#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bkn s GLU 421 N 0.00 3.72 0.49 7.34 2.56 -1.26 -4.74 118.70 126.82 1bkn s GLU 421 Ca 0.00 -1.68 0.06 0.00 0.00 0.00 0.00 54.97 53.35 1bkn s GLU 421 Cb 0.00 -5.19 0.01 0.00 2.00 0.00 0.00 34.13 30.95 1bkn s GLU 421 CO 0.00 -2.00 0.31 1.03 -0.56 0.00 0.00 175.26 174.05 1bkn s ARG 422 N 3.57 2.28 0.20 4.30 0.52 -1.26 -4.99 118.95 123.57 1bkn s ARG 422 Ca 0.42 -1.95 -0.09 0.00 -0.52 0.00 0.00 55.73 53.58 1bkn s ARG 422 Cb -0.02 -2.06 0.12 0.00 0.52 0.00 0.00 34.95 33.52 1bkn s ARG 422 CO -0.06 -0.43 1.75 -1.00 0.02 0.00 0.00 175.30 175.59 1bkn h PRO 423 N 0.99 1.09 -0.53 3.54 0.13 -1.94 -2.31 132.00 132.97 1bkn h PRO 423 Ca -0.39 -0.21 0.11 0.00 -0.87 0.00 0.00 66.00 64.64 1bkn h PRO 423 Cb 1.29 -0.17 -0.10 0.00 0.13 0.00 0.00 31.00 32.15 1bkn h PRO 423 CO 0.62 0.90 -0.11 0.00 -0.23 0.00 0.00 178.00 179.18 1bkn h ALA 424 N 1.13 0.38 -0.62 -0.56 0.00 -1.89 0.13 119.26 117.83 1bkn h ALA 424 Ca 0.24 0.20 0.12 0.00 0.00 0.00 0.00 54.91 55.47 1bkn h ALA 424 Cb 0.23 0.38 -0.09 0.00 0.00 0.00 0.00 17.79 18.31 1bkn h ALA 424 CO -0.02 -0.43 0.10 0.66 0.00 0.00 0.00 179.25 179.57 1bkn h SER 425 N 0.02 -0.06 -0.87 0.00 4.64 -1.72 0.14 113.55 115.70 1bkn h SER 425 Ca 0.26 0.13 -0.03 0.00 -0.47 0.00 0.00 61.79 61.68 1bkn h SER 425 Cb 0.39 0.19 -0.04 0.00 -0.31 0.00 0.00 62.40 62.63 1bkn h SER 425 CO -0.53 -0.03 0.45 0.58 -0.87 0.00 0.00 176.83 176.43 1bkn h VAL 426 N 0.23 1.26 -0.05 0.95 2.07 -0.55 0.07 116.25 120.23 1bkn h VAL 426 Ca 0.33 -0.69 0.02 0.00 0.82 0.00 0.00 66.70 67.17 1bkn h VAL 426 Cb 0.51 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.38 1bkn h VAL 426 CO -0.45 0.30 -0.05 0.58 0.02 0.00 0.00 177.57 177.98 1bkn h VAL 427 N 1.23 0.86 -0.37 2.57 2.07 0.13 -0.51 116.25 122.22 1bkn h VAL 427 Ca 0.30 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.90 1bkn h VAL 427 Cb 0.08 0.86 -0.07 0.00 -1.52 0.00 0.00 31.29 30.64 1bkn h VAL 427 CO -0.04 0.00 -0.10 0.50 0.02 0.00 0.00 177.57 177.95 1bkn h LYS 428 N -0.06 -0.01 0.00 1.57 3.64 -0.08 0.32 116.57 121.95 1bkn h LYS 428 Ca 0.04 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1bkn h LYS 428 Cb 0.12 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1bkn h LYS 428 CO -0.09 -0.00 0.00 0.39 -2.27 0.00 0.00 179.45 177.48 1bkn n GLU 429 N -5.30 0.00 -0.32 1.90 -0.58 -0.06 0.52 120.64 116.81 1bkn n GLU 429 Ca 0.02 0.62 0.15 0.00 -0.42 0.00 0.00 57.16 57.53 1bkn n GLU 429 Cb 0.21 -1.50 0.34 0.00 -0.57 0.00 0.00 31.44 29.92 1bkn n GLU 429 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1bkn h LEU 430 N 0.00 0.39 -0.59 -4.62 3.38 -0.98 0.42 115.31 113.31 1bkn h LEU 430 Ca 0.00 0.16 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 1bkn h LEU 430 Cb 0.00 0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1bkn h LEU 430 CO 0.00 -0.00 0.07 0.58 0.09 0.00 0.00 178.44 179.18 1bkn h VAL 431 N 0.42 1.26 0.20 1.22 2.07 -0.14 -1.50 116.25 119.77 1bkn h VAL 431 Ca 0.59 -1.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1bkn h VAL 431 Cb 1.15 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1bkn h VAL 431 CO -0.53 0.38 -0.10 -0.33 0.02 0.00 0.00 177.57 177.01 1bkn h GLU 432 N 0.90 -0.26 -0.62 1.57 5.08 0.39 -1.97 114.58 119.67 1bkn h GLU 432 Ca 0.18 0.02 0.12 0.00 -1.00 0.00 0.00 59.36 58.67 1bkn h GLU 432 Cb 0.46 0.06 -0.12 0.00 0.50 0.00 0.00 28.75 29.65 1bkn h GLU 432 CO 0.02 -0.05 -0.24 -0.91 -1.00 0.00 0.00 179.01 176.83 1bkn h ASN 433 N -0.43 -0.85 -0.50 1.42 -0.26 -0.22 0.61 115.58 115.35 1bkn h ASN 433 Ca -0.03 0.21 0.08 0.00 -0.56 0.00 0.00 56.30 56.01 1bkn h ASN 433 Cb 0.33 0.48 -0.07 0.00 -1.06 0.00 0.00 38.32 38.00 1bkn h ASN 433 CO 0.05 -0.26 0.10 0.28 -1.06 0.00 0.00 177.43 176.54 1bkn h SER 434 N -0.08 0.01 0.03 5.81 0.02 -1.03 -0.31 113.55 118.00 1bkn h SER 434 Ca 0.28 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1bkn h SER 434 Cb 0.52 0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1bkn h SER 434 CO -0.68 0.03 -0.02 -0.07 -1.14 0.00 0.00 176.83 174.96 1bkn h LEU 435 N 0.24 -0.04 -2.43 5.07 3.38 -0.16 -1.69 115.31 119.68 1bkn h LEU 435 Ca 0.25 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 1bkn h LEU 435 Cb 0.33 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 1bkn h LEU 435 CO -0.32 -0.01 -0.01 0.44 0.09 0.00 0.00 178.44 178.62 1bkn h ASP 436 N -0.06 0.00 -0.05 -0.43 3.32 -0.79 0.18 116.42 118.59 1bkn h ASP 436 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1bkn h ASP 436 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 1bkn h ASP 436 CO 0.01 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.54 1bkn n ALA 437 N -2.12 2.52 -2.08 3.45 0.00 -0.16 -4.86 120.51 117.26 1bkn n ALA 437 Ca -0.02 -0.14 -0.01 0.00 0.00 0.00 0.00 53.44 53.27 1bkn n ALA 437 Cb 0.15 -1.08 -0.00 0.00 0.00 0.00 0.00 19.45 18.52 1bkn n ALA 437 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bkn n GLY 438 N 0.69 0.37 3.77 0.00 0.00 0.62 -1.82 105.19 108.81 1bkn n GLY 438 Ca 0.06 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 1bkn n GLY 438 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bkn s ALA 439 N -2.17 2.41 0.00 4.61 0.00 -0.90 -4.48 121.76 121.23 1bkn s ALA 439 Ca 0.00 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1bkn s ALA 439 Cb -0.00 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1bkn s ALA 439 CO 0.01 -1.41 0.00 -2.37 0.00 0.00 0.00 175.76 171.99 1bkn n THR 440 N -2.68 0.00 -3.67 0.00 5.66 -1.26 -4.87 114.28 107.46 1bkn n THR 440 Ca 0.10 -0.20 -0.11 0.00 -3.05 0.00 0.00 64.05 60.80 1bkn n THR 440 Cb 0.52 0.90 -0.11 0.00 -1.55 0.00 0.00 70.33 70.09 1bkn n THR 440 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1bkn s ARG 441 N -0.52 0.27 -0.32 1.09 0.52 -1.26 -1.90 118.95 116.84 1bkn s ARG 441 Ca 0.00 0.87 0.01 0.00 -0.52 0.00 0.00 55.73 56.09 1bkn s ARG 441 Cb 0.00 0.12 0.10 0.00 0.52 0.00 0.00 34.95 35.69 1bkn s ARG 441 CO 0.00 -0.24 0.08 0.42 0.02 0.00 0.00 175.30 175.58 1bkn s ILE 442 N 2.26 1.35 -0.63 1.52 1.01 0.34 -3.00 121.20 124.06 1bkn s ILE 442 Ca -0.03 -1.71 -0.20 0.00 0.00 0.00 0.00 60.65 58.71 1bkn s ILE 442 Cb -0.11 -2.01 0.10 0.00 0.01 0.00 0.00 42.46 40.44 1bkn s ILE 442 CO -0.11 -0.64 0.80 -1.81 0.00 0.00 0.00 174.94 173.18 1bkn s ASP 443 N 1.38 6.20 -0.24 3.58 1.01 -0.84 -1.89 116.67 125.87 1bkn s ASP 443 Ca 0.10 -1.34 -0.09 0.00 0.71 0.00 0.00 52.55 51.93 1bkn s ASP 443 Cb -0.18 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 1bkn s ASP 443 CO -0.19 -1.21 0.12 -0.51 0.21 0.00 0.00 175.17 173.59 1bkn s ILE 444 N 3.07 4.94 -0.00 0.77 1.10 0.40 -2.73 121.20 128.75 1bkn s ILE 444 Ca 0.15 0.04 0.04 0.00 -0.51 0.00 0.00 60.65 60.37 1bkn s ILE 444 Cb -0.21 -3.30 -0.03 0.00 0.15 0.00 0.00 42.46 39.06 1bkn s ILE 444 CO 0.07 0.34 -0.11 -1.81 -2.11 0.00 0.00 174.94 171.32 1bkn s ASP 445 N 1.23 4.28 0.08 4.50 1.01 -0.27 -1.99 116.67 125.50 1bkn s ASP 445 Ca 0.06 -0.22 0.04 0.00 0.71 0.00 0.00 52.55 53.14 1bkn s ASP 445 Cb -0.14 -0.91 -0.03 0.00 1.01 0.00 0.00 42.92 42.85 1bkn s ASP 445 CO 0.05 0.29 -0.12 -0.63 0.21 0.00 0.00 175.17 174.97 1bkn s ILE 446 N -0.91 1.02 -0.04 0.77 1.01 -0.07 -1.37 121.20 121.61 1bkn s ILE 446 Ca 0.15 -1.43 -0.01 0.00 0.00 0.00 0.00 60.65 59.37 1bkn s ILE 446 Cb -0.11 -1.16 0.03 0.00 0.01 0.00 0.00 42.46 41.23 1bkn s ILE 446 CO 0.05 -0.36 0.02 -1.61 0.00 0.00 0.00 174.94 173.04 1bkn s GLU 447 N -2.14 0.26 -0.87 2.79 2.02 -0.62 -0.71 118.70 119.42 1bkn s GLU 447 Ca 0.01 0.17 -0.04 0.00 0.02 0.00 0.00 54.97 55.12 1bkn s GLU 447 Cb -0.07 -0.60 -0.01 0.00 0.10 0.00 0.00 34.13 33.54 1bkn s GLU 447 CO 0.02 -0.23 0.73 0.54 0.02 0.00 0.00 175.26 176.34 1bkn n ARG 448 N 4.72 -1.49 -1.38 1.61 1.74 -1.26 -2.05 116.66 118.55 1bkn n ARG 448 Ca -0.15 1.10 -0.14 0.00 -0.77 0.00 0.00 57.85 57.88 1bkn n ARG 448 Cb 0.50 -4.90 -0.06 0.00 -1.02 0.00 0.00 32.46 26.98 1bkn n ARG 448 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1bkn n GLY 449 N -1.65 1.34 3.18 -0.13 0.00 -1.25 -1.51 105.19 105.17 1bkn n GLY 449 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1bkn n GLY 449 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bkn n GLY 450 N -0.05 2.92 0.31 -0.02 0.00 -0.87 -4.51 105.19 102.97 1bkn n GLY 450 Ca -0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1bkn n GLY 450 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bkn h ALA 451 N 0.00 1.40 0.00 4.61 0.00 -1.35 -3.16 119.26 120.77 1bkn h ALA 451 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1bkn h ALA 451 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1bkn h ALA 451 CO 0.00 -0.23 -0.00 -0.22 0.00 0.00 0.00 179.25 178.79 1bkn h LYS 452 N 0.50 0.00 -6.09 0.00 3.11 -1.58 -2.90 116.57 109.61 1bkn h LYS 452 Ca 0.53 0.00 -0.56 0.00 -2.81 0.00 0.00 60.65 57.81 1bkn h LYS 452 Cb 0.91 0.00 -0.24 0.00 -1.00 0.00 0.00 32.23 31.91 1bkn h LYS 452 CO -0.46 0.00 -0.83 -1.17 -2.81 0.00 0.00 179.45 174.18 1bkn s LEU 453 N -5.04 2.23 -0.29 5.20 2.96 -1.08 -3.97 118.68 118.69 1bkn s LEU 453 Ca -0.00 -0.60 0.02 0.00 -0.22 0.00 0.00 54.13 53.32 1bkn s LEU 453 Cb 0.00 -0.91 0.16 0.00 0.50 0.00 0.00 46.19 45.93 1bkn s LEU 453 CO 0.00 0.10 0.40 -0.63 -1.32 0.00 0.00 176.35 174.90 1bkn s ILE 454 N -0.98 -0.61 -0.12 6.68 1.01 -1.12 -1.59 121.20 124.47 1bkn s ILE 454 Ca 0.07 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.42 1bkn s ILE 454 Cb -0.09 -0.98 -0.01 0.00 0.01 0.00 0.00 42.46 41.38 1bkn s ILE 454 CO 0.03 -0.29 -0.16 -0.60 0.00 0.00 0.00 174.94 173.92 1bkn s ARG 455 N 2.53 3.26 -0.20 2.79 3.52 -0.47 -2.46 118.95 127.92 1bkn s ARG 455 Ca 0.10 -0.73 0.01 0.00 -0.13 0.00 0.00 55.73 54.97 1bkn s ARG 455 Cb -0.13 -2.54 0.05 0.00 -1.56 0.00 0.00 34.95 30.77 1bkn s ARG 455 CO -0.30 0.23 -0.08 0.42 -0.81 0.00 0.00 175.30 174.76 1bkn s ILE 456 N 0.29 1.53 -0.22 4.11 1.09 -1.15 -1.12 121.20 125.74 1bkn s ILE 456 Ca -0.12 -1.01 -0.01 0.00 -1.10 0.00 0.00 60.65 58.40 1bkn s ILE 456 Cb -0.16 -1.68 0.01 0.00 -1.06 0.00 0.00 42.46 39.57 1bkn s ILE 456 CO 0.06 0.09 -0.10 -0.60 -0.10 0.00 0.00 174.94 174.29 1bkn s ARG 457 N 1.43 3.06 0.25 2.79 3.52 -1.11 -2.50 118.95 126.39 1bkn s ARG 457 Ca -0.02 -0.81 0.11 0.00 -0.13 0.00 0.00 55.73 54.88 1bkn s ARG 457 Cb -0.17 -2.86 -0.05 0.00 -1.56 0.00 0.00 34.95 30.31 1bkn s ARG 457 CO -0.08 -0.27 -0.18 0.16 -0.81 0.00 0.00 175.30 174.12 1bkn s ASP 458 N 1.36 3.71 -0.32 -2.12 1.47 -0.16 -1.98 116.67 118.63 1bkn s ASP 458 Ca 0.03 -0.92 0.09 0.00 1.18 0.00 0.00 52.55 52.94 1bkn s ASP 458 Cb -0.15 -0.38 0.66 0.00 -0.34 0.00 0.00 42.92 42.71 1bkn s ASP 458 CO -0.07 0.06 1.72 -0.46 0.68 0.00 0.00 175.17 177.10 1bkn n ASN 459 N -0.41 4.08 -4.97 2.11 6.94 -1.16 -1.21 115.26 120.63 1bkn n ASN 459 Ca -0.07 -3.38 -0.21 0.00 -0.02 0.00 0.00 54.58 50.90 1bkn n ASN 459 Cb 0.59 -0.72 0.01 0.00 -2.36 0.00 0.00 39.78 37.30 1bkn n ASN 459 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1bkn s GLY 460 N -1.49 1.66 0.12 4.83 0.00 -1.26 -4.67 107.32 106.51 1bkn s GLY 460 Ca 0.52 -1.25 -0.17 0.00 0.00 0.00 0.00 44.72 43.82 1bkn s GLY 460 CO 0.10 -1.08 0.31 0.00 0.00 0.00 0.00 173.10 172.42 1bkn n GLY 462 N 1.21 1.61 2.71 0.00 0.00 -1.26 -4.86 105.19 104.61 1bkn n GLY 462 Ca 0.11 -1.76 -0.19 0.00 0.00 0.00 0.00 46.02 44.18 1bkn n GLY 462 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bkn s ILE 463 N 2.32 -0.14 0.33 -0.61 1.01 -1.26 -4.86 121.20 117.99 1bkn s ILE 463 Ca 0.00 0.40 -0.29 0.00 0.00 0.00 0.00 60.65 60.76 1bkn s ILE 463 Cb 0.00 -0.18 -0.12 0.00 0.01 0.00 0.00 42.46 42.18 1bkn s ILE 463 CO 0.00 0.17 1.49 0.29 0.00 0.00 0.00 174.94 176.88 1bkn n LYS 464 N 5.23 2.53 -0.24 2.79 4.01 -1.26 -4.45 118.16 126.77 1bkn n LYS 464 Ca -0.05 0.89 0.12 0.00 -0.51 0.00 0.00 58.31 58.77 1bkn n LYS 464 Cb 0.50 -2.61 0.24 0.00 -0.51 0.00 0.00 35.03 32.65 1bkn n LYS 464 CO 0.00 0.00 0.00 0.36 -1.11 0.00 0.00 177.40 176.65 1bkn n LYS 465 N 1.24 -0.05 0.27 1.97 2.85 -1.26 -0.65 118.16 122.53 1bkn n LYS 465 Ca 0.05 1.06 -0.16 0.00 -1.05 0.00 0.00 58.31 58.21 1bkn n LYS 465 Cb 0.37 -1.71 -0.08 0.00 -0.65 0.00 0.00 35.03 32.95 1bkn n LYS 465 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 1bkn h ASP 466 N 0.00 -0.63 -0.88 -5.58 5.19 -2.03 -2.82 116.42 109.67 1bkn h ASP 466 Ca 0.46 0.03 0.16 0.00 -0.62 0.00 0.00 57.03 57.06 1bkn h ASP 466 Cb 1.00 0.18 -0.07 0.00 0.18 0.00 0.00 39.33 40.62 1bkn h ASP 466 CO -0.66 -0.42 0.57 -0.33 -3.12 0.00 0.00 179.24 175.28 1bkn h GLU 467 N -0.68 0.59 -0.45 3.56 5.08 -1.23 -2.35 114.58 119.10 1bkn h GLU 467 Ca -0.06 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 58.36 1bkn h GLU 467 Cb 0.54 -0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.57 1bkn h GLU 467 CO 0.08 0.39 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.23 1bkn h LEU 468 N 0.60 -0.63 0.00 1.33 3.38 -1.20 -1.45 115.31 117.35 1bkn h LEU 468 Ca 0.45 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.57 1bkn h LEU 468 Cb 0.83 0.36 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1bkn h LEU 468 CO -0.20 -0.21 0.00 0.00 0.09 0.00 0.00 178.44 178.12 1bkn n ALA 469 N -2.89 -0.06 0.30 1.53 0.00 -0.88 -2.13 120.51 116.39 1bkn n ALA 469 Ca 0.03 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.67 1bkn n ALA 469 Cb 0.29 0.21 1.03 0.00 0.00 0.00 0.00 19.45 20.98 1bkn n ALA 469 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1bkn h LEU 470 N 0.00 0.00 -2.60 0.00 -0.00 -1.69 -1.65 115.31 109.37 1bkn h LEU 470 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 1bkn h LEU 470 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.66 1bkn h LEU 470 CO 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 178.44 178.48 1bkn h ALA 471 N 1.88 1.37 0.01 0.17 0.00 -0.72 -1.52 119.26 120.46 1bkn h ALA 471 Ca 0.00 -0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.56 1bkn h ALA 471 Cb 0.11 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1bkn h ALA 471 CO 0.00 -0.05 -2.16 1.28 0.00 0.00 0.00 179.25 178.32 1bkn n LEU 472 N -3.54 0.98 0.00 0.00 7.99 -0.62 -3.61 117.00 118.20 1bkn n LEU 472 Ca -0.02 0.13 0.00 0.00 -0.01 0.00 0.00 56.01 56.10 1bkn n LEU 472 Cb 0.12 0.02 0.00 0.00 -0.11 0.00 0.00 43.42 43.45 1bkn n LEU 472 CO 0.24 0.57 0.00 0.00 -1.51 0.00 0.00 177.39 176.69 1bkn n ALA 473 N -2.79 0.00 -1.00 -1.18 0.00 -0.58 -4.64 120.51 110.32 1bkn n ALA 473 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1bkn n ALA 473 Cb 1.09 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.54 1bkn n ALA 473 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1bkn n GLU 487 N 0.00 2.91 -0.80 0.00 1.02 -1.26 -5.00 120.64 117.52 1bkn n GLU 487 Ca 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.01 1bkn n GLU 487 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 31.44 31.31 1bkn n GLU 487 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bkn n ALA 488 N -3.00 5.22 0.02 0.62 0.00 -1.26 -3.48 120.51 118.62 1bkn n ALA 488 Ca 0.00 -1.60 0.01 0.00 0.00 0.00 0.00 53.44 51.84 1bkn n ALA 488 Cb 0.00 -2.45 -0.01 0.00 0.00 0.00 0.00 19.45 16.99 1bkn n ALA 488 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1bkn n ILE 489 N 2.85 0.00 1.31 0.00 -6.64 -1.26 -4.50 119.36 111.12 1bkn n ILE 489 Ca 0.37 -0.13 0.11 0.00 -1.77 0.00 0.00 62.75 61.33 1bkn n ILE 489 Cb 0.60 0.59 0.63 0.00 -1.44 0.00 0.00 39.64 40.02 1bkn n ILE 489 CO 0.00 0.00 0.00 2.30 -1.77 0.00 0.00 176.55 177.08 1bkn n ILE 490 N -1.44 0.05 0.48 7.28 -0.00 -1.23 -1.25 119.36 123.26 1bkn n ILE 490 Ca -0.00 0.01 0.13 0.00 -0.00 0.00 0.00 62.75 62.89 1bkn n ILE 490 Cb 0.04 -0.67 0.29 0.00 -0.00 0.00 0.00 39.64 39.30 1bkn n ILE 490 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.55 177.32 1bkn h SER 491 N 0.00 0.00 -0.66 7.28 4.64 -1.87 -3.02 113.55 119.93 1bkn h SER 491 Ca 0.00 -0.02 -0.37 0.00 -0.47 0.00 0.00 61.79 60.93 1bkn h SER 491 Cb 0.03 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 61.92 1bkn h SER 491 CO 0.00 0.01 0.47 0.18 -0.87 0.00 0.00 176.83 176.62 1bkn n LEU 492 N -2.51 5.83 -2.85 5.97 7.99 -0.38 -4.56 117.00 126.48 1bkn n LEU 492 Ca 0.05 -3.08 -0.03 0.00 -0.01 0.00 0.00 56.01 52.94 1bkn n LEU 492 Cb 0.47 -0.80 0.01 0.00 -0.11 0.00 0.00 43.42 42.98 1bkn n LEU 492 CO 0.33 0.98 0.16 -0.83 -1.51 0.00 0.00 177.39 176.51 1bkn s GLY 493 N -0.51 -1.33 0.11 -0.72 0.00 -1.14 -4.92 107.32 98.81 1bkn s GLY 493 Ca 0.39 -0.15 -0.11 0.00 0.00 0.00 0.00 44.72 44.85 1bkn s GLY 493 CO 0.05 3.74 1.29 -2.75 0.00 0.00 0.00 173.10 175.43 1bkn h PHE 494 N 5.36 0.98 -0.11 1.90 3.04 -1.80 -2.97 116.94 123.33 1bkn h PHE 494 Ca 0.05 -0.46 -0.18 0.00 3.98 0.00 0.00 57.97 61.36 1bkn h PHE 494 Cb 1.13 -0.14 -0.00 0.00 2.56 0.00 0.00 35.95 39.50 1bkn h PHE 494 CO 0.09 1.29 -0.67 0.07 -2.02 0.00 0.00 178.31 177.07 1bkn h ARG 495 N 0.46 0.46 -0.89 1.11 0.11 -1.95 -3.05 114.38 110.63 1bkn h ARG 495 Ca -0.07 -0.34 0.17 0.00 0.10 0.00 0.00 59.98 59.84 1bkn h ARG 495 Cb 1.48 0.06 -0.10 0.00 1.11 0.00 0.00 29.97 32.52 1bkn h ARG 495 CO 0.17 0.97 0.46 0.78 0.10 0.00 0.00 179.97 182.44 1bkn h GLY 496 N 1.18 1.49 0.94 0.08 0.00 -1.88 0.63 103.07 105.51 1bkn h GLY 496 Ca -0.02 -0.25 0.02 0.00 0.00 0.00 0.00 47.33 47.08 1bkn h GLY 496 CO 0.12 -0.10 0.36 -2.09 0.00 0.00 0.00 176.54 174.83 1bkn h GLU 497 N 0.59 0.70 -0.77 4.80 4.22 -1.41 -1.81 114.58 120.90 1bkn h GLU 497 Ca 0.51 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.89 1bkn h GLU 497 Cb 0.80 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.86 1bkn h GLU 497 CO -0.41 0.46 0.40 0.00 -2.18 0.00 0.00 179.01 177.29 1bkn h ALA 498 N 1.23 0.99 -0.44 2.92 0.00 0.01 -2.79 119.26 121.18 1bkn h ALA 498 Ca 0.22 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1bkn h ALA 498 Cb -0.03 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 1bkn h ALA 498 CO -0.07 0.52 0.13 -0.07 0.00 0.00 0.00 179.25 179.76 1bkn h LEU 499 N 1.08 0.09 -0.62 0.00 -0.00 0.56 -1.76 115.31 114.66 1bkn h LEU 499 Ca 0.27 0.06 0.12 0.00 -0.00 0.00 0.00 57.88 58.33 1bkn h LEU 499 Cb 0.07 0.07 -0.09 0.00 -0.00 0.00 0.00 40.66 40.70 1bkn h LEU 499 CO -0.04 0.09 0.13 0.00 -0.00 0.00 0.00 178.44 178.62 1bkn h ALA 500 N 1.31 0.75 -0.63 1.53 0.00 -1.13 0.29 119.26 121.38 1bkn h ALA 500 Ca 0.21 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1bkn h ALA 500 Cb 0.24 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1bkn h ALA 500 CO -0.24 -0.31 0.39 0.66 0.00 0.00 0.00 179.25 179.75 1bkn h SER 501 N 0.26 0.74 0.14 0.00 4.64 -1.28 -2.69 113.55 115.36 1bkn h SER 501 Ca 0.33 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.61 1bkn h SER 501 Cb 0.50 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 1bkn h SER 501 CO -0.42 0.56 -0.07 0.40 -0.87 0.00 0.00 176.83 176.43 1bkn h ILE 502 N 0.86 0.00 -1.70 0.95 2.04 -0.30 -3.31 117.51 116.05 1bkn h ILE 502 Ca 0.23 -0.52 0.49 0.00 1.00 0.00 0.00 64.86 66.06 1bkn h ILE 502 Cb -0.06 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 35.95 1bkn h ILE 502 CO -0.05 0.00 1.28 0.77 0.00 0.00 0.00 178.15 180.16 1bkn h SER 503 N -0.71 0.00 -0.22 1.72 4.64 -0.59 0.85 113.55 119.24 1bkn h SER 503 Ca -0.02 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.18 1bkn h SER 503 Cb 0.15 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.17 1bkn h SER 503 CO 0.03 0.00 0.15 -1.54 -0.87 0.00 0.00 176.83 174.60 1bkn n SER 504 N -3.89 3.24 0.00 4.97 3.41 -1.02 -3.17 113.62 117.17 1bkn n SER 504 Ca 0.38 -2.37 0.00 0.00 -0.26 0.00 0.00 58.87 56.62 1bkn n SER 504 Cb 1.80 -0.59 0.00 0.00 -0.26 0.00 0.00 64.21 65.16 1bkn n SER 504 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1bkn n VAL 505 N 0.15 0.00 -3.70 -3.33 0.31 0.30 -5.05 118.33 107.01 1bkn n VAL 505 Ca 0.13 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.46 1bkn n VAL 505 Cb 0.76 0.84 -0.01 0.00 -0.91 0.00 0.00 33.84 34.52 1bkn n VAL 505 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1bkn s SER 506 N 0.00 -0.11 -1.16 4.52 1.04 -1.19 -4.05 113.70 112.76 1bkn s SER 506 Ca 0.00 -0.28 -0.22 0.00 0.48 0.00 0.00 55.95 55.93 1bkn s SER 506 Cb 0.00 0.32 -0.04 0.00 0.10 0.00 0.00 66.02 66.40 1bkn s SER 506 CO 0.00 -0.59 1.87 -0.13 0.98 0.00 0.00 173.24 175.37 1bkn s ARG 507 N -2.80 2.86 0.20 4.02 0.52 -0.82 -4.66 118.95 118.27 1bkn s ARG 507 Ca 0.14 -1.20 -0.30 0.00 -0.52 0.00 0.00 55.73 53.85 1bkn s ARG 507 Cb 0.02 -5.28 -0.08 0.00 0.52 0.00 0.00 34.95 30.13 1bkn s ARG 507 CO -0.01 -3.46 1.12 -1.17 0.02 0.00 0.00 175.30 171.80 1bkn s LEU 508 N 9.22 4.49 -0.46 2.53 1.98 -1.26 -3.79 118.68 131.39 1bkn s LEU 508 Ca 0.65 2.15 0.07 0.00 -2.89 0.00 0.00 54.13 54.11 1bkn s LEU 508 Cb -0.01 -3.61 0.25 0.00 0.66 0.00 0.00 46.19 43.48 1bkn s LEU 508 CO 0.09 -0.24 0.57 0.41 -1.89 0.00 0.00 176.35 175.29 1bkn n THR 509 N 2.18 0.14 -2.04 3.68 -1.04 -0.97 -4.65 114.28 111.57 1bkn n THR 509 Ca 0.02 -4.32 -0.39 0.00 -2.04 0.00 0.00 64.05 57.32 1bkn n THR 509 Cb 0.46 -1.99 0.00 0.00 -1.82 0.00 0.00 70.33 66.98 1bkn n THR 509 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1bkn s LEU 510 N -1.48 4.11 -0.30 -4.42 2.96 -1.25 -3.45 118.68 114.85 1bkn s LEU 510 Ca 0.36 2.61 -0.02 0.00 -0.22 0.00 0.00 54.13 56.86 1bkn s LEU 510 Cb 0.16 -4.03 0.19 0.00 0.50 0.00 0.00 46.19 43.01 1bkn s LEU 510 CO -0.09 -0.99 0.64 0.28 -1.32 0.00 0.00 176.35 174.87 1bkn s THR 511 N -1.32 -0.95 0.24 3.68 -1.32 -0.83 -2.38 115.64 112.76 1bkn s THR 511 Ca 0.61 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 61.08 1bkn s THR 511 Cb -0.37 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.59 1bkn s THR 511 CO 0.46 0.00 0.22 -0.55 -2.21 0.00 0.00 174.62 172.55 1bkn s SER 512 N 2.87 0.50 -0.20 8.08 0.15 -1.18 -1.30 113.70 122.61 1bkn s SER 512 Ca 0.19 -1.43 -0.05 0.00 0.70 0.00 0.00 55.95 55.36 1bkn s SER 512 Cb -0.15 0.46 0.10 0.00 -1.71 0.00 0.00 66.02 64.72 1bkn s SER 512 CO -0.20 -0.95 0.39 -0.60 1.20 0.00 0.00 173.24 173.08 1bkn s ARG 513 N -3.92 0.31 1.12 5.44 3.52 -0.57 -2.57 118.95 122.28 1bkn s ARG 513 Ca 0.37 0.85 -0.14 0.00 -0.13 0.00 0.00 55.73 56.69 1bkn s ARG 513 Cb 0.05 0.05 0.25 0.00 -1.56 0.00 0.00 34.95 33.74 1bkn s ARG 513 CO 0.16 -0.37 1.06 0.95 -0.81 0.00 0.00 175.30 176.28 1bkn s THR 514 N 2.57 1.92 -0.24 4.11 -4.23 -1.26 -2.32 115.64 116.18 1bkn s THR 514 Ca 0.03 0.00 -0.04 0.00 -1.18 0.00 0.00 61.69 60.50 1bkn s THR 514 Cb -0.13 -2.30 -0.04 0.00 1.34 0.00 0.00 72.50 71.37 1bkn s THR 514 CO -0.13 0.00 1.33 0.00 -0.54 0.00 0.00 174.62 175.28 1bkn n ALA 515 N -4.64 1.96 -3.52 3.99 0.00 -1.26 -4.71 120.51 112.33 1bkn n ALA 515 Ca 0.05 -0.75 -0.15 0.00 0.00 0.00 0.00 53.44 52.59 1bkn n ALA 515 Cb 0.57 -2.73 -0.05 0.00 0.00 0.00 0.00 19.45 17.23 1bkn n ALA 515 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1bkn s GLU 516 N 4.74 0.96 0.56 0.00 2.56 -1.26 -5.01 118.70 121.25 1bkn s GLU 516 Ca 0.16 0.13 0.38 0.00 0.00 0.00 0.00 54.97 55.64 1bkn s GLU 516 Cb 0.04 0.45 1.52 0.00 2.00 0.00 0.00 34.13 38.14 1bkn s GLU 516 CO 0.02 -0.32 1.70 1.96 -0.56 0.00 0.00 175.26 178.05 1bkn h GLN 517 N 2.74 0.00 -6.08 4.30 4.20 -2.01 -3.41 115.11 114.85 1bkn h GLN 517 Ca -0.25 0.00 -0.75 0.00 0.06 0.00 0.00 58.65 57.70 1bkn h GLN 517 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 1bkn h GLN 517 CO 0.37 0.00 1.01 0.00 -0.67 0.00 0.00 178.83 179.54 1bkn n GLN 518 N -3.95 0.82 -0.54 1.46 10.64 -1.26 -4.86 117.38 119.69 1bkn n GLN 518 Ca 0.28 0.28 -0.21 0.00 -1.83 0.00 0.00 57.00 55.52 1bkn n GLN 518 Cb 1.42 -2.00 0.16 0.00 -0.86 0.00 0.00 30.24 28.96 1bkn n GLN 518 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1bkn n GLU 519 N 5.94 -2.29 -2.37 2.61 1.02 -1.26 -4.70 120.64 119.59 1bkn n GLU 519 Ca 0.33 -0.67 -0.29 0.00 -0.02 0.00 0.00 57.16 56.51 1bkn n GLU 519 Cb 0.10 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 1bkn n GLU 519 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1bkn s ALA 520 N -2.10 3.30 0.28 0.62 0.00 -1.15 -4.83 121.76 117.87 1bkn s ALA 520 Ca 0.41 -0.35 0.02 0.00 0.00 0.00 0.00 51.96 52.04 1bkn s ALA 520 Cb -0.07 -2.76 -0.04 0.00 0.00 0.00 0.00 23.12 20.24 1bkn s ALA 520 CO 0.41 -0.46 0.14 -1.58 0.00 0.00 0.00 175.76 174.26 1bkn s TRP 521 N -2.89 1.53 -0.21 0.00 0.52 -1.06 -0.63 118.94 116.20 1bkn s TRP 521 Ca 0.50 -1.31 -0.19 0.00 0.02 0.00 0.00 56.10 55.12 1bkn s TRP 521 Cb -0.11 -0.84 0.06 0.00 -1.15 0.00 0.00 33.47 31.43 1bkn s TRP 521 CO 0.48 -0.48 0.56 -1.14 0.02 0.00 0.00 176.95 176.40 1bkn s GLN 522 N -3.93 0.65 0.23 4.98 -0.44 -0.48 -3.09 119.66 117.58 1bkn s GLN 522 Ca 0.37 0.80 0.12 0.00 -2.50 0.00 0.00 55.36 54.14 1bkn s GLN 522 Cb 0.06 0.31 -0.05 0.00 -1.64 0.00 0.00 33.01 31.69 1bkn s GLN 522 CO 0.16 -0.08 -0.21 0.00 0.50 0.00 0.00 175.29 175.65 1bkn s ALA 523 N 0.37 2.65 0.00 1.58 0.00 -1.00 -1.82 121.76 123.53 1bkn s ALA 523 Ca -0.01 -1.73 0.00 0.00 0.00 0.00 0.00 51.96 50.22 1bkn s ALA 523 Cb -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 23.12 22.75 1bkn s ALA 523 CO -0.00 0.37 0.00 0.66 0.00 0.00 0.00 175.76 176.79 1bkn n TYR 524 N -0.12 0.00 0.00 0.00 4.01 -1.25 -3.74 117.16 116.06 1bkn n TYR 524 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 1bkn n TYR 524 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.61 1bkn n TYR 524 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 1bkn n MET 530 N 0.00 0.00 -4.15 -0.72 2.81 -1.26 -3.23 117.12 110.57 1bkn n MET 530 Ca 0.00 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 55.77 1bkn n MET 530 Cb 0.00 -0.99 -0.10 0.00 -0.71 0.00 0.00 33.22 31.41 1bkn n MET 530 CO 0.00 0.00 0.00 -0.80 1.51 0.00 0.00 175.97 176.68 1bkn s ASN 531 N -1.35 1.16 0.11 7.83 -0.87 -1.26 -5.06 114.94 115.51 1bkn s ASN 531 Ca 0.00 -0.88 -0.23 0.00 -1.57 0.00 0.00 52.86 50.18 1bkn s ASN 531 Cb 0.00 0.06 -0.07 0.00 -0.02 0.00 0.00 41.25 41.22 1bkn s ASN 531 CO 0.00 -0.37 0.68 0.68 -2.57 0.00 0.00 177.10 175.52 1bkn s VAL 532 N -2.96 4.56 -0.57 1.60 -7.23 -1.20 -5.03 120.40 109.57 1bkn s VAL 532 Ca 0.07 1.48 0.01 0.00 -1.81 0.00 0.00 61.98 61.73 1bkn s VAL 532 Cb 0.01 -4.03 0.14 0.00 0.56 0.00 0.00 36.38 33.06 1bkn s VAL 532 CO -0.03 0.52 0.34 0.42 -0.31 0.00 0.00 175.10 176.05 1bkn s THR 533 N -1.03 3.07 -0.39 5.32 -4.23 -1.23 -4.83 115.64 112.32 1bkn s THR 533 Ca 0.33 -3.22 -0.20 0.00 -1.18 0.00 0.00 61.69 57.42 1bkn s THR 533 Cb -0.21 -3.06 0.01 0.00 1.34 0.00 0.00 72.50 70.58 1bkn s THR 533 CO 0.23 -0.84 0.61 0.54 -0.54 0.00 0.00 174.62 174.62 1bkn s VAL 534 N -0.26 4.90 0.29 2.29 0.11 -1.23 -3.74 120.40 122.76 1bkn s VAL 534 Ca 0.17 0.34 0.03 0.00 -2.93 0.00 0.00 61.98 59.60 1bkn s VAL 534 Cb -0.23 -4.10 -0.06 0.00 -1.53 0.00 0.00 36.38 30.46 1bkn s VAL 534 CO -0.02 -0.40 0.05 -1.59 -3.33 0.00 0.00 175.10 169.81 1bkn s LYS 535 N 2.67 1.52 0.88 1.54 -2.85 -0.76 -4.91 119.74 117.84 1bkn s LYS 535 Ca 0.22 -1.82 -0.11 0.00 -1.00 0.00 0.00 55.97 53.26 1bkn s LYS 535 Cb -0.15 -0.67 0.12 0.00 -2.06 0.00 0.00 37.83 35.07 1bkn s LYS 535 CO 0.16 -0.19 1.09 -2.14 0.10 0.00 0.00 175.35 174.38 1bkn s PRO 536 N -3.92 1.41 0.14 1.78 0.02 -1.26 -1.38 135.00 131.79 1bkn s PRO 536 Ca 0.35 0.82 -0.25 0.00 0.02 0.00 0.00 61.00 61.94 1bkn s PRO 536 Cb 0.08 -1.83 0.07 0.00 0.02 0.00 0.00 34.50 32.84 1bkn s PRO 536 CO 0.13 -2.14 1.01 0.00 -0.33 0.00 0.00 177.00 175.67 1bkn s ALA 537 N -2.96 -1.71 -0.24 -1.55 0.00 0.20 -4.73 121.76 110.76 1bkn s ALA 537 Ca 0.63 0.13 -0.10 0.00 0.00 0.00 0.00 51.96 52.62 1bkn s ALA 537 Cb -0.17 0.62 -0.05 0.00 0.00 0.00 0.00 23.12 23.52 1bkn s ALA 537 CO 0.57 -1.05 0.14 0.00 0.00 0.00 0.00 175.76 175.42 1bkn s ALA 538 N -3.05 3.51 -0.25 0.00 0.00 -1.26 -2.93 121.76 117.77 1bkn s ALA 538 Ca 0.14 -0.95 -0.27 0.00 0.00 0.00 0.00 51.96 50.88 1bkn s ALA 538 Cb -0.01 -2.28 0.15 0.00 0.00 0.00 0.00 23.12 20.98 1bkn s ALA 538 CO 0.02 -0.27 1.18 -1.58 0.00 0.00 0.00 175.76 175.11 1bkn s HIS 539 N 1.21 -0.27 0.92 0.00 5.04 -1.26 -5.01 115.29 115.92 1bkn s HIS 539 Ca 0.07 0.58 -0.15 0.00 -1.54 0.00 0.00 55.06 54.02 1bkn s HIS 539 Cb -0.14 0.44 0.16 0.00 0.04 0.00 0.00 32.58 33.08 1bkn s HIS 539 CO 0.05 -0.18 1.24 -1.25 -2.34 0.00 0.00 174.74 172.26 1bkn s PRO 540 N -0.41 0.99 -0.83 2.88 0.04 -1.26 -4.60 135.00 131.81 1bkn s PRO 540 Ca 0.04 -0.14 -0.23 0.00 0.04 0.00 0.00 61.00 60.71 1bkn s PRO 540 Cb -0.03 -1.86 -0.17 0.00 0.04 0.00 0.00 34.50 32.48 1bkn s PRO 540 CO -0.07 -2.22 2.34 0.28 0.04 0.00 0.00 177.00 177.37 1bkn n VAL 541 N -3.70 0.00 -2.04 -0.36 0.31 -1.26 -4.43 118.33 106.85 1bkn n VAL 541 Ca 0.12 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 1bkn n VAL 541 Cb 0.60 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 1bkn n VAL 541 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1bkn n GLY 542 N 6.55 0.99 3.19 2.92 0.00 -0.98 -4.63 105.19 113.23 1bkn n GLY 542 Ca 0.49 -0.27 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 1bkn n GLY 542 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1bkn s THR 543 N -1.06 0.11 -0.01 2.61 2.01 -0.35 -1.52 115.64 117.43 1bkn s THR 543 Ca 0.00 -0.87 -0.12 0.00 0.31 0.00 0.00 61.69 61.00 1bkn s THR 543 Cb 0.00 -0.93 0.02 0.00 0.01 0.00 0.00 72.50 71.60 1bkn s THR 543 CO 0.00 -0.48 0.25 -0.89 -0.69 0.00 0.00 174.62 172.81 1bkn s THR 544 N -2.60 0.06 -0.13 -0.82 2.01 -0.42 -0.99 115.64 112.75 1bkn s THR 544 Ca -0.05 -0.54 -0.05 0.00 0.31 0.00 0.00 61.69 61.37 1bkn s THR 544 Cb -0.01 -0.55 0.06 0.00 0.01 0.00 0.00 72.50 72.02 1bkn s THR 544 CO -0.04 -0.29 0.27 -0.76 -0.69 0.00 0.00 174.62 173.11 1bkn s LEU 545 N -1.31 -0.25 -0.06 4.42 1.02 -1.04 -1.96 118.68 119.49 1bkn s LEU 545 Ca -0.14 0.62 -0.09 0.00 0.02 0.00 0.00 54.13 54.54 1bkn s LEU 545 Cb -0.06 0.76 -0.05 0.00 0.02 0.00 0.00 46.19 46.86 1bkn s LEU 545 CO 0.03 -0.23 0.24 -1.61 0.02 0.00 0.00 176.35 174.80 1bkn s GLU 546 N 2.31 3.59 -0.06 1.70 2.02 -1.22 -2.95 118.70 124.08 1bkn s GLU 546 Ca -0.00 0.02 -0.03 0.00 0.02 0.00 0.00 54.97 54.99 1bkn s GLU 546 Cb -0.12 -3.18 0.04 0.00 0.10 0.00 0.00 34.13 30.97 1bkn s GLU 546 CO -0.09 0.73 0.07 0.08 0.02 0.00 0.00 175.26 176.08 1bkn s VAL 547 N -1.10 -0.12 -0.28 2.63 1.01 -1.03 -2.30 120.40 119.21 1bkn s VAL 547 Ca 0.20 0.33 0.01 0.00 0.00 0.00 0.00 61.98 62.51 1bkn s VAL 547 Cb -0.13 -0.23 0.08 0.00 0.00 0.00 0.00 36.38 36.10 1bkn s VAL 547 CO 0.09 0.10 0.03 -0.76 0.00 0.00 0.00 175.10 174.56 1bkn s LEU 548 N 2.18 2.80 1.11 3.92 1.02 -1.25 -2.80 118.68 125.66 1bkn s LEU 548 Ca 0.04 -1.51 -0.12 0.00 0.02 0.00 0.00 54.13 52.56 1bkn s LEU 548 Cb -0.13 -1.12 0.25 0.00 0.02 0.00 0.00 46.19 45.22 1bkn s LEU 548 CO -0.04 -0.33 1.05 -0.62 0.02 0.00 0.00 176.35 176.43 1bkn s ASP 549 N 1.41 1.42 -0.39 2.29 -1.08 -1.10 -1.94 116.67 117.28 1bkn s ASP 549 Ca 0.03 1.60 0.02 0.00 -0.52 0.00 0.00 52.55 53.68 1bkn s ASP 549 Cb -0.18 -2.31 0.28 0.00 -1.46 0.00 0.00 42.92 39.25 1bkn s ASP 549 CO -0.13 -3.94 1.16 0.00 0.52 0.00 0.00 175.17 172.78 1bkn n LEU 550 N -4.75 -1.85 0.00 -1.34 -0.00 -1.26 -4.88 117.00 102.92 1bkn n LEU 550 Ca 0.05 -2.45 -0.09 0.00 -0.00 0.00 0.00 56.01 53.52 1bkn n LEU 550 Cb 0.54 0.76 -0.01 0.00 -0.00 0.00 0.00 43.42 44.71 1bkn n LEU 550 CO 0.56 1.76 0.17 0.18 -0.00 0.00 0.00 177.39 180.06 1bkn n LEU 561 N 1.22 0.00 0.00 1.47 4.32 -1.26 -5.03 117.00 117.72 1bkn n LEU 561 Ca 0.03 -1.86 0.00 0.00 -0.02 0.00 0.00 56.01 54.16 1bkn n LEU 561 Cb 0.69 1.91 0.00 0.00 -1.62 0.00 0.00 43.42 44.41 1bkn n LEU 561 CO -0.06 -0.47 0.00 -2.11 -1.22 0.00 0.00 177.39 173.53 1bkn n ARG 562 N -0.38 0.00 -3.32 3.23 0.00 -1.26 -5.19 116.66 109.75 1bkn n ARG 562 Ca -0.01 0.00 -0.20 0.00 -0.00 0.00 0.00 57.85 57.64 1bkn n ARG 562 Cb 0.39 0.00 0.01 0.00 -0.00 0.00 0.00 32.46 32.86 1bkn n ARG 562 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1bkn s THR 563 N -0.17 2.49 0.00 8.89 -4.23 -1.26 -5.11 115.64 116.25 1bkn s THR 563 Ca 0.00 -1.18 0.00 0.00 -1.18 0.00 0.00 61.69 59.33 1bkn s THR 563 Cb 0.00 -2.67 0.00 0.00 1.34 0.00 0.00 72.50 71.17 1bkn s THR 563 CO 0.00 0.00 0.03 1.21 -0.54 0.00 0.00 174.62 175.32 1bkn n GLU 564 N -1.84 0.00 0.22 3.99 4.07 -1.26 -4.23 120.64 121.59 1bkn n GLU 564 Ca 0.07 0.09 0.11 0.00 -0.06 0.00 0.00 57.16 57.37 1bkn n GLU 564 Cb 0.61 -0.62 0.30 0.00 -0.06 0.00 0.00 31.44 31.68 1bkn n GLU 564 CO 0.00 0.00 0.00 -0.22 -0.06 0.00 0.00 177.13 176.85 1bkn h LYS 565 N 0.00 0.00 -0.81 5.31 3.64 -1.98 -3.24 116.57 119.50 1bkn h LYS 565 Ca 0.00 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1bkn h LYS 565 Cb 0.00 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 1bkn h LYS 565 CO 0.00 0.15 0.50 1.15 -2.27 0.00 0.00 179.45 178.97 1bkn h THR 566 N 0.00 1.05 -0.63 1.00 2.02 -2.00 -2.25 112.91 112.11 1bkn h THR 566 Ca -0.00 -0.32 0.05 0.00 0.77 0.00 0.00 66.41 66.91 1bkn h THR 566 Cb 0.93 0.05 -0.05 0.00 -1.74 0.00 0.00 68.15 67.33 1bkn h THR 566 CO 0.02 0.17 0.35 -0.33 0.37 0.00 0.00 175.52 176.10 1bkn h GLU 567 N 0.93 0.64 -0.67 6.66 4.39 -1.73 -2.05 114.58 122.74 1bkn h GLU 567 Ca 0.34 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.97 1bkn h GLU 567 Cb 0.13 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.60 1bkn h GLU 567 CO -0.16 0.42 0.27 0.35 -1.16 0.00 0.00 179.01 178.73 1bkn h PHE 568 N 0.66 1.02 -0.01 4.33 3.57 -1.58 -1.74 116.94 123.19 1bkn h PHE 568 Ca 0.28 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.70 1bkn h PHE 568 Cb 0.16 -0.31 -0.00 0.00 2.79 0.00 0.00 35.95 38.59 1bkn h PHE 568 CO -0.08 0.80 0.01 -0.91 -2.23 0.00 0.00 178.31 175.89 1bkn h ASN 569 N 0.95 0.00 -0.12 0.41 4.21 -0.99 0.17 115.58 120.21 1bkn h ASN 569 Ca 0.22 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.53 1bkn h ASN 569 Cb 0.21 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.42 1bkn h ASN 569 CO -0.02 0.00 -0.72 0.45 -1.29 0.00 0.00 177.43 175.85 1bkn h HIS 570 N 0.00 0.95 -0.48 1.19 3.86 -0.73 -2.40 115.15 117.54 1bkn h HIS 570 Ca 0.00 -0.44 -0.06 0.00 -1.16 0.00 0.00 60.37 58.72 1bkn h HIS 570 Cb 0.01 -0.14 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 1bkn h HIS 570 CO 0.00 1.25 0.06 0.82 0.86 0.00 0.00 177.93 180.93 1bkn h ILE 571 N 0.38 1.25 -0.31 2.45 2.04 -0.71 -1.65 117.51 120.96 1bkn h ILE 571 Ca -0.06 -0.95 0.06 0.00 1.00 0.00 0.00 64.86 64.91 1bkn h ILE 571 Cb 1.36 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 1bkn h ILE 571 CO 0.15 0.34 -0.03 -0.78 0.00 0.00 0.00 178.15 177.82 1bkn h ASP 572 N 0.67 -0.19 0.49 1.72 3.58 -0.71 0.84 116.42 122.83 1bkn h ASP 572 Ca 0.14 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.66 1bkn h ASP 572 Cb 0.42 0.15 -0.02 0.00 1.72 0.00 0.00 39.33 41.60 1bkn h ASP 572 CO 0.01 -0.06 -0.45 -0.08 -2.88 0.00 0.00 179.24 175.79 1bkn h GLU 573 N 0.05 -0.90 -0.35 0.28 4.57 -1.25 -0.67 114.58 116.31 1bkn h GLU 573 Ca 0.15 0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.43 1bkn h GLU 573 Cb 0.22 0.20 -0.06 0.00 -0.16 0.00 0.00 28.75 28.95 1bkn h GLU 573 CO -0.28 -0.60 -0.34 0.82 -1.18 0.00 0.00 179.01 177.43 1bkn h ILE 574 N -0.94 0.00 -0.91 2.32 2.04 -0.75 0.26 117.51 119.53 1bkn h ILE 574 Ca -0.05 0.00 0.22 0.00 1.00 0.00 0.00 64.86 66.03 1bkn h ILE 574 Cb 0.81 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.83 1bkn h ILE 574 CO -0.04 0.00 0.61 0.40 0.00 0.00 0.00 178.15 179.12 1bkn h ILE 575 N -0.17 0.64 0.47 -0.67 1.08 -0.75 0.32 117.51 118.42 1bkn h ILE 575 Ca 0.06 -0.11 -0.02 0.00 -0.39 0.00 0.00 64.86 64.40 1bkn h ILE 575 Cb 0.33 0.29 0.00 0.00 -3.07 0.00 0.00 36.82 34.37 1bkn h ILE 575 CO -0.42 0.06 -0.23 -0.09 -0.69 0.00 0.00 178.15 176.78 1bkn h ARG 576 N 0.32 -0.61 0.00 2.37 2.43 0.11 0.22 114.38 119.21 1bkn h ARG 576 Ca 0.47 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.69 1bkn h ARG 576 Cb 1.31 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 31.00 1bkn h ARG 576 CO -0.16 -0.40 0.00 0.54 -1.51 0.00 0.00 179.97 178.44 1bkn n ARG 577 N -5.36 0.00 -0.30 0.20 3.00 0.04 -1.52 116.66 112.71 1bkn n ARG 577 Ca -0.12 0.82 0.04 0.00 -0.01 0.00 0.00 57.85 58.59 1bkn n ARG 577 Cb 0.27 -1.48 0.13 0.00 0.00 0.00 0.00 32.46 31.38 1bkn n ARG 577 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.63 178.45 1bkn h ILE 578 N 0.00 0.14 -0.53 0.55 2.04 -1.35 0.57 117.51 118.93 1bkn h ILE 578 Ca 0.00 -0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.96 1bkn h ILE 578 Cb 0.00 0.14 -0.11 0.00 -0.74 0.00 0.00 36.82 36.11 1bkn h ILE 578 CO 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 178.15 177.90 1bkn h ALA 579 N 1.86 0.10 -0.37 1.87 0.00 0.33 0.33 119.26 123.38 1bkn h ALA 579 Ca 0.43 0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.45 1bkn h ALA 579 Cb 0.68 0.61 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1bkn h ALA 579 CO -0.87 -0.59 -0.02 -0.07 0.00 0.00 0.00 179.25 177.70 1bkn h LEU 580 N -0.13 0.57 -1.19 0.00 3.38 0.14 -2.54 115.31 115.53 1bkn h LEU 580 Ca 0.24 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1bkn h LEU 580 Cb 0.50 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1bkn h LEU 580 CO -0.61 0.65 -0.23 0.00 0.09 0.00 0.00 178.44 178.35 1bkn h ALA 581 N 1.42 1.33 -2.78 1.53 0.00 0.84 -3.35 119.26 118.25 1bkn h ALA 581 Ca 0.12 -0.29 -0.61 0.00 0.00 0.00 0.00 54.91 54.13 1bkn h ALA 581 Cb 0.39 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 17.68 1bkn h ALA 581 CO 0.02 0.46 -0.76 1.03 0.00 0.00 0.00 179.25 180.00 1bkn s ARG 582 N -4.52 1.71 0.00 0.00 1.81 0.82 -4.92 118.95 113.85 1bkn s ARG 582 Ca -0.05 -2.72 0.10 0.00 -1.72 0.00 0.00 55.73 51.34 1bkn s ARG 582 Cb 0.15 -2.49 0.43 0.00 -0.45 0.00 0.00 34.95 32.58 1bkn s ARG 582 CO 0.75 -1.32 1.29 1.19 -0.68 0.00 0.00 175.30 176.53 1bkn n PHE 583 N 2.47 0.00 0.02 -0.53 3.01 -1.20 -2.64 117.46 118.60 1bkn n PHE 583 Ca 0.23 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.76 1bkn n PHE 583 Cb 0.40 -0.46 0.26 0.00 -0.01 0.00 0.00 39.48 39.67 1bkn n PHE 583 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1bkn n ASP 584 N -1.46 3.51 -3.67 4.37 5.75 -1.26 -1.07 116.55 122.72 1bkn n ASP 584 Ca 0.03 -2.27 -0.20 0.00 -0.01 0.00 0.00 54.79 52.34 1bkn n ASP 584 Cb 0.11 -0.47 -0.17 0.00 -1.03 0.00 0.00 41.12 39.55 1bkn n ASP 584 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1bkn s VAL 585 N -1.68 -0.14 0.31 2.12 0.11 -1.08 -4.73 120.40 115.30 1bkn s VAL 585 Ca 0.37 0.39 -0.29 0.00 -2.93 0.00 0.00 61.98 59.52 1bkn s VAL 585 Cb 0.23 -0.20 -0.11 0.00 -1.53 0.00 0.00 36.38 34.77 1bkn s VAL 585 CO 0.19 0.15 1.53 -0.89 -3.33 0.00 0.00 175.10 172.76 1bkn s THR 586 N 2.20 2.17 -0.03 5.04 2.01 -0.80 -4.51 115.64 121.71 1bkn s THR 586 Ca 0.04 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.20 1bkn s THR 586 Cb -0.12 -3.10 0.03 0.00 0.01 0.00 0.00 72.50 69.32 1bkn s THR 586 CO -0.04 0.03 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.28 1bkn s ILE 587 N -0.34 0.24 -0.24 1.82 1.01 0.18 -0.50 121.20 123.36 1bkn s ILE 587 Ca 0.59 0.04 0.01 0.00 0.00 0.00 0.00 60.65 61.30 1bkn s ILE 587 Cb -0.46 -0.32 0.06 0.00 0.01 0.00 0.00 42.46 41.75 1bkn s ILE 587 CO 0.51 0.16 -0.07 0.20 0.00 0.00 0.00 174.94 175.75 1bkn s ASN 588 N 0.97 4.02 -0.25 3.58 0.01 -0.79 -0.02 114.94 122.47 1bkn s ASN 588 Ca -0.10 -1.25 -0.08 0.00 -0.71 0.00 0.00 52.86 50.71 1bkn s ASN 588 Cb -0.14 -1.28 -0.04 0.00 0.41 0.00 0.00 41.25 40.20 1bkn s ASN 588 CO -0.01 -0.23 0.11 -0.22 -1.51 0.00 0.00 177.10 175.24 1bkn s LEU 589 N 1.31 3.69 0.29 0.60 2.96 -0.68 -0.45 118.68 126.40 1bkn s LEU 589 Ca -0.06 -0.09 0.07 0.00 -0.22 0.00 0.00 54.13 53.83 1bkn s LEU 589 Cb -0.19 -1.99 -0.06 0.00 0.50 0.00 0.00 46.19 44.45 1bkn s LEU 589 CO -0.06 0.00 -0.06 -0.94 -1.32 0.00 0.00 176.35 173.97 1bkn s SER 590 N 1.42 2.94 -0.07 3.68 1.04 -0.84 -1.52 113.70 120.35 1bkn s SER 590 Ca 0.06 -1.20 -0.03 0.00 0.48 0.00 0.00 55.95 55.26 1bkn s SER 590 Cb -0.15 -0.20 0.04 0.00 0.10 0.00 0.00 66.02 65.81 1bkn s SER 590 CO 0.05 -0.32 0.12 -2.28 0.98 0.00 0.00 173.24 171.79 1bkn s HIS 591 N -2.94 -0.08 -1.26 5.02 2.46 0.78 -0.89 115.29 118.38 1bkn s HIS 591 Ca 0.30 0.45 -0.07 0.00 0.47 0.00 0.00 55.06 56.21 1bkn s HIS 591 Cb 0.04 -0.36 -0.01 0.00 -0.13 0.00 0.00 32.58 32.12 1bkn s HIS 591 CO 0.13 -0.25 0.68 0.09 -2.47 0.00 0.00 174.74 172.92 1bkn n ASN 592 N 5.31 -2.55 0.00 9.88 3.02 0.11 -0.42 115.26 130.61 1bkn n ASN 592 Ca -0.04 -0.91 0.00 0.00 -0.03 0.00 0.00 54.58 53.60 1bkn n ASN 592 Cb 0.50 -3.72 0.00 0.00 -0.61 0.00 0.00 39.78 35.95 1bkn n ASN 592 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bkn n GLY 593 N -1.67 1.50 3.53 7.41 0.00 -1.26 -4.94 105.19 109.76 1bkn n GLY 593 Ca -0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 1bkn n GLY 593 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1bkn s LYS 594 N -0.04 3.42 0.08 1.61 2.47 0.44 -5.02 119.74 122.70 1bkn s LYS 594 Ca 0.00 -0.29 -0.31 0.00 -1.56 0.00 0.00 55.97 53.82 1bkn s LYS 594 Cb 0.00 -3.89 -0.09 0.00 -1.46 0.00 0.00 37.83 32.39 1bkn s LYS 594 CO 0.00 -0.84 1.78 -1.50 0.16 0.00 0.00 175.35 174.95 1bkn s ILE 595 N 2.61 2.82 -0.24 5.43 -1.16 -1.26 -0.16 121.20 129.23 1bkn s ILE 595 Ca 0.21 0.22 -0.16 0.00 -0.51 0.00 0.00 60.65 60.41 1bkn s ILE 595 Cb -0.15 -3.14 -0.11 0.00 0.61 0.00 0.00 42.46 39.66 1bkn s ILE 595 CO 0.16 -0.00 -0.26 0.52 -2.81 0.00 0.00 174.94 172.55 1bkn n VAL 596 N 4.88 1.52 -3.86 4.00 0.31 -0.57 -4.90 118.33 119.71 1bkn n VAL 596 Ca 0.17 -0.18 -0.11 0.00 -0.01 0.00 0.00 64.34 64.21 1bkn n VAL 596 Cb 0.40 -2.04 -0.10 0.00 -0.91 0.00 0.00 33.84 31.19 1bkn n VAL 596 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bkn s ARG 597 N -2.55 0.48 -0.32 5.55 1.70 -0.66 -5.03 118.95 118.12 1bkn s ARG 597 Ca -0.34 -0.33 -0.01 0.00 -0.47 0.00 0.00 55.73 54.58 1bkn s ARG 597 Cb 0.10 0.20 0.11 0.00 -0.57 0.00 0.00 34.95 34.79 1bkn s ARG 597 CO 0.48 -0.12 0.12 -1.14 -1.08 0.00 0.00 175.30 173.56 1bkn s GLN 598 N -1.27 0.66 -0.84 3.89 0.74 -1.26 -1.69 119.66 119.88 1bkn s GLN 598 Ca -0.14 -1.07 -0.18 0.00 0.05 0.00 0.00 55.36 54.02 1bkn s GLN 598 Cb -0.07 -1.83 0.15 0.00 1.10 0.00 0.00 33.01 32.36 1bkn s GLN 598 CO 0.02 -1.02 0.96 0.71 -0.55 0.00 0.00 175.29 175.41 1bkn s TYR 599 N 1.56 3.25 0.50 1.67 2.02 0.96 -4.96 117.35 122.35 1bkn s TYR 599 Ca 0.11 -1.44 -0.22 0.00 -0.37 0.00 0.00 57.07 55.15 1bkn s TYR 599 Cb -0.18 -4.12 -0.06 0.00 -0.40 0.00 0.00 41.96 37.20 1bkn s TYR 599 CO -0.24 -1.34 1.22 1.03 -1.57 0.00 0.00 175.55 174.66 1bkn s ARG 600 N 2.10 3.48 0.61 -0.62 0.52 -1.26 -0.65 118.95 123.13 1bkn s ARG 600 Ca 0.25 1.90 -0.14 0.00 -0.52 0.00 0.00 55.73 57.22 1bkn s ARG 600 Cb -0.10 -2.29 -0.03 0.00 0.52 0.00 0.00 34.95 33.05 1bkn s ARG 600 CO -0.06 -0.82 1.04 0.00 0.02 0.00 0.00 175.30 175.48 1bkn s ALA 601 N -1.49 2.82 -0.16 2.13 0.00 -1.26 -4.72 121.76 119.08 1bkn s ALA 601 Ca 0.68 0.22 -0.03 0.00 0.00 0.00 0.00 51.96 52.83 1bkn s ALA 601 Cb -0.32 -3.18 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 1bkn s ALA 601 CO 0.38 -0.80 -0.07 0.08 0.00 0.00 0.00 175.76 175.35 1bkn s VAL 602 N -2.72 3.52 0.64 0.00 1.01 -0.24 -4.92 120.40 117.69 1bkn s VAL 602 Ca 0.60 -0.48 -0.11 0.00 0.00 0.00 0.00 61.98 61.99 1bkn s VAL 602 Cb -0.14 -2.53 0.16 0.00 0.00 0.00 0.00 36.38 33.87 1bkn s VAL 602 CO 0.42 0.49 0.55 -0.81 0.00 0.00 0.00 175.10 175.75 1bkn n PRO 603 N 3.78 -2.21 -1.78 2.72 -0.04 -1.26 -4.60 135.00 131.61 1bkn n PRO 603 Ca -0.18 -0.89 -0.43 0.00 -0.04 0.00 0.00 63.50 61.97 1bkn n PRO 603 Cb 0.52 -0.85 -0.03 0.00 -0.04 0.00 0.00 33.50 33.11 1bkn n PRO 603 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1bkn s GLU 604 N -4.26 3.70 -1.23 0.54 -6.30 -1.26 -2.13 118.70 107.75 1bkn s GLU 604 Ca 0.36 2.13 -0.02 0.00 -2.50 0.00 0.00 54.97 54.94 1bkn s GLU 604 Cb -0.04 -4.19 -0.01 0.00 0.00 0.00 0.00 34.13 29.89 1bkn s GLU 604 CO 0.28 -1.45 0.82 0.41 0.02 0.00 0.00 175.26 175.35 1bkn n GLY 605 N 4.98 -0.46 0.00 -1.50 0.00 -1.26 -5.00 105.19 101.95 1bkn n GLY 605 Ca 0.23 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.44 1bkn n GLY 605 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bkn n GLY 606 N -1.40 1.59 3.24 -0.02 0.00 -0.91 -5.02 105.19 102.66 1bkn n GLY 606 Ca -0.26 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 1bkn n GLY 606 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1bkn s GLN 607 N 3.37 2.66 0.24 1.61 -0.44 -1.26 -4.91 119.66 120.94 1bkn s GLN 607 Ca 0.00 -1.81 0.04 0.00 -2.50 0.00 0.00 55.36 51.09 1bkn s GLN 607 Cb 0.00 -4.04 0.27 0.00 -1.64 0.00 0.00 33.01 27.60 1bkn s GLN 607 CO 0.00 -1.23 1.58 0.87 0.50 0.00 0.00 175.29 177.01 1bkn h LYS 608 N 8.49 0.28 -0.41 1.67 1.57 -1.97 -3.23 116.57 122.97 1bkn h LYS 608 Ca -0.21 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.43 1bkn h LYS 608 Cb 1.07 0.02 -0.04 0.00 0.08 0.00 0.00 32.23 33.36 1bkn h LYS 608 CO 0.90 0.76 0.17 0.93 -0.57 0.00 0.00 179.45 181.64 1bkn h GLU 609 N 0.22 0.35 -0.02 3.15 3.07 -1.98 -1.95 114.58 117.41 1bkn h GLU 609 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1bkn h GLU 609 Cb 1.04 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.87 1bkn h GLU 609 CO 0.09 0.23 -0.05 -0.09 -1.40 0.00 0.00 179.01 177.79 1bkn h ARG 610 N 0.36 -0.05 -0.83 2.33 9.65 -1.99 0.35 114.38 124.21 1bkn h ARG 610 Ca 0.18 0.00 0.12 0.00 -1.10 0.00 0.00 59.98 59.19 1bkn h ARG 610 Cb 0.13 0.01 -0.08 0.00 -1.39 0.00 0.00 29.97 28.64 1bkn h ARG 610 CO -0.16 -0.03 0.45 -0.09 2.80 0.00 0.00 179.97 182.94 1bkn h ARG 611 N -0.05 0.69 -0.96 0.20 2.43 -1.70 0.89 114.38 115.88 1bkn h ARG 611 Ca 0.00 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1bkn h ARG 611 Cb 0.06 -0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.40 1bkn h ARG 611 CO -0.04 0.45 0.62 1.25 -1.51 0.00 0.00 179.97 180.75 1bkn h LEU 612 N 0.71 1.03 -0.72 3.80 5.85 -0.85 -0.43 115.31 124.70 1bkn h LEU 612 Ca 0.43 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 59.08 1bkn h LEU 612 Cb 0.51 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1bkn h LEU 612 CO -0.30 0.70 0.19 1.23 -0.34 0.00 0.00 178.44 179.92 1bkn h GLY 613 N 1.20 1.23 2.00 3.75 0.00 0.21 -0.50 103.07 110.95 1bkn h GLY 613 Ca 0.39 -0.76 -0.08 0.00 0.00 0.00 0.00 47.33 46.88 1bkn h GLY 613 CO -0.13 0.71 -0.38 0.00 0.00 0.00 0.00 176.54 176.74 1bkn h ALA 614 N 1.10 1.15 0.07 3.60 0.00 -0.06 1.09 119.26 126.21 1bkn h ALA 614 Ca 0.23 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 54.48 1bkn h ALA 614 Cb 0.36 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 1bkn h ALA 614 CO -0.00 0.47 -1.69 0.82 0.00 0.00 0.00 179.25 178.85 1bkn h ILE 615 N 0.00 0.93 -0.03 0.00 2.04 -0.86 -3.39 117.51 116.19 1bkn h ILE 615 Ca -0.00 -2.68 0.00 0.00 1.00 0.00 0.00 64.86 63.18 1bkn h ILE 615 Cb 0.78 2.57 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 1bkn h ILE 615 CO 0.05 0.72 0.00 0.00 0.00 0.00 0.00 178.15 178.92 1bkn n GLY 617 N 0.08 -2.63 0.23 0.00 0.00 0.38 -4.19 105.19 99.06 1bkn n GLY 617 Ca 0.02 -1.42 0.09 0.00 0.00 0.00 0.00 46.02 44.72 1bkn n GLY 617 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bkn h THR 618 N -0.13 0.71 -0.22 2.61 1.03 -1.93 -2.61 112.91 112.37 1bkn h THR 618 Ca -0.02 -0.96 0.06 0.00 -0.01 0.00 0.00 66.41 65.48 1bkn h THR 618 Cb 0.13 1.60 -0.07 0.00 -1.07 0.00 0.00 68.15 68.74 1bkn h THR 618 CO 0.01 0.22 -0.28 0.00 -0.01 0.00 0.00 175.52 175.46 1bkn h ALA 619 N 1.77 -0.22 0.07 0.00 0.00 -1.93 0.28 119.26 119.23 1bkn h ALA 619 Ca -0.00 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1bkn h ALA 619 Cb 0.59 0.56 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1bkn h ALA 619 CO 0.03 -0.72 -0.03 0.35 0.00 0.00 0.00 179.25 178.88 1bkn h PHE 620 N -0.30 -0.08 -1.18 0.00 3.57 -1.71 -3.22 116.94 114.02 1bkn h PHE 620 Ca 0.13 -0.00 0.38 0.00 3.53 0.00 0.00 57.97 62.01 1bkn h PHE 620 Cb 0.50 0.03 -0.13 0.00 2.79 0.00 0.00 35.95 39.13 1bkn h PHE 620 CO -0.41 0.47 0.73 1.25 -2.23 0.00 0.00 178.31 178.12 1bkn h LEU 621 N -0.72 0.34 -0.69 0.59 6.46 -1.18 0.85 115.31 120.97 1bkn h LEU 621 Ca -0.01 0.15 -0.14 0.00 -0.12 0.00 0.00 57.88 57.76 1bkn h LEU 621 Cb 0.59 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.63 1bkn h LEU 621 CO 0.01 -0.15 -0.57 -0.33 -0.62 0.00 0.00 178.44 176.79 1bkn h GLU 622 N 0.18 0.27 -0.02 1.25 5.08 -0.46 -3.04 114.58 117.84 1bkn h GLU 622 Ca 0.77 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.95 1bkn h GLU 622 Cb 2.17 0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.44 1bkn h GLU 622 CO -0.47 0.76 -0.07 1.04 -1.00 0.00 0.00 179.01 179.28 1bkn n GLN 623 N -3.91 1.86 -1.84 2.33 1.13 0.26 -4.95 117.38 112.26 1bkn n GLN 623 Ca -0.02 -1.37 -0.42 0.00 -1.94 0.00 0.00 57.00 53.25 1bkn n GLN 623 Cb 0.59 -1.47 -0.03 0.00 0.11 0.00 0.00 30.24 29.44 1bkn n GLN 623 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1bkn s ALA 624 N -2.09 3.72 -0.36 -1.58 0.00 0.82 -0.53 121.76 121.74 1bkn s ALA 624 Ca 0.30 1.31 -0.02 0.00 0.00 0.00 0.00 51.96 53.55 1bkn s ALA 624 Cb 0.20 -3.72 0.08 0.00 0.00 0.00 0.00 23.12 19.68 1bkn s ALA 624 CO 0.36 -1.14 0.12 -0.51 0.00 0.00 0.00 175.76 174.58 1bkn s LEU 625 N 2.63 4.71 0.26 0.00 1.43 0.15 -4.90 118.68 122.96 1bkn s LEU 625 Ca 0.77 -1.72 -0.30 0.00 -1.03 0.00 0.00 54.13 51.85 1bkn s LEU 625 Cb -0.42 -1.78 -0.10 0.00 0.03 0.00 0.00 46.19 43.91 1bkn s LEU 625 CO 0.34 -0.42 1.44 0.00 0.23 0.00 0.00 176.35 177.93 1bkn s ALA 626 N 1.18 3.62 -0.03 4.21 0.00 -1.26 -2.13 121.76 127.35 1bkn s ALA 626 Ca 0.03 1.34 0.02 0.00 0.00 0.00 0.00 51.96 53.36 1bkn s ALA 626 Cb -0.21 -3.56 0.01 0.00 0.00 0.00 0.00 23.12 19.36 1bkn s ALA 626 CO -0.03 -0.76 -0.09 -1.50 0.00 0.00 0.00 175.76 173.39 1bkn s ILE 627 N -0.15 0.78 -0.26 0.00 2.07 -0.25 -4.98 121.20 118.40 1bkn s ILE 627 Ca 0.58 -0.33 -0.02 0.00 -1.41 0.00 0.00 60.65 59.47 1bkn s ILE 627 Cb -0.42 -0.71 0.08 0.00 0.13 0.00 0.00 42.46 41.54 1bkn s ILE 627 CO 0.45 0.25 0.07 -1.61 -1.91 0.00 0.00 174.94 172.19 1bkn s GLU 628 N 0.36 0.71 0.19 3.50 2.02 -1.26 -2.52 118.70 121.69 1bkn s GLU 628 Ca -0.06 -0.80 0.11 0.00 0.02 0.00 0.00 54.97 54.25 1bkn s GLU 628 Cb -0.10 -2.00 -0.04 0.00 0.10 0.00 0.00 34.13 32.08 1bkn s GLU 628 CO 0.01 -0.85 -0.24 -0.46 0.02 0.00 0.00 175.26 173.74 1bkn s TRP 629 N 1.73 2.29 -0.28 1.61 -0.00 -0.32 -4.99 118.94 118.97 1bkn s TRP 629 Ca 0.05 -0.36 -0.17 0.00 -0.00 0.00 0.00 56.10 55.62 1bkn s TRP 629 Cb -0.17 -1.15 0.12 0.00 -0.00 0.00 0.00 33.47 32.27 1bkn s TRP 629 CO -0.19 0.48 0.85 -1.14 -0.00 0.00 0.00 176.95 176.95 1bkn s GLN 630 N -2.60 0.53 -0.41 5.86 0.74 -1.26 -1.33 119.66 121.19 1bkn s GLN 630 Ca 0.20 0.90 0.05 0.00 0.05 0.00 0.00 55.36 56.55 1bkn s GLN 630 Cb -0.08 0.12 0.18 0.00 1.10 0.00 0.00 33.01 34.33 1bkn s GLN 630 CO 0.09 -0.11 0.38 0.72 -0.55 0.00 0.00 175.29 175.82 1bkn n HIS 631 N 3.86 -1.04 0.00 1.67 8.25 0.34 -5.00 115.22 123.30 1bkn n HIS 631 Ca -0.19 -3.23 0.00 0.00 -0.26 0.00 0.00 57.72 54.05 1bkn n HIS 631 Cb 0.58 0.27 0.00 0.00 1.12 0.00 0.00 29.99 31.96 1bkn n HIS 631 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1bkn n GLY 632 N 2.70 2.30 0.16 -1.41 0.00 -1.26 -2.90 105.19 104.78 1bkn n GLY 632 Ca 0.28 -0.42 0.02 0.00 0.00 0.00 0.00 46.02 45.90 1bkn n GLY 632 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1bkn h ASP 633 N 0.00 0.00 -3.08 1.61 3.32 -1.98 -3.44 116.42 112.86 1bkn h ASP 633 Ca 0.00 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.50 1bkn h ASP 633 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1bkn h ASP 633 CO 0.00 0.51 0.71 -0.76 -1.72 0.00 0.00 179.24 177.98 1bkn s LEU 634 N -7.17 4.27 -0.03 1.55 2.01 -1.14 -3.76 118.68 114.40 1bkn s LEU 634 Ca -0.00 1.81 0.01 0.00 0.01 0.00 0.00 54.13 55.95 1bkn s LEU 634 Cb 0.11 -3.56 0.02 0.00 0.01 0.00 0.00 46.19 42.78 1bkn s LEU 634 CO 0.73 -0.59 -0.02 -0.89 1.01 0.00 0.00 176.35 176.58 1bkn s THR 635 N 2.29 0.33 -0.29 5.49 2.01 0.21 -0.50 115.64 125.17 1bkn s THR 635 Ca 0.56 -0.01 -0.00 0.00 0.31 0.00 0.00 61.69 62.54 1bkn s THR 635 Cb -0.24 -0.39 0.09 0.00 0.01 0.00 0.00 72.50 71.96 1bkn s THR 635 CO 0.21 0.18 0.06 -0.22 -0.69 0.00 0.00 174.62 174.17 1bkn s LEU 636 N 0.93 2.49 0.44 4.42 2.96 -0.44 -0.31 118.68 129.18 1bkn s LEU 636 Ca -0.11 -1.55 0.06 0.00 -0.22 0.00 0.00 54.13 52.31 1bkn s LEU 636 Cb -0.14 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.54 1bkn s LEU 636 CO -0.01 -0.37 0.18 -0.13 -1.32 0.00 0.00 176.35 174.70 1bkn s ARG 637 N 1.52 2.21 0.00 1.98 1.81 -0.65 -1.17 118.95 124.65 1bkn s ARG 637 Ca 0.07 -1.94 0.00 0.00 -1.72 0.00 0.00 55.73 52.14 1bkn s ARG 637 Cb -0.18 -1.93 0.00 0.00 -0.45 0.00 0.00 34.95 32.39 1bkn s ARG 637 CO -0.19 -0.21 0.00 0.41 -0.68 0.00 0.00 175.30 174.64 1bkn n GLY 638 N -1.30 0.54 3.16 -3.53 0.00 -1.05 -0.14 105.19 102.87 1bkn n GLY 638 Ca -0.03 -2.18 -0.11 0.00 0.00 0.00 0.00 46.02 43.70 1bkn n GLY 638 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1bkn s TRP 639 N -0.43 0.86 -0.08 1.61 0.51 -0.27 -1.08 118.94 120.06 1bkn s TRP 639 Ca 0.00 -0.90 -0.03 0.00 -2.12 0.00 0.00 56.10 53.05 1bkn s TRP 639 Cb 0.00 -0.50 0.04 0.00 -0.81 0.00 0.00 33.47 32.20 1bkn s TRP 639 CO 0.00 -0.16 0.17 0.08 -0.51 0.00 0.00 176.95 176.53 1bkn s VAL 640 N -3.53 -0.15 0.34 4.03 1.01 -0.91 -1.26 120.40 119.94 1bkn s VAL 640 Ca 0.11 0.25 -0.27 0.00 0.00 0.00 0.00 61.98 62.06 1bkn s VAL 640 Cb 0.05 -0.28 -0.09 0.00 0.00 0.00 0.00 36.38 36.05 1bkn s VAL 640 CO -0.05 0.10 1.16 0.00 0.00 0.00 0.00 175.10 176.32 1bkn s ALA 641 N 1.68 3.31 -0.28 5.51 0.00 -0.02 -0.67 121.76 131.29 1bkn s ALA 641 Ca -0.04 0.98 -0.33 0.00 0.00 0.00 0.00 51.96 52.57 1bkn s ALA 641 Cb -0.12 -3.37 -0.10 0.00 0.00 0.00 0.00 23.12 19.53 1bkn s ALA 641 CO -0.06 -0.39 2.15 -3.47 0.00 0.00 0.00 175.76 173.99 1bkn n ASP 642 N 0.63 2.60 -0.17 0.00 -0.08 0.31 -4.71 116.55 115.14 1bkn n ASP 642 Ca 0.01 0.45 -0.05 0.00 -1.51 0.00 0.00 54.79 53.70 1bkn n ASP 642 Cb 0.45 -1.35 0.01 0.00 2.34 0.00 0.00 41.12 42.58 1bkn n ASP 642 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1bkn h PRO 643 N 12.52 -0.14 -1.49 -0.67 0.11 -1.91 0.16 132.00 140.58 1bkn h PRO 643 Ca -0.34 0.01 0.43 0.00 0.11 0.00 0.00 66.00 66.21 1bkn h PRO 643 Cb 1.29 0.03 -0.07 0.00 0.11 0.00 0.00 31.00 32.37 1bkn h PRO 643 CO 0.99 -0.10 1.06 -0.97 -0.21 0.00 0.00 178.00 178.77 1bkn h ASN 644 N -0.15 0.05 -0.51 -2.05 -0.00 -1.97 0.26 115.58 111.21 1bkn h ASN 644 Ca 0.23 0.02 -0.35 0.00 -0.00 0.00 0.00 56.30 56.19 1bkn h ASN 644 Cb 0.51 0.01 -0.25 0.00 -0.00 0.00 0.00 38.32 38.59 1bkn h ASN 644 CO -0.60 -0.01 -0.46 1.41 -0.00 0.00 0.00 177.43 177.77 1bkn n HIS 645 N -4.16 1.79 -3.54 0.67 8.25 0.53 -4.98 115.22 113.78 1bkn n HIS 645 Ca 0.34 -2.00 -0.41 0.00 -0.26 0.00 0.00 57.72 55.39 1bkn n HIS 645 Cb 1.53 -0.44 -0.11 0.00 1.12 0.00 0.00 29.99 32.09 1bkn n HIS 645 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1bkn s THR 646 N -4.03 4.90 0.32 1.59 2.01 0.92 -4.83 115.64 116.51 1bkn s THR 646 Ca 0.48 -0.72 -0.12 0.00 0.31 0.00 0.00 61.69 61.63 1bkn s THR 646 Cb 0.41 -3.71 -0.08 0.00 0.01 0.00 0.00 72.50 69.13 1bkn s THR 646 CO -0.00 -0.24 0.69 0.42 -0.69 0.00 0.00 174.62 174.80 1bkn s THR 647 N 1.62 4.78 0.65 -0.82 -4.23 -1.26 -4.90 115.64 111.48 1bkn s THR 647 Ca 0.04 0.71 0.30 0.00 -1.18 0.00 0.00 61.69 61.55 1bkn s THR 647 Cb -0.19 -3.64 0.32 0.00 1.34 0.00 0.00 72.50 70.33 1bkn s THR 647 CO 0.08 -0.24 1.93 -0.65 -0.54 0.00 0.00 174.62 175.21 1bkn h PRO 648 N 2.07 0.00 -0.17 3.99 0.11 -1.97 0.48 132.00 136.51 1bkn h PRO 648 Ca -0.47 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.51 1bkn h PRO 648 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1bkn h PRO 648 CO 0.66 0.00 -0.38 0.00 -0.21 0.00 0.00 178.00 178.07 1bkn h ALA 649 N 1.39 0.27 -0.52 -0.75 0.00 -2.00 -3.18 119.26 114.48 1bkn h ALA 649 Ca 0.04 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.41 1bkn h ALA 649 Cb 0.74 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1bkn h ALA 649 CO -0.00 0.36 -0.05 -0.07 0.00 0.00 0.00 179.25 179.49 1bkn h LEU 650 N 0.21 0.95 0.00 0.00 3.38 -0.48 -2.48 115.31 116.89 1bkn h LEU 650 Ca 0.00 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1bkn h LEU 650 Cb 0.98 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1bkn h LEU 650 CO 0.08 1.05 0.00 0.00 0.09 0.00 0.00 178.44 179.67 1bkn n ALA 651 N -2.47 1.35 0.14 1.53 0.00 -0.36 -0.12 120.51 120.58 1bkn n ALA 651 Ca 0.01 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.46 1bkn n ALA 651 Cb 0.36 -0.92 0.16 0.00 0.00 0.00 0.00 19.45 19.05 1bkn n ALA 651 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1bkn h GLU 652 N 0.00 0.00 -5.67 0.00 4.57 -1.50 -3.41 114.58 108.58 1bkn h GLU 652 Ca 0.00 0.00 -0.61 0.00 -1.18 0.00 0.00 59.36 57.57 1bkn h GLU 652 Cb 0.01 0.00 -0.13 0.00 -0.16 0.00 0.00 28.75 28.47 1bkn h GLU 652 CO 0.00 0.57 0.64 0.42 -1.18 0.00 0.00 179.01 179.46 1bkn s ILE 653 N -3.34 4.23 -0.42 2.32 1.01 0.83 -4.90 121.20 120.92 1bkn s ILE 653 Ca 0.01 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.58 1bkn s ILE 653 Cb 0.11 -4.70 0.17 0.00 0.01 0.00 0.00 42.46 38.05 1bkn s ILE 653 CO 0.74 -1.47 0.38 -1.10 0.00 0.00 0.00 174.94 173.48 1bkn s GLN 654 N 4.33 0.91 -0.16 2.79 -0.21 -1.23 -0.71 119.66 125.38 1bkn s GLN 654 Ca 0.26 -1.98 -0.03 0.00 0.02 0.00 0.00 55.36 53.63 1bkn s GLN 654 Cb -0.15 -1.27 -0.02 0.00 1.00 0.00 0.00 33.01 32.57 1bkn s GLN 654 CO 0.12 -1.38 -0.06 0.71 -2.12 0.00 0.00 175.29 172.57 1bkn s TYR 655 N 0.17 2.96 -0.06 0.91 2.02 -0.83 -5.00 117.35 117.52 1bkn s TYR 655 Ca 0.32 -0.49 -0.01 0.00 -0.37 0.00 0.00 57.07 56.52 1bkn s TYR 655 Cb 0.03 -1.96 0.03 0.00 -0.40 0.00 0.00 41.96 39.65 1bkn s TYR 655 CO -0.18 -0.17 -0.00 0.00 -1.57 0.00 0.00 175.55 173.63 1bkn s TYR 657 N 1.75 2.88 -0.57 0.00 1.51 -0.24 -0.70 117.35 121.98 1bkn s TYR 657 Ca 0.01 -0.61 -0.09 0.00 -1.01 0.00 0.00 57.07 55.38 1bkn s TYR 657 Cb -0.13 -1.91 0.15 0.00 -0.11 0.00 0.00 41.96 39.96 1bkn s TYR 657 CO -0.04 -0.22 0.44 0.08 -1.11 0.00 0.00 175.55 174.70 1bkn s VAL 658 N 0.51 4.34 -0.86 0.71 1.01 0.04 0.34 120.40 126.49 1bkn s VAL 658 Ca -0.07 -2.17 -0.00 0.00 0.00 0.00 0.00 61.98 59.74 1bkn s VAL 658 Cb -0.15 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1bkn s VAL 658 CO 0.04 -0.84 0.72 0.59 0.00 0.00 0.00 175.10 175.60 1bkn n ASN 659 N 4.43 -2.12 0.00 3.32 3.02 0.11 -3.14 115.26 120.87 1bkn n ASN 659 Ca -0.01 -0.44 0.00 0.00 -0.03 0.00 0.00 54.58 54.10 1bkn n ASN 659 Cb 0.41 -3.80 0.00 0.00 -0.61 0.00 0.00 39.78 35.78 1bkn n ASN 659 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bkn n GLY 660 N -1.11 2.43 3.60 7.41 0.00 -1.26 -4.98 105.19 111.28 1bkn n GLY 660 Ca -0.20 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 1bkn n GLY 660 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bkn s ARG 661 N 0.00 3.91 -0.20 1.61 0.52 -1.19 -4.95 118.95 118.66 1bkn s ARG 661 Ca 0.00 0.45 -0.28 0.00 -0.52 0.00 0.00 55.73 55.38 1bkn s ARG 661 Cb 0.00 -3.74 -0.05 0.00 0.52 0.00 0.00 34.95 31.68 1bkn s ARG 661 CO 0.00 -0.66 2.17 1.41 0.02 0.00 0.00 175.30 178.24 1bkn s MET 662 N 2.85 3.24 0.17 3.54 -2.45 -1.26 -0.78 119.30 124.61 1bkn s MET 662 Ca 0.30 2.06 0.03 0.00 -1.25 0.00 0.00 55.69 56.82 1bkn s MET 662 Cb -0.14 -4.34 0.03 0.00 1.25 0.00 0.00 34.83 31.62 1bkn s MET 662 CO 0.13 -1.98 0.21 -1.33 1.05 0.00 0.00 175.02 173.10 1bkn n MET 663 N 8.61 0.95 -2.76 4.11 2.81 0.12 -4.90 117.12 126.06 1bkn n MET 663 Ca 0.28 -0.92 -0.03 0.00 -1.81 0.00 0.00 57.70 55.22 1bkn n MET 663 Cb 0.45 -0.04 0.02 0.00 -0.71 0.00 0.00 33.22 32.93 1bkn n MET 663 CO 0.00 0.00 0.00 0.50 1.51 0.00 0.00 175.97 177.98 1bkn s ARG 664 N -2.74 0.79 -0.16 0.03 3.52 -1.26 -4.46 118.95 114.66 1bkn s ARG 664 Ca 0.16 -0.74 -0.06 0.00 -0.13 0.00 0.00 55.73 54.96 1bkn s ARG 664 Cb -0.01 -0.03 -0.04 0.00 -1.56 0.00 0.00 34.95 33.31 1bkn s ARG 664 CO 0.10 -0.98 0.05 0.34 -0.81 0.00 0.00 175.30 174.00 1bkn s ASP 665 N 0.99 5.54 0.46 -2.12 2.15 -1.26 -4.97 116.67 117.45 1bkn s ASP 665 Ca 0.27 0.09 0.18 0.00 0.43 0.00 0.00 52.55 53.52 1bkn s ASP 665 Cb 0.04 -1.89 1.09 0.00 -0.30 0.00 0.00 42.92 41.86 1bkn s ASP 665 CO -0.07 0.22 1.98 0.08 -0.17 0.00 0.00 175.17 177.21 1bkn h ARG 666 N 6.36 0.00 -0.03 4.34 -0.00 -2.01 -2.10 114.38 120.95 1bkn h ARG 666 Ca -0.39 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.58 1bkn h ARG 666 Cb 1.18 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.15 1bkn h ARG 666 CO 0.67 0.20 0.01 1.25 -0.00 0.00 0.00 179.97 182.09 1bkn h LEU 667 N 0.00 0.05 -0.84 0.08 5.85 -1.99 0.19 115.31 118.65 1bkn h LEU 667 Ca -0.00 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.48 1bkn h LEU 667 Cb 0.39 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 1bkn h LEU 667 CO 0.03 0.28 0.55 0.40 -0.34 0.00 0.00 178.44 179.36 1bkn h ILE 668 N -0.19 1.21 -0.42 4.05 2.04 -1.90 -1.47 117.51 120.82 1bkn h ILE 668 Ca 0.01 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.43 1bkn h ILE 668 Cb 0.26 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 1bkn h ILE 668 CO 0.00 0.20 0.07 0.78 0.00 0.00 0.00 178.15 179.20 1bkn h ASN 669 N 1.12 0.68 -0.77 1.72 4.21 -1.19 -2.28 115.58 119.07 1bkn h ASN 669 Ca 0.31 -0.26 0.02 0.00 1.21 0.00 0.00 56.30 57.58 1bkn h ASN 669 Cb -0.12 -0.18 -0.04 0.00 -1.12 0.00 0.00 38.32 36.86 1bkn h ASN 669 CO -0.07 0.77 0.50 -0.74 -1.29 0.00 0.00 177.43 176.60 1bkn h HIS 670 N 0.56 0.95 0.13 1.19 2.76 -0.19 0.97 115.15 121.51 1bkn h HIS 670 Ca 0.13 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.33 1bkn h HIS 670 Cb 0.38 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 29.00 1bkn h HIS 670 CO 0.03 0.57 -0.20 0.00 -1.30 0.00 0.00 177.93 177.03 1bkn h ALA 671 N 1.30 -0.35 -0.77 5.26 0.00 -1.04 0.30 119.26 123.97 1bkn h ALA 671 Ca 0.29 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1bkn h ALA 671 Cb -0.06 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1bkn h ALA 671 CO -0.08 -0.73 0.50 0.82 0.00 0.00 0.00 179.25 179.76 1bkn h ILE 672 N -0.39 1.20 0.31 0.00 2.04 -1.07 -1.51 117.51 118.10 1bkn h ILE 672 Ca 0.02 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 1bkn h ILE 672 Cb 0.39 0.08 0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1bkn h ILE 672 CO -0.09 0.19 -0.16 -0.09 0.00 0.00 0.00 178.15 178.00 1bkn h ARG 673 N 1.04 -0.42 -1.05 2.37 9.65 -0.34 -2.66 114.38 122.98 1bkn h ARG 673 Ca 0.28 0.03 0.37 0.00 -1.10 0.00 0.00 59.98 59.56 1bkn h ARG 673 Cb -0.11 0.10 -0.15 0.00 -1.39 0.00 0.00 29.97 28.41 1bkn h ARG 673 CO -0.06 -0.28 0.60 0.37 2.80 0.00 0.00 179.97 183.40 1bkn h GLN 674 N -0.43 0.19 -0.56 0.20 4.15 -0.37 0.67 115.11 118.95 1bkn h GLN 674 Ca -0.04 -0.01 0.02 0.00 0.77 0.00 0.00 58.65 59.39 1bkn h GLN 674 Cb 0.34 -0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.95 1bkn h GLN 674 CO 0.06 0.12 0.35 0.00 -1.93 0.00 0.00 178.83 177.44 1bkn h ALA 675 N 1.86 0.72 -0.05 3.38 0.00 -1.08 0.14 119.26 124.23 1bkn h ALA 675 Ca 0.78 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 55.46 1bkn h ALA 675 Cb 1.98 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1bkn h ALA 675 CO -0.62 0.09 -0.84 0.00 0.00 0.00 0.00 179.25 177.87 1bkn h GLU 677 N 0.28 0.00 0.08 0.00 4.81 -0.67 -2.35 114.58 116.73 1bkn h GLU 677 Ca -0.06 0.00 -0.29 0.00 -0.13 0.00 0.00 59.36 58.88 1bkn h GLU 677 Cb 1.45 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.81 1bkn h GLU 677 CO 0.15 0.09 -1.49 -0.44 -0.73 0.00 0.00 179.01 176.59 1bkn h ASP 678 N 0.00 0.25 -0.43 1.04 5.19 -0.81 -3.14 116.42 118.52 1bkn h ASP 678 Ca -0.00 -0.36 -0.03 0.00 -0.62 0.00 0.00 57.03 56.02 1bkn h ASP 678 Cb 0.51 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.92 1bkn h ASP 678 CO 0.01 1.30 0.15 0.50 -3.12 0.00 0.00 179.24 178.08 1bkn h LYS 679 N 0.04 0.66 -3.25 3.56 3.11 -1.09 -3.43 116.57 116.17 1bkn h LYS 679 Ca -0.22 -0.13 -0.16 0.00 -2.81 0.00 0.00 60.65 57.32 1bkn h LYS 679 Cb 1.97 -0.10 -0.25 0.00 -1.00 0.00 0.00 32.23 32.86 1bkn h LYS 679 CO 0.14 0.63 -0.45 -0.48 -2.81 0.00 0.00 179.45 176.48 1bkn s LEU 680 N -9.72 1.21 0.00 5.20 0.05 -0.91 -5.02 118.68 109.49 1bkn s LEU 680 Ca -0.13 0.30 0.00 0.00 0.05 0.00 0.00 54.13 54.35 1bkn s LEU 680 Cb 0.10 0.77 0.00 0.00 -2.05 0.00 0.00 46.19 45.02 1bkn s LEU 680 CO 0.77 -0.15 0.32 0.61 -0.55 0.00 0.00 176.35 177.35 1bkn n GLY 681 N 2.59 0.00 3.55 -3.48 0.00 -1.19 -3.84 105.19 102.82 1bkn n GLY 681 Ca -0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 1bkn n GLY 681 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bkn s ALA 682 N -1.66 1.44 -0.47 4.61 0.00 -1.26 -4.93 121.76 119.50 1bkn s ALA 682 Ca 0.00 -0.41 -0.20 0.00 0.00 0.00 0.00 51.96 51.35 1bkn s ALA 682 Cb 0.00 -4.42 0.04 0.00 0.00 0.00 0.00 23.12 18.74 1bkn s ALA 682 CO 0.00 -4.82 0.64 0.34 0.00 0.00 0.00 175.76 171.92 1bkn s ASP 683 N 10.98 6.28 -0.18 0.00 -1.08 -1.26 -4.13 116.67 127.27 1bkn s ASP 683 Ca 0.90 -0.56 -0.31 0.00 -0.52 0.00 0.00 52.55 52.05 1bkn s ASP 683 Cb -0.14 -2.31 0.14 0.00 -1.46 0.00 0.00 42.92 39.15 1bkn s ASP 683 CO 0.18 -0.84 1.12 0.00 0.52 0.00 0.00 175.17 176.16 1bkn s GLN 684 N 2.79 0.42 -0.02 4.34 0.00 -1.26 -5.13 119.66 120.80 1bkn s GLN 684 Ca 0.20 -0.02 -0.38 0.00 -0.00 0.00 0.00 55.36 55.16 1bkn s GLN 684 Cb -0.16 0.20 -0.17 0.00 0.00 0.00 0.00 33.01 32.88 1bkn s GLN 684 CO 0.16 -0.16 1.42 1.04 0.00 0.00 0.00 175.29 177.75 1bkn n GLN 685 N 0.31 1.03 -3.28 9.60 1.13 -1.26 -4.97 117.38 119.94 1bkn n GLN 685 Ca -0.05 0.37 -0.26 0.00 -1.94 0.00 0.00 57.00 55.13 1bkn n GLN 685 Cb 0.59 -2.01 -0.02 0.00 0.11 0.00 0.00 30.24 28.91 1bkn n GLN 685 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 1bkn s PRO 686 N 1.22 3.54 -0.16 -1.09 0.04 -1.26 -4.70 135.00 132.60 1bkn s PRO 686 Ca 0.89 -0.16 -0.04 0.00 0.04 0.00 0.00 61.00 61.73 1bkn s PRO 686 Cb -1.02 -2.63 -0.03 0.00 0.04 0.00 0.00 34.50 30.86 1bkn s PRO 686 CO 0.53 0.13 -0.01 0.00 0.04 0.00 0.00 177.00 177.69 1bkn s ALA 687 N -2.28 3.10 0.18 8.56 0.00 -1.26 -4.69 121.76 125.38 1bkn s ALA 687 Ca 0.42 -0.80 -0.24 0.00 0.00 0.00 0.00 51.96 51.34 1bkn s ALA 687 Cb -0.10 -1.62 0.05 0.00 0.00 0.00 0.00 23.12 21.45 1bkn s ALA 687 CO 0.35 0.24 0.82 -0.59 0.00 0.00 0.00 175.76 176.57 1bkn s PHE 688 N 0.26 -0.23 -0.38 0.00 -0.12 0.11 -0.84 117.98 116.78 1bkn s PHE 688 Ca -0.01 -0.10 0.04 0.00 -0.05 0.00 0.00 56.93 56.81 1bkn s PHE 688 Cb -0.14 0.64 0.16 0.00 -0.63 0.00 0.00 43.02 43.06 1bkn s PHE 688 CO 0.02 -0.95 0.44 0.08 -0.05 0.00 0.00 175.22 174.76 1bkn s VAL 689 N -3.56 -0.49 0.22 -2.49 1.01 -0.39 -1.97 120.40 112.73 1bkn s VAL 689 Ca 0.10 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.38 1bkn s VAL 689 Cb -0.03 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1bkn s VAL 689 CO 0.01 -0.45 0.09 -0.76 0.00 0.00 0.00 175.10 173.99 1bkn s LEU 690 N 1.52 3.54 -0.25 3.92 1.43 0.08 -1.11 118.68 127.81 1bkn s LEU 690 Ca 0.17 -0.37 -0.00 0.00 -1.03 0.00 0.00 54.13 52.89 1bkn s LEU 690 Cb -0.13 -2.10 0.07 0.00 0.03 0.00 0.00 46.19 44.06 1bkn s LEU 690 CO -0.04 0.02 0.02 -0.31 0.23 0.00 0.00 176.35 176.26 1bkn s TYR 691 N -2.04 1.91 -0.09 0.29 2.02 0.80 -1.08 117.35 119.16 1bkn s TYR 691 Ca 0.31 -1.56 -0.09 0.00 -0.37 0.00 0.00 57.07 55.35 1bkn s TYR 691 Cb -0.08 -1.53 -0.05 0.00 -0.40 0.00 0.00 41.96 39.90 1bkn s TYR 691 CO 0.22 -0.76 0.22 -1.17 -1.57 0.00 0.00 175.55 172.49 1bkn s LEU 692 N 1.56 4.41 -0.05 -1.29 2.96 0.15 -1.64 118.68 124.79 1bkn s LEU 692 Ca 0.01 0.61 0.02 0.00 -0.22 0.00 0.00 54.13 54.54 1bkn s LEU 692 Cb -0.18 -2.22 0.02 0.00 0.50 0.00 0.00 46.19 44.30 1bkn s LEU 692 CO -0.12 0.38 -0.07 -1.61 -1.32 0.00 0.00 176.35 173.61 1bkn s GLU 693 N -1.00 1.08 0.17 1.98 2.02 0.58 0.04 118.70 123.56 1bkn s GLU 693 Ca 0.17 -0.22 -0.13 0.00 0.02 0.00 0.00 54.97 54.82 1bkn s GLU 693 Cb -0.13 -0.99 0.01 0.00 0.10 0.00 0.00 34.13 33.12 1bkn s GLU 693 CO 0.07 -0.01 0.38 0.96 0.02 0.00 0.00 175.26 176.67 1bkn s ILE 694 N 0.69 0.06 0.24 -1.63 -5.25 -1.25 -0.62 121.20 113.44 1bkn s ILE 694 Ca -0.11 -1.10 -0.30 0.00 -0.99 0.00 0.00 60.65 58.16 1bkn s ILE 694 Cb -0.14 -1.67 -0.09 0.00 2.95 0.00 0.00 42.46 43.52 1bkn s ILE 694 CO 0.01 -0.26 1.15 -0.62 -1.79 0.00 0.00 174.94 173.44 1bkn s ASP 695 N -2.91 7.17 -0.18 4.36 2.15 -1.26 -4.79 116.67 121.20 1bkn s ASP 695 Ca 0.12 2.27 -0.08 0.00 0.43 0.00 0.00 52.55 55.29 1bkn s ASP 695 Cb 0.02 -2.62 -0.05 0.00 -0.30 0.00 0.00 42.92 39.97 1bkn s ASP 695 CO -0.03 -0.26 0.55 -2.65 -0.17 0.00 0.00 175.17 172.62 1bkn n PRO 696 N 1.75 0.00 -2.92 4.34 -0.02 -1.26 -4.87 135.00 132.03 1bkn n PRO 696 Ca 0.01 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.41 1bkn n PRO 696 Cb 0.45 -0.33 -0.01 0.00 -0.02 0.00 0.00 33.50 33.58 1bkn n PRO 696 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1bkn s HIS 697 N 1.77 -1.09 0.15 6.00 3.76 -1.26 -5.15 115.29 119.46 1bkn s HIS 697 Ca 0.29 -0.85 -0.31 0.00 -0.15 0.00 0.00 55.06 54.03 1bkn s HIS 697 Cb -0.30 0.07 -0.10 0.00 1.11 0.00 0.00 32.58 33.37 1bkn s HIS 697 CO 0.12 -1.18 1.56 -1.14 -0.85 0.00 0.00 174.74 173.25 1bkn s GLN 698 N 0.80 4.23 0.00 1.40 2.00 -1.26 -5.13 119.66 121.69 1bkn s GLN 698 Ca 0.29 2.32 0.00 0.00 -2.00 0.00 0.00 55.36 55.98 1bkn s GLN 698 Cb 0.00 -3.22 0.00 0.00 0.80 0.00 0.00 33.01 30.59 1bkn s GLN 698 CO -0.08 -0.60 0.00 0.28 -0.50 0.00 0.00 175.29 174.39 1bkn n VAL 699 N 4.07 0.00 -0.09 1.34 0.31 -1.26 -5.18 118.33 117.52 1bkn n VAL 699 Ca 0.14 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.54 1bkn n VAL 699 Cb 0.39 0.00 0.10 0.00 -0.91 0.00 0.00 33.84 33.43 1bkn n VAL 699 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1bkn n HIS 713 N 0.00 0.00 0.07 3.52 8.25 -1.26 -5.11 115.22 120.69 1bkn n HIS 713 Ca 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.60 1bkn n HIS 713 Cb 0.00 -0.07 0.63 0.00 1.12 0.00 0.00 29.99 31.67 1bkn n HIS 713 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 1bkn h GLN 714 N 0.00 0.09 0.00 -0.41 -0.00 -2.05 -3.01 115.11 109.72 1bkn h GLN 714 Ca 0.12 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.76 1bkn h GLN 714 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 27.48 27.94 1bkn h GLN 714 CO -0.00 0.06 0.00 0.43 0.00 0.00 0.00 178.83 179.32 1bkn n SER 715 N -4.45 0.15 0.03 -0.69 7.64 -1.26 -4.75 113.62 110.29 1bkn n SER 715 Ca 0.05 -0.48 -0.12 0.00 1.01 0.00 0.00 58.87 59.33 1bkn n SER 715 Cb 0.38 0.40 -0.09 0.00 -1.01 0.00 0.00 64.21 63.89 1bkn n SER 715 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1bkn h ARG 716 N 0.00 -0.14 -0.60 1.43 2.43 -1.99 -3.21 114.38 112.30 1bkn h ARG 716 Ca 0.00 0.01 0.12 0.00 -0.81 0.00 0.00 59.98 59.30 1bkn h ARG 716 Cb 0.06 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 29.54 1bkn h ARG 716 CO 0.00 0.33 -0.04 1.25 -1.51 0.00 0.00 179.97 180.01 1bkn h LEU 717 N -0.72 -0.34 -0.90 3.80 5.85 -1.85 0.11 115.31 121.26 1bkn h LEU 717 Ca -0.02 0.16 0.25 0.00 0.84 0.00 0.00 57.88 59.11 1bkn h LEU 717 Cb 0.54 0.29 -0.15 0.00 0.37 0.00 0.00 40.66 41.71 1bkn h LEU 717 CO 0.02 -0.13 0.16 0.58 -0.34 0.00 0.00 178.44 178.73 1bkn h VAL 718 N 0.08 0.22 -0.24 1.05 2.07 -1.81 0.66 116.25 118.28 1bkn h VAL 718 Ca 0.31 -0.04 0.03 0.00 0.82 0.00 0.00 66.70 67.82 1bkn h VAL 718 Cb 0.49 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1bkn h VAL 718 CO -0.54 0.02 0.03 -0.74 0.02 0.00 0.00 177.57 176.37 1bkn h HIS 719 N 0.12 0.05 -0.46 1.57 -0.00 -0.79 -1.50 115.15 114.15 1bkn h HIS 719 Ca 0.56 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.88 1bkn h HIS 719 Cb 1.15 0.01 -0.02 0.00 -0.00 0.00 0.00 27.41 28.55 1bkn h HIS 719 CO -0.34 0.01 0.01 -0.44 -0.00 0.00 0.00 177.93 177.16 1bkn h ASP 720 N 0.12 0.72 -0.23 3.26 3.32 0.35 0.11 116.42 124.07 1bkn h ASP 720 Ca 0.11 -0.17 0.01 0.00 0.02 0.00 0.00 57.03 57.01 1bkn h ASP 720 Cb 0.12 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1bkn h ASP 720 CO -0.16 0.78 0.12 0.15 -1.72 0.00 0.00 179.24 178.41 1bkn h PHE 721 N 0.71 0.23 0.33 4.55 3.57 0.03 0.35 116.94 126.71 1bkn h PHE 721 Ca 0.14 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1bkn h PHE 721 Cb 0.43 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.10 1bkn h PHE 721 CO 0.02 0.13 -0.16 0.82 -2.23 0.00 0.00 178.31 176.89 1bkn h ILE 722 N 0.26 0.65 -0.81 1.41 2.04 -1.02 0.21 117.51 120.25 1bkn h ILE 722 Ca 0.09 -0.56 0.19 0.00 1.00 0.00 0.00 64.86 65.58 1bkn h ILE 722 Cb 0.02 0.92 -0.12 0.00 -0.74 0.00 0.00 36.82 36.90 1bkn h ILE 722 CO -0.06 0.10 0.23 0.22 0.00 0.00 0.00 178.15 178.65 1bkn h TYR 723 N -0.78 0.36 0.22 1.37 3.20 -0.66 0.45 116.97 121.14 1bkn h TYR 723 Ca -0.05 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1bkn h TYR 723 Cb 0.51 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.75 1bkn h TYR 723 CO 0.02 -0.11 -0.11 1.96 -1.64 0.00 0.00 178.16 178.29 1bkn h GLN 724 N 0.28 -0.28 -0.01 1.82 7.50 -0.14 -0.45 115.11 123.82 1bkn h GLN 724 Ca 0.48 0.02 0.02 0.00 0.50 0.00 0.00 58.65 59.67 1bkn h GLN 724 Cb 0.87 0.06 -0.06 0.00 0.05 0.00 0.00 27.48 28.41 1bkn h GLN 724 CO -0.55 -0.03 -0.54 0.78 -1.50 0.00 0.00 178.83 176.99 1bkn h GLY 725 N -0.52 -1.13 0.68 3.46 0.00 0.92 -1.39 103.07 105.09 1bkn h GLY 725 Ca -0.03 0.67 -0.03 0.00 0.00 0.00 0.00 47.33 47.94 1bkn h GLY 725 CO 0.05 -0.23 -0.45 -2.08 0.00 0.00 0.00 176.54 173.84 1bkn h VAL 726 N -0.67 0.00 -0.97 4.60 2.07 -1.01 -2.83 116.25 117.44 1bkn h VAL 726 Ca 0.01 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.85 1bkn h VAL 726 Cb 0.72 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.33 1bkn h VAL 726 CO -0.37 0.00 0.42 0.25 0.02 0.00 0.00 177.57 177.90 1bkn h LEU 727 N -1.06 0.25 -0.09 2.57 5.85 -1.01 0.11 115.31 121.93 1bkn h LEU 727 Ca -0.09 0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1bkn h LEU 727 Cb 0.86 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.11 1bkn h LEU 727 CO 0.07 -0.22 0.06 0.77 -0.34 0.00 0.00 178.44 178.78 1bkn h SER 728 N 0.20 0.11 -0.46 1.25 4.64 -1.03 -2.59 113.55 115.68 1bkn h SER 728 Ca 0.70 -0.04 0.05 0.00 -0.47 0.00 0.00 61.79 62.03 1bkn h SER 728 Cb 1.59 -0.03 -0.03 0.00 -0.31 0.00 0.00 62.40 63.63 1bkn h SER 728 CO -0.68 0.11 0.31 0.58 -0.87 0.00 0.00 176.83 176.28 1bkn h VAL 729 N 0.10 0.98 -0.12 0.95 2.07 -0.56 -1.77 116.25 117.90 1bkn h VAL 729 Ca 0.03 -0.14 -0.13 0.00 0.82 0.00 0.00 66.70 67.28 1bkn h VAL 729 Cb 0.02 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1bkn h VAL 729 CO -0.01 0.07 -0.49 -0.07 0.02 0.00 0.00 177.57 177.10 1bkn h LEU 730 N 0.41 0.34 -1.35 2.57 3.38 -1.06 -3.51 115.31 116.09 1bkn h LEU 730 Ca 0.20 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1bkn h LEU 730 Cb 0.27 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1bkn h LEU 730 CO -0.05 0.78 0.00 0.00 0.09 0.00 0.00 178.44 179.26