#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1toz s ASP 412 N 0.00 1.03 0.15 1.08 2.15 -1.26 -4.87 116.67 114.95 1toz s ASP 412 Ca 0.00 -1.15 0.07 0.00 0.43 0.00 0.00 52.55 51.90 1toz s ASP 412 Cb 0.00 0.15 -0.04 0.00 -0.30 0.00 0.00 42.92 42.73 1toz s ASP 412 CO 0.00 -0.58 -0.06 0.54 -0.17 0.00 0.00 175.17 174.90 1toz s VAL 413 N -3.73 3.50 -1.24 1.11 0.11 -1.26 -5.04 120.40 113.85 1toz s VAL 413 Ca 0.22 -1.40 -0.12 0.00 -2.93 0.00 0.00 61.98 57.74 1toz s VAL 413 Cb 0.06 -2.71 0.17 0.00 -1.53 0.00 0.00 36.38 32.37 1toz s VAL 413 CO 0.02 -0.02 1.60 -0.67 -3.33 0.00 0.00 175.10 172.70 1toz n ASP 414 N 0.23 5.18 0.31 3.54 4.64 -1.26 -4.64 116.55 124.55 1toz n ASP 414 Ca -0.11 -3.03 0.17 0.00 -1.38 0.00 0.00 54.79 50.44 1toz n ASP 414 Cb 0.54 -1.54 0.91 0.00 -1.04 0.00 0.00 41.12 39.99 1toz n ASP 414 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 1toz h GLU 415 N 6.61 0.00 0.00 -0.67 3.07 -1.91 1.45 114.58 123.13 1toz h GLU 415 Ca 0.35 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1toz h GLU 415 Cb 0.78 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.69 1toz h GLU 415 CO 1.39 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 179.00 1toz n SER 417 N -3.06 0.08 0.00 0.00 2.88 0.47 -4.48 113.62 109.51 1toz n SER 417 Ca 0.04 0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 1toz n SER 417 Cb 0.50 1.31 0.00 0.00 -0.75 0.00 0.00 64.21 65.27 1toz n SER 417 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1toz n LEU 418 N -2.57 0.94 -1.13 2.46 4.77 0.45 -4.88 117.00 117.05 1toz n LEU 418 Ca -0.19 0.39 -0.05 0.00 -0.03 0.00 0.00 56.01 56.13 1toz n LEU 418 Cb 0.90 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.89 1toz n LEU 418 CO 0.44 -0.07 0.31 0.61 -1.33 0.00 0.00 177.39 177.35 1toz n GLY 419 N 0.53 0.43 2.60 -0.72 0.00 -1.15 -5.03 105.19 101.85 1toz n GLY 419 Ca 0.00 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.73 1toz n GLY 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1toz n ALA 420 N -0.20 3.46 -3.82 4.61 0.00 0.11 -5.04 120.51 119.64 1toz n ALA 420 Ca -0.20 -4.31 -0.34 0.00 0.00 0.00 0.00 53.44 48.60 1toz n ALA 420 Cb 0.62 -0.93 -0.14 0.00 0.00 0.00 0.00 19.45 19.01 1toz n ALA 420 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1toz s ASN 421 N -1.57 4.81 0.13 0.00 2.47 -1.26 -3.80 114.94 115.72 1toz s ASN 421 Ca 0.32 -1.52 -0.05 0.00 0.42 0.00 0.00 52.86 52.02 1toz s ASN 421 Cb 0.05 -1.68 -0.08 0.00 -1.45 0.00 0.00 41.25 38.10 1toz s ASN 421 CO -0.12 -0.30 1.33 1.55 -3.72 0.00 0.00 177.10 175.84 1toz h PRO 422 N 7.90 0.48 -3.43 0.43 0.13 -1.95 -3.34 132.00 132.22 1toz h PRO 422 Ca -0.17 -0.47 -0.14 0.00 -0.87 0.00 0.00 66.00 64.35 1toz h PRO 422 Cb 1.05 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1toz h PRO 422 CO 0.53 1.11 1.32 0.00 -0.23 0.00 0.00 178.00 180.73 1toz n GLU 424 N 4.09 0.00 -0.06 0.00 1.02 -1.25 -1.12 120.64 123.32 1toz n GLU 424 Ca 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1toz n GLU 424 Cb 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.54 1toz n GLU 424 CO 0.00 0.00 0.00 -2.39 1.18 0.00 0.00 177.13 175.92 1toz n HIS 425 N 0.00 0.00 -3.59 -0.32 1.44 -1.26 -4.97 115.22 106.52 1toz n HIS 425 Ca 0.00 -0.12 -0.28 0.00 -2.01 0.00 0.00 57.72 55.31 1toz n HIS 425 Cb 0.00 -0.02 -0.16 0.00 0.12 0.00 0.00 29.99 29.93 1toz n HIS 425 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1toz s ALA 426 N -0.27 0.58 0.00 1.59 0.00 -0.27 -5.10 121.76 118.28 1toz s ALA 426 Ca 0.01 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1toz s ALA 426 Cb 0.01 -1.23 0.00 0.00 0.00 0.00 0.00 23.12 21.90 1toz s ALA 426 CO 0.00 -1.41 0.00 0.41 0.00 0.00 0.00 175.76 174.76 1toz n GLY 427 N 5.24 -1.60 3.38 0.00 0.00 -1.26 -4.55 105.19 106.41 1toz n GLY 427 Ca -0.06 -1.43 -0.35 0.00 0.00 0.00 0.00 46.02 44.17 1toz n GLY 427 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1toz s LYS 428 N -1.87 3.50 -0.34 1.61 2.47 -1.09 -4.97 119.74 119.05 1toz s LYS 428 Ca 0.00 -0.57 -0.06 0.00 -1.56 0.00 0.00 55.97 53.78 1toz s LYS 428 Cb 0.00 -3.07 0.04 0.00 -1.46 0.00 0.00 37.83 33.34 1toz s LYS 428 CO 0.00 -0.11 0.12 0.00 0.16 0.00 0.00 175.35 175.52 1toz s ILE 430 N 1.40 2.58 -0.08 0.00 -0.00 0.88 -4.87 121.20 121.10 1toz s ILE 430 Ca -0.01 -1.55 -0.00 0.00 -0.00 0.00 0.00 60.65 59.08 1toz s ILE 430 Cb -0.20 -3.00 -0.03 0.00 -0.00 0.00 0.00 42.46 39.23 1toz s ILE 430 CO 0.03 -0.03 -0.04 0.21 -0.00 0.00 0.00 174.94 175.11 1toz s ASN 431 N -3.98 4.91 0.34 4.36 2.47 -1.26 -0.81 114.94 120.97 1toz s ASN 431 Ca 0.43 0.05 0.04 0.00 0.42 0.00 0.00 52.86 53.80 1toz s ASN 431 Cb 0.00 -1.31 -0.06 0.00 -1.45 0.00 0.00 41.25 38.43 1toz s ASN 431 CO 0.25 0.37 0.06 0.42 -3.72 0.00 0.00 177.10 174.47 1toz s THR 432 N -0.83 1.20 -0.13 -5.21 -4.23 -0.33 -4.68 115.64 101.44 1toz s THR 432 Ca 0.13 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.34 1toz s THR 432 Cb -0.11 -2.78 -0.02 0.00 1.34 0.00 0.00 72.50 70.93 1toz s THR 432 CO 0.02 0.00 1.19 -0.76 -0.54 0.00 0.00 174.62 174.53 1toz s LEU 433 N -3.51 4.21 0.00 4.79 1.43 -1.26 -3.56 118.68 120.78 1toz s LEU 433 Ca 0.36 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 55.14 1toz s LEU 433 Cb 0.08 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1toz s LEU 433 CO 0.15 -0.66 0.00 0.61 0.23 0.00 0.00 176.35 176.68 1toz n GLY 434 N 3.44 1.53 3.39 -3.19 0.00 -1.26 -4.87 105.19 104.23 1toz n GLY 434 Ca 0.12 -0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 1toz n GLY 434 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1toz s SER 435 N 0.00 1.84 0.17 1.61 0.01 -1.23 -4.95 113.70 111.14 1toz s SER 435 Ca 0.00 -1.48 0.04 0.00 1.31 0.00 0.00 55.95 55.83 1toz s SER 435 Cb 0.00 0.22 -0.04 0.00 0.21 0.00 0.00 66.02 66.41 1toz s SER 435 CO 0.00 -0.78 0.20 0.72 0.41 0.00 0.00 173.24 173.79 1toz s PHE 436 N -3.51 3.27 0.07 2.43 -0.71 -1.26 -1.18 117.98 117.09 1toz s PHE 436 Ca 0.35 0.02 0.09 0.00 -1.04 0.00 0.00 56.93 56.35 1toz s PHE 436 Cb 0.06 -1.56 -0.03 0.00 -1.21 0.00 0.00 43.02 40.28 1toz s PHE 436 CO 0.15 0.52 -0.24 -2.00 -1.34 0.00 0.00 175.22 172.31 1toz s GLU 437 N -3.22 1.49 -0.06 1.99 2.12 0.01 -4.75 118.70 116.28 1toz s GLU 437 Ca 0.32 -1.13 -0.02 0.00 0.36 0.00 0.00 54.97 54.50 1toz s GLU 437 Cb -0.10 -1.74 0.04 0.00 0.26 0.00 0.00 34.13 32.58 1toz s GLU 437 CO 0.25 0.43 0.11 0.00 -0.54 0.00 0.00 175.26 175.52 1toz s GLN 439 N 1.74 3.59 0.54 0.00 -0.21 0.65 -4.25 119.66 121.71 1toz s GLN 439 Ca -0.02 0.61 -0.12 0.00 0.02 0.00 0.00 55.36 55.85 1toz s GLN 439 Cb -0.12 -2.16 -0.05 0.00 1.00 0.00 0.00 33.01 31.68 1toz s GLN 439 CO -0.05 -0.47 0.94 0.00 -2.12 0.00 0.00 175.29 173.60 1toz s LEU 441 N -4.62 5.36 0.00 0.00 1.98 -1.26 -4.61 118.68 115.52 1toz s LEU 441 Ca 0.54 -2.28 0.00 0.00 -2.89 0.00 0.00 54.13 49.50 1toz s LEU 441 Cb -0.10 -1.87 0.00 0.00 0.66 0.00 0.00 46.19 44.87 1toz s LEU 441 CO 0.43 -0.51 0.00 0.00 -1.89 0.00 0.00 176.35 174.38 1toz n GLN 442 N 4.29 0.00 -3.43 1.98 6.02 -1.26 -3.61 117.38 121.37 1toz n GLN 442 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.73 1toz n GLN 442 Cb 0.40 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.58 1toz n GLN 442 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1toz n GLY 443 N 0.00 4.37 3.88 1.08 0.00 -1.25 -5.05 105.19 108.22 1toz n GLY 443 Ca 0.00 -2.53 -0.21 0.00 0.00 0.00 0.00 46.02 43.27 1toz n GLY 443 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1toz s TYR 444 N -2.12 3.18 0.00 1.61 1.51 -1.24 -4.29 117.35 116.00 1toz s TYR 444 Ca 0.38 -0.12 0.00 0.00 -1.01 0.00 0.00 57.07 56.32 1toz s TYR 444 Cb 0.13 -1.54 0.00 0.00 -0.11 0.00 0.00 41.96 40.45 1toz s TYR 444 CO -0.05 0.42 0.00 -2.37 -1.11 0.00 0.00 175.55 172.45 1toz n THR 445 N -1.30 0.00 0.00 -0.71 5.66 3.86 -4.83 114.28 116.95 1toz n THR 445 Ca -0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1toz n THR 445 Cb 0.58 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 1toz n THR 445 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1toz n GLY 446 N 5.00 -2.27 0.15 1.09 0.00 -1.22 -2.32 105.19 105.62 1toz n GLY 446 Ca 0.00 -1.44 0.02 0.00 0.00 0.00 0.00 46.02 44.60 1toz n GLY 446 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1toz h PRO 447 N 0.00 0.00 -0.00 1.61 0.13 -1.96 -3.21 132.00 128.57 1toz h PRO 447 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1toz h PRO 447 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1toz h PRO 447 CO 0.00 0.54 -0.46 0.54 -0.23 0.00 0.00 178.00 178.40 1toz n ARG 448 N -3.50 3.63 -0.34 0.86 5.12 -1.26 -5.01 116.66 116.17 1toz n ARG 448 Ca 0.00 -0.03 0.00 0.00 -1.93 0.00 0.00 57.85 55.89 1toz n ARG 448 Cb 0.64 -0.98 0.00 0.00 -1.16 0.00 0.00 32.46 30.97 1toz n ARG 448 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1toz n GLU 450 N -0.31 0.00 -4.64 0.00 -0.00 -0.98 -2.29 120.64 112.42 1toz n GLU 450 Ca 0.00 -0.34 -0.26 0.00 -0.00 0.00 0.00 57.16 56.56 1toz n GLU 450 Cb 0.11 0.04 -0.14 0.00 -0.00 0.00 0.00 31.44 31.45 1toz n GLU 450 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1toz s ILE 451 N 0.00 1.74 -0.23 3.84 1.09 -1.14 -1.32 121.20 125.17 1toz s ILE 451 Ca 0.01 -1.26 -0.14 0.00 -1.10 0.00 0.00 60.65 58.16 1toz s ILE 451 Cb 0.01 -1.52 -0.04 0.00 -1.06 0.00 0.00 42.46 39.85 1toz s ILE 451 CO -0.00 0.20 0.32 -0.62 -0.10 0.00 0.00 174.94 174.74 1toz s ASP 452 N -1.26 6.29 0.27 3.58 -1.08 -1.26 0.75 116.67 123.96 1toz s ASP 452 Ca 0.08 0.33 0.04 0.00 -0.52 0.00 0.00 52.55 52.49 1toz s ASP 452 Cb -0.09 -2.19 -0.03 0.00 -1.46 0.00 0.00 42.92 39.15 1toz s ASP 452 CO 0.02 -0.06 0.40 0.54 0.52 0.00 0.00 175.17 176.59 1toz s VAL 453 N 1.43 5.18 -0.86 1.11 0.11 -1.26 -4.74 120.40 121.36 1toz s VAL 453 Ca 0.14 -0.89 -0.15 0.00 -2.93 0.00 0.00 61.98 58.16 1toz s VAL 453 Cb -0.15 -3.84 0.20 0.00 -1.53 0.00 0.00 36.38 31.06 1toz s VAL 453 CO 0.08 -0.37 0.87 0.21 -3.33 0.00 0.00 175.10 172.56 1toz s ASN 454 N -4.00 6.75 0.32 3.54 3.84 -1.26 -4.78 114.94 119.36 1toz s ASN 454 Ca 0.36 -2.57 0.21 0.00 0.21 0.00 0.00 52.86 51.06 1toz s ASN 454 Cb -0.09 -2.26 1.15 0.00 -0.55 0.00 0.00 41.25 39.51 1toz s ASN 454 CO 0.30 -0.68 1.64 -1.84 -2.79 0.00 0.00 177.10 173.74 1toz n GLU 455 N 4.55 0.14 0.00 0.43 0.00 -1.26 0.42 120.64 124.92 1toz n GLU 455 Ca 0.17 0.64 0.12 0.00 0.00 0.00 0.00 57.16 58.09 1toz n GLU 455 Cb 0.47 -1.97 0.69 0.00 0.00 0.00 0.00 31.44 30.63 1toz n GLU 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1toz h VAL 457 N 0.00 0.99 -0.00 0.00 -1.51 -0.44 -1.48 116.25 113.80 1toz h VAL 457 Ca 0.00 -1.98 0.00 0.00 -1.23 0.00 0.00 66.70 63.49 1toz h VAL 457 Cb 0.09 2.20 0.00 0.00 -2.13 0.00 0.00 31.29 31.45 1toz h VAL 457 CO 0.00 0.48 -0.00 -1.20 -1.23 0.00 0.00 177.57 175.62 1toz n SER 458 N -3.42 0.98 -2.90 4.19 7.64 -0.99 -4.74 113.62 114.38 1toz n SER 458 Ca 0.00 -0.99 -0.12 0.00 1.01 0.00 0.00 58.87 58.77 1toz n SER 458 Cb 0.63 0.05 0.04 0.00 -1.01 0.00 0.00 64.21 63.93 1toz n SER 458 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1toz n ASN 459 N -0.03 -0.82 0.00 6.43 3.02 -0.72 -4.93 115.26 118.21 1toz n ASN 459 Ca 0.00 -3.26 0.12 0.00 -0.03 0.00 0.00 54.58 51.41 1toz n ASN 459 Cb 0.01 0.70 0.63 0.00 -0.61 0.00 0.00 39.78 40.52 1toz n ASN 459 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1toz n PRO 460 N 0.21 0.50 -1.29 3.52 -0.04 -0.56 -4.42 135.00 132.91 1toz n PRO 460 Ca 0.13 0.04 -0.09 0.00 -0.04 0.00 0.00 63.50 63.53 1toz n PRO 460 Cb 0.71 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.63 1toz n PRO 460 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1toz n GLN 462 N -2.71 0.00 -0.06 0.00 7.27 -1.26 -3.66 117.38 116.96 1toz n GLN 462 Ca -0.10 0.00 -0.03 0.00 0.07 0.00 0.00 57.00 56.94 1toz n GLN 462 Cb 0.32 0.00 -0.14 0.00 2.41 0.00 0.00 30.24 32.83 1toz n GLN 462 CO 0.00 0.00 0.00 0.27 0.07 0.00 0.00 177.06 177.40 1toz n ASN 463 N 0.43 0.69 0.00 1.69 6.94 -1.26 -4.17 115.26 119.58 1toz n ASN 463 Ca 0.00 0.00 0.05 0.00 -0.02 0.00 0.00 54.58 54.61 1toz n ASN 463 Cb 0.00 1.21 0.23 0.00 -2.36 0.00 0.00 39.78 38.86 1toz n ASN 463 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1toz n ASP 464 N -2.50 0.00 -4.09 0.53 10.43 -1.26 -4.43 116.55 115.23 1toz n ASP 464 Ca -0.21 0.50 -0.30 0.00 2.57 0.00 0.00 54.79 57.35 1toz n ASP 464 Cb 0.90 -0.50 -0.17 0.00 1.84 0.00 0.00 41.12 43.19 1toz n ASP 464 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1toz s ALA 465 N -3.00 1.93 -0.40 2.24 0.00 -1.24 -4.43 121.76 116.86 1toz s ALA 465 Ca 0.05 -0.89 -0.29 0.00 0.00 0.00 0.00 51.96 50.83 1toz s ALA 465 Cb 0.07 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.27 1toz s ALA 465 CO 0.20 -0.10 1.49 0.99 0.00 0.00 0.00 175.76 178.34 1toz s THR 466 N 0.99 3.80 0.60 0.00 2.01 -1.21 -4.60 115.64 117.24 1toz s THR 466 Ca -0.05 0.81 -0.19 0.00 0.31 0.00 0.00 61.69 62.57 1toz s THR 466 Cb -0.15 -4.10 -0.03 0.00 0.01 0.00 0.00 72.50 68.24 1toz s THR 466 CO -0.03 -0.71 1.29 0.00 -0.69 0.00 0.00 174.62 174.48 1toz n LEU 468 N -1.56 -2.66 -4.76 0.00 4.77 0.11 -4.93 117.00 107.97 1toz n LEU 468 Ca 0.14 -3.32 -0.38 0.00 -0.03 0.00 0.00 56.01 52.42 1toz n LEU 468 Cb 0.47 0.71 0.01 0.00 -2.33 0.00 0.00 43.42 42.29 1toz n LEU 468 CO 0.48 1.92 0.92 -0.62 -1.33 0.00 0.00 177.39 178.77 1toz s ASP 469 N 0.55 5.81 0.00 -1.43 3.68 -1.26 -1.04 116.67 122.99 1toz s ASP 469 Ca 0.31 2.58 0.00 0.00 2.13 0.00 0.00 52.55 57.56 1toz s ASP 469 Cb 0.02 -2.62 0.00 0.00 -1.45 0.00 0.00 42.92 38.87 1toz s ASP 469 CO -0.10 -1.18 0.00 0.00 0.13 0.00 0.00 175.17 174.02 1toz n GLN 470 N -0.59 0.00 -1.59 4.34 10.64 0.67 -4.91 117.38 125.93 1toz n GLN 470 Ca 0.08 0.00 -0.51 0.00 -1.83 0.00 0.00 57.00 54.74 1toz n GLN 470 Cb 0.46 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.78 1toz n GLN 470 CO 0.00 0.00 0.00 0.44 -1.83 0.00 0.00 177.06 175.67 1toz n ILE 471 N 0.00 0.37 -2.52 -0.39 -6.64 -1.26 -2.19 119.36 106.73 1toz n ILE 471 Ca 0.00 -0.18 -0.13 0.00 -1.77 0.00 0.00 62.75 60.67 1toz n ILE 471 Cb 0.00 -1.72 -0.03 0.00 -1.44 0.00 0.00 39.64 36.46 1toz n ILE 471 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1toz n GLY 472 N 5.28 -0.12 3.57 3.28 0.00 -1.26 -4.71 105.19 111.23 1toz n GLY 472 Ca 0.31 0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.27 1toz n GLY 472 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1toz s GLU 473 N -3.10 0.55 0.07 1.61 4.04 -0.93 -3.85 118.70 117.08 1toz s GLU 473 Ca 0.25 -0.03 0.00 0.00 0.04 0.00 0.00 54.97 55.23 1toz s GLU 473 Cb -0.15 0.26 -0.04 0.00 0.02 0.00 0.00 34.13 34.22 1toz s GLU 473 CO 0.33 -0.20 -0.04 -0.59 -1.84 0.00 0.00 175.26 172.91 1toz s PHE 474 N -1.86 0.65 0.05 4.83 -0.12 -1.26 0.24 117.98 120.52 1toz s PHE 474 Ca 0.03 -0.99 0.02 0.00 -0.05 0.00 0.00 56.93 55.94 1toz s PHE 474 Cb -0.01 -0.43 -0.03 0.00 -0.63 0.00 0.00 43.02 41.92 1toz s PHE 474 CO -0.03 -0.29 -0.07 1.14 -0.05 0.00 0.00 175.22 175.92 1toz s GLN 475 N -3.79 0.55 -0.18 1.99 -2.07 -0.20 -4.95 119.66 111.02 1toz s GLN 475 Ca 0.08 -0.85 -0.01 0.00 -1.82 0.00 0.00 55.36 52.76 1toz s GLN 475 Cb 0.06 -0.22 0.05 0.00 -1.09 0.00 0.00 33.01 31.81 1toz s GLN 475 CO -0.08 0.02 -0.03 0.00 -1.32 0.00 0.00 175.29 173.89 1toz s ILE 477 N 1.67 2.78 0.15 0.00 1.01 -0.97 -4.78 121.20 121.06 1toz s ILE 477 Ca -0.01 0.25 0.11 0.00 0.00 0.00 0.00 60.65 61.01 1toz s ILE 477 Cb -0.16 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.63 1toz s ILE 477 CO -0.07 -0.33 -0.25 0.00 0.00 0.00 0.00 174.94 174.28 1toz s MET 479 N -2.24 3.45 -1.11 0.00 1.00 -1.26 -4.99 119.30 114.15 1toz s MET 479 Ca 0.15 -0.42 -0.17 0.00 0.00 0.00 0.00 55.69 55.25 1toz s MET 479 Cb -0.09 -3.02 -0.07 0.00 0.00 0.00 0.00 34.83 31.65 1toz s MET 479 CO 0.07 0.59 2.12 -0.35 0.00 0.00 0.00 175.02 177.46 1toz n PRO 480 N 0.23 2.22 0.00 2.03 -0.04 -1.26 -2.95 135.00 135.24 1toz n PRO 480 Ca -0.05 -2.14 0.00 0.00 -0.04 0.00 0.00 63.50 61.27 1toz n PRO 480 Cb 0.51 -3.03 0.00 0.00 -0.04 0.00 0.00 33.50 30.95 1toz n PRO 480 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1toz n GLY 481 N 4.24 0.13 3.43 0.55 0.00 -1.26 -5.15 105.19 107.13 1toz n GLY 481 Ca 0.52 -0.09 -0.21 0.00 0.00 0.00 0.00 46.02 46.24 1toz n GLY 481 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1toz s TYR 482 N -1.10 1.89 0.35 1.61 1.51 -1.15 -3.78 117.35 116.67 1toz s TYR 482 Ca 0.00 -1.01 0.02 0.00 -1.01 0.00 0.00 57.07 55.07 1toz s TYR 482 Cb 0.00 -1.22 -0.01 0.00 -0.11 0.00 0.00 41.96 40.63 1toz s TYR 482 CO 0.00 -0.06 0.42 -1.91 -1.11 0.00 0.00 175.55 172.89 1toz n GLU 483 N -0.66 0.61 0.00 -0.62 2.13 0.92 -4.41 120.64 118.60 1toz n GLU 483 Ca -0.02 -3.06 0.00 0.00 0.66 0.00 0.00 57.16 54.74 1toz n GLU 483 Cb 0.66 2.77 0.00 0.00 0.27 0.00 0.00 31.44 35.14 1toz n GLU 483 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1toz n GLY 484 N -0.61 0.58 0.18 8.31 0.00 -1.26 -1.68 105.19 110.71 1toz n GLY 484 Ca 0.03 -2.29 -0.02 0.00 0.00 0.00 0.00 46.02 43.74 1toz n GLY 484 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1toz h VAL 485 N 0.00 1.34 -0.00 1.61 3.04 -1.98 -3.03 116.25 117.22 1toz h VAL 485 Ca 0.00 -1.69 0.00 0.00 -1.01 0.00 0.00 66.70 64.00 1toz h VAL 485 Cb 0.00 1.82 0.00 0.00 -2.01 0.00 0.00 31.29 31.10 1toz h VAL 485 CO 0.00 0.50 -0.54 1.41 -1.01 0.00 0.00 177.57 177.93 1toz n HIS 486 N -3.97 0.00 -2.96 3.17 8.25 -1.26 -4.88 115.22 113.57 1toz n HIS 486 Ca -0.02 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.27 1toz n HIS 486 Cb 0.52 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.67 1toz n HIS 486 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1toz n GLU 488 N -3.38 1.83 -3.50 0.00 4.07 -1.19 -4.40 120.64 114.08 1toz n GLU 488 Ca -0.06 -0.63 -0.38 0.00 -0.06 0.00 0.00 57.16 56.03 1toz n GLU 488 Cb 0.58 -1.05 -0.08 0.00 -0.06 0.00 0.00 31.44 30.82 1toz n GLU 488 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 1toz s VAL 489 N -1.12 5.26 0.55 6.31 -7.23 -0.68 -4.93 120.40 118.56 1toz s VAL 489 Ca 0.07 0.50 -0.21 0.00 -1.81 0.00 0.00 61.98 60.53 1toz s VAL 489 Cb 0.07 -3.64 -0.05 0.00 0.56 0.00 0.00 36.38 33.32 1toz s VAL 489 CO 0.19 0.29 1.30 0.54 -0.31 0.00 0.00 175.10 177.11 1toz s ASN 490 N 1.07 5.35 0.73 4.85 2.20 -1.26 -0.05 114.94 127.81 1toz s ASN 490 Ca 0.14 2.63 -0.06 0.00 -0.94 0.00 0.00 52.86 54.64 1toz s ASN 490 Cb -0.14 -2.62 0.09 0.00 -2.00 0.00 0.00 41.25 36.58 1toz s ASN 490 CO 0.07 -1.51 0.21 1.07 -2.94 0.00 0.00 177.10 174.00 1toz n THR 491 N -1.08 0.00 -1.19 0.54 5.66 -1.25 -4.73 114.28 112.22 1toz n THR 491 Ca 0.11 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.80 1toz n THR 491 Cb 0.46 -0.24 0.12 0.00 -1.55 0.00 0.00 70.33 69.12 1toz n THR 491 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1toz s ASP 492 N -1.74 3.91 -0.05 1.09 2.15 -1.26 -4.84 116.67 115.92 1toz s ASP 492 Ca 0.16 1.69 0.10 0.00 0.43 0.00 0.00 52.55 54.93 1toz s ASP 492 Cb -0.03 -2.37 0.17 0.00 -0.30 0.00 0.00 42.92 40.40 1toz s ASP 492 CO 0.14 -2.39 1.08 -0.62 -0.17 0.00 0.00 175.17 173.20 1toz n GLU 493 N -3.74 0.46 -2.55 4.34 4.71 -1.26 -4.78 120.64 117.81 1toz n GLU 493 Ca 0.08 -1.75 -0.04 0.00 -0.01 0.00 0.00 57.16 55.44 1toz n GLU 493 Cb 0.54 -0.78 0.09 0.00 -1.01 0.00 0.00 31.44 30.28 1toz n GLU 493 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1toz h ALA 495 N 1.31 1.00 0.00 0.00 0.00 -2.01 -3.11 119.26 116.46 1toz h ALA 495 Ca -0.36 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 1toz h ALA 495 Cb 1.26 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.04 1toz h ALA 495 CO -0.13 0.00 -0.54 1.03 0.00 0.00 0.00 179.25 179.62 1toz h SER 496 N 0.00 0.00 -3.45 0.00 0.87 -2.00 -3.43 113.55 105.54 1toz h SER 496 Ca 0.00 -0.31 -0.71 0.00 -1.23 0.00 0.00 61.79 59.54 1toz h SER 496 Cb 0.38 0.00 -0.32 0.00 -0.44 0.00 0.00 62.40 62.02 1toz h SER 496 CO 0.00 0.96 -0.47 -0.44 -0.53 0.00 0.00 176.83 176.35 1toz s SER 497 N -6.10 5.45 0.00 6.23 0.01 -1.18 -4.91 113.70 113.21 1toz s SER 497 Ca -0.16 -2.04 0.24 0.00 1.31 0.00 0.00 55.95 55.29 1toz s SER 497 Cb 0.02 -1.91 1.37 0.00 0.21 0.00 0.00 66.02 65.71 1toz s SER 497 CO 0.36 -0.60 1.79 -0.81 0.41 0.00 0.00 173.24 174.39 1toz n PRO 498 N 4.65 0.65 -2.26 12.44 -0.04 -1.22 -4.76 135.00 144.46 1toz n PRO 498 Ca -0.04 0.02 -0.11 0.00 -0.04 0.00 0.00 63.50 63.33 1toz n PRO 498 Cb 0.41 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.37 1toz n PRO 498 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1toz n LEU 500 N -1.60 2.47 0.00 0.00 -0.00 -1.25 0.20 117.00 116.82 1toz n LEU 500 Ca -0.11 1.07 0.00 0.00 -0.00 0.00 0.00 56.01 56.97 1toz n LEU 500 Cb 0.59 -1.25 0.00 0.00 -0.00 0.00 0.00 43.42 42.76 1toz n LEU 500 CO 0.16 -0.54 0.00 0.00 -0.00 0.00 0.00 177.39 177.01 1toz n HIS 501 N 4.34 0.00 0.28 1.96 1.44 -1.26 -4.53 115.22 117.45 1toz n HIS 501 Ca 0.21 0.00 0.18 0.00 -2.01 0.00 0.00 57.72 56.10 1toz n HIS 501 Cb 0.21 0.00 0.74 0.00 0.12 0.00 0.00 29.99 31.05 1toz n HIS 501 CO 0.00 0.00 0.00 -0.91 -2.81 0.00 0.00 176.34 172.62 1toz h ASN 502 N 0.00 0.00 0.00 4.39 2.35 -1.18 -3.44 115.58 117.71 1toz h ASN 502 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1toz h ASN 502 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1toz h ASN 502 CO 0.00 0.01 0.00 0.61 -1.65 0.00 0.00 177.43 176.40 1toz n GLY 503 N -0.08 0.07 3.01 2.83 0.00 0.54 -4.25 105.19 107.31 1toz n GLY 503 Ca 0.00 -1.20 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 1toz n GLY 503 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1toz s ARG 504 N -2.00 1.91 -0.21 1.61 3.52 -0.92 -3.92 118.95 118.95 1toz s ARG 504 Ca 0.00 -0.45 -0.29 0.00 -0.13 0.00 0.00 55.73 54.86 1toz s ARG 504 Cb 0.00 -1.69 -0.01 0.00 -1.56 0.00 0.00 34.95 31.69 1toz s ARG 504 CO 0.00 -0.09 1.30 0.00 -0.81 0.00 0.00 175.30 175.70 1toz s LEU 506 N 3.87 4.39 -0.80 0.00 2.96 -0.19 -4.92 118.68 124.00 1toz s LEU 506 Ca 0.57 0.52 -0.11 0.00 -0.22 0.00 0.00 54.13 54.88 1toz s LEU 506 Cb -0.21 -2.28 0.21 0.00 0.50 0.00 0.00 46.19 44.42 1toz s LEU 506 CO 0.18 0.36 0.71 -0.62 -1.32 0.00 0.00 176.35 175.67 1toz s ASP 507 N -1.24 6.41 0.60 3.68 3.68 -1.26 -1.72 116.67 126.82 1toz s ASP 507 Ca 0.19 -2.82 -0.06 0.00 2.13 0.00 0.00 52.55 52.00 1toz s ASP 507 Cb -0.13 -2.12 0.02 0.00 -1.45 0.00 0.00 42.92 39.24 1toz s ASP 507 CO 0.09 -0.50 0.91 -0.54 0.13 0.00 0.00 175.17 175.26 1toz s LYS 508 N -0.02 2.83 -1.31 4.34 -0.14 0.70 -4.93 119.74 121.20 1toz s LYS 508 Ca 0.19 -0.05 -0.10 0.00 -1.36 0.00 0.00 55.97 54.65 1toz s LYS 508 Cb -0.12 -2.26 0.14 0.00 -1.68 0.00 0.00 37.83 33.90 1toz s LYS 508 CO -0.08 -0.76 1.98 -0.89 -0.76 0.00 0.00 175.35 174.84 1toz n ILE 509 N -2.62 4.27 0.00 2.17 -0.00 -1.26 -3.29 119.36 118.63 1toz n ILE 509 Ca 0.05 -4.16 0.00 0.00 -0.00 0.00 0.00 62.75 58.64 1toz n ILE 509 Cb 0.58 -2.38 0.00 0.00 -0.00 0.00 0.00 39.64 37.84 1toz n ILE 509 CO 0.00 0.00 0.00 0.59 -0.00 0.00 0.00 176.55 177.14 1toz n ASN 510 N 4.05 0.00 -2.21 4.38 4.13 -1.26 -4.90 115.26 119.45 1toz n ASN 510 Ca 0.43 0.00 0.01 0.00 1.68 0.00 0.00 54.58 56.70 1toz n ASN 510 Cb 0.36 0.00 0.01 0.00 -1.54 0.00 0.00 39.78 38.60 1toz n ASN 510 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 1toz n GLU 511 N 0.00 0.11 -4.76 3.52 2.13 -1.21 -5.14 120.64 115.29 1toz n GLU 511 Ca 0.00 -0.38 -0.31 0.00 0.66 0.00 0.00 57.16 57.13 1toz n GLU 511 Cb 0.00 0.60 -0.13 0.00 0.27 0.00 0.00 31.44 32.18 1toz n GLU 511 CO 0.00 0.00 0.00 -0.59 -0.41 0.00 0.00 177.13 176.13 1toz s PHE 512 N -2.85 2.54 -0.27 4.31 -0.12 -1.26 -0.22 117.98 120.11 1toz s PHE 512 Ca 0.13 -0.27 0.03 0.00 -0.05 0.00 0.00 56.93 56.76 1toz s PHE 512 Cb -0.00 -1.48 0.07 0.00 -0.63 0.00 0.00 43.02 40.97 1toz s PHE 512 CO 0.00 0.21 -0.07 -1.14 -0.05 0.00 0.00 175.22 174.17 1toz s GLN 513 N -1.27 2.00 -1.18 1.99 0.74 -0.70 -4.89 119.66 116.34 1toz s GLN 513 Ca 0.14 -1.37 -0.23 0.00 0.05 0.00 0.00 55.36 53.95 1toz s GLN 513 Cb -0.10 -2.88 -0.09 0.00 1.10 0.00 0.00 33.01 31.04 1toz s GLN 513 CO 0.04 -0.64 1.94 0.00 -0.55 0.00 0.00 175.29 176.08 1toz n GLU 515 N 8.28 -0.62 -3.86 0.00 -0.58 0.45 -4.59 120.64 119.72 1toz n GLU 515 Ca 0.45 -0.17 -0.35 0.00 -0.42 0.00 0.00 57.16 56.66 1toz n GLU 515 Cb 0.47 -1.29 -0.08 0.00 -0.57 0.00 0.00 31.44 29.96 1toz n GLU 515 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1toz s PRO 517 N -0.08 0.01 -0.32 0.00 0.04 -1.26 -4.74 135.00 128.64 1toz s PRO 517 Ca 0.09 -0.13 0.16 0.00 0.04 0.00 0.00 61.00 61.16 1toz s PRO 517 Cb -0.12 -1.75 0.44 0.00 0.04 0.00 0.00 34.50 33.12 1toz s PRO 517 CO 0.00 -2.88 1.28 -2.37 0.04 0.00 0.00 177.00 173.07 1toz n THR 518 N -4.16 0.55 0.01 1.26 5.66 -1.26 -4.27 114.28 112.08 1toz n THR 518 Ca 0.13 -2.03 0.00 0.00 -3.05 0.00 0.00 64.05 59.10 1toz n THR 518 Cb 0.59 1.03 0.00 0.00 -1.55 0.00 0.00 70.33 70.41 1toz n THR 518 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1toz n GLY 519 N -0.82 -0.14 3.69 1.09 0.00 -1.26 -4.93 105.19 102.82 1toz n GLY 519 Ca -0.03 0.02 -0.56 0.00 0.00 0.00 0.00 46.02 45.45 1toz n GLY 519 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1toz n PHE 520 N -2.57 2.03 -0.30 1.61 -1.74 -1.26 -4.54 117.46 110.69 1toz n PHE 520 Ca 0.00 0.47 0.04 0.00 -0.56 0.00 0.00 57.45 57.40 1toz n PHE 520 Cb 0.00 -2.47 -0.02 0.00 1.52 0.00 0.00 39.48 38.51 1toz n PHE 520 CO 0.00 0.00 0.00 -2.37 -0.56 0.00 0.00 176.76 173.83 1toz n THR 521 N 4.41 -0.07 0.00 1.97 5.66 -1.26 -4.79 114.28 120.20 1toz n THR 521 Ca 0.25 0.14 0.00 0.00 -3.05 0.00 0.00 64.05 61.39 1toz n THR 521 Cb 0.16 -0.24 0.00 0.00 -1.55 0.00 0.00 70.33 68.70 1toz n THR 521 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1toz n GLY 522 N -2.74 -0.80 1.07 1.09 0.00 -1.26 -4.75 105.19 97.81 1toz n GLY 522 Ca -0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 1toz n GLY 522 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1toz n HIS 523 N 0.00 -2.76 -4.11 1.61 8.25 -1.26 -4.89 115.22 112.06 1toz n HIS 523 Ca 0.00 -0.28 -0.21 0.00 -0.26 0.00 0.00 57.72 56.96 1toz n HIS 523 Cb 0.00 -0.40 -0.02 0.00 1.12 0.00 0.00 29.99 30.68 1toz n HIS 523 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 1toz n LEU 524 N 0.00 0.00 -4.81 2.41 -0.00 -1.26 -4.76 117.00 108.57 1toz n LEU 524 Ca 0.05 -2.21 -0.34 0.00 -0.00 0.00 0.00 56.01 53.50 1toz n LEU 524 Cb 0.20 0.09 -0.07 0.00 -0.00 0.00 0.00 43.42 43.65 1toz n LEU 524 CO 0.13 -0.43 0.57 0.00 -0.00 0.00 0.00 177.39 177.66