61.00 63.72 2dsk s PRO 431 Cb -0.10 -2.52 0.73 0.00 0.02 0.00 0.00 34.50 32.64 2dsk s PRO 431 CO 0.33 -0.79 1.87 -0.07 -0.33 0.00 0.00 177.00 178.01 2dsk h LEU 432 N 2.12 0.73 -1.52 -5.54 3.38 -1.98 0.06 115.31 112.57 2dsk h LEU 432 Ca -0.50 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 2dsk h LEU 432 Cb 1.27 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 2dsk h LEU 432 CO 0.60 0.39 -0.04 -0.37 0.09 0.00 0.00 178.44 179.11 2dsk h VAL 433 N 0.79 1.14 -0.26 1.22 -1.51 -1.90 -0.99 116.25 114.74 2dsk h VAL 433 Ca 0.45 -0.57 -0.19 0.00 -1.23 0.00 0.00 66.70 65.15 2dsk h VAL 433 Cb 0.60 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 30.82 2dsk h VAL 433 CO -0.21 0.18 -0.59 -0.08 -1.23 0.00 0.00 177.57 175.64 2dsk h GLU 434 N 0.25 0.86 -0.44 5.19 4.81 -1.35 -2.70 114.58 121.19 2dsk h GLU 434 Ca 0.06 -0.58 -0.04 0.00 -0.13 0.00 0.00 59.36 58.67 2dsk h GLU 434 Cb 0.25 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 2dsk h GLU 434 CO 0.01 1.21 0.10 1.88 -0.73 0.00 0.00 179.01 181.48 2dsk h TYR 435 N 0.63 0.67 -0.36 0.92 0.99 -0.89 -1.85 116.97 117.08 2dsk h TYR 435 Ca -0.00 -0.05 -0.00 0.00 2.00 0.00 0.00 58.73 60.68 2dsk h TYR 435 Cb 1.21 -0.20 -0.02 0.00 1.00 0.00 0.00 36.73 38.72 2dsk h TYR 435 CO 0.08 0.58 0.22 0.00 -0.00 0.00 0.00 178.16 179.03 2dsk h ALA 436 N 1.47 0.46 -0.72 3.88 0.00 -1.03 0.17 119.26 123.49 2dsk h ALA 436 Ca 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 2dsk h ALA 436 Cb 0.25 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2dsk h ALA 436 CO -0.00 -0.04 0.26 -0.22 0.00 0.00 0.00 179.25 179.25 2dsk h LYS 437 N 0.47 1.10 -0.04 0.00 3.64 -1.15 -0.63 116.57 119.97 2dsk h LYS 437 Ca 0.13 -0.22 -0.21 0.00 -1.27 0.00 0.00 60.65 59.08 2dsk h LYS 437 Cb 0.01 -0.17 0.01 0.00 -0.41 0.00 0.00 32.23 31.68 2dsk h LYS 437 CO -0.02 0.92 -0.79 -0.07 -2.27 0.00 0.00 179.45 177.22 2dsk h LEU 438 N 1.05 0.76 0.00 5.20 3.38 -1.08 -3.35 115.31 121.27 2dsk h LEU 438 Ca 0.24 -0.72 -0.20 0.00 0.09 0.00 0.00 57.88 57.29 2dsk h LEU 438 Cb 0.26 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 2dsk h LEU 438 CO -0.01 1.37 -1.09 0.71 0.09 0.00 0.00 178.44 179.50 2dsk h THR 439 N 0.21 1.24 0.00 0.22 1.35 -0.70 -3.47 112.91 111.76 2dsk h THR 439 Ca -0.09 -2.89 0.00 0.00 -0.55 0.00 0.00 66.41 62.89 2dsk h THR 439 Cb 1.46 2.59 0.00 0.00 -1.73 0.00 0.00 68.15 70.46 2dsk h THR 439 CO 0.16 0.71 0.00 0.61 -0.25 0.00 0.00 175.52 176.74 2dsk n GLY 440 N 1.37 0.66 3.43 5.82 0.00 -0.24 -3.98 105.19 112.24 2dsk n GLY 440 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.65 2dsk n GLY 440 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dsk s THR 441 N -2.26 2.86 -0.23 2.61 -1.32 -1.24 -4.85 115.64 111.21 2dsk s THR 441 Ca 0.00 -0.79 0.14 0.00 -1.21 0.00 0.00 61.69 59.83 2dsk s THR 441 Cb 0.00 -2.11 0.70 0.00 -1.51 0.00 0.00 72.50 69.57 2dsk s THR 441 CO 0.00 0.58 1.63 2.29 -2.21 0.00 0.00 174.62 176.91 2dsk n LYS 442 N 2.53 3.89 -4.89 7.08 2.85 -1.26 -4.16 118.16 124.20 2dsk n LYS 442 Ca -0.17 -3.05 -0.28 0.00 -1.05 0.00 0.00 58.31 53.77 2dsk n LYS 442 Cb 0.52 -2.10 -0.16 0.00 -0.65 0.00 0.00 35.03 32.64 2dsk n LYS 442 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2dsk s TYR 443 N -2.85 1.91 0.04 5.58 1.51 -1.26 -1.94 117.35 120.33 2dsk s TYR 443 Ca 0.50 -0.66 -0.01 0.00 -1.01 0.00 0.00 57.07 55.89 2dsk s TYR 443 Cb 0.39 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.91 2dsk s TYR 443 CO 0.12 -0.26 -0.02 -0.06 -1.11 0.00 0.00 175.55 174.22 2dsk s PHE 444 N 0.27 0.39 -0.33 2.71 0.40 -1.15 -4.02 117.98 116.25 2dsk s PHE 444 Ca -0.11 -0.81 -0.10 0.00 -0.60 0.00 0.00 56.93 55.31 2dsk s PHE 444 Cb -0.14 -0.29 0.01 0.00 0.51 0.00 0.00 43.02 43.10 2dsk s PHE 444 CO 0.04 -0.30 0.17 0.99 0.70 0.00 0.00 175.22 176.82 2dsk s THR 445 N -2.83 4.54 -0.19 0.64 2.01 -0.40 -1.06 115.64 118.34 2dsk s THR 445 Ca -0.03 -0.60 -0.26 0.00 0.31 0.00 0.00 61.69 61.11 2dsk s THR 445 Cb 0.00 -3.40 -0.01 0.00 0.01 0.00 0.00 72.50 69.10 2dsk s THR 445 CO -0.06 -0.04 0.86 -0.76 -0.69 0.00 0.00 174.62 173.93 2dsk s LEU 446 N 1.58 4.14 0.02 4.42 1.43 0.27 -1.43 118.68 129.12 2dsk s LEU 446 Ca 0.03 1.17 0.07 0.00 -1.03 0.00 0.00 54.13 54.38 2dsk s LEU 446 Cb -0.18 -3.27 -0.02 0.00 0.03 0.00 0.00 46.19 42.75 2dsk s LEU 446 CO 0.06 -0.46 -0.21 0.00 0.23 0.00 0.00 176.35 175.96 2dsk s ALA 447 N 2.46 1.81 0.02 4.21 0.00 -0.50 -0.95 121.76 128.81 2dsk s ALA 447 Ca 0.38 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 51.34 2dsk s ALA 447 Cb -0.16 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 2dsk s ALA 447 CO 0.10 0.42 -0.05 -0.06 0.00 0.00 0.00 175.76 176.18 2dsk s PHE 448 N -0.67 0.44 -0.10 0.00 0.40 -1.26 -1.07 117.98 115.72 2dsk s PHE 448 Ca 0.08 -0.41 -0.20 0.00 -0.60 0.00 0.00 56.93 55.81 2dsk s PHE 448 Cb -0.09 -0.28 -0.04 0.00 0.51 0.00 0.00 43.02 43.12 2dsk s PHE 448 CO 0.01 -0.10 0.54 0.42 0.70 0.00 0.00 175.22 176.79 2dsk s ILE 449 N -1.11 5.15 0.34 0.64 -1.09 0.13 -0.70 121.20 124.56 2dsk s ILE 449 Ca -0.09 1.09 0.04 0.00 -2.23 0.00 0.00 60.65 59.46 2dsk s ILE 449 Cb -0.08 -3.88 -0.03 0.00 -1.58 0.00 0.00 42.46 36.89 2dsk s ILE 449 CO -0.00 0.30 0.17 -0.76 -1.23 0.00 0.00 174.94 173.42 2dsk s LEU 450 N 0.68 1.78 0.20 2.97 1.43 -0.15 -2.06 118.68 123.53 2dsk s LEU 450 Ca 0.29 -1.62 -0.30 0.00 -1.03 0.00 0.00 54.13 51.48 2dsk s LEU 450 Cb -0.16 0.17 -0.08 0.00 0.03 0.00 0.00 46.19 46.15 2dsk s LEU 450 CO 0.13 -0.92 0.93 -0.47 0.23 0.00 0.00 176.35 176.25 2dsk s TYR 451 N -3.47 3.94 -0.11 0.29 5.04 -0.27 -1.55 117.35 121.23 2dsk s TYR 451 Ca 0.33 1.87 0.03 0.00 -2.44 0.00 0.00 57.07 56.87 2dsk s TYR 451 Cb 0.04 -2.98 0.00 0.00 0.35 0.00 0.00 41.96 39.37 2dsk s TYR 451 CO 0.18 0.40 -0.22 0.45 -1.34 0.00 0.00 175.55 175.03 2dsk s SER 452 N -0.90 2.93 0.26 4.32 0.15 0.24 -4.61 113.70 116.10 2dsk s SER 452 Ca 0.42 -0.54 0.11 0.00 0.70 0.00 0.00 55.95 56.64 2dsk s SER 452 Cb -0.25 -1.34 0.31 0.00 -1.71 0.00 0.00 66.02 63.03 2dsk s SER 452 CO 0.31 0.12 1.58 0.77 1.20 0.00 0.00 173.24 177.22 2dsk h SER 453 N 6.92 0.00 -0.43 5.45 4.64 -1.86 0.44 113.55 128.71 2dsk h SER 453 Ca -0.24 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 2dsk h SER 453 Cb 1.22 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.29 2dsk h SER 453 CO 0.49 0.64 0.10 0.58 -0.87 0.00 0.00 176.83 177.77 2dsk h VAL 454 N 0.00 1.23 -0.03 0.95 2.07 -1.94 -3.05 116.25 115.48 2dsk h VAL 454 Ca -0.01 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.69 2dsk h VAL 454 Cb 1.17 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.89 2dsk h VAL 454 CO 0.08 0.29 -0.04 -1.22 0.02 0.00 0.00 177.57 176.70 2dsk n TYR 455 N -4.52 0.00 -4.09 1.57 4.02 -1.21 -4.97 117.16 107.96 2dsk n TYR 455 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.61 2dsk n TYR 455 Cb 0.22 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.49 2dsk n TYR 455 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2dsk n ASN 456 N 1.13 0.03 0.00 7.72 5.15 0.15 -4.83 115.26 124.61 2dsk n ASN 456 Ca 0.13 -1.12 0.00 0.00 -0.60 0.00 0.00 54.58 52.99 2dsk n ASN 456 Cb 0.55 -2.47 0.00 0.00 -0.53 0.00 0.00 39.78 37.32 2dsk n ASN 456 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2dsk n GLY 457 N -2.21 -0.90 3.77 8.20 0.00 -0.88 -4.95 105.19 108.22 2dsk n GLY 457 Ca -0.31 -0.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 2dsk n GLY 457 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dsk s PRO 458 N -0.22 4.15 -0.01 1.61 0.04 -1.26 -0.59 135.00 138.73 2dsk s PRO 458 Ca 0.00 2.43 -0.29 0.00 0.04 0.00 0.00 61.00 63.18 2dsk s PRO 458 Cb 0.00 -2.97 0.07 0.00 0.04 0.00 0.00 34.50 31.64 2dsk s PRO 458 CO 0.00 -0.44 0.69 0.00 0.04 0.00 0.00 177.00 177.29 2dsk s ALA 459 N -1.14 -1.74 0.12 8.56 0.00 -0.59 -4.38 121.76 122.58 2dsk s ALA 459 Ca 0.52 1.14 -0.30 0.00 0.00 0.00 0.00 51.96 53.32 2dsk s ALA 459 Cb -0.44 0.17 -0.07 0.00 0.00 0.00 0.00 23.12 22.78 2dsk s ALA 459 CO 0.59 -0.47 1.25 -1.58 0.00 0.00 0.00 175.76 175.55 2dsk s TRP 460 N -1.83 3.38 -1.09 0.00 0.52 -0.15 -0.98 118.94 118.80 2dsk s TRP 460 Ca -0.07 1.26 0.00 0.00 0.02 0.00 0.00 56.10 57.30 2dsk s TRP 460 Cb -0.00 -3.49 0.00 0.00 -1.15 0.00 0.00 33.47 28.82 2dsk s TRP 460 CO 0.04 -1.54 0.00 0.00 0.02 0.00 0.00 176.95 175.47 2dsk n ALA 461 N 3.42 -0.16 -1.03 0.98 0.00 0.13 -1.04 120.51 122.80 2dsk n ALA 461 Ca 0.08 0.17 -0.01 0.00 0.00 0.00 0.00 53.44 53.67 2dsk n ALA 461 Cb 0.45 -1.55 -0.00 0.00 0.00 0.00 0.00 19.45 18.35 2dsk n ALA 461 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dsk n GLY 462 N 0.15 0.44 0.00 0.00 0.00 -0.95 -4.76 105.19 100.07 2dsk n GLY 462 Ca -0.10 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2dsk n GLY 462 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dsk n SER 463 N -0.05 0.00 -4.71 1.61 3.41 -0.21 -4.29 113.62 109.38 2dsk n SER 463 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.18 2dsk n SER 463 Cb 0.15 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.07 2dsk n SER 463 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2dsk s ILE 464 N -1.00 3.93 0.09 -1.33 1.01 -0.27 -4.85 121.20 118.77 2dsk s ILE 464 Ca 0.00 1.38 -0.36 0.00 0.00 0.00 0.00 60.65 61.67 2dsk s ILE 464 Cb 0.00 -3.89 -0.17 0.00 0.01 0.00 0.00 42.46 38.41 2dsk s ILE 464 CO 0.00 0.10 1.19 -2.65 0.00 0.00 0.00 174.94 173.58 2dsk n PRO 465 N 3.98 0.78 -0.29 2.79 -0.02 -1.26 -0.98 135.00 139.99 2dsk n PRO 465 Ca 0.09 0.28 0.09 0.00 -2.02 0.00 0.00 63.50 61.94 2dsk n PRO 465 Cb 0.46 -1.82 0.25 0.00 -0.02 0.00 0.00 33.50 32.37 2dsk n PRO 465 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2dsk h LEU 466 N 3.69 0.39 0.00 2.45 5.85 -1.92 -1.81 115.31 123.96 2dsk h LEU 466 Ca -0.47 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.38 2dsk h LEU 466 Cb 1.37 0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.48 2dsk h LEU 466 CO 0.71 0.10 0.00 -0.62 -0.34 0.00 0.00 178.44 178.30 2dsk n GLU 467 N -4.97 0.80 -0.31 1.25 4.71 -1.26 -4.30 120.64 116.56 2dsk n GLU 467 Ca 0.19 0.00 0.17 0.00 -0.01 0.00 0.00 57.16 57.51 2dsk n GLU 467 Cb 0.52 -1.50 0.43 0.00 -1.01 0.00 0.00 31.44 29.88 2dsk n GLU 467 CO 0.00 0.00 0.00 -0.22 0.09 0.00 0.00 177.13 177.00 2dsk h LYS 468 N 0.00 0.54 -0.48 3.49 1.63 -1.68 -2.61 116.57 117.47 2dsk h LYS 468 Ca 0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 2dsk h LYS 468 Cb 0.07 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.58 2dsk h LYS 468 CO 0.00 0.36 0.00 1.19 -3.45 0.00 0.00 179.45 177.55 2dsk n PHE 469 N -4.65 1.34 -0.22 1.91 3.01 -1.26 -4.56 117.46 113.04 2dsk n PHE 469 Ca 0.22 -0.71 -0.06 0.00 1.01 0.00 0.00 57.45 57.92 2dsk n PHE 469 Cb 0.69 -0.30 0.04 0.00 -0.01 0.00 0.00 39.48 39.89 2dsk n PHE 469 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2dsk h VAL 470 N 3.13 1.18 -0.66 -4.37 2.07 -1.76 -1.99 116.25 113.84 2dsk h VAL 470 Ca 0.00 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 67.05 2dsk h VAL 470 Cb 1.49 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.57 2dsk h VAL 470 CO 0.26 0.18 0.10 0.44 0.02 0.00 0.00 177.57 178.58 2dsk h ASP 471 N 0.83 1.05 -0.65 0.57 3.32 -1.82 -1.52 116.42 118.20 2dsk h ASP 471 Ca 0.22 -0.25 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 2dsk h ASP 471 Cb -0.03 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 2dsk h ASP 471 CO -0.04 1.04 0.28 -0.33 -1.72 0.00 0.00 179.24 178.46 2dsk h GLU 472 N 1.02 0.98 -0.42 3.56 5.08 -1.79 -0.66 114.58 122.35 2dsk h GLU 472 Ca 0.20 -0.16 -0.15 0.00 -1.00 0.00 0.00 59.36 58.25 2dsk h GLU 472 Cb 0.44 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2dsk h GLU 472 CO 0.01 0.80 -0.32 0.28 -1.00 0.00 0.00 179.01 178.78 2dsk h VAL 473 N 0.97 1.27 -0.69 3.13 2.07 -1.09 -1.19 116.25 120.72 2dsk h VAL 473 Ca 0.23 -1.50 0.00 0.00 0.82 0.00 0.00 66.70 66.25 2dsk h VAL 473 Cb 0.18 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.19 2dsk h VAL 473 CO -0.02 0.51 0.44 -0.09 0.02 0.00 0.00 177.57 178.42 2dsk h ARG 474 N 0.81 0.93 -0.72 1.57 2.43 -0.83 -0.48 114.38 118.08 2dsk h ARG 474 Ca 0.08 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 2dsk h ARG 474 Cb 0.92 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.24 2dsk h ARG 474 CO 0.09 0.64 0.25 0.93 -1.51 0.00 0.00 179.97 180.36 2dsk h GLU 475 N 0.94 1.10 -0.61 0.20 4.39 -0.92 -2.25 114.58 117.43 2dsk h GLU 475 Ca 0.25 -0.22 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2dsk h GLU 475 Cb -0.06 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 28.39 2dsk h GLU 475 CO -0.05 0.93 0.16 1.25 -1.16 0.00 0.00 179.01 180.14 2dsk h LEU 476 N 1.05 0.90 -1.77 1.33 5.85 -0.73 -2.13 115.31 119.81 2dsk h LEU 476 Ca 0.23 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2dsk h LEU 476 Cb 0.27 -0.23 -0.00 0.00 0.37 0.00 0.00 40.66 41.06 2dsk h LEU 476 CO -0.01 0.86 -0.14 0.03 -0.34 0.00 0.00 178.44 178.84 2dsk h ARG 477 N 0.92 0.00 0.00 1.25 3.08 -0.63 -1.26 114.38 117.74 2dsk h ARG 477 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 2dsk h ARG 477 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2dsk h ARG 477 CO -0.00 0.14 0.00 0.93 -1.07 0.00 0.00 179.97 179.97 2dsk h GLU 478 N 0.00 0.00 -0.37 0.04 5.08 -0.81 -1.63 114.58 116.88 2dsk h GLU 478 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2dsk h GLU 478 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 2dsk h GLU 478 CO 0.02 0.00 0.00 0.44 -1.00 0.00 0.00 179.01 178.47 2dsk n ILE 479 N -2.61 1.57 -0.50 3.13 -5.35 -0.82 -4.94 119.36 109.84 2dsk n ILE 479 Ca 0.01 -1.33 0.00 0.00 -0.27 0.00 0.00 62.75 61.16 2dsk n ILE 479 Cb 0.23 0.18 0.00 0.00 -1.74 0.00 0.00 39.64 38.31 2dsk n ILE 479 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dsk n GLY 480 N 0.29 0.75 3.88 3.28 0.00 -0.61 -5.06 105.19 107.71 2dsk n GLY 480 Ca 0.17 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 2dsk n GLY 480 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dsk s GLY 481 N -1.68 1.64 0.21 -0.02 0.00 -0.54 -4.80 107.32 102.13 2dsk s GLY 481 Ca 0.00 -0.80 -0.20 0.00 0.00 0.00 0.00 44.72 43.71 2dsk s GLY 481 CO 0.00 -0.20 0.62 1.85 0.00 0.00 0.00 173.10 175.36 2dsk s GLU 482 N -5.61 1.49 0.19 2.90 2.56 -0.82 -4.05 118.70 115.36 2dsk s GLU 482 Ca 0.66 -0.78 0.03 0.00 0.00 0.00 0.00 54.97 54.88 2dsk s GLU 482 Cb -0.09 0.57 -0.05 0.00 2.00 0.00 0.00 34.13 36.56 2dsk s GLU 482 CO 0.51 -0.66 -0.01 0.14 -0.56 0.00 0.00 175.26 174.68 2dsk s VAL 483 N -3.85 0.88 -0.10 3.70 -7.23 -1.26 -2.94 120.40 109.60 2dsk s VAL 483 Ca 0.07 -2.01 0.03 0.00 -1.81 0.00 0.00 61.98 58.26 2dsk s VAL 483 Cb -0.03 -2.17 -0.00 0.00 0.56 0.00 0.00 36.38 34.74 2dsk s VAL 483 CO -0.03 -0.45 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.46 2dsk s ILE 484 N -3.52 2.26 -0.26 -0.62 1.01 -0.22 -4.51 121.20 115.33 2dsk s ILE 484 Ca 0.25 -0.95 -0.14 0.00 0.00 0.00 0.00 60.65 59.81 2dsk s ILE 484 Cb 0.05 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.61 2dsk s ILE 484 CO 0.05 0.55 0.31 -0.63 0.00 0.00 0.00 174.94 175.23 2dsk s ILE 485 N 0.29 5.23 -0.10 2.92 -1.09 -0.82 -0.56 121.20 127.08 2dsk s ILE 485 Ca -0.16 0.45 -0.06 0.00 -2.23 0.00 0.00 60.65 58.66 2dsk s ILE 485 Cb -0.17 -3.64 -0.04 0.00 -1.58 0.00 0.00 42.46 37.03 2dsk s ILE 485 CO 0.08 0.22 0.12 0.00 -1.23 0.00 0.00 174.94 174.13 2dsk s ALA 486 N 1.75 3.80 0.12 9.38 0.00 -0.12 -0.56 121.76 136.13 2dsk s ALA 486 Ca 0.13 -0.68 0.08 0.00 0.00 0.00 0.00 51.96 51.49 2dsk s ALA 486 Cb -0.15 -1.88 -0.04 0.00 0.00 0.00 0.00 23.12 21.04 2dsk s ALA 486 CO 0.09 0.63 -0.13 -0.06 0.00 0.00 0.00 175.76 176.29 2dsk s PHE 487 N -1.05 2.64 0.00 0.00 0.40 0.79 -0.69 117.98 120.07 2dsk s PHE 487 Ca 0.16 -0.21 0.00 0.00 -0.60 0.00 0.00 56.93 56.28 2dsk s PHE 487 Cb -0.12 -1.37 0.00 0.00 0.51 0.00 0.00 43.02 42.04 2dsk s PHE 487 CO 0.06 0.42 0.00 0.41 0.70 0.00 0.00 175.22 176.81 2dsk n GLY 488 N 0.63 0.71 0.00 4.36 0.00 -0.87 -0.80 105.19 109.22 2dsk n GLY 488 Ca -0.14 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.75 2dsk n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dsk n GLY 489 N 0.00 -0.80 0.21 -0.02 0.00 -0.46 -4.66 105.19 99.47 2dsk n GLY 489 Ca 0.00 -2.16 0.08 0.00 0.00 0.00 0.00 46.02 43.94 2dsk n GLY 489 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dsk h ALA 490 N 0.00 1.16 -3.80 4.61 0.00 -1.95 -3.38 119.26 115.90 2dsk h ALA 490 Ca 0.00 -0.25 -0.59 0.00 0.00 0.00 0.00 54.91 54.07 2dsk h ALA 490 Cb 0.00 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 17.52 2dsk h ALA 490 CO 0.00 0.35 -0.84 0.14 0.00 0.00 0.00 179.25 178.90 2dsk s VAL 491 N -3.90 1.81 0.00 0.00 -7.23 -1.26 -5.01 120.40 104.81 2dsk s VAL 491 Ca -0.01 -1.52 0.00 0.00 -1.81 0.00 0.00 61.98 58.64 2dsk s VAL 491 Cb 0.12 -1.62 0.00 0.00 0.56 0.00 0.00 36.38 35.44 2dsk s VAL 491 CO 0.66 0.02 0.00 0.61 -0.31 0.00 0.00 175.10 176.08 2dsk n GLY 492 N 1.20 1.11 3.73 2.32 0.00 -1.26 -4.77 105.19 107.51 2dsk n GLY 492 Ca -0.19 -1.96 -0.40 0.00 0.00 0.00 0.00 46.02 43.47 2dsk n GLY 492 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dsk s PRO 493 N -0.17 4.50 0.51 1.61 0.04 -1.26 -4.98 135.00 135.26 2dsk s PRO 493 Ca 0.00 1.09 -0.20 0.00 0.04 0.00 0.00 61.00 61.93 2dsk s PRO 493 Cb 0.00 -3.41 -0.07 0.00 0.04 0.00 0.00 34.50 31.06 2dsk s PRO 493 CO 0.00 0.15 1.07 0.71 0.04 0.00 0.00 177.00 178.97 2dsk s TYR 494 N 0.41 2.88 0.26 0.56 4.12 -1.26 -1.11 117.35 123.21 2dsk s TYR 494 Ca 0.41 1.56 -0.03 0.00 0.02 0.00 0.00 57.07 59.03 2dsk s TYR 494 Cb -0.20 -3.14 0.32 0.00 -1.52 0.00 0.00 41.96 37.42 2dsk s TYR 494 CO 0.23 -1.11 1.80 -0.07 0.02 0.00 0.00 175.55 176.42 2dsk h LEU 495 N 1.35 0.88 -0.11 -1.29 3.38 -1.88 -1.89 115.31 115.75 2dsk h LEU 495 Ca -0.49 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.32 2dsk h LEU 495 Cb 1.23 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2dsk h LEU 495 CO 0.58 0.84 0.00 0.00 0.09 0.00 0.00 178.44 179.95 2dsk n GLN 497 N -1.63 0.68 0.07 0.00 6.02 -0.78 -4.45 117.38 117.30 2dsk n GLN 497 Ca 0.04 0.17 -0.11 0.00 -0.01 0.00 0.00 57.00 57.08 2dsk n GLN 497 Cb 0.20 -1.63 -0.13 0.00 1.02 0.00 0.00 30.24 29.70 2dsk n GLN 497 CO 0.00 0.00 0.00 0.37 -1.01 0.00 0.00 177.06 176.42 2dsk h GLN 498 N 0.02 0.12 -6.64 -1.09 5.75 -1.09 -3.47 115.11 108.71 2dsk h GLN 498 Ca -0.47 -0.21 -0.57 0.00 -0.15 0.00 0.00 58.65 57.25 2dsk h GLN 498 Cb 2.05 0.08 0.08 0.00 1.07 0.00 0.00 27.48 30.76 2dsk h GLN 498 CO 0.02 1.05 0.68 0.00 -2.65 0.00 0.00 178.83 177.93 2dsk n ALA 499 N -2.46 1.47 0.12 3.38 0.00 -0.19 -4.90 120.51 117.92 2dsk n ALA 499 Ca -0.06 0.40 0.01 0.00 0.00 0.00 0.00 53.44 53.79 2dsk n ALA 499 Cb 0.99 -2.32 -0.00 0.00 0.00 0.00 0.00 19.45 18.11 2dsk n ALA 499 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dsk h SER 500 N 4.39 0.00 -5.22 0.00 4.64 -1.91 -3.47 113.55 111.97 2dsk h SER 500 Ca -0.45 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.76 2dsk h SER 500 Cb 1.26 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.22 2dsk h SER 500 CO 0.77 0.56 -0.41 0.42 -0.87 0.00 0.00 176.83 177.30 2dsk s THR 501 N -2.93 0.12 0.43 2.95 -4.23 -1.26 -5.03 115.64 105.69 2dsk s THR 501 Ca 0.03 -1.37 0.15 0.00 -1.18 0.00 0.00 61.69 59.32 2dsk s THR 501 Cb 0.08 -1.58 0.17 0.00 1.34 0.00 0.00 72.50 72.51 2dsk s THR 501 CO 0.76 -0.55 1.96 -0.65 -0.54 0.00 0.00 174.62 175.60 2dsk h PRO 502 N 2.73 0.00 -0.41 3.99 0.11 -1.91 -1.90 132.00 134.61 2dsk h PRO 502 Ca -0.33 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.72 2dsk h PRO 502 Cb 1.20 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.30 2dsk h PRO 502 CO 0.55 0.22 0.02 0.93 -0.21 0.00 0.00 178.00 179.50 2dsk h GLU 503 N 0.00 0.71 -0.53 1.05 3.07 -1.94 -0.14 114.58 116.80 2dsk h GLU 503 Ca -0.00 -0.22 -0.12 0.00 -0.50 0.00 0.00 59.36 58.52 2dsk h GLU 503 Cb 0.39 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 2dsk h GLU 503 CO 0.03 0.78 -0.15 0.37 -1.40 0.00 0.00 179.01 178.64 2dsk h GLN 504 N 0.54 1.03 -0.34 2.33 4.15 -1.87 -1.52 115.11 119.44 2dsk h GLN 504 Ca 0.12 -0.40 -0.00 0.00 0.77 0.00 0.00 58.65 59.13 2dsk h GLN 504 Cb 0.45 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.07 2dsk h GLN 504 CO 0.02 1.09 0.19 1.25 -1.93 0.00 0.00 178.83 179.45 2dsk h LEU 505 N 0.90 0.42 -1.03 -2.39 5.85 -1.20 -1.68 115.31 116.19 2dsk h LEU 505 Ca 0.13 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 2dsk h LEU 505 Cb 0.72 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.61 2dsk h LEU 505 CO 0.06 0.37 0.46 0.00 -0.34 0.00 0.00 178.44 178.99 2dsk h ALA 506 N 1.06 1.26 -0.82 1.25 0.00 -0.89 -1.41 119.26 119.71 2dsk h ALA 506 Ca 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dsk h ALA 506 Cb 0.04 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 2dsk h ALA 506 CO -0.02 0.61 0.51 1.49 0.00 0.00 0.00 179.25 181.84 2dsk h GLU 507 N 1.15 1.10 -0.33 0.00 4.81 -0.81 -0.06 114.58 120.44 2dsk h GLU 507 Ca 0.29 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.35 2dsk h GLU 507 Cb 0.01 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.14 2dsk h GLU 507 CO -0.05 0.76 -0.13 -1.49 -0.73 0.00 0.00 179.01 177.37 2dsk h TRP 508 N 1.12 0.76 -0.60 0.92 6.55 -0.66 -1.28 115.95 122.78 2dsk h TRP 508 Ca 0.30 -0.18 -0.02 0.00 0.95 0.00 0.00 58.89 59.93 2dsk h TRP 508 Cb -0.07 -0.18 -0.03 0.00 -0.86 0.00 0.00 29.16 28.02 2dsk h TRP 508 CO -0.01 0.87 0.29 1.88 -1.05 0.00 0.00 178.44 180.41 2dsk h TYR 509 N 0.44 0.86 -0.16 0.49 0.99 -1.02 -2.40 116.97 116.17 2dsk h TYR 509 Ca 0.08 -0.04 -0.07 0.00 2.00 0.00 0.00 58.73 60.70 2dsk h TYR 509 Cb 0.65 -0.27 -0.01 0.00 1.00 0.00 0.00 36.73 38.10 2dsk h TYR 509 CO 0.06 0.66 -0.20 0.82 -0.00 0.00 0.00 178.16 179.49 2dsk h ILE 510 N 0.81 1.22 -0.77 -2.88 2.04 -0.93 -1.30 117.51 115.71 2dsk h ILE 510 Ca 0.20 -1.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.01 2dsk h ILE 510 Cb 0.12 1.32 -0.03 0.00 -0.74 0.00 0.00 36.82 37.49 2dsk h ILE 510 CO -0.03 0.31 0.30 0.50 0.00 0.00 0.00 178.15 179.24 2dsk h LYS 511 N 0.25 1.15 -0.22 2.37 3.64 -0.76 -0.13 116.57 122.88 2dsk h LYS 511 Ca 0.05 -0.21 -0.04 0.00 -1.27 0.00 0.00 60.65 59.17 2dsk h LYS 511 Cb 0.51 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2dsk h LYS 511 CO 0.03 0.94 -0.01 0.28 -2.27 0.00 0.00 179.45 178.42 2dsk h VAL 512 N 1.11 1.26 -0.17 2.00 2.07 -0.98 -1.46 116.25 120.09 2dsk h VAL 512 Ca 0.26 -0.92 0.04 0.00 0.82 0.00 0.00 66.70 66.89 2dsk h VAL 512 Cb 0.22 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.39 2dsk h VAL 512 CO -0.02 0.28 -0.08 0.40 0.02 0.00 0.00 177.57 178.17 2dsk h ILE 513 N 0.15 0.74 -0.24 4.57 2.04 -0.94 -2.41 117.51 121.42 2dsk h ILE 513 Ca 0.06 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 2dsk h ILE 513 Cb 0.43 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 2dsk h ILE 513 CO 0.01 0.00 -0.21 0.44 0.00 0.00 0.00 178.15 178.39 2dsk h ASP 514 N -0.07 0.42 -0.51 1.72 3.32 -0.99 0.47 116.42 120.79 2dsk h ASP 514 Ca 0.09 -0.13 -0.10 0.00 0.02 0.00 0.00 57.03 56.92 2dsk h ASP 514 Cb 0.20 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2dsk h ASP 514 CO -0.21 0.64 -0.06 0.74 -1.72 0.00 0.00 179.24 178.63 2dsk h THR 515 N 0.38 1.26 -0.13 0.35 2.02 -0.94 -3.23 112.91 112.63 2dsk h THR 515 Ca 0.06 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 66.06 2dsk h THR 515 Cb 0.58 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 2dsk h THR 515 CO 0.04 0.42 0.00 -1.22 0.37 0.00 0.00 175.52 175.13 2dsk n TYR 516 N -4.17 0.15 -3.91 3.16 4.02 -0.94 -4.96 117.16 110.52 2dsk n TYR 516 Ca 0.02 -0.12 -0.29 0.00 -0.01 0.00 0.00 57.90 57.51 2dsk n TYR 516 Cb 0.37 -0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.70 2dsk n TYR 516 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2dsk n ASN 517 N 0.91 -3.62 -4.76 7.72 4.05 0.15 -4.88 115.26 114.83 2dsk n ASN 517 Ca 0.11 -0.83 -0.38 0.00 0.45 0.00 0.00 54.58 53.93 2dsk n ASN 517 Cb 0.42 -3.74 0.01 0.00 1.23 0.00 0.00 39.78 37.70 2dsk n ASN 517 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2dsk s ALA 518 N -3.42 2.95 0.00 5.20 0.00 -0.34 -4.88 121.76 121.27 2dsk s ALA 518 Ca 0.50 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.58 2dsk s ALA 518 Cb -0.25 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2dsk s ALA 518 CO 0.84 -0.94 0.47 0.25 0.00 0.00 0.00 175.76 176.38 2dsk n THR 519 N -0.61 0.01 -3.67 0.00 -2.24 -1.26 -4.84 114.28 101.67 2dsk n THR 519 Ca 0.08 -0.47 -0.08 0.00 -2.27 0.00 0.00 64.05 61.31 2dsk n THR 519 Cb 0.46 1.06 -0.09 0.00 -2.10 0.00 0.00 70.33 69.67 2dsk n THR 519 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2dsk s TYR 520 N -0.01 -0.83 0.06 4.78 6.04 -1.26 -1.47 117.35 124.65 2dsk s TYR 520 Ca 0.00 1.65 0.09 0.00 0.04 0.00 0.00 57.07 58.84 2dsk s TYR 520 Cb 0.00 0.42 -0.03 0.00 -1.04 0.00 0.00 41.96 41.31 2dsk s TYR 520 CO 0.00 -0.45 -0.24 -0.51 -1.54 0.00 0.00 175.55 172.81 2dsk s LEU 521 N 1.85 2.33 -0.12 6.97 1.43 -0.29 -1.94 118.68 128.91 2dsk s LEU 521 Ca -0.08 -0.57 0.02 0.00 -1.03 0.00 0.00 54.13 52.47 2dsk s LEU 521 Cb -0.09 -1.35 0.01 0.00 0.03 0.00 0.00 46.19 44.80 2dsk s LEU 521 CO -0.15 0.24 -0.18 -0.62 0.23 0.00 0.00 176.35 175.88 2dsk s ASP 522 N -1.44 2.71 -0.46 2.29 2.15 0.28 -0.28 116.67 121.92 2dsk s ASP 522 Ca 0.13 -0.50 -0.11 0.00 0.43 0.00 0.00 52.55 52.50 2dsk s ASP 522 Cb -0.10 -1.23 0.10 0.00 -0.30 0.00 0.00 42.92 41.39 2dsk s ASP 522 CO 0.04 0.03 0.33 -0.36 -0.17 0.00 0.00 175.17 175.04 2dsk s PHE 523 N 0.96 3.35 -0.68 -5.34 0.40 0.73 -0.15 117.98 117.25 2dsk s PHE 523 Ca -0.06 -1.54 -0.20 0.00 -0.60 0.00 0.00 56.93 54.53 2dsk s PHE 523 Cb -0.15 -3.25 0.10 0.00 0.51 0.00 0.00 43.02 40.23 2dsk s PHE 523 CO -0.03 -0.91 0.87 0.34 0.70 0.00 0.00 175.22 176.20 2dsk s ASP 524 N 2.51 6.28 -0.39 1.36 -1.08 0.02 -1.04 116.67 124.33 2dsk s ASP 524 Ca 0.04 -1.43 -0.10 0.00 -0.52 0.00 0.00 52.55 50.54 2dsk s ASP 524 Cb -0.25 -2.36 0.05 0.00 -1.46 0.00 0.00 42.92 38.90 2dsk s ASP 524 CO 0.02 -1.20 0.21 -0.63 0.52 0.00 0.00 175.17 174.09 2dsk s ILE 525 N 3.08 4.36 -0.13 4.11 1.01 -0.65 -1.35 121.20 131.62 2dsk s ILE 525 Ca 0.19 -1.08 0.12 0.00 0.00 0.00 0.00 60.65 59.88 2dsk s ILE 525 Cb -0.18 -3.52 0.22 0.00 0.01 0.00 0.00 42.46 38.99 2dsk s ILE 525 CO 0.04 -0.32 1.13 -0.62 0.00 0.00 0.00 174.94 175.17 2dsk n GLU 526 N 4.95 2.06 -4.07 2.79 1.02 -1.26 -4.36 120.64 121.76 2dsk n GLU 526 Ca -0.11 -2.23 -0.09 0.00 -0.02 0.00 0.00 57.16 54.71 2dsk n GLU 526 Cb 0.45 -1.36 -0.09 0.00 -0.02 0.00 0.00 31.44 30.42 2dsk n GLU 526 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dsk s ALA 527 N -2.17 0.53 0.27 0.62 0.00 -1.26 -5.02 121.76 114.73 2dsk s ALA 527 Ca 0.22 -1.24 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 2dsk s ALA 527 Cb 0.19 0.80 -0.10 0.00 0.00 0.00 0.00 23.12 24.00 2dsk s ALA 527 CO 0.03 -0.52 1.39 0.20 0.00 0.00 0.00 175.76 176.85 2dsk s GLY 528 N -3.00 2.55 0.23 0.00 0.00 -1.26 -5.01 107.32 100.82 2dsk s GLY 528 Ca 0.20 1.29 0.00 0.00 0.00 0.00 0.00 44.72 46.21 2dsk s GLY 528 CO -0.00 2.15 0.17 -0.26 0.00 0.00 0.00 173.10 175.15 2dsk s ILE 529 N -0.35 0.00 -0.79 0.90 -4.36 -1.26 -5.06 121.20 110.28 2dsk s ILE 529 Ca 0.56 -1.98 -0.18 0.00 -0.26 0.00 0.00 60.65 58.79 2dsk s ILE 529 Cb -0.41 -2.49 0.13 0.00 1.25 0.00 0.00 42.46 40.94 2dsk s ILE 529 CO 0.46 0.00 0.93 -0.62 0.24 0.00 0.00 174.94 175.95 2dsk s ASP 530 N -3.19 6.48 0.28 4.36 -1.08 -1.26 -4.90 116.67 117.35 2dsk s ASP 530 Ca 0.39 -1.86 -0.03 0.00 -0.52 0.00 0.00 52.55 50.52 2dsk s ASP 530 Cb 0.06 -2.34 0.37 0.00 -1.46 0.00 0.00 42.92 39.55 2dsk s ASP 530 CO 0.15 -1.04 1.93 0.00 0.52 0.00 0.00 175.17 176.73 2dsk h ALA 531 N 8.84 1.34 -0.75 3.66 0.00 -1.97 -1.88 119.26 128.50 2dsk h ALA 531 Ca -0.03 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2dsk h ALA 531 Cb 1.05 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 2dsk h ALA 531 CO 1.05 0.59 0.29 0.22 0.00 0.00 0.00 179.25 181.40 2dsk h ASP 532 N 1.16 1.03 -0.36 0.00 1.82 -1.96 0.12 116.42 118.22 2dsk h ASP 532 Ca 0.31 -0.16 -0.09 0.00 -0.39 0.00 0.00 57.03 56.70 2dsk h ASP 532 Cb -0.08 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 39.66 2dsk h ASP 532 CO -0.06 0.91 -0.12 0.50 -1.61 0.00 0.00 179.24 178.87 2dsk h LYS 533 N 1.08 0.72 -0.71 0.28 3.64 -1.87 -1.45 116.57 118.25 2dsk h LYS 533 Ca 0.25 -0.29 -0.01 0.00 -1.27 0.00 0.00 60.65 59.33 2dsk h LYS 533 Cb 0.22 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.97 2dsk h LYS 533 CO -0.02 0.89 0.42 1.25 -2.27 0.00 0.00 179.45 179.72 2dsk h LEU 534 N 0.51 0.86 -0.47 5.20 5.85 -1.01 -1.52 115.31 124.74 2dsk h LEU 534 Ca 0.09 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2dsk h LEU 534 Cb 0.64 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 2dsk h LEU 534 CO 0.04 0.68 0.25 0.00 -0.34 0.00 0.00 178.44 179.07 2dsk h ALA 535 N 1.22 0.60 -0.74 1.25 0.00 -0.81 0.05 119.26 120.83 2dsk h ALA 535 Ca 0.26 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2dsk h ALA 535 Cb -0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 2dsk h ALA 535 CO -0.05 0.13 0.46 -0.44 0.00 0.00 0.00 179.25 179.36 2dsk h ASP 536 N 0.61 0.87 -0.30 0.00 3.32 -0.88 -0.82 116.42 119.22 2dsk h ASP 536 Ca 0.16 -0.04 -0.08 0.00 0.02 0.00 0.00 57.03 57.09 2dsk h ASP 536 Cb 0.07 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2dsk h ASP 536 CO -0.03 0.66 -0.14 0.00 -1.72 0.00 0.00 179.24 178.01 2dsk h ALA 537 N 1.50 0.42 0.00 3.45 0.00 -0.72 -3.02 119.26 120.89 2dsk h ALA 537 Ca 0.27 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2dsk h ALA 537 Cb -0.07 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2dsk h ALA 537 CO -0.05 0.31 -0.12 -0.07 0.00 0.00 0.00 179.25 179.32 2dsk h LEU 538 N 0.39 0.00 -0.84 0.00 3.38 -0.52 -1.70 115.31 116.02 2dsk h LEU 538 Ca 0.07 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 2dsk h LEU 538 Cb 0.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 2dsk h LEU 538 CO 0.04 0.12 -0.20 -0.07 0.09 0.00 0.00 178.44 178.42 2dsk h LEU 539 N 0.00 0.65 -0.11 1.67 3.38 -1.04 -0.64 115.31 119.22 2dsk h LEU 539 Ca -0.00 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.69 2dsk h LEU 539 Cb 0.56 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 2dsk h LEU 539 CO 0.02 0.85 -0.19 0.40 0.09 0.00 0.00 178.44 179.60 2dsk h ILE 540 N 0.58 1.38 -0.20 1.22 2.04 -1.33 -2.81 117.51 118.39 2dsk h ILE 540 Ca 0.09 -1.45 0.02 0.00 1.00 0.00 0.00 64.86 64.52 2dsk h ILE 540 Cb 0.66 2.07 -0.02 0.00 -0.74 0.00 0.00 36.82 38.78 2dsk h ILE 540 CO 0.05 0.42 0.08 0.58 0.00 0.00 0.00 178.15 179.27 2dsk h VAL 541 N -0.11 0.96 0.00 1.67 2.07 -1.14 -1.20 116.25 118.50 2dsk h VAL 541 Ca 0.01 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 2dsk h VAL 541 Cb 0.76 0.77 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2dsk h VAL 541 CO 0.04 0.03 -0.19 0.06 0.02 0.00 0.00 177.57 177.54 2dsk h GLN 542 N 0.18 0.00 -0.07 1.57 3.07 -1.19 0.13 115.11 118.80 2dsk h GLN 542 Ca 0.09 0.00 -0.10 0.00 0.09 0.00 0.00 58.65 58.73 2dsk h GLN 542 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.61 2dsk h GLN 542 CO -0.08 0.19 -0.35 -0.09 0.09 0.00 0.00 178.83 178.58 2dsk h ARG 543 N 0.00 0.36 0.00 0.06 2.43 -1.14 -2.50 114.38 113.59 2dsk h ARG 543 Ca -0.00 -0.30 -0.15 0.00 -0.81 0.00 0.00 59.98 58.72 2dsk h ARG 543 Cb 0.50 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 2dsk h ARG 543 CO 0.02 0.94 -0.73 0.93 -1.51 0.00 0.00 179.97 179.62 2dsk h GLU 544 N -0.13 0.00 -2.07 0.20 5.08 -0.99 -3.37 114.58 113.31 2dsk h GLU 544 Ca -0.02 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.77 2dsk h GLU 544 Cb 1.01 0.00 -0.40 0.00 0.50 0.00 0.00 28.75 29.86 2dsk h GLU 544 CO 0.07 0.73 -0.95 0.54 -1.00 0.00 0.00 179.01 178.41 2dsk n ARG 545 N -3.39 1.37 0.00 2.33 5.12 0.45 -4.98 116.66 117.57 2dsk n ARG 545 Ca 0.00 -3.73 0.00 0.00 -1.93 0.00 0.00 57.85 52.20 2dsk n ARG 545 Cb 0.79 -1.60 0.00 0.00 -1.16 0.00 0.00 32.46 30.49 2dsk n ARG 545 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2dsk n PRO 546 N 1.07 0.00 -0.04 5.56 -0.04 -0.94 -2.13 135.00 138.49 2dsk n PRO 546 Ca 0.24 0.32 0.12 0.00 -0.04 0.00 0.00 63.50 64.14 2dsk n PRO 546 Cb 0.50 -1.50 0.12 0.00 -0.04 0.00 0.00 33.50 32.58 2dsk n PRO 546 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2dsk n TRP 547 N -1.32 0.10 -3.40 0.54 2.14 -1.26 -4.92 117.44 109.32 2dsk n TRP 547 Ca 0.00 -0.05 -0.38 0.00 2.07 0.00 0.00 57.50 59.14 2dsk n TRP 547 Cb 0.00 -0.00 -0.08 0.00 -0.81 0.00 0.00 31.31 30.43 2dsk n TRP 547 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 2dsk s VAL 548 N -1.89 5.20 0.34 -1.67 1.01 -0.90 -4.86 120.40 117.63 2dsk s VAL 548 Ca 0.30 0.68 -0.15 0.00 0.00 0.00 0.00 61.98 62.81 2dsk s VAL 548 Cb 0.20 -3.72 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 2dsk s VAL 548 CO 0.30 0.25 0.76 -0.54 0.00 0.00 0.00 175.10 175.87 2dsk s LYS 549 N 1.35 3.98 -0.12 2.72 1.02 -0.54 -4.94 119.74 123.20 2dsk s LYS 549 Ca 0.18 0.67 0.01 0.00 0.02 0.00 0.00 55.97 56.85 2dsk s LYS 549 Cb -0.15 -2.41 -0.01 0.00 -0.52 0.00 0.00 37.83 34.74 2dsk s LYS 549 CO 0.08 0.11 -0.15 -0.06 -0.92 0.00 0.00 175.35 174.41 2dsk s PHE 550 N -2.06 2.76 0.04 3.18 2.99 -1.26 -1.14 117.98 122.49 2dsk s PHE 550 Ca 0.54 -0.71 0.09 0.00 0.00 0.00 0.00 56.93 56.86 2dsk s PHE 550 Cb -0.10 -1.82 -0.03 0.00 0.00 0.00 0.00 43.02 41.08 2dsk s PHE 550 CO 0.19 -0.24 -0.26 0.45 -0.00 0.00 0.00 175.22 175.36 2dsk s SER 551 N 0.33 3.17 -0.16 1.36 0.15 0.61 -1.74 113.70 117.42 2dsk s SER 551 Ca -0.12 -0.57 0.00 0.00 0.70 0.00 0.00 55.95 55.96 2dsk s SER 551 Cb -0.16 -0.30 0.03 0.00 -1.71 0.00 0.00 66.02 63.87 2dsk s SER 551 CO 0.06 0.27 -0.12 -0.36 1.20 0.00 0.00 173.24 174.29 2dsk s PHE 552 N -0.78 2.10 -0.23 3.44 0.40 -0.14 -0.19 117.98 122.59 2dsk s PHE 552 Ca 0.12 -1.23 -0.05 0.00 -0.60 0.00 0.00 56.93 55.16 2dsk s PHE 552 Cb -0.10 -1.54 -0.02 0.00 0.51 0.00 0.00 43.02 41.87 2dsk s PHE 552 CO 0.02 -0.66 0.01 0.99 0.70 0.00 0.00 175.22 176.28 2dsk s THR 553 N 1.51 3.89 0.06 0.64 2.01 -0.21 -0.07 115.64 123.47 2dsk s THR 553 Ca 0.03 -0.32 0.00 0.00 0.31 0.00 0.00 61.69 61.72 2dsk s THR 553 Cb -0.14 -2.79 -0.04 0.00 0.01 0.00 0.00 72.50 69.55 2dsk s THR 553 CO -0.10 0.39 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.42 2dsk s LEU 554 N 1.39 2.43 0.72 4.42 1.43 -1.08 -1.64 118.68 126.36 2dsk s LEU 554 Ca 0.05 -0.88 -0.15 0.00 -1.03 0.00 0.00 54.13 52.11 2dsk s LEU 554 Cb -0.15 0.06 0.03 0.00 0.03 0.00 0.00 46.19 46.17 2dsk s LEU 554 CO 0.01 -0.47 1.22 -2.84 0.23 0.00 0.00 176.35 174.49 2dsk s PRO 555 N -3.28 2.18 0.22 1.29 0.02 -1.26 -0.42 135.00 133.74 2dsk s PRO 555 Ca 0.03 1.80 -0.09 0.00 0.02 0.00 0.00 61.00 62.76 2dsk s PRO 555 Cb 0.03 -1.83 -0.02 0.00 0.02 0.00 0.00 34.50 32.70 2dsk s PRO 555 CO -0.06 -1.82 0.34 -1.54 -0.33 0.00 0.00 177.00 173.60 2dsk s SER 556 N -1.95 0.00 -0.17 2.53 1.04 -1.22 -3.41 113.70 110.53 2dsk s SER 556 Ca 0.75 -1.05 -0.13 0.00 0.48 0.00 0.00 55.95 56.00 2dsk s SER 556 Cb -0.30 0.50 0.05 0.00 0.10 0.00 0.00 66.02 66.37 2dsk s SER 556 CO 0.45 -1.01 0.43 -0.62 0.98 0.00 0.00 173.24 173.47 2dsk s ASP 557 N -3.05 -0.49 0.15 7.02 -1.08 -0.46 -4.74 116.67 114.03 2dsk s ASP 557 Ca 0.26 0.90 0.11 0.00 -0.52 0.00 0.00 52.55 53.30 2dsk s ASP 557 Cb 0.02 0.86 0.57 0.00 -1.46 0.00 0.00 42.92 42.92 2dsk s ASP 557 CO 0.08 -0.17 1.33 -0.81 0.52 0.00 0.00 175.17 176.13 2dsk n PRO 558 N 3.33 0.07 0.00 4.34 -0.04 -1.26 -0.23 135.00 141.20 2dsk n PRO 558 Ca -0.17 0.55 0.11 0.00 -0.04 0.00 0.00 63.50 63.95 2dsk n PRO 558 Cb 0.56 -1.71 0.01 0.00 -0.04 0.00 0.00 33.50 32.32 2dsk n PRO 558 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dsk n GLY 559 N -1.29 -1.09 0.00 0.55 0.00 -1.26 -4.54 105.19 97.56 2dsk n GLY 559 Ca -0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.50 2dsk n GLY 559 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2dsk n ILE 560 N -1.50 0.00 -0.22 -0.61 -5.35 -0.63 -5.13 119.36 105.91 2dsk n ILE 560 Ca 0.04 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.51 2dsk n ILE 560 Cb 0.33 0.33 0.00 0.00 -1.74 0.00 0.00 39.64 38.56 2dsk n ILE 560 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dsk n GLY 561 N 0.24 0.55 3.79 3.28 0.00 0.68 -4.81 105.19 108.91 2dsk n GLY 561 Ca 0.00 -0.97 -0.34 0.00 0.00 0.00 0.00 46.02 44.70 2dsk n GLY 561 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dsk s LEU 562 N 0.00 3.80 0.00 0.99 1.43 -1.26 -1.35 118.68 122.29 2dsk s LEU 562 Ca 0.00 2.04 0.00 0.00 -1.03 0.00 0.00 54.13 55.14 2dsk s LEU 562 Cb 0.00 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.65 2dsk s LEU 562 CO 0.00 -0.98 0.00 0.00 0.23 0.00 0.00 176.35 175.60 2dsk n ALA 563 N -1.11 0.00 0.30 4.21 0.00 -1.22 -4.65 120.51 118.04 2dsk n ALA 563 Ca 0.10 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.71 2dsk n ALA 563 Cb 0.52 0.00 0.93 0.00 0.00 0.00 0.00 19.45 20.90 2dsk n ALA 563 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2dsk h GLY 564 N 0.00 0.00 2.00 0.00 0.00 -1.97 -1.78 103.07 101.33 2dsk h GLY 564 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 2dsk h GLY 564 CO 0.00 0.00 -0.00 -1.33 0.00 0.00 0.00 176.54 175.21 2dsk h GLY 565 N 0.42 0.00 1.14 4.60 0.00 -1.88 -2.29 103.07 105.06 2dsk h GLY 565 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.36 2dsk h GLY 565 CO 0.00 0.00 0.50 -1.82 0.00 0.00 0.00 176.54 175.23 2dsk h TYR 566 N 0.00 0.90 0.00 5.60 3.20 -1.58 -0.55 116.97 124.55 2dsk h TYR 566 Ca -0.00 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.88 2dsk h TYR 566 Cb 0.12 -0.30 -0.00 0.00 1.54 0.00 0.00 36.73 38.09 2dsk h TYR 566 CO 0.00 0.53 -0.08 0.78 -1.64 0.00 0.00 178.16 177.75 2dsk h GLY 567 N 0.94 0.00 0.88 1.82 0.00 -1.62 -1.14 103.07 103.94 2dsk h GLY 567 Ca 0.30 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.56 2dsk h GLY 567 CO -0.09 0.00 -0.10 -2.22 0.00 0.00 0.00 176.54 174.13 2dsk h ILE 568 N 0.00 1.29 -0.54 2.60 2.04 -1.24 -1.66 117.51 120.00 2dsk h ILE 568 Ca -0.00 -1.16 -0.11 0.00 1.00 0.00 0.00 64.86 64.58 2dsk h ILE 568 Cb 0.16 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2dsk h ILE 568 CO 0.01 0.37 -0.11 0.40 0.00 0.00 0.00 178.15 178.82 2dsk h ILE 569 N 0.30 1.27 -0.78 -0.67 1.08 -1.26 -1.44 117.51 116.00 2dsk h ILE 569 Ca 0.07 -1.26 0.02 0.00 -0.39 0.00 0.00 64.86 63.29 2dsk h ILE 569 Cb 0.60 0.96 -0.04 0.00 -3.07 0.00 0.00 36.82 35.27 2dsk h ILE 569 CO 0.03 0.45 0.51 -0.33 -0.69 0.00 0.00 178.15 178.12 2dsk h GLU 570 N 0.90 0.99 -0.41 2.37 5.08 -1.14 -1.46 114.58 120.91 2dsk h GLU 570 Ca 0.14 -0.06 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 2dsk h GLU 570 Cb 0.67 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.68 2dsk h GLU 570 CO 0.05 0.66 0.10 1.15 -1.00 0.00 0.00 179.01 179.97 2dsk h THR 571 N 1.02 1.23 -0.26 1.13 2.02 -1.01 -1.09 112.91 115.94 2dsk h THR 571 Ca 0.30 -0.78 0.02 0.00 0.77 0.00 0.00 66.41 66.71 2dsk h THR 571 Cb -0.07 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 2dsk h THR 571 CO -0.08 0.27 0.13 0.24 0.37 0.00 0.00 175.52 176.45 2dsk h MET 572 N 0.52 0.27 -0.56 6.66 2.86 -0.88 -1.25 114.93 122.54 2dsk h MET 572 Ca 0.13 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 2dsk h MET 572 Cb 0.31 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.88 2dsk h MET 572 CO 0.00 0.18 0.30 0.00 1.06 0.00 0.00 176.91 178.45 2dsk h ALA 573 N 1.14 0.72 -0.70 6.32 0.00 -1.13 0.10 119.26 125.71 2dsk h ALA 573 Ca 0.11 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2dsk h ALA 573 Cb 0.03 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 2dsk h ALA 573 CO -0.08 0.24 0.21 -0.22 0.00 0.00 0.00 179.25 179.41 2dsk h LYS 574 N 0.76 1.08 -0.00 0.00 1.63 -0.94 -2.85 116.57 116.24 2dsk h LYS 574 Ca 0.20 -0.23 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 2dsk h LYS 574 Cb 0.05 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 31.52 2dsk h LYS 574 CO -0.03 0.92 -0.14 1.63 -3.45 0.00 0.00 179.45 178.38 2dsk n LYS 575 N -4.26 0.69 -0.96 1.90 5.02 -0.50 -4.94 118.16 115.12 2dsk n LYS 575 Ca 0.06 -0.27 0.00 0.00 -2.02 0.00 0.00 58.31 56.07 2dsk n LYS 575 Cb 0.23 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 2dsk n LYS 575 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2dsk n GLY 576 N 1.30 0.74 3.76 0.72 0.00 -0.66 -5.05 105.19 106.00 2dsk n GLY 576 Ca 0.14 -0.66 -0.39 0.00 0.00 0.00 0.00 46.02 45.11 2dsk n GLY 576 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dsk s VAL 577 N -2.00 4.94 0.35 1.61 1.01 0.27 -5.01 120.40 121.56 2dsk s VAL 577 Ca 0.00 1.24 -0.29 0.00 0.00 0.00 0.00 61.98 62.94 2dsk s VAL 577 Cb 0.00 -3.93 -0.11 0.00 0.00 0.00 0.00 36.38 32.34 2dsk s VAL 577 CO 0.00 0.40 1.41 0.00 0.00 0.00 0.00 175.10 176.91 2dsk s ARG 578 N -0.07 4.23 -0.38 2.72 1.70 -1.26 -4.37 118.95 121.51 2dsk s ARG 578 Ca 0.31 2.40 0.01 0.00 -0.47 0.00 0.00 55.73 57.99 2dsk s ARG 578 Cb -0.18 -3.02 0.12 0.00 -0.57 0.00 0.00 34.95 31.29 2dsk s ARG 578 CO 0.17 -0.38 0.16 0.08 -1.08 0.00 0.00 175.30 174.25 2dsk s VAL 579 N -1.02 1.38 -0.09 4.99 1.01 -1.26 -4.70 120.40 120.71 2dsk s VAL 579 Ca 0.52 -2.13 0.14 0.00 0.00 0.00 0.00 61.98 60.51 2dsk s VAL 579 Cb -0.43 -2.00 -0.08 0.00 0.00 0.00 0.00 36.38 33.87 2dsk s VAL 579 CO 0.57 -0.77 1.11 0.44 0.00 0.00 0.00 175.10 176.45 2dsk h ASP 580 N 7.34 0.00 -3.50 3.32 3.32 -1.72 -3.47 116.42 121.71 2dsk h ASP 580 Ca -0.06 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.88 2dsk h ASP 580 Cb 0.97 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.27 2dsk h ASP 580 CO 0.49 0.66 -0.24 -0.60 -1.72 0.00 0.00 179.24 177.83 2dsk s ARG 581 N -2.87 0.46 -0.23 3.56 3.52 -1.01 -4.60 118.95 117.77 2dsk s ARG 581 Ca 0.00 0.73 0.02 0.00 -0.13 0.00 0.00 55.73 56.36 2dsk s ARG 581 Cb 0.08 0.10 0.05 0.00 -1.56 0.00 0.00 34.95 33.63 2dsk s ARG 581 CO 0.79 -0.12 -0.14 0.08 -0.81 0.00 0.00 175.30 175.11 2dsk s VAL 582 N 0.91 2.11 -0.66 7.11 1.01 0.47 -0.96 120.40 130.39 2dsk s VAL 582 Ca -0.05 -1.41 0.03 0.00 0.00 0.00 0.00 61.98 60.55 2dsk s VAL 582 Cb -0.06 -2.13 0.16 0.00 0.00 0.00 0.00 36.38 34.35 2dsk s VAL 582 CO -0.07 0.15 0.44 0.21 0.00 0.00 0.00 175.10 175.82 2dsk s ASN 583 N 1.17 4.84 0.38 3.32 2.47 0.89 -1.38 114.94 126.63 2dsk s ASN 583 Ca -0.05 -3.44 -0.27 0.00 0.42 0.00 0.00 52.86 49.52 2dsk s ASN 583 Cb -0.18 -1.70 -0.10 0.00 -1.45 0.00 0.00 41.25 37.83 2dsk s ASN 583 CO -0.07 -0.18 1.34 -2.16 -3.72 0.00 0.00 177.10 172.31 2dsk s PRO 584 N -0.89 4.11 -0.59 0.43 0.04 -1.19 -2.62 135.00 134.29 2dsk s PRO 584 Ca 0.22 2.26 -0.22 0.00 0.04 0.00 0.00 61.00 63.30 2dsk s PRO 584 Cb -0.14 -2.90 0.06 0.00 0.04 0.00 0.00 34.50 31.57 2dsk s PRO 584 CO -0.09 -0.41 0.88 -1.64 0.04 0.00 0.00 177.00 175.77 2dsk s MET 585 N -2.07 3.18 -1.34 4.56 -1.94 0.44 -1.87 119.30 120.25 2dsk s MET 585 Ca 0.54 -0.70 -0.13 0.00 -1.71 0.00 0.00 55.69 53.69 2dsk s MET 585 Cb -0.40 -4.15 0.11 0.00 2.01 0.00 0.00 34.83 32.39 2dsk s MET 585 CO 0.53 -1.58 1.91 0.25 -0.01 0.00 0.00 175.02 176.12 2dsk n THR 586 N 5.92 3.95 -3.74 2.05 -2.24 -0.63 -3.42 114.28 116.18 2dsk n THR 586 Ca -0.03 -3.91 -0.09 0.00 -2.27 0.00 0.00 64.05 57.75 2dsk n THR 586 Cb 0.46 -2.46 -0.03 0.00 -2.10 0.00 0.00 70.33 66.20 2dsk n THR 586 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dsk s MET 587 N 2.18 1.52 -1.14 -0.78 0.23 -1.26 -4.31 119.30 115.75 2dsk s MET 587 Ca 0.45 -0.87 -0.25 0.00 -1.03 0.00 0.00 55.69 53.99 2dsk s MET 587 Cb 0.08 0.56 0.01 0.00 -1.53 0.00 0.00 34.83 33.96 2dsk s MET 587 CO -0.02 -0.67 0.74 -0.25 -2.03 0.00 0.00 175.02 172.79 2dsk n ASP 588 N -0.39 -4.90 0.08 -1.18 8.00 -1.26 -4.79 116.55 112.10 2dsk n ASP 588 Ca -0.08 -1.11 0.05 0.00 0.71 0.00 0.00 54.79 54.36 2dsk n ASP 588 Cb 0.62 -2.62 -0.03 0.00 -0.02 0.00 0.00 41.12 39.07 2dsk n ASP 588 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2dsk h TYR 589 N -2.03 0.00 0.00 1.24 0.99 -1.88 -3.48 116.97 111.80 2dsk h TYR 589 Ca -0.67 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.06 2dsk h TYR 589 Cb 1.37 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.10 2dsk h TYR 589 CO 0.34 0.34 0.00 0.66 -0.00 0.00 0.00 178.16 179.50 2dsk n TYR 590 N -2.87 0.00 0.94 4.88 4.02 -1.26 -4.46 117.16 118.41 2dsk n TYR 590 Ca -0.04 0.00 0.13 0.00 -0.01 0.00 0.00 57.90 57.98 2dsk n TYR 590 Cb 0.71 0.00 0.40 0.00 -0.02 0.00 0.00 39.34 40.43 2dsk n TYR 590 CO 0.00 0.00 0.00 -2.67 -1.01 0.00 0.00 176.86 173.18 2dsk n TRP 591 N 0.00 0.10 -3.74 -0.72 4.27 -1.26 -4.85 117.44 111.24 2dsk n TRP 591 Ca 0.00 0.03 -0.14 0.00 -3.89 0.00 0.00 57.50 53.50 2dsk n TRP 591 Cb 0.00 -0.42 -0.09 0.00 -1.36 0.00 0.00 31.31 29.44 2dsk n TRP 591 CO 0.00 0.00 0.00 -0.08 -2.29 0.00 0.00 177.69 175.32 2dsk s THR 592 N -3.02 0.05 0.60 -1.67 -1.32 -1.26 -5.16 115.64 103.85 2dsk s THR 592 Ca 0.12 -0.39 -0.18 0.00 -1.21 0.00 0.00 61.69 60.02 2dsk s THR 592 Cb 0.17 -0.63 -0.03 0.00 -1.51 0.00 0.00 72.50 70.50 2dsk s THR 592 CO 0.63 -0.22 1.19 -2.16 -2.21 0.00 0.00 174.62 171.85 2dsk s PRO 593 N -1.17 2.96 -1.19 7.08 0.04 -1.26 -4.39 135.00 137.07 2dsk s PRO 593 Ca -0.12 1.75 -0.17 0.00 0.04 0.00 0.00 61.00 62.49 2dsk s PRO 593 Cb -0.05 -1.94 0.11 0.00 0.04 0.00 0.00 34.50 32.67 2dsk s PRO 593 CO 0.04 -1.19 1.52 -1.12 0.04 0.00 0.00 177.00 176.29 2dsk s SER 594 N -1.74 6.86 0.25 6.66 0.01 -1.26 -4.73 113.70 119.75 2dsk s SER 594 Ca 0.75 -2.49 0.01 0.00 1.31 0.00 0.00 55.95 55.53 2dsk s SER 594 Cb -0.28 -2.49 -0.00 0.00 0.21 0.00 0.00 66.02 63.45 2dsk s SER 594 CO 0.33 -1.04 0.02 -0.46 0.41 0.00 0.00 173.24 172.51 2dsk n ASN 595 N 7.22 2.28 -0.13 2.44 0.23 -1.26 -3.17 115.26 122.87 2dsk n ASN 595 Ca 0.40 -2.13 -0.11 0.00 -0.53 0.00 0.00 54.58 52.21 2dsk n ASN 595 Cb 0.46 0.27 -0.02 0.00 -2.08 0.00 0.00 39.78 38.41 2dsk n ASN 595 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2dsk h ALA 596 N 1.19 0.54 -0.56 -2.53 0.00 -1.92 -2.27 119.26 113.72 2dsk h ALA 596 Ca -0.20 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.44 2dsk h ALA 596 Cb 0.64 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2dsk h ALA 596 CO 0.33 0.45 0.23 1.49 0.00 0.00 0.00 179.25 181.75 2dsk h GLU 597 N 0.59 0.42 -0.03 0.00 4.81 -1.95 -0.53 114.58 117.89 2dsk h GLU 597 Ca 0.09 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.14 2dsk h GLU 597 Cb 0.68 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.95 2dsk h GLU 597 CO 0.05 0.28 -0.69 -0.91 -0.73 0.00 0.00 179.01 177.01 2dsk h ASN 598 N 0.44 0.18 -0.46 1.04 2.35 -1.84 -2.04 115.58 115.25 2dsk h ASN 598 Ca 0.27 -0.12 -0.06 0.00 -0.55 0.00 0.00 56.30 55.84 2dsk h ASN 598 Cb 0.27 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 2dsk h ASN 598 CO -0.24 0.81 0.07 0.00 -1.65 0.00 0.00 177.43 176.43 2dsk h ALA 599 N 1.18 1.15 -0.43 -0.83 0.00 -0.77 -0.64 119.26 118.92 2dsk h ALA 599 Ca -0.02 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 2dsk h ALA 599 Cb 1.23 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2dsk h ALA 599 CO 0.10 0.56 -0.27 0.82 0.00 0.00 0.00 179.25 180.46 2dsk h ILE 600 N 0.79 1.27 -0.78 0.00 2.04 -0.96 -1.18 117.51 118.69 2dsk h ILE 600 Ca 0.16 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.57 2dsk h ILE 600 Cb 0.37 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.66 2dsk h ILE 600 CO 0.01 0.49 0.43 0.11 0.00 0.00 0.00 178.15 179.18 2dsk h LYS 601 N 0.79 1.08 -0.23 2.37 1.57 -0.95 -0.61 116.57 120.59 2dsk h LYS 601 Ca 0.09 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 2dsk h LYS 601 Cb 0.86 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 2dsk h LYS 601 CO 0.08 0.80 0.15 0.28 -0.57 0.00 0.00 179.45 180.19 2dsk h VAL 602 N 1.08 1.07 -0.71 0.50 2.07 -0.88 -1.50 116.25 117.87 2dsk h VAL 602 Ca 0.27 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.73 2dsk h VAL 602 Cb 0.03 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 30.48 2dsk h VAL 602 CO -0.04 0.06 0.40 0.00 0.02 0.00 0.00 177.57 178.01 2dsk h ALA 603 N 1.08 0.97 -0.60 1.67 0.00 -0.55 0.39 119.26 122.22 2dsk h ALA 603 Ca 0.09 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 2dsk h ALA 603 Cb -0.02 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 2dsk h ALA 603 CO -0.02 0.08 0.11 0.93 0.00 0.00 0.00 179.25 180.35 2dsk h GLU 604 N 0.73 0.97 -0.23 0.00 5.08 -0.82 -0.51 114.58 119.79 2dsk h GLU 604 Ca 0.32 -0.23 -0.16 0.00 -1.00 0.00 0.00 59.36 58.28 2dsk h GLU 604 Cb 0.21 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 2dsk h GLU 604 CO -0.19 0.89 -0.52 -0.91 -1.00 0.00 0.00 179.01 177.28 2dsk h ASN 605 N 0.91 0.74 -0.15 1.42 2.35 -0.49 -2.39 115.58 117.97 2dsk h ASN 605 Ca 0.19 -0.38 -0.10 0.00 -0.55 0.00 0.00 56.30 55.46 2dsk h ASN 605 Cb 0.39 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 2dsk h ASN 605 CO 0.01 1.12 -0.21 0.58 -1.65 0.00 0.00 177.43 177.28 2dsk h VAL 606 N 0.52 1.26 -0.16 2.81 2.07 -0.69 -0.57 116.25 121.48 2dsk h VAL 606 Ca 0.02 -1.23 0.02 0.00 0.82 0.00 0.00 66.70 66.32 2dsk h VAL 606 Cb 1.08 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 2dsk h VAL 606 CO 0.10 0.40 0.05 0.15 0.02 0.00 0.00 177.57 178.30 2dsk h PHE 607 N 0.52 0.09 -0.52 1.57 3.57 -0.87 0.58 116.94 121.88 2dsk h PHE 607 Ca 0.08 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.59 2dsk h PHE 607 Cb 0.64 -0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 2dsk h PHE 607 CO 0.03 0.05 0.34 -0.09 -2.23 0.00 0.00 178.31 176.40 2dsk h ARG 608 N 0.13 0.70 -0.92 1.11 9.65 -1.08 -0.62 114.38 123.35 2dsk h ARG 608 Ca 0.07 -0.05 0.01 0.00 -1.10 0.00 0.00 59.98 58.91 2dsk h ARG 608 Cb 0.04 -0.15 -0.05 0.00 -1.39 0.00 0.00 29.97 28.42 2dsk h ARG 608 CO -0.08 0.47 0.61 1.96 2.80 0.00 0.00 179.97 185.73 2dsk h GLN 609 N 0.71 1.21 -0.04 0.20 4.20 -0.55 -1.19 115.11 119.65 2dsk h GLN 609 Ca 0.19 -0.07 -0.19 0.00 0.06 0.00 0.00 58.65 58.64 2dsk h GLN 609 Cb -0.07 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.43 2dsk h GLN 609 CO -0.04 0.80 -0.80 -0.07 -0.67 0.00 0.00 178.83 178.05 2dsk h LEU 610 N 1.25 0.42 -1.36 1.46 3.38 -0.59 -2.95 115.31 116.91 2dsk h LEU 610 Ca 0.34 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 2dsk h LEU 610 Cb -0.14 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2dsk h LEU 610 CO -0.07 1.06 -0.13 0.11 0.09 0.00 0.00 178.44 179.49 2dsk h LYS 611 N 0.22 0.26 0.00 1.13 1.79 -0.75 0.24 116.57 119.46 2dsk h LYS 611 Ca -0.04 -0.06 -0.07 0.00 -2.18 0.00 0.00 60.65 58.29 2dsk h LYS 611 Cb 1.39 -0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 32.00 2dsk h LYS 611 CO 0.13 0.40 -0.34 0.37 -1.08 0.00 0.00 179.45 178.93 2dsk h GLN 612 N 0.25 0.00 0.11 3.15 5.75 -1.08 -1.56 115.11 121.73 2dsk h GLN 612 Ca 0.05 0.00 -0.30 0.00 -0.15 0.00 0.00 58.65 58.25 2dsk h GLN 612 Cb 0.39 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.93 2dsk h GLN 612 CO 0.02 0.34 -1.55 0.82 -2.65 0.00 0.00 178.83 175.82 2dsk h ILE 613 N 0.00 0.92 -2.34 2.39 2.04 -1.22 -3.41 117.51 115.89 2dsk h ILE 613 Ca -0.00 -2.37 -0.61 0.00 1.00 0.00 0.00 64.86 62.88 2dsk h ILE 613 Cb 0.86 2.62 -0.42 0.00 -0.74 0.00 0.00 36.82 39.14 2dsk h ILE 613 CO 0.04 0.72 -0.54 -1.22 0.00 0.00 0.00 178.15 177.15 2dsk n TYR 614 N -3.86 3.58 0.28 1.37 4.02 0.79 -4.92 117.16 118.43 2dsk n TYR 614 Ca -0.27 -4.14 0.16 0.00 -0.01 0.00 0.00 57.90 53.64 2dsk n TYR 614 Cb 0.92 -0.59 0.77 0.00 -0.02 0.00 0.00 39.34 40.42 2dsk n TYR 614 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2dsk h PRO 615 N 4.38 0.00 0.00 -0.72 0.13 -1.52 -2.46 132.00 131.81 2dsk h PRO 615 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2dsk h PRO 615 Cb 0.67 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.80 2dsk h PRO 615 CO 0.84 0.00 -0.14 -0.85 -0.23 0.00 0.00 178.00 177.61 2dsk n GLU 616 N -2.64 0.22 -2.82 0.86 0.00 -1.26 -4.86 120.64 110.13 2dsk n GLU 616 Ca -0.01 0.15 -0.37 0.00 0.00 0.00 0.00 57.16 56.93 2dsk n GLU 616 Cb 0.13 -1.73 -0.06 0.00 0.00 0.00 0.00 31.44 29.79 2dsk n GLU 616 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.13 177.28 2dsk s LYS 617 N -3.09 4.58 0.88 3.44 1.02 -0.93 -5.05 119.74 120.59 2dsk s LYS 617 Ca 0.10 1.29 -0.12 0.00 0.02 0.00 0.00 55.97 57.26 2dsk s LYS 617 Cb 0.14 -2.90 0.12 0.00 -0.52 0.00 0.00 37.83 34.67 2dsk s LYS 617 CO 0.62 0.34 1.10 -1.54 -0.92 0.00 0.00 175.35 174.94 2dsk s SER 618 N -1.54 3.71 0.26 2.83 1.04 -1.26 -4.82 113.70 113.92 2dsk s SER 618 Ca 0.47 1.36 -0.05 0.00 0.48 0.00 0.00 55.95 58.21 2dsk s SER 618 Cb -0.20 -2.05 0.29 0.00 0.10 0.00 0.00 66.02 64.17 2dsk s SER 618 CO 0.25 -2.47 1.90 0.44 0.98 0.00 0.00 173.24 174.34 2dsk h ASP 619 N -1.43 1.07 -0.69 7.02 3.32 -1.98 -1.36 116.42 122.36 2dsk h ASP 619 Ca -0.49 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.47 2dsk h ASP 619 Cb 1.29 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 2dsk h ASP 619 CO 0.57 0.83 0.35 -0.33 -1.72 0.00 0.00 179.24 178.93 2dsk h GLU 620 N 1.23 0.99 -0.69 3.56 3.07 -1.96 -1.07 114.58 119.71 2dsk h GLU 620 Ca 0.32 -0.14 -0.06 0.00 -0.50 0.00 0.00 59.36 58.98 2dsk h GLU 620 Cb -0.04 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 27.66 2dsk h GLU 620 CO -0.06 0.77 0.19 0.93 -1.40 0.00 0.00 179.01 179.44 2dsk h GLU 621 N 0.96 1.09 -0.11 2.33 5.08 -1.76 -1.64 114.58 120.54 2dsk h GLU 621 Ca 0.24 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 2dsk h GLU 621 Cb 0.09 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.19 2dsk h GLU 621 CO -0.03 0.96 0.03 0.82 -1.00 0.00 0.00 179.01 179.78 2dsk h ILE 622 N 1.03 1.19 -0.75 3.13 1.08 -0.93 -2.62 117.51 119.64 2dsk h ILE 622 Ca 0.22 -0.60 0.04 0.00 -0.39 0.00 0.00 64.86 64.13 2dsk h ILE 622 Cb 0.34 1.40 -0.04 0.00 -3.07 0.00 0.00 36.82 35.45 2dsk h ILE 622 CO -0.00 0.17 0.49 -0.50 -0.69 0.00 0.00 178.15 177.63 2dsk h TRP 623 N -0.03 0.87 0.00 1.37 -0.00 -1.09 -0.97 115.95 116.10 2dsk h TRP 623 Ca 0.03 0.02 -0.03 0.00 -0.00 0.00 0.00 58.89 58.92 2dsk h TRP 623 Cb 0.25 -0.29 -0.00 0.00 -0.00 0.00 0.00 29.16 29.12 2dsk h TRP 623 CO 0.01 0.50 -0.14 0.87 -0.00 0.00 0.00 178.44 179.68 2dsk h LYS 624 N 0.89 0.00 0.00 0.49 1.57 -1.06 -1.73 116.57 116.74 2dsk h LYS 624 Ca 0.30 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 59.03 2dsk h LYS 624 Cb 0.09 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2dsk h LYS 624 CO -0.09 0.14 -0.26 0.52 -0.57 0.00 0.00 179.45 179.18 2dsk h MET 625 N 0.00 0.00 -6.40 3.15 2.86 -0.82 -3.20 114.93 110.53 2dsk h MET 625 Ca -0.00 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.09 2dsk h MET 625 Cb 0.40 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.03 2dsk h MET 625 CO 0.02 0.26 0.08 0.42 1.06 0.00 0.00 176.91 178.75 2dsk s ILE 626 N -3.25 4.55 0.08 -1.22 1.01 -0.70 -0.40 121.20 121.27 2dsk s ILE 626 Ca 0.04 1.45 0.03 0.00 0.00 0.00 0.00 60.65 62.16 2dsk s ILE 626 Cb 0.08 -4.01 -0.03 0.00 0.01 0.00 0.00 42.46 38.51 2dsk s ILE 626 CO 0.68 0.51 -0.08 -0.83 0.00 0.00 0.00 174.94 175.22 2dsk s GLY 627 N -1.18 0.71 -0.03 6.18 0.00 -0.48 -1.39 107.32 111.13 2dsk s GLY 627 Ca 0.33 -1.09 0.04 0.00 0.00 0.00 0.00 44.72 44.00 2dsk s GLY 627 CO 0.23 -1.16 -0.15 1.08 0.00 0.00 0.00 173.10 173.10 2dsk s LEU 628 N -2.31 1.89 -0.33 0.66 1.43 -1.02 -3.16 118.68 115.83 2dsk s LEU 628 Ca 0.02 -0.30 -0.00 0.00 -1.03 0.00 0.00 54.13 52.82 2dsk s LEU 628 Cb -0.03 -0.83 0.11 0.00 0.03 0.00 0.00 46.19 45.47 2dsk s LEU 628 CO -0.01 0.13 0.12 -0.89 0.23 0.00 0.00 176.35 175.93 2dsk s THR 629 N 0.04 1.00 0.71 5.49 2.01 -0.78 -1.90 115.64 122.21 2dsk s THR 629 Ca -0.02 -1.64 -0.05 0.00 0.31 0.00 0.00 61.69 60.29 2dsk s THR 629 Cb -0.10 -1.75 0.09 0.00 0.01 0.00 0.00 72.50 70.75 2dsk s THR 629 CO 0.01 -0.72 1.01 -2.84 -0.69 0.00 0.00 174.62 171.39 2dsk s PRO 630 N 1.36 1.95 -0.27 4.92 0.02 -1.22 -1.61 135.00 140.16 2dsk s PRO 630 Ca 0.11 -0.54 -0.07 0.00 0.02 0.00 0.00 61.00 60.52 2dsk s PRO 630 Cb -0.19 -2.22 -0.01 0.00 0.02 0.00 0.00 34.50 32.11 2dsk s PRO 630 CO -0.20 -1.34 0.07 1.41 -0.33 0.00 0.00 177.00 176.61 2dsk s MET 631 N -5.22 3.36 0.47 5.54 1.75 -1.26 -1.21 119.30 122.73 2dsk s MET 631 Ca 0.63 -0.68 -0.23 0.00 -1.25 0.00 0.00 55.69 54.16 2dsk s MET 631 Cb -0.09 -3.32 -0.07 0.00 2.84 0.00 0.00 34.83 34.19 2dsk s MET 631 CO 0.45 -0.32 1.20 0.96 -0.65 0.00 0.00 175.02 176.66 2dsk s ILE 632 N 1.55 2.94 0.00 10.11 -4.36 -0.82 -4.47 121.20 126.15 2dsk s ILE 632 Ca 0.05 0.71 0.00 0.00 -0.26 0.00 0.00 60.65 61.14 2dsk s ILE 632 Cb -0.16 -3.36 0.00 0.00 1.25 0.00 0.00 42.46 40.19 2dsk s ILE 632 CO 0.02 -0.01 0.00 0.61 0.24 0.00 0.00 174.94 175.81 2dsk n GLY 633 N 0.49 2.69 3.72 6.27 0.00 -0.24 -4.68 105.19 113.44 2dsk n GLY 633 Ca 0.08 -0.42 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 2dsk n GLY 633 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2dsk s VAL 634 N 0.00 2.67 0.48 1.61 -7.23 -0.21 -0.74 120.40 116.98 2dsk s VAL 634 Ca 0.00 0.48 0.05 0.00 -1.81 0.00 0.00 61.98 60.71 2dsk s VAL 634 Cb 0.00 -3.31 0.02 0.00 0.56 0.00 0.00 36.38 33.65 2dsk s VAL 634 CO 0.00 0.04 0.67 0.20 -0.31 0.00 0.00 175.10 175.70 2dsk s ASN 635 N 1.09 5.46 0.52 4.85 -0.87 0.23 -4.93 114.94 121.29 2dsk s ASN 635 Ca 0.69 -0.28 0.17 0.00 -1.57 0.00 0.00 52.86 51.88 2dsk s ASN 635 Cb -0.43 -0.69 1.31 0.00 -0.02 0.00 0.00 41.25 41.41 2dsk s ASN 635 CO 0.32 -0.95 2.14 0.44 -2.57 0.00 0.00 177.10 176.47 2dsk h ASP 636 N 0.38 0.00 -0.25 -1.22 3.32 -1.95 -0.01 116.42 116.69 2dsk h ASP 636 Ca -0.40 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.65 2dsk h ASP 636 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 2dsk h ASP 636 CO 0.48 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 177.10 2dsk n ASP 637 N -4.49 1.43 0.00 6.45 5.75 -1.26 -4.90 116.55 119.52 2dsk n ASP 637 Ca -0.02 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.82 2dsk n ASP 637 Cb 0.14 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 2dsk n ASP 637 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2dsk n LYS 638 N 0.26 0.00 -1.79 0.11 4.76 -0.02 -4.95 118.16 116.53 2dsk n LYS 638 Ca 0.10 0.00 -0.30 0.00 -2.87 0.00 0.00 58.31 55.24 2dsk n LYS 638 Cb 0.23 -2.85 0.07 0.00 -1.84 0.00 0.00 35.03 30.65 2dsk n LYS 638 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2dsk s SER 639 N -2.83 4.89 -0.10 4.39 1.04 -1.26 -4.71 113.70 115.12 2dsk s SER 639 Ca 0.00 1.07 0.02 0.00 0.48 0.00 0.00 55.95 57.52 2dsk s SER 639 Cb 0.00 -1.77 0.01 0.00 0.10 0.00 0.00 66.02 64.36 2dsk s SER 639 CO 0.00 -1.69 -0.15 -0.69 0.98 0.00 0.00 173.24 171.69 2dsk s VAL 640 N -3.36 1.47 -0.61 5.02 1.01 -1.26 -0.60 120.40 122.06 2dsk s VAL 640 Ca 0.60 -0.64 -0.20 0.00 0.00 0.00 0.00 61.98 61.74 2dsk s VAL 640 Cb -0.12 -1.33 0.09 0.00 0.00 0.00 0.00 36.38 35.02 2dsk s VAL 640 CO 0.52 0.43 0.79 0.12 0.00 0.00 0.00 175.10 176.96 2dsk s PHE 641 N 0.86 2.89 0.86 5.22 5.36 0.08 -4.67 117.98 128.58 2dsk s PHE 641 Ca -0.10 -0.78 -0.13 0.00 -0.96 0.00 0.00 56.93 54.97 2dsk s PHE 641 Cb -0.15 -4.08 0.11 0.00 -0.34 0.00 0.00 43.02 38.56 2dsk s PHE 641 CO 0.01 -1.40 1.18 0.95 -1.46 0.00 0.00 175.22 174.49 2dsk s THR 642 N 3.17 1.99 0.38 0.12 -4.23 -1.26 -1.08 115.64 114.72 2dsk s THR 642 Ca 0.16 0.00 0.10 0.00 -1.18 0.00 0.00 61.69 60.77 2dsk s THR 642 Cb -0.21 -2.91 0.13 0.00 1.34 0.00 0.00 72.50 70.85 2dsk s THR 642 CO 0.08 0.00 1.88 0.25 -0.54 0.00 0.00 174.62 176.29 2dsk h LEU 643 N -1.27 0.17 -0.56 4.79 5.85 -1.99 -0.23 115.31 122.07 2dsk h LEU 643 Ca -0.47 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.12 2dsk h LEU 643 Cb 1.32 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 2dsk h LEU 643 CO 0.62 0.40 0.01 -0.08 -0.34 0.00 0.00 178.44 179.05 2dsk h GLU 644 N 0.16 0.98 -0.78 1.25 4.81 -1.99 -1.39 114.58 117.61 2dsk h GLU 644 Ca 0.03 -0.31 -0.03 0.00 -0.13 0.00 0.00 59.36 58.93 2dsk h GLU 644 Cb 0.48 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.73 2dsk h GLU 644 CO 0.03 0.97 0.38 -0.44 -0.73 0.00 0.00 179.01 179.23 2dsk h ASP 645 N 0.86 1.02 -0.34 1.04 3.32 -1.63 -0.92 116.42 119.77 2dsk h ASP 645 Ca 0.16 -0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.09 2dsk h ASP 645 Cb 0.53 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 2dsk h ASP 645 CO 0.03 0.87 0.21 0.00 -1.72 0.00 0.00 179.24 178.62 2dsk h ALA 646 N 1.20 0.43 -0.57 3.45 0.00 -0.64 0.39 119.26 123.51 2dsk h ALA 646 Ca 0.27 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 2dsk h ALA 646 Cb 0.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2dsk h ALA 646 CO -0.03 -0.13 0.13 0.37 0.00 0.00 0.00 179.25 179.58 2dsk h GLN 647 N 0.43 0.92 -0.62 0.00 5.75 -0.94 -0.54 115.11 120.11 2dsk h GLN 647 Ca 0.13 -0.23 -0.02 0.00 -0.15 0.00 0.00 58.65 58.38 2dsk h GLN 647 Cb -0.02 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.38 2dsk h GLN 647 CO -0.05 0.86 0.29 0.37 -2.65 0.00 0.00 178.83 177.66 2dsk h GLN 648 N 0.83 0.90 -0.48 1.69 4.15 -0.86 -1.44 115.11 119.89 2dsk h GLN 648 Ca 0.18 -0.14 -0.09 0.00 0.77 0.00 0.00 58.65 59.37 2dsk h GLN 648 Cb 0.36 -0.16 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 2dsk h GLN 648 CO 0.00 0.73 -0.04 1.25 -1.93 0.00 0.00 178.83 178.84 2dsk h LEU 649 N 0.86 0.87 -0.46 -2.39 5.85 -0.67 -1.99 115.31 117.37 2dsk h LEU 649 Ca 0.21 -0.33 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 2dsk h LEU 649 Cb 0.13 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2dsk h LEU 649 CO -0.03 0.99 0.27 0.58 -0.34 0.00 0.00 178.44 179.91 2dsk h VAL 650 N 0.73 1.15 -0.70 1.05 2.07 -0.88 0.80 116.25 120.48 2dsk h VAL 650 Ca 0.13 -0.38 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 2dsk h VAL 650 Cb 0.57 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 2dsk h VAL 650 CO 0.03 0.16 0.24 0.44 0.02 0.00 0.00 177.57 178.47 2dsk h ASP 651 N 0.61 0.98 -0.51 0.57 3.32 -1.16 -0.78 116.42 119.44 2dsk h ASP 651 Ca 0.16 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 2dsk h ASP 651 Cb 0.02 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 2dsk h ASP 651 CO -0.03 0.89 -0.03 -0.25 -1.72 0.00 0.00 179.24 178.11 2dsk h TRP 652 N 1.02 1.02 -0.63 4.55 7.01 -0.99 -1.94 115.95 125.99 2dsk h TRP 652 Ca 0.23 -0.19 -0.05 0.00 2.11 0.00 0.00 58.89 60.99 2dsk h TRP 652 Cb 0.25 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.02 2dsk h TRP 652 CO 0.02 0.95 0.17 0.00 -2.79 0.00 0.00 178.44 176.80 2dsk h ALA 653 N 0.93 1.12 -0.17 2.65 0.00 -0.37 -1.18 119.26 122.24 2dsk h ALA 653 Ca 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2dsk h ALA 653 Cb 0.57 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2dsk h ALA 653 CO 0.03 0.60 -0.03 0.82 0.00 0.00 0.00 179.25 180.67 2dsk h ILE 654 N 0.93 1.28 -0.88 0.00 2.04 -1.04 -1.18 117.51 118.66 2dsk h ILE 654 Ca 0.20 -0.95 0.03 0.00 1.00 0.00 0.00 64.86 65.14 2dsk h ILE 654 Cb 0.30 1.56 -0.05 0.00 -0.74 0.00 0.00 36.82 37.89 2dsk h ILE 654 CO -0.00 0.28 0.58 -0.61 0.00 0.00 0.00 178.15 178.40 2dsk h GLN 655 N 0.04 1.09 -0.02 2.37 4.15 -1.09 -2.20 115.11 119.45 2dsk h GLN 655 Ca 0.05 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.40 2dsk h GLN 655 Cb 0.44 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.89 2dsk h GLN 655 CO 0.01 0.72 -0.00 0.72 -1.93 0.00 0.00 178.83 178.35 2dsk n HIS 656 N -4.43 0.00 -3.93 3.99 8.25 -0.47 -4.97 115.22 113.66 2dsk n HIS 656 Ca 0.11 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.31 2dsk n HIS 656 Cb 0.08 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.19 2dsk n HIS 656 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2dsk n LYS 657 N 0.41 -3.95 -1.33 -0.41 5.02 -0.47 -4.87 118.16 112.56 2dsk n LYS 657 Ca 0.18 0.47 -0.29 0.00 -2.02 0.00 0.00 58.31 56.65 2dsk n LYS 657 Cb 0.41 -4.89 0.14 0.00 -0.02 0.00 0.00 35.03 30.66 2dsk n LYS 657 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2dsk s ILE 658 N -3.70 2.44 0.20 -0.18 -4.36 -1.07 -4.23 121.20 110.29 2dsk s ILE 658 Ca 0.21 0.14 -0.04 0.00 -0.26 0.00 0.00 60.65 60.70 2dsk s ILE 658 Cb -0.11 -2.74 -0.03 0.00 1.25 0.00 0.00 42.46 40.84 2dsk s ILE 658 CO 0.87 -0.19 1.54 1.23 0.24 0.00 0.00 174.94 178.63 2dsk h GLY 659 N -1.55 0.70 -2.24 6.27 0.00 -0.66 -3.46 103.07 102.14 2dsk h GLY 659 Ca -0.51 -0.74 0.16 0.00 0.00 0.00 0.00 47.33 46.24 2dsk h GLY 659 CO 0.58 0.67 0.44 -1.35 0.00 0.00 0.00 176.54 176.87 2dsk s SER 660 N -6.87 -0.18 0.03 0.19 1.04 -1.12 -2.16 113.70 104.63 2dsk s SER 660 Ca -0.08 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 55.88 2dsk s SER 660 Cb 0.12 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.75 2dsk s SER 660 CO 0.84 -1.00 -0.03 -0.76 0.98 0.00 0.00 173.24 173.28 2dsk s LEU 661 N -2.95 2.34 0.29 2.42 1.43 -0.43 -2.44 118.68 119.34 2dsk s LEU 661 Ca 0.12 -0.72 -0.20 0.00 -1.03 0.00 0.00 54.13 52.30 2dsk s LEU 661 Cb -0.02 0.15 0.04 0.00 0.03 0.00 0.00 46.19 46.39 2dsk s LEU 661 CO 0.03 -0.44 0.79 0.00 0.23 0.00 0.00 176.35 176.97 2dsk s ALA 662 N -2.56 -1.16 0.18 4.21 0.00 -0.80 -2.23 121.76 119.40 2dsk s ALA 662 Ca -0.06 -0.38 -0.21 0.00 0.00 0.00 0.00 51.96 51.31 2dsk s ALA 662 Cb -0.02 0.77 0.05 0.00 0.00 0.00 0.00 23.12 23.92 2dsk s ALA 662 CO -0.05 -1.03 0.60 -0.59 0.00 0.00 0.00 175.76 174.69 2dsk s PHE 663 N -3.27 -0.41 -0.33 0.00 -0.12 -1.26 -3.44 117.98 109.15 2dsk s PHE 663 Ca 0.13 0.13 -0.08 0.00 -0.05 0.00 0.00 56.93 57.06 2dsk s PHE 663 Cb -0.05 0.54 0.03 0.00 -0.63 0.00 0.00 43.02 42.91 2dsk s PHE 663 CO 0.08 -0.91 0.12 -0.46 -0.05 0.00 0.00 175.22 173.99 2dsk s TRP 664 N -3.80 3.22 0.29 3.49 -0.11 -0.35 -1.84 118.94 119.84 2dsk s TRP 664 Ca 0.04 -1.17 -0.10 0.00 1.22 0.00 0.00 56.10 56.09 2dsk s TRP 664 Cb -0.02 -2.31 0.00 0.00 -1.50 0.00 0.00 33.47 29.65 2dsk s TRP 664 CO -0.08 -0.66 0.52 -1.54 -4.62 0.00 0.00 176.95 170.56 2dsk s SER 665 N 1.47 0.21 0.15 5.86 1.04 -1.26 -1.94 113.70 119.23 2dsk s SER 665 Ca 0.01 -1.11 -0.16 0.00 0.48 0.00 0.00 55.95 55.16 2dsk s SER 665 Cb -0.19 0.64 0.02 0.00 0.10 0.00 0.00 66.02 66.59 2dsk s SER 665 CO 0.04 -1.25 1.80 0.58 0.98 0.00 0.00 173.24 175.38 2dsk h VAL 666 N 2.18 1.07 0.00 5.02 2.07 -1.04 -2.40 116.25 123.15 2dsk h VAL 666 Ca -0.27 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2dsk h VAL 666 Cb 1.25 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 2dsk h VAL 666 CO 0.37 0.09 0.00 0.47 0.02 0.00 0.00 177.57 178.52 2dsk n ASP 667 N -4.85 0.00 -0.63 0.57 8.00 -1.26 -2.22 116.55 116.16 2dsk n ASP 667 Ca 0.00 -0.09 0.12 0.00 0.71 0.00 0.00 54.79 55.54 2dsk n ASP 667 Cb 0.04 -0.24 0.13 0.00 -0.02 0.00 0.00 41.12 41.03 2dsk n ASP 667 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2dsk n ARG 668 N -1.24 1.60 -1.27 -1.24 1.74 -0.91 -3.64 116.66 111.70 2dsk n ARG 668 Ca 0.10 -1.26 -0.35 0.00 -0.77 0.00 0.00 57.85 55.57 2dsk n ARG 668 Cb 0.14 -1.47 -0.05 0.00 -1.02 0.00 0.00 32.46 30.06 2dsk n ARG 668 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2dsk n ASP 669 N 0.40 8.26 -3.92 0.55 2.03 -0.94 -0.87 116.55 122.07 2dsk n ASP 669 Ca 0.12 -2.56 -0.10 0.00 0.52 0.00 0.00 54.79 52.77 2dsk n ASP 669 Cb 0.49 -1.54 -0.10 0.00 -0.72 0.00 0.00 41.12 39.25 2dsk n ASP 669 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2dsk s HIS 670 N 1.96 0.13 0.63 -0.67 3.76 -1.26 -0.94 115.29 118.89 2dsk s HIS 670 Ca 0.69 -0.28 -0.15 0.00 -0.15 0.00 0.00 55.06 55.17 2dsk s HIS 670 Cb 0.20 -0.10 -0.02 0.00 1.11 0.00 0.00 32.58 33.77 2dsk s HIS 670 CO -0.05 -0.24 1.08 -1.25 -0.85 0.00 0.00 174.74 173.43 2dsk s PRO 671 N -1.36 3.07 0.28 8.40 0.04 -1.21 -1.58 135.00 142.66 2dsk s PRO 671 Ca -0.15 1.26 -0.20 0.00 0.04 0.00 0.00 61.00 61.96 2dsk s PRO 671 Cb -0.08 -2.00 0.06 0.00 0.04 0.00 0.00 34.50 32.52 2dsk s PRO 671 CO 0.00 -1.01 0.88 0.20 0.04 0.00 0.00 177.00 177.11 2dsk s GLY 672 N -2.78 0.15 -0.16 0.56 0.00 -0.72 -4.75 107.32 99.63 2dsk s GLY 672 Ca 0.65 -0.45 -0.39 0.00 0.00 0.00 0.00 44.72 44.52 2dsk s GLY 672 CO 0.40 0.58 1.60 -1.05 0.00 0.00 0.00 173.10 174.62 2dsk n PRO 673 N -0.56 1.11 -1.63 2.90 -0.02 -1.26 -3.82 135.00 131.71 2dsk n PRO 673 Ca -0.06 0.40 -0.51 0.00 -2.02 0.00 0.00 63.50 61.31 2dsk n PRO 673 Cb 0.60 -2.07 -0.06 0.00 -0.02 0.00 0.00 33.50 31.95 2dsk n PRO 673 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2dsk n THR 674 N 3.84 0.09 -0.98 3.45 -1.04 -1.26 -2.12 114.28 116.26 2dsk n THR 674 Ca 0.24 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.23 2dsk n THR 674 Cb 0.14 -1.12 0.00 0.00 -1.82 0.00 0.00 70.33 67.53 2dsk n THR 674 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2dsk n GLY 675 N 3.11 0.87 3.74 3.41 0.00 -0.78 -5.02 105.19 110.51 2dsk n GLY 675 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2dsk n GLY 675 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dsk s GLU 676 N -0.06 4.27 -0.21 1.61 2.02 -0.90 -5.02 118.70 120.42 2dsk s GLU 676 Ca 0.00 0.35 -0.21 0.00 0.02 0.00 0.00 54.97 55.14 2dsk s GLU 676 Cb 0.00 -3.41 -0.02 0.00 0.10 0.00 0.00 34.13 30.80 2dsk s GLU 676 CO 0.00 0.24 0.63 0.08 0.02 0.00 0.00 175.26 176.22 2dsk s VAL 677 N 0.39 5.02 0.08 2.63 1.01 -1.26 -3.84 120.40 124.43 2dsk s VAL 677 Ca 0.23 1.17 -0.16 0.00 0.00 0.00 0.00 61.98 63.23 2dsk s VAL 677 Cb -0.15 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.32 2dsk s VAL 677 CO 0.09 0.10 0.37 -0.55 0.00 0.00 0.00 175.10 175.11 2dsk s SER 678 N 1.24 -0.20 0.00 3.32 0.15 -1.26 -5.03 113.70 111.93 2dsk s SER 678 Ca 0.28 -0.21 0.29 0.00 0.70 0.00 0.00 55.95 57.01 2dsk s SER 678 Cb -0.16 0.42 1.19 0.00 -1.71 0.00 0.00 66.02 65.76 2dsk s SER 678 CO 0.10 -0.73 1.82 -0.81 1.20 0.00 0.00 173.24 174.83 2dsk n PRO 679 N 0.21 1.36 0.00 5.44 -0.04 -1.26 -3.97 135.00 136.75 2dsk n PRO 679 Ca -0.17 -0.67 0.05 0.00 -0.04 0.00 0.00 63.50 62.67 2dsk n PRO 679 Cb 0.61 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2dsk n PRO 679 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2dsk n LEU 680 N -0.23 1.30 -3.77 1.53 4.77 -1.26 -3.91 117.00 115.42 2dsk n LEU 680 Ca 0.19 -0.78 -0.06 0.00 -0.03 0.00 0.00 56.01 55.33 2dsk n LEU 680 Cb 0.30 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 2dsk n LEU 680 CO 0.18 0.26 0.59 -1.38 -1.33 0.00 0.00 177.39 175.71 2dsk s HIS 681 N -1.39 -0.19 -1.44 -1.77 -3.43 -1.24 -4.54 115.29 101.29 2dsk s HIS 681 Ca 0.09 -0.17 0.16 0.00 -0.80 0.00 0.00 55.06 54.34 2dsk s HIS 681 Cb 0.09 0.66 0.42 0.00 -1.43 0.00 0.00 32.58 32.32 2dsk s HIS 681 CO 0.26 -1.00 1.35 2.89 -2.00 0.00 0.00 174.74 176.24 2dsk n ARG 682 N -0.45 2.68 -1.90 -0.38 1.85 -0.05 -4.15 116.66 114.25 2dsk n ARG 682 Ca -0.06 -2.24 -0.17 0.00 -1.00 0.00 0.00 57.85 54.38 2dsk n ARG 682 Cb 0.60 -1.39 -0.04 0.00 -1.05 0.00 0.00 32.46 30.58 2dsk n ARG 682 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2dsk n GLY 683 N 1.00 0.68 3.46 2.89 0.00 -1.25 -1.05 105.19 110.92 2dsk n GLY 683 Ca 0.16 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 2dsk n GLY 683 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dsk s THR 684 N -2.74 0.73 -2.67 2.61 -4.23 -1.25 -1.87 115.64 106.23 2dsk s THR 684 Ca 0.00 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 58.76 2dsk s THR 684 Cb 0.00 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.70 2dsk s THR 684 CO 0.00 0.00 1.47 0.59 -0.54 0.00 0.00 174.62 176.14 2dsk n ASN 685 N -1.03 2.44 -4.77 3.99 3.02 -1.26 -1.76 115.26 115.89 2dsk n ASN 685 Ca -0.04 -1.81 -0.40 0.00 -0.03 0.00 0.00 54.58 52.30 2dsk n ASN 685 Cb 0.65 -0.06 -0.01 0.00 -0.61 0.00 0.00 39.78 39.76 2dsk n ASN 685 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2dsk s ASP 686 N -1.86 6.38 0.97 6.41 1.01 -1.26 -4.87 116.67 123.45 2dsk s ASP 686 Ca 0.33 2.78 -0.11 0.00 0.71 0.00 0.00 52.55 56.27 2dsk s ASP 686 Cb 0.20 -2.65 0.18 0.00 1.01 0.00 0.00 42.92 41.66 2dsk s ASP 686 CO 0.31 -0.82 1.12 -2.16 0.21 0.00 0.00 175.17 173.83 2dsk s PRO 687 N -2.12 0.59 0.18 8.23 0.04 -1.26 -3.30 135.00 137.36 2dsk s PRO 687 Ca 0.54 1.38 -0.33 0.00 0.04 0.00 0.00 61.00 62.64 2dsk s PRO 687 Cb -0.41 -1.69 -0.16 0.00 0.04 0.00 0.00 34.50 32.28 2dsk s PRO 687 CO 0.54 -2.87 1.18 -0.25 0.04 0.00 0.00 177.00 175.64 2dsk n ASP 688 N -4.38 1.44 -0.43 6.66 8.00 -1.26 -1.58 116.55 124.99 2dsk n ASP 688 Ca 0.10 1.14 -0.06 0.00 0.71 0.00 0.00 54.79 56.68 2dsk n ASP 688 Cb 0.53 -1.23 -0.02 0.00 -0.02 0.00 0.00 41.12 40.37 2dsk n ASP 688 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 2dsk n TRP 689 N 1.54 0.00 -0.20 1.24 7.02 -0.12 -4.90 117.44 122.02 2dsk n TRP 689 Ca 0.15 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.59 2dsk n TRP 689 Cb 0.25 -1.98 0.06 0.00 -2.42 0.00 0.00 31.31 27.22 2dsk n TRP 689 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2dsk h ALA 690 N 0.00 0.75 -0.42 6.99 0.00 -1.53 -1.98 119.26 123.07 2dsk h ALA 690 Ca -0.12 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 2dsk h ALA 690 Cb 0.87 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2dsk h ALA 690 CO 0.17 0.04 -0.29 0.74 0.00 0.00 0.00 179.25 179.91 2dsk h PHE 691 N 0.66 1.11 -0.44 0.00 -1.00 -1.90 -2.83 116.94 112.53 2dsk h PHE 691 Ca 0.24 -0.30 0.06 0.00 2.81 0.00 0.00 57.97 60.78 2dsk h PHE 691 Cb 0.07 -0.25 -0.05 0.00 3.61 0.00 0.00 35.95 39.33 2dsk h PHE 691 CO -0.07 1.12 0.13 0.77 -1.61 0.00 0.00 178.31 178.65 2dsk h SER 692 N 0.78 0.11 -0.34 2.17 0.02 -1.79 -0.83 113.55 113.66 2dsk h SER 692 Ca 0.08 0.06 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2dsk h SER 692 Cb 0.88 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 63.46 2dsk h SER 692 CO 0.08 0.09 0.14 0.45 -1.14 0.00 0.00 176.83 176.45 2dsk h HIS 693 N 0.29 0.57 -0.08 3.45 3.86 -1.29 -1.16 115.15 120.78 2dsk h HIS 693 Ca 0.21 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.33 2dsk h HIS 693 Cb 0.23 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.52 2dsk h HIS 693 CO -0.17 0.47 -0.20 0.28 0.86 0.00 0.00 177.93 179.16 2dsk h VAL 694 N 0.57 1.41 -0.27 2.45 2.07 -1.12 -3.23 116.25 118.12 2dsk h VAL 694 Ca 0.14 -1.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.10 2dsk h VAL 694 Cb 0.15 2.19 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 2dsk h VAL 694 CO -0.01 0.43 0.04 -0.26 0.02 0.00 0.00 177.57 177.79 2dsk h PHE 695 N -0.19 0.40 0.00 1.57 -1.00 -0.93 -2.15 116.94 114.65 2dsk h PHE 695 Ca -0.00 -0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.76 2dsk h PHE 695 Cb 0.80 -0.12 -0.00 0.00 3.61 0.00 0.00 35.95 40.24 2dsk h PHE 695 CO 0.11 0.38 -0.00 0.28 -1.61 0.00 0.00 178.31 177.47 2dsk h VAL 696 N 0.39 0.79 -0.34 -0.55 2.07 -1.24 -1.64 116.25 115.74 2dsk h VAL 696 Ca 0.09 -0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.67 2dsk h VAL 696 Cb 0.20 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 2dsk h VAL 696 CO 0.00 0.00 0.23 0.11 0.02 0.00 0.00 177.57 177.93 2dsk h LYS 697 N 0.00 0.17 -0.31 1.57 1.57 -1.45 -0.97 116.57 117.15 2dsk h LYS 697 Ca -0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2dsk h LYS 697 Cb 0.00 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2dsk h LYS 697 CO 0.00 0.11 0.18 0.35 -0.57 0.00 0.00 179.45 179.52 2dsk h PHE 698 N 0.17 0.41 -0.26 -1.35 3.57 -1.45 -2.16 116.94 115.87 2dsk h PHE 698 Ca 0.15 -0.00 -0.14 0.00 3.53 0.00 0.00 57.97 61.51 2dsk h PHE 698 Cb 0.38 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 2dsk h PHE 698 CO -0.00 0.31 -0.42 1.98 -2.23 0.00 0.00 178.31 177.94 2dsk h MET 699 N 0.39 0.64 -0.37 1.11 4.05 -1.40 -3.06 114.93 116.29 2dsk h MET 699 Ca 0.11 -0.34 -0.03 0.00 -0.28 0.00 0.00 59.70 59.15 2dsk h MET 699 Cb 0.02 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.82 2dsk h MET 699 CO -0.02 0.94 0.08 0.93 0.23 0.00 0.00 176.91 179.08 2dsk h GLU 700 N 0.52 0.54 0.00 0.39 5.08 -1.00 -2.09 114.58 118.02 2dsk h GLU 700 Ca 0.04 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2dsk h GLU 700 Cb 0.95 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 2dsk h GLU 700 CO 0.09 0.51 -0.00 0.00 -1.00 0.00 0.00 179.01 178.60 2dsk h ALA 701 N 1.56 1.46 -0.50 3.43 0.00 -1.29 -2.66 119.26 121.27 2dsk h ALA 701 Ca 0.12 -0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.76 2dsk h ALA 701 Cb 0.22 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.85 2dsk h ALA 701 CO -0.00 0.01 0.07 1.19 0.00 0.00 0.00 179.25 180.51 2dsk n PHE 702 N -3.76 1.56 0.00 0.00 3.01 -0.80 -4.94 117.46 112.53 2dsk n PHE 702 Ca -0.03 -1.70 0.00 0.00 1.01 0.00 0.00 57.45 56.73 2dsk n PHE 702 Cb 0.09 -0.60 0.00 0.00 -0.01 0.00 0.00 39.48 38.95 2dsk n PHE 702 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2dsk n GLY 703 N -1.12 2.65 3.75 1.37 0.00 -1.00 -4.91 105.19 105.93 2dsk n GLY 703 Ca 0.40 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.00 2dsk n GLY 703 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2dsk s TYR 704 N -2.39 3.09 -0.10 1.61 5.04 -1.11 -5.00 117.35 118.48 2dsk s TYR 704 Ca 0.00 1.20 -0.05 0.00 -2.44 0.00 0.00 57.07 55.79 2dsk s TYR 704 Cb 0.00 -3.72 0.05 0.00 0.35 0.00 0.00 41.96 38.64 2dsk s TYR 704 CO 0.00 -2.21 0.22 0.95 -1.34 0.00 0.00 175.55 173.17 2dsk s THR 705 N -0.35 -0.12 0.00 4.34 -4.23 -1.26 -4.38 115.64 109.64 2dsk s THR 705 Ca 0.55 0.19 0.00 0.00 -1.18 0.00 0.00 61.69 61.26 2dsk s THR 705 Cb -0.40 -0.36 0.00 0.00 1.34 0.00 0.00 72.50 73.09 2dsk s THR 705 CO 0.45 0.08 0.00 0.33 -0.54 0.00 0.00 174.62 174.94