#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 3.69 0.04 -0.67 5.04 -1.26 -5.09 117.35 119.10 2ce9 s TYR 435 Ca 0.00 0.96 0.06 0.00 -2.44 0.00 0.00 57.07 55.65 2ce9 s TYR 435 Cb 0.00 -2.27 -0.03 0.00 0.35 0.00 0.00 41.96 40.01 2ce9 s TYR 435 CO 0.00 0.60 -0.12 -0.06 -1.34 0.00 0.00 175.55 174.63 2ce9 s PHE 436 N -1.18 2.71 0.06 4.97 0.40 -1.26 -5.14 117.98 118.54 2ce9 s PHE 436 Ca 0.27 -0.16 0.06 0.00 -0.60 0.00 0.00 56.93 56.50 2ce9 s PHE 436 Cb -0.16 -1.51 -0.04 0.00 0.51 0.00 0.00 43.02 41.83 2ce9 s PHE 436 CO 0.15 0.33 -0.13 -0.65 0.70 0.00 0.00 175.22 175.63 2ce9 s GLN 437 N -1.61 2.20 0.68 0.44 -0.21 -1.26 -5.12 119.66 114.78 2ce9 s GLN 437 Ca 0.17 -0.94 -0.17 0.00 0.02 0.00 0.00 55.36 54.44 2ce9 s GLN 437 Cb -0.11 -2.30 0.01 0.00 1.00 0.00 0.00 33.01 31.61 2ce9 s GLN 437 CO 0.08 0.54 1.27 0.20 -2.12 0.00 0.00 175.29 175.26 2ce9 s GLY 438 N -1.71 2.71 -0.12 3.09 0.00 -1.26 -5.04 107.32 104.99 2ce9 s GLY 438 Ca 0.18 1.13 -0.06 0.00 0.00 0.00 0.00 44.72 45.97 2ce9 s GLY 438 CO 0.09 1.56 0.27 0.00 0.00 0.00 0.00 173.10 175.02 2ce9 s ALA 439 N -1.56 -0.64 0.12 3.20 0.00 -1.26 -5.15 121.76 116.47 2ce9 s ALA 439 Ca 0.80 1.08 -0.25 0.00 0.00 0.00 0.00 51.96 53.60 2ce9 s ALA 439 Cb -0.35 -0.70 -0.07 0.00 0.00 0.00 0.00 23.12 21.99 2ce9 s ALA 439 CO 0.42 -0.23 0.78 1.41 0.00 0.00 0.00 175.76 178.13 2ce9 s MET 440 N 1.35 4.54 0.47 0.00 1.75 -1.26 -5.06 119.30 121.09 2ce9 s MET 440 Ca -0.09 1.13 0.04 0.00 -1.25 0.00 0.00 55.69 55.52 2ce9 s MET 440 Cb -0.10 -3.31 -0.04 0.00 2.84 0.00 0.00 34.83 34.22 2ce9 s MET 440 CO -0.09 0.45 0.02 0.20 -0.65 0.00 0.00 175.02 174.95 2ce9 s GLY 441 N -0.68 2.78 0.11 2.11 0.00 -1.26 -5.17 107.32 105.21 2ce9 s GLY 441 Ca 0.37 -1.22 -0.10 0.00 0.00 0.00 0.00 44.72 43.77 2ce9 s GLY 441 CO 0.25 -2.14 0.25 -1.35 0.00 0.00 0.00 173.10 170.11 2ce9 s SER 442 N -3.83 0.03 0.05 1.64 1.04 -1.26 -5.17 113.70 106.20 2ce9 s SER 442 Ca 0.19 -0.62 -0.10 0.00 0.48 0.00 0.00 55.95 55.90 2ce9 s SER 442 Cb 0.05 0.39 0.01 0.00 0.10 0.00 0.00 66.02 66.56 2ce9 s SER 442 CO 0.10 -0.79 0.21 -0.54 0.98 0.00 0.00 173.24 173.20 2ce9 s LYS 443 N -3.87 0.73 0.50 4.02 1.02 -1.26 -5.12 119.74 115.77 2ce9 s LYS 443 Ca 0.07 -0.66 -0.22 0.00 0.02 0.00 0.00 55.97 55.18 2ce9 s LYS 443 Cb 0.04 0.31 -0.08 0.00 -0.52 0.00 0.00 37.83 37.58 2ce9 s LYS 443 CO -0.09 -0.22 1.03 -2.30 -0.92 0.00 0.00 175.35 172.85 2ce9 n PRO 444 N 0.55 1.25 -1.58 -1.68 -0.02 -1.26 -4.76 135.00 127.50 2ce9 n PRO 444 Ca -0.18 0.46 -0.52 0.00 -2.02 0.00 0.00 63.50 61.24 2ce9 n PRO 444 Cb 0.60 -2.15 -0.06 0.00 -0.02 0.00 0.00 33.50 31.87 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 -0.98 -1.09 0.00 3.55 0.00 -1.26 -4.86 120.51 115.88 2ce9 n ALA 445 Ca 0.11 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.05 2ce9 n ALA 445 Cb 0.43 -2.04 0.00 0.00 0.00 0.00 0.00 19.45 17.84 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 2.17 0.00 -4.07 0.00 0.18 -1.26 -5.01 117.16 109.18 2ce9 n TYR 446 Ca 0.18 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.61 2ce9 n TYR 446 Cb 0.20 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 39.01 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 -0.96 3.83 0.02 9.48 0.15 -1.26 -1.08 113.70 123.88 2ce9 s SER 447 Ca 0.00 -0.48 0.07 0.00 0.70 0.00 0.00 55.95 56.24 2ce9 s SER 447 Cb 0.00 -1.63 -0.02 0.00 -1.71 0.00 0.00 66.02 62.66 2ce9 s SER 447 CO 0.00 0.00 -0.21 -0.36 1.20 0.00 0.00 173.24 173.87 2ce9 s PHE 448 N 1.31 1.89 -0.23 3.44 0.08 -0.14 -1.53 117.98 122.81 2ce9 s PHE 448 Ca 0.04 -0.37 -0.10 0.00 0.12 0.00 0.00 56.93 56.62 2ce9 s PHE 448 Cb -0.14 -1.16 -0.05 0.00 -0.57 0.00 0.00 43.02 41.10 2ce9 s PHE 448 CO -0.06 0.05 0.15 -1.58 -0.10 0.00 0.00 175.22 173.67 2ce9 s HIS 449 N -0.68 3.32 -0.25 0.36 5.65 0.60 -0.44 115.29 123.85 2ce9 s HIS 449 Ca 0.08 0.21 -0.08 0.00 0.25 0.00 0.00 55.06 55.52 2ce9 s HIS 449 Cb -0.09 -2.24 -0.03 0.00 -1.18 0.00 0.00 32.58 29.04 2ce9 s HIS 449 CO 0.01 0.09 0.09 0.08 -0.65 0.00 0.00 174.74 174.36 2ce9 s VAL 450 N 0.93 4.55 0.21 0.89 1.01 0.57 -1.34 120.40 127.22 2ce9 s VAL 450 Ca 0.07 -0.09 -0.07 0.00 0.00 0.00 0.00 61.98 61.89 2ce9 s VAL 450 Cb -0.13 -3.13 -0.06 0.00 0.00 0.00 0.00 36.38 33.06 2ce9 s VAL 450 CO 0.03 0.34 0.49 0.28 0.00 0.00 0.00 175.10 176.24 2ce9 s THR 451 N 1.50 5.04 0.21 3.92 -1.32 -0.13 -1.98 115.64 122.87 2ce9 s THR 451 Ca 0.06 0.22 -0.09 0.00 -1.21 0.00 0.00 61.69 60.67 2ce9 s THR 451 Cb -0.15 -3.64 0.29 0.00 -1.51 0.00 0.00 72.50 67.49 2ce9 s THR 451 CO 0.05 -0.08 1.23 0.00 -2.21 0.00 0.00 174.62 173.60 2ce9 n ALA 452 N -0.23 0.08 -1.93 11.08 0.00 -1.26 -2.00 120.51 126.25 2ce9 n ALA 452 Ca -0.01 0.84 -0.37 0.00 0.00 0.00 0.00 53.44 53.90 2ce9 n ALA 452 Cb 0.52 -0.45 0.01 0.00 0.00 0.00 0.00 19.45 19.53 2ce9 n ALA 452 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ce9 n ASP 453 N -5.24 7.27 -4.01 0.00 5.75 -1.26 -5.00 116.55 114.06 2ce9 n ASP 453 Ca 0.11 -3.59 -0.09 0.00 -0.01 0.00 0.00 54.79 51.21 2ce9 n ASP 453 Cb 0.36 -1.15 -0.11 0.00 -1.03 0.00 0.00 41.12 39.19 2ce9 n ASP 453 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2ce9 s GLY 454 N -0.63 0.32 0.00 6.12 0.00 -0.85 -5.01 107.32 107.27 2ce9 s GLY 454 Ca 0.52 -0.76 0.00 0.00 0.00 0.00 0.00 44.72 44.48 2ce9 s GLY 454 CO -0.29 -0.84 0.00 -0.18 0.00 0.00 0.00 173.10 171.79 2ce9 n GLN 455 N 1.21 0.00 -4.77 2.90 7.27 -1.26 -4.77 117.38 117.96 2ce9 n GLN 455 Ca -0.21 0.00 -0.33 0.00 0.07 0.00 0.00 57.00 56.53 2ce9 n GLN 455 Cb 0.56 0.00 -0.14 0.00 2.41 0.00 0.00 30.24 33.08 2ce9 n GLN 455 CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 2ce9 s MET 456 N -0.16 3.26 -0.05 3.69 -1.94 -1.26 -0.95 119.30 121.88 2ce9 s MET 456 Ca 0.00 -0.67 0.03 0.00 -1.71 0.00 0.00 55.69 53.34 2ce9 s MET 456 Cb 0.00 -2.61 0.00 0.00 2.01 0.00 0.00 34.83 34.23 2ce9 s MET 456 CO 0.00 0.29 -0.14 -0.65 -0.01 0.00 0.00 175.02 174.50 2ce9 s GLN 457 N 0.16 1.69 0.32 2.03 -1.52 -0.45 -4.96 119.66 116.94 2ce9 s GLN 457 Ca -0.07 -0.50 -0.27 0.00 -1.95 0.00 0.00 55.36 52.58 2ce9 s GLN 457 Cb -0.15 -1.43 -0.13 0.00 -0.22 0.00 0.00 33.01 31.08 2ce9 s GLN 457 CO 0.05 0.13 0.99 -0.35 -0.25 0.00 0.00 175.29 175.86 2ce9 n PRO 458 N 3.46 1.33 -2.61 2.91 -0.04 -1.26 -0.29 135.00 138.51 2ce9 n PRO 458 Ca -0.20 0.47 -0.42 0.00 -0.04 0.00 0.00 63.50 63.31 2ce9 n PRO 458 Cb 0.53 -1.87 -0.03 0.00 -0.04 0.00 0.00 33.50 32.08 2ce9 n PRO 458 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2ce9 s VAL 459 N -1.12 4.56 -0.51 0.52 1.01 -0.58 -4.76 120.40 119.52 2ce9 s VAL 459 Ca 0.59 1.84 -0.28 0.00 0.00 0.00 0.00 61.98 64.14 2ce9 s VAL 459 Cb -0.67 -4.18 0.03 0.00 0.00 0.00 0.00 36.38 31.56 2ce9 s VAL 459 CO 0.59 0.14 1.09 -2.16 0.00 0.00 0.00 175.10 174.77 2ce9 s PRO 460 N 1.02 3.59 0.17 2.72 0.05 -1.26 -5.01 135.00 136.27 2ce9 s PRO 460 Ca 0.54 0.31 -0.31 0.00 0.05 0.00 0.00 61.00 61.60 2ce9 s PRO 460 Cb -0.24 -3.96 -0.09 0.00 0.05 0.00 0.00 34.50 30.27 2ce9 s PRO 460 CO 0.28 -1.45 1.38 -0.06 0.05 0.00 0.00 177.00 177.21 2ce9 s PHE 461 N 4.42 3.20 1.07 0.56 0.08 -1.26 -5.02 117.98 121.03 2ce9 s PHE 461 Ca 0.43 1.04 -0.14 0.00 0.12 0.00 0.00 56.93 58.37 2ce9 s PHE 461 Cb -0.08 -3.69 0.22 0.00 -0.57 0.00 0.00 43.02 38.90 2ce9 s PHE 461 CO 0.28 -2.32 1.10 -1.25 -0.10 0.00 0.00 175.22 172.93 2ce9 s PRO 462 N 0.42 -0.11 0.46 0.24 0.04 -1.26 -4.90 135.00 129.89 2ce9 s PRO 462 Ca 0.61 0.34 0.12 0.00 0.04 0.00 0.00 61.00 62.11 2ce9 s PRO 462 Cb -0.38 -1.69 1.07 0.00 0.04 0.00 0.00 34.50 33.54 2ce9 s PRO 462 CO 0.35 -3.06 2.08 -1.35 0.04 0.00 0.00 177.00 175.07 2ce9 h PRO 463 N -2.12 0.29 -0.71 0.56 0.11 -1.97 -1.86 132.00 126.29 2ce9 h PRO 463 Ca -0.53 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.57 2ce9 h PRO 463 Cb 1.32 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2ce9 h PRO 463 CO 0.52 0.19 0.00 -0.40 -0.21 0.00 0.00 178.00 178.10 2ce9 n ASP 464 N -4.49 3.11 -0.17 -2.05 5.75 -1.26 -4.46 116.55 112.97 2ce9 n ASP 464 Ca 0.02 -2.38 -0.11 0.00 -0.01 0.00 0.00 54.79 52.32 2ce9 n ASP 464 Cb 0.14 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 39.70 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 3.13 0.66 -0.02 2.12 0.00 -1.68 -3.35 119.26 120.12 2ce9 h ALA 465 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2ce9 h ALA 465 Cb 1.10 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2ce9 h ALA 465 CO 0.20 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.28 2ce9 n LEU 466 N -4.24 1.42 -3.64 0.00 4.77 -1.26 -4.76 117.00 109.28 2ce9 n LEU 466 Ca 0.00 -1.11 -0.13 0.00 -0.03 0.00 0.00 56.01 54.75 2ce9 n LEU 466 Cb 0.38 -0.01 -0.07 0.00 -2.33 0.00 0.00 43.42 41.39 2ce9 n LEU 466 CO 0.44 0.32 0.38 -0.51 -1.33 0.00 0.00 177.39 176.69 2ce9 s ILE 467 N -0.38 -0.00 0.00 -0.08 1.10 -1.26 -4.97 121.20 115.61 2ce9 s ILE 467 Ca 0.05 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.19 2ce9 s ILE 467 Cb 0.03 -0.97 0.00 0.00 0.15 0.00 0.00 42.46 41.67 2ce9 s ILE 467 CO 0.05 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.49 2ce9 n GLY 468 N 2.97 1.37 3.74 1.50 0.00 -1.26 -4.43 105.19 109.07 2ce9 n GLY 468 Ca -0.15 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 2ce9 n GLY 468 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ce9 s PRO 469 N -1.98 4.24 0.00 1.61 0.04 -1.26 -2.03 135.00 135.62 2ce9 s PRO 469 Ca 0.00 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.38 2ce9 s PRO 469 Cb 0.00 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.43 2ce9 s PRO 469 CO 0.00 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 176.96 2ce9 n GLY 470 N 2.60 0.90 3.55 0.56 0.00 -1.26 -5.01 105.19 106.52 2ce9 n GLY 470 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 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 -3.63 4.91 0.48 -0.61 -1.09 -0.86 -4.87 121.20 115.54 2ce9 s ILE 471 Ca 0.00 0.03 -0.24 0.00 -2.23 0.00 0.00 60.65 58.21 2ce9 s ILE 471 Cb 0.00 -3.31 -0.07 0.00 -1.58 0.00 0.00 42.46 37.50 2ce9 s ILE 471 CO 0.00 0.31 1.40 -2.84 -1.23 0.00 0.00 174.94 172.58 2ce9 s PRO 472 N 1.54 3.50 -0.02 2.79 0.02 -1.26 -4.56 135.00 137.00 2ce9 s PRO 472 Ca 0.06 2.35 -0.06 0.00 0.02 0.00 0.00 61.00 63.37 2ce9 s PRO 472 Cb -0.15 -2.52 -0.29 0.00 0.02 0.00 0.00 34.50 31.56 2ce9 s PRO 472 CO 0.07 -0.94 0.76 0.00 -0.33 0.00 0.00 177.00 176.55 2ce9 h ARG 473 N 2.03 0.31 -2.36 5.54 3.08 0.23 -3.47 114.38 119.74 2ce9 h ARG 473 Ca -0.51 -0.54 0.24 0.00 0.07 0.00 0.00 59.98 59.25 2ce9 h ARG 473 Cb 1.28 0.20 -0.05 0.00 0.08 0.00 0.00 29.97 31.48 2ce9 h ARG 473 CO 0.60 1.20 0.72 -3.38 -1.07 0.00 0.00 179.97 178.04 2ce9 s HIS 474 N -2.60 0.05 -0.04 3.04 -3.43 -1.13 -4.92 115.29 106.27 2ce9 s HIS 474 Ca -0.12 -0.34 0.03 0.00 -0.80 0.00 0.00 55.06 53.83 2ce9 s HIS 474 Cb 0.06 0.64 0.00 0.00 -1.43 0.00 0.00 32.58 31.85 2ce9 s HIS 474 CO 0.85 -0.64 -0.13 0.00 -2.00 0.00 0.00 174.74 172.82 2ce9 s ALA 475 N -2.09 1.20 -0.12 -1.38 0.00 -1.26 -0.92 121.76 117.19 2ce9 s ALA 475 Ca 0.25 -0.49 -0.00 0.00 0.00 0.00 0.00 51.96 51.72 2ce9 s ALA 475 Cb -0.02 -0.43 -0.02 0.00 0.00 0.00 0.00 23.12 22.65 2ce9 s ALA 475 CO 0.03 0.19 -0.10 -0.98 0.00 0.00 0.00 175.76 174.90 2ce9 s ARG 476 N 0.19 3.24 0.06 0.00 1.70 -0.41 -4.96 118.95 118.77 2ce9 s ARG 476 Ca -0.05 -0.62 -0.31 0.00 -0.47 0.00 0.00 55.73 54.28 2ce9 s ARG 476 Cb -0.11 -2.66 -0.06 0.00 -0.57 0.00 0.00 34.95 31.55 2ce9 s ARG 476 CO 0.02 0.34 1.32 -1.14 -1.08 0.00 0.00 175.30 174.76 2ce9 s GLN 477 N 0.03 4.35 0.00 3.89 0.74 -1.26 -0.81 119.66 126.60 2ce9 s GLN 477 Ca -0.03 1.92 0.00 0.00 0.05 0.00 0.00 55.36 57.31 2ce9 s GLN 477 Cb -0.14 -3.38 0.00 0.00 1.10 0.00 0.00 33.01 30.59 2ce9 s GLN 477 CO 0.04 -0.41 0.00 0.44 -0.55 0.00 0.00 175.29 174.80 2ce9 n ILE 478 N 4.16 0.00 -3.60 -2.34 -5.35 0.10 -4.92 119.36 107.42 2ce9 n ILE 478 Ca 0.11 -0.16 -0.11 0.00 -0.27 0.00 0.00 62.75 62.32 2ce9 n ILE 478 Cb 0.44 0.64 -0.04 0.00 -1.74 0.00 0.00 39.64 38.94 2ce9 n ILE 478 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2ce9 s ASN 479 N -1.23 -0.31 -0.07 7.28 3.84 -1.05 -4.99 114.94 118.42 2ce9 s ASN 479 Ca 0.00 -0.18 0.02 0.00 0.21 0.00 0.00 52.86 52.90 2ce9 s ASN 479 Cb 0.00 0.49 0.02 0.00 -0.55 0.00 0.00 41.25 41.20 2ce9 s ASN 479 CO 0.00 -0.83 -0.10 -0.89 -2.79 0.00 0.00 177.10 172.49 2ce9 s THR 480 N -3.50 0.98 -0.37 -5.21 2.01 -1.26 -1.28 115.64 107.01 2ce9 s THR 480 Ca 0.01 -0.36 -0.06 0.00 0.31 0.00 0.00 61.69 61.58 2ce9 s THR 480 Cb 0.01 -0.93 0.06 0.00 0.01 0.00 0.00 72.50 71.65 2ce9 s THR 480 CO -0.10 0.33 0.15 -0.76 -0.69 0.00 0.00 174.62 173.55 2ce9 s LEU 481 N 0.89 4.66 -1.36 4.42 1.43 0.33 -4.95 118.68 124.10 2ce9 s LEU 481 Ca -0.11 -1.41 -0.14 0.00 -1.03 0.00 0.00 54.13 51.44 2ce9 s LEU 481 Cb -0.15 -1.88 0.08 0.00 0.03 0.00 0.00 46.19 44.28 2ce9 s LEU 481 CO 0.01 -0.42 1.95 0.59 0.23 0.00 0.00 176.35 178.71 2ce9 n ASN 482 N 4.78 4.52 -0.21 2.29 5.03 -1.26 -1.18 115.26 129.23 2ce9 n ASN 482 Ca -0.10 -2.92 -0.07 0.00 0.87 0.00 0.00 54.58 52.36 2ce9 n ASN 482 Cb 0.43 -1.65 0.03 0.00 -1.02 0.00 0.00 39.78 37.58 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 6.52 0.79 0.00 3.10 2.76 -1.90 -3.47 115.15 122.95 2ce9 h HIS 483 Ca 0.48 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.64 2ce9 h HIS 483 Cb 0.73 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 29.43 2ce9 h HIS 483 CO 1.38 0.57 0.00 0.41 -1.30 0.00 0.00 177.93 178.99 2ce9 n GLY 484 N -1.07 0.87 3.23 5.26 0.00 0.25 -5.01 105.19 108.71 2ce9 n GLY 484 Ca 0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.57 1.00 0.04 1.61 0.41 -1.25 -4.96 118.70 114.98 2ce9 s GLU 485 Ca 0.00 -1.33 -0.35 0.00 -0.41 0.00 0.00 54.97 52.87 2ce9 s GLU 485 Cb 0.00 -0.66 -0.14 0.00 -1.78 0.00 0.00 34.13 31.54 2ce9 s GLU 485 CO 0.00 0.10 1.60 0.28 -0.49 0.00 0.00 175.26 176.75 2ce9 n VAL 486 N 0.15 0.16 -3.12 2.63 0.31 -1.26 -3.97 118.33 113.23 2ce9 n VAL 486 Ca -0.13 -0.03 -0.45 0.00 -0.01 0.00 0.00 64.34 63.72 2ce9 n VAL 486 Cb 0.59 -1.39 -0.04 0.00 -0.91 0.00 0.00 33.84 32.09 2ce9 n VAL 486 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2ce9 s VAL 487 N 1.78 4.92 -0.59 2.52 1.01 -1.04 -4.36 120.40 124.64 2ce9 s VAL 487 Ca 0.85 -1.28 0.25 0.00 0.00 0.00 0.00 61.98 61.80 2ce9 s VAL 487 Cb -0.80 -4.53 0.23 0.00 0.00 0.00 0.00 36.38 31.29 2ce9 s VAL 487 CO 0.46 -1.17 1.58 0.00 0.00 0.00 0.00 175.10 175.98 2ce9 s ALA 489 N -3.17 -0.42 0.01 0.00 0.00 -1.20 -4.64 121.76 112.34 2ce9 s ALA 489 Ca 0.08 0.50 0.01 0.00 0.00 0.00 0.00 51.96 52.55 2ce9 s ALA 489 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.92 2ce9 s ALA 489 CO 0.66 -0.09 -0.04 0.14 0.00 0.00 0.00 175.76 176.43 2ce9 s VAL 490 N 0.16 0.31 -0.01 0.00 -7.23 -1.26 -0.57 120.40 111.80 2ce9 s VAL 490 Ca -0.01 -0.47 -0.03 0.00 -1.81 0.00 0.00 61.98 59.67 2ce9 s VAL 490 Cb -0.02 -0.33 0.00 0.00 0.56 0.00 0.00 36.38 36.60 2ce9 s VAL 490 CO -0.00 -0.11 0.07 -0.89 -0.31 0.00 0.00 175.10 173.85 2ce9 s THR 491 N -0.57 0.04 -0.12 5.32 2.01 -0.66 -4.53 115.64 117.12 2ce9 s THR 491 Ca -0.04 -0.31 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 2ce9 s THR 491 Cb -0.05 -0.20 -0.03 0.00 0.01 0.00 0.00 72.50 72.23 2ce9 s THR 491 CO -0.00 -0.17 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.11 2ce9 s ILE 492 N -0.51 4.07 0.98 1.82 1.01 -1.26 -0.30 121.20 127.00 2ce9 s ILE 492 Ca -0.06 -0.32 -0.11 0.00 0.00 0.00 0.00 60.65 60.16 2ce9 s ILE 492 Cb -0.04 -2.74 0.18 0.00 0.01 0.00 0.00 42.46 39.88 2ce9 s ILE 492 CO 0.00 0.55 1.09 -0.94 0.00 0.00 0.00 174.94 175.64 2ce9 s SER 493 N -0.31 2.57 -0.16 3.58 1.04 0.35 -4.96 113.70 115.81 2ce9 s SER 493 Ca 0.06 1.69 0.00 0.00 0.48 0.00 0.00 55.95 58.18 2ce9 s SER 493 Cb -0.12 -2.32 0.03 0.00 0.10 0.00 0.00 66.02 63.70 2ce9 s SER 493 CO 0.02 -3.24 -0.11 0.21 0.98 0.00 0.00 173.24 171.10 2ce9 s ASN 494 N -2.95 2.84 0.76 7.02 2.47 -1.26 -2.96 114.94 120.86 2ce9 s ASN 494 Ca 0.66 -0.60 -0.14 0.00 0.42 0.00 0.00 52.86 53.20 2ce9 s ASN 494 Cb -0.21 -1.13 0.06 0.00 -1.45 0.00 0.00 41.25 38.51 2ce9 s ASN 494 CO 0.60 -0.10 1.20 -2.16 -3.72 0.00 0.00 177.10 172.92 2ce9 s PRO 495 N 1.50 1.95 0.16 0.43 0.04 -1.26 -4.80 135.00 133.03 2ce9 s PRO 495 Ca 0.03 1.74 -0.31 0.00 0.04 0.00 0.00 61.00 62.49 2ce9 s PRO 495 Cb -0.14 -1.81 -0.11 0.00 0.04 0.00 0.00 34.50 32.48 2ce9 s PRO 495 CO -0.09 -1.97 1.72 0.99 0.04 0.00 0.00 177.00 177.68 2ce9 s THR 496 N -2.08 2.39 0.00 1.26 2.01 -1.16 -4.49 115.64 113.58 2ce9 s THR 496 Ca 0.73 0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.89 2ce9 s THR 496 Cb -0.28 -3.10 0.00 0.00 0.01 0.00 0.00 72.50 69.13 2ce9 s THR 496 CO 0.48 0.01 0.00 -1.14 -0.69 0.00 0.00 174.62 173.27 2ce9 n ARG 497 N 4.64 0.00 -4.33 4.92 0.63 -1.26 -4.95 116.66 116.31 2ce9 n ARG 497 Ca 0.16 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.81 2ce9 n ARG 497 Cb 0.37 0.00 -0.11 0.00 0.45 0.00 0.00 32.46 33.17 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 -1.74 2.51 -0.03 -0.14 3.76 -1.26 -0.54 115.29 117.85 2ce9 s HIS 498 Ca 0.00 -0.27 0.07 0.00 -0.15 0.00 0.00 55.06 54.71 2ce9 s HIS 498 Cb 0.00 -1.28 -0.02 0.00 1.11 0.00 0.00 32.58 32.39 2ce9 s HIS 498 CO 0.00 0.45 -0.26 0.08 -0.85 0.00 0.00 174.74 174.16 2ce9 s VAL 499 N -1.43 2.05 -0.16 -0.90 1.01 -0.03 -0.49 120.40 120.43 2ce9 s VAL 499 Ca 0.21 -1.09 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 2ce9 s VAL 499 Cb -0.09 -1.71 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 2ce9 s VAL 499 CO 0.12 0.57 -0.05 -0.31 0.00 0.00 0.00 175.10 175.43 2ce9 s TYR 500 N -0.44 2.97 -0.09 5.22 2.02 0.59 -1.10 117.35 126.52 2ce9 s TYR 500 Ca 0.05 -0.46 0.04 0.00 -0.37 0.00 0.00 57.07 56.33 2ce9 s TYR 500 Cb -0.11 -1.97 0.00 0.00 -0.40 0.00 0.00 41.96 39.48 2ce9 s TYR 500 CO 0.01 -0.15 -0.21 0.95 -1.57 0.00 0.00 175.55 174.57 2ce9 s THR 501 N 0.56 1.84 -0.29 -0.71 -4.23 -0.32 -1.66 115.64 110.83 2ce9 s THR 501 Ca -0.04 -0.89 -0.09 0.00 -1.18 0.00 0.00 61.69 59.49 2ce9 s THR 501 Cb -0.15 -1.60 -0.02 0.00 1.34 0.00 0.00 72.50 72.07 2ce9 s THR 501 CO 0.03 0.51 0.14 -0.83 -0.54 0.00 0.00 174.62 173.93 2ce9 s GLY 502 N 0.42 1.85 0.00 3.99 0.00 0.27 -0.68 107.32 113.17 2ce9 s GLY 502 Ca -0.18 -1.26 0.00 0.00 0.00 0.00 0.00 44.72 43.28 2ce9 s GLY 502 CO 0.08 0.65 0.00 0.61 0.00 0.00 0.00 173.10 174.43 2ce9 n GLY 503 N 4.98 2.23 3.61 0.20 0.00 -0.86 -1.34 105.19 114.02 2ce9 n GLY 503 Ca -0.14 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.28 2ce9 n GLY 503 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ce9 s LYS 504 N 4.12 4.00 0.00 1.61 1.02 -1.26 -1.42 119.74 127.81 2ce9 s LYS 504 Ca 0.00 0.40 0.00 0.00 0.02 0.00 0.00 55.97 56.39 2ce9 s LYS 504 Cb 0.00 -3.69 0.00 0.00 -0.52 0.00 0.00 37.83 33.62 2ce9 s LYS 504 CO 0.00 -0.48 0.00 0.41 -0.92 0.00 0.00 175.35 174.36 2ce9 n GLY 505 N 4.32 1.87 3.18 -3.33 0.00 0.31 -4.91 105.19 106.62 2ce9 n GLY 505 Ca -0.01 -0.24 -0.11 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.67 4.79 -0.13 0.00 1.01 0.25 -2.02 120.40 120.63 2ce9 s VAL 507 Ca 0.14 -0.04 -0.07 0.00 0.00 0.00 0.00 61.98 62.02 2ce9 s VAL 507 Cb 0.06 -3.15 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 2ce9 s VAL 507 CO -0.03 0.47 0.12 -0.54 0.00 0.00 0.00 175.10 175.12 2ce9 s LYS 508 N 0.32 3.49 -0.17 2.72 1.02 0.15 0.65 119.74 127.91 2ce9 s LYS 508 Ca 0.03 -0.18 -0.03 0.00 0.02 0.00 0.00 55.97 55.81 2ce9 s LYS 508 Cb -0.12 -3.17 -0.02 0.00 -0.52 0.00 0.00 37.83 33.99 2ce9 s LYS 508 CO 0.00 0.70 -0.05 0.08 -0.92 0.00 0.00 175.35 175.17 2ce9 s VAL 509 N -0.81 3.71 -0.07 3.17 1.01 0.13 -1.18 120.40 126.36 2ce9 s VAL 509 Ca 0.14 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 61.75 2ce9 s VAL 509 Cb -0.12 -2.63 -0.01 0.00 0.00 0.00 0.00 36.38 33.62 2ce9 s VAL 509 CO 0.03 0.48 -0.24 0.26 0.00 0.00 0.00 175.10 175.63 2ce9 s TRP 510 N 0.60 2.40 -0.50 5.22 0.52 -0.26 0.51 118.94 127.43 2ce9 s TRP 510 Ca -0.03 -0.83 -0.18 0.00 0.02 0.00 0.00 56.10 55.08 2ce9 s TRP 510 Cb -0.15 -1.59 0.07 0.00 -1.15 0.00 0.00 33.47 30.65 2ce9 s TRP 510 CO 0.03 -0.29 0.56 0.34 0.02 0.00 0.00 176.95 177.60 2ce9 s ASP 511 N 0.07 6.20 0.00 2.95 -1.08 -1.26 -0.85 116.67 122.69 2ce9 s ASP 511 Ca -0.10 -1.09 0.21 0.00 -0.52 0.00 0.00 52.55 51.04 2ce9 s ASP 511 Cb -0.15 -2.26 0.61 0.00 -1.46 0.00 0.00 42.92 39.66 2ce9 s ASP 511 CO 0.06 -0.83 1.47 2.30 0.52 0.00 0.00 175.17 178.69 2ce9 n ILE 512 N 5.48 0.33 0.76 4.11 -5.35 0.30 -3.45 119.36 121.55 2ce9 n ILE 512 Ca -0.09 -0.49 0.12 0.00 -0.27 0.00 0.00 62.75 62.03 2ce9 n ILE 512 Cb 0.45 0.55 0.28 0.00 -1.74 0.00 0.00 39.64 39.18 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 0.73 0.56 -4.18 7.28 3.41 -1.20 -4.27 113.62 115.94 2ce9 n SER 513 Ca 0.17 0.11 -0.40 0.00 -0.26 0.00 0.00 58.87 58.49 2ce9 n SER 513 Cb 0.42 -0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.29 2ce9 n SER 513 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 2ce9 s HIS 514 N -3.09 3.52 0.04 7.33 3.76 -1.22 -5.00 115.29 120.63 2ce9 s HIS 514 Ca 0.09 -2.36 0.31 0.00 -0.15 0.00 0.00 55.06 52.95 2ce9 s HIS 514 Cb 0.15 -3.43 1.53 0.00 1.11 0.00 0.00 32.58 31.95 2ce9 s HIS 514 CO 0.68 -0.91 1.93 -1.00 -0.85 0.00 0.00 174.74 174.58 2ce9 h PRO 515 N 7.51 0.00 0.00 8.40 0.13 -1.83 -2.72 132.00 143.49 2ce9 h PRO 515 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2ce9 h PRO 515 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2ce9 h PRO 515 CO 0.75 0.00 -0.11 0.78 -0.23 0.00 0.00 178.00 179.19 2ce9 h GLY 516 N 0.76 0.00 -5.40 1.56 0.00 -1.94 -3.47 103.07 94.59 2ce9 h GLY 516 Ca 0.00 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.73 2ce9 h GLY 516 CO 0.00 0.00 0.99 0.70 0.00 0.00 0.00 176.54 178.23 2ce9 n ASN 517 N -2.87 3.36 -0.28 0.19 4.13 -1.03 -4.89 115.26 113.88 2ce9 n ASN 517 Ca 0.04 1.01 0.08 0.00 1.68 0.00 0.00 54.58 57.40 2ce9 n ASN 517 Cb 0.51 -1.41 -0.03 0.00 -1.54 0.00 0.00 39.78 37.32 2ce9 n ASN 517 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2ce9 n LYS 518 N 5.35 1.60 -4.24 3.52 4.76 -1.26 -5.04 118.16 122.85 2ce9 n LYS 518 Ca 0.20 -0.61 -0.14 0.00 -2.87 0.00 0.00 58.31 54.90 2ce9 n LYS 518 Cb 0.30 -1.30 -0.10 0.00 -1.84 0.00 0.00 35.03 32.09 2ce9 n LYS 518 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2ce9 s SER 519 N -2.16 1.31 0.73 4.39 1.04 -1.26 -4.65 113.70 113.11 2ce9 s SER 519 Ca 0.12 -1.15 -0.14 0.00 0.48 0.00 0.00 55.95 55.26 2ce9 s SER 519 Cb 0.13 0.10 0.04 0.00 0.10 0.00 0.00 66.02 66.39 2ce9 s SER 519 CO 0.50 -0.54 1.16 -2.84 0.98 0.00 0.00 173.24 172.51 2ce9 s PRO 520 N -3.89 2.22 0.25 4.02 0.02 -1.26 -4.76 135.00 131.60 2ce9 s PRO 520 Ca 0.23 1.58 0.22 0.00 0.02 0.00 0.00 61.00 63.05 2ce9 s PRO 520 Cb 0.06 -1.86 0.07 0.00 0.02 0.00 0.00 34.50 32.78 2ce9 s PRO 520 CO 0.03 -1.73 1.17 -0.39 -0.33 0.00 0.00 177.00 175.75 2ce9 h VAL 521 N -0.43 0.07 -3.19 3.83 -1.51 -0.30 -3.48 116.25 111.23 2ce9 h VAL 521 Ca -0.47 -1.11 -0.07 0.00 -1.23 0.00 0.00 66.70 63.82 2ce9 h VAL 521 Cb 1.27 1.68 -0.15 0.00 -2.13 0.00 0.00 31.29 31.97 2ce9 h VAL 521 CO 0.50 0.04 -0.10 -0.44 -1.23 0.00 0.00 177.57 176.34 2ce9 s SER 522 N -5.63 -0.25 -0.05 4.19 0.01 -1.11 -5.01 113.70 105.87 2ce9 s SER 522 Ca 0.01 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2ce9 s SER 522 Cb 0.08 0.44 0.02 0.00 0.21 0.00 0.00 66.02 66.78 2ce9 s SER 522 CO 0.76 -0.74 -0.02 -1.58 0.41 0.00 0.00 173.24 172.07 2ce9 s GLN 523 N -3.02 0.66 -0.40 12.44 0.74 -1.26 0.18 119.66 129.00 2ce9 s GLN 523 Ca -0.02 -0.01 -0.10 0.00 0.05 0.00 0.00 55.36 55.28 2ce9 s GLN 523 Cb 0.00 -0.79 0.06 0.00 1.10 0.00 0.00 33.01 33.38 2ce9 s GLN 523 CO -0.06 -0.15 0.24 -0.51 -0.55 0.00 0.00 175.29 174.26 2ce9 s LEU 524 N 1.19 4.96 -0.34 3.68 1.02 0.21 -4.95 118.68 124.45 2ce9 s LEU 524 Ca -0.07 -1.27 -0.26 0.00 0.02 0.00 0.00 54.13 52.55 2ce9 s LEU 524 Cb -0.14 -2.00 0.01 0.00 0.02 0.00 0.00 46.19 44.08 2ce9 s LEU 524 CO -0.02 -0.47 0.92 -1.81 0.02 0.00 0.00 176.35 174.99 2ce9 s ASP 525 N 1.88 6.74 -0.11 2.29 1.01 -1.26 -0.59 116.67 126.63 2ce9 s ASP 525 Ca 0.02 0.72 -0.03 0.00 0.71 0.00 0.00 52.55 53.97 2ce9 s ASP 525 Cb -0.21 -2.46 -0.06 0.00 1.01 0.00 0.00 42.92 41.20 2ce9 s ASP 525 CO 0.04 -0.78 -0.12 0.00 0.21 0.00 0.00 175.17 174.52 2ce9 n LEU 527 N -3.22 0.00 -4.47 0.00 -0.00 -0.55 -4.97 117.00 103.78 2ce9 n LEU 527 Ca -0.21 -2.97 -0.56 0.00 -0.00 0.00 0.00 56.01 52.28 2ce9 n LEU 527 Cb 0.67 2.56 -0.07 0.00 -0.00 0.00 0.00 43.42 46.59 2ce9 n LEU 527 CO 0.05 -0.67 0.42 -3.20 -0.00 0.00 0.00 177.39 173.99 2ce9 n ASN 528 N -1.61 -0.31 0.27 1.45 2.85 -1.26 -4.45 115.26 112.19 2ce9 n ASN 528 Ca 0.01 1.15 0.18 0.00 -0.11 0.00 0.00 54.58 55.81 2ce9 n ASN 528 Cb 0.61 -0.94 0.82 0.00 1.24 0.00 0.00 39.78 41.51 2ce9 n ASN 528 CO 0.00 0.00 0.00 0.08 -2.11 0.00 0.00 177.26 175.23 2ce9 h ARG 529 N 2.47 0.00 0.00 1.20 0.11 -1.91 -0.26 114.38 115.99 2ce9 h ARG 529 Ca -0.45 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.63 2ce9 h ARG 529 Cb 1.43 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.51 2ce9 h ARG 529 CO 0.63 0.00 -0.43 -0.25 0.10 0.00 0.00 179.97 180.02 2ce9 n ASP 530 N -2.92 0.48 -4.76 0.08 8.00 -1.26 -4.14 116.55 112.03 2ce9 n ASP 530 Ca -0.00 0.01 -0.32 0.00 0.71 0.00 0.00 54.79 55.19 2ce9 n ASP 530 Cb 0.21 0.06 -0.07 0.00 -0.02 0.00 0.00 41.12 41.29 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 -3.41 5.53 0.15 -2.24 0.02 -0.11 -4.96 114.94 109.92 2ce9 s ASN 531 Ca 0.10 0.08 -0.17 0.00 -1.02 0.00 0.00 52.86 51.85 2ce9 s ASN 531 Cb 0.16 -1.54 -0.07 0.00 0.02 0.00 0.00 41.25 39.82 2ce9 s ASN 531 CO 0.67 0.25 0.61 -0.31 0.02 0.00 0.00 177.10 178.35 2ce9 s TYR 532 N -1.21 3.67 0.25 2.20 2.02 -1.26 -0.53 117.35 122.50 2ce9 s TYR 532 Ca 0.23 1.22 -0.30 0.00 -0.37 0.00 0.00 57.07 57.86 2ce9 s TYR 532 Cb -0.12 -2.48 -0.10 0.00 -0.40 0.00 0.00 41.96 38.86 2ce9 s TYR 532 CO 0.15 0.44 1.35 0.42 -1.57 0.00 0.00 175.55 176.34 2ce9 s ILE 533 N -1.39 2.89 -0.01 2.71 -1.09 -0.51 -1.03 121.20 122.77 2ce9 s ILE 533 Ca 0.37 0.78 0.08 0.00 -2.23 0.00 0.00 60.65 59.65 2ce9 s ILE 533 Cb -0.17 -3.50 -0.13 0.00 -1.58 0.00 0.00 42.46 37.09 2ce9 s ILE 533 CO 0.20 0.14 0.18 0.54 -1.23 0.00 0.00 174.94 174.77 2ce9 n ARG 534 N 2.00 0.35 -3.64 2.79 5.12 0.30 -4.56 116.66 119.03 2ce9 n ARG 534 Ca 0.05 -0.07 -0.11 0.00 -1.93 0.00 0.00 57.85 55.78 2ce9 n ARG 534 Cb 0.42 -1.20 -0.07 0.00 -1.16 0.00 0.00 32.46 30.44 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 -3.01 -0.81 -0.03 0.55 0.15 -0.84 -4.49 113.70 105.23 2ce9 s SER 535 Ca -0.03 1.44 -0.02 0.00 0.70 0.00 0.00 55.95 58.05 2ce9 s SER 535 Cb 0.05 1.41 0.01 0.00 -1.71 0.00 0.00 66.02 65.78 2ce9 s SER 535 CO 0.35 -0.24 0.06 0.00 1.20 0.00 0.00 173.24 174.61 2ce9 s LYS 537 N 0.31 1.05 0.27 0.00 -0.14 -0.07 -4.69 119.74 116.46 2ce9 s LYS 537 Ca -0.02 -0.27 -0.28 0.00 -1.36 0.00 0.00 55.97 54.05 2ce9 s LYS 537 Cb -0.03 -0.96 -0.09 0.00 -1.68 0.00 0.00 37.83 35.06 2ce9 s LYS 537 CO -0.01 0.04 0.92 -0.51 -0.76 0.00 0.00 175.35 175.03 2ce9 s LEU 538 N 0.47 4.50 0.52 3.17 1.43 -1.26 -0.83 118.68 126.68 2ce9 s LEU 538 Ca -0.08 1.86 -0.20 0.00 -1.03 0.00 0.00 54.13 54.68 2ce9 s LEU 538 Cb -0.12 -3.75 -0.07 0.00 0.03 0.00 0.00 46.19 42.29 2ce9 s LEU 538 CO 0.01 0.06 1.12 -0.76 0.23 0.00 0.00 176.35 177.01 2ce9 s LEU 539 N -1.57 3.81 0.50 1.79 1.02 -0.39 -4.91 118.68 118.92 2ce9 s LEU 539 Ca 0.45 2.15 0.35 0.00 0.02 0.00 0.00 54.13 57.10 2ce9 s LEU 539 Cb -0.22 -4.53 1.49 0.00 0.02 0.00 0.00 46.19 42.95 2ce9 s LEU 539 CO 0.28 -1.10 1.70 -0.65 0.02 0.00 0.00 176.35 176.60 2ce9 h PRO 540 N 1.39 0.08 0.00 1.29 0.11 -1.91 0.30 132.00 133.26 2ce9 h PRO 540 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2ce9 h PRO 540 Cb 1.25 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2ce9 h PRO 540 CO 0.58 0.05 -0.40 -0.40 -0.21 0.00 0.00 178.00 177.62 2ce9 n ASP 541 N -4.33 0.52 0.00 -2.05 5.75 -1.26 -4.96 116.55 110.22 2ce9 n ASP 541 Ca 0.33 0.11 0.00 0.00 -0.01 0.00 0.00 54.79 55.22 2ce9 n ASP 541 Cb 1.42 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 41.48 2ce9 n ASP 541 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2ce9 n GLY 542 N 1.42 1.64 0.04 6.12 0.00 0.10 -4.89 105.19 109.63 2ce9 n GLY 542 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.87 0.61 -0.04 0.00 -1.32 -1.26 -0.82 115.64 109.94 2ce9 s THR 544 Ca 0.16 -0.65 0.06 0.00 -1.21 0.00 0.00 61.69 60.04 2ce9 s THR 544 Cb 0.18 -0.58 -0.01 0.00 -1.51 0.00 0.00 72.50 70.59 2ce9 s THR 544 CO 0.61 -0.05 -0.22 -0.22 -2.21 0.00 0.00 174.62 172.53 2ce9 s LEU 545 N -0.78 2.01 -0.09 9.08 2.96 -0.61 -1.26 118.68 129.99 2ce9 s LEU 545 Ca -0.02 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.48 2ce9 s LEU 545 Cb -0.06 -1.17 -0.02 0.00 0.50 0.00 0.00 46.19 45.44 2ce9 s LEU 545 CO 0.00 0.23 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.52 2ce9 s ILE 546 N -0.22 3.30 -0.07 6.68 1.01 -0.01 -0.41 121.20 131.48 2ce9 s ILE 546 Ca 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 60.65 60.05 2ce9 s ILE 546 Cb -0.11 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 40.03 2ce9 s ILE 546 CO 0.02 0.57 -0.06 -0.69 0.00 0.00 0.00 174.94 174.77 2ce9 s VAL 547 N -0.36 0.74 0.26 2.92 1.01 0.08 -0.90 120.40 124.16 2ce9 s VAL 547 Ca 0.04 -0.20 0.05 0.00 0.00 0.00 0.00 61.98 61.87 2ce9 s VAL 547 Cb -0.12 -0.76 -0.06 0.00 0.00 0.00 0.00 36.38 35.44 2ce9 s VAL 547 CO 0.02 0.29 -0.01 -0.83 0.00 0.00 0.00 175.10 174.57 2ce9 s GLY 548 N 1.16 1.72 0.00 4.51 0.00 -0.54 -0.57 107.32 113.60 2ce9 s GLY 548 Ca -0.07 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.80 2ce9 s GLY 548 CO -0.01 -1.75 0.00 0.61 0.00 0.00 0.00 173.10 171.95 2ce9 n GLY 549 N -0.51 0.93 2.54 0.20 0.00 -1.24 -0.54 105.19 106.57 2ce9 n GLY 549 Ca -0.05 -0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 3.45 -3.58 1.61 1.02 -0.20 -1.01 120.64 121.93 2ce9 n GLU 550 Ca 0.00 -2.58 -0.07 0.00 -0.02 0.00 0.00 57.16 54.49 2ce9 n GLU 550 Cb 0.00 -2.99 -0.02 0.00 -0.02 0.00 0.00 31.44 28.42 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 2.12 -1.76 -2.43 0.62 0.00 -1.11 -4.76 121.76 114.42 2ce9 s ALA 551 Ca 0.57 0.69 0.28 0.00 0.00 0.00 0.00 51.96 53.50 2ce9 s ALA 551 Cb 0.16 0.51 1.06 0.00 0.00 0.00 0.00 23.12 24.85 2ce9 s ALA 551 CO -0.07 -0.81 1.75 -1.13 0.00 0.00 0.00 175.76 175.50 2ce9 n SER 552 N -0.33 1.41 -4.56 0.00 3.41 -1.20 -3.97 113.62 108.39 2ce9 n SER 552 Ca -0.08 -1.44 -0.34 0.00 -0.26 0.00 0.00 58.87 56.75 2ce9 n SER 552 Cb 0.62 0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 2ce9 n SER 552 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2ce9 s THR 553 N -2.03 3.79 -0.16 6.66 -4.23 -1.26 -0.14 115.64 118.27 2ce9 s THR 553 Ca 0.37 -0.43 -0.09 0.00 -1.18 0.00 0.00 61.69 60.37 2ce9 s THR 553 Cb 0.21 -2.59 -0.05 0.00 1.34 0.00 0.00 72.50 71.42 2ce9 s THR 553 CO 0.35 0.57 0.14 -0.76 -0.54 0.00 0.00 174.62 174.38 2ce9 s LEU 554 N -0.45 4.29 -0.08 4.79 1.43 0.45 -4.62 118.68 124.48 2ce9 s LEU 554 Ca 0.07 0.35 -0.04 0.00 -1.03 0.00 0.00 54.13 53.48 2ce9 s LEU 554 Cb -0.12 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 2ce9 s LEU 554 CO 0.02 0.27 0.09 -0.94 0.23 0.00 0.00 176.35 176.03 2ce9 s SER 555 N -0.22 5.95 -0.21 2.29 1.04 0.26 -0.76 113.70 122.04 2ce9 s SER 555 Ca 0.11 0.32 -0.02 0.00 0.48 0.00 0.00 55.95 56.84 2ce9 s SER 555 Cb -0.12 -1.83 0.00 0.00 0.10 0.00 0.00 66.02 64.18 2ce9 s SER 555 CO 0.01 0.37 -0.09 -0.63 0.98 0.00 0.00 173.24 173.88 2ce9 s ILE 556 N -1.04 2.96 -0.17 -1.02 1.01 0.06 -0.74 121.20 122.26 2ce9 s ILE 556 Ca 0.17 -0.65 -0.03 0.00 0.00 0.00 0.00 60.65 60.14 2ce9 s ILE 556 Cb -0.12 -2.33 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 2ce9 s ILE 556 CO 0.06 0.44 -0.07 0.26 0.00 0.00 0.00 174.94 175.64 2ce9 s TRP 557 N 1.42 2.93 -0.26 3.97 0.52 0.45 -0.50 118.94 127.46 2ce9 s TRP 557 Ca 0.05 -0.67 -0.29 0.00 0.02 0.00 0.00 56.10 55.21 2ce9 s TRP 557 Cb -0.14 -1.98 0.01 0.00 -1.15 0.00 0.00 33.47 30.20 2ce9 s TRP 557 CO -0.06 -0.30 1.16 0.34 0.02 0.00 0.00 176.95 178.10 2ce9 s ASP 558 N 0.83 6.92 0.06 2.95 2.15 0.19 -1.58 116.67 128.18 2ce9 s ASP 558 Ca -0.02 1.30 0.18 0.00 0.43 0.00 0.00 52.55 54.45 2ce9 s ASP 558 Cb -0.15 -2.54 -0.14 0.00 -0.30 0.00 0.00 42.92 39.79 2ce9 s ASP 558 CO 0.01 -0.85 0.77 0.18 -0.17 0.00 0.00 175.17 175.12 2ce9 n LEU 559 N 6.84 0.71 -0.25 -1.34 4.77 -0.00 -2.39 117.00 125.34 2ce9 n LEU 559 Ca 0.13 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.42 2ce9 n LEU 559 Cb 0.46 0.07 0.13 0.00 -2.33 0.00 0.00 43.42 41.75 2ce9 n LEU 559 CO 0.58 0.09 1.10 0.00 -1.33 0.00 0.00 177.39 177.83 2ce9 h ALA 560 N 1.56 0.99 -2.25 -1.18 0.00 -1.92 -3.40 119.26 113.05 2ce9 h ALA 560 Ca -0.15 0.03 -0.55 0.00 0.00 0.00 0.00 54.91 54.25 2ce9 h ALA 560 Cb 1.47 -0.10 0.21 0.00 0.00 0.00 0.00 17.79 19.36 2ce9 h ALA 560 CO 0.03 0.04 -0.64 0.00 0.00 0.00 0.00 179.25 178.68 2ce9 n ALA 561 N -2.38 -2.48 -3.24 0.00 0.00 -1.26 -4.95 120.51 106.20 2ce9 n ALA 561 Ca 0.11 -0.47 -0.46 0.00 0.00 0.00 0.00 53.44 52.61 2ce9 n ALA 561 Cb 0.23 -1.75 -0.02 0.00 0.00 0.00 0.00 19.45 17.91 2ce9 n ALA 561 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2ce9 s PRO 562 N -3.11 3.68 0.00 0.00 0.04 -1.26 -3.61 135.00 130.73 2ce9 s PRO 562 Ca 0.58 -2.40 0.00 0.00 0.04 0.00 0.00 61.00 59.23 2ce9 s PRO 562 Cb -0.26 -4.56 0.00 0.00 0.04 0.00 0.00 34.50 29.72 2ce9 s PRO 562 CO 0.65 -1.40 0.00 0.25 0.04 0.00 0.00 177.00 176.55 2ce9 n THR 563 N 4.18 0.00 -0.25 1.26 -2.24 -1.26 -5.11 114.28 110.85 2ce9 n THR 563 Ca 0.18 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.87 2ce9 n THR 563 Cb 0.47 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.69 2ce9 n THR 563 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2ce9 n PRO 564 N 0.00 0.00 -3.71 -0.78 -0.02 -1.24 -5.02 135.00 124.24 2ce9 n PRO 564 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.36 2ce9 n PRO 564 Cb 0.00 -0.19 -0.10 0.00 -0.02 0.00 0.00 33.50 33.19 2ce9 n PRO 564 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2ce9 s ARG 565 N -0.15 0.47 -0.36 -0.52 3.52 -1.00 -5.01 118.95 115.90 2ce9 s ARG 565 Ca 0.12 0.72 -0.28 0.00 -0.13 0.00 0.00 55.73 56.16 2ce9 s ARG 565 Cb -0.17 0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.32 2ce9 s ARG 565 CO 0.10 -0.11 1.81 0.42 -0.81 0.00 0.00 175.30 176.71 2ce9 s ILE 566 N 0.81 3.46 0.11 4.11 1.01 -1.26 -0.64 121.20 128.80 2ce9 s ILE 566 Ca -0.05 0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.90 2ce9 s ILE 566 Cb -0.05 -3.67 -0.05 0.00 0.01 0.00 0.00 42.46 38.70 2ce9 s ILE 566 CO -0.06 -0.46 1.53 0.50 0.00 0.00 0.00 174.94 176.45 2ce9 h LYS 567 N 13.16 0.63 -2.09 2.79 3.64 -1.13 -3.47 116.57 130.10 2ce9 h LYS 567 Ca -0.33 -0.22 0.22 0.00 -1.27 0.00 0.00 60.65 59.05 2ce9 h LYS 567 Cb 1.17 -0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.85 2ce9 h LYS 567 CO 1.05 0.78 0.58 0.00 -2.27 0.00 0.00 179.45 179.59 2ce9 s ALA 568 N -4.88 -1.82 0.02 5.00 0.00 -1.01 -5.03 121.76 114.05 2ce9 s ALA 568 Ca -0.13 0.28 0.04 0.00 0.00 0.00 0.00 51.96 52.16 2ce9 s ALA 568 Cb 0.09 0.56 -0.02 0.00 0.00 0.00 0.00 23.12 23.75 2ce9 s ALA 568 CO 0.79 -1.05 -0.13 -1.21 0.00 0.00 0.00 175.76 174.16 2ce9 s GLU 569 N -3.04 0.91 -0.20 0.00 2.02 -1.26 -0.76 118.70 116.36 2ce9 s GLU 569 Ca 0.13 -0.62 -0.06 0.00 0.02 0.00 0.00 54.97 54.44 2ce9 s GLU 569 Cb 0.00 -0.89 -0.03 0.00 0.10 0.00 0.00 34.13 33.32 2ce9 s GLU 569 CO 0.01 0.23 0.02 -0.51 0.02 0.00 0.00 175.26 175.02 2ce9 s LEU 570 N -0.83 3.39 -0.33 1.80 1.43 0.06 -4.94 118.68 119.25 2ce9 s LEU 570 Ca 0.02 -0.14 -0.06 0.00 -1.03 0.00 0.00 54.13 52.92 2ce9 s LEU 570 Cb -0.07 -1.86 0.04 0.00 0.03 0.00 0.00 46.19 44.33 2ce9 s LEU 570 CO 0.01 0.08 0.09 -0.89 0.23 0.00 0.00 176.35 175.86 2ce9 s THR 571 N 0.91 3.71 0.51 5.49 2.01 -1.26 -0.41 115.64 126.60 2ce9 s THR 571 Ca 0.02 -1.10 -0.04 0.00 0.31 0.00 0.00 61.69 60.88 2ce9 s THR 571 Cb -0.14 -3.08 -0.01 0.00 0.01 0.00 0.00 72.50 69.28 2ce9 s THR 571 CO 0.02 -0.13 0.80 -0.55 -0.69 0.00 0.00 174.62 174.07 2ce9 s SER 572 N 1.40 5.91 0.00 3.53 0.15 0.80 -5.00 113.70 120.50 2ce9 s SER 572 Ca -0.01 0.70 0.23 0.00 0.70 0.00 0.00 55.95 57.56 2ce9 s SER 572 Cb -0.19 -1.88 0.11 0.00 -1.71 0.00 0.00 66.02 62.35 2ce9 s SER 572 CO 0.02 -0.78 1.13 -1.54 1.20 0.00 0.00 173.24 173.27 2ce9 n SER 573 N -2.33 0.74 -4.78 5.45 3.41 -1.26 -4.79 113.62 110.06 2ce9 n SER 573 Ca 0.02 -0.61 -0.37 0.00 -0.26 0.00 0.00 58.87 57.66 2ce9 n SER 573 Cb 0.57 0.66 -0.04 0.00 -0.26 0.00 0.00 64.21 65.13 2ce9 n SER 573 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ce9 s ALA 574 N -3.02 3.12 0.12 7.33 0.00 -1.26 -4.97 121.76 123.08 2ce9 s ALA 574 Ca 0.09 0.71 0.22 0.00 0.00 0.00 0.00 51.96 52.98 2ce9 s ALA 574 Cb 0.17 -3.27 0.82 0.00 0.00 0.00 0.00 23.12 20.84 2ce9 s ALA 574 CO 0.79 -0.19 1.79 -1.00 0.00 0.00 0.00 175.76 177.15 2ce9 h PRO 575 N 2.63 0.00 -3.53 0.00 0.14 -1.91 -3.38 132.00 125.95 2ce9 h PRO 575 Ca -0.48 0.00 -0.13 0.00 0.14 0.00 0.00 66.00 65.53 2ce9 h PRO 575 Cb 1.21 0.00 -0.19 0.00 0.14 0.00 0.00 31.00 32.16 2ce9 h PRO 575 CO 0.63 0.27 -0.45 0.00 0.14 0.00 0.00 178.00 178.58 2ce9 s ALA 576 N -3.61 -0.33 -0.16 -0.56 0.00 -1.26 -2.77 121.76 113.07 2ce9 s ALA 576 Ca 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.73 2ce9 s ALA 576 Cb 0.10 0.17 -0.03 0.00 0.00 0.00 0.00 23.12 23.37 2ce9 s ALA 576 CO 0.65 -0.27 -0.03 0.00 0.00 0.00 0.00 175.76 176.11 2ce9 n TYR 578 N 3.66 0.00 -3.59 0.00 4.01 -0.10 -3.62 117.16 117.50 2ce9 n TYR 578 Ca -0.17 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.45 2ce9 n TYR 578 Cb 0.52 -0.30 -0.06 0.00 -0.31 0.00 0.00 39.34 39.19 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 -3.20 -1.91 0.15 -0.72 0.00 -1.25 -4.66 121.76 110.16 2ce9 s ALA 579 Ca -0.02 1.68 0.07 0.00 0.00 0.00 0.00 51.96 53.69 2ce9 s ALA 579 Cb 0.13 -0.90 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 2ce9 s ALA 579 CO 0.82 -0.29 -0.15 -0.51 0.00 0.00 0.00 175.76 175.62 2ce9 s LEU 580 N -0.54 2.44 -0.02 0.00 1.43 -1.26 -0.86 118.68 119.87 2ce9 s LEU 580 Ca -0.01 -0.87 -0.07 0.00 -1.03 0.00 0.00 54.13 52.16 2ce9 s LEU 580 Cb -0.02 -0.65 0.01 0.00 0.03 0.00 0.00 46.19 45.55 2ce9 s LEU 580 CO -0.00 -0.12 0.15 0.00 0.23 0.00 0.00 176.35 176.61 2ce9 s ALA 581 N -2.28 -0.35 -0.03 4.21 0.00 -0.57 -4.93 121.76 117.82 2ce9 s ALA 581 Ca 0.13 0.09 0.04 0.00 0.00 0.00 0.00 51.96 52.22 2ce9 s ALA 581 Cb -0.04 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 2ce9 s ALA 581 CO 0.05 -0.16 -0.15 0.42 0.00 0.00 0.00 175.76 175.92 2ce9 s ILE 582 N -0.83 3.03 0.54 0.00 1.01 -1.26 -0.73 121.20 122.96 2ce9 s ILE 582 Ca -0.09 -0.81 -0.21 0.00 0.00 0.00 0.00 60.65 59.55 2ce9 s ILE 582 Cb -0.05 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 40.16 2ce9 s ILE 582 CO 0.01 0.54 1.21 -0.94 0.00 0.00 0.00 174.94 175.76 2ce9 s SER 583 N -0.88 5.55 0.42 3.58 1.04 -0.47 -4.93 113.70 118.01 2ce9 s SER 583 Ca 0.12 2.40 0.14 0.00 0.48 0.00 0.00 55.95 59.09 2ce9 s SER 583 Cb -0.11 -2.60 1.00 0.00 0.10 0.00 0.00 66.02 64.41 2ce9 s SER 583 CO 0.02 -1.35 1.94 -0.65 0.98 0.00 0.00 173.24 174.17 2ce9 h PRO 584 N 1.35 0.45 0.00 4.02 0.11 -1.94 0.21 132.00 136.20 2ce9 h PRO 584 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2ce9 h PRO 584 Cb 1.28 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2ce9 h PRO 584 CO 0.57 0.30 0.00 -0.40 -0.21 0.00 0.00 178.00 178.26 2ce9 n ASP 585 N -4.48 0.00 0.00 -2.05 5.68 -1.26 -4.90 116.55 109.53 2ce9 n ASP 585 Ca 0.13 -1.23 0.00 0.00 -0.50 0.00 0.00 54.79 53.18 2ce9 n ASP 585 Cb 0.45 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 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 -0.86 -2.44 0.12 -1.12 7.64 0.06 -4.87 113.62 112.15 2ce9 n SER 586 Ca 0.16 0.00 0.10 0.00 1.01 0.00 0.00 58.87 60.14 2ce9 n SER 586 Cb 0.08 -1.60 0.02 0.00 -1.01 0.00 0.00 64.21 61.70 2ce9 n SER 586 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2ce9 h LYS 587 N 0.99 0.00 -4.80 1.43 1.57 -1.91 -3.47 116.57 110.38 2ce9 h LYS 587 Ca 0.00 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 58.40 2ce9 h LYS 587 Cb 0.26 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.30 2ce9 h LYS 587 CO 0.00 0.07 -0.77 0.08 -0.57 0.00 0.00 179.45 178.25 2ce9 s VAL 588 N -3.25 0.75 -0.12 0.50 1.01 -1.26 -1.75 120.40 116.29 2ce9 s VAL 588 Ca 0.01 -0.59 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 2ce9 s VAL 588 Cb 0.08 -0.67 -0.02 0.00 0.00 0.00 0.00 36.38 35.78 2ce9 s VAL 588 CO 0.77 0.08 -0.11 0.00 0.00 0.00 0.00 175.10 175.83 2ce9 s PHE 590 N 0.11 3.46 -0.13 0.00 0.08 0.09 -0.43 117.98 121.16 2ce9 s PHE 590 Ca -0.05 0.41 0.03 0.00 0.12 0.00 0.00 56.93 57.44 2ce9 s PHE 590 Cb -0.14 -2.13 0.01 0.00 -0.57 0.00 0.00 43.02 40.19 2ce9 s PHE 590 CO 0.04 0.40 -0.21 0.45 -0.10 0.00 0.00 175.22 175.79 2ce9 s SER 591 N 0.03 3.00 -0.47 1.36 0.15 0.29 -1.51 113.70 116.55 2ce9 s SER 591 Ca 0.11 -0.57 -0.29 0.00 0.70 0.00 0.00 55.95 55.90 2ce9 s SER 591 Cb -0.11 -1.38 0.03 0.00 -1.71 0.00 0.00 66.02 62.84 2ce9 s SER 591 CO 0.00 0.08 1.15 0.00 1.20 0.00 0.00 173.24 175.68 2ce9 h SER 594 N 1.14 0.00 -0.05 0.00 4.64 -1.35 -1.88 113.55 116.05 2ce9 h SER 594 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 2ce9 h SER 594 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 2ce9 h SER 594 CO 0.64 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 175.72 2ce9 n ASP 595 N -3.23 0.88 0.00 4.97 5.68 -1.26 -3.42 116.55 120.16 2ce9 n ASP 595 Ca -0.02 -1.43 0.00 0.00 -0.50 0.00 0.00 54.79 52.84 2ce9 n ASP 595 Cb 0.17 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 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 1.04 3.21 3.77 6.12 0.00 -0.75 -4.44 105.19 114.13 2ce9 n GLY 596 Ca 0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.03 5.79 -0.35 1.61 0.01 -1.26 -4.07 114.94 116.64 2ce9 s ASN 597 Ca 0.00 2.28 -0.10 0.00 -0.71 0.00 0.00 52.86 54.34 2ce9 s ASN 597 Cb 0.00 -2.59 0.02 0.00 0.41 0.00 0.00 41.25 39.08 2ce9 s ASN 597 CO 0.00 -1.18 0.17 -0.63 -1.51 0.00 0.00 177.10 173.96 2ce9 s ILE 598 N -1.64 4.46 0.19 0.60 -1.09 -0.17 -1.05 121.20 122.50 2ce9 s ILE 598 Ca 0.70 -0.76 -0.30 0.00 -2.23 0.00 0.00 60.65 58.06 2ce9 s ILE 598 Cb -0.27 -3.43 -0.08 0.00 -1.58 0.00 0.00 42.46 37.10 2ce9 s ILE 598 CO 0.32 -0.13 0.96 0.00 -1.23 0.00 0.00 174.94 174.86 2ce9 s ALA 599 N 1.55 3.31 -0.24 9.38 0.00 0.15 -0.34 121.76 135.57 2ce9 s ALA 599 Ca 0.02 0.62 -0.01 0.00 0.00 0.00 0.00 51.96 52.60 2ce9 s ALA 599 Cb -0.18 -3.25 0.03 0.00 0.00 0.00 0.00 23.12 19.72 2ce9 s ALA 599 CO 0.06 0.09 -0.09 0.08 0.00 0.00 0.00 175.76 175.89 2ce9 s VAL 600 N -0.70 2.64 -0.13 0.00 1.01 0.35 -0.54 120.40 123.02 2ce9 s VAL 600 Ca 0.44 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 61.32 2ce9 s VAL 600 Cb -0.25 -2.32 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 2ce9 s VAL 600 CO 0.32 0.24 -0.05 0.26 0.00 0.00 0.00 175.10 175.87 2ce9 s TRP 601 N 1.29 3.00 -0.50 5.22 0.52 0.42 -0.30 118.94 128.60 2ce9 s TRP 601 Ca -0.00 -0.19 -0.26 0.00 0.02 0.00 0.00 56.10 55.67 2ce9 s TRP 601 Cb -0.16 -1.87 0.03 0.00 -1.15 0.00 0.00 33.47 30.31 2ce9 s TRP 601 CO -0.06 0.09 1.00 0.34 0.02 0.00 0.00 176.95 178.34 2ce9 s ASP 602 N -0.05 6.48 0.16 2.95 -1.08 0.45 -1.09 116.67 124.49 2ce9 s ASP 602 Ca 0.01 0.07 -0.16 0.00 -0.52 0.00 0.00 52.55 51.95 2ce9 s ASP 602 Cb -0.13 -2.48 0.09 0.00 -1.46 0.00 0.00 42.92 38.94 2ce9 s ASP 602 CO 0.03 -1.18 1.74 -0.07 0.52 0.00 0.00 175.17 176.21 2ce9 h LEU 603 N 10.94 0.06 -0.32 -1.34 3.38 -1.64 -1.56 115.31 124.83 2ce9 h LEU 603 Ca -0.24 0.06 0.07 0.00 0.09 0.00 0.00 57.88 57.85 2ce9 h LEU 603 Cb 1.07 0.06 -0.08 0.00 0.09 0.00 0.00 40.66 41.80 2ce9 h LEU 603 CO 1.08 0.07 -0.29 -0.74 0.09 0.00 0.00 178.44 178.64 2ce9 h HIS 604 N 0.24 -0.80 -0.26 1.13 2.76 -1.93 -3.04 115.15 113.25 2ce9 h HIS 604 Ca 0.18 0.05 0.00 0.00 -2.20 0.00 0.00 60.37 58.40 2ce9 h HIS 604 Cb 0.20 0.40 0.00 0.00 1.55 0.00 0.00 27.41 29.55 2ce9 h HIS 604 CO -0.18 -0.36 0.00 0.27 -1.30 0.00 0.00 177.93 176.36 2ce9 n ASN 605 N -5.40 3.72 -4.14 3.26 0.23 -1.22 -4.98 115.26 106.72 2ce9 n ASN 605 Ca 0.00 -2.90 -0.29 0.00 -0.53 0.00 0.00 54.58 50.87 2ce9 n ASN 605 Cb 0.32 -0.50 -0.06 0.00 -2.08 0.00 0.00 39.78 37.46 2ce9 n ASN 605 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2ce9 n GLN 606 N -0.42 -2.01 -4.71 -3.83 3.00 -0.60 -4.95 117.38 103.86 2ce9 n GLN 606 Ca 0.20 0.24 -0.27 0.00 -0.01 0.00 0.00 57.00 57.16 2ce9 n GLN 606 Cb 0.83 -4.00 -0.14 0.00 0.00 0.00 0.00 30.24 26.92 2ce9 n GLN 606 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.06 178.01 2ce9 s THR 607 N -4.17 1.78 -0.28 5.09 -4.23 -1.14 -4.89 115.64 107.79 2ce9 s THR 607 Ca 0.01 -1.24 -0.29 0.00 -1.18 0.00 0.00 61.69 58.99 2ce9 s THR 607 Cb -0.01 -1.54 0.01 0.00 1.34 0.00 0.00 72.50 72.30 2ce9 s THR 607 CO 0.95 0.24 1.14 -0.22 -0.54 0.00 0.00 174.62 176.19 2ce9 s LEU 608 N -1.19 3.98 -0.02 4.79 2.96 -1.26 -0.41 118.68 127.52 2ce9 s LEU 608 Ca 0.08 1.21 0.22 0.00 -0.22 0.00 0.00 54.13 55.42 2ce9 s LEU 608 Cb -0.09 -3.54 -0.32 0.00 0.50 0.00 0.00 46.19 42.74 2ce9 s LEU 608 CO 0.02 -0.88 0.52 1.33 -1.32 0.00 0.00 176.35 176.02 2ce9 n VAL 609 N 5.80 0.03 -3.58 1.68 0.24 0.59 -4.94 118.33 118.15 2ce9 n VAL 609 Ca 0.13 -0.48 -0.16 0.00 -2.04 0.00 0.00 64.34 61.78 2ce9 n VAL 609 Cb 0.47 0.02 -0.06 0.00 -1.47 0.00 0.00 33.84 32.79 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 -3.50 0.97 -0.08 7.34 3.52 -1.14 -5.03 118.95 121.03 2ce9 s ARG 610 Ca -0.07 0.09 0.01 0.00 -0.13 0.00 0.00 55.73 55.62 2ce9 s ARG 610 Cb 0.14 0.45 0.02 0.00 -1.56 0.00 0.00 34.95 34.00 2ce9 s ARG 610 CO 0.90 -0.31 -0.08 -1.14 -0.81 0.00 0.00 175.30 173.87 2ce9 s GLN 611 N -1.41 1.35 -0.38 5.12 0.74 -1.26 -0.50 119.66 123.32 2ce9 s GLN 611 Ca -0.11 -0.24 -0.20 0.00 0.05 0.00 0.00 55.36 54.87 2ce9 s GLN 611 Cb -0.01 -1.31 0.01 0.00 1.10 0.00 0.00 33.01 32.80 2ce9 s GLN 611 CO 0.07 -0.13 0.59 -0.06 -0.55 0.00 0.00 175.29 175.20 2ce9 s PHE 612 N 1.21 3.14 -0.08 1.67 0.08 0.54 -4.92 117.98 119.63 2ce9 s PHE 612 Ca -0.05 0.16 -0.01 0.00 0.12 0.00 0.00 56.93 57.14 2ce9 s PHE 612 Cb -0.14 -3.10 -0.03 0.00 -0.57 0.00 0.00 43.02 39.17 2ce9 s PHE 612 CO -0.02 -0.66 0.00 -0.65 -0.10 0.00 0.00 175.22 173.79 2ce9 s GLN 613 N 2.60 2.96 0.00 0.44 -0.21 -1.26 -1.00 119.66 123.19 2ce9 s GLN 613 Ca 0.21 -0.43 0.00 0.00 0.02 0.00 0.00 55.36 55.17 2ce9 s GLN 613 Cb -0.15 -2.78 0.00 0.00 1.00 0.00 0.00 33.01 31.08 2ce9 s GLN 613 CO 0.15 0.70 0.00 0.41 -2.12 0.00 0.00 175.29 174.43 2ce9 n GLY 614 N 2.06 0.02 3.69 3.09 0.00 -1.26 -4.94 105.19 107.84 2ce9 n GLY 614 Ca -0.18 0.16 -0.44 0.00 0.00 0.00 0.00 46.02 45.55 2ce9 n GLY 614 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2ce9 n HIS 615 N 0.00 2.32 0.38 1.61 8.25 -1.26 -4.89 115.22 121.64 2ce9 n HIS 615 Ca 0.00 0.38 0.11 0.00 -0.26 0.00 0.00 57.72 57.95 2ce9 n HIS 615 Cb 0.00 -2.50 0.26 0.00 1.12 0.00 0.00 29.99 28.87 2ce9 n HIS 615 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 2ce9 n THR 616 N 2.10 0.53 -3.92 1.59 -2.24 -1.26 -4.52 114.28 106.56 2ce9 n THR 616 Ca 0.11 -0.71 -0.11 0.00 -2.27 0.00 0.00 64.05 61.08 2ce9 n THR 616 Cb 0.32 0.76 -0.00 0.00 -2.10 0.00 0.00 70.33 69.31 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 -1.39 0.36 0.32 3.42 -1.08 -1.26 -4.95 116.67 112.08 2ce9 s ASP 617 Ca 0.39 -1.26 -0.28 0.00 -0.52 0.00 0.00 52.55 50.88 2ce9 s ASP 617 Cb 0.22 0.77 -0.13 0.00 -1.46 0.00 0.00 42.92 42.32 2ce9 s ASP 617 CO 0.30 -1.52 1.07 0.61 0.52 0.00 0.00 175.17 176.16 2ce9 n GLY 618 N -0.54 -0.06 3.66 2.66 0.00 -1.22 -3.31 105.19 106.37 2ce9 n GLY 618 Ca -0.05 0.30 -0.41 0.00 0.00 0.00 0.00 46.02 45.87 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 -1.09 3.56 -0.05 4.61 0.00 -0.92 -0.61 121.76 127.27 2ce9 s ALA 619 Ca 0.58 -0.19 0.22 0.00 0.00 0.00 0.00 51.96 52.57 2ce9 s ALA 619 Cb -0.65 -3.10 -0.33 0.00 0.00 0.00 0.00 23.12 19.04 2ce9 s ALA 619 CO 0.60 -0.67 0.46 -1.13 0.00 0.00 0.00 175.76 175.03 2ce9 n SER 620 N 5.32 0.02 -3.69 0.00 3.41 -0.37 -4.43 113.62 113.89 2ce9 n SER 620 Ca 0.01 0.01 -0.08 0.00 -0.26 0.00 0.00 58.87 58.55 2ce9 n SER 620 Cb 0.49 1.89 -0.02 0.00 -0.26 0.00 0.00 64.21 66.31 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 -3.69 0.00 0.31 0.00 2.07 -1.26 -2.12 121.20 116.51 2ce9 s ILE 622 Ca 0.08 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.21 2ce9 s ILE 622 Cb -0.03 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.57 2ce9 s ILE 622 CO -0.01 0.00 0.56 -0.62 -1.91 0.00 0.00 174.94 172.96 2ce9 s ASP 623 N -0.40 0.26 0.00 4.50 -1.08 -0.08 -4.89 116.67 114.98 2ce9 s ASP 623 Ca 0.00 -1.14 0.08 0.00 -0.52 0.00 0.00 52.55 50.97 2ce9 s ASP 623 Cb -0.03 0.68 -0.02 0.00 -1.46 0.00 0.00 42.92 42.09 2ce9 s ASP 623 CO -0.02 -1.32 -0.26 -0.63 0.52 0.00 0.00 175.17 173.46 2ce9 s ILE 624 N -3.33 2.07 0.98 4.11 1.01 -1.26 -0.73 121.20 124.04 2ce9 s ILE 624 Ca 0.23 -1.19 -0.12 0.00 0.00 0.00 0.00 60.65 59.57 2ce9 s ILE 624 Cb -0.02 -1.74 0.14 0.00 0.01 0.00 0.00 42.46 40.85 2ce9 s ILE 624 CO 0.13 0.51 0.87 -1.54 0.00 0.00 0.00 174.94 174.92 2ce9 n SER 625 N 2.24 -0.74 0.24 3.58 3.41 -0.03 -4.77 113.62 117.54 2ce9 n SER 625 Ca -0.16 0.28 0.06 0.00 -0.26 0.00 0.00 58.87 58.79 2ce9 n SER 625 Cb 0.51 -1.35 0.56 0.00 -0.26 0.00 0.00 64.21 63.67 2ce9 n SER 625 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2ce9 h ASN 626 N -1.95 0.00 0.50 4.04 -1.07 -1.87 -2.27 115.58 112.96 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 1.29 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.54 2ce9 h ASN 626 CO 0.40 0.12 -0.17 -0.90 0.07 0.00 0.00 177.43 176.95 2ce9 n ASP 627 N -4.39 0.42 0.00 6.14 5.68 -1.26 -4.94 116.55 118.20 2ce9 n ASP 627 Ca -0.03 -0.33 0.00 0.00 -0.50 0.00 0.00 54.79 53.93 2ce9 n ASP 627 Cb 0.19 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.09 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 1.36 0.54 0.00 6.12 0.00 -0.85 -4.91 105.19 107.46 2ce9 n GLY 628 Ca 0.11 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.20 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 -2.91 0.00 -4.63 2.61 -2.24 -1.26 -4.93 114.28 100.92 2ce9 n THR 629 Ca 0.00 -0.20 -0.23 0.00 -2.27 0.00 0.00 64.05 61.35 2ce9 n THR 629 Cb 0.00 0.78 -0.14 0.00 -2.10 0.00 0.00 70.33 68.87 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 -2.57 1.23 0.02 -0.78 -0.14 -1.26 -0.78 119.74 115.47 2ce9 s LYS 630 Ca 0.03 -0.72 0.06 0.00 -1.36 0.00 0.00 55.97 53.98 2ce9 s LYS 630 Cb 0.11 -1.24 -0.03 0.00 -1.68 0.00 0.00 37.83 34.98 2ce9 s LYS 630 CO 0.61 0.33 -0.14 -1.17 -0.76 0.00 0.00 175.35 174.23 2ce9 s LEU 631 N -0.78 2.83 -0.08 3.17 2.96 -0.63 -0.85 118.68 125.31 2ce9 s LEU 631 Ca 0.05 -0.31 0.03 0.00 -0.22 0.00 0.00 54.13 53.68 2ce9 s LEU 631 Cb -0.07 -1.64 0.01 0.00 0.50 0.00 0.00 46.19 44.99 2ce9 s LEU 631 CO 0.00 0.27 -0.15 0.26 -1.32 0.00 0.00 176.35 175.41 2ce9 s TRP 632 N -0.95 1.79 0.03 5.38 0.52 0.09 -1.19 118.94 124.61 2ce9 s TRP 632 Ca 0.16 -0.71 0.03 0.00 0.02 0.00 0.00 56.10 55.60 2ce9 s TRP 632 Cb -0.11 -1.27 -0.02 0.00 -1.15 0.00 0.00 33.47 30.92 2ce9 s TRP 632 CO 0.06 -0.34 -0.10 0.95 0.02 0.00 0.00 176.95 177.54 2ce9 s THR 633 N 0.64 0.75 0.18 2.01 -4.23 0.58 -0.90 115.64 114.66 2ce9 s THR 633 Ca -0.15 -0.86 0.11 0.00 -1.18 0.00 0.00 61.69 59.61 2ce9 s THR 633 Cb -0.16 -0.72 -0.04 0.00 1.34 0.00 0.00 72.50 72.92 2ce9 s THR 633 CO 0.04 -0.12 -0.20 -0.83 -0.54 0.00 0.00 174.62 172.97 2ce9 s GLY 634 N -1.09 1.71 0.19 3.99 0.00 -0.90 -0.43 107.32 110.78 2ce9 s GLY 634 Ca -0.03 -1.57 -0.03 0.00 0.00 0.00 0.00 44.72 43.09 2ce9 s GLY 634 CO 0.01 -1.59 0.16 -0.32 0.00 0.00 0.00 173.10 171.36 2ce9 s GLY 635 N -2.63 1.16 0.00 0.20 0.00 -0.61 -1.24 107.32 104.20 2ce9 s GLY 635 Ca 0.21 -1.49 0.13 0.00 0.00 0.00 0.00 44.72 43.56 2ce9 s GLY 635 CO 0.11 -1.26 1.47 1.04 0.00 0.00 0.00 173.10 174.45 2ce9 n LEU 636 N -0.24 0.22 -1.56 0.66 4.77 0.22 -2.10 117.00 118.98 2ce9 n LEU 636 Ca -0.01 -0.10 0.08 0.00 -0.03 0.00 0.00 56.01 55.95 2ce9 n LEU 636 Cb 0.65 -0.02 0.34 0.00 -2.33 0.00 0.00 43.42 42.06 2ce9 n LEU 636 CO 0.31 0.05 0.79 -0.90 -1.33 0.00 0.00 177.39 176.30 2ce9 n ASP 637 N -0.55 4.62 -1.25 -1.43 5.75 -1.26 -4.84 116.55 117.59 2ce9 n ASP 637 Ca 0.10 -2.51 -0.13 0.00 -0.01 0.00 0.00 54.79 52.24 2ce9 n ASP 637 Cb 0.08 -0.58 -0.02 0.00 -1.03 0.00 0.00 41.12 39.56 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 0.92 -4.17 -4.38 -1.12 4.13 -0.98 -4.92 115.26 104.73 2ce9 n ASN 638 Ca 0.24 0.11 -0.25 0.00 1.68 0.00 0.00 54.58 56.36 2ce9 n ASN 638 Cb 0.90 -3.14 -0.12 0.00 -1.54 0.00 0.00 39.78 35.88 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 -2.56 2.11 -0.11 3.41 -4.23 -1.25 -0.27 115.64 112.74 2ce9 s THR 639 Ca 0.00 -1.92 0.01 0.00 -1.18 0.00 0.00 61.69 58.61 2ce9 s THR 639 Cb 0.00 -1.96 -0.01 0.00 1.34 0.00 0.00 72.50 71.86 2ce9 s THR 639 CO 0.00 -0.15 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.08 2ce9 s VAL 640 N -1.67 2.85 -0.01 2.29 1.01 0.48 -1.57 120.40 123.77 2ce9 s VAL 640 Ca 0.17 -0.75 0.07 0.00 0.00 0.00 0.00 61.98 61.47 2ce9 s VAL 640 Cb -0.08 -2.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2ce9 s VAL 640 CO 0.08 0.54 -0.23 -0.13 0.00 0.00 0.00 175.10 175.36 2ce9 s ARG 641 N 0.15 1.81 0.07 2.72 0.52 0.43 -0.59 118.95 124.06 2ce9 s ARG 641 Ca -0.08 -0.82 0.03 0.00 -0.52 0.00 0.00 55.73 54.34 2ce9 s ARG 641 Cb -0.15 -1.77 -0.04 0.00 0.52 0.00 0.00 34.95 33.51 2ce9 s ARG 641 CO 0.05 0.48 0.05 -1.54 0.02 0.00 0.00 175.30 174.37 2ce9 s SER 642 N -0.58 5.38 0.02 0.23 1.04 -0.89 -0.31 113.70 118.58 2ce9 s SER 642 Ca 0.09 -0.04 0.03 0.00 0.48 0.00 0.00 55.95 56.50 2ce9 s SER 642 Cb -0.09 -1.41 -0.01 0.00 0.10 0.00 0.00 66.02 64.61 2ce9 s SER 642 CO -0.01 0.19 -0.10 0.26 0.98 0.00 0.00 173.24 174.56 2ce9 s TRP 643 N -1.33 0.84 -0.36 5.02 0.52 -0.34 -0.59 118.94 122.70 2ce9 s TRP 643 Ca 0.27 -0.27 -0.20 0.00 0.02 0.00 0.00 56.10 55.92 2ce9 s TRP 643 Cb -0.12 -0.52 0.00 0.00 -1.15 0.00 0.00 33.47 31.68 2ce9 s TRP 643 CO 0.20 -0.01 0.62 0.34 0.02 0.00 0.00 176.95 178.11 2ce9 s ASP 644 N -0.73 6.41 0.40 2.95 -1.08 0.50 -1.60 116.67 123.50 2ce9 s ASP 644 Ca -0.00 0.11 0.16 0.00 -0.52 0.00 0.00 52.55 52.30 2ce9 s ASP 644 Cb -0.06 -2.32 0.84 0.00 -1.46 0.00 0.00 42.92 39.92 2ce9 s ASP 644 CO 0.00 -0.58 1.85 -0.07 0.52 0.00 0.00 175.17 176.90 2ce9 h LEU 645 N 9.34 0.00 0.02 -1.34 3.38 -1.28 0.21 115.31 125.64 2ce9 h LEU 645 Ca -0.27 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.70 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 0.33 -0.01 0.03 0.09 0.00 0.00 178.44 179.71 2ce9 h ARG 646 N 0.00 -0.03 0.00 1.13 2.47 -1.93 -3.37 114.38 112.64 2ce9 h ARG 646 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2ce9 h ARG 646 Cb 0.65 0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.97 2ce9 h ARG 646 CO 0.04 0.56 -0.15 0.93 0.56 0.00 0.00 179.97 181.91 2ce9 h GLU 647 N -0.97 0.00 0.00 0.04 5.08 -1.94 -3.47 114.58 113.31 2ce9 h GLU 647 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ce9 h GLU 647 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 2ce9 h GLU 647 CO 0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.43 2ce9 n GLY 648 N 1.18 0.55 3.81 -3.84 0.00 0.06 -5.03 105.19 101.92 2ce9 n GLY 648 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 2ce9 n GLY 648 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ce9 s ARG 649 N -0.15 2.90 0.23 1.61 1.70 -1.23 -4.84 118.95 119.18 2ce9 s ARG 649 Ca 0.00 -1.01 -0.30 0.00 -0.47 0.00 0.00 55.73 53.95 2ce9 s ARG 649 Cb 0.00 -2.58 -0.09 0.00 -0.57 0.00 0.00 34.95 31.72 2ce9 s ARG 649 CO 0.00 0.42 1.11 -1.14 -1.08 0.00 0.00 175.30 174.61 2ce9 s GLN 650 N -3.64 4.61 -0.14 3.89 0.74 -1.26 -0.37 119.66 123.49 2ce9 s GLN 650 Ca 0.32 1.77 -0.11 0.00 0.05 0.00 0.00 55.36 57.39 2ce9 s GLN 650 Cb -0.08 -3.23 -0.06 0.00 1.10 0.00 0.00 33.01 30.73 2ce9 s GLN 650 CO 0.24 0.14 -0.25 1.28 -0.55 0.00 0.00 175.29 176.15 2ce9 n LEU 651 N 1.79 1.53 -4.38 3.68 4.77 0.24 -4.90 117.00 119.73 2ce9 n LEU 651 Ca 0.01 0.26 -0.23 0.00 -0.03 0.00 0.00 56.01 56.01 2ce9 n LEU 651 Cb 0.45 -0.60 -0.11 0.00 -2.33 0.00 0.00 43.42 40.84 2ce9 n LEU 651 CO 0.54 -0.02 -0.49 -1.10 -1.33 0.00 0.00 177.39 174.99 2ce9 s GLN 652 N -2.50 1.40 -0.07 3.23 -0.21 -1.21 -4.97 119.66 115.34 2ce9 s GLN 652 Ca -0.24 -1.51 -0.03 0.00 0.02 0.00 0.00 55.36 53.61 2ce9 s GLN 652 Cb 0.07 -1.51 0.04 0.00 1.00 0.00 0.00 33.01 32.61 2ce9 s GLN 652 CO 0.32 0.30 0.14 -1.14 -2.12 0.00 0.00 175.29 172.79 2ce9 s GLN 653 N -2.95 0.03 -0.17 2.91 0.74 -1.26 -2.10 119.66 116.87 2ce9 s GLN 653 Ca 0.20 0.47 -0.02 0.00 0.05 0.00 0.00 55.36 56.05 2ce9 s GLN 653 Cb -0.06 -0.27 -0.02 0.00 1.10 0.00 0.00 33.01 33.76 2ce9 s GLN 653 CO 0.09 -0.26 -0.08 -1.01 -0.55 0.00 0.00 175.29 173.48 2ce9 s HIS 654 N 1.90 2.92 -0.17 1.67 3.76 0.24 -4.96 115.29 120.65 2ce9 s HIS 654 Ca -0.01 -0.64 -0.07 0.00 -0.15 0.00 0.00 55.06 54.20 2ce9 s HIS 654 Cb -0.12 -1.96 -0.04 0.00 1.11 0.00 0.00 32.58 31.57 2ce9 s HIS 654 CO -0.05 -0.27 0.06 -0.51 -0.85 0.00 0.00 174.74 173.12 2ce9 s ASP 655 N 0.71 5.64 0.33 1.40 1.01 -1.26 -0.39 116.67 124.11 2ce9 s ASP 655 Ca -0.04 0.12 0.06 0.00 0.71 0.00 0.00 52.55 53.40 2ce9 s ASP 655 Cb -0.15 -1.92 -0.07 0.00 1.01 0.00 0.00 42.92 41.80 2ce9 s ASP 655 CO 0.02 0.22 -0.00 -0.36 0.21 0.00 0.00 175.17 175.25 2ce9 s PHE 656 N 0.10 2.11 -1.86 4.23 0.08 0.63 -5.02 117.98 118.26 2ce9 s PHE 656 Ca 0.05 -0.77 0.27 0.00 0.12 0.00 0.00 56.93 56.60 2ce9 s PHE 656 Cb -0.12 -1.34 0.90 0.00 -0.57 0.00 0.00 43.02 41.89 2ce9 s PHE 656 CO 0.01 0.24 1.66 0.25 -0.10 0.00 0.00 175.22 177.27 2ce9 n THR 657 N -0.72 0.00 -4.26 0.64 -2.24 -1.26 -4.84 114.28 101.61 2ce9 n THR 657 Ca -0.04 -0.13 -0.15 0.00 -2.27 0.00 0.00 64.05 61.46 2ce9 n THR 657 Cb 0.65 0.31 -0.10 0.00 -2.10 0.00 0.00 70.33 69.10 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 -2.41 0.77 0.53 3.42 1.04 -1.26 -5.04 113.70 110.75 2ce9 s SER 658 Ca 0.28 -1.45 -0.21 0.00 0.48 0.00 0.00 55.95 55.04 2ce9 s SER 658 Cb 0.20 0.35 -0.05 0.00 0.10 0.00 0.00 66.02 66.61 2ce9 s SER 658 CO 0.48 -0.85 1.25 -1.10 0.98 0.00 0.00 173.24 174.00 2ce9 s GLN 659 N -4.00 3.33 -0.20 4.02 -0.21 -1.26 -4.43 119.66 116.90 2ce9 s GLN 659 Ca 0.38 1.96 -0.11 0.00 0.02 0.00 0.00 55.36 57.61 2ce9 s GLN 659 Cb 0.06 -2.23 -0.05 0.00 1.00 0.00 0.00 33.01 31.80 2ce9 s GLN 659 CO 0.15 -0.96 0.19 0.42 -2.12 0.00 0.00 175.29 172.97 2ce9 s ILE 660 N -1.47 5.36 -0.14 1.08 1.09 -0.89 -1.02 121.20 125.21 2ce9 s ILE 660 Ca 0.70 0.29 0.15 0.00 -1.10 0.00 0.00 60.65 60.69 2ce9 s ILE 660 Cb -0.33 -3.53 -0.21 0.00 -1.06 0.00 0.00 42.46 37.33 2ce9 s ILE 660 CO 0.39 0.39 0.10 0.49 -0.10 0.00 0.00 174.94 176.21 2ce9 n PHE 661 N 3.80 0.00 -3.74 3.97 3.72 -0.21 -4.14 117.46 120.86 2ce9 n PHE 661 Ca -0.14 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.15 2ce9 n PHE 661 Cb 0.52 -0.74 -0.07 0.00 -0.94 0.00 0.00 39.48 38.25 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 -4.85 -0.12 0.19 4.37 1.04 -1.11 -4.49 113.70 108.73 2ce9 s SER 662 Ca -0.08 -0.27 -0.21 0.00 0.48 0.00 0.00 55.95 55.88 2ce9 s SER 662 Cb 0.06 0.38 0.05 0.00 0.10 0.00 0.00 66.02 66.61 2ce9 s SER 662 CO 0.67 -0.68 0.60 -1.48 0.98 0.00 0.00 173.24 173.32 2ce9 s LEU 663 N -2.32 -0.30 -0.27 2.42 0.05 -1.26 -0.04 118.68 116.96 2ce9 s LEU 663 Ca -0.02 -0.26 -0.25 0.00 0.05 0.00 0.00 54.13 53.66 2ce9 s LEU 663 Cb 0.01 2.48 0.09 0.00 -2.05 0.00 0.00 46.19 46.71 2ce9 s LEU 663 CO -0.06 -1.06 0.81 -0.83 -0.55 0.00 0.00 176.35 174.66 2ce9 s GLY 664 N -2.82 -0.42 -0.26 -3.48 0.00 0.07 -4.73 107.32 95.68 2ce9 s GLY 664 Ca 0.05 2.23 -0.10 0.00 0.00 0.00 0.00 44.72 46.90 2ce9 s GLY 664 CO -0.06 1.79 0.16 -0.47 0.00 0.00 0.00 173.10 174.52 2ce9 s TYR 665 N 0.36 3.25 0.07 1.90 5.04 -1.26 -0.55 117.35 126.16 2ce9 s TYR 665 Ca 0.01 0.11 -0.31 0.00 -2.44 0.00 0.00 57.07 54.44 2ce9 s TYR 665 Cb -0.05 -2.31 -0.10 0.00 0.35 0.00 0.00 41.96 39.85 2ce9 s TYR 665 CO -0.02 -0.08 1.89 0.00 -1.34 0.00 0.00 175.55 176.01 2ce9 h PRO 667 N 9.40 0.00 -0.26 0.00 0.11 -1.86 0.30 132.00 139.68 2ce9 h PRO 667 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2ce9 h PRO 667 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2ce9 h PRO 667 CO 0.94 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.98 2ce9 n THR 668 N -2.95 0.33 -0.65 -1.15 -2.24 -1.26 -4.79 114.28 101.56 2ce9 n THR 668 Ca -0.02 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 2ce9 n THR 668 Cb 0.09 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.15 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 1.36 -2.82 3.42 3.38 0.00 0.10 -4.98 105.19 105.65 2ce9 n GLY 669 Ca 0.18 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.44 2ce9 n GLY 669 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ce9 n GLU 670 N -0.42 0.00 -4.67 1.61 1.02 -1.26 -4.75 120.64 112.17 2ce9 n GLU 670 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 2ce9 n GLU 670 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 31.44 31.26 2ce9 n GLU 670 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2ce9 s TRP 671 N -0.35 1.38 -0.19 -0.32 0.52 -1.26 0.23 118.94 118.95 2ce9 s TRP 671 Ca 0.00 -0.34 0.01 0.00 0.02 0.00 0.00 56.10 55.79 2ce9 s TRP 671 Cb 0.00 -0.93 0.02 0.00 -1.15 0.00 0.00 33.47 31.41 2ce9 s TRP 671 CO 0.00 -0.10 -0.19 -1.17 0.02 0.00 0.00 176.95 175.51 2ce9 s LEU 672 N -0.06 2.24 0.07 2.99 2.96 -0.18 -1.11 118.68 125.59 2ce9 s LEU 672 Ca -0.00 -0.68 -0.21 0.00 -0.22 0.00 0.00 54.13 53.02 2ce9 s LEU 672 Cb -0.09 -1.50 -0.06 0.00 0.50 0.00 0.00 46.19 45.04 2ce9 s LEU 672 CO 0.01 -0.01 0.62 0.00 -1.32 0.00 0.00 176.35 175.65 2ce9 s ALA 673 N 1.29 3.52 -0.05 5.97 0.00 0.29 -0.38 121.76 132.41 2ce9 s ALA 673 Ca 0.04 0.11 -0.01 0.00 0.00 0.00 0.00 51.96 52.10 2ce9 s ALA 673 Cb -0.13 -2.74 0.03 0.00 0.00 0.00 0.00 23.12 20.27 2ce9 s ALA 673 CO -0.12 0.30 0.02 0.08 0.00 0.00 0.00 175.76 176.03 2ce9 s VAL 674 N -0.79 0.18 -0.16 0.00 1.01 0.90 -0.75 120.40 120.79 2ce9 s VAL 674 Ca 0.31 0.19 -0.07 0.00 0.00 0.00 0.00 61.98 62.42 2ce9 s VAL 674 Cb -0.20 -0.35 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 2ce9 s VAL 674 CO 0.20 0.20 0.07 -0.83 0.00 0.00 0.00 175.10 174.74 2ce9 s GLY 675 N 1.69 1.95 -0.02 4.51 0.00 0.94 -0.66 107.32 115.75 2ce9 s GLY 675 Ca -0.00 -0.73 0.05 0.00 0.00 0.00 0.00 44.72 44.03 2ce9 s GLY 675 CO -0.03 -0.12 -0.14 -0.29 0.00 0.00 0.00 173.10 172.51 2ce9 s MET 676 N -0.10 2.39 0.50 2.90 1.75 -0.67 -1.04 119.30 125.02 2ce9 s MET 676 Ca 0.07 -0.78 0.32 0.00 -1.25 0.00 0.00 55.69 54.05 2ce9 s MET 676 Cb -0.12 -2.34 1.44 0.00 2.84 0.00 0.00 34.83 36.64 2ce9 s MET 676 CO 0.01 0.60 1.79 1.49 -0.65 0.00 0.00 175.02 178.26 2ce9 h GLU 677 N 4.98 0.10 0.00 4.11 4.22 -1.37 -1.75 114.58 124.87 2ce9 h GLU 677 Ca -0.47 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 58.96 2ce9 h GLU 677 Cb 1.16 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2ce9 h GLU 677 CO 0.50 0.07 0.00 -1.13 -2.18 0.00 0.00 179.01 176.27 2ce9 n SER 678 N -4.31 0.00 0.00 1.04 3.41 -1.26 -3.72 113.62 108.77 2ce9 n SER 678 Ca 0.26 0.48 0.00 0.00 -0.26 0.00 0.00 58.87 59.35 2ce9 n SER 678 Cb 1.16 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.62 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 -1.49 0.00 -4.77 4.04 3.41 -0.70 -4.83 113.62 109.28 2ce9 n SER 679 Ca 0.05 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.29 2ce9 n SER 679 Cb 0.25 0.00 -0.00 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 -1.43 5.99 -0.18 4.04 -0.87 -1.26 -4.16 114.94 117.07 2ce9 s ASN 680 Ca 0.00 2.37 -0.07 0.00 -1.57 0.00 0.00 52.86 53.59 2ce9 s ASN 680 Cb 0.00 -2.61 -0.04 0.00 -0.02 0.00 0.00 41.25 38.59 2ce9 s ASN 680 CO 0.00 -1.04 0.04 -0.69 -2.57 0.00 0.00 177.10 172.84 2ce9 s VAL 681 N -1.52 4.60 -0.07 1.60 1.01 -0.62 -1.67 120.40 123.73 2ce9 s VAL 681 Ca 0.65 -0.10 0.03 0.00 0.00 0.00 0.00 61.98 62.56 2ce9 s VAL 681 Cb -0.30 -3.07 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 2ce9 s VAL 681 CO 0.36 0.46 -0.16 -1.61 0.00 0.00 0.00 175.10 174.16 2ce9 s GLU 682 N 0.43 2.74 -0.36 2.72 2.02 0.17 -0.71 118.70 125.70 2ce9 s GLU 682 Ca 0.02 -0.73 -0.01 0.00 0.02 0.00 0.00 54.97 54.27 2ce9 s GLU 682 Cb -0.13 -2.41 0.09 0.00 0.10 0.00 0.00 34.13 31.78 2ce9 s GLU 682 CO 0.01 0.48 0.10 0.08 0.02 0.00 0.00 175.26 175.95 2ce9 s VAL 683 N -0.36 3.00 0.14 2.63 1.01 -0.08 -0.07 120.40 126.66 2ce9 s VAL 683 Ca 0.03 -1.86 -0.27 0.00 0.00 0.00 0.00 61.98 59.88 2ce9 s VAL 683 Cb -0.12 -2.96 -0.07 0.00 0.00 0.00 0.00 36.38 33.23 2ce9 s VAL 683 CO 0.02 -0.46 0.85 -0.76 0.00 0.00 0.00 175.10 174.75 2ce9 s LEU 684 N 1.14 4.55 -0.45 3.92 1.43 0.49 -0.68 118.68 129.08 2ce9 s LEU 684 Ca 0.04 1.69 -0.25 0.00 -1.03 0.00 0.00 54.13 54.57 2ce9 s LEU 684 Cb -0.21 -3.41 0.03 0.00 0.03 0.00 0.00 46.19 42.62 2ce9 s LEU 684 CO -0.04 0.09 0.92 -2.28 0.23 0.00 0.00 176.35 175.27 2ce9 s HIS 685 N -0.62 2.94 0.04 0.29 5.65 -1.00 -1.01 115.29 121.58 2ce9 s HIS 685 Ca 0.40 0.44 -0.30 0.00 0.25 0.00 0.00 55.06 55.84 2ce9 s HIS 685 Cb -0.23 -3.92 -0.07 0.00 -1.18 0.00 0.00 32.58 27.18 2ce9 s HIS 685 CO 0.27 -1.06 1.60 0.08 -0.65 0.00 0.00 174.74 174.99 2ce9 s VAL 686 N 3.71 3.25 -2.08 0.89 1.01 0.13 -0.60 120.40 126.72 2ce9 s VAL 686 Ca 0.37 0.64 0.00 0.00 0.00 0.00 0.00 61.98 62.99 2ce9 s VAL 686 Cb -0.10 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.87 2ce9 s VAL 686 CO 0.25 -0.01 0.00 0.59 0.00 0.00 0.00 175.10 175.93 2ce9 n ASN 687 N 5.78 -5.46 -4.42 3.32 3.02 -1.26 -4.94 115.26 111.30 2ce9 n ASN 687 Ca 0.15 0.43 -0.21 0.00 -0.03 0.00 0.00 54.58 54.93 2ce9 n ASN 687 Cb 0.41 -4.69 -0.10 0.00 -0.61 0.00 0.00 39.78 34.79 2ce9 n ASN 687 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2ce9 s LYS 688 N -3.87 1.53 0.35 3.52 -0.14 0.24 -5.06 119.74 116.30 2ce9 s LYS 688 Ca 0.00 -1.77 0.25 0.00 -1.36 0.00 0.00 55.97 53.09 2ce9 s LYS 688 Cb 0.00 -1.12 0.64 0.00 -1.68 0.00 0.00 37.83 35.67 2ce9 s LYS 688 CO 0.00 0.04 1.71 -1.00 -0.76 0.00 0.00 175.35 175.33 2ce9 h PRO 689 N 2.30 0.00 -6.31 -1.68 0.13 -1.95 -3.43 132.00 121.06 2ce9 h PRO 689 Ca -0.40 0.00 -0.44 0.00 -0.87 0.00 0.00 66.00 64.29 2ce9 h PRO 689 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2ce9 h PRO 689 CO 0.67 0.00 -0.35 0.16 -0.23 0.00 0.00 178.00 178.25 2ce9 s ASP 690 N -5.41 5.99 0.25 1.44 -4.77 -1.26 -4.29 116.67 108.61 2ce9 s ASP 690 Ca 0.08 -0.17 -0.20 0.00 -3.30 0.00 0.00 52.55 48.96 2ce9 s ASP 690 Cb 0.08 -1.27 0.02 0.00 -1.09 0.00 0.00 42.92 40.67 2ce9 s ASP 690 CO 0.62 -0.41 0.65 -1.59 0.70 0.00 0.00 175.17 175.13 2ce9 s LYS 691 N -4.16 1.64 0.03 2.11 -2.85 -0.84 -2.37 119.74 113.30 2ce9 s LYS 691 Ca 0.44 -0.94 0.04 0.00 -1.00 0.00 0.00 55.97 54.51 2ce9 s LYS 691 Cb -0.09 0.58 -0.04 0.00 -2.06 0.00 0.00 37.83 36.22 2ce9 s LYS 691 CO 0.31 -0.73 -0.05 0.71 0.10 0.00 0.00 175.35 175.69 2ce9 s TYR 692 N -3.90 2.92 -0.09 1.78 2.02 0.14 -0.32 117.35 119.90 2ce9 s TYR 692 Ca 0.11 -0.03 0.03 0.00 -0.37 0.00 0.00 57.07 56.81 2ce9 s TYR 692 Cb -0.04 -1.59 0.01 0.00 -0.40 0.00 0.00 41.96 39.94 2ce9 s TYR 692 CO 0.03 0.41 -0.19 -0.65 -1.57 0.00 0.00 175.55 173.59 2ce9 s GLN 693 N -1.67 2.47 -0.08 -0.62 -0.21 0.42 -0.90 119.66 119.06 2ce9 s GLN 693 Ca 0.19 -0.68 0.04 0.00 0.02 0.00 0.00 55.36 54.94 2ce9 s GLN 693 Cb -0.11 -1.93 -0.00 0.00 1.00 0.00 0.00 33.01 31.97 2ce9 s GLN 693 CO 0.10 0.10 -0.21 -0.51 -2.12 0.00 0.00 175.29 172.65 2ce9 s LEU 694 N 0.51 1.98 -0.52 2.90 1.43 0.11 -0.97 118.68 124.13 2ce9 s LEU 694 Ca -0.16 -0.48 0.04 0.00 -1.03 0.00 0.00 54.13 52.49 2ce9 s LEU 694 Cb -0.17 -1.24 0.16 0.00 0.03 0.00 0.00 46.19 44.96 2ce9 s LEU 694 CO 0.06 0.15 0.35 -1.00 0.23 0.00 0.00 176.35 176.14 2ce9 s HIS 695 N 0.27 2.23 -0.03 0.29 3.76 -0.24 -1.58 115.29 119.97 2ce9 s HIS 695 Ca -0.13 -2.69 0.04 0.00 -0.15 0.00 0.00 55.06 52.13 2ce9 s HIS 695 Cb -0.16 -1.87 0.06 0.00 1.11 0.00 0.00 32.58 31.73 2ce9 s HIS 695 CO 0.06 -0.72 0.94 1.28 -0.85 0.00 0.00 174.74 175.45 2ce9 n LEU 696 N 2.84 0.67 -4.44 0.89 4.77 -1.26 -4.78 117.00 115.69 2ce9 n LEU 696 Ca 0.18 -1.36 -0.30 0.00 -0.03 0.00 0.00 56.01 54.50 2ce9 n LEU 696 Cb 0.39 -0.09 -0.13 0.00 -2.33 0.00 0.00 43.42 41.25 2ce9 n LEU 696 CO 0.20 0.33 -0.51 -1.00 -1.33 0.00 0.00 177.39 175.08 2ce9 s HIS 697 N -0.71 2.48 -1.98 -1.77 3.76 -1.26 -5.01 115.29 110.80 2ce9 s HIS 697 Ca 0.07 -0.30 0.20 0.00 -0.15 0.00 0.00 55.06 54.89 2ce9 s HIS 697 Cb 0.06 -1.39 0.47 0.00 1.11 0.00 0.00 32.58 32.83 2ce9 s HIS 697 CO 0.01 0.28 1.40 0.39 -0.85 0.00 0.00 174.74 175.97 2ce9 n GLU 698 N 1.31 2.55 -2.64 1.40 1.02 -1.26 -4.81 120.64 118.21 2ce9 n GLU 698 Ca -0.16 -2.34 -0.06 0.00 -0.02 0.00 0.00 57.16 54.57 2ce9 n GLU 698 Cb 0.52 -1.48 0.01 0.00 -0.02 0.00 0.00 31.44 30.47 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 1.36 -1.18 -4.58 1.62 2.88 -1.26 -4.94 113.62 107.52 2ce9 n SER 699 Ca 0.20 -1.94 -0.50 0.00 -1.33 0.00 0.00 58.87 55.29 2ce9 n SER 699 Cb 0.57 2.01 -0.05 0.00 -0.75 0.00 0.00 64.21 65.99 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 0.06 4.15 0.18 0.00 1.01 -0.96 -0.67 120.40 124.17 2ce9 s VAL 701 Ca 0.78 -0.32 -0.03 0.00 0.00 0.00 0.00 61.98 62.41 2ce9 s VAL 701 Cb -0.91 -4.80 -0.08 0.00 0.00 0.00 0.00 36.38 30.58 2ce9 s VAL 701 CO 0.50 -1.63 1.46 -0.07 0.00 0.00 0.00 175.10 175.36 2ce9 h LEU 702 N 11.89 0.60 -7.48 3.92 3.38 -1.47 -3.37 115.31 122.77 2ce9 h LEU 702 Ca -0.18 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.37 2ce9 h LEU 702 Cb 1.05 -0.17 -0.14 0.00 0.09 0.00 0.00 40.66 41.49 2ce9 h LEU 702 CO 1.23 1.08 -0.14 -0.94 0.09 0.00 0.00 178.44 179.76 2ce9 s SER 703 N -6.96 -0.17 0.08 -0.43 1.04 -1.23 -4.44 113.70 101.59 2ce9 s SER 703 Ca -0.07 -0.34 -0.22 0.00 0.48 0.00 0.00 55.95 55.80 2ce9 s SER 703 Cb 0.11 0.44 0.06 0.00 0.10 0.00 0.00 66.02 66.72 2ce9 s SER 703 CO 0.85 -0.80 0.54 -1.48 0.98 0.00 0.00 173.24 173.33 2ce9 s LEU 704 N -2.68 -0.19 -0.25 2.42 0.05 -1.26 -1.52 118.68 115.23 2ce9 s LEU 704 Ca 0.02 0.11 -0.14 0.00 0.05 0.00 0.00 54.13 54.17 2ce9 s LEU 704 Cb 0.02 2.25 0.07 0.00 -2.05 0.00 0.00 46.19 46.49 2ce9 s LEU 704 CO -0.10 -0.79 0.62 -0.75 -0.55 0.00 0.00 176.35 174.77 2ce9 s LYS 705 N -2.86 0.63 0.35 1.48 2.47 -0.74 -4.78 119.74 116.29 2ce9 s LYS 705 Ca -0.03 1.12 -0.26 0.00 -1.56 0.00 0.00 55.97 55.24 2ce9 s LYS 705 Cb -0.00 0.10 -0.09 0.00 -1.46 0.00 0.00 37.83 36.37 2ce9 s LYS 705 CO -0.05 -0.15 1.02 -0.06 0.16 0.00 0.00 175.35 176.27 2ce9 s PHE 706 N 1.57 3.49 0.60 4.03 0.40 -1.26 -0.81 117.98 126.00 2ce9 s PHE 706 Ca -0.10 1.71 -0.18 0.00 -0.60 0.00 0.00 56.93 57.76 2ce9 s PHE 706 Cb -0.06 -3.08 -0.05 0.00 0.51 0.00 0.00 43.02 40.34 2ce9 s PHE 706 CO -0.18 -0.30 0.95 0.00 0.70 0.00 0.00 175.22 176.39 2ce9 n ALA 707 N 0.42 0.12 -0.11 5.36 0.00 -0.24 -4.88 120.51 121.18 2ce9 n ALA 707 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.49 2ce9 n ALA 707 Cb 0.49 -2.10 0.33 0.00 0.00 0.00 0.00 19.45 18.17 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 0.48 0.73 0.00 0.00 -1.99 -1.88 0.10 116.97 114.41 2ce9 h TYR 708 Ca -0.48 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.26 2ce9 h TYR 708 Cb 1.37 -0.25 0.00 0.00 2.00 0.00 0.00 36.73 39.85 2ce9 h TYR 708 CO 0.37 0.48 0.00 0.00 -0.00 0.00 0.00 178.16 179.01 2ce9 n GLY 710 N -0.31 1.05 0.09 0.00 0.00 0.35 -4.72 105.19 101.65 2ce9 n GLY 710 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 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 0.21 -3.74 1.61 5.02 -1.26 -4.69 118.16 113.30 2ce9 n LYS 711 Ca 0.00 0.21 -0.10 0.00 -2.02 0.00 0.00 58.31 56.40 2ce9 n LYS 711 Cb 0.00 -1.76 -0.05 0.00 -0.02 0.00 0.00 35.03 33.19 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 -3.11 -0.03 0.20 2.13 1.48 -1.26 -1.51 118.94 116.84 2ce9 s TRP 712 Ca 0.10 -0.32 -0.03 0.00 -1.06 0.00 0.00 56.10 54.79 2ce9 s TRP 712 Cb 0.13 0.16 -0.03 0.00 -1.16 0.00 0.00 33.47 32.56 2ce9 s TRP 712 CO 0.56 -0.69 0.18 -0.59 -4.06 0.00 0.00 176.95 172.35 2ce9 s PHE 713 N -3.85 1.02 0.12 1.66 -0.12 -0.03 -1.07 117.98 115.71 2ce9 s PHE 713 Ca 0.06 -1.27 0.10 0.00 -0.05 0.00 0.00 56.93 55.78 2ce9 s PHE 713 Cb 0.02 -0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 41.94 2ce9 s PHE 713 CO -0.09 -0.68 -0.26 0.14 -0.05 0.00 0.00 175.22 174.27 2ce9 s VAL 714 N -4.13 2.17 0.14 -2.49 -7.23 0.01 0.29 120.40 109.16 2ce9 s VAL 714 Ca 0.35 -1.71 0.08 0.00 -1.81 0.00 0.00 61.98 58.89 2ce9 s VAL 714 Cb 0.06 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 35.04 2ce9 s VAL 714 CO 0.11 0.08 -0.18 -0.94 -0.31 0.00 0.00 175.10 173.86 2ce9 s SER 715 N -2.00 2.50 0.02 4.85 1.04 -0.26 -1.80 113.70 118.06 2ce9 s SER 715 Ca 0.13 -0.82 0.06 0.00 0.48 0.00 0.00 55.95 55.80 2ce9 s SER 715 Cb -0.10 -0.13 -0.02 0.00 0.10 0.00 0.00 66.02 65.87 2ce9 s SER 715 CO 0.06 -0.04 -0.17 0.42 0.98 0.00 0.00 173.24 174.48 2ce9 s THR 716 N -1.91 1.37 0.20 2.02 -4.23 -0.58 -0.96 115.64 111.54 2ce9 s THR 716 Ca 0.12 -0.96 0.09 0.00 -1.18 0.00 0.00 61.69 59.76 2ce9 s THR 716 Cb -0.06 -1.19 -0.04 0.00 1.34 0.00 0.00 72.50 72.55 2ce9 s THR 716 CO 0.05 0.21 -0.17 -0.83 -0.54 0.00 0.00 174.62 173.34 2ce9 s GLY 717 N -0.88 1.48 0.24 3.99 0.00 0.00 -1.37 107.32 110.79 2ce9 s GLY 717 Ca 0.05 -1.61 0.19 0.00 0.00 0.00 0.00 44.72 43.36 2ce9 s GLY 717 CO 0.01 -1.68 1.58 1.17 0.00 0.00 0.00 173.10 174.17 2ce9 n LYS 718 N -0.07 0.13 -0.15 2.90 4.81 0.16 -1.39 118.16 124.55 2ce9 n LYS 718 Ca -0.10 0.54 0.04 0.00 -0.87 0.00 0.00 58.31 57.91 2ce9 n LYS 718 Cb 0.59 -1.85 0.11 0.00 0.02 0.00 0.00 35.03 33.90 2ce9 n LYS 718 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 2ce9 n ASP 719 N -2.11 1.47 0.00 3.14 5.75 -1.26 -4.31 116.55 119.23 2ce9 n ASP 719 Ca 0.00 -2.05 0.00 0.00 -0.01 0.00 0.00 54.79 52.73 2ce9 n ASP 719 Cb 0.09 -0.22 0.00 0.00 -1.03 0.00 0.00 41.12 39.96 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 0.20 -2.81 -4.88 -1.12 3.02 -0.96 -4.96 115.26 103.75 2ce9 n ASN 720 Ca 0.08 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.28 2ce9 n ASN 720 Cb 0.26 -0.71 -0.05 0.00 -0.61 0.00 0.00 39.78 38.66 2ce9 n ASN 720 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2ce9 s LEU 721 N 0.00 4.33 -0.28 3.41 1.43 -1.25 -0.73 118.68 125.59 2ce9 s LEU 721 Ca 0.00 0.37 -0.06 0.00 -1.03 0.00 0.00 54.13 53.41 2ce9 s LEU 721 Cb 0.00 -2.37 0.01 0.00 0.03 0.00 0.00 46.19 43.86 2ce9 s LEU 721 CO 0.00 0.32 0.05 -0.22 0.23 0.00 0.00 176.35 176.73 2ce9 s LEU 722 N -1.56 3.67 -0.07 1.79 2.96 -0.32 -0.82 118.68 124.34 2ce9 s LEU 722 Ca 0.22 -0.67 -0.00 0.00 -0.22 0.00 0.00 54.13 53.46 2ce9 s LEU 722 Cb -0.12 -1.85 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 2ce9 s LEU 722 CO 0.12 -0.16 -0.04 0.20 -1.32 0.00 0.00 176.35 175.15 2ce9 s ASN 723 N 1.48 4.85 -0.11 3.68 0.02 -0.14 -0.76 114.94 123.97 2ce9 s ASN 723 Ca 0.03 0.04 -0.01 0.00 -1.02 0.00 0.00 52.86 51.89 2ce9 s ASN 723 Cb -0.17 -1.28 -0.03 0.00 0.02 0.00 0.00 41.25 39.80 2ce9 s ASN 723 CO 0.01 0.37 -0.06 0.00 0.02 0.00 0.00 177.10 177.44 2ce9 s ALA 724 N -0.83 2.97 0.02 0.60 0.00 -0.34 -1.11 121.76 123.07 2ce9 s ALA 724 Ca 0.13 -0.86 0.03 0.00 0.00 0.00 0.00 51.96 51.25 2ce9 s ALA 724 Cb -0.11 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 2ce9 s ALA 724 CO 0.02 0.42 -0.09 -1.58 0.00 0.00 0.00 175.76 174.52 2ce9 s TRP 725 N -0.29 0.79 0.11 0.00 0.52 0.15 -1.10 118.94 119.12 2ce9 s TRP 725 Ca 0.04 -0.26 -0.30 0.00 0.02 0.00 0.00 56.10 55.60 2ce9 s TRP 725 Cb -0.13 -0.49 -0.06 0.00 -1.15 0.00 0.00 33.47 31.65 2ce9 s TRP 725 CO 0.02 -0.02 0.97 0.50 0.02 0.00 0.00 176.95 178.44 2ce9 s ARG 726 N -0.72 4.69 0.13 4.98 6.06 0.04 -0.85 118.95 133.29 2ce9 s ARG 726 Ca -0.00 1.46 -0.24 0.00 -2.50 0.00 0.00 55.73 54.45 2ce9 s ARG 726 Cb -0.06 -3.38 -0.07 0.00 0.06 0.00 0.00 34.95 31.50 2ce9 s ARG 726 CO 0.00 0.21 0.73 0.99 -2.50 0.00 0.00 175.30 174.73 2ce9 s THR 727 N 0.01 4.49 -0.42 4.11 2.01 -0.57 0.49 115.64 125.75 2ce9 s THR 727 Ca 0.47 1.59 0.23 0.00 0.31 0.00 0.00 61.69 64.29 2ce9 s THR 727 Cb -0.23 -4.08 0.01 0.00 0.01 0.00 0.00 72.50 68.20 2ce9 s THR 727 CO 0.30 0.51 1.14 1.55 -0.69 0.00 0.00 174.62 177.43 2ce9 h PRO 728 N 4.51 0.00 -0.00 4.92 0.13 -1.93 -3.46 132.00 136.17 2ce9 h PRO 728 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2ce9 h PRO 728 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2ce9 h PRO 728 CO 0.66 0.00 -0.02 2.48 -0.23 0.00 0.00 178.00 180.89 2ce9 n TYR 729 N -2.40 0.00 -3.18 1.56 4.11 -1.19 -4.86 117.16 111.19 2ce9 n TYR 729 Ca 0.01 0.00 -0.15 0.00 -0.00 0.00 0.00 57.90 57.77 2ce9 n TYR 729 Cb 0.50 -0.04 0.07 0.00 -0.00 0.00 0.00 39.34 39.87 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 1.10 -0.20 3.77 -7.48 0.00 0.18 -4.77 105.19 97.79 2ce9 n GLY 730 Ca 0.21 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 2ce9 n GLY 730 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ce9 s ALA 731 N -3.28 3.42 -0.38 4.61 0.00 -1.26 -4.67 121.76 120.21 2ce9 s ALA 731 Ca 0.09 1.14 -0.23 0.00 0.00 0.00 0.00 51.96 52.96 2ce9 s ALA 731 Cb -0.04 -3.43 0.01 0.00 0.00 0.00 0.00 23.12 19.66 2ce9 s ALA 731 CO 0.58 -0.54 0.79 0.45 0.00 0.00 0.00 175.76 177.05 2ce9 s SER 732 N -0.67 6.54 -0.18 0.00 0.15 -1.26 -0.78 113.70 117.51 2ce9 s SER 732 Ca 0.49 0.31 -0.03 0.00 0.70 0.00 0.00 55.95 57.42 2ce9 s SER 732 Cb -0.37 -2.40 -0.23 0.00 -1.71 0.00 0.00 66.02 61.32 2ce9 s SER 732 CO 0.48 -0.76 0.13 -0.38 1.20 0.00 0.00 173.24 173.91 2ce9 n ILE 733 N 5.85 1.67 -3.61 6.45 5.41 -0.26 -4.97 119.36 129.90 2ce9 n ILE 733 Ca 0.03 -0.62 -0.10 0.00 1.00 0.00 0.00 62.75 63.06 2ce9 n ILE 733 Cb 0.48 -1.62 -0.03 0.00 -0.71 0.00 0.00 39.64 37.77 2ce9 n ILE 733 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2ce9 s PHE 734 N -2.54 -0.31 0.01 1.39 -0.71 -1.23 -4.86 117.98 109.73 2ce9 s PHE 734 Ca -0.27 0.01 0.00 0.00 -1.04 0.00 0.00 56.93 55.62 2ce9 s PHE 734 Cb 0.08 0.49 -0.01 0.00 -1.21 0.00 0.00 43.02 42.37 2ce9 s PHE 734 CO 0.70 -0.91 -0.02 -0.65 -1.34 0.00 0.00 175.22 173.01 2ce9 s GLN 735 N -3.82 0.14 -0.09 1.99 -0.21 -1.26 -1.20 119.66 115.21 2ce9 s GLN 735 Ca 0.05 -0.21 0.00 0.00 0.02 0.00 0.00 55.36 55.23 2ce9 s GLN 735 Cb -0.01 -0.02 0.02 0.00 1.00 0.00 0.00 33.01 34.00 2ce9 s GLN 735 CO -0.07 -0.00 -0.08 0.45 -2.12 0.00 0.00 175.29 173.47 2ce9 s SER 736 N -0.46 1.94 -0.23 5.90 0.15 0.06 -5.01 113.70 116.05 2ce9 s SER 736 Ca -0.04 -0.28 -0.14 0.00 0.70 0.00 0.00 55.95 56.19 2ce9 s SER 736 Cb -0.03 -0.79 -0.04 0.00 -1.71 0.00 0.00 66.02 63.45 2ce9 s SER 736 CO -0.00 -0.07 0.33 -0.75 1.20 0.00 0.00 173.24 173.94 2ce9 s LYS 737 N 1.36 4.09 0.52 5.44 2.47 -1.26 -1.17 119.74 131.19 2ce9 s LYS 737 Ca -0.02 0.02 0.09 0.00 -1.56 0.00 0.00 55.97 54.50 2ce9 s LYS 737 Cb -0.14 -3.58 0.06 0.00 -1.46 0.00 0.00 37.83 32.72 2ce9 s LYS 737 CO -0.04 -0.09 0.70 -1.21 0.16 0.00 0.00 175.35 174.87 2ce9 s GLU 738 N 1.49 2.47 0.34 4.03 2.02 0.09 -5.02 118.70 124.13 2ce9 s GLU 738 Ca 0.15 -1.53 0.26 0.00 0.02 0.00 0.00 54.97 53.87 2ce9 s GLU 738 Cb -0.15 -2.66 0.92 0.00 0.10 0.00 0.00 34.13 32.35 2ce9 s GLU 738 CO 0.08 -0.66 1.78 0.66 0.02 0.00 0.00 175.26 177.14 2ce9 h SER 739 N 0.36 0.00 -2.35 -0.19 4.64 -1.98 -3.46 113.55 110.57 2ce9 h SER 739 Ca -0.33 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.90 2ce9 h SER 739 Cb 1.29 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.36 2ce9 h SER 739 CO 0.43 0.00 0.01 -0.24 -0.87 0.00 0.00 176.83 176.16 2ce9 n SER 740 N -2.57 -0.77 -4.71 4.97 2.88 -1.26 -4.97 113.62 107.20 2ce9 n SER 740 Ca 0.03 -1.79 -0.39 0.00 -1.33 0.00 0.00 58.87 55.39 2ce9 n SER 740 Cb 0.35 1.36 0.04 0.00 -0.75 0.00 0.00 64.21 65.20 2ce9 n SER 740 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2ce9 n SER 741 N -1.64 2.27 -4.28 -3.46 3.41 -1.26 -3.99 113.62 104.67 2ce9 n SER 741 Ca -0.01 0.98 -0.37 0.00 -0.26 0.00 0.00 58.87 59.21 2ce9 n SER 741 Cb 0.26 -1.52 -0.13 0.00 -0.26 0.00 0.00 64.21 62.57 2ce9 n SER 741 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2ce9 s VAL 742 N -1.30 3.76 -0.13 -3.33 1.01 -0.49 -1.17 120.40 118.76 2ce9 s VAL 742 Ca 0.69 -1.07 0.20 0.00 0.00 0.00 0.00 61.98 61.80 2ce9 s VAL 742 Cb -0.45 -3.10 -0.19 0.00 0.00 0.00 0.00 36.38 32.65 2ce9 s VAL 742 CO 0.51 -0.13 0.64 0.18 0.00 0.00 0.00 175.10 176.30 2ce9 n LEU 743 N 4.81 0.43 -3.50 3.92 4.77 0.34 -3.73 117.00 124.05 2ce9 n LEU 743 Ca -0.13 0.18 -0.11 0.00 -0.03 0.00 0.00 56.01 55.92 2ce9 n LEU 743 Cb 0.45 0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.60 2ce9 n LEU 743 CO 0.31 0.08 0.35 -0.94 -1.33 0.00 0.00 177.39 175.86 2ce9 s SER 744 N -5.21 -0.48 0.16 -1.43 1.04 -1.23 -4.34 113.70 102.21 2ce9 s SER 744 Ca -0.05 -0.11 -0.23 0.00 0.48 0.00 0.00 55.95 56.03 2ce9 s SER 744 Cb 0.10 0.58 0.07 0.00 0.10 0.00 0.00 66.02 66.87 2ce9 s SER 744 CO 0.84 -0.97 0.64 0.00 0.98 0.00 0.00 173.24 174.73 2ce9 s ASP 746 N -2.74 -0.10 -0.03 0.00 2.15 -0.23 -4.74 116.67 110.98 2ce9 s ASP 746 Ca 0.02 -0.37 0.06 0.00 0.43 0.00 0.00 52.55 52.69 2ce9 s ASP 746 Cb -0.01 0.40 -0.01 0.00 -0.30 0.00 0.00 42.92 42.99 2ce9 s ASP 746 CO -0.11 -0.74 -0.20 -0.63 -0.17 0.00 0.00 175.17 173.32 2ce9 s ILE 747 N -3.39 1.65 0.86 4.11 1.01 -1.26 -1.59 121.20 122.59 2ce9 s ILE 747 Ca 0.01 -0.87 -0.11 0.00 0.00 0.00 0.00 60.65 59.68 2ce9 s ILE 747 Cb 0.02 -1.39 0.11 0.00 0.01 0.00 0.00 42.46 41.21 2ce9 s ILE 747 CO -0.09 0.47 1.10 -0.94 0.00 0.00 0.00 174.94 175.48 2ce9 s SER 748 N -0.26 3.64 0.54 3.58 1.04 -0.34 -4.89 113.70 117.02 2ce9 s SER 748 Ca 0.02 1.75 0.36 0.00 0.48 0.00 0.00 55.95 58.56 2ce9 s SER 748 Cb -0.10 -2.39 1.72 0.00 0.10 0.00 0.00 66.02 65.35 2ce9 s SER 748 CO 0.01 -2.57 2.07 -0.37 0.98 0.00 0.00 173.24 173.36 2ce9 h VAL 749 N -1.50 0.00 -0.44 5.02 -1.51 -1.92 -0.21 116.25 115.69 2ce9 h VAL 749 Ca -0.47 -0.23 0.00 0.00 -1.23 0.00 0.00 66.70 64.77 2ce9 h VAL 749 Cb 1.26 1.15 0.00 0.00 -2.13 0.00 0.00 31.29 31.57 2ce9 h VAL 749 CO 0.51 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 175.95 2ce9 n ASP 750 N -2.90 3.22 -1.81 4.19 5.75 -1.26 -4.83 116.55 118.91 2ce9 n ASP 750 Ca -0.01 -1.95 -0.19 0.00 -0.01 0.00 0.00 54.79 52.63 2ce9 n ASP 750 Cb 0.18 -0.29 -0.05 0.00 -1.03 0.00 0.00 41.12 39.93 2ce9 n ASP 750 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2ce9 n ASP 751 N 0.99 -5.40 0.04 -1.12 8.00 -0.09 -4.89 116.55 114.07 2ce9 n ASP 751 Ca 0.16 0.24 0.04 0.00 0.71 0.00 0.00 54.79 55.94 2ce9 n ASP 751 Cb 0.49 -4.52 -0.08 0.00 -0.02 0.00 0.00 41.12 37.00 2ce9 n ASP 751 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 2ce9 n LYS 752 N -2.63 0.63 -4.23 -1.24 4.81 -1.26 -4.75 118.16 109.48 2ce9 n LYS 752 Ca -0.21 0.11 -0.20 0.00 -0.87 0.00 0.00 58.31 57.14 2ce9 n LYS 752 Cb 0.65 -1.75 -0.12 0.00 0.02 0.00 0.00 35.03 33.83 2ce9 n LYS 752 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 2ce9 s TYR 753 N -3.11 1.34 -0.03 5.64 1.51 -1.26 0.42 117.35 121.86 2ce9 s TYR 753 Ca -0.04 -0.43 0.04 0.00 -1.01 0.00 0.00 57.07 55.63 2ce9 s TYR 753 Cb 0.10 -0.76 -0.00 0.00 -0.11 0.00 0.00 41.96 41.18 2ce9 s TYR 753 CO 0.82 0.08 -0.15 0.42 -1.11 0.00 0.00 175.55 175.61 2ce9 s ILE 754 N -1.18 1.26 -0.06 2.71 1.01 -0.20 -1.20 121.20 123.55 2ce9 s ILE 754 Ca 0.00 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.07 2ce9 s ILE 754 Cb -0.10 -1.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 2ce9 s ILE 754 CO 0.02 0.37 -0.24 -0.69 0.00 0.00 0.00 174.94 174.41 2ce9 s VAL 755 N -0.03 1.94 0.13 2.92 1.01 -0.62 0.01 120.40 125.77 2ce9 s VAL 755 Ca -0.01 -1.00 0.09 0.00 0.00 0.00 0.00 61.98 61.05 2ce9 s VAL 755 Cb -0.10 -1.65 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2ce9 s VAL 755 CO 0.01 0.54 -0.21 0.42 0.00 0.00 0.00 175.10 175.86 2ce9 s THR 756 N -0.11 1.87 -0.10 3.92 -4.23 -0.29 -1.07 115.64 115.64 2ce9 s THR 756 Ca -0.04 -1.72 -0.02 0.00 -1.18 0.00 0.00 61.69 58.72 2ce9 s THR 756 Cb -0.14 -1.75 -0.03 0.00 1.34 0.00 0.00 72.50 71.92 2ce9 s THR 756 CO 0.04 -0.12 0.00 -0.83 -0.54 0.00 0.00 174.62 173.17 2ce9 s GLY 757 N -2.21 1.85 0.09 3.99 0.00 -0.30 -0.73 107.32 110.00 2ce9 s GLY 757 Ca 0.11 -0.80 0.08 0.00 0.00 0.00 0.00 44.72 44.11 2ce9 s GLY 757 CO 0.06 -0.50 -0.18 -0.45 0.00 0.00 0.00 173.10 172.03 2ce9 s SER 758 N -0.73 3.85 0.06 1.64 0.15 0.11 -0.51 113.70 118.28 2ce9 s SER 758 Ca 0.11 -0.51 0.16 0.00 0.70 0.00 0.00 55.95 56.41 2ce9 s SER 758 Cb -0.12 -0.57 0.68 0.00 -1.71 0.00 0.00 66.02 64.31 2ce9 s SER 758 CO 0.02 0.20 1.50 0.61 1.20 0.00 0.00 173.24 176.78 2ce9 n GLY 759 N 1.06 -1.04 1.00 9.45 0.00 -0.31 -1.79 105.19 113.54 2ce9 n GLY 759 Ca -0.16 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 45.88 2ce9 n GLY 759 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ce9 n ASP 760 N -1.68 2.75 -2.30 1.61 8.00 -1.26 -4.78 116.55 118.89 2ce9 n ASP 760 Ca 0.03 -2.32 -0.13 0.00 0.71 0.00 0.00 54.79 53.07 2ce9 n ASP 760 Cb 0.18 -0.52 0.05 0.00 -0.02 0.00 0.00 41.12 40.80 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 0.28 -4.53 -3.94 -1.24 5.02 -0.74 -4.91 118.16 108.10 2ce9 n LYS 761 Ca 0.11 0.48 -0.09 0.00 -2.02 0.00 0.00 58.31 56.79 2ce9 n LYS 761 Cb 0.58 -4.45 -0.05 0.00 -0.02 0.00 0.00 35.03 31.09 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 -5.65 1.51 0.25 1.97 -2.85 -1.25 -0.59 119.74 113.13 2ce9 s LYS 762 Ca 0.30 -1.15 0.11 0.00 -1.00 0.00 0.00 55.97 54.23 2ce9 s LYS 762 Cb -0.13 0.49 -0.05 0.00 -2.06 0.00 0.00 37.83 36.08 2ce9 s LYS 762 CO 0.42 -0.63 -0.14 0.00 0.10 0.00 0.00 175.35 175.10 2ce9 s ALA 763 N -3.98 2.85 -0.06 0.59 0.00 -0.32 -0.71 121.76 120.12 2ce9 s ALA 763 Ca 0.19 -1.74 0.04 0.00 0.00 0.00 0.00 51.96 50.44 2ce9 s ALA 763 Cb -0.01 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.66 2ce9 s ALA 763 CO 0.06 0.32 -0.19 0.99 0.00 0.00 0.00 175.76 176.94 2ce9 s THR 764 N -2.26 1.59 -0.22 0.00 2.01 0.09 -0.52 115.64 116.34 2ce9 s THR 764 Ca 0.29 -0.77 -0.07 0.00 0.31 0.00 0.00 61.69 61.44 2ce9 s THR 764 Cb -0.06 -1.38 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 2ce9 s THR 764 CO 0.16 0.45 0.07 -0.69 -0.69 0.00 0.00 174.62 173.92 2ce9 s VAL 765 N 0.25 4.54 -0.03 3.82 1.01 -0.40 -1.14 120.40 128.44 2ce9 s VAL 765 Ca -0.10 -0.11 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2ce9 s VAL 765 Cb -0.14 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.12 2ce9 s VAL 765 CO 0.04 0.39 -0.03 -0.31 0.00 0.00 0.00 175.10 175.20 2ce9 s TYR 766 N 1.02 3.02 -0.05 5.22 1.51 0.10 -0.72 117.35 127.44 2ce9 s TYR 766 Ca 0.04 0.06 -0.21 0.00 -1.01 0.00 0.00 57.07 55.95 2ce9 s TYR 766 Cb -0.14 -1.69 -0.04 0.00 -0.11 0.00 0.00 41.96 39.97 2ce9 s TYR 766 CO 0.03 0.41 0.61 -2.00 -1.11 0.00 0.00 175.55 173.49 2ce9 s GLU 767 N -1.20 4.37 -0.13 -0.62 2.12 0.01 -1.03 118.70 122.21 2ce9 s GLU 767 Ca 0.16 0.72 -0.25 0.00 0.36 0.00 0.00 54.97 55.97 2ce9 s GLU 767 Cb -0.11 -3.40 -0.02 0.00 0.26 0.00 0.00 34.13 30.85 2ce9 s GLU 767 CO 0.06 0.21 0.78 0.08 -0.54 0.00 0.00 175.26 175.85 2ce9 s VAL 768 N 0.36 4.94 -0.19 3.70 1.01 0.17 -1.29 120.40 129.09 2ce9 s VAL 768 Ca 0.32 1.56 -0.06 0.00 0.00 0.00 0.00 61.98 63.81 2ce9 s VAL 768 Cb -0.17 -4.10 -0.03 0.00 0.00 0.00 0.00 36.38 32.08 2ce9 s VAL 768 CO 0.16 0.11 0.01 -0.63 0.00 0.00 0.00 175.10 174.75 2ce9 s ILE 769 N 1.68 4.15 -1.57 2.22 -1.09 -0.10 -4.88 121.20 121.62 2ce9 s ILE 769 Ca 0.38 -0.25 0.13 0.00 -2.23 0.00 0.00 60.65 58.67 2ce9 s ILE 769 Cb -0.17 -2.87 0.10 0.00 -1.58 0.00 0.00 42.46 37.94 2ce9 s ILE 769 CO 0.15 0.44 0.90 -1.22 -1.23 0.00 0.00 174.94 173.97