#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 2.44 0.05 1.24 2.02 -1.26 -5.13 117.35 116.70 2ce9 s TYR 435 Ca 0.00 -0.31 0.02 0.00 -0.37 0.00 0.00 57.07 56.42 2ce9 s TYR 435 Cb 0.00 -1.24 -0.03 0.00 -0.40 0.00 0.00 41.96 40.30 2ce9 s TYR 435 CO 0.00 0.46 -0.07 -0.06 -1.57 0.00 0.00 175.55 174.30 2ce9 s PHE 436 N -1.48 0.67 0.00 2.71 0.40 -1.26 -5.16 117.98 113.86 2ce9 s PHE 436 Ca 0.20 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 56.01 2ce9 s PHE 436 Cb -0.09 -0.40 -0.01 0.00 0.51 0.00 0.00 43.02 43.03 2ce9 s PHE 436 CO 0.11 -0.10 -0.05 -0.65 0.70 0.00 0.00 175.22 175.23 2ce9 s GLN 437 N -1.78 0.41 0.80 0.44 -0.21 -1.26 -5.08 119.66 112.98 2ce9 s GLN 437 Ca -0.08 -0.28 -0.13 0.00 0.02 0.00 0.00 55.36 54.88 2ce9 s GLN 437 Cb -0.09 -0.35 0.08 0.00 1.00 0.00 0.00 33.01 33.65 2ce9 s GLN 437 CO -0.00 0.09 1.17 0.20 -2.12 0.00 0.00 175.29 174.63 2ce9 s GLY 438 N -0.40 2.06 -0.22 3.09 0.00 -1.26 -5.05 107.32 105.54 2ce9 s GLY 438 Ca -0.01 0.72 -0.04 0.00 0.00 0.00 0.00 44.72 45.39 2ce9 s GLY 438 CO -0.00 1.12 0.37 0.00 0.00 0.00 0.00 173.10 174.60 2ce9 s ALA 439 N -2.30 -1.03 0.38 3.20 0.00 -1.26 -5.15 121.76 115.60 2ce9 s ALA 439 Ca 0.70 1.09 -0.26 0.00 0.00 0.00 0.00 51.96 53.49 2ce9 s ALA 439 Cb -0.26 -1.48 -0.09 0.00 0.00 0.00 0.00 23.12 21.30 2ce9 s ALA 439 CO 0.51 -1.03 1.20 1.41 0.00 0.00 0.00 175.76 177.84 2ce9 s MET 440 N 2.55 4.16 0.00 0.00 1.75 -1.26 -5.04 119.30 121.46 2ce9 s MET 440 Ca 0.07 1.93 0.00 0.00 -1.25 0.00 0.00 55.69 56.43 2ce9 s MET 440 Cb -0.14 -2.80 0.00 0.00 2.84 0.00 0.00 34.83 34.73 2ce9 s MET 440 CO -0.14 -0.26 0.00 0.41 -0.65 0.00 0.00 175.02 174.38 2ce9 n GLY 441 N 0.73 5.12 3.50 2.11 0.00 -1.26 -5.18 105.19 110.21 2ce9 n GLY 441 Ca 0.03 -1.85 -0.16 0.00 0.00 0.00 0.00 46.02 44.04 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 -0.17 -0.62 0.06 1.61 1.04 -1.26 -5.19 113.70 109.16 2ce9 s SER 442 Ca 0.00 0.56 0.00 0.00 0.48 0.00 0.00 55.95 57.00 2ce9 s SER 442 Cb 0.00 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.62 2ce9 s SER 442 CO 0.00 -0.66 -0.05 -0.54 0.98 0.00 0.00 173.24 172.97 2ce9 s LYS 443 N -1.67 0.60 0.22 4.02 1.02 -1.26 -5.12 119.74 117.55 2ce9 s LYS 443 Ca -0.08 -1.08 -0.31 0.00 0.02 0.00 0.00 55.97 54.52 2ce9 s LYS 443 Cb -0.00 0.02 -0.15 0.00 -0.52 0.00 0.00 37.83 37.18 2ce9 s LYS 443 CO 0.05 -0.06 1.21 -2.30 -0.92 0.00 0.00 175.35 173.33 2ce9 n PRO 444 N 0.51 1.49 -1.56 -1.68 -0.02 -1.26 -4.79 135.00 127.69 2ce9 n PRO 444 Ca -0.16 0.53 -0.54 0.00 -2.02 0.00 0.00 63.50 61.30 2ce9 n PRO 444 Cb 0.59 -2.05 -0.07 0.00 -0.02 0.00 0.00 33.50 31.96 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 1.31 -1.93 0.00 3.55 0.00 -1.26 -4.86 120.51 117.33 2ce9 n ALA 445 Ca 0.13 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.11 2ce9 n ALA 445 Cb 0.28 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.77 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 2.12 0.00 -4.15 0.00 0.18 -1.26 -5.01 117.16 109.04 2ce9 n TYR 446 Ca 0.19 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.63 2ce9 n TYR 446 Cb 0.15 0.00 -0.15 0.00 -0.38 0.00 0.00 39.34 38.97 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 -0.49 3.86 -0.04 9.48 0.15 -1.26 -0.69 113.70 124.71 2ce9 s SER 447 Ca 0.00 -0.46 0.03 0.00 0.70 0.00 0.00 55.95 56.22 2ce9 s SER 447 Cb 0.00 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.68 2ce9 s SER 447 CO 0.00 0.02 -0.13 -0.36 1.20 0.00 0.00 173.24 173.97 2ce9 s PHE 448 N 1.20 1.36 -0.07 3.44 0.08 -0.87 -1.29 117.98 121.83 2ce9 s PHE 448 Ca 0.02 -0.39 -0.27 0.00 0.12 0.00 0.00 56.93 56.41 2ce9 s PHE 448 Cb -0.14 -0.95 -0.03 0.00 -0.57 0.00 0.00 43.02 41.33 2ce9 s PHE 448 CO -0.04 -0.16 0.86 -1.58 -0.10 0.00 0.00 175.22 174.20 2ce9 s HIS 449 N 0.20 3.56 -0.20 0.36 5.65 0.03 -0.79 115.29 124.09 2ce9 s HIS 449 Ca -0.05 1.44 -0.05 0.00 0.25 0.00 0.00 55.06 56.65 2ce9 s HIS 449 Cb -0.11 -3.00 -0.02 0.00 -1.18 0.00 0.00 32.58 28.27 2ce9 s HIS 449 CO 0.02 -0.05 -0.01 0.08 -0.65 0.00 0.00 174.74 174.12 2ce9 s VAL 450 N 1.31 3.81 -0.27 0.89 1.01 0.64 -0.17 120.40 127.63 2ce9 s VAL 450 Ca 0.44 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 62.08 2ce9 s VAL 450 Cb -0.19 -2.73 0.07 0.00 0.00 0.00 0.00 36.38 33.54 2ce9 s VAL 450 CO 0.20 0.43 -0.07 -0.04 0.00 0.00 0.00 175.10 175.62 2ce9 s MET 456 N 1.11 1.95 -0.13 2.72 1.00 -1.26 -3.27 119.30 121.42 2ce9 s MET 456 Ca 0.02 -1.33 -0.00 0.00 0.00 0.00 0.00 55.69 54.38 2ce9 s MET 456 Cb -0.14 -2.84 -0.02 0.00 0.00 0.00 0.00 34.83 31.83 2ce9 s MET 456 CO 0.01 -0.63 -0.13 -1.14 0.00 0.00 0.00 175.02 173.13 2ce9 s GLN 457 N 1.16 3.39 0.34 2.03 2.00 0.76 -5.10 119.66 124.25 2ce9 s GLN 457 Ca -0.05 -0.68 -0.28 0.00 -2.00 0.00 0.00 55.36 52.35 2ce9 s GLN 457 Cb -0.20 -2.64 -0.12 0.00 0.80 0.00 0.00 33.01 30.85 2ce9 s GLN 457 CO -0.06 0.22 1.34 -2.30 -0.50 0.00 0.00 175.29 173.99 2ce9 n PRO 458 N 3.51 2.25 -2.32 1.67 -0.02 -1.26 -0.79 135.00 138.03 2ce9 n PRO 458 Ca -0.18 0.79 -0.42 0.00 -2.02 0.00 0.00 63.50 61.67 2ce9 n PRO 458 Cb 0.53 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.57 2ce9 n PRO 458 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ce9 s VAL 459 N -1.01 3.87 -0.50 -1.45 1.01 -0.41 -4.77 120.40 117.13 2ce9 s VAL 459 Ca 0.56 1.28 -0.28 0.00 0.00 0.00 0.00 61.98 63.54 2ce9 s VAL 459 Cb -0.55 -3.82 0.03 0.00 0.00 0.00 0.00 36.38 32.04 2ce9 s VAL 459 CO 0.61 0.04 1.08 -2.16 0.00 0.00 0.00 175.10 174.67 2ce9 s PRO 460 N 1.85 3.59 0.46 2.72 0.04 -1.26 -5.00 135.00 137.40 2ce9 s PRO 460 Ca 0.61 0.32 -0.24 0.00 0.04 0.00 0.00 61.00 61.73 2ce9 s PRO 460 Cb -0.30 -3.95 -0.07 0.00 0.04 0.00 0.00 34.50 30.22 2ce9 s PRO 460 CO 0.27 -1.42 1.29 -0.06 0.04 0.00 0.00 177.00 177.11 2ce9 s PHE 461 N 4.36 2.65 0.77 0.56 0.08 -1.26 -5.04 117.98 120.11 2ce9 s PHE 461 Ca 0.43 1.42 -0.06 0.00 0.12 0.00 0.00 56.93 58.84 2ce9 s PHE 461 Cb -0.08 -3.65 0.12 0.00 -0.57 0.00 0.00 43.02 38.85 2ce9 s PHE 461 CO 0.28 -2.23 1.08 -1.25 -0.10 0.00 0.00 175.22 173.00 2ce9 s PRO 462 N -2.57 1.57 0.55 0.24 0.04 -1.26 -4.95 135.00 128.62 2ce9 s PRO 462 Ca 0.63 -0.69 0.26 0.00 0.04 0.00 0.00 61.00 61.25 2ce9 s PRO 462 Cb -0.37 -2.17 1.57 0.00 0.04 0.00 0.00 34.50 33.58 2ce9 s PRO 462 CO 0.45 -1.62 2.16 -1.35 0.04 0.00 0.00 177.00 176.69 2ce9 h PRO 463 N -0.82 0.00 -0.54 0.56 0.11 -1.98 -2.04 132.00 127.30 2ce9 h PRO 463 Ca -0.41 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.67 2ce9 h PRO 463 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 2ce9 h PRO 463 CO 0.45 0.05 0.03 -0.40 -0.21 0.00 0.00 178.00 177.93 2ce9 n ASP 464 N -3.92 5.27 -0.30 -2.05 5.75 -1.26 -4.52 116.55 115.53 2ce9 n ASP 464 Ca -0.03 -3.00 0.03 0.00 -0.01 0.00 0.00 54.79 51.78 2ce9 n ASP 464 Cb 0.14 -0.67 0.23 0.00 -1.03 0.00 0.00 41.12 39.79 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 3.40 1.49 0.00 2.12 0.00 -1.73 -3.35 119.26 121.18 2ce9 h ALA 465 Ca 0.04 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2ce9 h ALA 465 Cb 1.93 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.44 2ce9 h ALA 465 CO 0.48 0.40 0.00 1.28 0.00 0.00 0.00 179.25 181.41 2ce9 n LEU 466 N -4.47 0.43 -3.86 0.00 4.77 -1.26 -4.74 117.00 107.87 2ce9 n LEU 466 Ca 0.13 -0.61 -0.12 0.00 -0.03 0.00 0.00 56.01 55.38 2ce9 n LEU 466 Cb 0.16 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.11 2ce9 n LEU 466 CO 0.34 0.11 -0.33 -0.63 -1.33 0.00 0.00 177.39 175.54 2ce9 s ILE 467 N -0.35 0.00 0.00 -0.08 -1.09 -1.26 -4.97 121.20 113.45 2ce9 s ILE 467 Ca 0.00 -0.00 0.00 0.00 -2.23 0.00 0.00 60.65 58.42 2ce9 s ILE 467 Cb 0.00 -0.04 0.00 0.00 -1.58 0.00 0.00 42.46 40.84 2ce9 s ILE 467 CO 0.00 -0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.32 2ce9 n GLY 468 N 3.06 2.47 3.66 6.18 0.00 -1.26 -4.52 105.19 114.78 2ce9 n GLY 468 Ca -0.12 -1.40 -0.50 0.00 0.00 0.00 0.00 46.02 44.00 2ce9 n GLY 468 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ce9 n PRO 469 N -1.45 1.71 -1.15 1.61 -0.02 -1.26 -1.36 135.00 133.07 2ce9 n PRO 469 Ca 0.00 0.62 -0.05 0.00 -2.02 0.00 0.00 63.50 62.05 2ce9 n PRO 469 Cb 0.00 -2.36 -0.02 0.00 -0.02 0.00 0.00 33.50 31.09 2ce9 n PRO 469 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ce9 n GLY 470 N 3.62 0.74 3.62 -1.23 0.00 -1.26 -5.00 105.19 105.68 2ce9 n GLY 470 Ca 0.21 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.99 5.20 0.51 -0.61 -1.09 -0.47 -4.90 121.20 117.86 2ce9 s ILE 471 Ca 0.00 0.55 -0.22 0.00 -2.23 0.00 0.00 60.65 58.74 2ce9 s ILE 471 Cb 0.00 -3.68 -0.07 0.00 -1.58 0.00 0.00 42.46 37.13 2ce9 s ILE 471 CO 0.00 0.20 1.22 -2.65 -1.23 0.00 0.00 174.94 172.48 2ce9 n PRO 472 N 5.02 1.57 -0.04 2.79 -0.02 -1.26 -4.69 135.00 138.38 2ce9 n PRO 472 Ca -0.09 0.57 0.03 0.00 -2.02 0.00 0.00 63.50 61.99 2ce9 n PRO 472 Cb 0.51 -2.39 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 2ce9 n PRO 472 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2ce9 n ARG 473 N -0.59 0.77 -3.63 -0.52 1.74 0.12 -4.92 116.66 109.63 2ce9 n ARG 473 Ca 0.10 -0.12 -0.10 0.00 -0.77 0.00 0.00 57.85 56.96 2ce9 n ARG 473 Cb 0.43 -1.46 -0.07 0.00 -1.02 0.00 0.00 32.46 30.35 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 -3.01 -0.48 -0.28 -1.55 5.04 -1.12 -4.74 115.29 109.15 2ce9 s HIS 474 Ca -0.08 1.12 -0.06 0.00 -1.54 0.00 0.00 55.06 54.51 2ce9 s HIS 474 Cb 0.10 0.37 0.01 0.00 0.04 0.00 0.00 32.58 33.10 2ce9 s HIS 474 CO 0.77 -0.26 0.05 0.00 -2.34 0.00 0.00 174.74 172.96 2ce9 s ALA 475 N 0.01 2.98 -0.21 1.58 0.00 -1.26 -0.44 121.76 124.41 2ce9 s ALA 475 Ca 0.02 -1.46 -0.11 0.00 0.00 0.00 0.00 51.96 50.42 2ce9 s ALA 475 Cb -0.04 -2.05 -0.05 0.00 0.00 0.00 0.00 23.12 20.98 2ce9 s ALA 475 CO -0.04 -0.90 0.17 0.50 0.00 0.00 0.00 175.76 175.48 2ce9 s ARG 476 N 1.46 4.15 -0.17 0.00 3.52 0.13 -4.92 118.95 123.12 2ce9 s ARG 476 Ca 0.02 -0.19 -0.29 0.00 -0.13 0.00 0.00 55.73 55.13 2ce9 s ARG 476 Cb -0.17 -3.47 -0.02 0.00 -1.56 0.00 0.00 34.95 29.73 2ce9 s ARG 476 CO 0.01 0.19 1.41 -0.65 -0.81 0.00 0.00 175.30 175.45 2ce9 s GLN 477 N 0.68 4.10 -0.06 5.12 -0.21 -1.26 0.13 119.66 128.15 2ce9 s GLN 477 Ca 0.09 1.71 0.09 0.00 0.02 0.00 0.00 55.36 57.28 2ce9 s GLN 477 Cb -0.12 -3.88 -0.13 0.00 1.00 0.00 0.00 33.01 29.88 2ce9 s GLN 477 CO 0.01 -0.90 0.11 0.44 -2.12 0.00 0.00 175.29 172.83 2ce9 n ILE 478 N 5.69 0.41 -3.92 1.08 -5.35 0.79 -4.92 119.36 113.14 2ce9 n ILE 478 Ca 0.16 -0.34 -0.11 0.00 -0.27 0.00 0.00 62.75 62.19 2ce9 n ILE 478 Cb 0.45 -0.36 -0.12 0.00 -1.74 0.00 0.00 39.64 37.86 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 -3.79 0.10 -0.15 7.28 -0.87 -1.12 -4.99 114.94 111.41 2ce9 s ASN 479 Ca -0.04 -0.24 -0.02 0.00 -1.57 0.00 0.00 52.86 51.00 2ce9 s ASN 479 Cb 0.04 0.09 -0.02 0.00 -0.02 0.00 0.00 41.25 41.35 2ce9 s ASN 479 CO 0.40 -0.18 -0.09 -0.89 -2.57 0.00 0.00 177.10 173.77 2ce9 s THR 480 N -0.83 3.35 -0.46 1.60 2.01 -1.26 -0.79 115.64 119.27 2ce9 s THR 480 Ca -0.09 -0.55 -0.12 0.00 0.31 0.00 0.00 61.69 61.24 2ce9 s THR 480 Cb -0.06 -2.44 0.09 0.00 0.01 0.00 0.00 72.50 70.10 2ce9 s THR 480 CO -0.00 0.51 0.34 -0.76 -0.69 0.00 0.00 174.62 174.01 2ce9 s LEU 481 N 0.45 5.50 -1.39 4.42 1.43 0.28 -4.70 118.68 124.67 2ce9 s LEU 481 Ca -0.07 -1.56 -0.14 0.00 -1.03 0.00 0.00 54.13 51.32 2ce9 s LEU 481 Cb -0.15 -2.07 0.07 0.00 0.03 0.00 0.00 46.19 44.07 2ce9 s LEU 481 CO 0.04 -0.63 2.05 0.59 0.23 0.00 0.00 176.35 178.63 2ce9 n ASN 482 N 5.03 4.31 -0.03 2.29 5.03 -1.26 -0.75 115.26 129.88 2ce9 n ASN 482 Ca -0.11 -2.90 -0.10 0.00 0.87 0.00 0.00 54.58 52.34 2ce9 n ASN 482 Cb 0.42 -1.65 -0.03 0.00 -1.02 0.00 0.00 39.78 37.51 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 6.31 0.13 0.00 3.10 2.76 -1.89 -3.47 115.15 122.08 2ce9 h HIS 483 Ca 0.51 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.69 2ce9 h HIS 483 Cb 0.69 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.62 2ce9 h HIS 483 CO 1.41 0.07 0.00 0.41 -1.30 0.00 0.00 177.93 178.52 2ce9 n GLY 484 N -1.15 0.41 3.10 5.26 0.00 0.20 -5.02 105.19 107.99 2ce9 n GLY 484 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.88 0.64 0.21 1.61 0.41 -1.25 -4.96 118.70 114.48 2ce9 s GLU 485 Ca 0.00 -0.97 -0.32 0.00 -0.41 0.00 0.00 54.97 53.26 2ce9 s GLU 485 Cb 0.00 -0.25 -0.13 0.00 -1.78 0.00 0.00 34.13 31.96 2ce9 s GLU 485 CO 0.00 0.02 1.51 0.28 -0.49 0.00 0.00 175.26 176.59 2ce9 n VAL 486 N 0.90 0.50 -3.21 2.63 0.31 -1.26 -3.99 118.33 114.21 2ce9 n VAL 486 Ca -0.19 -0.13 -0.46 0.00 -0.01 0.00 0.00 64.34 63.56 2ce9 n VAL 486 Cb 0.57 -1.57 -0.04 0.00 -0.91 0.00 0.00 33.84 31.90 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 0.42 5.15 -0.72 2.52 1.01 -1.00 -4.19 120.40 123.60 2ce9 s VAL 487 Ca 0.73 -1.65 0.25 0.00 0.00 0.00 0.00 61.98 61.31 2ce9 s VAL 487 Cb -0.64 -4.48 0.12 0.00 0.00 0.00 0.00 36.38 31.38 2ce9 s VAL 487 CO 0.44 -1.08 1.48 0.00 0.00 0.00 0.00 175.10 175.94 2ce9 s ALA 489 N -3.13 -0.66 0.03 0.00 0.00 -1.17 -4.66 121.76 112.18 2ce9 s ALA 489 Ca 0.08 0.95 0.03 0.00 0.00 0.00 0.00 51.96 53.02 2ce9 s ALA 489 Cb 0.14 -0.58 -0.02 0.00 0.00 0.00 0.00 23.12 22.66 2ce9 s ALA 489 CO 0.68 -0.17 -0.09 0.14 0.00 0.00 0.00 175.76 176.31 2ce9 s VAL 490 N 0.79 0.65 0.07 0.00 -7.23 -1.26 -0.14 120.40 113.27 2ce9 s VAL 490 Ca -0.05 -0.84 -0.11 0.00 -1.81 0.00 0.00 61.98 59.17 2ce9 s VAL 490 Cb -0.06 -0.64 0.01 0.00 0.56 0.00 0.00 36.38 36.25 2ce9 s VAL 490 CO -0.05 -0.16 0.25 0.28 -0.31 0.00 0.00 175.10 175.11 2ce9 s THR 491 N -0.92 0.11 -0.04 5.32 -1.32 -0.50 -4.57 115.64 113.72 2ce9 s THR 491 Ca -0.04 -0.89 0.05 0.00 -1.21 0.00 0.00 61.69 59.60 2ce9 s THR 491 Cb -0.07 -1.10 -0.01 0.00 -1.51 0.00 0.00 72.50 69.81 2ce9 s THR 491 CO 0.00 -0.49 -0.19 -0.63 -2.21 0.00 0.00 174.62 171.10 2ce9 s ILE 492 N -3.15 1.55 0.90 5.08 1.01 -1.26 -0.12 121.20 125.21 2ce9 s ILE 492 Ca -0.01 -0.80 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 2ce9 s ILE 492 Cb 0.01 -1.32 0.13 0.00 0.01 0.00 0.00 42.46 41.30 2ce9 s ILE 492 CO -0.07 0.44 1.10 -0.94 0.00 0.00 0.00 174.94 175.47 2ce9 s SER 493 N -0.14 3.26 -0.15 3.58 1.04 -0.39 -4.91 113.70 115.98 2ce9 s SER 493 Ca -0.00 1.82 -0.02 0.00 0.48 0.00 0.00 55.95 58.23 2ce9 s SER 493 Cb -0.11 -2.42 0.05 0.00 0.10 0.00 0.00 66.02 63.64 2ce9 s SER 493 CO 0.02 -2.83 -0.00 0.21 0.98 0.00 0.00 173.24 171.62 2ce9 s ASN 494 N -3.05 2.54 0.77 7.02 2.47 -1.26 -3.23 114.94 120.20 2ce9 s ASN 494 Ca 0.65 -0.58 -0.13 0.00 0.42 0.00 0.00 52.86 53.22 2ce9 s ASN 494 Cb -0.20 -0.66 0.06 0.00 -1.45 0.00 0.00 41.25 39.00 2ce9 s ASN 494 CO 0.58 -0.24 1.14 -2.16 -3.72 0.00 0.00 177.10 172.71 2ce9 s PRO 495 N 1.82 2.06 0.09 0.43 0.04 -1.26 -4.98 135.00 133.19 2ce9 s PRO 495 Ca 0.01 1.49 -0.31 0.00 0.04 0.00 0.00 61.00 62.24 2ce9 s PRO 495 Cb -0.15 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 2ce9 s PRO 495 CO -0.07 -1.84 1.79 0.99 0.04 0.00 0.00 177.00 177.91 2ce9 s THR 496 N -2.43 2.79 0.00 1.26 2.01 -1.20 -4.56 115.64 113.51 2ce9 s THR 496 Ca 0.68 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.87 2ce9 s THR 496 Cb -0.23 -3.13 0.00 0.00 0.01 0.00 0.00 72.50 69.15 2ce9 s THR 496 CO 0.50 -0.00 0.00 -1.14 -0.69 0.00 0.00 174.62 173.28 2ce9 n ARG 497 N 6.01 0.00 -4.69 4.92 0.63 -1.26 -4.93 116.66 117.33 2ce9 n ARG 497 Ca 0.17 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.77 2ce9 n ARG 497 Cb 0.39 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 33.18 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 -1.72 2.87 -0.01 -0.14 3.76 -1.26 -1.56 115.29 117.23 2ce9 s HIS 498 Ca 0.00 -0.10 0.03 0.00 -0.15 0.00 0.00 55.06 54.84 2ce9 s HIS 498 Cb 0.00 -1.72 -0.03 0.00 1.11 0.00 0.00 32.58 31.94 2ce9 s HIS 498 CO 0.00 0.22 -0.10 0.08 -0.85 0.00 0.00 174.74 174.10 2ce9 s VAL 499 N -0.61 3.44 -0.14 -0.90 1.01 -0.20 -1.26 120.40 121.73 2ce9 s VAL 499 Ca 0.09 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.31 2ce9 s VAL 499 Cb -0.11 -2.45 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 2ce9 s VAL 499 CO 0.02 0.46 -0.15 -0.31 0.00 0.00 0.00 175.10 175.11 2ce9 s TYR 500 N -0.91 2.78 -0.13 5.22 2.02 0.82 -1.25 117.35 125.90 2ce9 s TYR 500 Ca 0.15 -0.90 0.02 0.00 -0.37 0.00 0.00 57.07 55.97 2ce9 s TYR 500 Cb -0.11 -1.86 -0.00 0.00 -0.40 0.00 0.00 41.96 39.58 2ce9 s TYR 500 CO 0.05 -0.38 -0.19 0.95 -1.57 0.00 0.00 175.55 174.40 2ce9 s THR 501 N 0.64 2.40 -0.21 -0.71 -4.23 0.04 -1.41 115.64 112.16 2ce9 s THR 501 Ca -0.08 -0.88 -0.06 0.00 -1.18 0.00 0.00 61.69 59.48 2ce9 s THR 501 Cb -0.16 -1.97 -0.03 0.00 1.34 0.00 0.00 72.50 71.69 2ce9 s THR 501 CO 0.03 0.54 0.04 -0.83 -0.54 0.00 0.00 174.62 173.86 2ce9 s GLY 502 N 0.54 1.79 0.00 3.99 0.00 0.80 0.13 107.32 114.57 2ce9 s GLY 502 Ca -0.12 -0.96 0.00 0.00 0.00 0.00 0.00 44.72 43.65 2ce9 s GLY 502 CO 0.04 0.27 0.00 0.61 0.00 0.00 0.00 173.10 174.02 2ce9 n GLY 503 N 4.23 4.43 3.56 0.20 0.00 -0.58 -1.50 105.19 115.53 2ce9 n GLY 503 Ca -0.17 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.75 2ce9 n GLY 503 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2ce9 n LYS 504 N 0.00 1.32 -0.79 1.61 4.81 -1.26 -3.11 118.16 120.74 2ce9 n LYS 504 Ca 0.00 0.21 0.00 0.00 -0.87 0.00 0.00 58.31 57.65 2ce9 n LYS 504 Cb 0.00 -3.21 0.00 0.00 0.02 0.00 0.00 35.03 31.84 2ce9 n LYS 504 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ce9 n GLY 505 N 6.00 0.58 3.65 3.14 0.00 -0.42 -4.80 105.19 113.34 2ce9 n GLY 505 Ca 0.36 -0.21 -0.01 0.00 0.00 0.00 0.00 46.02 46.16 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 1.21 5.30 -0.04 0.00 1.01 0.05 -1.52 120.40 126.40 2ce9 s VAL 507 Ca -0.08 0.33 -0.04 0.00 0.00 0.00 0.00 61.98 62.20 2ce9 s VAL 507 Cb -0.03 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.73 2ce9 s VAL 507 CO -0.13 0.29 0.15 -0.54 0.00 0.00 0.00 175.10 174.87 2ce9 s LYS 508 N 1.32 3.36 -0.16 2.72 1.02 0.12 -0.18 119.74 127.94 2ce9 s LYS 508 Ca 0.11 -0.30 -0.02 0.00 0.02 0.00 0.00 55.97 55.78 2ce9 s LYS 508 Cb -0.14 -3.07 -0.02 0.00 -0.52 0.00 0.00 37.83 34.07 2ce9 s LYS 508 CO 0.07 0.70 -0.07 0.08 -0.92 0.00 0.00 175.35 175.21 2ce9 s VAL 509 N -1.20 3.51 -0.03 3.17 1.01 -0.18 -0.78 120.40 125.90 2ce9 s VAL 509 Ca 0.23 -0.49 0.05 0.00 0.00 0.00 0.00 61.98 61.77 2ce9 s VAL 509 Cb -0.12 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 2ce9 s VAL 509 CO 0.13 0.49 -0.19 0.26 0.00 0.00 0.00 175.10 175.80 2ce9 s TRP 510 N 0.54 1.74 -0.45 5.22 0.52 -0.38 -0.08 118.94 126.05 2ce9 s TRP 510 Ca -0.05 -0.39 -0.08 0.00 0.02 0.00 0.00 56.10 55.60 2ce9 s TRP 510 Cb -0.15 -1.14 0.11 0.00 -1.15 0.00 0.00 33.47 31.15 2ce9 s TRP 510 CO 0.03 -0.08 0.31 0.34 0.02 0.00 0.00 176.95 177.57 2ce9 s ASP 511 N -0.29 5.62 0.00 2.95 -1.08 -1.26 -1.04 116.67 121.57 2ce9 s ASP 511 Ca 0.03 -1.87 0.18 0.00 -0.52 0.00 0.00 52.55 50.37 2ce9 s ASP 511 Cb -0.09 -1.98 0.52 0.00 -1.46 0.00 0.00 42.92 39.92 2ce9 s ASP 511 CO 0.00 -0.65 1.42 2.30 0.52 0.00 0.00 175.17 178.77 2ce9 n ILE 512 N 4.86 0.49 -2.55 4.11 -5.35 -0.60 -4.29 119.36 116.02 2ce9 n ILE 512 Ca -0.07 -0.57 -0.42 0.00 -0.27 0.00 0.00 62.75 61.42 2ce9 n ILE 512 Cb 0.41 0.45 -0.00 0.00 -1.74 0.00 0.00 39.64 38.76 2ce9 n ILE 512 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2ce9 s SER 513 N -1.26 6.72 0.00 7.28 1.04 -1.25 -4.64 113.70 121.59 2ce9 s SER 513 Ca 0.33 -2.37 0.00 0.00 0.48 0.00 0.00 55.95 54.39 2ce9 s SER 513 Cb 0.18 -2.58 0.00 0.00 0.10 0.00 0.00 66.02 63.72 2ce9 s SER 513 CO 0.25 -1.29 0.00 1.41 0.98 0.00 0.00 173.24 174.59 2ce9 n HIS 514 N 8.76 0.00 -3.03 5.02 8.25 -1.26 -5.12 115.22 127.84 2ce9 n HIS 514 Ca 0.48 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.98 2ce9 n HIS 514 Cb 0.46 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.56 2ce9 n HIS 514 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2ce9 n PRO 515 N 0.00 -0.57 0.00 -0.41 -0.02 -1.26 -5.01 135.00 127.73 2ce9 n PRO 515 Ca 0.00 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2ce9 n PRO 515 Cb 0.00 -0.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.79 2ce9 n PRO 515 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ce9 n GLY 516 N -1.02 1.15 3.56 -1.23 0.00 -1.26 -5.09 105.19 101.30 2ce9 n GLY 516 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2ce9 n GLY 516 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2ce9 s ASN 517 N -2.00 4.51 0.00 1.61 3.04 -1.26 -4.76 114.94 116.07 2ce9 s ASN 517 Ca 0.00 0.09 0.00 0.00 0.04 0.00 0.00 52.86 52.99 2ce9 s ASN 517 Cb 0.00 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.17 2ce9 s ASN 517 CO 0.00 -3.19 0.00 1.17 -3.04 0.00 0.00 177.10 172.04 2ce9 n LYS 518 N 8.92 0.00 -0.47 0.43 4.81 -1.26 -4.49 118.16 126.09 2ce9 n LYS 518 Ca 0.40 0.05 -0.16 0.00 -0.87 0.00 0.00 58.31 57.73 2ce9 n LYS 518 Cb 0.48 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.54 2ce9 n LYS 518 CO 0.00 0.00 0.00 0.43 1.17 0.00 0.00 177.40 179.00 2ce9 n SER 519 N -0.02 -2.14 -4.76 3.14 7.64 -1.26 -4.82 113.62 111.39 2ce9 n SER 519 Ca 0.00 0.16 -0.35 0.00 1.01 0.00 0.00 58.87 59.69 2ce9 n SER 519 Cb 0.00 -0.34 0.04 0.00 -1.01 0.00 0.00 64.21 62.90 2ce9 n SER 519 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 2ce9 s PRO 520 N -0.67 2.93 0.27 1.43 0.02 -1.26 -4.78 135.00 132.94 2ce9 s PRO 520 Ca 0.20 1.63 0.20 0.00 0.02 0.00 0.00 61.00 63.04 2ce9 s PRO 520 Cb -0.13 -1.95 0.09 0.00 0.02 0.00 0.00 34.50 32.53 2ce9 s PRO 520 CO 0.32 -1.19 1.27 -0.39 -0.33 0.00 0.00 177.00 176.68 2ce9 h VAL 521 N 0.58 0.30 -3.15 3.83 -1.51 -0.84 -3.49 116.25 111.98 2ce9 h VAL 521 Ca -0.49 -1.48 0.03 0.00 -1.23 0.00 0.00 66.70 63.53 2ce9 h VAL 521 Cb 1.27 1.97 -0.05 0.00 -2.13 0.00 0.00 31.29 32.35 2ce9 h VAL 521 CO 0.55 0.17 0.16 -0.55 -1.23 0.00 0.00 177.57 176.67 2ce9 s SER 522 N -5.96 -0.18 -0.01 4.19 0.15 -1.14 -5.03 113.70 105.73 2ce9 s SER 522 Ca 0.02 -0.75 -0.19 0.00 0.70 0.00 0.00 55.95 55.74 2ce9 s SER 522 Cb 0.08 0.71 0.04 0.00 -1.71 0.00 0.00 66.02 65.13 2ce9 s SER 522 CO 0.75 -1.34 0.41 0.00 1.20 0.00 0.00 173.24 174.26 2ce9 s GLN 523 N -3.76 0.81 -0.30 5.44 -2.07 -1.26 -1.01 119.66 117.50 2ce9 s GLN 523 Ca 0.14 -0.14 0.03 0.00 -1.82 0.00 0.00 55.36 53.57 2ce9 s GLN 523 Cb -0.05 0.37 0.08 0.00 -1.09 0.00 0.00 33.01 32.32 2ce9 s GLN 523 CO 0.08 -0.24 -0.03 -0.51 -1.32 0.00 0.00 175.29 173.27 2ce9 s LEU 524 N -1.46 4.10 -0.24 2.60 1.43 0.74 -4.96 118.68 120.89 2ce9 s LEU 524 Ca -0.11 -1.77 -0.20 0.00 -1.03 0.00 0.00 54.13 51.02 2ce9 s LEU 524 Cb -0.03 -1.59 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 2ce9 s LEU 524 CO 0.04 -0.28 0.63 -1.81 0.23 0.00 0.00 176.35 175.15 2ce9 s ASP 525 N 1.01 6.60 0.70 2.29 1.01 -1.26 -0.77 116.67 126.25 2ce9 s ASP 525 Ca 0.01 0.74 -0.13 0.00 0.71 0.00 0.00 52.55 53.88 2ce9 s ASP 525 Cb -0.20 -2.34 0.02 0.00 1.01 0.00 0.00 42.92 41.41 2ce9 s ASP 525 CO -0.06 -0.34 1.09 0.00 0.21 0.00 0.00 175.17 176.07 2ce9 h LEU 527 N -0.44 0.07 -8.41 0.00 5.85 -1.98 -3.38 115.31 107.03 2ce9 h LEU 527 Ca -0.45 -0.18 -0.64 0.00 0.84 0.00 0.00 57.88 57.45 2ce9 h LEU 527 Cb 1.23 -0.02 -0.15 0.00 0.37 0.00 0.00 40.66 42.10 2ce9 h LEU 527 CO 0.54 0.23 0.39 0.21 -0.34 0.00 0.00 178.44 179.47 2ce9 s ASN 528 N -5.44 6.27 0.08 1.25 3.84 -1.26 -4.89 114.94 114.79 2ce9 s ASN 528 Ca -0.14 -0.67 0.21 0.00 0.21 0.00 0.00 52.86 52.47 2ce9 s ASN 528 Cb 0.05 -2.38 0.87 0.00 -0.55 0.00 0.00 41.25 39.24 2ce9 s ASN 528 CO 0.68 -1.16 1.67 -2.11 -2.79 0.00 0.00 177.10 173.39 2ce9 n ARG 529 N 7.07 0.08 0.00 0.43 1.85 -1.26 -1.27 116.66 123.56 2ce9 n ARG 529 Ca -0.02 0.22 0.13 0.00 -1.00 0.00 0.00 57.85 57.18 2ce9 n ARG 529 Cb 0.46 -1.62 0.30 0.00 -1.05 0.00 0.00 32.46 30.56 2ce9 n ARG 529 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2ce9 n ASP 530 N -1.76 2.05 -4.63 2.89 8.00 -1.26 -3.85 116.55 117.99 2ce9 n ASP 530 Ca 0.04 -1.62 -0.42 0.00 0.71 0.00 0.00 54.79 53.51 2ce9 n ASP 530 Cb 0.26 0.06 -0.05 0.00 -0.02 0.00 0.00 41.12 41.37 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 -2.10 6.74 0.09 -2.24 0.01 -0.39 -4.85 114.94 112.20 2ce9 s ASN 531 Ca 0.31 0.89 -0.31 0.00 -0.71 0.00 0.00 52.86 53.04 2ce9 s ASN 531 Cb 0.20 -2.41 -0.06 0.00 0.41 0.00 0.00 41.25 39.39 2ce9 s ASN 531 CO 0.36 -0.51 1.23 -0.31 -1.51 0.00 0.00 177.10 176.36 2ce9 s TYR 532 N 2.81 3.40 0.05 2.20 1.51 -1.26 -1.30 117.35 124.76 2ce9 s TYR 532 Ca 0.33 1.26 -0.25 0.00 -1.01 0.00 0.00 57.07 57.40 2ce9 s TYR 532 Cb -0.15 -3.47 -0.05 0.00 -0.11 0.00 0.00 41.96 38.18 2ce9 s TYR 532 CO 0.09 -1.45 0.77 0.42 -1.11 0.00 0.00 175.55 174.26 2ce9 s ILE 533 N 0.89 4.72 -0.04 2.71 1.01 -1.23 -0.81 121.20 128.45 2ce9 s ILE 533 Ca 0.59 1.63 0.07 0.00 0.00 0.00 0.00 60.65 62.95 2ce9 s ILE 533 Cb -0.31 -4.12 -0.11 0.00 0.01 0.00 0.00 42.46 37.93 2ce9 s ILE 533 CO 0.31 0.37 0.11 0.54 0.00 0.00 0.00 174.94 176.26 2ce9 n ARG 534 N 2.79 1.36 -3.66 2.79 5.12 0.26 -4.54 116.66 120.77 2ce9 n ARG 534 Ca -0.02 -0.04 -0.15 0.00 -1.93 0.00 0.00 57.85 55.70 2ce9 n ARG 534 Cb 0.50 -1.19 -0.08 0.00 -1.16 0.00 0.00 32.46 30.53 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 -3.35 -0.42 -0.08 0.55 0.15 -0.74 -4.57 113.70 105.24 2ce9 s SER 535 Ca -0.03 0.47 -0.07 0.00 0.70 0.00 0.00 55.95 57.02 2ce9 s SER 535 Cb 0.04 0.51 0.02 0.00 -1.71 0.00 0.00 66.02 64.88 2ce9 s SER 535 CO 0.32 -0.47 0.20 0.00 1.20 0.00 0.00 173.24 174.50 2ce9 s LYS 537 N 0.29 0.29 -0.10 0.00 -0.14 -0.28 -4.64 119.74 115.16 2ce9 s LYS 537 Ca -0.01 -0.12 -0.09 0.00 -1.36 0.00 0.00 55.97 54.39 2ce9 s LYS 537 Cb -0.03 -0.29 -0.04 0.00 -1.68 0.00 0.00 37.83 35.79 2ce9 s LYS 537 CO -0.01 0.07 0.19 -1.17 -0.76 0.00 0.00 175.35 173.67 2ce9 s LEU 538 N -0.04 4.40 0.42 3.17 2.96 -1.26 -0.91 118.68 127.41 2ce9 s LEU 538 Ca 0.01 0.55 -0.20 0.00 -0.22 0.00 0.00 54.13 54.27 2ce9 s LEU 538 Cb -0.02 -2.17 -0.11 0.00 0.50 0.00 0.00 46.19 44.40 2ce9 s LEU 538 CO -0.00 0.39 0.92 -0.76 -1.32 0.00 0.00 176.35 175.57 2ce9 s LEU 539 N -0.98 3.95 0.55 -0.68 1.43 -1.03 -4.99 118.68 116.94 2ce9 s LEU 539 Ca 0.16 1.63 0.25 0.00 -1.03 0.00 0.00 54.13 55.15 2ce9 s LEU 539 Cb -0.13 -4.48 1.48 0.00 0.03 0.00 0.00 46.19 43.09 2ce9 s LEU 539 CO 0.06 -0.34 2.05 -0.65 0.23 0.00 0.00 176.35 177.69 2ce9 h PRO 540 N 1.94 0.00 0.00 1.29 0.11 -1.95 -3.38 132.00 130.01 2ce9 h PRO 540 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2ce9 h PRO 540 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2ce9 h PRO 540 CO 0.62 0.00 0.51 -0.25 -0.21 0.00 0.00 178.00 178.67 2ce9 n ASP 541 N -4.15 0.16 -3.00 -2.05 8.00 -1.26 -4.76 116.55 109.49 2ce9 n ASP 541 Ca 0.05 0.39 -0.17 0.00 0.71 0.00 0.00 54.79 55.76 2ce9 n ASP 541 Cb 0.43 -0.25 -0.02 0.00 -0.02 0.00 0.00 41.12 41.26 2ce9 n ASP 541 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ce9 n GLY 542 N -1.25 1.68 0.00 0.44 0.00 -1.26 -4.91 105.19 99.88 2ce9 n GLY 542 Ca -0.00 -0.84 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 0.00 0.35 -0.07 0.00 -1.32 -1.26 0.61 115.64 113.95 2ce9 s THR 544 Ca 0.00 -1.10 0.02 0.00 -1.21 0.00 0.00 61.69 59.41 2ce9 s THR 544 Cb 0.00 -0.57 0.01 0.00 -1.51 0.00 0.00 72.50 70.43 2ce9 s THR 544 CO 0.00 -0.49 -0.13 -0.22 -2.21 0.00 0.00 174.62 171.57 2ce9 s LEU 545 N -1.69 1.64 -0.22 9.08 2.96 -0.45 -2.45 118.68 127.55 2ce9 s LEU 545 Ca -0.10 -0.31 -0.12 0.00 -0.22 0.00 0.00 54.13 53.38 2ce9 s LEU 545 Cb -0.08 -0.86 -0.05 0.00 0.50 0.00 0.00 46.19 45.70 2ce9 s LEU 545 CO -0.01 0.03 0.21 -0.63 -1.32 0.00 0.00 176.35 174.63 2ce9 s ILE 546 N 0.71 5.33 -0.08 6.68 1.01 -0.09 -0.97 121.20 133.80 2ce9 s ILE 546 Ca -0.14 0.31 0.05 0.00 0.00 0.00 0.00 60.65 60.88 2ce9 s ILE 546 Cb -0.16 -3.55 -0.00 0.00 0.01 0.00 0.00 42.46 38.76 2ce9 s ILE 546 CO 0.03 0.35 -0.24 -0.69 0.00 0.00 0.00 174.94 174.39 2ce9 s VAL 547 N 0.94 2.03 0.09 2.92 1.01 -0.39 -1.13 120.40 125.87 2ce9 s VAL 547 Ca 0.11 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.09 2ce9 s VAL 547 Cb -0.13 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.47 2ce9 s VAL 547 CO 0.04 0.56 -0.08 -0.83 0.00 0.00 0.00 175.10 174.79 2ce9 s GLY 548 N 0.13 0.77 0.00 4.51 0.00 -0.52 -0.95 107.32 111.27 2ce9 s GLY 548 Ca -0.12 -1.20 0.00 0.00 0.00 0.00 0.00 44.72 43.40 2ce9 s GLY 548 CO 0.07 -1.28 0.00 0.61 0.00 0.00 0.00 173.10 172.49 2ce9 n GLY 549 N 0.43 1.14 2.83 0.20 0.00 -1.25 -0.58 105.19 107.96 2ce9 n GLY 549 Ca -0.15 0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -3.52 1.61 1.02 0.01 -0.66 120.64 122.51 2ce9 n GLU 550 Ca 0.00 -3.28 -0.09 0.00 -0.02 0.00 0.00 57.16 53.77 2ce9 n GLU 550 Cb 0.00 -3.02 -0.03 0.00 -0.02 0.00 0.00 31.44 28.37 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 1.13 -1.85 -0.48 0.62 0.00 -1.04 -4.60 121.76 115.53 2ce9 s ALA 551 Ca 0.42 1.14 0.25 0.00 0.00 0.00 0.00 51.96 53.77 2ce9 s ALA 551 Cb 0.11 0.20 0.97 0.00 0.00 0.00 0.00 23.12 24.39 2ce9 s ALA 551 CO -0.02 -0.62 1.75 0.77 0.00 0.00 0.00 175.76 177.64 2ce9 h SER 552 N 2.11 0.00 -3.38 0.00 0.02 -1.74 -3.34 113.55 107.22 2ce9 h SER 552 Ca -0.21 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 60.08 2ce9 h SER 552 Cb 1.22 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.63 2ce9 h SER 552 CO 0.31 0.00 -0.65 0.42 -1.14 0.00 0.00 176.83 175.76 2ce9 s THR 553 N -3.30 4.09 -0.09 -2.27 -4.23 -1.26 0.05 115.64 108.62 2ce9 s THR 553 Ca 0.05 -0.67 -0.12 0.00 -1.18 0.00 0.00 61.69 59.77 2ce9 s THR 553 Cb 0.10 -2.84 -0.05 0.00 1.34 0.00 0.00 72.50 71.05 2ce9 s THR 553 CO 0.46 0.34 0.30 -0.76 -0.54 0.00 0.00 174.62 174.42 2ce9 s LEU 554 N -1.65 4.37 -0.22 4.79 1.43 -0.22 -4.54 118.68 122.64 2ce9 s LEU 554 Ca 0.20 0.67 -0.10 0.00 -1.03 0.00 0.00 54.13 53.87 2ce9 s LEU 554 Cb -0.11 -2.37 -0.05 0.00 0.03 0.00 0.00 46.19 43.68 2ce9 s LEU 554 CO 0.11 0.27 0.14 -0.44 0.23 0.00 0.00 176.35 176.66 2ce9 s SER 555 N -0.51 6.09 -0.31 2.29 0.01 -0.13 -0.81 113.70 120.34 2ce9 s SER 555 Ca 0.19 0.14 -0.11 0.00 1.31 0.00 0.00 55.95 57.48 2ce9 s SER 555 Cb -0.14 -2.09 -0.02 0.00 0.21 0.00 0.00 66.02 63.98 2ce9 s SER 555 CO 0.07 0.11 0.18 -0.63 0.41 0.00 0.00 173.24 173.39 2ce9 s ILE 556 N 0.78 4.97 -0.23 1.44 1.01 -0.05 -1.26 121.20 127.86 2ce9 s ILE 556 Ca 0.07 -0.19 -0.08 0.00 0.00 0.00 0.00 60.65 60.46 2ce9 s ILE 556 Cb -0.13 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.83 2ce9 s ILE 556 CO 0.02 0.11 0.09 0.26 0.00 0.00 0.00 174.94 175.43 2ce9 s TRP 557 N 1.69 3.17 -0.31 3.97 0.52 -0.15 0.45 118.94 128.28 2ce9 s TRP 557 Ca 0.06 -0.13 -0.29 0.00 0.02 0.00 0.00 56.10 55.76 2ce9 s TRP 557 Cb -0.17 -2.21 0.00 0.00 -1.15 0.00 0.00 33.47 29.94 2ce9 s TRP 557 CO 0.09 -0.13 1.31 0.34 0.02 0.00 0.00 176.95 178.57 2ce9 s ASP 558 N 1.20 6.63 -0.25 2.95 2.15 0.10 -1.35 116.67 128.12 2ce9 s ASP 558 Ca 0.05 1.16 0.00 0.00 0.43 0.00 0.00 52.55 54.19 2ce9 s ASP 558 Cb -0.14 -2.54 -0.18 0.00 -0.30 0.00 0.00 42.92 39.76 2ce9 s ASP 558 CO 0.04 -1.12 -0.18 0.18 -0.17 0.00 0.00 175.17 173.92 2ce9 n LEU 559 N 7.76 2.90 0.00 -1.34 4.77 0.20 -1.66 117.00 129.63 2ce9 n LEU 559 Ca 0.15 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2ce9 n LEU 559 Cb 0.47 -0.93 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 2ce9 n LEU 559 CO 0.64 0.91 0.50 0.00 -1.33 0.00 0.00 177.39 178.11 2ce9 n ALA 560 N -3.28 0.22 -1.12 -1.18 0.00 -0.91 -3.07 120.51 111.16 2ce9 n ALA 560 Ca -0.45 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 52.95 2ce9 n ALA 560 Cb 0.99 -0.22 0.27 0.00 0.00 0.00 0.00 19.45 20.50 2ce9 n ALA 560 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ce9 n ALA 561 N -1.10 4.35 0.00 0.00 0.00 -1.26 -5.07 120.51 117.42 2ce9 n ALA 561 Ca 0.00 -2.51 0.00 0.00 0.00 0.00 0.00 53.44 50.93 2ce9 n ALA 561 Cb 0.39 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2ce9 n ALA 561 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2ce9 n PRO 562 N -0.45 0.00 -0.94 0.00 -0.02 -1.18 -4.67 135.00 127.74 2ce9 n PRO 562 Ca 0.38 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.86 2ce9 n PRO 562 Cb 1.27 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.75 2ce9 n PRO 562 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2ce9 n THR 563 N 0.12 -0.37 -0.43 3.45 -1.04 -1.26 -5.08 114.28 109.67 2ce9 n THR 563 Ca 0.00 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.84 2ce9 n THR 563 Cb 0.00 -1.59 -0.02 0.00 -1.82 0.00 0.00 70.33 66.89 2ce9 n THR 563 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2ce9 n PRO 564 N -0.75 0.00 -4.22 -2.82 -0.02 -1.26 -5.00 135.00 120.93 2ce9 n PRO 564 Ca 0.00 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.27 2ce9 n PRO 564 Cb 0.28 -0.42 -0.12 0.00 -0.02 0.00 0.00 33.50 33.22 2ce9 n PRO 564 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 2ce9 s ARG 565 N 0.10 0.95 0.01 -0.52 3.03 -0.67 -4.99 118.95 116.86 2ce9 s ARG 565 Ca 0.26 -1.04 -0.30 0.00 2.03 0.00 0.00 55.73 56.68 2ce9 s ARG 565 Cb -0.36 -1.07 -0.05 0.00 -1.03 0.00 0.00 34.95 32.44 2ce9 s ARG 565 CO 0.17 0.24 1.32 -1.50 -1.13 0.00 0.00 175.30 174.40 2ce9 s ILE 566 N -1.22 3.85 -0.26 4.99 2.07 -1.26 0.02 121.20 129.39 2ce9 s ILE 566 Ca 0.02 1.25 -0.04 0.00 -1.41 0.00 0.00 60.65 60.46 2ce9 s ILE 566 Cb -0.10 -3.80 -0.16 0.00 0.13 0.00 0.00 42.46 38.53 2ce9 s ILE 566 CO 0.03 0.02 -0.22 1.17 -1.91 0.00 0.00 174.94 174.03 2ce9 n LYS 567 N 4.98 0.64 -3.65 3.50 4.81 0.17 -4.87 118.16 123.75 2ce9 n LYS 567 Ca 0.12 0.20 -0.15 0.00 -0.87 0.00 0.00 58.31 57.61 2ce9 n LYS 567 Cb 0.44 -1.53 -0.08 0.00 0.02 0.00 0.00 35.03 33.89 2ce9 n LYS 567 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ce9 s ALA 568 N -2.51 -1.37 -0.10 3.14 0.00 -1.15 -5.01 121.76 114.75 2ce9 s ALA 568 Ca -0.35 1.20 0.01 0.00 0.00 0.00 0.00 51.96 52.82 2ce9 s ALA 568 Cb 0.11 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2ce9 s ALA 568 CO 0.57 -0.30 -0.13 -1.21 0.00 0.00 0.00 175.76 174.69 2ce9 s GLU 569 N -0.57 3.11 -0.37 0.00 0.41 -1.26 -0.87 118.70 119.15 2ce9 s GLU 569 Ca -0.07 -0.68 -0.11 0.00 -0.41 0.00 0.00 54.97 53.70 2ce9 s GLU 569 Cb -0.03 -2.56 0.02 0.00 -1.78 0.00 0.00 34.13 29.78 2ce9 s GLU 569 CO 0.05 0.35 0.21 -0.51 -0.49 0.00 0.00 175.26 174.87 2ce9 s LEU 570 N -0.00 4.70 -0.20 1.80 1.43 0.01 -4.96 118.68 121.46 2ce9 s LEU 570 Ca -0.04 -0.92 -0.16 0.00 -1.03 0.00 0.00 54.13 51.98 2ce9 s LEU 570 Cb -0.14 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2ce9 s LEU 570 CO 0.04 -0.37 0.43 -0.89 0.23 0.00 0.00 176.35 175.79 2ce9 s THR 571 N 1.58 5.18 0.33 5.49 2.01 -1.26 -1.06 115.64 127.91 2ce9 s THR 571 Ca 0.03 0.77 0.01 0.00 0.31 0.00 0.00 61.69 62.81 2ce9 s THR 571 Cb -0.19 -3.76 -0.03 0.00 0.01 0.00 0.00 72.50 68.53 2ce9 s THR 571 CO 0.07 0.24 0.51 -0.55 -0.69 0.00 0.00 174.62 174.20 2ce9 s SER 572 N 1.06 6.30 0.10 3.53 0.15 0.11 -5.00 113.70 119.95 2ce9 s SER 572 Ca 0.20 0.37 0.23 0.00 0.70 0.00 0.00 55.95 57.46 2ce9 s SER 572 Cb -0.15 -1.99 0.08 0.00 -1.71 0.00 0.00 66.02 62.25 2ce9 s SER 572 CO 0.08 -0.25 1.06 -1.54 1.20 0.00 0.00 173.24 173.79 2ce9 n SER 573 N -1.71 0.66 -4.76 5.45 3.41 -1.26 -4.82 113.62 110.58 2ce9 n SER 573 Ca -0.06 0.04 -0.40 0.00 -0.26 0.00 0.00 58.87 58.19 2ce9 n SER 573 Cb 0.56 0.63 -0.04 0.00 -0.26 0.00 0.00 64.21 65.11 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 -3.26 3.39 0.31 7.33 0.00 -1.26 -4.96 121.76 123.30 2ce9 s ALA 574 Ca 0.02 0.98 0.38 0.00 0.00 0.00 0.00 51.96 53.33 2ce9 s ALA 574 Cb 0.13 -3.36 1.75 0.00 0.00 0.00 0.00 23.12 21.63 2ce9 s ALA 574 CO 0.79 -0.31 2.13 -1.35 0.00 0.00 0.00 175.76 177.02 2ce9 h PRO 575 N 3.54 0.00 -3.06 0.00 0.11 -1.90 -3.39 132.00 127.30 2ce9 h PRO 575 Ca -0.47 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 2ce9 h PRO 575 Cb 1.22 0.00 -0.19 0.00 0.11 0.00 0.00 31.00 32.14 2ce9 h PRO 575 CO 0.66 0.00 -0.23 0.00 -0.21 0.00 0.00 178.00 178.22 2ce9 s ALA 576 N -3.85 -0.82 -0.14 -0.75 0.00 -1.25 -2.49 121.76 112.46 2ce9 s ALA 576 Ca -0.01 0.28 -0.02 0.00 0.00 0.00 0.00 51.96 52.22 2ce9 s ALA 576 Cb 0.10 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.37 2ce9 s ALA 576 CO 0.50 -0.32 -0.09 0.00 0.00 0.00 0.00 175.76 175.84 2ce9 n TYR 578 N 3.53 0.00 -3.57 0.00 4.01 -0.32 -3.74 117.16 117.07 2ce9 n TYR 578 Ca -0.18 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.46 2ce9 n TYR 578 Cb 0.53 -0.28 -0.05 0.00 -0.31 0.00 0.00 39.34 39.23 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 -2.97 -1.93 0.12 -0.72 0.00 -1.25 -4.66 121.76 110.35 2ce9 s ALA 579 Ca -0.03 1.53 0.06 0.00 0.00 0.00 0.00 51.96 53.52 2ce9 s ALA 579 Cb 0.11 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 2ce9 s ALA 579 CO 0.66 -0.36 -0.15 -0.51 0.00 0.00 0.00 175.76 175.41 2ce9 s LEU 580 N -1.28 2.39 -0.03 0.00 1.43 -1.26 -0.10 118.68 119.83 2ce9 s LEU 580 Ca -0.01 -0.79 -0.05 0.00 -1.03 0.00 0.00 54.13 52.26 2ce9 s LEU 580 Cb -0.01 -0.60 0.01 0.00 0.03 0.00 0.00 46.19 45.62 2ce9 s LEU 580 CO 0.00 -0.11 0.11 0.00 0.23 0.00 0.00 176.35 176.58 2ce9 s ALA 581 N -1.98 -0.27 -0.08 4.21 0.00 -0.68 -4.89 121.76 118.06 2ce9 s ALA 581 Ca 0.08 0.12 -0.01 0.00 0.00 0.00 0.00 51.96 52.15 2ce9 s ALA 581 Cb -0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 22.95 2ce9 s ALA 581 CO 0.03 -0.11 -0.02 0.42 0.00 0.00 0.00 175.76 176.08 2ce9 s ILE 582 N -0.49 4.09 0.63 0.00 -1.09 -1.26 -0.54 121.20 122.54 2ce9 s ILE 582 Ca -0.06 -0.33 -0.19 0.00 -2.23 0.00 0.00 60.65 57.85 2ce9 s ILE 582 Cb -0.04 -2.71 -0.02 0.00 -1.58 0.00 0.00 42.46 38.11 2ce9 s ILE 582 CO 0.00 0.60 1.28 -0.94 -1.23 0.00 0.00 174.94 174.65 2ce9 s SER 583 N -0.78 4.80 0.56 3.58 1.04 -0.07 -4.90 113.70 117.92 2ce9 s SER 583 Ca 0.12 2.58 0.26 0.00 0.48 0.00 0.00 55.95 59.39 2ce9 s SER 583 Cb -0.11 -2.62 1.48 0.00 0.10 0.00 0.00 66.02 64.87 2ce9 s SER 583 CO 0.02 -1.87 2.03 -0.65 0.98 0.00 0.00 173.24 173.74 2ce9 h PRO 584 N 0.70 0.00 -0.00 4.02 0.11 -1.95 0.64 132.00 135.52 2ce9 h PRO 584 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2ce9 h PRO 584 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 2ce9 h PRO 584 CO 0.54 0.00 -0.35 -0.40 -0.21 0.00 0.00 178.00 177.58 2ce9 n ASP 585 N -4.11 0.57 -0.00 -2.05 5.75 -1.26 -4.95 116.55 110.49 2ce9 n ASP 585 Ca 0.06 -0.36 -0.00 0.00 -0.01 0.00 0.00 54.79 54.48 2ce9 n ASP 585 Cb 0.49 0.11 -0.00 0.00 -1.03 0.00 0.00 41.12 40.69 2ce9 n ASP 585 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 2ce9 n SER 586 N -1.24 -3.34 0.14 -1.12 7.64 0.22 -4.90 113.62 111.02 2ce9 n SER 586 Ca 0.08 0.00 0.04 0.00 1.01 0.00 0.00 58.87 60.01 2ce9 n SER 586 Cb 0.33 -0.84 0.04 0.00 -1.01 0.00 0.00 64.21 62.73 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 0.88 0.00 -4.92 1.43 2.10 -1.93 -3.46 116.57 110.67 2ce9 h LYS 587 Ca -0.00 0.00 -0.43 0.00 -2.00 0.00 0.00 60.65 58.22 2ce9 h LYS 587 Cb 0.11 0.00 -0.29 0.00 -0.90 0.00 0.00 32.23 31.15 2ce9 h LYS 587 CO 0.00 0.37 -0.79 0.08 -2.00 0.00 0.00 179.45 177.11 2ce9 s VAL 588 N -3.02 0.86 -0.11 0.07 1.01 -1.26 -0.30 120.40 117.66 2ce9 s VAL 588 Ca 0.04 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2ce9 s VAL 588 Cb 0.07 -0.73 -0.00 0.00 0.00 0.00 0.00 36.38 35.72 2ce9 s VAL 588 CO 0.74 0.25 -0.21 0.00 0.00 0.00 0.00 175.10 175.88 2ce9 s PHE 590 N 0.36 3.26 -0.14 0.00 0.08 0.30 -1.21 117.98 120.63 2ce9 s PHE 590 Ca -0.16 0.09 -0.02 0.00 0.12 0.00 0.00 56.93 56.96 2ce9 s PHE 590 Cb -0.17 -2.24 -0.02 0.00 -0.57 0.00 0.00 43.02 40.01 2ce9 s PHE 590 CO 0.08 -0.00 -0.08 0.45 -0.10 0.00 0.00 175.22 175.56 2ce9 s SER 591 N 1.09 4.42 -0.49 1.36 0.15 0.13 -1.69 113.70 118.68 2ce9 s SER 591 Ca 0.06 -0.21 -0.24 0.00 0.70 0.00 0.00 55.95 56.26 2ce9 s SER 591 Cb -0.14 -1.65 0.03 0.00 -1.71 0.00 0.00 66.02 62.56 2ce9 s SER 591 CO 0.04 0.18 0.86 0.00 1.20 0.00 0.00 173.24 175.53 2ce9 h SER 594 N 3.08 0.00 0.23 0.00 4.64 -0.91 -1.00 113.55 119.58 2ce9 h SER 594 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2ce9 h SER 594 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 2ce9 h SER 594 CO 0.67 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.73 2ce9 n ASP 595 N -2.71 0.00 0.00 4.97 5.68 -1.26 -1.49 116.55 121.73 2ce9 n ASP 595 Ca -0.02 -0.62 0.00 0.00 -0.50 0.00 0.00 54.79 53.65 2ce9 n ASP 595 Cb 0.10 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 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 1.03 2.87 3.77 6.12 0.00 -0.42 -4.55 105.19 114.01 2ce9 n GLY 596 Ca 0.19 0.00 -0.37 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 0.73 5.82 -0.47 1.61 0.02 -1.26 -4.05 114.94 117.34 2ce9 s ASN 597 Ca 0.00 2.38 -0.12 0.00 -1.02 0.00 0.00 52.86 54.10 2ce9 s ASN 597 Cb 0.00 -2.60 0.10 0.00 0.02 0.00 0.00 41.25 38.77 2ce9 s ASN 597 CO 0.00 -1.16 0.36 -0.63 0.02 0.00 0.00 177.10 175.69 2ce9 s ILE 598 N -1.54 4.63 0.06 0.60 1.09 -0.30 -0.71 121.20 125.03 2ce9 s ILE 598 Ca 0.68 -1.47 -0.30 0.00 -1.10 0.00 0.00 60.65 58.46 2ce9 s ILE 598 Cb -0.30 -3.91 -0.05 0.00 -1.06 0.00 0.00 42.46 37.14 2ce9 s ILE 598 CO 0.36 -0.68 1.12 0.00 -0.10 0.00 0.00 174.94 175.63 2ce9 s ALA 599 N 1.49 3.32 -0.29 9.38 0.00 -0.53 -0.21 121.76 134.91 2ce9 s ALA 599 Ca 0.04 0.75 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 2ce9 s ALA 599 Cb -0.26 -3.40 0.03 0.00 0.00 0.00 0.00 23.12 19.49 2ce9 s ALA 599 CO 0.02 -0.34 0.03 0.08 0.00 0.00 0.00 175.76 175.55 2ce9 s VAL 600 N 0.88 3.38 -0.19 0.00 1.01 -0.53 0.22 120.40 125.18 2ce9 s VAL 600 Ca 0.55 -1.05 -0.05 0.00 0.00 0.00 0.00 61.98 61.44 2ce9 s VAL 600 Cb -0.27 -2.82 -0.03 0.00 0.00 0.00 0.00 36.38 33.26 2ce9 s VAL 600 CO 0.29 0.01 -0.01 0.26 0.00 0.00 0.00 175.10 175.66 2ce9 s TRP 601 N 1.37 3.05 -0.17 5.22 0.52 -0.35 -0.71 118.94 127.87 2ce9 s TRP 601 Ca -0.01 -0.38 -0.29 0.00 0.02 0.00 0.00 56.10 55.44 2ce9 s TRP 601 Cb -0.18 -2.05 -0.01 0.00 -1.15 0.00 0.00 33.47 30.08 2ce9 s TRP 601 CO -0.00 -0.16 1.22 0.34 0.02 0.00 0.00 176.95 178.36 2ce9 s ASP 602 N 0.79 6.98 0.05 2.95 2.15 0.11 -1.83 116.67 127.87 2ce9 s ASP 602 Ca 0.00 1.64 -0.16 0.00 0.43 0.00 0.00 52.55 54.46 2ce9 s ASP 602 Cb -0.14 -2.54 -0.25 0.00 -0.30 0.00 0.00 42.92 39.69 2ce9 s ASP 602 CO 0.02 -0.73 1.14 -0.07 -0.17 0.00 0.00 175.17 175.35 2ce9 h LEU 603 N 9.60 0.80 -0.41 -1.34 3.38 -0.96 0.99 115.31 127.36 2ce9 h LEU 603 Ca -0.25 -0.77 -0.01 0.00 0.09 0.00 0.00 57.88 56.93 2ce9 h LEU 603 Cb 1.10 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2ce9 h LEU 603 CO 0.97 1.47 0.20 -0.74 0.09 0.00 0.00 178.44 180.43 2ce9 h HIS 604 N 0.22 0.59 -0.01 1.13 2.76 -1.92 -3.23 115.15 114.69 2ce9 h HIS 604 Ca -0.13 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.01 2ce9 h HIS 604 Cb 1.65 -0.18 0.00 0.00 1.55 0.00 0.00 27.41 30.42 2ce9 h HIS 604 CO 0.12 0.48 -0.31 0.09 -1.30 0.00 0.00 177.93 177.01 2ce9 n ASN 605 N -4.69 1.63 -3.70 3.26 3.02 -1.23 -4.95 115.26 108.61 2ce9 n ASN 605 Ca 0.00 -1.29 -0.23 0.00 -0.03 0.00 0.00 54.58 53.04 2ce9 n ASN 605 Cb 0.11 0.26 0.04 0.00 -0.61 0.00 0.00 39.78 39.58 2ce9 n ASN 605 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ce9 n GLN 606 N -0.17 -5.66 -4.06 3.52 6.02 0.31 -4.98 117.38 112.36 2ce9 n GLN 606 Ca 0.12 0.67 -0.13 0.00 -0.01 0.00 0.00 57.00 57.65 2ce9 n GLN 606 Cb 0.42 -5.44 -0.13 0.00 1.02 0.00 0.00 30.24 26.11 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 -3.50 0.37 -0.35 5.09 -1.32 -0.98 -4.97 115.64 109.98 2ce9 s THR 607 Ca 0.23 -0.64 -0.29 0.00 -1.21 0.00 0.00 61.69 59.77 2ce9 s THR 607 Cb -0.11 -0.40 0.01 0.00 -1.51 0.00 0.00 72.50 70.49 2ce9 s THR 607 CO 0.80 -0.19 1.23 -0.22 -2.21 0.00 0.00 174.62 174.02 2ce9 s LEU 608 N -0.90 3.81 -0.08 9.08 2.96 -1.26 0.04 118.68 132.34 2ce9 s LEU 608 Ca -0.06 0.99 0.17 0.00 -0.22 0.00 0.00 54.13 55.01 2ce9 s LEU 608 Cb -0.06 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.86 2ce9 s LEU 608 CO -0.00 -1.10 0.43 1.33 -1.32 0.00 0.00 176.35 175.69 2ce9 n VAL 609 N 6.34 1.16 -3.65 1.68 0.24 0.11 -4.97 118.33 119.25 2ce9 n VAL 609 Ca 0.14 -0.75 -0.02 0.00 -2.04 0.00 0.00 64.34 61.67 2ce9 n VAL 609 Cb 0.47 -0.56 -0.01 0.00 -1.47 0.00 0.00 33.84 32.27 2ce9 n VAL 609 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ce9 s ARG 610 N -2.78 0.68 -0.04 7.34 1.70 -1.22 -5.04 118.95 119.59 2ce9 s ARG 610 Ca -0.07 -0.35 0.04 0.00 -0.47 0.00 0.00 55.73 54.88 2ce9 s ARG 610 Cb 0.08 0.25 -0.00 0.00 -0.57 0.00 0.00 34.95 34.71 2ce9 s ARG 610 CO 0.84 -0.31 -0.15 -0.65 -1.08 0.00 0.00 175.30 173.95 2ce9 s GLN 611 N -2.77 1.55 -0.52 3.89 -0.21 -1.26 -1.45 119.66 118.88 2ce9 s GLN 611 Ca 0.12 -0.54 -0.22 0.00 0.02 0.00 0.00 55.36 54.75 2ce9 s GLN 611 Cb 0.01 -1.37 0.05 0.00 1.00 0.00 0.00 33.01 32.70 2ce9 s GLN 611 CO -0.03 0.22 0.79 -0.06 -2.12 0.00 0.00 175.29 174.10 2ce9 s PHE 612 N 0.03 2.92 -0.15 0.91 0.08 0.71 -4.94 117.98 117.54 2ce9 s PHE 612 Ca -0.03 -0.24 -0.08 0.00 0.12 0.00 0.00 56.93 56.70 2ce9 s PHE 612 Cb -0.10 -3.80 -0.04 0.00 -0.57 0.00 0.00 43.02 38.50 2ce9 s PHE 612 CO 0.01 -1.19 0.13 -0.65 -0.10 0.00 0.00 175.22 173.43 2ce9 s GLN 613 N 3.31 3.70 0.00 0.44 -0.21 -1.26 -1.14 119.66 124.49 2ce9 s GLN 613 Ca 0.23 -0.18 0.00 0.00 0.02 0.00 0.00 55.36 55.43 2ce9 s GLN 613 Cb -0.16 -3.25 0.00 0.00 1.00 0.00 0.00 33.01 30.60 2ce9 s GLN 613 CO 0.16 0.59 0.00 0.41 -2.12 0.00 0.00 175.29 174.33 2ce9 n GLY 614 N 2.58 0.64 3.63 3.09 0.00 -1.26 -4.94 105.19 108.93 2ce9 n GLY 614 Ca -0.18 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 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 1.47 -0.06 1.61 8.25 -1.26 -4.98 115.22 120.25 2ce9 n HIS 615 Ca 0.00 0.57 -0.22 0.00 -0.26 0.00 0.00 57.72 57.81 2ce9 n HIS 615 Cb 0.00 -2.28 -0.12 0.00 1.12 0.00 0.00 29.99 28.71 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 -0.23 1.63 -3.38 1.59 -2.24 -1.26 -4.50 114.28 105.89 2ce9 n THR 616 Ca 0.08 -0.33 -0.15 0.00 -2.27 0.00 0.00 64.05 61.38 2ce9 n THR 616 Cb 0.38 -1.88 0.02 0.00 -2.10 0.00 0.00 70.33 66.75 2ce9 n THR 616 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2ce9 n ASP 617 N -3.98 1.78 -1.24 3.42 4.64 -1.26 -4.57 116.55 115.33 2ce9 n ASP 617 Ca -0.34 -2.15 -0.14 0.00 -1.38 0.00 0.00 54.79 50.78 2ce9 n ASP 617 Cb 0.86 -0.16 -0.01 0.00 -1.04 0.00 0.00 41.12 40.76 2ce9 n ASP 617 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2ce9 n GLY 618 N 0.38 -0.41 3.71 0.27 0.00 -0.56 -3.71 105.19 104.87 2ce9 n GLY 618 Ca 0.05 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.22 3.26 -0.53 4.61 0.00 -0.92 -2.25 121.76 125.71 2ce9 s ALA 619 Ca 0.20 0.67 0.20 0.00 0.00 0.00 0.00 51.96 53.02 2ce9 s ALA 619 Cb -0.28 -3.38 -0.26 0.00 0.00 0.00 0.00 23.12 19.20 2ce9 s ALA 619 CO 0.16 -0.32 0.66 -1.13 0.00 0.00 0.00 175.76 175.13 2ce9 n SER 620 N 3.90 0.70 -3.50 0.00 3.41 0.36 -4.43 113.62 114.06 2ce9 n SER 620 Ca 0.07 -0.54 -0.09 0.00 -0.26 0.00 0.00 58.87 58.05 2ce9 n SER 620 Cb 0.49 1.40 -0.02 0.00 -0.26 0.00 0.00 64.21 65.82 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 -3.32 0.00 0.24 0.00 2.07 -1.26 -2.06 121.20 116.86 2ce9 s ILE 622 Ca 0.04 0.00 -0.18 0.00 -1.41 0.00 0.00 60.65 59.10 2ce9 s ILE 622 Cb -0.01 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.60 2ce9 s ILE 622 CO -0.09 0.00 0.60 -0.62 -1.91 0.00 0.00 174.94 172.92 2ce9 s ASP 623 N -0.83 -0.25 -0.09 4.50 -1.08 -0.10 -4.89 116.67 113.92 2ce9 s ASP 623 Ca -0.05 -0.58 0.01 0.00 -0.52 0.00 0.00 52.55 51.40 2ce9 s ASP 623 Cb -0.01 0.64 -0.02 0.00 -1.46 0.00 0.00 42.92 42.07 2ce9 s ASP 623 CO 0.04 -1.19 -0.11 -0.63 0.52 0.00 0.00 175.17 173.81 2ce9 s ILE 624 N -3.91 3.30 0.14 4.11 1.01 -1.26 -0.82 121.20 123.76 2ce9 s ILE 624 Ca 0.12 -0.61 -0.08 0.00 0.00 0.00 0.00 60.65 60.08 2ce9 s ILE 624 Cb -0.03 -2.35 -0.06 0.00 0.01 0.00 0.00 42.46 40.03 2ce9 s ILE 624 CO 0.03 0.56 0.04 -1.20 0.00 0.00 0.00 174.94 174.36 2ce9 n SER 625 N 2.83 -1.03 0.21 3.58 7.64 0.13 -4.77 113.62 122.22 2ce9 n SER 625 Ca -0.18 0.30 0.05 0.00 1.01 0.00 0.00 58.87 60.05 2ce9 n SER 625 Cb 0.53 -0.32 0.47 0.00 -1.01 0.00 0.00 64.21 63.87 2ce9 n SER 625 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2ce9 h ASN 626 N 0.13 0.00 0.57 6.43 7.08 -1.89 -1.89 115.58 126.01 2ce9 h ASN 626 Ca -0.13 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.09 2ce9 h ASN 626 Cb 0.53 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.77 2ce9 h ASN 626 CO 0.17 0.23 0.00 -0.90 -2.08 0.00 0.00 177.43 174.85 2ce9 n ASP 627 N -4.25 0.00 -0.32 6.14 5.68 -1.26 -4.93 116.55 117.61 2ce9 n ASP 627 Ca -0.02 -0.07 -0.04 0.00 -0.50 0.00 0.00 54.79 54.16 2ce9 n ASP 627 Cb 0.29 -0.30 -0.02 0.00 -1.14 0.00 0.00 41.12 39.95 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 1.16 0.68 0.00 6.12 0.00 -0.71 -4.92 105.19 107.52 2ce9 n GLY 628 Ca 0.13 -0.45 0.06 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.75 0.00 -5.11 2.61 -2.24 -1.26 -4.93 114.28 100.59 2ce9 n THR 629 Ca -0.04 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.15 2ce9 n THR 629 Cb 0.20 0.42 -0.15 0.00 -2.10 0.00 0.00 70.33 68.70 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 -2.67 2.65 -0.03 -0.78 -0.14 -1.26 -1.46 119.74 116.04 2ce9 s LYS 630 Ca -0.02 -0.83 -0.09 0.00 -1.36 0.00 0.00 55.97 53.67 2ce9 s LYS 630 Cb 0.08 -2.27 -0.05 0.00 -1.68 0.00 0.00 37.83 33.91 2ce9 s LYS 630 CO 0.51 0.41 0.28 -1.17 -0.76 0.00 0.00 175.35 174.62 2ce9 s LEU 631 N -0.22 4.41 -0.07 3.17 2.96 -0.13 0.21 118.68 129.01 2ce9 s LEU 631 Ca -0.01 0.67 0.04 0.00 -0.22 0.00 0.00 54.13 54.60 2ce9 s LEU 631 Cb -0.13 -2.46 0.00 0.00 0.50 0.00 0.00 46.19 44.10 2ce9 s LEU 631 CO 0.03 0.32 -0.18 0.26 -1.32 0.00 0.00 176.35 175.46 2ce9 s TRP 632 N -1.15 1.93 0.05 5.38 0.52 -0.00 -0.08 118.94 125.59 2ce9 s TRP 632 Ca 0.22 -0.70 0.01 0.00 0.02 0.00 0.00 56.10 55.66 2ce9 s TRP 632 Cb -0.14 -1.33 -0.03 0.00 -1.15 0.00 0.00 33.47 30.83 2ce9 s TRP 632 CO 0.11 -0.29 -0.05 0.95 0.02 0.00 0.00 176.95 177.69 2ce9 s THR 633 N 0.34 0.39 0.20 2.01 -4.23 -0.35 -0.93 115.64 113.07 2ce9 s THR 633 Ca -0.12 -1.26 0.09 0.00 -1.18 0.00 0.00 61.69 59.22 2ce9 s THR 633 Cb -0.15 -0.80 -0.05 0.00 1.34 0.00 0.00 72.50 72.85 2ce9 s THR 633 CO 0.05 -0.58 -0.18 -0.83 -0.54 0.00 0.00 174.62 172.54 2ce9 s GLY 634 N -1.96 1.54 0.07 3.99 0.00 -0.88 -0.54 107.32 109.55 2ce9 s GLY 634 Ca -0.06 -1.64 -0.01 0.00 0.00 0.00 0.00 44.72 43.01 2ce9 s GLY 634 CO -0.02 -1.71 0.01 -0.32 0.00 0.00 0.00 173.10 171.06 2ce9 s GLY 635 N -3.04 0.59 0.46 0.20 0.00 -0.29 -0.49 107.32 104.76 2ce9 s GLY 635 Ca 0.21 -1.25 0.32 0.00 0.00 0.00 0.00 44.72 44.00 2ce9 s GLY 635 CO 0.09 -1.30 1.96 1.41 0.00 0.00 0.00 173.10 175.26 2ce9 h LEU 636 N 3.05 0.00 -0.42 0.66 3.38 -1.62 -1.87 115.31 118.49 2ce9 h LEU 636 Ca -0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2ce9 h LEU 636 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2ce9 h LEU 636 CO 0.63 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 178.26 2ce9 n ASP 637 N -2.70 0.33 -1.42 -0.43 5.68 -1.26 -4.72 116.55 112.03 2ce9 n ASP 637 Ca -0.01 -1.57 -0.16 0.00 -0.50 0.00 0.00 54.79 52.55 2ce9 n ASP 637 Cb 0.15 -0.17 -0.05 0.00 -1.14 0.00 0.00 41.12 39.92 2ce9 n ASP 637 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 2ce9 n ASN 638 N -0.25 -4.89 -4.30 -1.12 4.13 -0.76 -4.94 115.26 103.13 2ce9 n ASN 638 Ca 0.00 0.27 -0.23 0.00 1.68 0.00 0.00 54.58 56.29 2ce9 n ASN 638 Cb 0.08 -3.87 -0.12 0.00 -1.54 0.00 0.00 39.78 34.33 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 -2.66 1.75 -0.10 3.41 -4.23 -1.25 -0.87 115.64 111.69 2ce9 s THR 639 Ca 0.00 -1.65 -0.00 0.00 -1.18 0.00 0.00 61.69 58.86 2ce9 s THR 639 Cb 0.00 -1.64 -0.03 0.00 1.34 0.00 0.00 72.50 72.17 2ce9 s THR 639 CO 0.00 -0.13 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.18 2ce9 s VAL 640 N -1.40 3.56 0.14 2.29 1.01 0.23 -1.14 120.40 125.08 2ce9 s VAL 640 Ca 0.09 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 61.64 2ce9 s VAL 640 Cb -0.09 -2.48 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2ce9 s VAL 640 CO 0.05 0.56 -0.17 -0.13 0.00 0.00 0.00 175.10 175.40 2ce9 s ARG 641 N -0.28 1.15 0.13 2.72 0.52 0.30 -0.49 118.95 123.00 2ce9 s ARG 641 Ca 0.03 -1.29 0.09 0.00 -0.52 0.00 0.00 55.73 54.05 2ce9 s ARG 641 Cb -0.13 -1.19 -0.04 0.00 0.52 0.00 0.00 34.95 34.11 2ce9 s ARG 641 CO 0.03 0.25 -0.22 -1.54 0.02 0.00 0.00 175.30 173.83 2ce9 s SER 642 N -2.42 2.83 0.02 0.23 1.04 -1.07 -1.21 113.70 113.13 2ce9 s SER 642 Ca 0.11 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 55.82 2ce9 s SER 642 Cb -0.06 -0.17 -0.01 0.00 0.10 0.00 0.00 66.02 65.87 2ce9 s SER 642 CO 0.05 0.08 -0.08 0.26 0.98 0.00 0.00 173.24 174.53 2ce9 s TRP 643 N -1.30 0.71 -0.21 5.02 0.52 0.89 -0.05 118.94 124.52 2ce9 s TRP 643 Ca 0.11 -0.27 -0.26 0.00 0.02 0.00 0.00 56.10 55.69 2ce9 s TRP 643 Cb -0.09 -0.44 -0.01 0.00 -1.15 0.00 0.00 33.47 31.79 2ce9 s TRP 643 CO 0.05 -0.03 0.89 0.34 0.02 0.00 0.00 176.95 178.23 2ce9 s ASP 644 N -0.78 6.96 0.46 2.95 2.15 -0.47 -0.95 116.67 126.99 2ce9 s ASP 644 Ca -0.02 1.19 0.26 0.00 0.43 0.00 0.00 52.55 54.41 2ce9 s ASP 644 Cb -0.06 -2.47 0.93 0.00 -0.30 0.00 0.00 42.92 41.02 2ce9 s ASP 644 CO 0.00 -0.51 1.82 -0.07 -0.17 0.00 0.00 175.17 176.25 2ce9 h LEU 645 N 8.87 0.00 0.00 -1.34 3.38 -1.60 0.13 115.31 124.75 2ce9 h LEU 645 Ca -0.25 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.44 2ce9 h LEU 645 Cb 1.10 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.80 2ce9 h LEU 645 CO 0.88 0.16 -1.99 -2.11 0.09 0.00 0.00 178.44 175.48 2ce9 n ARG 646 N -3.28 0.66 -0.11 1.13 1.85 -1.26 -4.50 116.66 111.15 2ce9 n ARG 646 Ca 0.01 0.11 -0.14 0.00 -1.00 0.00 0.00 57.85 56.82 2ce9 n ARG 646 Cb 0.43 -1.65 -0.14 0.00 -1.05 0.00 0.00 32.46 30.04 2ce9 n ARG 646 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 2ce9 n GLU 647 N -2.82 0.67 0.00 2.89 1.02 -1.24 -5.04 120.64 116.13 2ce9 n GLU 647 Ca -0.22 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2ce9 n GLU 647 Cb 1.02 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.91 2ce9 n GLU 647 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ce9 n GLY 648 N 1.98 0.41 3.84 0.62 0.00 0.03 -5.05 105.19 107.02 2ce9 n GLY 648 Ca -0.38 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.42 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 -0.94 2.90 0.28 1.61 1.70 -1.25 -4.80 118.95 118.45 2ce9 s ARG 649 Ca 0.00 -1.10 -0.29 0.00 -0.47 0.00 0.00 55.73 53.87 2ce9 s ARG 649 Cb 0.00 -2.56 -0.10 0.00 -0.57 0.00 0.00 34.95 31.72 2ce9 s ARG 649 CO 0.00 0.33 1.29 -1.14 -1.08 0.00 0.00 175.30 174.69 2ce9 s GLN 650 N -3.89 4.40 -0.03 3.89 0.74 -1.26 -1.37 119.66 122.14 2ce9 s GLN 650 Ca 0.35 2.12 -0.03 0.00 0.05 0.00 0.00 55.36 57.85 2ce9 s GLN 650 Cb -0.07 -3.12 -0.01 0.00 1.10 0.00 0.00 33.01 30.90 2ce9 s GLN 650 CO 0.26 -0.16 -0.06 1.28 -0.55 0.00 0.00 175.29 176.05 2ce9 n LEU 651 N 1.47 0.35 -4.76 3.68 4.77 0.92 -4.88 117.00 118.55 2ce9 n LEU 651 Ca 0.02 0.06 -0.23 0.00 -0.03 0.00 0.00 56.01 55.83 2ce9 n LEU 651 Cb 0.42 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.97 2ce9 n LEU 651 CO 0.58 -0.47 -0.17 -1.10 -1.33 0.00 0.00 177.39 174.90 2ce9 s GLN 652 N -1.34 2.46 -0.12 3.23 -0.21 -1.21 -4.96 119.66 117.51 2ce9 s GLN 652 Ca -0.05 -1.48 -0.05 0.00 0.02 0.00 0.00 55.36 53.80 2ce9 s GLN 652 Cb 0.01 -2.25 0.06 0.00 1.00 0.00 0.00 33.01 31.83 2ce9 s GLN 652 CO 0.07 0.12 0.26 -1.14 -2.12 0.00 0.00 175.29 172.48 2ce9 s GLN 653 N -3.87 0.18 -0.20 2.91 0.74 -1.26 -2.58 119.66 115.58 2ce9 s GLN 653 Ca 0.38 0.65 -0.01 0.00 0.05 0.00 0.00 55.36 56.43 2ce9 s GLN 653 Cb -0.03 -0.08 0.01 0.00 1.10 0.00 0.00 33.01 34.01 2ce9 s GLN 653 CO 0.23 -0.22 -0.14 -1.01 -0.55 0.00 0.00 175.29 173.60 2ce9 s HIS 654 N 1.84 2.86 -0.12 1.67 3.76 0.35 -4.99 115.29 120.67 2ce9 s HIS 654 Ca -0.04 -1.41 -0.09 0.00 -0.15 0.00 0.00 55.06 53.37 2ce9 s HIS 654 Cb -0.11 -1.99 -0.05 0.00 1.11 0.00 0.00 32.58 31.54 2ce9 s HIS 654 CO -0.09 -0.72 0.19 -0.51 -0.85 0.00 0.00 174.74 172.77 2ce9 s ASP 655 N 1.35 6.42 0.27 1.40 1.01 -1.26 -0.60 116.67 125.26 2ce9 s ASP 655 Ca 0.05 0.50 0.05 0.00 0.71 0.00 0.00 52.55 53.86 2ce9 s ASP 655 Cb -0.14 -2.11 -0.06 0.00 1.01 0.00 0.00 42.92 41.62 2ce9 s ASP 655 CO -0.09 0.32 -0.01 -0.36 0.21 0.00 0.00 175.17 175.24 2ce9 s PHE 656 N -0.61 1.81 -0.26 4.23 0.08 -0.05 -5.02 117.98 118.16 2ce9 s PHE 656 Ca 0.15 -0.85 0.13 0.00 0.12 0.00 0.00 56.93 56.48 2ce9 s PHE 656 Cb -0.13 -1.08 0.79 0.00 -0.57 0.00 0.00 43.02 42.03 2ce9 s PHE 656 CO 0.04 0.09 1.75 0.25 -0.10 0.00 0.00 175.22 177.26 2ce9 n THR 657 N -0.55 2.81 -3.74 0.64 -2.24 -1.26 -4.82 114.28 105.12 2ce9 n THR 657 Ca -0.04 -1.52 -0.12 0.00 -2.27 0.00 0.00 64.05 60.09 2ce9 n THR 657 Cb 0.64 -0.30 -0.08 0.00 -2.10 0.00 0.00 70.33 68.49 2ce9 n THR 657 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2ce9 s SER 658 N -0.94 -0.18 0.45 3.42 0.15 -1.26 -5.04 113.70 110.30 2ce9 s SER 658 Ca 0.54 -0.04 -0.25 0.00 0.70 0.00 0.00 55.95 56.90 2ce9 s SER 658 Cb 0.42 0.35 -0.08 0.00 -1.71 0.00 0.00 66.02 65.01 2ce9 s SER 658 CO 0.15 -0.56 1.36 -1.10 1.20 0.00 0.00 173.24 174.28 2ce9 s GLN 659 N -2.06 3.73 -0.16 5.44 -0.21 -1.26 -4.33 119.66 120.80 2ce9 s GLN 659 Ca -0.08 2.26 -0.11 0.00 0.02 0.00 0.00 55.36 57.45 2ce9 s GLN 659 Cb -0.02 -2.63 -0.05 0.00 1.00 0.00 0.00 33.01 31.31 2ce9 s GLN 659 CO -0.00 -0.73 0.19 0.42 -2.12 0.00 0.00 175.29 173.05 2ce9 s ILE 660 N -1.26 5.38 -0.09 1.08 1.09 -0.84 -1.57 121.20 125.00 2ce9 s ILE 660 Ca 0.61 0.33 0.08 0.00 -1.10 0.00 0.00 60.65 60.57 2ce9 s ILE 660 Cb -0.40 -3.51 -0.12 0.00 -1.06 0.00 0.00 42.46 37.37 2ce9 s ILE 660 CO 0.51 0.47 0.04 0.49 -0.10 0.00 0.00 174.94 176.35 2ce9 n PHE 661 N 3.13 0.00 -3.84 3.97 3.72 -0.48 -4.20 117.46 119.77 2ce9 n PHE 661 Ca -0.16 0.00 -0.10 0.00 -0.05 0.00 0.00 57.45 57.15 2ce9 n PHE 661 Cb 0.53 -0.45 -0.08 0.00 -0.94 0.00 0.00 39.48 38.54 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 -4.11 0.06 0.19 4.37 1.04 -1.06 -4.56 113.70 109.63 2ce9 s SER 662 Ca -0.05 -0.50 -0.17 0.00 0.48 0.00 0.00 55.95 55.71 2ce9 s SER 662 Cb 0.03 0.33 0.03 0.00 0.10 0.00 0.00 66.02 66.50 2ce9 s SER 662 CO 0.38 -0.66 0.51 -1.48 0.98 0.00 0.00 173.24 172.97 2ce9 s LEU 663 N -2.52 0.11 -0.10 2.42 0.05 -1.26 -0.35 118.68 117.04 2ce9 s LEU 663 Ca 0.01 -0.49 -0.24 0.00 0.05 0.00 0.00 54.13 53.46 2ce9 s LEU 663 Cb 0.02 2.10 0.05 0.00 -2.05 0.00 0.00 46.19 46.32 2ce9 s LEU 663 CO -0.08 -1.04 0.56 -0.83 -0.55 0.00 0.00 176.35 174.41 2ce9 s GLY 664 N -2.87 -0.43 -0.18 -3.48 0.00 -0.08 -4.75 107.32 95.53 2ce9 s GLY 664 Ca 0.09 1.18 -0.03 0.00 0.00 0.00 0.00 44.72 45.96 2ce9 s GLY 664 CO -0.03 0.90 -0.05 -0.47 0.00 0.00 0.00 173.10 173.45 2ce9 s TYR 665 N -0.74 2.97 0.17 1.90 5.04 -1.26 -1.42 117.35 124.00 2ce9 s TYR 665 Ca -0.08 -0.57 -0.32 0.00 -2.44 0.00 0.00 57.07 53.66 2ce9 s TYR 665 Cb -0.03 -2.01 -0.11 0.00 0.35 0.00 0.00 41.96 40.17 2ce9 s TYR 665 CO 0.06 -0.26 1.72 0.00 -1.34 0.00 0.00 175.55 175.73 2ce9 n PRO 667 N 4.60 0.13 -0.01 0.00 -0.02 -1.26 -1.17 135.00 137.27 2ce9 n PRO 667 Ca 0.16 0.33 0.09 0.00 -2.02 0.00 0.00 63.50 62.07 2ce9 n PRO 667 Cb 0.37 -1.74 0.09 0.00 -0.02 0.00 0.00 33.50 32.20 2ce9 n PRO 667 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ce9 n THR 668 N -1.99 0.05 0.00 3.45 -2.24 -1.26 -4.85 114.28 107.43 2ce9 n THR 668 Ca 0.03 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2ce9 n THR 668 Cb 0.23 1.35 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 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 1.07 0.59 4.00 3.38 0.00 -0.32 -5.01 105.19 108.91 2ce9 n GLY 669 Ca 0.11 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 0.47 0.00 -4.32 1.61 2.13 -1.26 -4.75 120.64 114.52 2ce9 n GLU 670 Ca 0.00 0.00 -0.18 0.00 0.66 0.00 0.00 57.16 57.64 2ce9 n GLU 670 Cb 0.00 -0.82 -0.14 0.00 0.27 0.00 0.00 31.44 30.75 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 -0.82 0.89 -0.15 4.31 0.52 -1.26 -0.81 118.94 121.62 2ce9 s TRP 671 Ca 0.00 -0.25 -0.00 0.00 0.02 0.00 0.00 56.10 55.87 2ce9 s TRP 671 Cb 0.00 -0.55 0.03 0.00 -1.15 0.00 0.00 33.47 31.80 2ce9 s TRP 671 CO 0.00 -0.01 -0.07 -1.17 0.02 0.00 0.00 176.95 175.72 2ce9 s LEU 672 N -0.64 1.56 -0.05 2.99 2.96 -0.23 -1.50 118.68 123.77 2ce9 s LEU 672 Ca 0.01 -0.56 -0.20 0.00 -0.22 0.00 0.00 54.13 53.17 2ce9 s LEU 672 Cb -0.05 -0.95 -0.05 0.00 0.50 0.00 0.00 46.19 45.64 2ce9 s LEU 672 CO 0.00 -0.15 0.55 0.00 -1.32 0.00 0.00 176.35 175.44 2ce9 s ALA 673 N 1.62 3.48 -0.09 5.97 0.00 -0.51 -0.07 121.76 132.16 2ce9 s ALA 673 Ca 0.02 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.95 2ce9 s ALA 673 Cb -0.14 -2.71 0.01 0.00 0.00 0.00 0.00 23.12 20.28 2ce9 s ALA 673 CO -0.08 0.10 -0.13 0.08 0.00 0.00 0.00 175.76 175.72 2ce9 s VAL 674 N 0.14 1.30 -0.24 0.00 1.01 0.31 -0.90 120.40 122.03 2ce9 s VAL 674 Ca 0.30 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.62 2ce9 s VAL 674 Cb -0.17 -1.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 2ce9 s VAL 674 CO 0.15 0.40 0.19 -0.83 0.00 0.00 0.00 175.10 175.00 2ce9 s GLY 675 N 0.89 2.00 0.08 4.51 0.00 0.52 -1.54 107.32 113.76 2ce9 s GLY 675 Ca -0.10 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 43.80 2ce9 s GLY 675 CO 0.01 0.45 0.14 1.06 0.00 0.00 0.00 173.10 174.76 2ce9 s MET 676 N 1.10 3.11 0.56 2.90 1.00 -0.74 -1.38 119.30 125.86 2ce9 s MET 676 Ca 0.09 -0.60 0.25 0.00 0.00 0.00 0.00 55.69 55.43 2ce9 s MET 676 Cb -0.14 -2.85 1.59 0.00 0.00 0.00 0.00 34.83 33.43 2ce9 s MET 676 CO 0.05 0.58 2.18 1.05 0.00 0.00 0.00 175.02 178.88 2ce9 h GLU 677 N 3.16 0.00 0.00 2.03 4.11 -1.57 -1.00 114.58 121.31 2ce9 h GLU 677 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2ce9 h GLU 677 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2ce9 h GLU 677 CO 0.70 0.00 0.00 0.66 0.07 0.00 0.00 179.01 180.44 2ce9 h SER 678 N 0.00 0.00 0.00 3.06 4.64 -1.89 -3.28 113.55 116.08 2ce9 h SER 678 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2ce9 h SER 678 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 2ce9 h SER 678 CO -0.00 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.42 2ce9 n SER 679 N -2.66 0.00 -4.77 4.97 3.41 -0.74 -4.82 113.62 109.01 2ce9 n SER 679 Ca 0.01 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.24 2ce9 n SER 679 Cb 0.23 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.15 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 -1.79 6.81 -0.20 4.04 -0.87 -1.26 -4.14 114.94 117.52 2ce9 s ASN 680 Ca 0.00 2.16 -0.07 0.00 -1.57 0.00 0.00 52.86 53.38 2ce9 s ASN 680 Cb 0.00 -2.60 -0.03 0.00 -0.02 0.00 0.00 41.25 38.59 2ce9 s ASN 680 CO 0.00 -0.46 0.05 -0.69 -2.57 0.00 0.00 177.10 173.42 2ce9 s VAL 681 N -1.49 4.47 -0.08 1.60 1.01 -0.83 -1.79 120.40 123.30 2ce9 s VAL 681 Ca 0.55 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.42 2ce9 s VAL 681 Cb -0.26 -3.03 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 2ce9 s VAL 681 CO 0.33 0.43 -0.18 -1.61 0.00 0.00 0.00 175.10 174.07 2ce9 s GLU 682 N 0.77 2.82 -0.37 2.72 2.02 -0.59 0.23 118.70 126.29 2ce9 s GLU 682 Ca 0.03 -0.76 -0.02 0.00 0.02 0.00 0.00 54.97 54.23 2ce9 s GLU 682 Cb -0.14 -2.39 0.09 0.00 0.10 0.00 0.00 34.13 31.80 2ce9 s GLU 682 CO 0.02 0.40 0.13 0.08 0.02 0.00 0.00 175.26 175.92 2ce9 s VAL 683 N -0.18 3.09 0.13 2.63 1.01 0.19 -0.53 120.40 126.75 2ce9 s VAL 683 Ca -0.01 -1.91 -0.28 0.00 0.00 0.00 0.00 61.98 59.77 2ce9 s VAL 683 Cb -0.13 -3.05 -0.07 0.00 0.00 0.00 0.00 36.38 33.13 2ce9 s VAL 683 CO 0.03 -0.53 0.88 -0.76 0.00 0.00 0.00 175.10 174.73 2ce9 s LEU 684 N 1.14 4.53 -0.43 3.92 1.43 0.90 -1.18 118.68 129.00 2ce9 s LEU 684 Ca 0.05 1.72 -0.24 0.00 -1.03 0.00 0.00 54.13 54.63 2ce9 s LEU 684 Cb -0.21 -3.46 0.02 0.00 0.03 0.00 0.00 46.19 42.56 2ce9 s LEU 684 CO -0.04 0.04 0.85 -2.28 0.23 0.00 0.00 176.35 175.15 2ce9 s HIS 685 N -0.41 3.00 0.20 0.29 5.65 -0.90 -1.07 115.29 122.05 2ce9 s HIS 685 Ca 0.42 0.39 -0.31 0.00 0.25 0.00 0.00 55.06 55.81 2ce9 s HIS 685 Cb -0.23 -3.71 -0.10 0.00 -1.18 0.00 0.00 32.58 27.36 2ce9 s HIS 685 CO 0.28 -0.96 1.48 0.14 -0.65 0.00 0.00 174.74 175.04 2ce9 s VAL 686 N 3.43 2.73 -0.71 0.89 -7.23 0.01 -2.27 120.40 117.25 2ce9 s VAL 686 Ca 0.34 0.56 0.00 0.00 -1.81 0.00 0.00 61.98 61.07 2ce9 s VAL 686 Cb -0.12 -3.36 0.00 0.00 0.56 0.00 0.00 36.38 33.46 2ce9 s VAL 686 CO 0.22 0.07 0.00 0.59 -0.31 0.00 0.00 175.10 175.67 2ce9 n ASN 687 N 3.19 -4.24 -4.12 4.85 5.03 -1.26 -4.96 115.26 113.75 2ce9 n ASN 687 Ca 0.10 0.17 -0.10 0.00 0.87 0.00 0.00 54.58 55.62 2ce9 n ASN 687 Cb 0.40 -2.33 -0.10 0.00 -1.02 0.00 0.00 39.78 36.73 2ce9 n ASN 687 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2ce9 s LYS 688 N -2.23 0.70 0.00 3.52 -0.14 -0.96 -5.08 119.74 115.55 2ce9 s LYS 688 Ca 0.00 -1.18 0.28 0.00 -1.36 0.00 0.00 55.97 53.71 2ce9 s LYS 688 Cb 0.00 -0.09 1.03 0.00 -1.68 0.00 0.00 37.83 37.08 2ce9 s LYS 688 CO 0.00 -0.03 1.76 -0.35 -0.76 0.00 0.00 175.35 175.97 2ce9 n PRO 689 N 0.32 0.19 -3.81 -1.68 -0.04 -1.26 -4.67 135.00 124.05 2ce9 n PRO 689 Ca -0.15 -0.06 -0.21 0.00 -0.04 0.00 0.00 63.50 63.04 2ce9 n PRO 689 Cb 0.60 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.52 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 -2.85 5.14 0.21 3.54 -4.77 -1.26 -5.03 116.67 111.65 2ce9 s ASP 690 Ca 0.17 -0.60 -0.23 0.00 -3.30 0.00 0.00 52.55 48.60 2ce9 s ASP 690 Cb 0.19 -0.84 0.05 0.00 -1.09 0.00 0.00 42.92 41.22 2ce9 s ASP 690 CO 0.56 -0.41 0.71 -1.59 0.70 0.00 0.00 175.17 175.14 2ce9 s LYS 691 N -4.00 1.50 -0.09 2.11 -2.85 -1.20 -2.12 119.74 113.09 2ce9 s LYS 691 Ca 0.42 -0.74 -0.02 0.00 -1.00 0.00 0.00 55.97 54.63 2ce9 s LYS 691 Cb -0.05 0.57 -0.03 0.00 -2.06 0.00 0.00 37.83 36.26 2ce9 s LYS 691 CO 0.26 -0.68 0.01 0.71 0.10 0.00 0.00 175.35 175.75 2ce9 s TYR 692 N -3.75 3.17 -0.13 1.78 2.02 -0.33 -0.26 117.35 119.86 2ce9 s TYR 692 Ca 0.07 0.18 -0.01 0.00 -0.37 0.00 0.00 57.07 56.94 2ce9 s TYR 692 Cb -0.04 -1.81 -0.02 0.00 -0.40 0.00 0.00 41.96 39.69 2ce9 s TYR 692 CO -0.01 0.44 -0.08 -0.65 -1.57 0.00 0.00 175.55 173.67 2ce9 s GLN 693 N -0.78 3.37 -0.02 -0.62 -0.21 0.03 -0.63 119.66 120.80 2ce9 s GLN 693 Ca 0.12 -0.60 0.07 0.00 0.02 0.00 0.00 55.36 54.98 2ce9 s GLN 693 Cb -0.12 -2.73 -0.02 0.00 1.00 0.00 0.00 33.01 31.14 2ce9 s GLN 693 CO 0.02 0.31 -0.24 -0.51 -2.12 0.00 0.00 175.29 172.76 2ce9 s LEU 694 N 0.13 2.19 -0.51 2.90 1.43 0.14 -2.06 118.68 122.90 2ce9 s LEU 694 Ca -0.04 -0.43 0.07 0.00 -1.03 0.00 0.00 54.13 52.70 2ce9 s LEU 694 Cb -0.14 -1.38 0.24 0.00 0.03 0.00 0.00 46.19 44.94 2ce9 s LEU 694 CO 0.04 0.32 0.61 1.41 0.23 0.00 0.00 176.35 178.95 2ce9 n HIS 695 N 2.36 1.50 -0.54 0.29 8.25 0.14 -1.96 115.22 125.27 2ce9 n HIS 695 Ca -0.16 -3.84 0.02 0.00 -0.26 0.00 0.00 57.72 53.48 2ce9 n HIS 695 Cb 0.51 -0.42 0.03 0.00 1.12 0.00 0.00 29.99 31.24 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 1.28 1.60 -4.65 2.41 4.77 -1.26 -4.84 117.00 116.30 2ce9 n LEU 696 Ca 0.25 -1.83 -0.31 0.00 -0.03 0.00 0.00 56.01 54.09 2ce9 n LEU 696 Cb 0.47 -0.09 -0.09 0.00 -2.33 0.00 0.00 43.42 41.38 2ce9 n LEU 696 CO 0.28 0.44 -0.36 -1.00 -1.33 0.00 0.00 177.39 175.42 2ce9 s HIS 697 N -1.18 2.94 -1.63 -1.77 3.76 -1.26 -5.01 115.29 111.15 2ce9 s HIS 697 Ca 0.07 -0.04 0.16 0.00 -0.15 0.00 0.00 55.06 55.10 2ce9 s HIS 697 Cb 0.06 -1.54 0.03 0.00 1.11 0.00 0.00 32.58 32.24 2ce9 s HIS 697 CO 0.01 0.45 0.90 0.39 -0.85 0.00 0.00 174.74 175.64 2ce9 n GLU 698 N 0.79 1.60 -2.64 1.40 1.02 -1.26 -4.83 120.64 116.72 2ce9 n GLU 698 Ca -0.12 -0.97 -0.06 0.00 -0.02 0.00 0.00 57.16 55.98 2ce9 n GLU 698 Cb 0.52 -1.29 -0.02 0.00 -0.02 0.00 0.00 31.44 30.63 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 0.13 -0.43 -4.56 1.62 2.88 -1.26 -4.96 113.62 107.04 2ce9 n SER 699 Ca 0.07 -1.78 -0.51 0.00 -1.33 0.00 0.00 58.87 55.33 2ce9 n SER 699 Cb 0.36 0.86 -0.05 0.00 -0.75 0.00 0.00 64.21 64.63 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 4.32 0.05 0.00 1.01 -0.46 -1.04 120.40 124.23 2ce9 s VAL 701 Ca 0.77 -0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.57 2ce9 s VAL 701 Cb -0.93 -4.64 -0.31 0.00 0.00 0.00 0.00 36.38 30.50 2ce9 s VAL 701 CO 0.52 -1.35 1.04 -0.07 0.00 0.00 0.00 175.10 175.24 2ce9 h LEU 702 N 11.28 0.57 -8.55 3.92 3.38 -0.37 -3.38 115.31 122.16 2ce9 h LEU 702 Ca -0.28 -0.64 -0.25 0.00 0.09 0.00 0.00 57.88 56.80 2ce9 h LEU 702 Cb 1.07 -0.19 -0.12 0.00 0.09 0.00 0.00 40.66 41.52 2ce9 h LEU 702 CO 1.15 1.51 -0.38 -0.94 0.09 0.00 0.00 178.44 179.87 2ce9 s SER 703 N -7.29 0.56 -0.20 -0.43 1.04 -1.21 -4.50 113.70 101.68 2ce9 s SER 703 Ca -0.07 -1.38 -0.28 0.00 0.48 0.00 0.00 55.95 54.71 2ce9 s SER 703 Cb 0.06 0.53 0.11 0.00 0.10 0.00 0.00 66.02 66.81 2ce9 s SER 703 CO 0.90 -1.06 0.91 -0.22 0.98 0.00 0.00 173.24 174.75 2ce9 s LEU 704 N -3.19 -0.51 -0.26 2.42 0.20 -1.26 -0.94 118.68 115.14 2ce9 s LEU 704 Ca 0.33 0.77 -0.15 0.00 0.69 0.00 0.00 54.13 55.78 2ce9 s LEU 704 Cb 0.03 2.09 0.08 0.00 -0.43 0.00 0.00 46.19 47.95 2ce9 s LEU 704 CO 0.16 -0.32 0.64 -0.75 -0.29 0.00 0.00 176.35 175.80 2ce9 s LYS 705 N -0.46 0.65 0.40 1.98 2.47 -0.51 -4.76 119.74 119.51 2ce9 s LYS 705 Ca -0.02 1.17 -0.23 0.00 -1.56 0.00 0.00 55.97 55.33 2ce9 s LYS 705 Cb -0.03 0.15 -0.09 0.00 -1.46 0.00 0.00 37.83 36.40 2ce9 s LYS 705 CO 0.01 -0.15 1.01 -0.06 0.16 0.00 0.00 175.35 176.32 2ce9 s PHE 706 N 1.67 3.30 0.76 4.03 0.08 -1.26 -1.54 117.98 125.02 2ce9 s PHE 706 Ca -0.10 1.65 -0.15 0.00 0.12 0.00 0.00 56.93 58.45 2ce9 s PHE 706 Cb -0.06 -3.04 0.04 0.00 -0.57 0.00 0.00 43.02 39.39 2ce9 s PHE 706 CO -0.19 -0.44 1.11 0.00 -0.10 0.00 0.00 175.22 175.60 2ce9 n ALA 707 N -0.19 0.01 0.11 5.36 0.00 -0.16 -4.85 120.51 120.79 2ce9 n ALA 707 Ca 0.05 -0.24 0.05 0.00 0.00 0.00 0.00 53.44 53.31 2ce9 n ALA 707 Cb 0.51 -2.20 0.49 0.00 0.00 0.00 0.00 19.45 18.24 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 -0.47 0.30 0.00 0.00 0.05 -1.86 -1.03 116.97 113.96 2ce9 h TYR 708 Ca -0.47 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.31 2ce9 h TYR 708 Cb 1.32 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.96 2ce9 h TYR 708 CO 0.43 0.23 0.00 0.00 -1.05 0.00 0.00 178.16 177.77 2ce9 n GLY 710 N 0.51 0.98 0.12 0.00 0.00 -0.39 -4.75 105.19 101.66 2ce9 n GLY 710 Ca 0.04 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.19 2ce9 n GLY 710 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ce9 h LYS 711 N 2.50 0.00 -3.48 1.61 1.57 -1.90 -3.44 116.57 113.43 2ce9 h LYS 711 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 2ce9 h LYS 711 Cb 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.20 2ce9 h LYS 711 CO 0.00 0.00 -0.08 1.67 -0.57 0.00 0.00 179.45 180.47 2ce9 s TRP 712 N -3.12 0.02 0.23 -1.35 1.48 -1.26 -1.76 118.94 113.18 2ce9 s TRP 712 Ca 0.10 -0.37 -0.11 0.00 -1.06 0.00 0.00 56.10 54.66 2ce9 s TRP 712 Cb 0.11 0.25 -0.01 0.00 -1.16 0.00 0.00 33.47 32.67 2ce9 s TRP 712 CO 0.62 -0.84 0.40 -0.59 -4.06 0.00 0.00 176.95 172.48 2ce9 s PHE 713 N -3.89 0.48 0.16 1.66 -0.12 -0.25 -0.99 117.98 115.02 2ce9 s PHE 713 Ca 0.11 -0.82 0.10 0.00 -0.05 0.00 0.00 56.93 56.27 2ce9 s PHE 713 Cb 0.00 0.05 -0.04 0.00 -0.63 0.00 0.00 43.02 42.40 2ce9 s PHE 713 CO -0.03 -0.91 -0.23 0.14 -0.05 0.00 0.00 175.22 174.15 2ce9 s VAL 714 N -4.03 2.13 0.13 -2.49 -7.23 -0.59 -0.08 120.40 108.24 2ce9 s VAL 714 Ca 0.24 -1.90 0.06 0.00 -1.81 0.00 0.00 61.98 58.58 2ce9 s VAL 714 Cb 0.01 -1.96 -0.04 0.00 0.56 0.00 0.00 36.38 34.95 2ce9 s VAL 714 CO 0.08 -0.12 -0.15 -0.94 -0.31 0.00 0.00 175.10 173.66 2ce9 s SER 715 N -2.47 2.12 0.01 4.85 1.04 -0.70 -1.43 113.70 117.13 2ce9 s SER 715 Ca 0.17 -0.83 0.05 0.00 0.48 0.00 0.00 55.95 55.82 2ce9 s SER 715 Cb -0.08 -0.08 -0.02 0.00 0.10 0.00 0.00 66.02 65.94 2ce9 s SER 715 CO 0.08 -0.13 -0.15 0.42 0.98 0.00 0.00 173.24 174.44 2ce9 s THR 716 N -2.17 1.15 0.25 2.02 -4.23 -0.12 -1.34 115.64 111.21 2ce9 s THR 716 Ca 0.10 -0.80 0.11 0.00 -1.18 0.00 0.00 61.69 59.92 2ce9 s THR 716 Cb -0.05 -1.00 -0.05 0.00 1.34 0.00 0.00 72.50 72.75 2ce9 s THR 716 CO 0.04 0.18 -0.13 -0.83 -0.54 0.00 0.00 174.62 173.34 2ce9 s GLY 717 N -0.71 1.77 0.62 3.99 0.00 0.15 0.34 107.32 113.47 2ce9 s GLY 717 Ca 0.04 -1.71 0.40 0.00 0.00 0.00 0.00 44.72 43.45 2ce9 s GLY 717 CO 0.00 -1.77 2.22 1.70 0.00 0.00 0.00 173.10 175.25 2ce9 h LYS 718 N 2.38 0.00 -0.08 2.90 3.64 -1.30 0.24 116.57 124.35 2ce9 h LYS 718 Ca -0.43 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2ce9 h LYS 718 Cb 1.24 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.06 2ce9 h LYS 718 CO 0.58 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.36 2ce9 n ASP 719 N -3.05 0.44 0.00 4.20 5.75 -1.26 -4.29 116.55 118.34 2ce9 n ASP 719 Ca -0.02 -2.00 0.00 0.00 -0.01 0.00 0.00 54.79 52.77 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 -0.26 -2.45 -4.73 -1.12 4.13 -1.04 -4.94 115.26 104.84 2ce9 n ASN 720 Ca 0.03 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 55.94 2ce9 n ASN 720 Cb 0.07 -0.41 -0.08 0.00 -1.54 0.00 0.00 39.78 37.82 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 3.77 -0.26 3.41 1.43 -1.25 -0.80 118.68 124.99 2ce9 s LEU 721 Ca 0.00 0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 53.24 2ce9 s LEU 721 Cb 0.00 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2ce9 s LEU 721 CO 0.00 0.36 0.03 -0.22 0.23 0.00 0.00 176.35 176.76 2ce9 s LEU 722 N -1.08 3.41 -0.06 1.79 2.96 -0.34 -0.67 118.68 124.68 2ce9 s LEU 722 Ca 0.15 -0.47 0.03 0.00 -0.22 0.00 0.00 54.13 53.63 2ce9 s LEU 722 Cb -0.12 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.71 2ce9 s LEU 722 CO 0.05 -0.09 -0.13 0.20 -1.32 0.00 0.00 176.35 175.06 2ce9 s ASN 723 N 1.52 4.10 -0.10 3.68 0.01 -0.45 -0.74 114.94 122.96 2ce9 s ASN 723 Ca 0.05 -0.19 -0.03 0.00 -0.71 0.00 0.00 52.86 51.98 2ce9 s ASN 723 Cb -0.16 -0.99 -0.03 0.00 0.41 0.00 0.00 41.25 40.48 2ce9 s ASN 723 CO 0.01 0.32 0.02 0.00 -1.51 0.00 0.00 177.10 175.94 2ce9 s ALA 724 N -0.59 3.35 -0.01 0.60 0.00 -0.18 -1.72 121.76 123.21 2ce9 s ALA 724 Ca 0.09 -0.78 0.03 0.00 0.00 0.00 0.00 51.96 51.29 2ce9 s ALA 724 Cb -0.11 -1.56 -0.01 0.00 0.00 0.00 0.00 23.12 21.44 2ce9 s ALA 724 CO 0.01 0.56 -0.10 -1.58 0.00 0.00 0.00 175.76 174.65 2ce9 s TRP 725 N -0.79 0.89 0.14 0.00 0.52 0.89 -1.46 118.94 119.12 2ce9 s TRP 725 Ca 0.12 -0.18 -0.30 0.00 0.02 0.00 0.00 56.10 55.77 2ce9 s TRP 725 Cb -0.12 -0.58 -0.07 0.00 -1.15 0.00 0.00 33.47 31.56 2ce9 s TRP 725 CO 0.02 -0.03 1.01 0.50 0.02 0.00 0.00 176.95 178.47 2ce9 s ARG 726 N -0.16 4.67 0.10 4.98 6.06 -0.04 -1.09 118.95 133.48 2ce9 s ARG 726 Ca 0.03 1.54 -0.25 0.00 -2.50 0.00 0.00 55.73 54.55 2ce9 s ARG 726 Cb -0.05 -3.34 -0.07 0.00 0.06 0.00 0.00 34.95 31.56 2ce9 s ARG 726 CO -0.00 0.18 0.77 0.99 -2.50 0.00 0.00 175.30 174.74 2ce9 s THR 727 N -0.13 4.55 -0.55 4.11 2.01 -0.72 0.42 115.64 125.33 2ce9 s THR 727 Ca 0.47 1.67 0.23 0.00 0.31 0.00 0.00 61.69 64.37 2ce9 s THR 727 Cb -0.25 -4.13 -0.13 0.00 0.01 0.00 0.00 72.50 68.00 2ce9 s THR 727 CO 0.31 0.44 0.97 -0.81 -0.69 0.00 0.00 174.62 174.85 2ce9 n PRO 728 N 2.21 0.33 0.00 4.92 -0.04 -1.26 -4.84 135.00 136.31 2ce9 n PRO 728 Ca -0.04 -0.01 0.13 0.00 -0.04 0.00 0.00 63.50 63.54 2ce9 n PRO 728 Cb 0.49 -1.60 0.42 0.00 -0.04 0.00 0.00 33.50 32.78 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 -2.01 0.00 -2.20 0.54 4.11 -1.18 -4.85 117.16 111.56 2ce9 n TYR 729 Ca 0.01 0.00 -0.03 0.00 -0.00 0.00 0.00 57.90 57.89 2ce9 n TYR 729 Cb 0.45 -0.17 0.00 0.00 -0.00 0.00 0.00 39.34 39.62 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 1.36 0.40 3.66 -7.48 0.00 0.17 -4.75 105.19 98.55 2ce9 n GLY 730 Ca 0.11 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.97 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 -1.56 0.82 -2.60 4.61 0.00 -1.26 -4.61 120.51 115.90 2ce9 n ALA 731 Ca -0.02 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.37 2ce9 n ALA 731 Cb 0.52 -2.19 -0.04 0.00 0.00 0.00 0.00 19.45 17.74 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 -0.32 6.41 0.01 0.00 0.15 -1.26 -0.86 113.70 117.83 2ce9 s SER 732 Ca 0.58 -0.12 -0.09 0.00 0.70 0.00 0.00 55.95 57.02 2ce9 s SER 732 Cb -0.62 -2.44 -0.31 0.00 -1.71 0.00 0.00 66.02 60.94 2ce9 s SER 732 CO 0.60 -1.14 0.90 0.40 1.20 0.00 0.00 173.24 175.21 2ce9 h ILE 733 N 6.05 1.20 -2.92 6.45 2.04 -1.60 -3.48 117.51 125.25 2ce9 h ILE 733 Ca -0.25 -2.75 0.06 0.00 1.00 0.00 0.00 64.86 62.92 2ce9 h ILE 733 Cb 1.07 2.88 -0.07 0.00 -0.74 0.00 0.00 36.82 39.96 2ce9 h ILE 733 CO 1.06 0.84 0.26 0.72 0.00 0.00 0.00 178.15 181.02 2ce9 s PHE 734 N -2.61 -0.26 -0.01 1.37 -0.12 -1.25 -4.89 117.98 110.22 2ce9 s PHE 734 Ca -0.10 -0.12 -0.01 0.00 -0.05 0.00 0.00 56.93 56.65 2ce9 s PHE 734 Cb 0.06 0.67 0.00 0.00 -0.63 0.00 0.00 43.02 43.12 2ce9 s PHE 734 CO 0.89 -1.10 0.02 -0.65 -0.05 0.00 0.00 175.22 174.33 2ce9 s GLN 735 N -3.80 0.06 -0.09 1.99 -0.21 -1.26 -1.01 119.66 115.34 2ce9 s GLN 735 Ca 0.09 -0.02 0.01 0.00 0.02 0.00 0.00 55.36 55.46 2ce9 s GLN 735 Cb -0.04 0.02 0.02 0.00 1.00 0.00 0.00 33.01 34.01 2ce9 s GLN 735 CO 0.02 -0.01 -0.10 0.45 -2.12 0.00 0.00 175.29 173.53 2ce9 s SER 736 N -0.12 1.92 -0.33 5.90 0.15 0.08 -5.01 113.70 116.29 2ce9 s SER 736 Ca -0.01 -0.29 -0.14 0.00 0.70 0.00 0.00 55.95 56.20 2ce9 s SER 736 Cb -0.01 -0.82 -0.02 0.00 -1.71 0.00 0.00 66.02 63.46 2ce9 s SER 736 CO -0.00 -0.04 0.30 -0.75 1.20 0.00 0.00 173.24 173.95 2ce9 s LYS 737 N 1.14 3.62 0.66 5.44 2.20 -1.26 -1.20 119.74 130.34 2ce9 s LYS 737 Ca -0.06 -0.44 0.02 0.00 -0.36 0.00 0.00 55.97 55.13 2ce9 s LYS 737 Cb -0.14 -3.78 0.10 0.00 -1.51 0.00 0.00 37.83 32.50 2ce9 s LYS 737 CO -0.02 -0.44 0.91 -1.21 -0.36 0.00 0.00 175.35 174.24 2ce9 s GLU 738 N 1.90 1.95 0.44 4.03 2.02 0.02 -5.00 118.70 124.06 2ce9 s GLU 738 Ca 0.10 -1.18 0.30 0.00 0.02 0.00 0.00 54.97 54.20 2ce9 s GLU 738 Cb -0.17 -2.43 1.22 0.00 0.10 0.00 0.00 34.13 32.85 2ce9 s GLU 738 CO 0.11 -1.20 1.88 0.66 0.02 0.00 0.00 175.26 176.73 2ce9 h SER 739 N -0.27 0.00 -5.26 -0.19 4.64 -1.98 -3.46 113.55 107.02 2ce9 h SER 739 Ca -0.36 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.81 2ce9 h SER 739 Cb 1.28 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.33 2ce9 h SER 739 CO 0.42 0.00 0.05 -0.55 -0.87 0.00 0.00 176.83 175.88 2ce9 s SER 740 N -5.13 0.48 0.17 4.97 0.15 -1.26 -4.96 113.70 108.12 2ce9 s SER 740 Ca 0.02 -1.33 -0.31 0.00 0.70 0.00 0.00 55.95 55.04 2ce9 s SER 740 Cb 0.09 0.77 -0.17 0.00 -1.71 0.00 0.00 66.02 65.00 2ce9 s SER 740 CO 0.49 -1.51 0.79 -0.24 1.20 0.00 0.00 173.24 173.96 2ce9 n SER 741 N -1.45 -0.26 -4.12 5.45 2.88 -1.26 -4.02 113.62 110.84 2ce9 n SER 741 Ca -0.04 1.14 -0.35 0.00 -1.33 0.00 0.00 58.87 58.29 2ce9 n SER 741 Cb 0.61 -1.03 -0.12 0.00 -0.75 0.00 0.00 64.21 62.91 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 -0.70 3.12 -0.23 2.46 1.01 0.82 -0.48 120.40 126.40 2ce9 s VAL 742 Ca 0.69 -1.92 0.21 0.00 0.00 0.00 0.00 61.98 60.97 2ce9 s VAL 742 Cb -0.95 -3.07 0.01 0.00 0.00 0.00 0.00 36.38 32.37 2ce9 s VAL 742 CO 0.56 -0.54 1.08 -0.07 0.00 0.00 0.00 175.10 176.13 2ce9 h LEU 743 N 7.99 0.00 -7.36 3.92 4.07 -1.54 -3.30 115.31 119.09 2ce9 h LEU 743 Ca -0.14 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.81 2ce9 h LEU 743 Cb 1.05 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 42.68 2ce9 h LEU 743 CO 0.64 0.15 0.15 -0.94 -1.08 0.00 0.00 178.44 177.36 2ce9 s SER 744 N -5.60 -0.42 0.17 -0.43 1.04 -1.23 -4.34 113.70 102.89 2ce9 s SER 744 Ca -0.00 -0.24 -0.22 0.00 0.48 0.00 0.00 55.95 55.96 2ce9 s SER 744 Cb 0.09 0.61 0.06 0.00 0.10 0.00 0.00 66.02 66.88 2ce9 s SER 744 CO 0.78 -1.05 0.60 0.00 0.98 0.00 0.00 173.24 174.55 2ce9 s ASP 746 N -2.77 0.04 -0.07 0.00 2.15 -0.19 -4.76 116.67 111.06 2ce9 s ASP 746 Ca 0.02 -0.31 0.03 0.00 0.43 0.00 0.00 52.55 52.73 2ce9 s ASP 746 Cb -0.01 0.25 -0.02 0.00 -0.30 0.00 0.00 42.92 42.84 2ce9 s ASP 746 CO -0.11 -0.48 -0.17 -0.63 -0.17 0.00 0.00 175.17 173.62 2ce9 s ILE 747 N -2.10 2.80 0.74 4.11 1.01 -1.26 -0.85 121.20 125.65 2ce9 s ILE 747 Ca -0.09 -0.79 -0.13 0.00 0.00 0.00 0.00 60.65 59.64 2ce9 s ILE 747 Cb -0.03 -2.10 0.04 0.00 0.01 0.00 0.00 42.46 40.38 2ce9 s ILE 747 CO -0.02 0.57 1.12 -0.94 0.00 0.00 0.00 174.94 175.67 2ce9 s SER 748 N -0.27 4.50 0.51 3.58 1.04 -0.10 -4.91 113.70 118.06 2ce9 s SER 748 Ca 0.01 1.98 0.23 0.00 0.48 0.00 0.00 55.95 58.66 2ce9 s SER 748 Cb -0.13 -2.54 1.38 0.00 0.10 0.00 0.00 66.02 64.82 2ce9 s SER 748 CO 0.03 -2.04 2.08 0.58 0.98 0.00 0.00 173.24 174.87 2ce9 h VAL 749 N -0.71 0.75 -0.01 5.02 2.07 -1.91 0.34 116.25 121.79 2ce9 h VAL 749 Ca -0.45 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 66.62 2ce9 h VAL 749 Cb 1.25 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 32.28 2ce9 h VAL 749 CO 0.51 0.11 -0.01 -0.90 0.02 0.00 0.00 177.57 177.30 2ce9 n ASP 750 N -3.92 1.03 -0.61 0.57 5.68 -1.26 -4.78 116.55 113.26 2ce9 n ASP 750 Ca -0.02 -1.32 -0.08 0.00 -0.50 0.00 0.00 54.79 52.86 2ce9 n ASP 750 Cb 0.21 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.15 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 -0.21 -5.42 0.11 -1.12 8.00 0.11 -4.88 116.55 113.14 2ce9 n ASP 751 Ca 0.20 0.20 0.12 0.00 0.71 0.00 0.00 54.79 56.02 2ce9 n ASP 751 Cb 0.28 -3.61 0.07 0.00 -0.02 0.00 0.00 41.12 37.84 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 0.08 0.00 -4.20 -1.24 1.57 -1.90 -3.45 116.57 107.42 2ce9 h LYS 752 Ca -0.16 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.35 2ce9 h LYS 752 Cb 1.00 0.00 -0.26 0.00 0.08 0.00 0.00 32.23 33.06 2ce9 h LYS 752 CO 0.24 0.00 -0.74 0.71 -0.57 0.00 0.00 179.45 179.09 2ce9 s TYR 753 N -3.29 0.39 -0.09 -1.35 2.02 -1.26 -0.01 117.35 113.77 2ce9 s TYR 753 Ca 0.02 -0.22 0.04 0.00 -0.37 0.00 0.00 57.07 56.54 2ce9 s TYR 753 Cb 0.10 -0.25 -0.01 0.00 -0.40 0.00 0.00 41.96 41.41 2ce9 s TYR 753 CO 0.75 -0.05 -0.23 0.42 -1.57 0.00 0.00 175.55 174.88 2ce9 s ILE 754 N -0.57 2.19 -0.09 2.71 1.01 -0.80 -0.93 121.20 124.72 2ce9 s ILE 754 Ca -0.04 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.64 2ce9 s ILE 754 Cb -0.04 -1.83 -0.02 0.00 0.01 0.00 0.00 42.46 40.58 2ce9 s ILE 754 CO -0.00 0.56 -0.15 -0.69 0.00 0.00 0.00 174.94 174.66 2ce9 s VAL 755 N 0.12 2.96 0.13 2.92 1.01 -0.03 -0.03 120.40 127.47 2ce9 s VAL 755 Ca -0.12 -0.72 0.11 0.00 0.00 0.00 0.00 61.98 61.25 2ce9 s VAL 755 Cb -0.16 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2ce9 s VAL 755 CO 0.06 0.55 -0.25 0.42 0.00 0.00 0.00 175.10 175.89 2ce9 s THR 756 N -0.09 2.40 -0.10 3.92 -4.23 -0.49 -1.02 115.64 116.03 2ce9 s THR 756 Ca -0.02 -1.71 -0.06 0.00 -1.18 0.00 0.00 61.69 58.72 2ce9 s THR 756 Cb -0.14 -2.07 -0.04 0.00 1.34 0.00 0.00 72.50 71.59 2ce9 s THR 756 CO 0.04 0.09 0.14 -0.83 -0.54 0.00 0.00 174.62 173.52 2ce9 s GLY 757 N -2.09 2.15 0.06 3.99 0.00 0.36 -1.42 107.32 110.37 2ce9 s GLY 757 Ca 0.15 -0.66 0.07 0.00 0.00 0.00 0.00 44.72 44.28 2ce9 s GLY 757 CO 0.07 -0.42 -0.17 -0.45 0.00 0.00 0.00 173.10 172.13 2ce9 s SER 758 N -1.14 3.92 0.06 1.64 0.15 0.19 -1.53 113.70 116.98 2ce9 s SER 758 Ca 0.17 -0.44 0.12 0.00 0.70 0.00 0.00 55.95 56.50 2ce9 s SER 758 Cb -0.12 -0.64 0.54 0.00 -1.71 0.00 0.00 66.02 64.09 2ce9 s SER 758 CO 0.06 0.23 1.38 0.61 1.20 0.00 0.00 173.24 176.73 2ce9 n GLY 759 N 1.31 -0.89 1.66 9.45 0.00 0.37 -1.69 105.19 115.40 2ce9 n GLY 759 Ca -0.16 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.81 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 -1.66 3.95 -2.29 1.61 8.00 -1.26 -4.85 116.55 120.05 2ce9 n ASP 760 Ca 0.02 -2.88 -0.15 0.00 0.71 0.00 0.00 54.79 52.50 2ce9 n ASP 760 Cb 0.12 -0.68 0.04 0.00 -0.02 0.00 0.00 41.12 40.58 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 -0.08 -4.38 -3.85 -1.24 5.02 -0.68 -4.93 118.16 108.01 2ce9 n LYS 761 Ca 0.30 0.53 -0.09 0.00 -2.02 0.00 0.00 58.31 57.03 2ce9 n LYS 761 Cb 1.11 -4.65 -0.05 0.00 -0.02 0.00 0.00 35.03 31.42 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 -5.64 1.30 0.24 1.97 -2.85 -1.25 -0.63 119.74 112.87 2ce9 s LYS 762 Ca 0.31 -1.02 0.11 0.00 -1.00 0.00 0.00 55.97 54.37 2ce9 s LYS 762 Cb -0.14 0.46 -0.05 0.00 -2.06 0.00 0.00 37.83 36.04 2ce9 s LYS 762 CO 0.39 -0.52 -0.20 0.00 0.10 0.00 0.00 175.35 175.11 2ce9 s ALA 763 N -3.92 2.53 -0.04 0.59 0.00 0.07 0.53 121.76 121.52 2ce9 s ALA 763 Ca 0.13 -1.75 0.05 0.00 0.00 0.00 0.00 51.96 50.39 2ce9 s ALA 763 Cb 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 2ce9 s ALA 763 CO -0.01 0.29 -0.20 0.99 0.00 0.00 0.00 175.76 176.83 2ce9 s THR 764 N -2.31 1.67 -0.18 0.00 2.01 -0.50 0.99 115.64 117.31 2ce9 s THR 764 Ca 0.25 -0.86 -0.07 0.00 0.31 0.00 0.00 61.69 61.33 2ce9 s THR 764 Cb -0.05 -1.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.00 2ce9 s THR 764 CO 0.12 0.47 0.05 -0.69 -0.69 0.00 0.00 174.62 173.88 2ce9 s VAL 765 N -0.11 4.68 -0.07 3.82 1.01 0.03 -1.39 120.40 128.37 2ce9 s VAL 765 Ca -0.02 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 61.93 2ce9 s VAL 765 Cb -0.12 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 2ce9 s VAL 765 CO 0.02 0.46 -0.19 -0.31 0.00 0.00 0.00 175.10 175.08 2ce9 s TYR 766 N 0.40 2.60 -0.12 5.22 2.02 0.96 -0.15 117.35 128.27 2ce9 s TYR 766 Ca 0.02 -0.51 -0.23 0.00 -0.37 0.00 0.00 57.07 55.99 2ce9 s TYR 766 Cb -0.13 -1.66 -0.03 0.00 -0.40 0.00 0.00 41.96 39.75 2ce9 s TYR 766 CO 0.01 -0.08 0.69 -2.00 -1.57 0.00 0.00 175.55 172.60 2ce9 s GLU 767 N -0.26 4.35 -0.38 -0.62 2.12 0.12 -1.91 118.70 122.12 2ce9 s GLU 767 Ca 0.00 0.81 -0.27 0.00 0.36 0.00 0.00 54.97 55.87 2ce9 s GLU 767 Cb -0.13 -3.50 0.02 0.00 0.26 0.00 0.00 34.13 30.77 2ce9 s GLU 767 CO 0.03 -0.08 0.99 0.08 -0.54 0.00 0.00 175.26 175.74 2ce9 s VAL 768 N 1.33 4.50 -0.26 3.70 1.01 0.99 -0.70 120.40 130.97 2ce9 s VAL 768 Ca 0.35 1.28 -0.15 0.00 0.00 0.00 0.00 61.98 63.45 2ce9 s VAL 768 Cb -0.17 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.77 2ce9 s VAL 768 CO 0.15 -0.62 0.37 -0.63 0.00 0.00 0.00 175.10 174.36 2ce9 s ILE 769 N 3.68 5.18 -2.59 2.22 -1.09 0.41 -4.89 121.20 124.13 2ce9 s ILE 769 Ca 0.41 0.56 0.21 0.00 -2.23 0.00 0.00 60.65 59.60 2ce9 s ILE 769 Cb -0.11 -3.69 0.16 0.00 -1.58 0.00 0.00 42.46 37.24 2ce9 s ILE 769 CO 0.21 0.17 1.16 -1.22 -1.23 0.00 0.00 174.94 174.02