#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ce9 s TYR 435 N 0.00 3.16 0.06 -0.67 2.02 -1.26 -5.12 117.35 115.55 2ce9 s TYR 435 Ca 0.00 0.14 0.05 0.00 -0.37 0.00 0.00 57.07 56.89 2ce9 s TYR 435 Cb 0.00 -1.71 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 2ce9 s TYR 435 CO 0.00 0.50 -0.14 -0.06 -1.57 0.00 0.00 175.55 174.28 2ce9 s PHE 436 N -1.09 1.19 0.03 2.71 0.08 -1.26 -5.16 117.98 114.49 2ce9 s PHE 436 Ca 0.19 -0.44 0.06 0.00 0.12 0.00 0.00 56.93 56.86 2ce9 s PHE 436 Cb -0.12 -0.68 -0.02 0.00 -0.57 0.00 0.00 43.02 41.63 2ce9 s PHE 436 CO 0.10 0.05 -0.17 -0.65 -0.10 0.00 0.00 175.22 174.45 2ce9 s GLN 437 N -1.61 1.13 0.64 0.44 -0.21 -1.26 -5.06 119.66 113.74 2ce9 s GLN 437 Ca -0.02 -0.79 -0.17 0.00 0.02 0.00 0.00 55.36 54.40 2ce9 s GLN 437 Cb -0.10 -1.17 -0.01 0.00 1.00 0.00 0.00 33.01 32.73 2ce9 s GLN 437 CO 0.02 0.30 1.22 0.20 -2.12 0.00 0.00 175.29 174.91 2ce9 s GLY 438 N -1.05 2.65 -0.14 3.09 0.00 -1.26 -5.05 107.32 105.56 2ce9 s GLY 438 Ca 0.04 1.01 -0.04 0.00 0.00 0.00 0.00 44.72 45.73 2ce9 s GLY 438 CO 0.01 1.41 0.25 0.00 0.00 0.00 0.00 173.10 174.77 2ce9 s ALA 439 N -1.67 -0.50 0.37 3.20 0.00 -1.26 -5.14 121.76 116.76 2ce9 s ALA 439 Ca 0.77 0.82 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 2ce9 s ALA 439 Cb -0.31 -1.05 -0.09 0.00 0.00 0.00 0.00 23.12 21.67 2ce9 s ALA 439 CO 0.38 -0.71 1.12 1.41 0.00 0.00 0.00 175.76 177.96 2ce9 s MET 440 N 2.40 4.22 0.16 0.00 1.75 -1.26 -5.03 119.30 121.55 2ce9 s MET 440 Ca 0.02 1.75 0.01 0.00 -1.25 0.00 0.00 55.69 56.23 2ce9 s MET 440 Cb -0.13 -2.76 -0.00 0.00 2.84 0.00 0.00 34.83 34.78 2ce9 s MET 440 CO -0.09 -0.15 0.04 0.41 -0.65 0.00 0.00 175.02 174.59 2ce9 n GLY 441 N 0.68 3.82 3.39 2.11 0.00 -1.26 -5.18 105.19 108.75 2ce9 n GLY 441 Ca 0.03 -2.05 -0.14 0.00 0.00 0.00 0.00 46.02 43.86 2ce9 n GLY 441 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ce9 s SER 442 N -1.98 -0.45 0.06 1.61 1.04 -1.26 -5.18 113.70 107.54 2ce9 s SER 442 Ca 0.06 0.15 -0.02 0.00 0.48 0.00 0.00 55.95 56.62 2ce9 s SER 442 Cb 0.00 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.59 2ce9 s SER 442 CO 0.04 -0.75 0.01 -0.54 0.98 0.00 0.00 173.24 172.99 2ce9 s LYS 443 N -2.60 0.64 0.19 4.02 1.02 -1.26 -5.13 119.74 116.63 2ce9 s LYS 443 Ca -0.04 -1.15 -0.32 0.00 0.02 0.00 0.00 55.97 54.47 2ce9 s LYS 443 Cb -0.01 0.23 -0.15 0.00 -0.52 0.00 0.00 37.83 37.38 2ce9 s LYS 443 CO -0.03 -0.14 1.14 -2.30 -0.92 0.00 0.00 175.35 173.10 2ce9 n PRO 444 N 0.13 1.19 -1.54 -1.68 -0.02 -1.26 -4.76 135.00 127.05 2ce9 n PRO 444 Ca -0.14 0.42 -0.60 0.00 -2.02 0.00 0.00 63.50 61.16 2ce9 n PRO 444 Cb 0.61 -1.90 -0.09 0.00 -0.02 0.00 0.00 33.50 32.11 2ce9 n PRO 444 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ce9 n ALA 445 N 1.30 -1.84 0.00 3.55 0.00 -1.26 -4.84 120.51 117.42 2ce9 n ALA 445 Ca 0.14 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.07 2ce9 n ALA 445 Cb 0.26 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2ce9 n ALA 445 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2ce9 n TYR 446 N 3.04 0.00 -4.19 0.00 0.18 -1.26 -5.00 117.16 109.93 2ce9 n TYR 446 Ca 0.26 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.70 2ce9 n TYR 446 Cb -0.02 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 38.79 2ce9 n TYR 446 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2ce9 s SER 447 N -1.08 3.80 0.02 9.48 0.15 -1.26 -0.83 113.70 123.98 2ce9 s SER 447 Ca 0.00 -0.48 0.06 0.00 0.70 0.00 0.00 55.95 56.23 2ce9 s SER 447 Cb 0.00 -1.61 -0.02 0.00 -1.71 0.00 0.00 66.02 62.68 2ce9 s SER 447 CO 0.00 0.03 -0.18 -0.36 1.20 0.00 0.00 173.24 173.93 2ce9 s PHE 448 N 1.17 1.56 -0.18 3.44 0.08 -0.53 -0.88 117.98 122.64 2ce9 s PHE 448 Ca 0.02 -0.33 -0.07 0.00 0.12 0.00 0.00 56.93 56.66 2ce9 s PHE 448 Cb -0.14 -0.96 -0.04 0.00 -0.57 0.00 0.00 43.02 41.31 2ce9 s PHE 448 CO -0.04 0.03 0.05 -1.58 -0.10 0.00 0.00 175.22 173.58 2ce9 s HIS 449 N -0.65 3.21 -0.24 0.36 5.65 0.42 -0.99 115.29 123.05 2ce9 s HIS 449 Ca 0.06 -0.02 -0.06 0.00 0.25 0.00 0.00 55.06 55.29 2ce9 s HIS 449 Cb -0.08 -2.08 -0.02 0.00 -1.18 0.00 0.00 32.58 29.22 2ce9 s HIS 449 CO 0.01 0.08 0.03 0.08 -0.65 0.00 0.00 174.74 174.29 2ce9 s VAL 450 N 0.48 3.99 0.43 0.89 1.01 0.37 -2.08 120.40 125.49 2ce9 s VAL 450 Ca 0.02 -0.28 0.04 0.00 0.00 0.00 0.00 61.98 61.77 2ce9 s VAL 450 Cb -0.13 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.40 2ce9 s VAL 450 CO 0.01 0.37 0.61 0.42 0.00 0.00 0.00 175.10 176.51 2ce9 s THR 451 N 1.57 3.44 0.35 3.92 -4.23 -0.73 -0.96 115.64 119.01 2ce9 s THR 451 Ca 0.06 -0.82 0.10 0.00 -1.18 0.00 0.00 61.69 59.85 2ce9 s THR 451 Cb -0.15 -3.22 0.33 0.00 1.34 0.00 0.00 72.50 70.81 2ce9 s THR 451 CO 0.01 -0.11 1.81 0.00 -0.54 0.00 0.00 174.62 175.79 2ce9 h ALA 452 N 0.54 1.88 0.00 3.99 0.00 -1.91 -0.97 119.26 122.79 2ce9 h ALA 452 Ca -0.43 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2ce9 h ALA 452 Cb 1.27 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2ce9 h ALA 452 CO 0.51 -0.20 0.00 -0.40 0.00 0.00 0.00 179.25 179.16 2ce9 n ASP 453 N -4.65 0.72 0.00 0.00 5.68 -1.26 -4.92 116.55 112.12 2ce9 n ASP 453 Ca 0.21 -1.86 0.00 0.00 -0.50 0.00 0.00 54.79 52.65 2ce9 n ASP 453 Cb 0.60 -0.36 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 2ce9 n ASP 453 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ce9 n GLY 454 N 0.12 2.92 3.56 6.12 0.00 -0.37 -5.02 105.19 112.53 2ce9 n GLY 454 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 2ce9 n GLY 454 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ce9 n GLN 455 N -1.61 1.03 -3.59 1.61 6.02 -1.26 -4.73 117.38 114.85 2ce9 n GLN 455 Ca 0.00 0.37 -0.29 0.00 -0.01 0.00 0.00 57.00 57.07 2ce9 n GLN 455 Cb 0.00 -1.88 -0.13 0.00 1.02 0.00 0.00 30.24 29.25 2ce9 n GLN 455 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 2ce9 s MET 456 N -1.98 0.82 0.06 -1.09 -2.45 -1.26 -1.77 119.30 111.63 2ce9 s MET 456 Ca 0.65 -1.52 0.06 0.00 -1.25 0.00 0.00 55.69 53.63 2ce9 s MET 456 Cb -0.55 -1.75 -0.04 0.00 1.25 0.00 0.00 34.83 33.75 2ce9 s MET 456 CO 0.56 -1.16 -0.10 1.14 1.05 0.00 0.00 175.02 176.50 2ce9 s GLN 457 N 0.91 2.27 0.36 4.11 -2.07 -0.88 -4.87 119.66 119.48 2ce9 s GLN 457 Ca 0.17 -0.91 -0.29 0.00 -1.82 0.00 0.00 55.36 52.51 2ce9 s GLN 457 Cb -0.23 -2.35 -0.11 0.00 -1.09 0.00 0.00 33.01 29.23 2ce9 s GLN 457 CO -0.04 0.55 1.52 -1.25 -1.32 0.00 0.00 175.29 174.75 2ce9 s PRO 458 N -1.79 4.11 0.00 9.60 0.04 -1.26 -0.43 135.00 145.27 2ce9 s PRO 458 Ca 0.19 2.58 -0.30 0.00 0.04 0.00 0.00 61.00 63.51 2ce9 s PRO 458 Cb -0.11 -2.98 -0.03 0.00 0.04 0.00 0.00 34.50 31.42 2ce9 s PRO 458 CO 0.10 -0.56 0.97 0.08 0.04 0.00 0.00 177.00 177.63 2ce9 s VAL 459 N -0.83 4.86 -0.39 -0.36 1.01 -0.06 -4.81 120.40 119.82 2ce9 s VAL 459 Ca 0.55 2.05 -0.26 0.00 0.00 0.00 0.00 61.98 64.32 2ce9 s VAL 459 Cb -0.47 -4.31 0.02 0.00 0.00 0.00 0.00 36.38 31.61 2ce9 s VAL 459 CO 0.59 0.17 0.97 -2.16 0.00 0.00 0.00 175.10 174.67 2ce9 s PRO 460 N 0.97 3.82 0.17 2.72 0.04 -1.26 -5.01 135.00 136.44 2ce9 s PRO 460 Ca 0.52 0.58 -0.30 0.00 0.04 0.00 0.00 61.00 61.84 2ce9 s PRO 460 Cb -0.21 -3.82 -0.08 0.00 0.04 0.00 0.00 34.50 30.43 2ce9 s PRO 460 CO 0.28 -1.03 1.12 -0.06 0.04 0.00 0.00 177.00 177.35 2ce9 s PHE 461 N 3.64 3.56 0.92 0.56 0.08 -1.26 -5.04 117.98 120.44 2ce9 s PHE 461 Ca 0.40 1.56 -0.12 0.00 0.12 0.00 0.00 56.93 58.88 2ce9 s PHE 461 Cb -0.11 -3.31 0.14 0.00 -0.57 0.00 0.00 43.02 39.17 2ce9 s PHE 461 CO 0.21 -0.74 1.12 -1.25 -0.10 0.00 0.00 175.22 174.46 2ce9 s PRO 462 N -0.28 1.06 0.60 0.24 0.04 -1.26 -4.91 135.00 130.48 2ce9 s PRO 462 Ca 0.50 0.43 0.32 0.00 0.04 0.00 0.00 61.00 62.30 2ce9 s PRO 462 Cb -0.30 -1.82 1.91 0.00 0.04 0.00 0.00 34.50 34.33 2ce9 s PRO 462 CO 0.35 -2.29 2.27 -1.35 0.04 0.00 0.00 177.00 176.02 2ce9 h PRO 463 N -1.57 0.00 -0.71 0.56 0.11 -1.98 -2.10 132.00 126.31 2ce9 h PRO 463 Ca -0.51 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.48 2ce9 h PRO 463 Cb 1.32 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.36 2ce9 h PRO 463 CO 0.60 0.01 0.15 -0.40 -0.21 0.00 0.00 178.00 178.15 2ce9 n ASP 464 N -3.71 5.00 -0.17 -2.05 5.75 -1.26 -4.51 116.55 115.59 2ce9 n ASP 464 Ca -0.03 -3.03 -0.03 0.00 -0.01 0.00 0.00 54.79 51.69 2ce9 n ASP 464 Cb 0.09 -0.71 0.17 0.00 -1.03 0.00 0.00 41.12 39.63 2ce9 n ASP 464 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ce9 h ALA 465 N 3.17 1.19 0.00 2.12 0.00 -1.73 -3.34 119.26 120.67 2ce9 h ALA 465 Ca 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2ce9 h ALA 465 Cb 2.10 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 19.65 2ce9 h ALA 465 CO 0.61 0.57 0.00 1.28 0.00 0.00 0.00 179.25 181.70 2ce9 n LEU 466 N -4.28 1.33 -3.72 0.00 4.77 -1.26 -4.71 117.00 109.12 2ce9 n LEU 466 Ca 0.05 -1.33 -0.13 0.00 -0.03 0.00 0.00 56.01 54.57 2ce9 n LEU 466 Cb 0.21 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.20 2ce9 n LEU 466 CO 0.40 0.33 0.11 -0.63 -1.33 0.00 0.00 177.39 176.28 2ce9 s ILE 467 N -0.53 0.00 0.00 -0.08 -1.09 -1.25 -4.97 121.20 113.27 2ce9 s ILE 467 Ca 0.00 -0.01 0.00 0.00 -2.23 0.00 0.00 60.65 58.41 2ce9 s ILE 467 Cb 0.00 -0.61 0.00 0.00 -1.58 0.00 0.00 42.46 40.27 2ce9 s ILE 467 CO 0.00 -0.01 0.00 0.61 -1.23 0.00 0.00 174.94 174.31 2ce9 n GLY 468 N 2.80 3.70 3.73 6.18 0.00 -1.26 -4.51 105.19 115.83 2ce9 n GLY 468 Ca -0.13 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 2ce9 n GLY 468 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2ce9 s PRO 469 N -2.49 4.12 0.00 1.61 0.02 -1.26 -1.02 135.00 135.98 2ce9 s PRO 469 Ca 0.00 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.63 2ce9 s PRO 469 Cb 0.00 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.47 2ce9 s PRO 469 CO 0.00 -0.72 0.00 0.41 -0.33 0.00 0.00 177.00 176.36 2ce9 n GLY 470 N 3.34 0.74 3.66 0.52 0.00 -1.26 -5.01 105.19 107.17 2ce9 n GLY 470 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 2ce9 n GLY 470 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ce9 s ILE 471 N -3.07 5.18 0.52 -0.61 -1.09 -0.19 -4.91 121.20 117.04 2ce9 s ILE 471 Ca 0.00 0.73 -0.23 0.00 -2.23 0.00 0.00 60.65 58.93 2ce9 s ILE 471 Cb 0.00 -3.74 -0.06 0.00 -1.58 0.00 0.00 42.46 37.08 2ce9 s ILE 471 CO 0.00 0.22 1.39 -2.84 -1.23 0.00 0.00 174.94 172.48 2ce9 s PRO 472 N 1.49 3.26 -0.13 2.79 0.02 -1.26 -4.73 135.00 136.44 2ce9 s PRO 472 Ca 0.19 2.31 0.19 0.00 0.02 0.00 0.00 61.00 63.71 2ce9 s PRO 472 Cb -0.15 -2.36 -0.28 0.00 0.02 0.00 0.00 34.50 31.73 2ce9 s PRO 472 CO 0.08 -1.12 0.23 0.54 -0.33 0.00 0.00 177.00 176.40 2ce9 n ARG 473 N -0.83 0.70 -3.57 5.54 1.74 0.13 -4.94 116.66 115.44 2ce9 n ARG 473 Ca 0.09 -0.08 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 2ce9 n ARG 473 Cb 0.44 -1.51 -0.06 0.00 -1.02 0.00 0.00 32.46 30.30 2ce9 n ARG 473 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2ce9 s HIS 474 N -2.88 -0.67 -0.28 -1.55 5.04 -0.99 -4.75 115.29 109.22 2ce9 s HIS 474 Ca -0.09 1.35 -0.01 0.00 -1.54 0.00 0.00 55.06 54.77 2ce9 s HIS 474 Cb 0.09 0.36 0.05 0.00 0.04 0.00 0.00 32.58 33.12 2ce9 s HIS 474 CO 0.85 -0.49 -0.04 0.00 -2.34 0.00 0.00 174.74 172.72 2ce9 s ALA 475 N -0.58 2.72 -0.24 1.58 0.00 -1.26 0.86 121.76 124.84 2ce9 s ALA 475 Ca -0.06 -1.69 -0.14 0.00 0.00 0.00 0.00 51.96 50.08 2ce9 s ALA 475 Cb -0.02 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.27 2ce9 s ALA 475 CO 0.05 -1.14 0.31 0.50 0.00 0.00 0.00 175.76 175.48 2ce9 s ARG 476 N 1.23 4.08 -0.17 0.00 3.52 -0.47 -4.91 118.95 122.23 2ce9 s ARG 476 Ca -0.05 -0.02 -0.29 0.00 -0.13 0.00 0.00 55.73 55.24 2ce9 s ARG 476 Cb -0.19 -3.58 -0.03 0.00 -1.56 0.00 0.00 34.95 29.58 2ce9 s ARG 476 CO -0.03 -0.10 1.63 -0.65 -0.81 0.00 0.00 175.30 175.34 2ce9 s GLN 477 N 1.51 3.90 -0.05 5.12 -0.21 -1.26 -0.47 119.66 128.20 2ce9 s GLN 477 Ca 0.14 1.81 0.08 0.00 0.02 0.00 0.00 55.36 57.42 2ce9 s GLN 477 Cb -0.15 -4.02 -0.12 0.00 1.00 0.00 0.00 33.01 29.72 2ce9 s GLN 477 CO 0.08 -1.17 0.12 0.44 -2.12 0.00 0.00 175.29 172.63 2ce9 n ILE 478 N 6.15 0.29 -3.89 1.08 -5.35 -0.09 -4.95 119.36 112.60 2ce9 n ILE 478 Ca 0.18 -0.29 -0.11 0.00 -0.27 0.00 0.00 62.75 62.27 2ce9 n ILE 478 Cb 0.45 -0.24 -0.12 0.00 -1.74 0.00 0.00 39.64 37.99 2ce9 n ILE 478 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 2ce9 s ASN 479 N -3.55 0.04 -0.15 7.28 0.02 -1.08 -4.91 114.94 112.59 2ce9 s ASN 479 Ca -0.04 -0.12 -0.01 0.00 -1.02 0.00 0.00 52.86 51.67 2ce9 s ASN 479 Cb 0.04 0.14 -0.01 0.00 0.02 0.00 0.00 41.25 41.43 2ce9 s ASN 479 CO 0.37 -0.17 -0.11 -0.89 0.02 0.00 0.00 177.10 176.32 2ce9 s THR 480 N -0.68 3.16 -0.43 1.60 2.01 -1.26 -0.85 115.64 119.18 2ce9 s THR 480 Ca -0.08 -0.61 -0.12 0.00 0.31 0.00 0.00 61.69 61.19 2ce9 s THR 480 Cb -0.05 -2.36 0.07 0.00 0.01 0.00 0.00 72.50 70.17 2ce9 s THR 480 CO 0.00 0.50 0.31 -0.76 -0.69 0.00 0.00 174.62 173.98 2ce9 s LEU 481 N 0.64 5.28 -1.34 4.42 1.02 0.54 -4.85 118.68 124.39 2ce9 s LEU 481 Ca -0.06 -1.34 -0.14 0.00 0.02 0.00 0.00 54.13 52.61 2ce9 s LEU 481 Cb -0.15 -2.08 0.09 0.00 0.02 0.00 0.00 46.19 44.07 2ce9 s LEU 481 CO 0.03 -0.56 1.89 0.59 0.02 0.00 0.00 176.35 178.32 2ce9 n ASN 482 N 5.05 4.63 -0.13 2.29 5.03 -1.26 -1.31 115.26 129.56 2ce9 n ASN 482 Ca -0.11 -2.94 -0.09 0.00 0.87 0.00 0.00 54.58 52.31 2ce9 n ASN 482 Cb 0.44 -1.64 -0.01 0.00 -1.02 0.00 0.00 39.78 37.54 2ce9 n ASN 482 CO 0.00 0.00 0.00 -0.74 -1.83 0.00 0.00 177.26 174.69 2ce9 h HIS 483 N 6.61 0.60 0.00 3.10 2.76 -1.89 -3.48 115.15 122.85 2ce9 h HIS 483 Ca 0.46 -0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.58 2ce9 h HIS 483 Cb 0.74 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 29.53 2ce9 h HIS 483 CO 1.36 0.56 0.00 0.41 -1.30 0.00 0.00 177.93 178.96 2ce9 n GLY 484 N -0.69 0.64 3.10 5.26 0.00 -0.06 -5.02 105.19 108.41 2ce9 n GLY 484 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2ce9 n GLY 484 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ce9 s GLU 485 N -0.80 0.63 0.30 1.61 0.41 -1.25 -4.96 118.70 114.63 2ce9 s GLU 485 Ca 0.00 -0.98 -0.29 0.00 -0.41 0.00 0.00 54.97 53.28 2ce9 s GLU 485 Cb 0.00 -0.21 -0.13 0.00 -1.78 0.00 0.00 34.13 32.01 2ce9 s GLU 485 CO 0.00 0.01 1.36 1.33 -0.49 0.00 0.00 175.26 177.47 2ce9 n VAL 486 N 0.86 1.50 -3.23 2.63 0.24 -1.26 -4.00 118.33 115.06 2ce9 n VAL 486 Ca -0.19 -0.37 -0.46 0.00 -2.04 0.00 0.00 64.34 61.28 2ce9 n VAL 486 Cb 0.57 -1.57 -0.04 0.00 -1.47 0.00 0.00 33.84 31.33 2ce9 n VAL 486 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2ce9 s VAL 487 N -0.59 5.11 -0.43 3.34 1.01 -1.02 -4.36 120.40 123.46 2ce9 s VAL 487 Ca 0.61 -1.45 0.23 0.00 0.00 0.00 0.00 61.98 61.38 2ce9 s VAL 487 Cb -0.59 -4.42 0.16 0.00 0.00 0.00 0.00 36.38 31.52 2ce9 s VAL 487 CO 0.56 -1.00 1.37 0.00 0.00 0.00 0.00 175.10 176.03 2ce9 s ALA 489 N -3.25 -0.18 0.03 0.00 0.00 -1.17 -4.61 121.76 112.58 2ce9 s ALA 489 Ca 0.05 0.25 0.02 0.00 0.00 0.00 0.00 51.96 52.28 2ce9 s ALA 489 Cb 0.09 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 2ce9 s ALA 489 CO 0.72 -0.05 -0.08 0.14 0.00 0.00 0.00 175.76 176.49 2ce9 s VAL 490 N 0.17 0.58 0.06 0.00 -7.23 -1.26 -0.46 120.40 112.26 2ce9 s VAL 490 Ca -0.01 -0.79 -0.07 0.00 -1.81 0.00 0.00 61.98 59.30 2ce9 s VAL 490 Cb -0.02 -0.58 -0.01 0.00 0.56 0.00 0.00 36.38 36.33 2ce9 s VAL 490 CO -0.00 -0.17 0.13 0.28 -0.31 0.00 0.00 175.10 175.03 2ce9 s THR 491 N -0.90 0.15 -0.07 5.32 -1.32 -0.65 -4.60 115.64 113.57 2ce9 s THR 491 Ca -0.04 -1.21 0.03 0.00 -1.21 0.00 0.00 61.69 59.26 2ce9 s THR 491 Cb -0.07 -1.18 0.01 0.00 -1.51 0.00 0.00 72.50 69.75 2ce9 s THR 491 CO 0.00 -0.67 -0.16 -0.63 -2.21 0.00 0.00 174.62 170.95 2ce9 s ILE 492 N -3.32 1.45 0.96 5.08 1.01 -1.26 -0.31 121.20 124.82 2ce9 s ILE 492 Ca 0.01 -0.68 -0.11 0.00 0.00 0.00 0.00 60.65 59.87 2ce9 s ILE 492 Cb 0.03 -1.29 0.14 0.00 0.01 0.00 0.00 42.46 41.35 2ce9 s ILE 492 CO -0.08 0.42 0.91 -1.54 0.00 0.00 0.00 174.94 174.66 2ce9 n SER 493 N 3.61 -0.57 -3.76 3.58 3.41 -0.20 -4.91 113.62 114.77 2ce9 n SER 493 Ca -0.21 0.31 -0.26 0.00 -0.26 0.00 0.00 58.87 58.45 2ce9 n SER 493 Cb 0.52 -1.37 -0.17 0.00 -0.26 0.00 0.00 64.21 62.93 2ce9 n SER 493 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2ce9 s ASN 494 N -2.43 2.51 0.66 4.04 2.47 -1.26 -3.14 114.94 117.79 2ce9 s ASN 494 Ca 0.64 -0.59 -0.17 0.00 0.42 0.00 0.00 52.86 53.16 2ce9 s ASN 494 Cb -0.22 -0.59 -0.01 0.00 -1.45 0.00 0.00 41.25 38.98 2ce9 s ASN 494 CO 0.61 -0.26 1.14 -0.81 -3.72 0.00 0.00 177.10 174.06 2ce9 n PRO 495 N 5.06 0.86 -1.68 0.43 -0.04 -1.26 -4.63 135.00 133.74 2ce9 n PRO 495 Ca -0.09 0.35 -0.45 0.00 -0.04 0.00 0.00 63.50 63.27 2ce9 n PRO 495 Cb 0.48 -2.37 -0.04 0.00 -0.04 0.00 0.00 33.50 31.53 2ce9 n PRO 495 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2ce9 n THR 496 N -2.10 0.33 0.03 0.52 -1.04 -1.19 -4.62 114.28 106.21 2ce9 n THR 496 Ca 0.15 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 2ce9 n THR 496 Cb 0.48 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.10 2ce9 n THR 496 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2ce9 n ARG 497 N 5.30 0.00 -4.46 -2.82 0.63 -1.26 -4.96 116.66 109.10 2ce9 n ARG 497 Ca 0.19 0.00 -0.34 0.00 -0.92 0.00 0.00 57.85 56.78 2ce9 n ARG 497 Cb 0.33 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.14 2ce9 n ARG 497 CO 0.00 0.00 0.00 -1.01 -2.51 0.00 0.00 177.63 174.11 2ce9 s HIS 498 N -2.00 3.01 0.00 -0.14 3.76 -1.26 -0.90 115.29 117.76 2ce9 s HIS 498 Ca 0.00 0.07 0.05 0.00 -0.15 0.00 0.00 55.06 55.02 2ce9 s HIS 498 Cb 0.00 -1.70 -0.03 0.00 1.11 0.00 0.00 32.58 31.96 2ce9 s HIS 498 CO 0.00 0.40 -0.13 0.08 -0.85 0.00 0.00 174.74 174.25 2ce9 s VAL 499 N -0.92 3.20 -0.20 -0.90 1.01 0.08 -1.03 120.40 121.64 2ce9 s VAL 499 Ca 0.15 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.20 2ce9 s VAL 499 Cb -0.11 -2.35 -0.00 0.00 0.00 0.00 0.00 36.38 33.92 2ce9 s VAL 499 CO 0.05 0.42 -0.10 -0.31 0.00 0.00 0.00 175.10 175.16 2ce9 s TYR 500 N -0.91 2.89 -0.16 5.22 2.02 0.58 -1.48 117.35 125.50 2ce9 s TYR 500 Ca 0.15 -1.09 -0.02 0.00 -0.37 0.00 0.00 57.07 55.74 2ce9 s TYR 500 Cb -0.11 -2.02 -0.02 0.00 -0.40 0.00 0.00 41.96 39.42 2ce9 s TYR 500 CO 0.05 -0.57 -0.08 0.95 -1.57 0.00 0.00 175.55 174.33 2ce9 s THR 501 N 1.27 3.38 -0.20 -0.71 -4.23 0.05 -1.63 115.64 113.57 2ce9 s THR 501 Ca 0.03 -0.53 -0.07 0.00 -1.18 0.00 0.00 61.69 59.95 2ce9 s THR 501 Cb -0.14 -2.47 -0.03 0.00 1.34 0.00 0.00 72.50 71.19 2ce9 s THR 501 CO -0.05 0.49 0.05 -0.83 -0.54 0.00 0.00 174.62 173.74 2ce9 s GLY 502 N 0.68 1.83 0.00 3.99 0.00 0.39 -0.74 107.32 113.47 2ce9 s GLY 502 Ca -0.04 -0.89 0.00 0.00 0.00 0.00 0.00 44.72 43.78 2ce9 s GLY 502 CO 0.02 0.21 0.00 0.61 0.00 0.00 0.00 173.10 173.94 2ce9 n GLY 503 N 4.03 3.29 3.31 0.20 0.00 -0.60 -1.74 105.19 113.68 2ce9 n GLY 503 Ca -0.16 -0.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.88 2ce9 n GLY 503 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2ce9 s LYS 504 N 4.36 2.74 0.00 1.61 2.20 -1.26 -0.97 119.74 128.41 2ce9 s LYS 504 Ca 0.00 -1.11 0.00 0.00 -0.36 0.00 0.00 55.97 54.50 2ce9 s LYS 504 Cb 0.00 -3.51 0.00 0.00 -1.51 0.00 0.00 37.83 32.81 2ce9 s LYS 504 CO 0.00 -0.64 0.00 0.41 -0.36 0.00 0.00 175.35 174.76 2ce9 n GLY 505 N 4.86 0.76 3.64 5.54 0.00 -0.06 -4.83 105.19 115.10 2ce9 n GLY 505 Ca -0.13 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.86 2ce9 n GLY 505 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ce9 s VAL 507 N 0.91 5.05 0.09 0.00 1.01 0.15 -1.56 120.40 126.05 2ce9 s VAL 507 Ca -0.04 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.03 2ce9 s VAL 507 Cb -0.04 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 33.02 2ce9 s VAL 507 CO -0.12 0.46 0.08 -0.54 0.00 0.00 0.00 175.10 174.98 2ce9 s LYS 508 N 0.29 2.87 -0.10 2.72 1.02 0.08 -0.03 119.74 126.59 2ce9 s LYS 508 Ca 0.06 -0.72 0.04 0.00 0.02 0.00 0.00 55.97 55.37 2ce9 s LYS 508 Cb -0.12 -2.71 0.00 0.00 -0.52 0.00 0.00 37.83 34.48 2ce9 s LYS 508 CO -0.01 0.56 -0.24 0.08 -0.92 0.00 0.00 175.35 174.82 2ce9 s VAL 509 N -1.43 2.05 -0.02 3.17 1.01 -0.22 -0.77 120.40 124.19 2ce9 s VAL 509 Ca 0.29 -1.01 0.04 0.00 0.00 0.00 0.00 61.98 61.31 2ce9 s VAL 509 Cb -0.12 -1.78 -0.01 0.00 0.00 0.00 0.00 36.38 34.48 2ce9 s VAL 509 CO 0.22 0.56 -0.15 0.26 0.00 0.00 0.00 175.10 175.99 2ce9 s TRP 510 N 0.40 1.37 -0.37 5.22 0.52 -0.55 0.45 118.94 125.98 2ce9 s TRP 510 Ca -0.18 -0.29 -0.09 0.00 0.02 0.00 0.00 56.10 55.56 2ce9 s TRP 510 Cb -0.18 -0.90 0.04 0.00 -1.15 0.00 0.00 33.47 31.29 2ce9 s TRP 510 CO 0.08 -0.06 0.17 0.34 0.02 0.00 0.00 176.95 177.50 2ce9 s ASP 511 N -0.22 5.54 -0.02 2.95 -1.08 -1.26 -0.74 116.67 121.84 2ce9 s ASP 511 Ca 0.03 -1.15 0.15 0.00 -0.52 0.00 0.00 52.55 51.07 2ce9 s ASP 511 Cb -0.07 -1.95 0.48 0.00 -1.46 0.00 0.00 42.92 39.91 2ce9 s ASP 511 CO 0.00 -0.39 1.38 2.30 0.52 0.00 0.00 175.17 178.98 2ce9 n ILE 512 N 4.90 0.87 0.00 4.11 -5.35 -0.08 -1.56 119.36 122.26 2ce9 n ILE 512 Ca -0.12 -0.74 0.00 0.00 -0.27 0.00 0.00 62.75 61.63 2ce9 n ILE 512 Cb 0.45 0.25 0.00 0.00 -1.74 0.00 0.00 39.64 38.60 2ce9 n ILE 512 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2ce9 n SER 513 N 0.94 0.00 0.00 7.28 3.41 -1.26 -4.15 113.62 119.84 2ce9 n SER 513 Ca 0.18 0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.98 2ce9 n SER 513 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 2ce9 n SER 513 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2ce9 n HIS 514 N -0.46 0.00 0.00 7.33 8.25 -1.26 -4.65 115.22 124.43 2ce9 n HIS 514 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2ce9 n HIS 514 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2ce9 n HIS 514 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2ce9 n PRO 515 N -0.57 0.00 0.00 -0.41 -0.04 -1.26 -4.98 135.00 127.74 2ce9 n PRO 515 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2ce9 n PRO 515 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2ce9 n PRO 515 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ce9 n GLY 516 N 0.00 0.00 3.56 0.55 0.00 -0.60 -4.79 105.19 103.91 2ce9 n GLY 516 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2ce9 n GLY 516 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ce9 s ASN 517 N 0.00 6.47 -0.21 1.61 -0.87 -1.26 -3.85 114.94 116.82 2ce9 s ASN 517 Ca 0.00 0.04 0.11 0.00 -1.57 0.00 0.00 52.86 51.44 2ce9 s ASN 517 Cb 0.00 -2.42 0.30 0.00 -0.02 0.00 0.00 41.25 39.11 2ce9 s ASN 517 CO 0.00 -0.98 1.33 2.29 -2.57 0.00 0.00 177.10 177.17 2ce9 n LYS 518 N 6.95 0.93 -4.40 -0.60 0.00 -1.26 -5.14 118.16 114.64 2ce9 n LYS 518 Ca 0.04 -1.42 -0.31 0.00 -0.00 0.00 0.00 58.31 56.63 2ce9 n LYS 518 Cb 0.48 0.23 -0.11 0.00 -0.00 0.00 0.00 35.03 35.63 2ce9 n LYS 518 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 2ce9 s SER 519 N -1.40 4.32 0.50 -5.58 1.04 -1.25 -4.37 113.70 106.96 2ce9 s SER 519 Ca 0.09 -0.32 -0.21 0.00 0.48 0.00 0.00 55.95 56.00 2ce9 s SER 519 Cb 0.30 -0.86 -0.07 0.00 0.10 0.00 0.00 66.02 65.49 2ce9 s SER 519 CO -0.09 0.23 1.09 -2.16 0.98 0.00 0.00 173.24 173.29 2ce9 s PRO 520 N -1.78 3.66 0.07 4.02 0.05 -1.26 -4.68 135.00 135.07 2ce9 s PRO 520 Ca 0.18 1.53 0.22 0.00 0.05 0.00 0.00 61.00 62.98 2ce9 s PRO 520 Cb -0.11 -2.14 -0.16 0.00 0.05 0.00 0.00 34.50 32.14 2ce9 s PRO 520 CO 0.10 -0.58 0.78 1.33 0.05 0.00 0.00 177.00 178.68 2ce9 n VAL 521 N -0.94 0.25 -3.88 -0.36 0.24 0.17 -4.97 118.33 108.84 2ce9 n VAL 521 Ca 0.09 -0.46 -0.07 0.00 -2.04 0.00 0.00 64.34 61.86 2ce9 n VAL 521 Cb 0.51 -0.06 -0.02 0.00 -1.47 0.00 0.00 33.84 32.80 2ce9 n VAL 521 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2ce9 s SER 522 N -4.68 -0.22 -0.02 -1.34 0.15 -1.17 -5.03 113.70 101.39 2ce9 s SER 522 Ca -0.03 -0.68 -0.18 0.00 0.70 0.00 0.00 55.95 55.77 2ce9 s SER 522 Cb 0.13 0.71 0.03 0.00 -1.71 0.00 0.00 66.02 65.18 2ce9 s SER 522 CO 0.85 -1.33 0.38 0.00 1.20 0.00 0.00 173.24 174.34 2ce9 s GLN 523 N -3.88 0.75 -0.26 5.44 -2.07 -1.26 -1.06 119.66 117.31 2ce9 s GLN 523 Ca 0.13 -0.12 0.02 0.00 -1.82 0.00 0.00 55.36 53.57 2ce9 s GLN 523 Cb -0.05 0.34 0.06 0.00 -1.09 0.00 0.00 33.01 32.26 2ce9 s GLN 523 CO 0.07 -0.21 -0.09 -0.51 -1.32 0.00 0.00 175.29 173.23 2ce9 s LEU 524 N -1.33 3.48 -0.11 2.60 1.43 0.95 -4.95 118.68 120.75 2ce9 s LEU 524 Ca -0.13 -1.33 -0.15 0.00 -1.03 0.00 0.00 54.13 51.49 2ce9 s LEU 524 Cb -0.04 -1.58 -0.05 0.00 0.03 0.00 0.00 46.19 44.55 2ce9 s LEU 524 CO 0.05 -0.20 0.36 -1.81 0.23 0.00 0.00 176.35 174.98 2ce9 s ASP 525 N 1.15 6.58 0.60 2.29 1.01 -1.26 -0.68 116.67 126.35 2ce9 s ASP 525 Ca -0.07 0.68 -0.18 0.00 0.71 0.00 0.00 52.55 53.69 2ce9 s ASP 525 Cb -0.20 -2.22 -0.03 0.00 1.01 0.00 0.00 42.92 41.49 2ce9 s ASP 525 CO -0.04 0.14 1.15 0.00 0.21 0.00 0.00 175.17 176.62 2ce9 h LEU 527 N 0.70 0.43 -8.45 0.00 5.85 -1.99 -3.37 115.31 108.49 2ce9 h LEU 527 Ca -0.49 -0.08 -0.65 0.00 0.84 0.00 0.00 57.88 57.50 2ce9 h LEU 527 Cb 1.27 -0.11 -0.16 0.00 0.37 0.00 0.00 40.66 42.03 2ce9 h LEU 527 CO 0.55 0.39 0.25 0.21 -0.34 0.00 0.00 178.44 179.50 2ce9 s ASN 528 N -5.63 6.28 0.55 1.25 2.47 -1.26 -4.91 114.94 113.69 2ce9 s ASN 528 Ca -0.13 -0.64 0.29 0.00 0.42 0.00 0.00 52.86 52.81 2ce9 s ASN 528 Cb 0.10 -2.35 1.46 0.00 -1.45 0.00 0.00 41.25 39.01 2ce9 s ASN 528 CO 0.73 -1.00 1.91 -0.09 -3.72 0.00 0.00 177.10 174.92 2ce9 h ARG 529 N 9.10 0.00 -0.05 0.43 9.65 -1.87 -2.22 114.38 129.42 2ce9 h ARG 529 Ca -0.27 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.61 2ce9 h ARG 529 Cb 1.09 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.67 2ce9 h ARG 529 CO 1.00 0.00 0.00 -0.25 2.80 0.00 0.00 179.97 183.52 2ce9 n ASP 530 N -4.09 2.14 -4.66 -3.80 8.00 -1.26 -2.85 116.55 110.01 2ce9 n ASP 530 Ca 0.13 -1.72 -0.43 0.00 0.71 0.00 0.00 54.79 53.49 2ce9 n ASP 530 Cb 0.79 -0.02 -0.02 0.00 -0.02 0.00 0.00 41.12 41.85 2ce9 n ASP 530 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 2ce9 s ASN 531 N -1.95 7.10 0.04 -2.24 0.01 -0.84 -4.83 114.94 112.24 2ce9 s ASN 531 Ca 0.34 1.44 -0.30 0.00 -0.71 0.00 0.00 52.86 53.63 2ce9 s ASN 531 Cb 0.20 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 39.27 2ce9 s ASN 531 CO 0.32 -0.66 1.24 -0.31 -1.51 0.00 0.00 177.10 176.18 2ce9 s TYR 532 N 3.09 3.32 0.13 2.20 1.51 -1.26 -0.89 117.35 125.45 2ce9 s TYR 532 Ca 0.46 1.20 -0.30 0.00 -1.01 0.00 0.00 57.07 57.42 2ce9 s TYR 532 Cb -0.16 -3.47 -0.06 0.00 -0.11 0.00 0.00 41.96 38.15 2ce9 s TYR 532 CO 0.09 -1.50 1.02 0.42 -1.11 0.00 0.00 175.55 174.46 2ce9 s ILE 533 N 1.40 4.27 -0.04 2.71 1.01 -0.14 -0.66 121.20 129.74 2ce9 s ILE 533 Ca 0.59 1.90 0.07 0.00 0.00 0.00 0.00 60.65 63.22 2ce9 s ILE 533 Cb -0.29 -4.21 -0.11 0.00 0.01 0.00 0.00 42.46 37.85 2ce9 s ILE 533 CO 0.28 0.30 0.10 0.54 0.00 0.00 0.00 174.94 176.16 2ce9 n ARG 534 N 2.68 1.47 -3.64 2.79 5.12 -0.05 -4.52 116.66 120.50 2ce9 n ARG 534 Ca 0.03 -0.04 -0.15 0.00 -1.93 0.00 0.00 57.85 55.76 2ce9 n ARG 534 Cb 0.48 -1.19 -0.08 0.00 -1.16 0.00 0.00 32.46 30.51 2ce9 n ARG 534 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2ce9 s SER 535 N -3.40 -0.62 -0.07 0.55 0.15 -0.78 -4.49 113.70 105.04 2ce9 s SER 535 Ca -0.03 1.05 -0.06 0.00 0.70 0.00 0.00 55.95 57.61 2ce9 s SER 535 Cb 0.04 1.04 0.02 0.00 -1.71 0.00 0.00 66.02 65.41 2ce9 s SER 535 CO 0.32 -0.32 0.19 0.00 1.20 0.00 0.00 173.24 174.63 2ce9 s LYS 537 N 0.35 0.53 0.20 0.00 -0.14 -0.65 -4.61 119.74 115.41 2ce9 s LYS 537 Ca -0.02 -0.31 -0.13 0.00 -1.36 0.00 0.00 55.97 54.16 2ce9 s LYS 537 Cb -0.03 -0.49 -0.07 0.00 -1.68 0.00 0.00 37.83 35.55 2ce9 s LYS 537 CO -0.01 0.13 0.57 -0.51 -0.76 0.00 0.00 175.35 174.76 2ce9 s LEU 538 N -0.35 4.25 0.44 3.17 1.43 -1.26 -0.66 118.68 125.69 2ce9 s LEU 538 Ca 0.01 1.04 -0.22 0.00 -1.03 0.00 0.00 54.13 53.92 2ce9 s LEU 538 Cb -0.04 -3.51 -0.09 0.00 0.03 0.00 0.00 46.19 42.59 2ce9 s LEU 538 CO -0.00 0.01 1.06 -0.76 0.23 0.00 0.00 176.35 176.88 2ce9 s LEU 539 N -2.39 4.02 0.32 1.79 1.43 -0.42 -4.95 118.68 118.48 2ce9 s LEU 539 Ca 0.43 2.02 0.19 0.00 -1.03 0.00 0.00 54.13 55.74 2ce9 s LEU 539 Cb -0.13 -4.33 1.14 0.00 0.03 0.00 0.00 46.19 42.90 2ce9 s LEU 539 CO 0.20 -0.64 1.31 -2.65 0.23 0.00 0.00 176.35 174.80 2ce9 n PRO 540 N -0.45 -0.05 -0.30 1.29 -0.02 -1.26 -0.48 135.00 133.74 2ce9 n PRO 540 Ca 0.07 1.13 0.02 0.00 -2.02 0.00 0.00 63.50 62.70 2ce9 n PRO 540 Cb 0.51 -2.06 0.14 0.00 -0.02 0.00 0.00 33.50 32.06 2ce9 n PRO 540 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2ce9 n ASP 541 N -4.79 2.54 0.00 2.55 5.68 -1.26 -4.83 116.55 116.44 2ce9 n ASP 541 Ca 0.32 -2.30 0.00 0.00 -0.50 0.00 0.00 54.79 52.31 2ce9 n ASP 541 Cb 1.11 -0.54 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 2ce9 n ASP 541 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ce9 n GLY 542 N 0.25 0.00 0.05 6.12 0.00 0.37 -4.78 105.19 107.21 2ce9 n GLY 542 Ca 0.09 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.23 2ce9 n GLY 542 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ce9 s THR 544 N -2.90 0.58 -0.13 0.00 2.01 -1.26 0.06 115.64 114.00 2ce9 s THR 544 Ca 0.13 -0.22 0.01 0.00 0.31 0.00 0.00 61.69 61.92 2ce9 s THR 544 Cb 0.18 -0.55 -0.01 0.00 0.01 0.00 0.00 72.50 72.13 2ce9 s THR 544 CO 0.68 0.20 -0.17 -0.22 -0.69 0.00 0.00 174.62 174.43 2ce9 s LEU 545 N 0.42 2.48 -0.15 4.42 2.96 -0.42 -1.30 118.68 127.10 2ce9 s LEU 545 Ca -0.06 -0.43 -0.12 0.00 -0.22 0.00 0.00 54.13 53.31 2ce9 s LEU 545 Cb -0.10 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 45.00 2ce9 s LEU 545 CO 0.00 0.15 0.25 -0.63 -1.32 0.00 0.00 176.35 174.80 2ce9 s ILE 546 N 0.45 5.33 -0.07 6.68 1.09 0.17 -0.44 121.20 134.40 2ce9 s ILE 546 Ca -0.12 0.46 0.03 0.00 -1.10 0.00 0.00 60.65 59.92 2ce9 s ILE 546 Cb -0.16 -3.58 0.01 0.00 -1.06 0.00 0.00 42.46 37.67 2ce9 s ILE 546 CO 0.05 0.45 -0.17 -0.69 -0.10 0.00 0.00 174.94 174.48 2ce9 s VAL 547 N 0.09 1.51 0.08 2.92 1.01 -0.08 -1.64 120.40 124.29 2ce9 s VAL 547 Ca 0.15 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.44 2ce9 s VAL 547 Cb -0.13 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.89 2ce9 s VAL 547 CO 0.04 0.44 -0.06 -0.83 0.00 0.00 0.00 175.10 174.68 2ce9 s GLY 548 N 0.45 0.69 0.00 4.51 0.00 -0.33 -1.19 107.32 111.44 2ce9 s GLY 548 Ca -0.14 -1.24 0.00 0.00 0.00 0.00 0.00 44.72 43.33 2ce9 s GLY 548 CO 0.05 -1.34 0.00 0.61 0.00 0.00 0.00 173.10 172.42 2ce9 n GLY 549 N 0.21 1.00 2.71 0.20 0.00 -1.25 -0.87 105.19 107.18 2ce9 n GLY 549 Ca -0.14 -0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.35 2ce9 n GLY 549 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ce9 n GLU 550 N 0.00 3.42 -3.61 1.61 1.02 0.16 -1.40 120.64 121.84 2ce9 n GLU 550 Ca 0.00 -3.00 -0.06 0.00 -0.02 0.00 0.00 57.16 54.08 2ce9 n GLU 550 Cb 0.00 -3.03 -0.02 0.00 -0.02 0.00 0.00 31.44 28.38 2ce9 n GLU 550 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ce9 s ALA 551 N 1.55 -1.78 -0.99 0.62 0.00 -1.13 -4.50 121.76 115.54 2ce9 s ALA 551 Ca 0.47 0.65 0.22 0.00 0.00 0.00 0.00 51.96 53.30 2ce9 s ALA 551 Cb 0.13 0.49 0.92 0.00 0.00 0.00 0.00 23.12 24.66 2ce9 s ALA 551 CO -0.05 -0.85 1.69 0.43 0.00 0.00 0.00 175.76 176.98 2ce9 n SER 552 N -0.34 0.03 -4.53 0.00 7.64 -1.23 -4.11 113.62 111.07 2ce9 n SER 552 Ca -0.07 0.50 -0.31 0.00 1.01 0.00 0.00 58.87 60.00 2ce9 n SER 552 Cb 0.61 -0.51 -0.11 0.00 -1.01 0.00 0.00 64.21 63.19 2ce9 n SER 552 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ce9 s THR 553 N -3.01 3.24 -0.22 0.44 -4.23 -1.26 0.73 115.64 111.33 2ce9 s THR 553 Ca 0.10 -0.97 -0.14 0.00 -1.18 0.00 0.00 61.69 59.50 2ce9 s THR 553 Cb 0.14 -2.39 -0.04 0.00 1.34 0.00 0.00 72.50 71.54 2ce9 s THR 553 CO 0.40 0.36 0.34 -0.76 -0.54 0.00 0.00 174.62 174.42 2ce9 s LEU 554 N -1.44 4.12 -0.11 4.79 1.43 0.27 -4.52 118.68 123.23 2ce9 s LEU 554 Ca 0.16 0.38 -0.15 0.00 -1.03 0.00 0.00 54.13 53.49 2ce9 s LEU 554 Cb -0.11 -2.40 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 2ce9 s LEU 554 CO 0.07 -0.06 0.36 -0.44 0.23 0.00 0.00 176.35 176.50 2ce9 s SER 555 N 1.16 6.59 -0.22 2.29 0.01 -0.34 0.49 113.70 123.68 2ce9 s SER 555 Ca 0.16 0.70 -0.06 0.00 1.31 0.00 0.00 55.95 58.05 2ce9 s SER 555 Cb -0.15 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 63.84 2ce9 s SER 555 CO 0.08 0.15 0.04 -0.51 0.41 0.00 0.00 173.24 173.40 2ce9 s ILE 556 N 0.03 4.19 -0.19 1.44 2.07 0.49 -0.91 121.20 128.34 2ce9 s ILE 556 Ca 0.21 -0.22 -0.07 0.00 -1.41 0.00 0.00 60.65 59.15 2ce9 s ILE 556 Cb -0.14 -2.92 -0.04 0.00 0.13 0.00 0.00 42.46 39.49 2ce9 s ILE 556 CO 0.08 0.40 0.04 0.26 -1.91 0.00 0.00 174.94 173.81 2ce9 s TRP 557 N 1.18 3.17 -0.23 3.50 0.52 0.41 -1.16 118.94 126.34 2ce9 s TRP 557 Ca 0.04 -0.08 -0.25 0.00 0.02 0.00 0.00 56.10 55.82 2ce9 s TRP 557 Cb -0.14 -2.08 -0.00 0.00 -1.15 0.00 0.00 33.47 30.09 2ce9 s TRP 557 CO 0.02 0.03 0.87 0.34 0.02 0.00 0.00 176.95 178.23 2ce9 s ASP 558 N 0.58 6.90 -0.08 2.95 2.15 0.83 -1.30 116.67 128.69 2ce9 s ASP 558 Ca 0.02 1.11 0.15 0.00 0.43 0.00 0.00 52.55 54.26 2ce9 s ASP 558 Cb -0.13 -2.46 0.49 0.00 -0.30 0.00 0.00 42.92 40.52 2ce9 s ASP 558 CO 0.02 -0.53 1.41 0.18 -0.17 0.00 0.00 175.17 176.08 2ce9 n LEU 559 N 5.95 3.73 0.07 -1.34 4.77 0.11 -1.94 117.00 128.35 2ce9 n LEU 559 Ca 0.07 -2.41 -0.20 0.00 -0.03 0.00 0.00 56.01 53.43 2ce9 n LEU 559 Cb 0.47 -0.42 -0.11 0.00 -2.33 0.00 0.00 43.42 41.03 2ce9 n LEU 559 CO 0.48 0.75 0.02 0.00 -1.33 0.00 0.00 177.39 177.31 2ce9 h ALA 560 N 2.58 0.10 -3.11 -1.18 0.00 -1.84 -3.43 119.26 112.38 2ce9 h ALA 560 Ca 0.00 -0.74 -0.70 0.00 0.00 0.00 0.00 54.91 53.47 2ce9 h ALA 560 Cb 1.14 0.07 -0.34 0.00 0.00 0.00 0.00 17.79 18.65 2ce9 h ALA 560 CO 0.13 0.72 -0.47 0.00 0.00 0.00 0.00 179.25 179.62 2ce9 s ALA 561 N -3.14 3.32 0.00 0.00 0.00 -1.26 -4.93 121.76 115.74 2ce9 s ALA 561 Ca -0.09 -2.77 0.00 0.00 0.00 0.00 0.00 51.96 49.10 2ce9 s ALA 561 Cb 0.07 -2.53 0.00 0.00 0.00 0.00 0.00 23.12 20.65 2ce9 s ALA 561 CO 0.92 -1.91 0.00 -2.30 0.00 0.00 0.00 175.76 172.47 2ce9 n PRO 562 N 4.26 0.00 -2.87 0.00 -0.02 -1.26 -4.49 135.00 130.63 2ce9 n PRO 562 Ca 0.01 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.07 2ce9 n PRO 562 Cb 0.40 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 33.84 2ce9 n PRO 562 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2ce9 s THR 563 N -1.37 4.92 0.48 3.45 2.01 -1.26 -5.07 115.64 118.80 2ce9 s THR 563 Ca 0.00 1.73 -0.23 0.00 0.31 0.00 0.00 61.69 63.50 2ce9 s THR 563 Cb 0.00 -4.17 -0.07 0.00 0.01 0.00 0.00 72.50 68.27 2ce9 s THR 563 CO 0.00 0.13 1.20 -2.16 -0.69 0.00 0.00 174.62 173.09 2ce9 s PRO 564 N 1.43 3.63 -0.03 4.92 0.04 -1.26 -4.70 135.00 139.03 2ce9 s PRO 564 Ca 0.43 1.85 -0.06 0.00 0.04 0.00 0.00 61.00 63.25 2ce9 s PRO 564 Cb -0.18 -2.36 0.01 0.00 0.04 0.00 0.00 34.50 32.01 2ce9 s PRO 564 CO 0.19 -0.68 0.14 -0.98 0.04 0.00 0.00 177.00 175.71 2ce9 s ARG 565 N -2.76 0.31 0.01 4.56 1.70 -0.82 -5.01 118.95 116.94 2ce9 s ARG 565 Ca 0.65 -0.07 -0.30 0.00 -0.47 0.00 0.00 55.73 55.54 2ce9 s ARG 565 Cb -0.30 0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.17 2ce9 s ARG 565 CO 0.37 -0.06 1.06 -1.50 -1.08 0.00 0.00 175.30 174.08 2ce9 s ILE 566 N -0.59 4.59 -0.04 4.99 2.07 -1.26 -0.12 121.20 130.83 2ce9 s ILE 566 Ca -0.07 1.86 0.11 0.00 -1.41 0.00 0.00 60.65 61.14 2ce9 s ILE 566 Cb -0.04 -4.19 -0.17 0.00 0.13 0.00 0.00 42.46 38.19 2ce9 s ILE 566 CO 0.01 0.13 0.19 2.29 -1.91 0.00 0.00 174.94 175.65 2ce9 n LYS 567 N 4.01 0.93 -3.67 3.50 2.85 -0.30 -4.89 118.16 120.58 2ce9 n LYS 567 Ca 0.07 -0.08 -0.15 0.00 -1.05 0.00 0.00 58.31 57.11 2ce9 n LYS 567 Cb 0.49 -1.28 -0.08 0.00 -0.65 0.00 0.00 35.03 33.52 2ce9 n LYS 567 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ce9 s ALA 568 N -2.64 -1.19 -0.13 0.58 0.00 -1.16 -5.02 121.76 112.21 2ce9 s ALA 568 Ca -0.05 0.87 0.03 0.00 0.00 0.00 0.00 51.96 52.82 2ce9 s ALA 568 Cb 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.04 2ce9 s ALA 568 CO 0.47 -0.29 -0.22 -1.21 0.00 0.00 0.00 175.76 174.52 2ce9 s GLU 569 N -0.92 3.07 -0.30 0.00 0.41 -1.26 -0.38 118.70 119.32 2ce9 s GLU 569 Ca -0.10 -0.84 -0.12 0.00 -0.41 0.00 0.00 54.97 53.50 2ce9 s GLU 569 Cb -0.03 -2.42 -0.04 0.00 -1.78 0.00 0.00 34.13 29.86 2ce9 s GLU 569 CO 0.05 0.07 0.21 -0.51 -0.49 0.00 0.00 175.26 174.59 2ce9 s LEU 570 N 0.62 4.21 -0.23 1.80 1.43 0.18 -4.95 118.68 121.74 2ce9 s LEU 570 Ca -0.11 -0.17 -0.10 0.00 -1.03 0.00 0.00 54.13 52.72 2ce9 s LEU 570 Cb -0.16 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 43.88 2ce9 s LEU 570 CO 0.03 -0.12 0.14 -0.89 0.23 0.00 0.00 176.35 175.73 2ce9 s THR 571 N 1.74 5.22 0.20 5.49 2.01 -1.26 -0.56 115.64 128.48 2ce9 s THR 571 Ca 0.07 0.13 0.03 0.00 0.31 0.00 0.00 61.69 62.23 2ce9 s THR 571 Cb -0.17 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 68.89 2ce9 s THR 571 CO 0.11 0.37 0.34 -0.55 -0.69 0.00 0.00 174.62 174.19 2ce9 s SER 572 N 0.93 6.34 0.12 3.53 0.15 0.22 -5.00 113.70 119.99 2ce9 s SER 572 Ca 0.07 0.17 0.09 0.00 0.70 0.00 0.00 55.95 56.98 2ce9 s SER 572 Cb -0.13 -1.91 -0.18 0.00 -1.71 0.00 0.00 66.02 62.09 2ce9 s SER 572 CO 0.03 -0.02 1.20 0.77 1.20 0.00 0.00 173.24 176.43 2ce9 h SER 573 N 1.71 0.00 -3.70 5.45 4.64 -1.99 -3.47 113.55 116.20 2ce9 h SER 573 Ca -0.50 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.31 2ce9 h SER 573 Cb 1.21 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.31 2ce9 h SER 573 CO 0.65 0.93 0.47 0.00 -0.87 0.00 0.00 176.83 178.01 2ce9 s ALA 574 N -2.73 3.39 0.51 5.18 0.00 -1.26 -4.94 121.76 121.91 2ce9 s ALA 574 Ca 0.00 0.85 0.34 0.00 0.00 0.00 0.00 51.96 53.16 2ce9 s ALA 574 Cb 0.09 -3.33 1.87 0.00 0.00 0.00 0.00 23.12 21.75 2ce9 s ALA 574 CO 0.81 -0.16 2.21 -1.00 0.00 0.00 0.00 175.76 177.62 2ce9 h PRO 575 N 4.37 0.00 -3.04 0.00 0.13 -1.89 -3.39 132.00 128.17 2ce9 h PRO 575 Ca -0.46 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.60 2ce9 h PRO 575 Cb 1.21 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.18 2ce9 h PRO 575 CO 0.69 0.04 -0.09 0.00 -0.23 0.00 0.00 178.00 178.40 2ce9 s ALA 576 N -4.24 -1.02 -0.13 -0.56 0.00 -1.26 -2.84 121.76 111.71 2ce9 s ALA 576 Ca -0.04 0.30 -0.01 0.00 0.00 0.00 0.00 51.96 52.21 2ce9 s ALA 576 Cb 0.13 0.38 -0.02 0.00 0.00 0.00 0.00 23.12 23.61 2ce9 s ALA 576 CO 0.51 -0.47 -0.12 0.00 0.00 0.00 0.00 175.76 175.68 2ce9 n TYR 578 N 3.55 0.00 -3.61 0.00 4.01 0.33 -3.78 117.16 117.66 2ce9 n TYR 578 Ca -0.18 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.48 2ce9 n TYR 578 Cb 0.53 -0.03 -0.05 0.00 -0.31 0.00 0.00 39.34 39.47 2ce9 n TYR 578 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2ce9 s ALA 579 N -2.31 -2.01 0.15 -0.72 0.00 -1.25 -4.66 121.76 110.96 2ce9 s ALA 579 Ca 0.04 1.72 0.07 0.00 0.00 0.00 0.00 51.96 53.79 2ce9 s ALA 579 Cb 0.10 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 22.06 2ce9 s ALA 579 CO 0.54 -0.26 -0.16 -0.51 0.00 0.00 0.00 175.76 175.37 2ce9 s LEU 580 N -0.78 2.44 -0.03 0.00 1.43 -1.26 -0.85 118.68 119.64 2ce9 s LEU 580 Ca 0.02 -0.87 -0.08 0.00 -1.03 0.00 0.00 54.13 52.18 2ce9 s LEU 580 Cb -0.02 -0.70 0.01 0.00 0.03 0.00 0.00 46.19 45.52 2ce9 s LEU 580 CO -0.04 -0.10 0.17 0.00 0.23 0.00 0.00 176.35 176.62 2ce9 s ALA 581 N -2.23 -0.42 -0.02 4.21 0.00 -0.59 -4.89 121.76 117.82 2ce9 s ALA 581 Ca 0.14 0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.28 2ce9 s ALA 581 Cb -0.05 -0.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 2ce9 s ALA 581 CO 0.05 -0.16 -0.03 0.42 0.00 0.00 0.00 175.76 176.03 2ce9 s ILE 582 N -0.79 3.94 0.60 0.00 -1.09 -1.26 -0.79 121.20 121.81 2ce9 s ILE 582 Ca -0.09 -0.58 -0.18 0.00 -2.23 0.00 0.00 60.65 57.57 2ce9 s ILE 582 Cb -0.05 -2.70 -0.03 0.00 -1.58 0.00 0.00 42.46 38.10 2ce9 s ILE 582 CO 0.01 0.45 1.16 -0.94 -1.23 0.00 0.00 174.94 174.39 2ce9 s SER 583 N -1.29 5.28 0.58 3.58 1.04 -0.52 -4.93 113.70 117.45 2ce9 s SER 583 Ca 0.17 2.23 0.28 0.00 0.48 0.00 0.00 55.95 59.11 2ce9 s SER 583 Cb -0.11 -2.58 1.76 0.00 0.10 0.00 0.00 66.02 65.18 2ce9 s SER 583 CO 0.07 -1.52 2.22 -0.65 0.98 0.00 0.00 173.24 174.34 2ce9 h PRO 584 N 0.72 0.00 -0.00 4.02 0.11 -1.93 -0.39 132.00 134.52 2ce9 h PRO 584 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ce9 h PRO 584 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2ce9 h PRO 584 CO 0.55 0.00 -0.12 -0.40 -0.21 0.00 0.00 178.00 177.82 2ce9 n ASP 585 N -3.90 0.59 0.00 -2.05 5.68 -1.26 -4.94 116.55 110.68 2ce9 n ASP 585 Ca -0.02 -0.70 0.00 0.00 -0.50 0.00 0.00 54.79 53.57 2ce9 n ASP 585 Cb 0.12 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.06 2ce9 n ASP 585 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2ce9 n SER 586 N -0.84 -0.21 0.10 -1.12 7.64 -0.16 -4.89 113.62 114.14 2ce9 n SER 586 Ca 0.15 0.00 0.02 0.00 1.01 0.00 0.00 58.87 60.05 2ce9 n SER 586 Cb 0.28 -0.04 -0.02 0.00 -1.01 0.00 0.00 64.21 63.43 2ce9 n SER 586 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 2ce9 h LYS 587 N 2.86 0.00 -5.59 1.43 2.10 -1.92 -3.45 116.57 111.99 2ce9 h LYS 587 Ca 0.00 0.00 -0.51 0.00 -2.00 0.00 0.00 60.65 58.14 2ce9 h LYS 587 Cb 0.00 0.00 -0.27 0.00 -0.90 0.00 0.00 32.23 31.06 2ce9 h LYS 587 CO 0.00 0.40 -0.82 0.08 -2.00 0.00 0.00 179.45 177.11 2ce9 s VAL 588 N -2.96 1.32 -0.14 0.07 1.01 -1.26 -0.07 120.40 118.36 2ce9 s VAL 588 Ca 0.01 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2ce9 s VAL 588 Cb 0.08 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.33 2ce9 s VAL 588 CO 0.77 0.23 -0.18 0.00 0.00 0.00 0.00 175.10 175.93 2ce9 s PHE 590 N 0.76 3.35 -0.17 0.00 0.08 0.03 -0.93 117.98 121.10 2ce9 s PHE 590 Ca -0.07 0.38 0.00 0.00 0.12 0.00 0.00 56.93 57.36 2ce9 s PHE 590 Cb -0.16 -2.34 0.01 0.00 -0.57 0.00 0.00 43.02 39.95 2ce9 s PHE 590 CO 0.00 0.07 -0.16 0.45 -0.10 0.00 0.00 175.22 175.49 2ce9 s SER 591 N 0.95 3.51 -0.35 1.36 0.15 0.10 -1.54 113.70 117.89 2ce9 s SER 591 Ca 0.12 -0.53 -0.29 0.00 0.70 0.00 0.00 55.95 55.95 2ce9 s SER 591 Cb -0.14 -1.55 0.02 0.00 -1.71 0.00 0.00 66.02 62.65 2ce9 s SER 591 CO 0.05 0.05 1.07 0.00 1.20 0.00 0.00 173.24 175.60 2ce9 h SER 594 N 2.56 0.00 -0.15 0.00 4.64 -1.14 -2.02 113.55 117.44 2ce9 h SER 594 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 2ce9 h SER 594 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2ce9 h SER 594 CO 0.71 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.77 2ce9 n ASP 595 N -2.49 2.16 0.00 4.97 5.68 -1.26 -2.94 116.55 122.67 2ce9 n ASP 595 Ca -0.01 -1.75 0.00 0.00 -0.50 0.00 0.00 54.79 52.53 2ce9 n ASP 595 Cb 0.11 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.00 2ce9 n ASP 595 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ce9 n GLY 596 N 1.25 2.68 3.77 6.12 0.00 -0.82 -4.50 105.19 113.69 2ce9 n GLY 596 Ca 0.17 -0.08 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 2ce9 n GLY 596 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2ce9 s ASN 597 N 0.66 5.94 -0.35 1.61 0.01 -1.26 -4.11 114.94 117.43 2ce9 s ASN 597 Ca 0.00 2.20 -0.12 0.00 -0.71 0.00 0.00 52.86 54.23 2ce9 s ASN 597 Cb 0.00 -2.59 0.00 0.00 0.41 0.00 0.00 41.25 39.08 2ce9 s ASN 597 CO 0.00 -1.07 0.22 -0.63 -1.51 0.00 0.00 177.10 174.12 2ce9 s ILE 598 N -1.71 4.96 -0.09 0.60 -1.09 -0.64 -1.09 121.20 122.15 2ce9 s ILE 598 Ca 0.69 -0.49 -0.22 0.00 -2.23 0.00 0.00 60.65 58.39 2ce9 s ILE 598 Cb -0.25 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 36.96 2ce9 s ILE 598 CO 0.29 -0.10 0.65 0.00 -1.23 0.00 0.00 174.94 174.55 2ce9 s ALA 599 N 1.65 3.38 -0.29 9.38 0.00 -0.31 -0.63 121.76 134.94 2ce9 s ALA 599 Ca 0.05 0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 2ce9 s ALA 599 Cb -0.18 -2.89 0.02 0.00 0.00 0.00 0.00 23.12 20.07 2ce9 s ALA 599 CO 0.09 -0.11 0.06 0.08 0.00 0.00 0.00 175.76 175.87 2ce9 s VAL 600 N 0.84 3.74 -0.17 0.00 1.01 -0.85 0.02 120.40 124.98 2ce9 s VAL 600 Ca 0.34 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 2ce9 s VAL 600 Cb -0.17 -2.95 -0.02 0.00 0.00 0.00 0.00 36.38 33.24 2ce9 s VAL 600 CO 0.16 0.06 -0.07 0.26 0.00 0.00 0.00 175.10 175.51 2ce9 s TRP 601 N 1.45 2.93 -0.16 5.22 0.52 -0.11 -0.87 118.94 127.92 2ce9 s TRP 601 Ca 0.01 -0.66 -0.29 0.00 0.02 0.00 0.00 56.10 55.19 2ce9 s TRP 601 Cb -0.17 -1.97 -0.02 0.00 -1.15 0.00 0.00 33.47 30.16 2ce9 s TRP 601 CO 0.01 -0.29 1.26 0.34 0.02 0.00 0.00 176.95 178.29 2ce9 s ASP 602 N 0.78 6.95 0.03 2.95 -1.08 0.27 -1.50 116.67 125.07 2ce9 s ASP 602 Ca -0.03 1.70 -0.17 0.00 -0.52 0.00 0.00 52.55 53.53 2ce9 s ASP 602 Cb -0.15 -2.54 -0.23 0.00 -1.46 0.00 0.00 42.92 38.55 2ce9 s ASP 602 CO 0.02 -0.75 1.15 -0.07 0.52 0.00 0.00 175.17 176.03 2ce9 h LEU 603 N 9.62 0.68 -0.33 -1.34 3.38 -0.80 -0.10 115.31 126.42 2ce9 h LEU 603 Ca -0.27 -0.74 -0.02 0.00 0.09 0.00 0.00 57.88 56.95 2ce9 h LEU 603 Cb 1.11 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2ce9 h LEU 603 CO 0.96 1.33 0.14 -0.74 0.09 0.00 0.00 178.44 180.22 2ce9 h HIS 604 N 0.10 0.49 -0.00 1.13 2.76 -1.91 -3.08 115.15 114.64 2ce9 h HIS 604 Ca -0.09 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 2ce9 h HIS 604 Cb 1.43 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.24 2ce9 h HIS 604 CO 0.13 0.46 -0.25 0.09 -1.30 0.00 0.00 177.93 177.05 2ce9 n ASN 605 N -4.72 0.72 -3.65 3.26 4.13 -1.25 -4.96 115.26 108.78 2ce9 n ASN 605 Ca -0.01 -0.60 -0.22 0.00 1.68 0.00 0.00 54.58 55.42 2ce9 n ASN 605 Cb 0.13 0.07 0.06 0.00 -1.54 0.00 0.00 39.78 38.49 2ce9 n ASN 605 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2ce9 n GLN 606 N -0.95 -6.02 -4.03 3.52 6.02 -0.08 -4.98 117.38 110.86 2ce9 n GLN 606 Ca 0.11 0.71 -0.11 0.00 -0.01 0.00 0.00 57.00 57.71 2ce9 n GLN 606 Cb 0.33 -5.55 -0.11 0.00 1.02 0.00 0.00 30.24 25.93 2ce9 n GLN 606 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2ce9 s THR 607 N -3.46 0.33 -0.40 5.09 -1.32 -1.03 -4.98 115.64 109.87 2ce9 s THR 607 Ca 0.22 -1.09 -0.29 0.00 -1.21 0.00 0.00 61.69 59.32 2ce9 s THR 607 Cb -0.11 -0.56 0.02 0.00 -1.51 0.00 0.00 72.50 70.35 2ce9 s THR 607 CO 0.78 -0.50 1.14 -0.22 -2.21 0.00 0.00 174.62 173.61 2ce9 s LEU 608 N -1.68 3.77 0.04 9.08 2.96 -1.26 -0.56 118.68 131.02 2ce9 s LEU 608 Ca -0.11 0.78 0.20 0.00 -0.22 0.00 0.00 54.13 54.78 2ce9 s LEU 608 Cb -0.08 -3.55 -0.17 0.00 0.50 0.00 0.00 46.19 42.90 2ce9 s LEU 608 CO -0.01 -1.10 0.70 1.33 -1.32 0.00 0.00 176.35 175.95 2ce9 n VAL 609 N 6.42 0.77 -3.56 1.68 0.24 -0.05 -4.97 118.33 118.87 2ce9 n VAL 609 Ca 0.12 -0.63 -0.06 0.00 -2.04 0.00 0.00 64.34 61.73 2ce9 n VAL 609 Cb 0.48 -0.42 -0.03 0.00 -1.47 0.00 0.00 33.84 32.41 2ce9 n VAL 609 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2ce9 s ARG 610 N -3.13 0.51 -0.05 7.34 3.52 -1.22 -5.05 118.95 120.86 2ce9 s ARG 610 Ca -0.04 -0.13 0.03 0.00 -0.13 0.00 0.00 55.73 55.46 2ce9 s ARG 610 Cb 0.10 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.73 2ce9 s ARG 610 CO 0.83 -0.21 -0.15 -0.65 -0.81 0.00 0.00 175.30 174.31 2ce9 s GLN 611 N -2.40 1.73 -0.54 5.12 -0.21 -1.26 -2.00 119.66 120.10 2ce9 s GLN 611 Ca 0.06 -0.52 -0.21 0.00 0.02 0.00 0.00 55.36 54.71 2ce9 s GLN 611 Cb -0.01 -1.47 0.06 0.00 1.00 0.00 0.00 33.01 32.59 2ce9 s GLN 611 CO -0.05 0.15 0.76 -0.06 -2.12 0.00 0.00 175.29 173.97 2ce9 s PHE 612 N 0.28 2.93 -0.13 0.91 0.08 0.20 -4.94 117.98 117.31 2ce9 s PHE 612 Ca -0.08 -0.41 -0.06 0.00 0.12 0.00 0.00 56.93 56.50 2ce9 s PHE 612 Cb -0.13 -3.82 -0.04 0.00 -0.57 0.00 0.00 43.02 38.46 2ce9 s PHE 612 CO 0.03 -1.21 0.09 -0.65 -0.10 0.00 0.00 175.22 173.37 2ce9 s GLN 613 N 3.18 3.45 0.00 0.44 -0.21 -1.26 -1.62 119.66 123.65 2ce9 s GLN 613 Ca 0.20 -0.25 0.00 0.00 0.02 0.00 0.00 55.36 55.33 2ce9 s GLN 613 Cb -0.17 -3.10 0.00 0.00 1.00 0.00 0.00 33.01 30.74 2ce9 s GLN 613 CO 0.13 0.64 0.00 0.41 -2.12 0.00 0.00 175.29 174.35 2ce9 n GLY 614 N 2.40 1.47 3.69 3.09 0.00 -1.26 -4.94 105.19 109.63 2ce9 n GLY 614 Ca -0.19 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 2ce9 n GLY 614 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ce9 s HIS 615 N 0.00 2.05 -1.51 1.61 3.76 -1.26 -4.87 115.29 115.07 2ce9 s HIS 615 Ca 0.00 -0.06 0.14 0.00 -0.15 0.00 0.00 55.06 54.99 2ce9 s HIS 615 Cb 0.00 -4.17 0.51 0.00 1.11 0.00 0.00 32.58 30.03 2ce9 s HIS 615 CO 0.00 -4.90 1.40 0.25 -0.85 0.00 0.00 174.74 170.64 2ce9 n THR 616 N 4.85 1.12 -3.85 1.30 -2.24 -1.26 -4.35 114.28 109.85 2ce9 n THR 616 Ca 0.18 -0.81 -0.07 0.00 -2.27 0.00 0.00 64.05 61.08 2ce9 n THR 616 Cb 0.39 0.13 -0.01 0.00 -2.10 0.00 0.00 70.33 68.74 2ce9 n THR 616 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2ce9 s ASP 617 N -0.86 -0.21 0.12 3.42 -1.08 -1.26 -4.90 116.67 111.90 2ce9 s ASP 617 Ca 0.37 -0.70 -0.33 0.00 -0.52 0.00 0.00 52.55 51.37 2ce9 s ASP 617 Cb 0.22 0.74 -0.18 0.00 -1.46 0.00 0.00 42.92 42.25 2ce9 s ASP 617 CO 0.20 -1.40 0.81 0.61 0.52 0.00 0.00 175.17 175.91 2ce9 n GLY 618 N -0.47 -0.98 3.72 2.66 0.00 -1.15 -3.60 105.19 105.36 2ce9 n GLY 618 Ca -0.05 0.53 -0.40 0.00 0.00 0.00 0.00 46.02 46.09 2ce9 n GLY 618 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ce9 s ALA 619 N -0.53 3.29 -0.39 4.61 0.00 -0.84 -1.11 121.76 126.79 2ce9 s ALA 619 Ca 0.76 0.25 0.13 0.00 0.00 0.00 0.00 51.96 53.10 2ce9 s ALA 619 Cb -1.06 -3.06 -0.16 0.00 0.00 0.00 0.00 23.12 18.84 2ce9 s ALA 619 CO 0.56 -0.13 0.45 -1.13 0.00 0.00 0.00 175.76 175.51 2ce9 n SER 620 N 3.77 1.11 -3.55 0.00 3.41 0.03 -4.34 113.62 114.05 2ce9 n SER 620 Ca 0.01 -0.51 -0.06 0.00 -0.26 0.00 0.00 58.87 58.04 2ce9 n SER 620 Cb 0.51 1.22 -0.02 0.00 -0.26 0.00 0.00 64.21 65.66 2ce9 n SER 620 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ce9 s ILE 622 N -2.82 0.00 0.20 0.00 2.07 -1.26 -1.99 121.20 117.40 2ce9 s ILE 622 Ca 0.07 0.00 -0.23 0.00 -1.41 0.00 0.00 60.65 59.09 2ce9 s ILE 622 Cb -0.01 -1.00 0.05 0.00 0.13 0.00 0.00 42.46 41.64 2ce9 s ILE 622 CO -0.07 0.00 0.66 -0.62 -1.91 0.00 0.00 174.94 173.01 2ce9 s ASP 623 N -1.10 -0.44 0.02 4.50 -1.08 -0.25 -4.89 116.67 113.43 2ce9 s ASP 623 Ca -0.02 -0.22 0.04 0.00 -0.52 0.00 0.00 52.55 51.82 2ce9 s ASP 623 Cb -0.00 0.64 -0.03 0.00 -1.46 0.00 0.00 42.92 42.06 2ce9 s ASP 623 CO 0.02 -1.09 -0.06 -0.63 0.52 0.00 0.00 175.17 173.93 2ce9 s ILE 624 N -3.78 3.68 0.68 4.11 1.01 -1.26 -1.43 121.20 124.22 2ce9 s ILE 624 Ca 0.05 -0.83 -0.14 0.00 0.00 0.00 0.00 60.65 59.73 2ce9 s ILE 624 Cb -0.03 -2.63 0.01 0.00 0.01 0.00 0.00 42.46 39.82 2ce9 s ILE 624 CO -0.05 0.34 1.10 -0.94 0.00 0.00 0.00 174.94 175.38 2ce9 s SER 625 N -1.58 5.04 0.51 3.58 1.04 -0.46 -4.77 113.70 117.06 2ce9 s SER 625 Ca 0.18 1.92 0.18 0.00 0.48 0.00 0.00 55.95 58.71 2ce9 s SER 625 Cb -0.11 -2.54 1.26 0.00 0.10 0.00 0.00 66.02 64.73 2ce9 s SER 625 CO 0.09 -1.67 2.08 -0.55 0.98 0.00 0.00 173.24 174.17 2ce9 h ASN 626 N -0.26 0.07 1.11 7.02 -1.07 -1.86 0.19 115.58 120.77 2ce9 h ASN 626 Ca -0.46 -0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.91 2ce9 h ASN 626 Cb 1.24 -0.01 0.00 0.00 -2.07 0.00 0.00 38.32 37.47 2ce9 h ASN 626 CO 0.54 0.04 0.00 -0.90 0.07 0.00 0.00 177.43 177.18 2ce9 n ASP 627 N -4.48 0.49 0.00 6.14 5.68 -1.26 -4.94 116.55 118.18 2ce9 n ASP 627 Ca 0.02 0.57 0.00 0.00 -0.50 0.00 0.00 54.79 54.88 2ce9 n ASP 627 Cb 0.27 -0.69 0.00 0.00 -1.14 0.00 0.00 41.12 39.56 2ce9 n ASP 627 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ce9 n GLY 628 N 0.98 0.65 0.00 6.12 0.00 0.65 -4.93 105.19 108.66 2ce9 n GLY 628 Ca 0.05 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.12 2ce9 n GLY 628 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ce9 n THR 629 N -2.69 0.00 -5.25 2.61 -2.24 -1.26 -4.91 114.28 100.54 2ce9 n THR 629 Ca 0.00 -0.26 -0.31 0.00 -2.27 0.00 0.00 64.05 61.21 2ce9 n THR 629 Cb 0.00 0.50 -0.16 0.00 -2.10 0.00 0.00 70.33 68.57 2ce9 n THR 629 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ce9 s LYS 630 N -2.63 2.22 -0.11 -0.78 -0.14 -1.26 -0.99 119.74 116.04 2ce9 s LYS 630 Ca -0.01 -0.90 -0.05 0.00 -1.36 0.00 0.00 55.97 53.65 2ce9 s LYS 630 Cb 0.09 -2.03 -0.04 0.00 -1.68 0.00 0.00 37.83 34.17 2ce9 s LYS 630 CO 0.53 0.48 0.08 -1.17 -0.76 0.00 0.00 175.35 174.51 2ce9 s LEU 631 N -0.42 4.02 -0.06 3.17 2.96 0.97 -1.35 118.68 127.97 2ce9 s LEU 631 Ca 0.05 0.30 0.04 0.00 -0.22 0.00 0.00 54.13 54.30 2ce9 s LEU 631 Cb -0.11 -1.96 0.00 0.00 0.50 0.00 0.00 46.19 44.62 2ce9 s LEU 631 CO 0.01 0.37 -0.18 0.26 -1.32 0.00 0.00 176.35 175.49 2ce9 s TRP 632 N -0.82 1.91 0.02 5.38 0.52 -0.51 -0.03 118.94 125.41 2ce9 s TRP 632 Ca 0.13 -0.66 0.02 0.00 0.02 0.00 0.00 56.10 55.62 2ce9 s TRP 632 Cb -0.12 -1.30 -0.02 0.00 -1.15 0.00 0.00 33.47 30.88 2ce9 s TRP 632 CO 0.03 -0.26 -0.08 0.95 0.02 0.00 0.00 176.95 177.61 2ce9 s THR 633 N 0.26 0.56 0.18 2.01 -4.23 -0.57 -1.09 115.64 112.76 2ce9 s THR 633 Ca -0.10 -0.70 0.09 0.00 -1.18 0.00 0.00 61.69 59.79 2ce9 s THR 633 Cb -0.14 -0.55 -0.04 0.00 1.34 0.00 0.00 72.50 73.11 2ce9 s THR 633 CO 0.04 -0.12 -0.10 -0.83 -0.54 0.00 0.00 174.62 173.08 2ce9 s GLY 634 N -0.90 1.73 0.16 3.99 0.00 -0.84 -0.94 107.32 110.52 2ce9 s GLY 634 Ca -0.03 -1.48 -0.01 0.00 0.00 0.00 0.00 44.72 43.20 2ce9 s GLY 634 CO 0.00 -1.50 0.08 -0.32 0.00 0.00 0.00 173.10 171.37 2ce9 s GLY 635 N -2.83 1.20 0.00 0.20 0.00 -0.53 -0.78 107.32 104.57 2ce9 s GLY 635 Ca 0.25 -1.58 0.16 0.00 0.00 0.00 0.00 44.72 43.55 2ce9 s GLY 635 CO 0.15 -1.39 1.48 1.04 0.00 0.00 0.00 173.10 174.37 2ce9 n LEU 636 N -0.18 0.00 -0.04 0.66 4.77 -0.27 -2.04 117.00 119.91 2ce9 n LEU 636 Ca -0.02 0.30 0.07 0.00 -0.03 0.00 0.00 56.01 56.33 2ce9 n LEU 636 Cb 0.65 -0.30 0.42 0.00 -2.33 0.00 0.00 43.42 41.86 2ce9 n LEU 636 CO 0.32 -0.14 0.77 -0.90 -1.33 0.00 0.00 177.39 176.11 2ce9 n ASP 637 N -1.30 0.12 -0.48 -1.43 5.75 -1.26 -4.82 116.55 113.13 2ce9 n ASP 637 Ca 0.08 -1.57 -0.05 0.00 -0.01 0.00 0.00 54.79 53.24 2ce9 n ASP 637 Cb 0.13 -0.01 -0.01 0.00 -1.03 0.00 0.00 41.12 40.20 2ce9 n ASP 637 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2ce9 n ASN 638 N -0.65 -2.91 -4.23 -1.12 4.13 -0.86 -4.91 115.26 104.70 2ce9 n ASN 638 Ca 0.11 0.06 -0.22 0.00 1.68 0.00 0.00 54.58 56.21 2ce9 n ASN 638 Cb 0.07 -1.57 -0.13 0.00 -1.54 0.00 0.00 39.78 36.62 2ce9 n ASN 638 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2ce9 s THR 639 N -2.22 1.45 -0.10 3.41 -4.23 -1.25 0.53 115.64 113.23 2ce9 s THR 639 Ca 0.00 -1.38 -0.03 0.00 -1.18 0.00 0.00 61.69 59.10 2ce9 s THR 639 Cb 0.00 -1.33 -0.03 0.00 1.34 0.00 0.00 72.50 72.48 2ce9 s THR 639 CO 0.00 -0.09 0.01 -0.69 -0.54 0.00 0.00 174.62 173.32 2ce9 s VAL 640 N -1.14 4.41 0.01 2.29 1.01 -0.03 -1.45 120.40 125.49 2ce9 s VAL 640 Ca 0.03 -0.21 0.04 0.00 0.00 0.00 0.00 61.98 61.84 2ce9 s VAL 640 Cb -0.10 -2.87 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 2ce9 s VAL 640 CO 0.03 0.60 -0.11 -0.13 0.00 0.00 0.00 175.10 175.48 2ce9 s ARG 641 N -0.79 0.86 0.13 2.72 0.52 -0.12 -0.34 118.95 121.94 2ce9 s ARG 641 Ca 0.12 -0.49 0.06 0.00 -0.52 0.00 0.00 55.73 54.89 2ce9 s ARG 641 Cb -0.12 -0.83 -0.04 0.00 0.52 0.00 0.00 34.95 34.49 2ce9 s ARG 641 CO 0.02 0.22 0.03 -1.54 0.02 0.00 0.00 175.30 174.05 2ce9 s SER 642 N -0.54 5.07 0.01 0.23 1.04 -0.60 -1.51 113.70 117.40 2ce9 s SER 642 Ca 0.03 -0.23 0.01 0.00 0.48 0.00 0.00 55.95 56.24 2ce9 s SER 642 Cb -0.05 -1.20 -0.01 0.00 0.10 0.00 0.00 66.02 64.85 2ce9 s SER 642 CO 0.00 0.12 -0.04 0.26 0.98 0.00 0.00 173.24 174.57 2ce9 s TRP 643 N -1.54 0.32 -0.35 5.02 0.52 0.95 0.26 118.94 124.12 2ce9 s TRP 643 Ca 0.28 -0.23 -0.20 0.00 0.02 0.00 0.00 56.10 55.96 2ce9 s TRP 643 Cb -0.11 -0.21 0.00 0.00 -1.15 0.00 0.00 33.47 32.01 2ce9 s TRP 643 CO 0.20 -0.06 0.63 0.34 0.02 0.00 0.00 176.95 178.08 2ce9 s ASP 644 N -0.63 6.43 0.50 2.95 2.15 -0.42 -0.02 116.67 127.63 2ce9 s ASP 644 Ca -0.04 0.18 0.29 0.00 0.43 0.00 0.00 52.55 53.41 2ce9 s ASP 644 Cb -0.05 -2.33 1.17 0.00 -0.30 0.00 0.00 42.92 41.42 2ce9 s ASP 644 CO -0.00 -0.58 1.92 -0.07 -0.17 0.00 0.00 175.17 176.27 2ce9 h LEU 645 N 9.35 0.00 0.00 -1.34 3.38 -1.40 0.16 115.31 125.46 2ce9 h LEU 645 Ca -0.26 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 2ce9 h LEU 645 Cb 1.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 2ce9 h LEU 645 CO 0.83 0.10 -0.33 0.08 0.09 0.00 0.00 178.44 179.22 2ce9 h ARG 646 N 0.00 0.00 -0.32 1.13 0.11 -1.93 -3.40 114.38 109.97 2ce9 h ARG 646 Ca -0.00 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.07 2ce9 h ARG 646 Cb 0.61 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.67 2ce9 h ARG 646 CO 0.01 0.26 0.15 0.93 0.10 0.00 0.00 179.97 181.42 2ce9 h GLU 647 N -1.00 0.46 0.00 0.08 5.08 -1.95 -3.47 114.58 113.78 2ce9 h GLU 647 Ca -0.04 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.25 2ce9 h GLU 647 Cb 0.47 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2ce9 h GLU 647 CO -0.03 0.44 0.00 0.41 -1.00 0.00 0.00 179.01 178.83 2ce9 n GLY 648 N -0.84 0.48 3.80 -3.84 0.00 0.55 -5.06 105.19 100.28 2ce9 n GLY 648 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2ce9 n GLY 648 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ce9 s ARG 649 N -0.98 4.21 0.32 1.61 6.06 -1.24 -4.82 118.95 124.11 2ce9 s ARG 649 Ca 0.00 0.71 -0.29 0.00 -2.50 0.00 0.00 55.73 53.65 2ce9 s ARG 649 Cb 0.00 -3.26 -0.10 0.00 0.06 0.00 0.00 34.95 31.64 2ce9 s ARG 649 CO 0.00 0.58 1.41 -1.14 -2.50 0.00 0.00 175.30 173.64 2ce9 s GLN 650 N -0.88 4.25 -0.03 5.12 0.74 -1.26 -1.31 119.66 126.30 2ce9 s GLN 650 Ca 0.29 2.36 -0.04 0.00 0.05 0.00 0.00 55.36 58.01 2ce9 s GLN 650 Cb -0.19 -3.05 -0.01 0.00 1.10 0.00 0.00 33.01 30.86 2ce9 s GLN 650 CO 0.18 -0.37 -0.09 1.28 -0.55 0.00 0.00 175.29 175.75 2ce9 n LEU 651 N 1.18 0.67 -4.66 3.68 4.77 0.14 -4.89 117.00 117.90 2ce9 n LEU 651 Ca 0.02 0.11 -0.23 0.00 -0.03 0.00 0.00 56.01 55.88 2ce9 n LEU 651 Cb 0.40 -0.41 -0.07 0.00 -2.33 0.00 0.00 43.42 41.01 2ce9 n LEU 651 CO 0.61 -0.49 -0.31 -1.10 -1.33 0.00 0.00 177.39 174.78 2ce9 s GLN 652 N -1.64 2.31 -0.05 3.23 -0.21 -1.19 -4.94 119.66 117.16 2ce9 s GLN 652 Ca -0.07 -1.45 -0.03 0.00 0.02 0.00 0.00 55.36 53.84 2ce9 s GLN 652 Cb 0.01 -2.16 0.03 0.00 1.00 0.00 0.00 33.01 31.89 2ce9 s GLN 652 CO 0.11 0.32 0.11 -1.14 -2.12 0.00 0.00 175.29 172.57 2ce9 s GLN 653 N -3.70 0.08 -0.13 2.91 0.74 -1.26 -1.56 119.66 116.73 2ce9 s GLN 653 Ca 0.32 0.26 0.01 0.00 0.05 0.00 0.00 55.36 56.00 2ce9 s GLN 653 Cb -0.06 -0.10 0.02 0.00 1.10 0.00 0.00 33.01 33.97 2ce9 s GLN 653 CO 0.20 -0.11 -0.15 -1.01 -0.55 0.00 0.00 175.29 173.68 2ce9 s HIS 654 N 0.74 2.11 -0.12 1.67 3.76 0.54 -4.98 115.29 119.02 2ce9 s HIS 654 Ca -0.06 -1.12 -0.10 0.00 -0.15 0.00 0.00 55.06 53.63 2ce9 s HIS 654 Cb -0.08 -1.54 -0.05 0.00 1.11 0.00 0.00 32.58 32.02 2ce9 s HIS 654 CO -0.03 -0.60 0.22 -0.51 -0.85 0.00 0.00 174.74 172.96 2ce9 s ASP 655 N 1.31 6.45 0.43 1.40 1.01 -1.26 -0.85 116.67 125.15 2ce9 s ASP 655 Ca 0.01 0.53 0.04 0.00 0.71 0.00 0.00 52.55 53.84 2ce9 s ASP 655 Cb -0.14 -2.13 -0.05 0.00 1.01 0.00 0.00 42.92 41.62 2ce9 s ASP 655 CO -0.07 0.30 0.03 -0.36 0.21 0.00 0.00 175.17 175.28 2ce9 s PHE 656 N -0.56 2.15 -1.63 4.23 0.08 0.19 -5.00 117.98 117.44 2ce9 s PHE 656 Ca 0.16 -0.87 0.20 0.00 0.12 0.00 0.00 56.93 56.54 2ce9 s PHE 656 Cb -0.13 -1.58 -0.05 0.00 -0.57 0.00 0.00 43.02 40.68 2ce9 s PHE 656 CO 0.05 0.23 0.96 0.25 -0.10 0.00 0.00 175.22 176.61 2ce9 n THR 657 N -1.02 0.00 -4.29 0.64 -2.24 -1.26 -4.85 114.28 101.27 2ce9 n THR 657 Ca -0.09 -0.23 -0.15 0.00 -2.27 0.00 0.00 64.05 61.30 2ce9 n THR 657 Cb 0.67 1.18 -0.10 0.00 -2.10 0.00 0.00 70.33 69.98 2ce9 n THR 657 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2ce9 s SER 658 N -2.39 1.11 0.52 3.42 1.04 -1.26 -5.06 113.70 111.08 2ce9 s SER 658 Ca 0.14 -1.32 -0.23 0.00 0.48 0.00 0.00 55.95 55.02 2ce9 s SER 658 Cb 0.16 0.17 -0.06 0.00 0.10 0.00 0.00 66.02 66.39 2ce9 s SER 658 CO 0.57 -0.69 1.36 0.00 0.98 0.00 0.00 173.24 175.46 2ce9 n GLN 659 N -0.38 1.80 -3.57 4.02 6.02 -1.26 -4.53 117.38 119.48 2ce9 n GLN 659 Ca -0.02 0.66 -0.36 0.00 -0.01 0.00 0.00 57.00 57.27 2ce9 n GLN 659 Cb 0.65 -2.57 -0.08 0.00 1.02 0.00 0.00 30.24 29.27 2ce9 n GLN 659 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2ce9 s ILE 660 N -1.27 5.32 -0.02 5.09 1.09 -0.95 -1.49 121.20 128.98 2ce9 s ILE 660 Ca 0.69 0.45 0.10 0.00 -1.10 0.00 0.00 60.65 60.79 2ce9 s ILE 660 Cb -0.43 -3.60 -0.15 0.00 -1.06 0.00 0.00 42.46 37.23 2ce9 s ILE 660 CO 0.51 0.37 0.20 0.49 -0.10 0.00 0.00 174.94 176.42 2ce9 n PHE 661 N 3.78 0.00 -3.50 3.97 3.72 -0.55 -4.24 117.46 120.64 2ce9 n PHE 661 Ca -0.13 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.15 2ce9 n PHE 661 Cb 0.52 -0.24 -0.04 0.00 -0.94 0.00 0.00 39.48 38.78 2ce9 n PHE 661 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2ce9 s SER 662 N -3.20 -0.50 0.07 4.37 1.04 -1.11 -4.65 113.70 109.72 2ce9 s SER 662 Ca -0.04 0.08 -0.21 0.00 0.48 0.00 0.00 55.95 56.26 2ce9 s SER 662 Cb 0.06 0.55 0.05 0.00 0.10 0.00 0.00 66.02 66.78 2ce9 s SER 662 CO 0.40 -0.86 0.50 -1.48 0.98 0.00 0.00 173.24 172.79 2ce9 s LEU 663 N -2.40 -0.03 -0.10 2.42 0.05 -1.26 -0.03 118.68 117.33 2ce9 s LEU 663 Ca -0.02 0.06 -0.13 0.00 0.05 0.00 0.00 54.13 54.09 2ce9 s LEU 663 Cb -0.00 2.12 0.03 0.00 -2.05 0.00 0.00 46.19 46.29 2ce9 s LEU 663 CO -0.08 -0.77 0.34 -0.83 -0.55 0.00 0.00 176.35 174.46 2ce9 s GLY 664 N -2.22 -0.24 -0.18 -3.48 0.00 0.29 -4.72 107.32 96.77 2ce9 s GLY 664 Ca -0.03 0.82 -0.08 0.00 0.00 0.00 0.00 44.72 45.43 2ce9 s GLY 664 CO -0.05 0.66 0.09 -0.47 0.00 0.00 0.00 173.10 173.33 2ce9 s TYR 665 N -0.22 3.33 0.01 1.90 5.04 -1.26 -0.69 117.35 125.45 2ce9 s TYR 665 Ca -0.04 0.20 -0.30 0.00 -2.44 0.00 0.00 57.07 54.49 2ce9 s TYR 665 Cb -0.03 -2.08 -0.07 0.00 0.35 0.00 0.00 41.96 40.13 2ce9 s TYR 665 CO 0.02 0.26 1.67 0.00 -1.34 0.00 0.00 175.55 176.16 2ce9 h PRO 667 N 9.04 0.00 -0.15 0.00 0.11 -1.88 0.32 132.00 139.44 2ce9 h PRO 667 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2ce9 h PRO 667 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2ce9 h PRO 667 CO 0.94 0.03 0.00 0.25 -0.21 0.00 0.00 178.00 179.01 2ce9 n THR 668 N -3.94 0.19 0.00 -1.15 -2.24 -1.26 -4.77 114.28 101.11 2ce9 n THR 668 Ca -0.03 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.38 2ce9 n THR 668 Cb 0.12 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 2ce9 n THR 668 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2ce9 n GLY 669 N 1.18 -0.15 4.01 3.38 0.00 0.11 -4.99 105.19 108.73 2ce9 n GLY 669 Ca 0.17 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.26 2ce9 n GLY 669 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2ce9 n GLU 670 N -0.33 0.00 -4.77 1.61 2.13 -1.26 -4.72 120.64 113.30 2ce9 n GLU 670 Ca 0.00 0.00 -0.25 0.00 0.66 0.00 0.00 57.16 57.57 2ce9 n GLU 670 Cb 0.00 -0.17 -0.16 0.00 0.27 0.00 0.00 31.44 31.38 2ce9 n GLU 670 CO 0.00 0.00 0.00 -1.58 -0.41 0.00 0.00 177.13 175.14 2ce9 s TRP 671 N -0.16 1.53 -0.19 4.31 0.52 -1.26 0.06 118.94 123.75 2ce9 s TRP 671 Ca 0.00 -0.37 0.01 0.00 0.02 0.00 0.00 56.10 55.76 2ce9 s TRP 671 Cb 0.00 -1.01 0.04 0.00 -1.15 0.00 0.00 33.47 31.34 2ce9 s TRP 671 CO 0.00 -0.09 -0.13 -1.17 0.02 0.00 0.00 176.95 175.57 2ce9 s LEU 672 N -0.14 2.24 0.18 2.99 2.96 -0.17 -1.29 118.68 125.45 2ce9 s LEU 672 Ca 0.01 -0.80 -0.23 0.00 -0.22 0.00 0.00 54.13 52.89 2ce9 s LEU 672 Cb -0.09 -1.30 -0.08 0.00 0.50 0.00 0.00 46.19 45.22 2ce9 s LEU 672 CO 0.01 -0.10 0.74 0.00 -1.32 0.00 0.00 176.35 175.68 2ce9 s ALA 673 N 1.36 3.45 -0.05 5.97 0.00 0.13 -0.75 121.76 131.86 2ce9 s ALA 673 Ca 0.01 0.27 -0.00 0.00 0.00 0.00 0.00 51.96 52.24 2ce9 s ALA 673 Cb -0.15 -2.89 0.03 0.00 0.00 0.00 0.00 23.12 20.11 2ce9 s ALA 673 CO -0.09 0.31 -0.02 0.08 0.00 0.00 0.00 175.76 176.04 2ce9 s VAL 674 N -1.27 0.39 -0.22 0.00 1.01 0.21 -0.55 120.40 119.97 2ce9 s VAL 674 Ca 0.37 0.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.29 2ce9 s VAL 674 Cb -0.21 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2ce9 s VAL 674 CO 0.24 0.22 0.11 -0.83 0.00 0.00 0.00 175.10 174.84 2ce9 s GLY 675 N 1.38 1.91 0.22 4.51 0.00 0.96 -1.36 107.32 114.94 2ce9 s GLY 675 Ca -0.04 -0.89 0.10 0.00 0.00 0.00 0.00 44.72 43.88 2ce9 s GLY 675 CO -0.02 0.31 -0.10 -3.16 0.00 0.00 0.00 173.10 170.12 2ce9 s MET 676 N 0.95 2.01 0.44 2.90 0.23 -0.72 -1.48 119.30 123.62 2ce9 s MET 676 Ca 0.06 -1.42 0.21 0.00 -1.03 0.00 0.00 55.69 53.50 2ce9 s MET 676 Cb -0.14 -2.06 1.17 0.00 -1.53 0.00 0.00 34.83 32.28 2ce9 s MET 676 CO 0.03 0.39 1.84 1.49 -2.03 0.00 0.00 175.02 176.74 2ce9 h GLU 677 N 2.54 0.31 0.00 3.16 4.22 -1.54 -0.26 114.58 123.02 2ce9 h GLU 677 Ca -0.45 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 58.97 2ce9 h GLU 677 Cb 1.23 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2ce9 h GLU 677 CO 0.56 0.20 0.00 -1.13 -2.18 0.00 0.00 179.01 176.47 2ce9 n SER 678 N -4.48 0.65 0.00 1.04 3.41 -1.26 -3.67 113.62 109.31 2ce9 n SER 678 Ca 0.21 0.67 0.00 0.00 -0.26 0.00 0.00 58.87 59.48 2ce9 n SER 678 Cb 0.81 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2ce9 n SER 678 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ce9 n SER 679 N -2.22 0.00 -4.75 4.04 3.41 -0.55 -4.87 113.62 108.67 2ce9 n SER 679 Ca 0.02 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.27 2ce9 n SER 679 Cb 0.22 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.20 2ce9 n SER 679 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2ce9 s ASN 680 N -1.45 5.22 -0.15 4.04 0.02 -1.26 -4.29 114.94 117.06 2ce9 s ASN 680 Ca 0.00 2.39 -0.04 0.00 -1.02 0.00 0.00 52.86 54.19 2ce9 s ASN 680 Cb 0.00 -2.60 -0.03 0.00 0.02 0.00 0.00 41.25 38.64 2ce9 s ASN 680 CO 0.00 -1.57 -0.03 -0.69 0.02 0.00 0.00 177.10 174.82 2ce9 s VAL 681 N -1.59 3.94 -0.10 1.60 1.01 -0.92 -1.76 120.40 122.59 2ce9 s VAL 681 Ca 0.77 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.43 2ce9 s VAL 681 Cb -0.30 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2ce9 s VAL 681 CO 0.33 0.50 -0.18 -1.61 0.00 0.00 0.00 175.10 174.14 2ce9 s GLU 682 N 0.32 3.02 -0.32 2.72 2.02 -0.47 -0.39 118.70 125.60 2ce9 s GLU 682 Ca -0.03 -0.77 -0.03 0.00 0.02 0.00 0.00 54.97 54.15 2ce9 s GLU 682 Cb -0.14 -2.43 0.05 0.00 0.10 0.00 0.00 34.13 31.71 2ce9 s GLU 682 CO 0.03 0.30 0.05 0.08 0.02 0.00 0.00 175.26 175.74 2ce9 s VAL 683 N 0.08 3.26 0.05 2.63 1.01 -0.23 -0.62 120.40 126.58 2ce9 s VAL 683 Ca -0.08 -1.34 -0.18 0.00 0.00 0.00 0.00 61.98 60.38 2ce9 s VAL 683 Cb -0.15 -2.89 -0.06 0.00 0.00 0.00 0.00 36.38 33.28 2ce9 s VAL 683 CO 0.05 -0.17 0.51 -0.76 0.00 0.00 0.00 175.10 174.74 2ce9 s LEU 684 N 1.29 4.51 -0.46 3.92 1.43 0.07 -0.80 118.68 128.64 2ce9 s LEU 684 Ca -0.03 1.16 -0.25 0.00 -1.03 0.00 0.00 54.13 53.98 2ce9 s LEU 684 Cb -0.20 -2.79 0.03 0.00 0.03 0.00 0.00 46.19 43.26 2ce9 s LEU 684 CO -0.00 0.29 0.88 -2.28 0.23 0.00 0.00 176.35 175.47 2ce9 s HIS 685 N -1.10 2.94 0.05 0.29 5.65 -0.86 -1.00 115.29 121.26 2ce9 s HIS 685 Ca 0.27 0.29 -0.32 0.00 0.25 0.00 0.00 55.06 55.55 2ce9 s HIS 685 Cb -0.18 -3.88 -0.11 0.00 -1.18 0.00 0.00 32.58 27.23 2ce9 s HIS 685 CO 0.17 -1.08 1.85 0.28 -0.65 0.00 0.00 174.74 175.32 2ce9 n VAL 686 N 6.32 0.48 -0.95 0.89 0.31 0.11 -1.53 118.33 123.96 2ce9 n VAL 686 Ca 0.05 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 2ce9 n VAL 686 Cb 0.48 -2.03 0.00 0.00 -0.91 0.00 0.00 33.84 31.38 2ce9 n VAL 686 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2ce9 n ASN 687 N 6.11 -2.58 -4.35 4.52 4.13 -1.26 -4.95 115.26 116.88 2ce9 n ASN 687 Ca 0.20 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 56.24 2ce9 n ASN 687 Cb 0.35 -1.21 -0.11 0.00 -1.54 0.00 0.00 39.78 37.27 2ce9 n ASN 687 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2ce9 s LYS 688 N -0.51 1.33 -0.00 3.52 1.02 -0.58 -5.08 119.74 119.43 2ce9 s LYS 688 Ca 0.00 -1.46 0.12 0.00 0.02 0.00 0.00 55.97 54.65 2ce9 s LYS 688 Cb 0.00 -1.37 0.36 0.00 -0.52 0.00 0.00 37.83 36.30 2ce9 s LYS 688 CO 0.00 0.27 1.29 -0.35 -0.92 0.00 0.00 175.35 175.65 2ce9 n PRO 689 N 0.15 1.96 -4.00 -1.68 -0.04 -1.26 -4.55 135.00 125.58 2ce9 n PRO 689 Ca -0.12 -1.45 -0.22 0.00 -0.04 0.00 0.00 63.50 61.67 2ce9 n PRO 689 Cb 0.58 -1.33 -0.04 0.00 -0.04 0.00 0.00 33.50 32.67 2ce9 n PRO 689 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 2ce9 s ASP 690 N -0.99 5.33 0.23 3.54 -4.77 -1.26 -3.99 116.67 114.77 2ce9 s ASP 690 Ca 0.27 -0.40 -0.19 0.00 -3.30 0.00 0.00 52.55 48.93 2ce9 s ASP 690 Cb 0.14 -1.17 0.03 0.00 -1.09 0.00 0.00 42.92 40.83 2ce9 s ASP 690 CO 0.18 -0.18 0.61 -1.59 0.70 0.00 0.00 175.17 174.89 2ce9 s LYS 691 N -3.90 1.55 0.01 2.11 -2.85 -0.13 -2.03 119.74 114.50 2ce9 s LYS 691 Ca 0.36 -0.91 0.00 0.00 -1.00 0.00 0.00 55.97 54.43 2ce9 s LYS 691 Cb -0.07 0.56 -0.04 0.00 -2.06 0.00 0.00 37.83 36.23 2ce9 s LYS 691 CO 0.25 -0.68 0.07 0.71 0.10 0.00 0.00 175.35 175.80 2ce9 s TYR 692 N -3.89 3.26 -0.13 1.78 2.02 0.02 0.14 117.35 120.54 2ce9 s TYR 692 Ca 0.10 0.18 0.03 0.00 -0.37 0.00 0.00 57.07 57.01 2ce9 s TYR 692 Cb -0.03 -1.72 0.01 0.00 -0.40 0.00 0.00 41.96 39.82 2ce9 s TYR 692 CO 0.01 0.54 -0.22 -0.65 -1.57 0.00 0.00 175.55 173.66 2ce9 s GLN 693 N -1.79 2.94 -0.08 -0.62 -0.21 -0.16 -1.07 119.66 118.66 2ce9 s GLN 693 Ca 0.23 -0.83 0.03 0.00 0.02 0.00 0.00 55.36 54.81 2ce9 s GLN 693 Cb -0.12 -2.35 -0.02 0.00 1.00 0.00 0.00 33.01 31.52 2ce9 s GLN 693 CO 0.14 0.02 -0.16 -0.51 -2.12 0.00 0.00 175.29 172.66 2ce9 s LEU 694 N 0.74 2.60 -0.53 2.90 1.43 0.48 -1.45 118.68 124.85 2ce9 s LEU 694 Ca -0.09 -0.31 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 2ce9 s LEU 694 Cb -0.16 -1.54 0.17 0.00 0.03 0.00 0.00 46.19 44.69 2ce9 s LEU 694 CO 0.00 0.26 0.41 1.41 0.23 0.00 0.00 176.35 178.66 2ce9 n HIS 695 N 2.90 0.79 -0.72 0.29 8.25 -0.01 -2.15 115.22 124.57 2ce9 n HIS 695 Ca -0.18 -3.72 0.01 0.00 -0.26 0.00 0.00 57.72 53.58 2ce9 n HIS 695 Cb 0.52 -0.10 0.01 0.00 1.12 0.00 0.00 29.99 31.54 2ce9 n HIS 695 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2ce9 n LEU 696 N 2.45 1.03 -4.63 2.41 4.77 -1.26 -4.83 117.00 116.94 2ce9 n LEU 696 Ca 0.26 -1.21 -0.31 0.00 -0.03 0.00 0.00 56.01 54.71 2ce9 n LEU 696 Cb 0.43 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.38 2ce9 n LEU 696 CO 0.16 0.30 -0.36 -1.00 -1.33 0.00 0.00 177.39 175.15 2ce9 s HIS 697 N -0.69 2.93 -1.12 -1.77 3.76 -1.26 -5.00 115.29 112.14 2ce9 s HIS 697 Ca 0.03 -0.03 0.20 0.00 -0.15 0.00 0.00 55.06 55.12 2ce9 s HIS 697 Cb 0.03 -1.58 -0.18 0.00 1.11 0.00 0.00 32.58 31.96 2ce9 s HIS 697 CO 0.00 0.42 0.88 0.39 -0.85 0.00 0.00 174.74 175.58 2ce9 n GLU 698 N 1.18 0.61 -3.52 1.40 1.02 -1.26 -4.83 120.64 115.25 2ce9 n GLU 698 Ca -0.14 -0.18 -0.13 0.00 -0.02 0.00 0.00 57.16 56.69 2ce9 n GLU 698 Cb 0.52 -1.44 -0.04 0.00 -0.02 0.00 0.00 31.44 30.46 2ce9 n GLU 698 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2ce9 n SER 699 N -1.20 -0.68 -3.61 1.62 2.88 -1.26 -4.96 113.62 106.41 2ce9 n SER 699 Ca 0.05 -2.52 -0.45 0.00 -1.33 0.00 0.00 58.87 54.62 2ce9 n SER 699 Cb 0.33 1.44 -0.05 0.00 -0.75 0.00 0.00 64.21 65.18 2ce9 n SER 699 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ce9 s VAL 701 N -0.21 4.42 0.08 0.00 1.01 -0.22 -2.03 120.40 123.46 2ce9 s VAL 701 Ca 0.68 -0.33 -0.08 0.00 0.00 0.00 0.00 61.98 62.25 2ce9 s VAL 701 Cb -0.95 -4.61 -0.26 0.00 0.00 0.00 0.00 36.38 30.55 2ce9 s VAL 701 CO 0.46 -1.32 1.17 -0.07 0.00 0.00 0.00 175.10 175.33 2ce9 h LEU 702 N 11.04 0.63 -8.22 3.92 3.38 -1.10 -3.38 115.31 121.58 2ce9 h LEU 702 Ca -0.28 -0.59 -0.11 0.00 0.09 0.00 0.00 57.88 56.99 2ce9 h LEU 702 Cb 1.07 -0.20 -0.12 0.00 0.09 0.00 0.00 40.66 41.51 2ce9 h LEU 702 CO 1.14 1.42 -0.29 -0.94 0.09 0.00 0.00 178.44 179.87 2ce9 s SER 703 N -7.25 0.00 -0.07 -0.43 1.04 -1.20 -4.44 113.70 101.35 2ce9 s SER 703 Ca -0.06 -0.98 -0.31 0.00 0.48 0.00 0.00 55.95 55.08 2ce9 s SER 703 Cb 0.07 0.49 0.07 0.00 0.10 0.00 0.00 66.02 66.75 2ce9 s SER 703 CO 0.90 -0.98 0.70 -0.22 0.98 0.00 0.00 173.24 174.62 2ce9 s LEU 704 N -3.02 -0.65 -0.19 2.42 0.20 -1.26 -0.85 118.68 115.34 2ce9 s LEU 704 Ca 0.23 0.73 -0.11 0.00 0.69 0.00 0.00 54.13 55.67 2ce9 s LEU 704 Cb 0.02 2.50 0.06 0.00 -0.43 0.00 0.00 46.19 48.34 2ce9 s LEU 704 CO 0.05 -0.58 0.45 -0.75 -0.29 0.00 0.00 176.35 175.24 2ce9 s LYS 705 N -1.12 0.45 0.37 1.98 2.47 -0.22 -4.77 119.74 118.91 2ce9 s LYS 705 Ca -0.10 0.84 -0.26 0.00 -1.56 0.00 0.00 55.97 54.89 2ce9 s LYS 705 Cb -0.00 0.02 -0.09 0.00 -1.46 0.00 0.00 37.83 36.30 2ce9 s LYS 705 CO 0.09 -0.15 1.13 -0.06 0.16 0.00 0.00 175.35 176.53 2ce9 s PHE 706 N 1.34 3.23 0.55 4.03 0.08 -1.26 -0.91 117.98 125.03 2ce9 s PHE 706 Ca -0.09 1.60 -0.21 0.00 0.12 0.00 0.00 56.93 58.35 2ce9 s PHE 706 Cb -0.07 -3.33 -0.05 0.00 -0.57 0.00 0.00 43.02 39.00 2ce9 s PHE 706 CO -0.13 -1.02 1.33 0.00 -0.10 0.00 0.00 175.22 175.30 2ce9 n ALA 707 N 0.34 1.45 0.26 5.36 0.00 -0.36 -4.84 120.51 122.72 2ce9 n ALA 707 Ca 0.03 0.11 0.09 0.00 0.00 0.00 0.00 53.44 53.68 2ce9 n ALA 707 Cb 0.46 -2.34 0.68 0.00 0.00 0.00 0.00 19.45 18.26 2ce9 n ALA 707 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2ce9 h TYR 708 N 1.31 0.00 0.00 0.00 0.05 -1.85 -0.79 116.97 115.69 2ce9 h TYR 708 Ca -0.51 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.27 2ce9 h TYR 708 Cb 1.31 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.05 2ce9 h TYR 708 CO 0.45 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.56 2ce9 n GLY 710 N 0.75 2.24 0.06 0.00 0.00 -0.30 -4.75 105.19 103.18 2ce9 n GLY 710 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2ce9 n GLY 710 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ce9 n LYS 711 N -2.00 0.15 -3.88 1.61 5.02 -1.26 -4.68 118.16 113.11 2ce9 n LYS 711 Ca 0.00 0.11 -0.09 0.00 -2.02 0.00 0.00 58.31 56.31 2ce9 n LYS 711 Cb 0.00 -1.66 -0.05 0.00 -0.02 0.00 0.00 35.03 33.30 2ce9 n LYS 711 CO 0.00 0.00 0.00 1.67 -0.52 0.00 0.00 177.40 178.55 2ce9 s TRP 712 N -3.06 0.16 0.19 2.13 1.48 -1.26 -1.32 118.94 117.26 2ce9 s TRP 712 Ca 0.12 -0.52 -0.15 0.00 -1.06 0.00 0.00 56.10 54.49 2ce9 s TRP 712 Cb 0.15 0.23 0.01 0.00 -1.16 0.00 0.00 33.47 32.70 2ce9 s TRP 712 CO 0.58 -0.90 0.45 -0.59 -4.06 0.00 0.00 176.95 172.43 2ce9 s PHE 713 N -3.94 0.08 0.15 1.66 -0.12 -0.41 -1.22 117.98 114.17 2ce9 s PHE 713 Ca 0.15 -0.43 0.10 0.00 -0.05 0.00 0.00 56.93 56.71 2ce9 s PHE 713 Cb -0.00 0.25 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 2ce9 s PHE 713 CO 0.02 -0.87 -0.24 0.14 -0.05 0.00 0.00 175.22 174.22 2ce9 s VAL 714 N -3.92 2.13 0.10 -2.49 -7.23 -0.09 -0.02 120.40 108.89 2ce9 s VAL 714 Ca 0.13 -1.83 0.04 0.00 -1.81 0.00 0.00 61.98 58.51 2ce9 s VAL 714 Cb 0.00 -1.94 -0.04 0.00 0.56 0.00 0.00 36.38 34.97 2ce9 s VAL 714 CO -0.01 -0.06 -0.10 -0.94 -0.31 0.00 0.00 175.10 173.68 2ce9 s SER 715 N -2.31 1.55 0.05 4.85 1.04 -0.31 -1.05 113.70 117.51 2ce9 s SER 715 Ca 0.15 -0.84 0.05 0.00 0.48 0.00 0.00 55.95 55.79 2ce9 s SER 715 Cb -0.09 -0.00 -0.02 0.00 0.10 0.00 0.00 66.02 66.01 2ce9 s SER 715 CO 0.07 -0.26 -0.13 0.42 0.98 0.00 0.00 173.24 174.32 2ce9 s THR 716 N -2.52 1.04 0.14 2.02 -4.23 -0.03 -1.58 115.64 110.48 2ce9 s THR 716 Ca 0.07 -1.06 0.08 0.00 -1.18 0.00 0.00 61.69 59.61 2ce9 s THR 716 Cb -0.02 -0.97 -0.04 0.00 1.34 0.00 0.00 72.50 72.81 2ce9 s THR 716 CO 0.00 -0.08 -0.19 -0.83 -0.54 0.00 0.00 174.62 172.98 2ce9 s GLY 717 N -1.29 1.33 0.61 3.99 0.00 -0.45 -0.57 107.32 110.95 2ce9 s GLY 717 Ca -0.00 -1.39 0.38 0.00 0.00 0.00 0.00 44.72 43.70 2ce9 s GLY 717 CO 0.01 -1.42 2.15 1.70 0.00 0.00 0.00 173.10 175.54 2ce9 h LYS 718 N 3.59 0.00 -0.08 2.90 3.64 -1.62 0.15 116.57 125.14 2ce9 h LYS 718 Ca -0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2ce9 h LYS 718 Cb 1.20 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2ce9 h LYS 718 CO 0.46 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.24 2ce9 n ASP 719 N -2.90 0.55 0.00 4.20 5.75 -1.26 -4.44 116.55 118.45 2ce9 n ASP 719 Ca -0.03 -1.81 0.00 0.00 -0.01 0.00 0.00 54.79 52.95 2ce9 n ASP 719 Cb 0.15 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.18 2ce9 n ASP 719 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2ce9 n ASN 720 N -0.29 -1.59 -4.85 -1.12 4.13 -0.90 -4.94 115.26 105.71 2ce9 n ASN 720 Ca 0.08 0.00 -0.37 0.00 1.68 0.00 0.00 54.58 55.97 2ce9 n ASN 720 Cb 0.11 -0.26 -0.06 0.00 -1.54 0.00 0.00 39.78 38.02 2ce9 n ASN 720 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2ce9 s LEU 721 N 0.00 4.35 -0.26 3.41 1.43 -1.26 0.12 118.68 126.48 2ce9 s LEU 721 Ca 0.00 0.44 -0.08 0.00 -1.03 0.00 0.00 54.13 53.46 2ce9 s LEU 721 Cb 0.00 -2.10 -0.03 0.00 0.03 0.00 0.00 46.19 44.09 2ce9 s LEU 721 CO 0.00 0.36 0.10 -0.22 0.23 0.00 0.00 176.35 176.81 2ce9 s LEU 722 N -0.73 3.59 -0.06 1.79 2.96 -0.57 -1.34 118.68 124.32 2ce9 s LEU 722 Ca 0.14 -0.19 0.05 0.00 -0.22 0.00 0.00 54.13 53.91 2ce9 s LEU 722 Cb -0.12 -1.96 -0.02 0.00 0.50 0.00 0.00 46.19 44.59 2ce9 s LEU 722 CO 0.03 -0.05 -0.21 0.20 -1.32 0.00 0.00 176.35 175.00 2ce9 s ASN 723 N 1.64 3.42 -0.06 3.68 0.01 -0.62 -0.92 114.94 122.09 2ce9 s ASN 723 Ca 0.06 -0.40 -0.01 0.00 -0.71 0.00 0.00 52.86 51.80 2ce9 s ASN 723 Cb -0.15 -0.85 -0.03 0.00 0.41 0.00 0.00 41.25 40.62 2ce9 s ASN 723 CO 0.05 0.27 -0.00 0.00 -1.51 0.00 0.00 177.10 175.91 2ce9 s ALA 724 N -0.32 3.26 -0.00 0.60 0.00 -0.48 -1.16 121.76 123.66 2ce9 s ALA 724 Ca 0.02 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.14 2ce9 s ALA 724 Cb -0.13 -1.43 -0.00 0.00 0.00 0.00 0.00 23.12 21.57 2ce9 s ALA 724 CO 0.02 0.60 -0.04 -1.58 0.00 0.00 0.00 175.76 174.77 2ce9 s TRP 725 N -0.93 0.35 0.16 0.00 0.52 0.96 -1.61 118.94 118.39 2ce9 s TRP 725 Ca 0.15 -0.06 -0.30 0.00 0.02 0.00 0.00 56.10 55.90 2ce9 s TRP 725 Cb -0.11 -0.23 -0.07 0.00 -1.15 0.00 0.00 33.47 31.90 2ce9 s TRP 725 CO 0.04 -0.01 1.11 0.50 0.02 0.00 0.00 176.95 178.61 2ce9 s ARG 726 N -0.05 4.57 0.08 4.98 6.06 -0.17 -1.29 118.95 133.14 2ce9 s ARG 726 Ca 0.01 1.71 -0.29 0.00 -2.50 0.00 0.00 55.73 54.66 2ce9 s ARG 726 Cb -0.02 -3.29 -0.05 0.00 0.06 0.00 0.00 34.95 31.64 2ce9 s ARG 726 CO -0.00 0.03 0.91 0.99 -2.50 0.00 0.00 175.30 174.73 2ce9 s THR 727 N -0.03 4.62 -0.47 4.11 2.01 -0.44 0.60 115.64 126.04 2ce9 s THR 727 Ca 0.51 1.94 0.23 0.00 0.31 0.00 0.00 61.69 64.68 2ce9 s THR 727 Cb -0.29 -4.26 -0.13 0.00 0.01 0.00 0.00 72.50 67.82 2ce9 s THR 727 CO 0.34 0.31 0.94 -0.81 -0.69 0.00 0.00 174.62 174.71 2ce9 n PRO 728 N 2.95 0.39 0.00 4.92 -0.04 -1.26 -4.85 135.00 137.10 2ce9 n PRO 728 Ca 0.01 -0.01 0.14 0.00 -0.04 0.00 0.00 63.50 63.60 2ce9 n PRO 728 Cb 0.50 -1.62 0.56 0.00 -0.04 0.00 0.00 33.50 32.90 2ce9 n PRO 728 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2ce9 n TYR 729 N -2.11 0.00 -2.64 0.54 4.11 -1.18 -4.84 117.16 111.04 2ce9 n TYR 729 Ca 0.01 0.00 -0.10 0.00 -0.00 0.00 0.00 57.90 57.81 2ce9 n TYR 729 Cb 0.47 -0.07 0.02 0.00 -0.00 0.00 0.00 39.34 39.76 2ce9 n TYR 729 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2ce9 n GLY 730 N 1.22 0.17 3.73 -7.48 0.00 0.20 -4.74 105.19 98.29 2ce9 n GLY 730 Ca 0.17 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2ce9 n GLY 730 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ce9 n ALA 731 N -2.70 1.97 -2.57 4.61 0.00 -1.26 -4.59 120.51 115.97 2ce9 n ALA 731 Ca -0.04 0.37 -0.42 0.00 0.00 0.00 0.00 53.44 53.35 2ce9 n ALA 731 Cb 0.55 -2.37 -0.03 0.00 0.00 0.00 0.00 19.45 17.60 2ce9 n ALA 731 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2ce9 s SER 732 N 0.14 6.31 0.15 0.00 0.15 -1.26 -0.99 113.70 118.19 2ce9 s SER 732 Ca 0.60 -0.17 -0.09 0.00 0.70 0.00 0.00 55.95 56.99 2ce9 s SER 732 Cb -0.54 -2.55 -0.01 0.00 -1.71 0.00 0.00 66.02 61.21 2ce9 s SER 732 CO 0.55 -1.64 1.46 0.40 1.20 0.00 0.00 173.24 175.21 2ce9 h ILE 733 N 6.09 1.28 -2.52 6.45 2.04 -1.64 -3.48 117.51 125.74 2ce9 h ILE 733 Ca -0.26 -1.69 0.06 0.00 1.00 0.00 0.00 64.86 63.97 2ce9 h ILE 733 Cb 1.05 1.59 -0.14 0.00 -0.74 0.00 0.00 36.82 38.58 2ce9 h ILE 733 CO 1.23 0.55 0.39 0.72 0.00 0.00 0.00 178.15 181.04 2ce9 s PHE 734 N -4.18 -0.42 0.00 1.37 -0.12 -1.24 -4.92 117.98 108.48 2ce9 s PHE 734 Ca -0.10 0.27 0.02 0.00 -0.05 0.00 0.00 56.93 57.08 2ce9 s PHE 734 Cb 0.11 0.54 -0.01 0.00 -0.63 0.00 0.00 43.02 43.03 2ce9 s PHE 734 CO 0.87 -0.65 -0.07 -0.65 -0.05 0.00 0.00 175.22 174.67 2ce9 s GLN 735 N -3.29 0.54 -0.07 1.99 -0.21 -1.26 -1.38 119.66 115.97 2ce9 s GLN 735 Ca 0.03 -0.32 0.00 0.00 0.02 0.00 0.00 55.36 55.09 2ce9 s GLN 735 Cb -0.01 -0.49 0.02 0.00 1.00 0.00 0.00 33.01 33.53 2ce9 s GLN 735 CO -0.10 0.13 -0.05 0.45 -2.12 0.00 0.00 175.29 173.60 2ce9 s SER 736 N -0.39 1.53 -0.31 5.90 0.15 -0.10 -5.00 113.70 115.48 2ce9 s SER 736 Ca 0.01 -0.18 -0.13 0.00 0.70 0.00 0.00 55.95 56.35 2ce9 s SER 736 Cb -0.04 -0.59 -0.03 0.00 -1.71 0.00 0.00 66.02 63.65 2ce9 s SER 736 CO -0.00 -0.10 0.27 -0.75 1.20 0.00 0.00 173.24 173.86 2ce9 s LYS 737 N 1.37 3.72 0.74 5.44 2.47 -1.26 -1.52 119.74 130.70 2ce9 s LYS 737 Ca -0.03 -0.40 -0.01 0.00 -1.56 0.00 0.00 55.97 53.97 2ce9 s LYS 737 Cb -0.13 -3.74 0.14 0.00 -1.46 0.00 0.00 37.83 32.63 2ce9 s LYS 737 CO -0.03 -0.36 1.02 -1.21 0.16 0.00 0.00 175.35 174.93 2ce9 s GLU 738 N 1.85 1.55 0.35 4.03 2.02 0.12 -5.00 118.70 123.62 2ce9 s GLU 738 Ca 0.09 -1.18 0.25 0.00 0.02 0.00 0.00 54.97 54.15 2ce9 s GLU 738 Cb -0.17 -2.31 0.65 0.00 0.10 0.00 0.00 34.13 32.40 2ce9 s GLU 738 CO 0.11 -1.55 1.71 0.66 0.02 0.00 0.00 175.26 176.21 2ce9 h SER 739 N -0.60 0.00 -3.72 -0.19 4.64 -1.97 -3.47 113.55 108.24 2ce9 h SER 739 Ca -0.35 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.71 2ce9 h SER 739 Cb 1.26 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.29 2ce9 h SER 739 CO 0.38 0.00 -0.14 -0.24 -0.87 0.00 0.00 176.83 175.96 2ce9 n SER 740 N -2.72 -1.14 -4.64 4.97 2.88 -1.26 -4.96 113.62 106.74 2ce9 n SER 740 Ca 0.04 -2.65 -0.42 0.00 -1.33 0.00 0.00 58.87 54.51 2ce9 n SER 740 Cb 0.45 2.15 0.01 0.00 -0.75 0.00 0.00 64.21 66.07 2ce9 n SER 740 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2ce9 n SER 741 N -1.71 1.80 -4.16 -3.46 2.88 -1.26 -4.08 113.62 103.63 2ce9 n SER 741 Ca 0.01 1.10 -0.37 0.00 -1.33 0.00 0.00 58.87 58.28 2ce9 n SER 741 Cb 0.51 -1.40 -0.12 0.00 -0.75 0.00 0.00 64.21 62.45 2ce9 n SER 741 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2ce9 s VAL 742 N -1.20 3.39 -0.14 2.46 1.01 -0.01 -0.52 120.40 125.38 2ce9 s VAL 742 Ca 0.61 -1.75 0.17 0.00 0.00 0.00 0.00 61.98 61.01 2ce9 s VAL 742 Cb -0.56 -3.18 -0.10 0.00 0.00 0.00 0.00 36.38 32.54 2ce9 s VAL 742 CO 0.58 -0.50 0.90 -0.07 0.00 0.00 0.00 175.10 176.01 2ce9 h LEU 743 N 8.10 0.00 -7.61 3.92 4.07 -1.44 -3.26 115.31 119.09 2ce9 h LEU 743 Ca -0.17 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.76 2ce9 h LEU 743 Cb 1.06 0.00 -0.11 0.00 1.08 0.00 0.00 40.66 42.69 2ce9 h LEU 743 CO 0.66 0.49 0.00 -0.94 -1.08 0.00 0.00 178.44 177.58 2ce9 s SER 744 N -5.77 -0.25 0.10 -0.43 1.04 -1.22 -4.38 113.70 102.79 2ce9 s SER 744 Ca -0.02 -0.45 -0.25 0.00 0.48 0.00 0.00 55.95 55.71 2ce9 s SER 744 Cb 0.09 0.55 0.08 0.00 0.10 0.00 0.00 66.02 66.84 2ce9 s SER 744 CO 0.80 -1.01 0.67 0.00 0.98 0.00 0.00 173.24 174.69 2ce9 s ASP 746 N -2.50 0.06 -0.04 0.00 2.15 0.43 -4.75 116.67 112.02 2ce9 s ASP 746 Ca 0.00 -0.54 0.07 0.00 0.43 0.00 0.00 52.55 52.51 2ce9 s ASP 746 Cb -0.01 0.34 -0.01 0.00 -0.30 0.00 0.00 42.92 42.94 2ce9 s ASP 746 CO -0.10 -0.69 -0.24 -0.63 -0.17 0.00 0.00 175.17 173.34 2ce9 s ILE 747 N -3.49 1.97 0.64 4.11 1.01 -1.26 -0.92 121.20 123.25 2ce9 s ILE 747 Ca 0.02 -1.04 -0.15 0.00 0.00 0.00 0.00 60.65 59.48 2ce9 s ILE 747 Cb 0.03 -1.66 -0.01 0.00 0.01 0.00 0.00 42.46 40.83 2ce9 s ILE 747 CO -0.09 0.55 1.08 -0.94 0.00 0.00 0.00 174.94 175.54 2ce9 s SER 748 N -0.31 5.45 0.50 3.58 1.04 -0.67 -4.92 113.70 118.38 2ce9 s SER 748 Ca 0.01 1.85 0.24 0.00 0.48 0.00 0.00 55.95 58.54 2ce9 s SER 748 Cb -0.12 -2.53 1.35 0.00 0.10 0.00 0.00 66.02 64.81 2ce9 s SER 748 CO 0.02 -1.40 2.05 -0.37 0.98 0.00 0.00 173.24 174.52 2ce9 h VAL 749 N 0.09 0.70 -0.02 5.02 -1.51 -1.91 -0.16 116.25 118.46 2ce9 h VAL 749 Ca -0.46 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 64.44 2ce9 h VAL 749 Cb 1.23 1.35 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 2ce9 h VAL 749 CO 0.56 0.14 0.00 -0.90 -1.23 0.00 0.00 177.57 176.13 2ce9 n ASP 750 N -3.79 0.84 -0.94 4.19 5.68 -1.26 -4.75 116.55 116.52 2ce9 n ASP 750 Ca -0.02 -1.31 -0.12 0.00 -0.50 0.00 0.00 54.79 52.84 2ce9 n ASP 750 Cb 0.24 -0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 40.16 2ce9 n ASP 750 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2ce9 n ASP 751 N -0.33 -5.55 0.13 -1.12 8.00 -0.07 -4.86 116.55 112.74 2ce9 n ASP 751 Ca 0.21 0.30 0.12 0.00 0.71 0.00 0.00 54.79 56.12 2ce9 n ASP 751 Cb 0.24 -4.13 0.05 0.00 -0.02 0.00 0.00 41.12 37.26 2ce9 n ASP 751 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 2ce9 h LYS 752 N 0.02 0.00 -4.48 -1.24 1.57 -1.92 -3.44 116.57 107.09 2ce9 h LYS 752 Ca -0.25 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.23 2ce9 h LYS 752 Cb 1.16 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 33.22 2ce9 h LYS 752 CO 0.37 0.00 -0.74 0.71 -0.57 0.00 0.00 179.45 179.21 2ce9 s TYR 753 N -3.32 0.60 -0.07 -1.35 2.02 -1.26 -0.59 117.35 113.38 2ce9 s TYR 753 Ca 0.02 -0.31 0.05 0.00 -0.37 0.00 0.00 57.07 56.45 2ce9 s TYR 753 Cb 0.09 -0.37 -0.00 0.00 -0.40 0.00 0.00 41.96 41.27 2ce9 s TYR 753 CO 0.76 -0.05 -0.22 0.42 -1.57 0.00 0.00 175.55 174.89 2ce9 s ILE 754 N -0.81 1.85 -0.06 2.71 1.01 -0.37 -1.67 121.20 123.85 2ce9 s ILE 754 Ca -0.04 -0.93 0.06 0.00 0.00 0.00 0.00 60.65 59.73 2ce9 s ILE 754 Cb -0.06 -1.58 -0.01 0.00 0.01 0.00 0.00 42.46 40.81 2ce9 s ILE 754 CO 0.00 0.52 -0.25 -0.69 0.00 0.00 0.00 174.94 174.52 2ce9 s VAL 755 N 0.09 2.09 0.07 2.92 1.01 -0.10 0.14 120.40 126.62 2ce9 s VAL 755 Ca -0.09 -1.05 0.09 0.00 0.00 0.00 0.00 61.98 60.93 2ce9 s VAL 755 Cb -0.15 -1.76 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2ce9 s VAL 755 CO 0.05 0.57 -0.23 0.42 0.00 0.00 0.00 175.10 175.91 2ce9 s THR 756 N -0.13 1.87 -0.03 3.92 -4.23 -0.65 -0.43 115.64 115.97 2ce9 s THR 756 Ca -0.05 -1.41 -0.02 0.00 -1.18 0.00 0.00 61.69 59.03 2ce9 s THR 756 Cb -0.14 -1.64 -0.04 0.00 1.34 0.00 0.00 72.50 72.02 2ce9 s THR 756 CO 0.04 0.16 0.13 -0.83 -0.54 0.00 0.00 174.62 173.58 2ce9 s GLY 757 N -1.51 2.10 0.13 3.99 0.00 0.08 -1.46 107.32 110.65 2ce9 s GLY 757 Ca 0.09 -0.79 0.11 0.00 0.00 0.00 0.00 44.72 44.13 2ce9 s GLY 757 CO 0.03 -0.64 -0.26 -0.45 0.00 0.00 0.00 173.10 171.78 2ce9 s SER 758 N -1.68 3.20 0.38 1.64 0.15 0.32 -1.26 113.70 116.46 2ce9 s SER 758 Ca 0.23 -0.74 0.28 0.00 0.70 0.00 0.00 55.95 56.42 2ce9 s SER 758 Cb -0.12 -0.21 1.25 0.00 -1.71 0.00 0.00 66.02 65.23 2ce9 s SER 758 CO 0.14 0.16 1.83 1.23 1.20 0.00 0.00 173.24 177.80 2ce9 h GLY 759 N 3.91 0.00 -1.96 9.45 0.00 -1.09 -2.64 103.07 110.75 2ce9 h GLY 759 Ca -0.50 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.82 2ce9 h GLY 759 CO 0.39 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.16 2ce9 n ASP 760 N -2.54 2.77 -1.84 0.19 8.00 -1.26 -4.80 116.55 117.07 2ce9 n ASP 760 Ca 0.01 -2.35 -0.10 0.00 0.71 0.00 0.00 54.79 53.06 2ce9 n ASP 760 Cb 0.20 -0.57 0.03 0.00 -0.02 0.00 0.00 41.12 40.77 2ce9 n ASP 760 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2ce9 n LYS 761 N 0.22 -3.37 -3.86 -1.24 5.02 -1.04 -4.93 118.16 108.96 2ce9 n LYS 761 Ca 0.11 0.35 -0.08 0.00 -2.02 0.00 0.00 58.31 56.67 2ce9 n LYS 761 Cb 0.61 -3.94 -0.03 0.00 -0.02 0.00 0.00 35.03 31.64 2ce9 n LYS 761 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 2ce9 s LYS 762 N -5.48 1.63 0.21 1.97 -2.85 -1.25 -0.88 119.74 113.08 2ce9 s LYS 762 Ca 0.23 -1.02 0.09 0.00 -1.00 0.00 0.00 55.97 54.26 2ce9 s LYS 762 Cb -0.10 0.55 -0.05 0.00 -2.06 0.00 0.00 37.83 36.18 2ce9 s LYS 762 CO 0.31 -0.72 -0.16 0.00 0.10 0.00 0.00 175.35 174.88 2ce9 s ALA 763 N -3.93 2.12 -0.06 0.59 0.00 -0.43 -0.52 121.76 119.52 2ce9 s ALA 763 Ca 0.14 -1.65 0.03 0.00 0.00 0.00 0.00 51.96 50.48 2ce9 s ALA 763 Cb -0.03 -0.14 0.01 0.00 0.00 0.00 0.00 23.12 22.96 2ce9 s ALA 763 CO 0.05 0.14 -0.16 0.99 0.00 0.00 0.00 175.76 176.78 2ce9 s THR 764 N -2.68 1.36 -0.23 0.00 2.01 -0.54 -0.34 115.64 115.22 2ce9 s THR 764 Ca 0.22 -0.64 -0.10 0.00 0.31 0.00 0.00 61.69 61.48 2ce9 s THR 764 Cb -0.03 -1.20 -0.05 0.00 0.01 0.00 0.00 72.50 71.23 2ce9 s THR 764 CO 0.08 0.40 0.15 -0.69 -0.69 0.00 0.00 174.62 173.87 2ce9 s VAL 765 N 0.38 5.32 -0.09 3.82 1.01 -0.03 -1.63 120.40 129.18 2ce9 s VAL 765 Ca -0.11 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.04 2ce9 s VAL 765 Cb -0.14 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.74 2ce9 s VAL 765 CO 0.04 0.36 -0.09 -0.31 0.00 0.00 0.00 175.10 175.10 2ce9 s TYR 766 N 0.94 2.87 -0.11 5.22 2.02 0.12 -0.92 117.35 127.50 2ce9 s TYR 766 Ca 0.07 -0.19 -0.20 0.00 -0.37 0.00 0.00 57.07 56.39 2ce9 s TYR 766 Cb -0.13 -1.75 -0.04 0.00 -0.40 0.00 0.00 41.96 39.63 2ce9 s TYR 766 CO 0.03 0.14 0.54 -2.00 -1.57 0.00 0.00 175.55 172.70 2ce9 s GLU 767 N -0.40 4.36 -0.22 -0.62 2.12 0.38 -1.24 118.70 123.08 2ce9 s GLU 767 Ca 0.05 0.57 -0.25 0.00 0.36 0.00 0.00 54.97 55.71 2ce9 s GLU 767 Cb -0.12 -3.44 -0.01 0.00 0.26 0.00 0.00 34.13 30.82 2ce9 s GLU 767 CO 0.02 0.12 0.84 0.08 -0.54 0.00 0.00 175.26 175.78 2ce9 s VAL 768 N 0.71 4.85 -0.27 3.70 1.01 0.24 -1.36 120.40 129.28 2ce9 s VAL 768 Ca 0.29 1.61 -0.13 0.00 0.00 0.00 0.00 61.98 63.75 2ce9 s VAL 768 Cb -0.16 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2ce9 s VAL 768 CO 0.12 -0.04 0.28 -0.63 0.00 0.00 0.00 175.10 174.83 2ce9 s ILE 769 N 2.62 5.25 -2.80 2.22 -1.09 0.25 -4.92 121.20 122.72 2ce9 s ILE 769 Ca 0.36 0.38 0.22 0.00 -2.23 0.00 0.00 60.65 59.38 2ce9 s ILE 769 Cb -0.16 -3.61 0.18 0.00 -1.58 0.00 0.00 42.46 37.29 2ce9 s ILE 769 CO 0.09 0.22 1.21 -1.22 -1.23 0.00 0.00 174.94 174.00