#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nob h PRO 404 N 0.00 -0.30 0.00 -0.78 0.11 -2.05 -3.45 132.00 125.53 1nob h PRO 404 Ca 0.00 0.02 -0.18 0.00 0.11 0.00 0.00 66.00 65.95 1nob h PRO 404 Cb 0.00 0.07 0.06 0.00 0.11 0.00 0.00 31.00 31.24 1nob h PRO 404 CO 0.00 -0.11 0.14 2.48 -0.21 0.00 0.00 178.00 180.30 1nob n TYR 405 N -5.17 -3.79 -3.85 0.65 4.11 -1.26 -4.66 117.16 103.19 1nob n TYR 405 Ca -0.09 -0.55 -0.30 0.00 -0.00 0.00 0.00 57.90 56.96 1nob n TYR 405 Cb 0.18 -0.39 -0.16 0.00 -0.00 0.00 0.00 39.34 38.97 1nob n TYR 405 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1nob s ASP 406 N -2.93 3.77 0.00 9.48 2.15 -0.45 -4.98 116.67 123.72 1nob s ASP 406 Ca 0.30 -1.30 0.07 0.00 0.43 0.00 0.00 52.55 52.05 1nob s ASP 406 Cb -0.01 -1.01 0.33 0.00 -0.30 0.00 0.00 42.92 41.92 1nob s ASP 406 CO 0.21 -0.31 1.16 -0.81 -0.17 0.00 0.00 175.17 175.25 1nob n PRO 407 N 4.76 0.05 0.00 4.34 -0.04 -1.26 -1.85 135.00 140.99 1nob n PRO 407 Ca -0.07 0.31 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 1nob n PRO 407 Cb 0.44 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.78 1nob n PRO 407 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1nob n LEU 408 N -1.40 1.70 -3.75 1.53 4.77 -1.26 -4.85 117.00 113.75 1nob n LEU 408 Ca 0.02 -0.56 -0.21 0.00 -0.03 0.00 0.00 56.01 55.23 1nob n LEU 408 Cb 0.07 -0.03 -0.18 0.00 -2.33 0.00 0.00 43.42 40.96 1nob n LEU 408 CO 0.06 0.29 -0.37 -0.89 -1.33 0.00 0.00 177.39 175.15 1nob s THR 409 N -2.15 0.21 -0.14 -5.08 2.01 -0.77 -2.92 115.64 106.80 1nob s THR 409 Ca 0.32 0.21 0.01 0.00 0.31 0.00 0.00 61.69 62.53 1nob s THR 409 Cb 0.20 -0.39 -0.01 0.00 0.01 0.00 0.00 72.50 72.32 1nob s THR 409 CO 0.39 0.22 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.62 1nob s LEU 410 N 1.92 2.49 0.00 4.42 1.43 -1.14 -1.87 118.68 125.93 1nob s LEU 410 Ca 0.03 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.69 1nob s LEU 410 Cb -0.12 -1.55 0.00 0.00 0.03 0.00 0.00 46.19 44.54 1nob s LEU 410 CO -0.04 0.12 0.00 -2.67 0.23 0.00 0.00 176.35 173.99 1nob n TRP 411 N 3.82 -0.27 0.65 0.29 2.14 -0.20 -2.50 117.44 121.37 1nob n TRP 411 Ca -0.19 0.00 0.08 0.00 2.07 0.00 0.00 57.50 59.46 1nob n TRP 411 Cb 0.52 0.00 0.04 0.00 -0.81 0.00 0.00 31.31 31.06 1nob n TRP 411 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 1nob n THR 412 N 0.00 0.00 0.00 -1.67 -2.24 -0.99 -2.60 114.28 106.78 1nob n THR 412 Ca 0.00 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1nob n THR 412 Cb 0.00 1.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 1nob n THR 412 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1nob n THR 413 N 0.48 0.00 0.14 4.28 -2.24 -1.26 -4.39 114.28 111.29 1nob n THR 413 Ca 0.08 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.00 1nob n THR 413 Cb 0.36 0.00 0.67 0.00 -2.10 0.00 0.00 70.33 69.26 1nob n THR 413 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1nob h PRO 414 N 0.00 0.00 -2.13 -0.78 0.13 -1.96 -3.35 132.00 123.90 1nob h PRO 414 Ca 0.00 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.56 1nob h PRO 414 Cb 0.00 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 30.75 1nob h PRO 414 CO 0.00 0.00 -1.04 -3.47 -0.23 0.00 0.00 178.00 173.26 1nob n ASP 415 N -4.44 -0.21 -4.77 1.44 2.03 -1.26 -5.01 116.55 104.32 1nob n ASP 415 Ca 0.03 -2.55 -0.39 0.00 0.52 0.00 0.00 54.79 52.40 1nob n ASP 415 Cb 0.33 -0.54 -0.04 0.00 -0.72 0.00 0.00 41.12 40.14 1nob n ASP 415 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1nob s PRO 416 N -0.56 4.45 0.29 -0.67 0.04 -1.26 -5.06 135.00 132.23 1nob s PRO 416 Ca 0.34 1.70 -0.05 0.00 0.04 0.00 0.00 61.00 63.03 1nob s PRO 416 Cb 0.11 -2.94 0.07 0.00 0.04 0.00 0.00 34.50 31.78 1nob s PRO 416 CO -0.15 0.07 0.23 -2.30 0.04 0.00 0.00 177.00 174.89 1nob n PRO 417 N 0.71 -1.80 -1.71 0.56 -0.02 -1.26 -4.81 135.00 126.66 1nob n PRO 417 Ca 0.01 -0.37 -0.41 0.00 -2.02 0.00 0.00 63.50 60.71 1nob n PRO 417 Cb 0.47 -0.38 0.01 0.00 -0.02 0.00 0.00 33.50 33.58 1nob n PRO 417 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1nob n PRO 418 N -2.41 1.96 -0.04 0.52 -0.02 -1.26 -4.64 135.00 129.12 1nob n PRO 418 Ca 0.03 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1nob n PRO 418 Cb 0.13 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 1nob n PRO 418 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1nob n ASN 419 N 0.19 0.00 -3.92 2.55 2.04 0.13 -4.94 115.26 111.31 1nob n ASN 419 Ca 0.06 -1.06 -0.16 0.00 -0.44 0.00 0.00 54.58 52.99 1nob n ASN 419 Cb 0.40 -0.01 -0.15 0.00 -2.53 0.00 0.00 39.78 37.49 1nob n ASN 419 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1nob n SER 421 N 3.25 6.30 0.00 0.00 7.64 -1.26 -0.16 113.62 129.40 1nob n SER 421 Ca -0.16 -3.75 0.00 0.00 1.01 0.00 0.00 58.87 55.97 1nob n SER 421 Cb 0.56 -0.86 0.00 0.00 -1.01 0.00 0.00 64.21 62.90 1nob n SER 421 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1nob n LEU 422 N -0.36 0.00 0.00 -3.43 4.77 -1.26 -4.50 117.00 112.22 1nob n LEU 422 Ca 0.45 0.75 0.00 0.00 -0.03 0.00 0.00 56.01 57.17 1nob n LEU 422 Cb 0.37 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1nob n LEU 422 CO 0.44 -0.25 0.00 -0.38 -1.33 0.00 0.00 177.39 175.87 1nob n ILE 423 N -1.59 0.00 -3.24 -0.08 5.41 -1.26 -5.02 119.36 113.58 1nob n ILE 423 Ca 0.00 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.56 1nob n ILE 423 Cb 0.00 -0.27 0.01 0.00 -0.71 0.00 0.00 39.64 38.67 1nob n ILE 423 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1nob s GLN 424 N 0.00 2.60 -0.02 0.38 -2.07 -1.26 -5.03 119.66 114.26 1nob s GLN 424 Ca 0.00 -1.46 -0.38 0.00 -1.82 0.00 0.00 55.36 51.70 1nob s GLN 424 Cb 0.00 -2.58 -0.19 0.00 -1.09 0.00 0.00 33.01 29.15 1nob s GLN 424 CO 0.00 -0.38 1.03 -1.91 -1.32 0.00 0.00 175.29 172.71 1nob n GLU 425 N -1.83 0.00 -1.63 9.60 4.07 -1.26 -3.31 120.64 126.29 1nob n GLU 425 Ca 0.07 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.10 1nob n GLU 425 Cb 0.61 -1.41 0.01 0.00 -0.06 0.00 0.00 31.44 30.58 1nob n GLU 425 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1nob n LEU 426 N 1.52 -0.47 -0.20 4.31 4.77 -1.24 -4.87 117.00 120.82 1nob n LEU 426 Ca 0.19 -0.05 0.02 0.00 -0.03 0.00 0.00 56.01 56.15 1nob n LEU 426 Cb 0.07 -0.31 0.03 0.00 -2.33 0.00 0.00 43.42 40.87 1nob n LEU 426 CO 0.59 0.01 0.38 -0.90 -1.33 0.00 0.00 177.39 176.13 1nob n ASP 427 N 0.68 1.61 -4.04 -1.43 5.75 0.78 -4.57 116.55 115.32 1nob n ASP 427 Ca -0.02 -1.38 -0.09 0.00 -0.01 0.00 0.00 54.79 53.29 1nob n ASP 427 Cb 0.14 -0.02 -0.09 0.00 -1.03 0.00 0.00 41.12 40.12 1nob n ASP 427 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1nob s ALA 428 N -0.52 0.39 -0.36 2.12 0.00 -1.17 0.11 121.76 122.33 1nob s ALA 428 Ca 0.06 -1.14 0.04 0.00 0.00 0.00 0.00 51.96 50.92 1nob s ALA 428 Cb 0.04 0.80 0.10 0.00 0.00 0.00 0.00 23.12 24.06 1nob s ALA 428 CO 0.06 -0.55 0.08 0.15 0.00 0.00 0.00 175.76 175.50 1nob s LYS 429 N -3.99 1.53 -0.53 0.00 1.02 -0.27 0.20 119.74 117.71 1nob s LYS 429 Ca 0.19 -1.96 -0.24 0.00 0.02 0.00 0.00 55.97 53.98 1nob s LYS 429 Cb 0.06 -3.19 0.04 0.00 -0.52 0.00 0.00 37.83 34.21 1nob s LYS 429 CO -0.01 -0.96 0.90 -1.17 -0.92 0.00 0.00 175.35 173.18 1nob s LEU 430 N 0.76 4.18 -0.39 3.17 2.96 -1.26 -3.44 118.68 124.66 1nob s LEU 430 Ca 0.12 -0.32 -0.11 0.00 -0.22 0.00 0.00 54.13 53.60 1nob s LEU 430 Cb -0.20 -2.85 0.04 0.00 0.50 0.00 0.00 46.19 43.67 1nob s LEU 430 CO -0.07 -1.14 0.23 -0.89 -1.32 0.00 0.00 176.35 173.15 1nob s THR 431 N 3.74 4.61 -0.01 3.68 2.01 -0.87 -4.88 115.64 123.92 1nob s THR 431 Ca 0.30 -0.92 0.07 0.00 0.31 0.00 0.00 61.69 61.45 1nob s THR 431 Cb -0.13 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.75 1nob s THR 431 CO 0.20 -0.29 -0.24 -0.22 -0.69 0.00 0.00 174.62 173.38 1nob s LEU 432 N 1.55 2.05 0.01 4.42 2.96 -1.26 -2.54 118.68 125.86 1nob s LEU 432 Ca 0.02 -0.44 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 1nob s LEU 432 Cb -0.20 -1.21 -0.01 0.00 0.50 0.00 0.00 46.19 45.27 1nob s LEU 432 CO 0.06 0.28 -0.03 0.00 -1.32 0.00 0.00 176.35 175.35 1nob s LEU 434 N -0.37 0.75 -0.09 0.00 1.43 -1.04 -1.91 118.68 117.44 1nob s LEU 434 Ca -0.02 0.04 0.03 0.00 -1.03 0.00 0.00 54.13 53.15 1nob s LEU 434 Cb -0.03 -0.13 0.00 0.00 0.03 0.00 0.00 46.19 46.07 1nob s LEU 434 CO -0.00 -0.17 -0.21 -0.89 0.23 0.00 0.00 176.35 175.31 1nob s THR 435 N 1.48 1.80 -0.39 5.49 2.01 0.89 -2.87 115.64 124.05 1nob s THR 435 Ca -0.04 -0.87 -0.18 0.00 0.31 0.00 0.00 61.69 60.92 1nob s THR 435 Cb -0.13 -1.58 0.01 0.00 0.01 0.00 0.00 72.50 70.81 1nob s THR 435 CO -0.03 0.50 0.50 -0.75 -0.69 0.00 0.00 174.62 174.16 1nob s LYS 436 N 0.47 3.39 -0.85 4.92 2.20 -1.15 -0.04 119.74 128.68 1nob s LYS 436 Ca -0.17 -0.41 0.01 0.00 -0.36 0.00 0.00 55.97 55.04 1nob s LYS 436 Cb -0.17 -3.89 0.26 0.00 -1.51 0.00 0.00 37.83 32.52 1nob s LYS 436 CO 0.07 -0.77 0.99 -1.71 -0.36 0.00 0.00 175.35 173.56 1nob n ASN 437 N 5.77 4.72 0.00 1.43 5.15 -0.35 -5.01 115.26 126.98 1nob n ASN 437 Ca -0.05 -3.35 0.00 0.00 -0.60 0.00 0.00 54.58 50.58 1nob n ASN 437 Cb 0.48 -0.97 0.00 0.00 -0.53 0.00 0.00 39.78 38.77 1nob n ASN 437 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1nob n GLY 438 N 1.41 2.25 0.66 8.20 0.00 -1.26 -3.38 105.19 113.07 1nob n GLY 438 Ca 0.26 -0.34 0.06 0.00 0.00 0.00 0.00 46.02 46.01 1nob n GLY 438 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1nob n SER 439 N 9.35 1.93 -3.83 1.61 2.88 -1.26 -4.84 113.62 119.45 1nob n SER 439 Ca 0.00 -1.97 -0.13 0.00 -1.33 0.00 0.00 58.87 55.44 1nob n SER 439 Cb 0.00 -0.23 -0.14 0.00 -0.75 0.00 0.00 64.21 63.09 1nob n SER 439 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1nob s ILE 440 N -1.54 -0.01 -0.10 2.46 1.01 -1.22 -1.62 121.20 120.18 1nob s ILE 440 Ca 0.25 0.05 -0.05 0.00 0.00 0.00 0.00 60.65 60.90 1nob s ILE 440 Cb 0.13 -0.10 -0.04 0.00 0.01 0.00 0.00 42.46 42.46 1nob s ILE 440 CO 0.18 0.02 0.12 -0.69 0.00 0.00 0.00 174.94 174.56 1nob s VAL 441 N 0.28 5.25 -0.25 2.92 1.01 0.03 -1.21 120.40 128.44 1nob s VAL 441 Ca -0.02 0.06 -0.04 0.00 0.00 0.00 0.00 61.98 61.98 1nob s VAL 441 Cb -0.03 -3.30 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1nob s VAL 441 CO -0.01 0.58 -0.01 0.20 0.00 0.00 0.00 175.10 175.86 1nob s ASN 442 N -1.12 4.57 0.20 3.32 0.01 0.94 -2.73 114.94 120.12 1nob s ASN 442 Ca 0.16 -0.55 0.08 0.00 -0.71 0.00 0.00 52.86 51.85 1nob s ASN 442 Cb -0.12 -1.77 -0.05 0.00 0.41 0.00 0.00 41.25 39.72 1nob s ASN 442 CO 0.06 -0.08 -0.16 -0.83 -1.51 0.00 0.00 177.10 174.57 1nob s GLY 443 N 1.47 1.46 -0.03 0.66 0.00 -0.04 -0.08 107.32 110.75 1nob s GLY 443 Ca 0.04 -1.62 -0.01 0.00 0.00 0.00 0.00 44.72 43.13 1nob s GLY 443 CO -0.02 -1.70 0.06 -0.42 0.00 0.00 0.00 173.10 171.03 1nob s ILE 444 N -2.60 -0.05 0.34 0.90 1.01 -0.80 -1.58 121.20 118.42 1nob s ILE 444 Ca 0.21 0.19 0.06 0.00 0.00 0.00 0.00 60.65 61.10 1nob s ILE 444 Cb -0.03 -0.12 -0.07 0.00 0.01 0.00 0.00 42.46 42.25 1nob s ILE 444 CO 0.08 0.08 0.01 0.54 0.00 0.00 0.00 174.94 175.64 1nob s VAL 445 N 1.00 1.57 -0.29 2.92 0.11 0.27 -1.94 120.40 124.04 1nob s VAL 445 Ca -0.08 -2.04 -0.16 0.00 -2.93 0.00 0.00 61.98 56.77 1nob s VAL 445 Cb -0.11 -2.77 0.17 0.00 -1.53 0.00 0.00 36.38 32.13 1nob s VAL 445 CO -0.04 -0.07 1.07 -0.55 -3.33 0.00 0.00 175.10 172.18 1nob s SER 446 N -3.55 -0.36 -0.05 3.54 0.15 -1.05 -0.71 113.70 111.66 1nob s SER 446 Ca 0.34 0.59 0.01 0.00 0.70 0.00 0.00 55.95 57.59 1nob s SER 446 Cb 0.08 1.13 0.02 0.00 -1.71 0.00 0.00 66.02 65.54 1nob s SER 446 CO 0.16 -0.09 -0.04 -0.22 1.20 0.00 0.00 173.24 174.24 1nob s LEU 447 N 1.20 1.20 -0.06 3.45 2.96 -1.26 -2.04 118.68 124.13 1nob s LEU 447 Ca -0.08 -0.13 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1nob s LEU 447 Cb -0.03 -0.46 0.02 0.00 0.50 0.00 0.00 46.19 46.22 1nob s LEU 447 CO -0.13 -0.08 -0.07 0.54 -1.32 0.00 0.00 176.35 175.29 1nob s VAL 448 N 1.12 0.77 0.16 1.68 0.11 -1.22 -2.76 120.40 120.26 1nob s VAL 448 Ca -0.08 -0.26 -0.27 0.00 -2.93 0.00 0.00 61.98 58.44 1nob s VAL 448 Cb -0.14 -0.76 -0.08 0.00 -1.53 0.00 0.00 36.38 33.88 1nob s VAL 448 CO -0.01 0.28 0.84 -0.83 -3.33 0.00 0.00 175.10 172.05 1nob s GLY 449 N 0.88 2.96 0.00 6.54 0.00 -0.84 -1.11 107.32 115.75 1nob s GLY 449 Ca -0.11 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1nob s GLY 449 CO 0.01 1.05 0.00 3.33 0.00 0.00 0.00 173.10 177.49 1nob n VAL 450 N 1.87 0.00 -1.86 1.40 0.24 0.30 -4.79 118.33 115.49 1nob n VAL 450 Ca -0.03 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 62.05 1nob n VAL 450 Cb 0.49 0.00 -0.07 0.00 -1.47 0.00 0.00 33.84 32.78 1nob n VAL 450 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1nob s LYS 451 N 2.12 2.04 0.00 7.34 2.20 -1.26 -4.67 119.74 127.51 1nob s LYS 451 Ca 0.00 -0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.23 1nob s LYS 451 Cb 0.00 -5.03 0.00 0.00 -1.51 0.00 0.00 37.83 31.29 1nob s LYS 451 CO 0.00 -4.22 0.00 0.41 -0.36 0.00 0.00 175.35 171.18 1nob n GLY 452 N 6.42 -0.52 0.00 5.54 0.00 -1.26 -4.33 105.19 111.04 1nob n GLY 452 Ca 0.43 -0.97 0.09 0.00 0.00 0.00 0.00 46.02 45.57 1nob n GLY 452 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nob n ASN 453 N 0.00 0.00 0.00 1.61 5.15 -1.26 -2.61 115.26 118.15 1nob n ASN 453 Ca 0.00 -0.46 0.10 0.00 -0.60 0.00 0.00 54.58 53.62 1nob n ASN 453 Cb 0.00 -0.05 0.60 0.00 -0.53 0.00 0.00 39.78 39.79 1nob n ASN 453 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1nob n LEU 454 N -1.05 0.00 -0.03 1.20 4.77 -1.26 -2.47 117.00 118.16 1nob n LEU 454 Ca 0.13 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 56.00 1nob n LEU 454 Cb 0.08 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.02 1nob n LEU 454 CO 0.11 0.00 -0.70 0.18 -1.33 0.00 0.00 177.39 175.65 1nob n LEU 455 N -0.88 1.10 -3.93 2.23 4.77 -1.07 0.85 117.00 120.07 1nob n LEU 455 Ca 0.15 0.30 -0.31 0.00 -0.03 0.00 0.00 56.01 56.12 1nob n LEU 455 Cb 0.07 -0.03 -0.15 0.00 -2.33 0.00 0.00 43.42 40.98 1nob n LEU 455 CO 0.11 0.50 -0.34 0.20 -1.33 0.00 0.00 177.39 176.54 1nob s ASN 456 N -6.17 4.49 0.10 -1.43 -0.87 -1.03 0.71 114.94 110.74 1nob s ASN 456 Ca -0.09 -1.93 -0.31 0.00 -1.57 0.00 0.00 52.86 48.96 1nob s ASN 456 Cb 0.07 -1.38 -0.08 0.00 -0.02 0.00 0.00 41.25 39.85 1nob s ASN 456 CO 0.81 -0.38 1.42 -0.63 -2.57 0.00 0.00 177.10 175.75 1nob s ILE 457 N 1.15 3.31 0.59 0.60 1.01 -1.09 -4.76 121.20 122.01 1nob s ILE 457 Ca 0.09 0.90 -0.09 0.00 0.00 0.00 0.00 60.65 61.55 1nob s ILE 457 Cb -0.18 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.68 1nob s ILE 457 CO -0.13 0.05 0.96 -1.10 0.00 0.00 0.00 174.94 174.73 1nob s GLN 458 N 1.42 3.46 0.15 2.79 -1.52 -1.26 -1.15 119.66 123.55 1nob s GLN 458 Ca 0.65 0.52 0.15 0.00 -1.95 0.00 0.00 55.36 54.74 1nob s GLN 458 Cb -0.37 -2.16 0.71 0.00 -0.22 0.00 0.00 33.01 30.97 1nob s GLN 458 CO 0.30 -0.53 1.47 -1.13 -0.25 0.00 0.00 175.29 175.15 1nob n SER 459 N -2.64 0.32 -0.01 5.90 3.41 -1.26 -1.69 113.62 117.65 1nob n SER 459 Ca 0.05 0.61 0.08 0.00 -0.26 0.00 0.00 58.87 59.34 1nob n SER 459 Cb 0.55 -0.66 -0.12 0.00 -0.26 0.00 0.00 64.21 63.72 1nob n SER 459 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nob n THR 460 N -1.88 0.00 -2.15 6.66 -2.24 -1.26 -4.88 114.28 108.52 1nob n THR 460 Ca 0.01 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.06 1nob n THR 460 Cb 0.11 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 68.67 1nob n THR 460 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1nob s THR 461 N -2.99 3.62 -0.17 4.28 2.01 -0.68 -4.77 115.64 116.94 1nob s THR 461 Ca -0.03 0.59 0.05 0.00 0.31 0.00 0.00 61.69 62.62 1nob s THR 461 Cb 0.11 -3.94 -0.14 0.00 0.01 0.00 0.00 72.50 68.55 1nob s THR 461 CO 0.68 -0.66 -0.09 0.41 -0.69 0.00 0.00 174.62 174.27 1nob n THR 462 N 7.23 1.03 -4.36 -0.82 -1.04 -1.26 -1.34 114.28 113.72 1nob n THR 462 Ca 0.20 -0.47 -0.21 0.00 -2.04 0.00 0.00 64.05 61.53 1nob n THR 462 Cb 0.48 -0.97 -0.13 0.00 -1.82 0.00 0.00 70.33 67.89 1nob n THR 462 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1nob s THR 463 N -2.36 1.19 -0.01 12.58 2.01 -1.26 -0.12 115.64 127.67 1nob s THR 463 Ca -0.19 -1.07 0.01 0.00 0.31 0.00 0.00 61.69 60.75 1nob s THR 463 Cb 0.06 -1.08 0.00 0.00 0.01 0.00 0.00 72.50 71.49 1nob s THR 463 CO 0.48 -0.00 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.68 1nob s VAL 464 N -0.90 0.37 0.00 3.82 1.01 0.15 -4.99 120.40 119.86 1nob s VAL 464 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1nob s VAL 464 Cb -0.08 -0.35 0.00 0.00 0.00 0.00 0.00 36.38 35.95 1nob s VAL 464 CO 0.02 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1nob n GLY 465 N 3.28 2.02 3.39 4.51 0.00 -1.26 -0.75 105.19 116.39 1nob n GLY 465 Ca -0.17 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 1nob n GLY 465 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nob s VAL 466 N -2.92 0.02 0.37 1.61 -7.23 -0.58 -5.01 120.40 106.67 1nob s VAL 466 Ca 0.00 -0.20 0.04 0.00 -1.81 0.00 0.00 61.98 60.01 1nob s VAL 466 Cb 0.00 -1.03 -0.05 0.00 0.56 0.00 0.00 36.38 35.85 1nob s VAL 466 CO 0.00 -0.11 0.06 -1.00 -0.31 0.00 0.00 175.10 173.74 1nob s HIS 467 N -3.30 2.00 -0.20 2.82 3.76 -1.26 -1.70 115.29 117.41 1nob s HIS 467 Ca -0.01 -0.98 -0.07 0.00 -0.15 0.00 0.00 55.06 53.85 1nob s HIS 467 Cb -0.00 -1.36 0.09 0.00 1.11 0.00 0.00 32.58 32.42 1nob s HIS 467 CO -0.09 0.03 0.43 -0.51 -0.85 0.00 0.00 174.74 173.75 1nob s LEU 468 N -3.57 -0.60 -0.08 0.89 1.43 -0.71 -1.58 118.68 114.46 1nob s LEU 468 Ca 0.31 1.01 0.01 0.00 -1.03 0.00 0.00 54.13 54.43 1nob s LEU 468 Cb 0.07 1.39 -0.03 0.00 0.03 0.00 0.00 46.19 47.66 1nob s LEU 468 CO 0.15 -0.23 -0.10 -0.69 0.23 0.00 0.00 176.35 175.71 1nob s VAL 469 N 2.46 3.42 0.28 -1.59 1.01 -1.26 -2.23 120.40 122.49 1nob s VAL 469 Ca -0.03 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.44 1nob s VAL 469 Cb -0.11 -2.40 -0.06 0.00 0.00 0.00 0.00 36.38 33.81 1nob s VAL 469 CO -0.13 0.58 -0.05 -0.36 0.00 0.00 0.00 175.10 175.13 1nob s PHE 470 N -0.52 1.96 0.61 5.22 0.40 -0.17 0.92 117.98 126.40 1nob s PHE 470 Ca 0.07 -0.71 0.04 0.00 -0.60 0.00 0.00 56.93 55.74 1nob s PHE 470 Cb -0.12 -1.13 0.09 0.00 0.51 0.00 0.00 43.02 42.37 1nob s PHE 470 CO 0.02 0.27 0.84 0.16 0.70 0.00 0.00 175.22 177.21 1nob s ASP 471 N -3.45 4.90 0.00 1.36 1.47 -0.33 -2.33 116.67 118.29 1nob s ASP 471 Ca 0.30 -0.50 0.00 0.00 1.18 0.00 0.00 52.55 53.53 1nob s ASP 471 Cb 0.04 -0.10 0.00 0.00 -0.34 0.00 0.00 42.92 42.52 1nob s ASP 471 CO 0.12 -1.45 0.00 -1.84 0.68 0.00 0.00 175.17 172.69 1nob n GLU 472 N -2.44 0.00 0.00 2.11 0.28 -1.24 0.74 120.64 120.10 1nob n GLU 472 Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 1nob n GLU 472 Cb 0.61 -1.00 0.00 0.00 1.43 0.00 0.00 31.44 32.48 1nob n GLU 472 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1nob n GLN 473 N -0.42 -0.56 -0.99 3.44 1.13 -1.26 -4.93 117.38 113.78 1nob n GLN 473 Ca 0.00 -0.34 0.00 0.00 -1.94 0.00 0.00 57.00 54.72 1nob n GLN 473 Cb 0.00 -0.84 0.00 0.00 0.11 0.00 0.00 30.24 29.51 1nob n GLN 473 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1nob n GLY 474 N 0.02 0.46 3.75 1.08 0.00 0.23 -2.44 105.19 108.28 1nob n GLY 474 Ca 0.00 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.22 1nob n GLY 474 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nob s ARG 475 N -0.73 4.62 0.52 1.61 0.52 -1.26 -4.68 118.95 119.55 1nob s ARG 475 Ca 0.00 1.24 -0.22 0.00 -0.52 0.00 0.00 55.73 56.23 1nob s ARG 475 Cb 0.00 -3.32 -0.05 0.00 0.52 0.00 0.00 34.95 32.09 1nob s ARG 475 CO 0.00 0.39 1.28 -1.17 0.02 0.00 0.00 175.30 175.82 1nob s LEU 476 N -0.54 3.88 -0.25 2.53 2.96 -1.26 -1.19 118.68 124.82 1nob s LEU 476 Ca 0.40 2.58 -0.03 0.00 -0.22 0.00 0.00 54.13 56.86 1nob s LEU 476 Cb -0.23 -4.30 0.01 0.00 0.50 0.00 0.00 46.19 42.18 1nob s LEU 476 CO 0.27 -1.37 -0.02 -0.63 -1.32 0.00 0.00 176.35 173.28 1nob s ILE 477 N -1.41 3.27 -1.08 6.68 1.01 0.26 -4.83 121.20 125.10 1nob s ILE 477 Ca 0.70 -0.81 -0.14 0.00 0.00 0.00 0.00 60.65 60.39 1nob s ILE 477 Cb -0.36 -2.62 0.18 0.00 0.01 0.00 0.00 42.46 39.67 1nob s ILE 477 CO 0.42 0.22 1.24 0.42 0.00 0.00 0.00 174.94 177.25 1nob s THR 478 N 1.41 5.15 0.00 2.92 -4.23 -1.26 -4.41 115.64 115.21 1nob s THR 478 Ca 0.02 -2.45 0.00 0.00 -1.18 0.00 0.00 61.69 58.08 1nob s THR 478 Cb -0.16 -4.79 0.00 0.00 1.34 0.00 0.00 72.50 68.89 1nob s THR 478 CO -0.02 -1.47 0.00 -1.54 -0.54 0.00 0.00 174.62 171.04 1nob n SER 479 N 5.29 0.00 -1.82 3.99 3.41 -1.26 -4.62 113.62 118.62 1nob n SER 479 Ca 0.29 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.66 1nob n SER 479 Cb 0.44 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 1nob n SER 479 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1nob n THR 480 N -0.20 0.00 0.89 6.66 -1.04 -1.26 0.13 114.28 119.45 1nob n THR 480 Ca 0.00 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.02 1nob n THR 480 Cb 0.00 -0.05 0.07 0.00 -1.82 0.00 0.00 70.33 68.53 1nob n THR 480 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1nob n PRO 481 N 0.84 1.60 -1.57 -2.82 -0.04 -1.26 -5.08 135.00 126.67 1nob n PRO 481 Ca 0.09 -0.55 -0.41 0.00 -0.04 0.00 0.00 63.50 62.60 1nob n PRO 481 Cb 0.02 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.94 1nob n PRO 481 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1nob n THR 482 N 0.06 0.17 -0.05 0.52 -1.04 0.12 -4.18 114.28 109.88 1nob n THR 482 Ca 0.05 -0.57 -0.10 0.00 -2.04 0.00 0.00 64.05 61.39 1nob n THR 482 Cb 0.34 -2.58 -0.04 0.00 -1.82 0.00 0.00 70.33 66.24 1nob n THR 482 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nob h ALA 483 N 16.56 -0.38 -2.83 2.41 0.00 -1.61 -3.40 119.26 130.02 1nob h ALA 483 Ca -0.34 0.04 -0.56 0.00 0.00 0.00 0.00 54.91 54.06 1nob h ALA 483 Cb 1.26 0.71 0.13 0.00 0.00 0.00 0.00 17.79 19.89 1nob h ALA 483 CO 1.04 -0.82 0.54 1.28 0.00 0.00 0.00 179.25 181.30 1nob n LEU 484 N -5.42 4.50 -4.89 0.00 4.77 -1.26 -4.19 117.00 110.51 1nob n LEU 484 Ca -0.02 1.08 -0.29 0.00 -0.03 0.00 0.00 56.01 56.75 1nob n LEU 484 Cb 0.34 -1.53 -0.01 0.00 -2.33 0.00 0.00 43.42 39.89 1nob n LEU 484 CO 0.11 -0.57 0.47 0.68 -1.33 0.00 0.00 177.39 176.75 1nob s VAL 485 N -1.22 4.85 0.33 4.08 -7.23 -1.02 -4.54 120.40 115.65 1nob s VAL 485 Ca 0.63 0.39 0.11 0.00 -1.81 0.00 0.00 61.98 61.31 1nob s VAL 485 Cb -0.48 -3.83 0.32 0.00 0.56 0.00 0.00 36.38 32.95 1nob s VAL 485 CO 0.56 -0.79 1.70 -0.65 -0.31 0.00 0.00 175.10 175.61 1nob h PRO 486 N 0.46 0.43 -0.00 4.82 0.11 -1.94 0.31 132.00 136.20 1nob h PRO 486 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1nob h PRO 486 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1nob h PRO 486 CO 0.62 0.29 -0.10 0.00 -0.21 0.00 0.00 178.00 178.60 1nob n GLN 487 N -4.98 0.48 -1.57 1.05 0.00 -1.26 -4.91 117.38 106.20 1nob n GLN 487 Ca 0.29 -0.12 -0.37 0.00 0.00 0.00 0.00 57.00 56.80 1nob n GLN 487 Cb 0.84 -1.50 0.06 0.00 0.00 0.00 0.00 30.24 29.65 1nob n GLN 487 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1nob n ALA 488 N -1.16 0.10 -2.67 2.61 0.00 0.11 -4.94 120.51 114.56 1nob n ALA 488 Ca 0.13 -0.05 -0.39 0.00 0.00 0.00 0.00 53.44 53.13 1nob n ALA 488 Cb 0.28 -2.12 -0.05 0.00 0.00 0.00 0.00 19.45 17.56 1nob n ALA 488 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1nob s SER 489 N -1.36 6.94 -0.30 0.00 0.01 -1.26 -4.96 113.70 112.77 1nob s SER 489 Ca 0.76 1.13 -0.11 0.00 1.31 0.00 0.00 55.95 59.05 1nob s SER 489 Cb -0.39 -2.39 0.15 0.00 0.21 0.00 0.00 66.02 63.60 1nob s SER 489 CO 0.47 -0.06 0.79 0.86 0.41 0.00 0.00 173.24 175.71 1nob s TRP 490 N 0.57 -1.10 -2.21 2.43 -0.11 -1.25 -4.28 118.94 112.99 1nob s TRP 490 Ca 0.35 1.72 0.00 0.00 1.22 0.00 0.00 56.10 59.38 1nob s TRP 490 Cb -0.17 0.59 0.00 0.00 -1.50 0.00 0.00 33.47 32.39 1nob s TRP 490 CO 0.17 -0.56 0.00 0.41 -4.62 0.00 0.00 176.95 172.35 1nob n GLY 491 N 5.28 -0.79 3.53 5.86 0.00 -1.07 -4.99 105.19 113.01 1nob n GLY 491 Ca -0.09 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.76 1nob n GLY 491 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nob s TYR 492 N -3.00 0.97 -0.21 1.61 1.51 -1.26 -1.04 117.35 115.93 1nob s TYR 492 Ca 0.00 0.83 -0.08 0.00 -1.01 0.00 0.00 57.07 56.81 1nob s TYR 492 Cb 0.00 -3.19 -0.04 0.00 -0.11 0.00 0.00 41.96 38.62 1nob s TYR 492 CO 0.00 -3.85 0.09 0.50 -1.11 0.00 0.00 175.55 171.17 1nob s ARG 493 N -4.94 3.90 -0.28 -0.62 3.52 -0.78 -1.85 118.95 117.89 1nob s ARG 493 Ca 0.68 -0.37 -0.00 0.00 -0.13 0.00 0.00 55.73 55.91 1nob s ARG 493 Cb -0.17 -3.32 0.08 0.00 -1.56 0.00 0.00 34.95 29.98 1nob s ARG 493 CO 0.59 0.09 0.04 -1.14 -0.81 0.00 0.00 175.30 174.07 1nob s GLN 494 N 0.90 1.02 7.88 5.12 0.74 0.13 -1.34 119.66 134.12 1nob s GLN 494 Ca 0.05 -1.05 0.00 0.00 0.05 0.00 0.00 55.36 54.41 1nob s GLN 494 Cb -0.14 -2.31 0.00 0.00 1.10 0.00 0.00 33.01 31.66 1nob s GLN 494 CO 0.03 -0.83 0.00 0.41 -0.55 0.00 0.00 175.29 174.35 1nob n GLY 495 N 4.76 3.66 1.47 2.59 0.00 -1.26 -0.78 105.19 115.63 1nob n GLY 495 Ca -0.05 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.01 1nob n GLY 495 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1nob n GLN 496 N 13.56 3.69 -2.63 1.61 1.13 -1.26 -4.98 117.38 128.49 1nob n GLN 496 Ca 0.00 -2.85 -0.07 0.00 -1.94 0.00 0.00 57.00 52.15 1nob n GLN 496 Cb 0.00 -1.87 -0.02 0.00 0.11 0.00 0.00 30.24 28.46 1nob n GLN 496 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1nob n SER 497 N 0.88 0.88 -4.59 1.08 2.88 0.04 -4.24 113.62 110.55 1nob n SER 497 Ca 0.24 -1.58 -0.39 0.00 -1.33 0.00 0.00 58.87 55.82 1nob n SER 497 Cb 0.88 0.29 -0.10 0.00 -0.75 0.00 0.00 64.21 64.53 1nob n SER 497 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1nob s VAL 498 N -1.99 5.25 0.37 2.46 1.01 -1.26 0.22 120.40 126.47 1nob s VAL 498 Ca 0.06 0.32 -0.28 0.00 0.00 0.00 0.00 61.98 62.09 1nob s VAL 498 Cb 0.00 -3.61 -0.11 0.00 0.00 0.00 0.00 36.38 32.66 1nob s VAL 498 CO 0.04 0.20 1.36 -0.24 0.00 0.00 0.00 175.10 176.47 1nob n SER 499 N 5.18 3.13 0.27 3.32 2.88 -0.77 -4.80 113.62 122.83 1nob n SER 499 Ca -0.12 1.20 0.12 0.00 -1.33 0.00 0.00 58.87 58.74 1nob n SER 499 Cb 0.51 -1.54 0.78 0.00 -0.75 0.00 0.00 64.21 63.21 1nob n SER 499 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1nob h THR 500 N 2.62 0.69 -2.52 2.46 1.35 -1.97 -3.41 112.91 112.13 1nob h THR 500 Ca -0.48 -0.19 -0.54 0.00 -0.55 0.00 0.00 66.41 64.65 1nob h THR 500 Cb 1.27 1.11 0.05 0.00 -1.73 0.00 0.00 68.15 68.85 1nob h THR 500 CO 0.63 0.05 1.01 0.59 -0.25 0.00 0.00 175.52 177.54 1nob n ASN 501 N -3.99 3.84 -4.72 5.36 5.03 -1.26 -4.97 115.26 114.56 1nob n ASN 501 Ca -0.03 1.04 -0.29 0.00 0.87 0.00 0.00 54.58 56.17 1nob n ASN 501 Cb 0.13 -1.54 0.14 0.00 -1.02 0.00 0.00 39.78 37.50 1nob n ASN 501 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1nob s THR 502 N 1.65 2.52 -0.09 3.41 -4.23 -1.26 -4.64 115.64 112.99 1nob s THR 502 Ca 0.78 0.17 -0.30 0.00 -1.18 0.00 0.00 61.69 61.16 1nob s THR 502 Cb -0.53 -2.71 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 1nob s THR 502 CO 0.35 -0.22 1.03 -0.69 -0.54 0.00 0.00 174.62 174.55 1nob s VAL 503 N -3.00 4.72 0.04 2.29 1.01 -1.26 -4.88 120.40 119.31 1nob s VAL 503 Ca 0.64 1.98 -0.03 0.00 0.00 0.00 0.00 61.98 64.57 1nob s VAL 503 Cb -0.17 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 31.92 1nob s VAL 503 CO 0.56 0.02 -0.06 0.35 0.00 0.00 0.00 175.10 175.97 1nob n THR 504 N 4.50 1.12 -1.44 3.92 -2.24 -1.26 -4.78 114.28 114.09 1nob n THR 504 Ca 0.09 0.29 -0.39 0.00 -2.27 0.00 0.00 64.05 61.77 1nob n THR 504 Cb 0.49 -1.70 -0.02 0.00 -2.10 0.00 0.00 70.33 67.00 1nob n THR 504 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1nob n ASN 505 N -3.59 6.52 0.06 3.42 6.94 -1.26 -4.60 115.26 122.74 1nob n ASN 505 Ca -0.04 -2.67 -0.09 0.00 -0.02 0.00 0.00 54.58 51.76 1nob n ASN 505 Cb 0.17 -1.56 -0.13 0.00 -2.36 0.00 0.00 39.78 35.90 1nob n ASN 505 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 1nob h GLY 506 N 8.43 0.08 2.00 4.83 0.00 -1.75 -3.30 103.07 113.35 1nob h GLY 506 Ca 0.73 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.86 1nob h GLY 506 CO 1.82 0.18 0.00 1.04 0.00 0.00 0.00 176.54 179.57 1nob n LEU 507 N -3.36 0.44 0.17 3.11 4.77 -1.19 -1.48 117.00 119.46 1nob n LEU 507 Ca -0.04 0.62 0.05 0.00 -0.03 0.00 0.00 56.01 56.61 1nob n LEU 507 Cb 0.97 -0.58 0.24 0.00 -2.33 0.00 0.00 43.42 41.72 1nob n LEU 507 CO 0.48 -0.52 0.62 1.23 -1.33 0.00 0.00 177.39 177.87 1nob h GLY 508 N 1.93 0.00 -2.01 -0.72 0.00 -1.90 -2.83 103.07 97.53 1nob h GLY 508 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1nob h GLY 508 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 176.54 177.23 1nob n PHE 509 N -3.40 0.15 -3.46 5.60 3.01 -0.55 -4.67 117.46 114.14 1nob n PHE 509 Ca 0.01 -0.08 -0.32 0.00 1.01 0.00 0.00 57.45 58.07 1nob n PHE 509 Cb 0.58 -0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 40.00 1nob n PHE 509 CO 0.00 0.00 0.00 -1.64 1.01 0.00 0.00 176.76 176.13 1nob s MET 510 N -1.81 3.79 0.01 -1.08 -1.94 -1.06 -4.95 119.30 112.25 1nob s MET 510 Ca 0.31 0.23 -0.30 0.00 -1.71 0.00 0.00 55.69 54.22 1nob s MET 510 Cb 0.20 -2.73 -0.07 0.00 2.01 0.00 0.00 34.83 34.25 1nob s MET 510 CO 0.30 0.37 1.66 -2.14 -0.01 0.00 0.00 175.02 175.20 1nob s PRO 511 N -2.65 4.19 -0.21 2.03 0.02 -1.26 0.19 135.00 137.30 1nob s PRO 511 Ca 0.45 2.27 -0.37 0.00 0.02 0.00 0.00 61.00 63.37 1nob s PRO 511 Cb -0.12 -3.82 -0.13 0.00 0.02 0.00 0.00 34.50 30.45 1nob s PRO 511 CO 0.21 -0.79 1.90 -1.71 -0.33 0.00 0.00 177.00 176.28 1nob n ASN 512 N 6.44 2.82 0.16 2.53 2.85 -0.79 -4.36 115.26 124.91 1nob n ASN 512 Ca 0.17 0.90 0.13 0.00 -0.11 0.00 0.00 54.58 55.66 1nob n ASN 512 Cb 0.42 -1.27 0.52 0.00 1.24 0.00 0.00 39.78 40.69 1nob n ASN 512 CO 0.00 0.00 0.00 -0.37 -2.11 0.00 0.00 177.26 174.78 1nob h VAL 513 N 5.71 0.00 0.15 3.44 -1.51 -1.91 0.52 116.25 122.65 1nob h VAL 513 Ca -0.44 -0.30 -0.24 0.00 -1.23 0.00 0.00 66.70 64.50 1nob h VAL 513 Cb 1.30 1.09 0.02 0.00 -2.13 0.00 0.00 31.29 31.56 1nob h VAL 513 CO 0.97 0.00 -1.11 0.28 -1.23 0.00 0.00 177.57 176.48 1nob h SER 514 N 0.00 0.49 -0.33 4.19 0.02 -1.97 -2.28 113.55 113.67 1nob h SER 514 Ca 0.00 -0.92 -0.06 0.00 -0.84 0.00 0.00 61.79 59.97 1nob h SER 514 Cb 0.41 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 1nob h SER 514 CO 0.00 1.51 -0.03 0.00 -1.14 0.00 0.00 176.83 177.18 1nob h ALA 515 N 0.05 0.44 -2.85 3.77 0.00 -1.88 -3.36 119.26 115.43 1nob h ALA 515 Ca -0.21 -0.26 -0.61 0.00 0.00 0.00 0.00 54.91 53.82 1nob h ALA 515 Cb 1.75 -0.12 -0.41 0.00 0.00 0.00 0.00 17.79 19.02 1nob h ALA 515 CO 0.14 0.23 -0.67 0.66 0.00 0.00 0.00 179.25 179.61 1nob n TYR 516 N -4.50 2.31 -1.74 0.00 4.01 0.18 -4.74 117.16 112.67 1nob n TYR 516 Ca -0.02 -4.07 -0.40 0.00 -0.16 0.00 0.00 57.90 53.24 1nob n TYR 516 Cb 0.29 -0.42 0.01 0.00 -0.31 0.00 0.00 39.34 38.91 1nob n TYR 516 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1nob n PRO 517 N 2.06 2.16 -0.04 -0.72 -0.02 -0.86 -4.28 135.00 133.31 1nob n PRO 517 Ca 0.23 0.77 -0.09 0.00 -2.02 0.00 0.00 63.50 62.39 1nob n PRO 517 Cb 0.39 -2.54 -0.03 0.00 -0.02 0.00 0.00 33.50 31.30 1nob n PRO 517 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1nob h ARG 518 N 2.26 0.05 -0.32 -0.52 3.08 -1.77 -2.61 114.38 114.55 1nob h ARG 518 Ca -0.50 -0.00 -0.05 0.00 0.07 0.00 0.00 59.98 59.50 1nob h ARG 518 Cb 1.28 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.30 1nob h ARG 518 CO 0.61 0.03 -0.01 -1.00 -1.07 0.00 0.00 179.97 178.53 1nob h PRO 519 N 0.05 0.49 -3.88 0.04 0.13 -1.92 -3.38 132.00 123.53 1nob h PRO 519 Ca 0.09 -0.10 -0.79 0.00 -0.87 0.00 0.00 66.00 64.34 1nob h PRO 519 Cb 0.12 -0.07 -0.26 0.00 0.13 0.00 0.00 31.00 30.92 1nob h PRO 519 CO -0.17 0.52 0.12 -0.80 -0.23 0.00 0.00 178.00 177.45 1nob s ASN 520 N -6.75 6.76 -0.00 1.44 0.01 -0.98 -4.75 114.94 110.66 1nob s ASN 520 Ca -0.07 -2.67 0.05 0.00 -0.71 0.00 0.00 52.86 49.46 1nob s ASN 520 Cb 0.16 -2.22 -0.07 0.00 0.41 0.00 0.00 41.25 39.53 1nob s ASN 520 CO 0.76 -0.59 0.18 0.00 -1.51 0.00 0.00 177.10 175.94 1nob n ALA 521 N 4.06 2.48 0.87 0.60 0.00 -1.26 -4.23 120.51 123.04 1nob n ALA 521 Ca 0.14 -0.14 0.09 0.00 0.00 0.00 0.00 53.44 53.53 1nob n ALA 521 Cb 0.47 -0.18 0.26 0.00 0.00 0.00 0.00 19.45 20.00 1nob n ALA 521 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1nob n SER 522 N -1.34 2.11 -4.70 0.00 7.64 -1.26 -4.69 113.62 111.38 1nob n SER 522 Ca 0.00 -1.88 -0.42 0.00 1.01 0.00 0.00 58.87 57.58 1nob n SER 522 Cb 0.10 -0.21 -0.03 0.00 -1.01 0.00 0.00 64.21 63.07 1nob n SER 522 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1nob s GLU 523 N -1.59 4.47 0.32 1.43 0.41 -1.26 -4.93 118.70 117.56 1nob s GLU 523 Ca 0.31 1.44 0.08 0.00 -0.41 0.00 0.00 54.97 56.39 1nob s GLU 523 Cb 0.16 -3.50 0.91 0.00 -1.78 0.00 0.00 34.13 29.92 1nob s GLU 523 CO 0.23 -0.21 1.61 0.00 -0.49 0.00 0.00 175.26 176.40 1nob h ALA 524 N 6.99 1.52 -0.01 5.21 0.00 -1.95 0.66 119.26 131.68 1nob h ALA 524 Ca -0.36 0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1nob h ALA 524 Cb 1.18 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.35 1nob h ALA 524 CO 0.81 -0.62 -0.05 -0.22 0.00 0.00 0.00 179.25 179.17 1nob h LYS 525 N 0.12 0.01 0.00 0.00 3.64 -1.95 -1.20 116.57 117.19 1nob h LYS 525 Ca 0.65 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 60.03 1nob h LYS 525 Cb 1.46 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.28 1nob h LYS 525 CO -0.75 0.06 0.00 0.43 -2.27 0.00 0.00 179.45 176.92 1nob n SER 526 N -4.47 0.00 -4.52 4.20 7.64 0.23 -4.75 113.62 111.95 1nob n SER 526 Ca -0.03 -0.60 -0.24 0.00 1.01 0.00 0.00 58.87 59.01 1nob n SER 526 Cb 0.14 -0.04 -0.09 0.00 -1.01 0.00 0.00 64.21 63.20 1nob n SER 526 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1nob s GLN 527 N -2.08 1.83 -0.25 1.43 1.11 -0.45 -2.11 119.66 119.14 1nob s GLN 527 Ca 0.32 -1.71 -0.03 0.00 0.01 0.00 0.00 55.36 53.95 1nob s GLN 527 Cb 0.15 -1.85 0.11 0.00 -1.01 0.00 0.00 33.01 30.41 1nob s GLN 527 CO 0.27 0.32 0.24 1.41 0.01 0.00 0.00 175.29 177.54 1nob s MET 528 N -3.56 0.25 0.18 2.91 -2.45 -0.98 -4.99 119.30 110.66 1nob s MET 528 Ca 0.31 -0.02 0.07 0.00 -1.25 0.00 0.00 55.69 54.80 1nob s MET 528 Cb -0.05 -0.97 -0.04 0.00 1.25 0.00 0.00 34.83 35.03 1nob s MET 528 CO 0.16 -0.85 -0.00 0.08 1.05 0.00 0.00 175.02 175.46 1nob s VAL 529 N 2.32 3.71 0.27 10.11 1.01 -1.26 -2.06 120.40 134.50 1nob s VAL 529 Ca 0.08 -1.44 -0.21 0.00 0.00 0.00 0.00 61.98 60.41 1nob s VAL 529 Cb -0.15 -2.87 0.02 0.00 0.00 0.00 0.00 36.38 33.38 1nob s VAL 529 CO -0.24 -0.12 0.72 -0.94 0.00 0.00 0.00 175.10 174.53 1nob s SER 530 N -2.97 -0.28 -0.23 3.32 1.04 -0.37 -5.02 113.70 109.20 1nob s SER 530 Ca 0.28 -0.57 -0.08 0.00 0.48 0.00 0.00 55.95 56.06 1nob s SER 530 Cb -0.09 0.71 -0.04 0.00 0.10 0.00 0.00 66.02 66.70 1nob s SER 530 CO 0.19 -1.31 0.10 -0.22 0.98 0.00 0.00 173.24 172.97 1nob s LEU 531 N -2.91 3.74 0.12 2.42 2.96 -1.26 -1.16 118.68 122.59 1nob s LEU 531 Ca 0.10 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 1nob s LEU 531 Cb -0.06 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.60 1nob s LEU 531 CO 0.06 0.05 -0.00 0.28 -1.32 0.00 0.00 176.35 175.41 1nob s THR 532 N 1.15 0.41 -0.19 3.68 -1.32 -0.79 -4.96 115.64 113.63 1nob s THR 532 Ca 0.05 -1.91 -0.04 0.00 -1.21 0.00 0.00 61.69 58.57 1nob s THR 532 Cb -0.14 -1.88 -0.02 0.00 -1.51 0.00 0.00 72.50 68.95 1nob s THR 532 CO 0.04 -0.67 -0.02 -0.31 -2.21 0.00 0.00 174.62 171.45 1nob s TYR 533 N -3.82 3.02 0.23 9.09 1.51 -1.26 -0.55 117.35 125.57 1nob s TYR 533 Ca 0.18 -0.47 -0.31 0.00 -1.01 0.00 0.00 57.07 55.46 1nob s TYR 533 Cb 0.07 -2.05 -0.14 0.00 -0.11 0.00 0.00 41.96 39.73 1nob s TYR 533 CO -0.02 -0.22 1.29 -0.11 -1.11 0.00 0.00 175.55 175.39 1nob n LEU 534 N 4.09 2.56 0.00 -1.29 7.94 -0.61 0.17 117.00 129.87 1nob n LEU 534 Ca -0.17 1.15 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 1nob n LEU 534 Cb 0.52 -1.36 0.00 0.00 0.53 0.00 0.00 43.42 43.11 1nob n LEU 534 CO 0.32 -0.82 0.00 0.00 -1.11 0.00 0.00 177.39 175.78 1nob n GLN 535 N 1.69 -0.80 -1.01 1.96 6.02 0.22 -1.07 117.38 124.40 1nob n GLN 535 Ca 0.12 0.20 -0.00 0.00 -0.01 0.00 0.00 57.00 57.30 1nob n GLN 535 Cb 0.30 -4.67 -0.00 0.00 1.02 0.00 0.00 30.24 26.89 1nob n GLN 535 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1nob n GLY 536 N -0.81 0.44 3.65 1.08 0.00 0.13 -4.96 105.19 104.71 1nob n GLY 536 Ca 0.00 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1nob n GLY 536 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1nob s ASP 537 N -2.09 6.90 0.00 1.61 -1.08 -0.23 -4.93 116.67 116.85 1nob s ASP 537 Ca 0.00 1.12 0.08 0.00 -0.52 0.00 0.00 52.55 53.23 1nob s ASP 537 Cb 0.00 -2.46 0.40 0.00 -1.46 0.00 0.00 42.92 39.40 1nob s ASP 537 CO 0.00 -0.51 1.09 0.35 0.52 0.00 0.00 175.17 176.62 1nob n THR 538 N 5.15 0.78 1.03 1.71 -2.24 -1.26 -1.24 114.28 118.20 1nob n THR 538 Ca 0.06 0.19 0.11 0.00 -2.27 0.00 0.00 64.05 62.15 1nob n THR 538 Cb 0.48 -1.07 0.04 0.00 -2.10 0.00 0.00 70.33 67.68 1nob n THR 538 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1nob n SER 539 N -1.26 1.84 -3.51 3.42 3.41 -1.26 -4.60 113.62 111.65 1nob n SER 539 Ca 0.04 -1.40 -0.32 0.00 -0.26 0.00 0.00 58.87 56.93 1nob n SER 539 Cb 0.06 0.46 -0.04 0.00 -0.26 0.00 0.00 64.21 64.42 1nob n SER 539 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1nob n LYS 540 N -0.19 3.33 -2.03 4.33 5.02 -0.38 -5.07 118.16 123.18 1nob n LYS 540 Ca 0.09 -4.68 -0.41 0.00 -2.02 0.00 0.00 58.31 51.30 1nob n LYS 540 Cb 0.45 -2.33 -0.02 0.00 -0.02 0.00 0.00 35.03 33.10 1nob n LYS 540 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1nob s PRO 541 N -2.84 4.28 0.31 1.97 0.04 -1.26 -1.57 135.00 135.94 1nob s PRO 541 Ca 0.39 2.30 0.02 0.00 0.04 0.00 0.00 61.00 63.74 1nob s PRO 541 Cb 0.15 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.60 1nob s PRO 541 CO -0.01 -0.34 0.37 0.44 0.04 0.00 0.00 177.00 177.50 1nob n ILE 542 N 1.54 0.00 -4.09 0.56 -5.35 0.29 -4.87 119.36 107.43 1nob n ILE 542 Ca 0.03 -1.84 -0.22 0.00 -0.27 0.00 0.00 62.75 60.46 1nob n ILE 542 Cb 0.41 1.03 -0.17 0.00 -1.74 0.00 0.00 39.64 39.17 1nob n ILE 542 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1nob s THR 543 N -2.95 0.61 -0.22 7.28 -4.23 -0.60 -1.89 115.64 113.63 1nob s THR 543 Ca 0.30 -0.12 -0.11 0.00 -1.18 0.00 0.00 61.69 60.58 1nob s THR 543 Cb 0.00 -0.65 -0.05 0.00 1.34 0.00 0.00 72.50 73.14 1nob s THR 543 CO 0.21 0.26 0.18 -0.32 -0.54 0.00 0.00 174.62 174.41 1nob s MET 544 N 1.21 4.12 0.02 3.99 1.75 -0.31 -1.55 119.30 128.53 1nob s MET 544 Ca -0.06 -0.19 0.05 0.00 -1.25 0.00 0.00 55.69 54.24 1nob s MET 544 Cb -0.14 -3.50 -0.03 0.00 2.84 0.00 0.00 34.83 34.00 1nob s MET 544 CO -0.02 0.13 -0.14 0.21 -0.65 0.00 0.00 175.02 174.56 1nob s LYS 545 N 0.85 2.29 -0.09 4.11 2.20 0.22 -1.24 119.74 128.09 1nob s LYS 545 Ca 0.09 -0.86 0.01 0.00 -0.36 0.00 0.00 55.97 54.85 1nob s LYS 545 Cb -0.13 -2.32 0.02 0.00 -1.51 0.00 0.00 37.83 33.89 1nob s LYS 545 CO 0.03 0.57 -0.11 0.08 -0.36 0.00 0.00 175.35 175.56 1nob s VAL 546 N -0.93 1.12 -0.03 4.02 1.01 -0.87 -0.64 120.40 124.07 1nob s VAL 546 Ca 0.15 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 61.77 1nob s VAL 546 Cb -0.11 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1nob s VAL 546 CO 0.06 0.37 -0.19 0.00 0.00 0.00 0.00 175.10 175.33 1nob s ALA 547 N 1.10 2.47 -0.04 5.51 0.00 0.14 -2.31 121.76 128.63 1nob s ALA 547 Ca -0.06 -1.04 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 1nob s ALA 547 Cb -0.14 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.14 1nob s ALA 547 CO -0.02 0.55 0.08 -0.06 0.00 0.00 0.00 175.76 176.31 1nob s PHE 548 N -0.69 3.32 -1.52 0.00 0.08 -0.90 -1.41 117.98 116.86 1nob s PHE 548 Ca 0.11 0.26 -0.19 0.00 0.12 0.00 0.00 56.93 57.23 1nob s PHE 548 Cb -0.10 -1.78 0.19 0.00 -0.57 0.00 0.00 43.02 40.76 1nob s PHE 548 CO 0.00 0.57 0.48 0.09 -0.10 0.00 0.00 175.22 176.26 1nob n ASN 549 N 1.48 -1.64 -0.13 1.36 3.02 -1.05 -4.78 115.26 113.52 1nob n ASN 549 Ca -0.15 -0.93 0.13 0.00 -0.03 0.00 0.00 54.58 53.60 1nob n ASN 549 Cb 0.53 -1.45 0.41 0.00 -0.61 0.00 0.00 39.78 38.66 1nob n ASN 549 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nob n GLY 550 N -0.95 -0.93 2.66 7.41 0.00 -1.26 -4.44 105.19 107.68 1nob n GLY 550 Ca 0.10 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 1nob n GLY 550 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1nob n ILE 551 N -1.02 -0.16 -3.34 -0.61 3.06 -1.26 -4.94 119.36 111.09 1nob n ILE 551 Ca 0.10 -1.84 0.00 0.00 -2.50 0.00 0.00 62.75 58.52 1nob n ILE 551 Cb 0.33 0.75 0.00 0.00 0.54 0.00 0.00 39.64 41.25 1nob n ILE 551 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 1nob n THR 552 N 1.96 0.00 -3.22 9.51 -2.24 -1.26 -4.78 114.28 114.25 1nob n THR 552 Ca 0.14 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.68 1nob n THR 552 Cb 0.59 -0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.52 1nob n THR 552 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1nob n SER 553 N -0.85 1.39 0.00 3.42 7.64 -1.26 -4.95 113.62 119.00 1nob n SER 553 Ca 0.00 -2.98 0.00 0.00 1.01 0.00 0.00 58.87 56.90 1nob n SER 553 Cb 0.00 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.56 1nob n SER 553 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1nob n LEU 554 N 0.97 0.00 -0.00 -3.43 7.99 -1.26 -3.68 117.00 117.59 1nob n LEU 554 Ca 0.24 0.00 0.01 0.00 -0.01 0.00 0.00 56.01 56.26 1nob n LEU 554 Cb 0.52 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.81 1nob n LEU 554 CO 0.25 0.00 -0.22 0.59 -1.51 0.00 0.00 177.39 176.49 1nob n ASN 555 N 1.11 1.84 -3.49 -1.43 4.13 -1.26 -5.07 115.26 111.08 1nob n ASN 555 Ca 0.00 -0.34 -0.23 0.00 1.68 0.00 0.00 54.58 55.69 1nob n ASN 555 Cb 0.00 1.06 0.16 0.00 -1.54 0.00 0.00 39.78 39.46 1nob n ASN 555 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1nob n GLY 556 N 1.58 -1.39 3.23 7.41 0.00 -1.24 -3.64 105.19 111.14 1nob n GLY 556 Ca 0.00 -1.71 -0.13 0.00 0.00 0.00 0.00 46.02 44.18 1nob n GLY 556 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nob s TYR 557 N -3.25 1.22 0.34 1.61 2.02 -0.99 -4.59 117.35 113.72 1nob s TYR 557 Ca 0.59 -1.25 -0.17 0.00 -0.37 0.00 0.00 57.07 55.86 1nob s TYR 557 Cb -0.02 -0.66 0.06 0.00 -0.40 0.00 0.00 41.96 40.94 1nob s TYR 557 CO 0.41 -0.47 0.82 -1.54 -1.57 0.00 0.00 175.55 173.20 1nob s SER 558 N -3.19 -0.02 -0.16 2.29 1.04 -1.26 -1.00 113.70 111.39 1nob s SER 558 Ca 0.34 -1.02 -0.11 0.00 0.48 0.00 0.00 55.95 55.64 1nob s SER 558 Cb 0.07 0.78 0.05 0.00 0.10 0.00 0.00 66.02 67.03 1nob s SER 558 CO 0.10 -1.55 0.40 -0.76 0.98 0.00 0.00 173.24 172.41 1nob s LEU 559 N -3.10 0.16 -0.17 2.42 1.43 -0.95 -2.51 118.68 115.96 1nob s LEU 559 Ca 0.16 0.85 -0.03 0.00 -1.03 0.00 0.00 54.13 54.08 1nob s LEU 559 Cb -0.05 1.35 0.05 0.00 0.03 0.00 0.00 46.19 47.58 1nob s LEU 559 CO 0.10 -0.17 0.03 -0.89 0.23 0.00 0.00 176.35 175.65 1nob s THR 560 N 0.87 0.49 -0.23 5.49 2.01 -0.50 -1.74 115.64 122.03 1nob s THR 560 Ca -0.05 -0.41 -0.10 0.00 0.31 0.00 0.00 61.69 61.44 1nob s THR 560 Cb -0.06 -0.92 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 1nob s THR 560 CO -0.07 -0.11 0.15 -0.36 -0.69 0.00 0.00 174.62 173.54 1nob s PHE 561 N 1.89 3.33 -0.08 4.92 0.40 -0.69 -0.69 117.98 127.06 1nob s PHE 561 Ca 0.00 0.23 0.00 0.00 -0.60 0.00 0.00 56.93 56.56 1nob s PHE 561 Cb -0.16 -2.24 0.02 0.00 0.51 0.00 0.00 43.02 41.16 1nob s PHE 561 CO -0.07 0.11 -0.05 -1.64 0.70 0.00 0.00 175.22 174.26 1nob s MET 562 N 0.89 1.11 -0.24 0.44 -1.94 0.18 -1.53 119.30 118.21 1nob s MET 562 Ca 0.07 -0.14 -0.08 0.00 -1.71 0.00 0.00 55.69 53.83 1nob s MET 562 Cb -0.13 -1.18 -0.04 0.00 2.01 0.00 0.00 34.83 35.49 1nob s MET 562 CO 0.03 -0.18 0.10 -1.58 -0.01 0.00 0.00 175.02 173.38 1nob s TRP 563 N 1.39 3.16 0.14 -0.03 0.51 0.07 -0.61 118.94 123.57 1nob s TRP 563 Ca -0.03 -0.16 0.07 0.00 -2.12 0.00 0.00 56.10 53.86 1nob s TRP 563 Cb -0.13 -2.24 -0.04 0.00 -0.81 0.00 0.00 33.47 30.25 1nob s TRP 563 CO -0.03 -0.18 -0.16 -1.12 -0.51 0.00 0.00 176.95 174.95 1nob s SER 564 N 1.36 2.25 0.00 2.95 0.01 -0.59 -0.68 113.70 119.00 1nob s SER 564 Ca 0.06 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.49 1nob s SER 564 Cb -0.15 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1nob s SER 564 CO 0.05 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.21 1nob n GLY 565 N 0.46 1.08 0.19 3.44 0.00 0.83 -1.56 105.19 109.61 1nob n GLY 565 Ca -0.15 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.54 1nob n GLY 565 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1nob h LEU 566 N 0.00 0.83 -0.77 0.99 3.38 -1.62 -3.37 115.31 114.76 1nob h LEU 566 Ca 0.00 -0.74 0.10 0.00 0.09 0.00 0.00 57.88 57.33 1nob h LEU 566 Cb 0.02 -0.25 -0.11 0.00 0.09 0.00 0.00 40.66 40.41 1nob h LEU 566 CO 0.00 1.46 -0.36 -0.24 0.09 0.00 0.00 178.44 179.40 1nob n SER 567 N -3.94 -0.62 -1.51 -0.43 2.88 -0.45 -0.32 113.62 109.23 1nob n SER 567 Ca -0.11 1.35 0.00 0.00 -1.33 0.00 0.00 58.87 58.78 1nob n SER 567 Cb 0.83 -0.25 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 1nob n SER 567 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1nob n ASN 568 N -5.06 3.69 -2.75 -3.46 0.23 -1.26 -2.55 115.26 104.10 1nob n ASN 568 Ca 0.05 -1.95 -0.04 0.00 -0.53 0.00 0.00 54.58 52.11 1nob n ASN 568 Cb 0.26 -0.76 0.06 0.00 -2.08 0.00 0.00 39.78 37.27 1nob n ASN 568 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1nob n TYR 569 N 1.43 0.37 -1.46 -2.53 4.01 0.57 -5.14 117.16 114.41 1nob n TYR 569 Ca 0.00 -2.24 -0.41 0.00 -0.16 0.00 0.00 57.90 55.09 1nob n TYR 569 Cb 0.38 0.18 0.01 0.00 -0.31 0.00 0.00 39.34 39.59 1nob n TYR 569 CO 0.00 0.00 0.00 -0.89 -0.46 0.00 0.00 176.86 175.51 1nob n ILE 570 N -0.59 1.82 -2.39 -0.72 2.08 -1.06 -3.04 119.36 115.47 1nob n ILE 570 Ca 0.03 -0.50 -0.11 0.00 0.56 0.00 0.00 62.75 62.72 1nob n ILE 570 Cb 0.82 -0.58 -0.01 0.00 -0.75 0.00 0.00 39.64 39.13 1nob n ILE 570 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1nob n ASN 571 N 1.16 -3.68 -4.38 4.38 3.02 -0.30 -4.84 115.26 110.62 1nob n ASN 571 Ca 0.11 0.22 -0.30 0.00 -0.03 0.00 0.00 54.58 54.58 1nob n ASN 571 Cb 0.41 -3.15 -0.14 0.00 -0.61 0.00 0.00 39.78 36.29 1nob n ASN 571 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1nob s GLN 572 N -4.93 1.92 0.22 3.52 -0.21 -1.17 -4.69 119.66 114.33 1nob s GLN 572 Ca 0.00 -1.05 -0.31 0.00 0.02 0.00 0.00 55.36 54.02 1nob s GLN 572 Cb 0.00 -2.06 -0.10 0.00 1.00 0.00 0.00 33.01 31.85 1nob s GLN 572 CO 0.00 0.53 1.51 -1.25 -2.12 0.00 0.00 175.29 173.95 1nob s PRO 573 N -1.27 4.23 -0.61 2.91 0.04 0.22 -2.67 135.00 137.86 1nob s PRO 573 Ca 0.13 2.36 -0.28 0.00 0.04 0.00 0.00 61.00 63.25 1nob s PRO 573 Cb -0.10 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.34 1nob s PRO 573 CO 0.03 -0.52 1.34 0.12 0.04 0.00 0.00 177.00 178.02 1nob s PHE 574 N 0.42 2.34 -0.01 0.56 5.36 0.25 -4.81 117.98 122.10 1nob s PHE 574 Ca 0.64 0.35 0.02 0.00 -0.96 0.00 0.00 56.93 56.98 1nob s PHE 574 Cb -0.43 -4.47 -0.00 0.00 -0.34 0.00 0.00 43.02 37.78 1nob s PHE 574 CO 0.39 -1.91 -0.06 0.45 -1.46 0.00 0.00 175.22 172.63 1nob s SER 575 N 4.04 0.73 0.32 6.13 0.15 -1.26 -1.99 113.70 121.82 1nob s SER 575 Ca 0.47 -0.11 0.11 0.00 0.70 0.00 0.00 55.95 57.11 1nob s SER 575 Cb -0.09 -0.10 -0.06 0.00 -1.71 0.00 0.00 66.02 64.06 1nob s SER 575 CO 0.23 0.07 -0.14 0.42 1.20 0.00 0.00 173.24 175.02 1nob s THR 576 N -0.09 2.36 0.00 6.45 -4.23 -1.11 0.69 115.64 119.70 1nob s THR 576 Ca 0.02 -2.29 0.00 0.00 -1.18 0.00 0.00 61.69 58.24 1nob s THR 576 Cb -0.03 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1nob s THR 576 CO -0.00 -0.29 0.00 -2.65 -0.54 0.00 0.00 174.62 171.14 1nob n PRO 577 N -0.72 0.31 -2.97 3.99 -0.02 -1.26 -4.65 135.00 129.68 1nob n PRO 577 Ca -0.05 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.02 1nob n PRO 577 Cb 0.62 0.00 -0.04 0.00 -0.02 0.00 0.00 33.50 34.05 1nob n PRO 577 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1nob s SER 578 N -1.00 6.96 -0.12 2.55 0.01 -1.26 -4.48 113.70 116.36 1nob s SER 578 Ca 0.00 1.17 0.01 0.00 1.31 0.00 0.00 55.95 58.44 1nob s SER 578 Cb 0.00 -2.43 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 1nob s SER 578 CO 0.00 -0.26 -0.16 0.00 0.41 0.00 0.00 173.24 173.23 1nob s SER 580 N 0.33 6.72 0.18 0.00 1.04 -1.26 -0.56 113.70 120.15 1nob s SER 580 Ca -0.13 0.94 -0.23 0.00 0.48 0.00 0.00 55.95 57.02 1nob s SER 580 Cb -0.16 -2.24 0.06 0.00 0.10 0.00 0.00 66.02 63.78 1nob s SER 580 CO 0.06 0.10 0.64 0.72 0.98 0.00 0.00 173.24 175.74 1nob s PHE 581 N -1.50 -0.46 0.07 5.02 -0.71 -0.62 -4.98 117.98 114.80 1nob s PHE 581 Ca 0.38 0.20 -0.19 0.00 -1.04 0.00 0.00 56.93 56.28 1nob s PHE 581 Cb -0.14 0.59 0.04 0.00 -1.21 0.00 0.00 43.02 42.30 1nob s PHE 581 CO 0.19 -0.91 0.45 -1.54 -1.34 0.00 0.00 175.22 172.06 1nob s SER 582 N -2.77 -0.32 0.12 1.98 1.04 -1.26 -0.86 113.70 111.62 1nob s SER 582 Ca 0.03 -0.05 -0.20 0.00 0.48 0.00 0.00 55.95 56.21 1nob s SER 582 Cb -0.02 0.47 0.05 0.00 0.10 0.00 0.00 66.02 66.62 1nob s SER 582 CO -0.09 -0.75 0.50 -0.72 0.98 0.00 0.00 173.24 173.16 1nob s TYR 583 N -2.93 -0.37 0.25 5.02 -0.85 -1.11 -4.96 117.35 112.40 1nob s TYR 583 Ca -0.03 0.18 -0.30 0.00 -0.52 0.00 0.00 57.07 56.41 1nob s TYR 583 Cb 0.00 0.38 -0.09 0.00 0.38 0.00 0.00 41.96 42.63 1nob s TYR 583 CO -0.06 -0.74 1.04 0.42 -1.52 0.00 0.00 175.55 174.69 1nob s ILE 584 N -3.46 3.78 0.13 -3.49 1.01 -1.26 -0.79 121.20 117.13 1nob s ILE 584 Ca 0.00 1.75 -0.21 0.00 0.00 0.00 0.00 60.65 62.19 1nob s ILE 584 Cb 0.00 -4.11 -0.07 0.00 0.01 0.00 0.00 42.46 38.29 1nob s ILE 584 CO -0.10 0.40 0.67 0.42 0.00 0.00 0.00 174.94 176.33 1nob s THR 585 N -1.01 4.59 0.64 2.92 -4.23 -0.64 -1.88 115.64 116.03 1nob s THR 585 Ca 0.44 1.38 0.33 0.00 -1.18 0.00 0.00 61.69 62.66 1nob s THR 585 Cb -0.29 -3.97 0.35 0.00 1.34 0.00 0.00 72.50 69.93 1nob s THR 585 CO 0.37 0.48 2.05 -0.61 -0.54 0.00 0.00 174.62 176.36 1nob h GLN 586 N 4.24 0.00 0.00 3.99 5.75 0.19 -3.39 115.11 125.89 1nob h GLN 586 Ca -0.48 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.02 1nob h GLN 586 Cb 1.21 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.76 1nob h GLN 586 CO 0.65 0.00 0.00 -1.91 -2.65 0.00 0.00 178.83 174.92