#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1toz n ASP 412 N 0.00 0.81 -4.86 1.08 2.03 -1.26 -4.96 116.55 109.39 1toz n ASP 412 Ca 0.00 -3.27 -0.32 0.00 0.52 0.00 0.00 54.79 51.72 1toz n ASP 412 Cb 0.00 1.22 -0.06 0.00 -0.72 0.00 0.00 41.12 41.56 1toz n ASP 412 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1toz s VAL 413 N -3.21 4.79 -1.28 5.18 0.11 -1.26 -4.98 120.40 119.74 1toz s VAL 413 Ca 0.26 0.74 -0.14 0.00 -2.93 0.00 0.00 61.98 59.91 1toz s VAL 413 Cb 0.01 -3.62 0.13 0.00 -1.53 0.00 0.00 36.38 31.37 1toz s VAL 413 CO 0.18 -0.15 1.72 -0.67 -3.33 0.00 0.00 175.10 172.85 1toz n ASP 414 N -0.30 4.94 0.11 3.54 4.64 -1.26 -4.62 116.55 123.60 1toz n ASP 414 Ca 0.02 -2.97 0.07 0.00 -1.38 0.00 0.00 54.79 50.53 1toz n ASP 414 Cb 0.53 -1.61 0.40 0.00 -1.04 0.00 0.00 41.12 39.39 1toz n ASP 414 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1toz n GLU 415 N 6.06 0.09 0.08 -0.67 4.71 -1.26 0.13 120.64 129.78 1toz n GLU 415 Ca 0.43 0.59 0.13 0.00 -0.01 0.00 0.00 57.16 58.29 1toz n GLU 415 Cb 0.42 -1.83 0.30 0.00 -1.01 0.00 0.00 31.44 29.31 1toz n GLU 415 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1toz n SER 417 N -2.15 1.25 0.00 0.00 2.88 0.34 -4.47 113.62 111.47 1toz n SER 417 Ca 0.05 -0.46 0.00 0.00 -1.33 0.00 0.00 58.87 57.12 1toz n SER 417 Cb 0.43 1.10 0.00 0.00 -0.75 0.00 0.00 64.21 64.99 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 -1.34 0.11 -0.36 2.46 4.77 0.85 -4.90 117.00 118.59 1toz n LEU 418 Ca 0.01 0.01 0.00 0.00 -0.03 0.00 0.00 56.01 55.99 1toz n LEU 418 Cb 0.13 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1toz n LEU 418 CO 0.14 0.00 0.22 0.61 -1.33 0.00 0.00 177.39 177.03 1toz n GLY 419 N 1.97 0.09 2.80 -0.72 0.00 -1.25 -4.99 105.19 103.09 1toz n GLY 419 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1toz n GLY 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1toz s ALA 420 N 0.00 3.06 -0.30 4.61 0.00 -0.53 -5.05 121.76 123.55 1toz s ALA 420 Ca 0.00 -3.31 0.00 0.00 0.00 0.00 0.00 51.96 48.65 1toz s ALA 420 Cb 0.00 -2.03 0.06 0.00 0.00 0.00 0.00 23.12 21.16 1toz s ALA 420 CO 0.00 -2.06 -0.02 1.21 0.00 0.00 0.00 175.76 174.90 1toz s ASN 421 N -0.70 4.76 0.09 0.00 2.47 -1.26 -3.60 114.94 116.70 1toz s ASN 421 Ca 0.23 -1.45 -0.13 0.00 0.42 0.00 0.00 52.86 51.94 1toz s ASN 421 Cb -0.10 -1.66 -0.19 0.00 -1.45 0.00 0.00 41.25 37.84 1toz s ASN 421 CO -0.11 -0.27 1.24 1.55 -3.72 0.00 0.00 177.10 175.79 1toz h PRO 422 N 7.89 0.72 -0.73 0.43 0.13 -1.92 -3.04 132.00 135.47 1toz h PRO 422 Ca -0.18 -0.70 0.21 0.00 -0.87 0.00 0.00 66.00 64.46 1toz h PRO 422 Cb 1.05 0.18 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 1toz h PRO 422 CO 0.52 1.29 0.92 0.00 -0.23 0.00 0.00 178.00 180.50 1toz n GLU 424 N -3.33 0.00 -2.08 0.00 -0.58 -1.15 -2.07 120.64 111.43 1toz n GLU 424 Ca 0.16 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.90 1toz n GLU 424 Cb 1.16 0.00 0.03 0.00 -0.57 0.00 0.00 31.44 32.06 1toz n GLU 424 CO 0.00 0.00 0.00 -2.39 -0.48 0.00 0.00 177.13 174.26 1toz n HIS 425 N 0.00 0.22 0.00 -0.32 1.44 -1.26 -5.02 115.22 110.28 1toz n HIS 425 Ca 0.00 -1.25 0.00 0.00 -2.01 0.00 0.00 57.72 54.46 1toz n HIS 425 Cb 0.00 0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.21 1toz n HIS 425 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1toz n ALA 426 N -0.21 0.00 0.00 1.59 0.00 -0.88 -5.10 120.51 115.91 1toz n ALA 426 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1toz n ALA 426 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.38 1toz n ALA 426 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1toz n GLY 427 N 0.00 1.30 3.68 0.00 0.00 -1.26 -4.72 105.19 104.19 1toz n GLY 427 Ca 0.00 -1.41 -0.37 0.00 0.00 0.00 0.00 46.02 44.24 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 -1.85 4.15 -0.31 1.61 2.47 -1.01 -4.95 119.74 119.86 1toz s LYS 428 Ca 0.00 -0.05 -0.03 0.00 -1.56 0.00 0.00 55.97 54.33 1toz s LYS 428 Cb 0.00 -3.50 0.04 0.00 -1.46 0.00 0.00 37.83 32.91 1toz s LYS 428 CO 0.00 0.09 0.03 0.00 0.16 0.00 0.00 175.35 175.62 1toz s ILE 430 N 1.31 2.40 -0.12 0.00 -0.00 0.67 -4.90 121.20 120.56 1toz s ILE 430 Ca -0.03 -1.75 -0.02 0.00 -0.00 0.00 0.00 60.65 58.84 1toz s ILE 430 Cb -0.19 -2.97 -0.03 0.00 -0.00 0.00 0.00 42.46 39.27 1toz s ILE 430 CO -0.00 -0.04 -0.03 0.21 -0.00 0.00 0.00 174.94 175.07 1toz s ASN 431 N -3.86 4.91 0.26 4.36 2.47 -1.26 -1.34 114.94 120.48 1toz s ASN 431 Ca 0.40 -0.02 0.07 0.00 0.42 0.00 0.00 52.86 53.73 1toz s ASN 431 Cb 0.03 -1.55 -0.05 0.00 -1.45 0.00 0.00 41.25 38.23 1toz s ASN 431 CO 0.22 0.28 -0.09 0.42 -3.72 0.00 0.00 177.10 174.20 1toz s THR 432 N -0.27 1.74 -0.07 -5.21 -4.23 -0.34 -4.68 115.64 102.58 1toz s THR 432 Ca 0.05 -2.17 -0.30 0.00 -1.18 0.00 0.00 61.69 58.10 1toz s THR 432 Cb -0.13 -2.35 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 1toz s THR 432 CO 0.02 -0.37 1.39 -0.76 -0.54 0.00 0.00 174.62 174.35 1toz s LEU 433 N -3.42 4.27 0.00 4.79 1.43 -1.26 -3.25 118.68 121.23 1toz s LEU 433 Ca 0.28 1.97 0.00 0.00 -1.03 0.00 0.00 54.13 55.35 1toz s LEU 433 Cb 0.02 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1toz s LEU 433 CO 0.11 -0.76 0.00 0.61 0.23 0.00 0.00 176.35 176.54 1toz n GLY 434 N 3.70 1.54 3.32 -3.19 0.00 -1.26 -4.87 105.19 104.43 1toz n GLY 434 Ca 0.14 -0.14 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 1.41 0.03 1.61 0.01 -1.20 -5.02 113.70 110.53 1toz s SER 435 Ca 0.00 -1.34 -0.01 0.00 1.31 0.00 0.00 55.95 55.92 1toz s SER 435 Cb 0.00 0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.30 1toz s SER 435 CO 0.00 -0.67 0.16 0.72 0.41 0.00 0.00 173.24 173.86 1toz s PHE 436 N -3.65 3.46 0.03 2.43 -0.71 -1.26 -1.20 117.98 117.08 1toz s PHE 436 Ca 0.35 0.26 0.05 0.00 -1.04 0.00 0.00 56.93 56.55 1toz s PHE 436 Cb 0.07 -1.77 -0.03 0.00 -1.21 0.00 0.00 43.02 40.09 1toz s PHE 436 CO 0.12 0.60 -0.12 -2.00 -1.34 0.00 0.00 175.22 172.48 1toz s GLU 437 N -2.16 2.30 -0.06 1.99 2.12 -0.45 -4.77 118.70 117.67 1toz s GLU 437 Ca 0.30 -0.87 -0.03 0.00 0.36 0.00 0.00 54.97 54.73 1toz s GLU 437 Cb -0.13 -2.35 0.04 0.00 0.26 0.00 0.00 34.13 31.95 1toz s GLU 437 CO 0.22 0.56 0.13 0.00 -0.54 0.00 0.00 175.26 175.63 1toz s GLN 439 N 1.60 3.86 0.62 0.00 -0.21 0.33 -4.40 119.66 121.46 1toz s GLN 439 Ca -0.04 0.73 -0.06 0.00 0.02 0.00 0.00 55.36 56.00 1toz s GLN 439 Cb -0.12 -2.25 0.02 0.00 1.00 0.00 0.00 33.01 31.66 1toz s GLN 439 CO -0.05 -0.17 0.94 0.00 -2.12 0.00 0.00 175.29 173.89 1toz s LEU 441 N -5.07 0.78 0.00 0.00 -0.00 -1.26 -4.68 118.68 108.44 1toz s LEU 441 Ca 0.56 0.46 0.00 0.00 -0.00 0.00 0.00 54.13 55.14 1toz s LEU 441 Cb -0.11 1.18 0.00 0.00 -0.00 0.00 0.00 46.19 47.27 1toz s LEU 441 CO 0.46 -0.23 0.00 0.00 -0.00 0.00 0.00 176.35 176.57 1toz n GLN 442 N 2.32 0.00 -3.15 1.48 1.13 -1.26 -2.53 117.38 115.36 1toz n GLN 442 Ca -0.16 0.00 -0.22 0.00 -1.94 0.00 0.00 57.00 54.68 1toz n GLN 442 Cb 0.57 0.00 -0.06 0.00 0.11 0.00 0.00 30.24 30.86 1toz n GLN 442 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1toz n GLY 443 N 0.00 2.20 3.91 1.08 0.00 -1.20 -5.05 105.19 106.14 1toz n GLY 443 Ca 0.00 -1.21 -0.22 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.62 3.32 0.00 1.61 1.51 -1.05 -4.29 117.35 117.83 1toz s TYR 444 Ca 0.34 -0.05 0.00 0.00 -1.01 0.00 0.00 57.07 56.35 1toz s TYR 444 Cb 0.15 -1.51 0.00 0.00 -0.11 0.00 0.00 41.96 40.49 1toz s TYR 444 CO -0.14 0.47 0.00 -2.37 -1.11 0.00 0.00 175.55 172.40 1toz n THR 445 N -1.28 0.00 0.00 -0.71 5.66 3.93 -4.83 114.28 117.05 1toz n THR 445 Ca -0.08 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 1toz n THR 445 Cb 0.57 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.35 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 -1.22 0.16 1.09 0.00 -1.22 -2.09 105.19 106.91 1toz n GLY 446 Ca 0.00 -1.58 -0.12 0.00 0.00 0.00 0.00 46.02 44.31 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 0.41 -0.01 1.61 0.13 -1.96 -3.28 132.00 128.91 1toz h PRO 447 Ca 0.00 -0.40 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 1toz h PRO 447 Cb 0.00 0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.23 1toz h PRO 447 CO 0.00 1.06 -0.27 0.54 -0.23 0.00 0.00 178.00 179.10 1toz n ARG 448 N -3.77 2.10 -0.25 0.86 1.74 -1.26 -5.00 116.66 111.07 1toz n ARG 448 Ca -0.06 -0.59 0.00 0.00 -0.77 0.00 0.00 57.85 56.43 1toz n ARG 448 Cb 0.79 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 31.11 1toz n ARG 448 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1toz n GLU 450 N -0.16 0.00 -4.34 0.00 0.00 -0.89 -3.27 120.64 111.98 1toz n GLU 450 Ca 0.00 -0.46 -0.20 0.00 0.00 0.00 0.00 57.16 56.50 1toz n GLU 450 Cb 0.07 0.33 -0.13 0.00 0.00 0.00 0.00 31.44 31.72 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 1.10 -0.19 3.84 1.09 -1.14 -1.49 121.20 124.41 1toz s ILE 451 Ca 0.00 -1.01 -0.11 0.00 -1.10 0.00 0.00 60.65 58.42 1toz s ILE 451 Cb 0.00 -1.00 -0.05 0.00 -1.06 0.00 0.00 42.46 40.35 1toz s ILE 451 CO 0.00 -0.01 0.19 1.51 -0.10 0.00 0.00 174.94 176.53 1toz s ASP 452 N -1.17 6.27 0.36 3.58 -4.77 -1.26 0.76 116.67 120.45 1toz s ASP 452 Ca 0.01 0.31 0.04 0.00 -3.30 0.00 0.00 52.55 49.61 1toz s ASP 452 Cb -0.08 -2.12 -0.01 0.00 -1.09 0.00 0.00 42.92 39.62 1toz s ASP 452 CO 0.01 0.14 0.52 0.54 0.70 0.00 0.00 175.17 177.08 1toz s VAL 453 N 0.49 4.31 -0.66 2.11 0.11 -1.26 -4.74 120.40 120.76 1toz s VAL 453 Ca 0.11 -0.79 -0.13 0.00 -2.93 0.00 0.00 61.98 58.24 1toz s VAL 453 Cb -0.12 -3.53 0.17 0.00 -1.53 0.00 0.00 36.38 31.36 1toz s VAL 453 CO 0.01 -0.27 0.58 0.21 -3.33 0.00 0.00 175.10 172.30 1toz s ASN 454 N -4.15 6.28 0.00 3.54 2.47 -1.26 -4.75 114.94 117.07 1toz s ASN 454 Ca 0.44 -2.27 0.01 0.00 0.42 0.00 0.00 52.86 51.46 1toz s ASN 454 Cb -0.10 -2.15 0.05 0.00 -1.45 0.00 0.00 41.25 37.60 1toz s ASN 454 CO 0.33 -0.68 1.02 -0.62 -3.72 0.00 0.00 177.10 173.44 1toz n GLU 455 N 4.53 0.00 -0.12 0.43 4.71 -1.26 0.10 120.64 129.03 1toz n GLU 455 Ca 0.00 0.47 0.03 0.00 -0.01 0.00 0.00 57.16 57.66 1toz n GLU 455 Cb 0.43 -1.50 0.10 0.00 -1.01 0.00 0.00 31.44 29.45 1toz n GLU 455 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1toz h VAL 457 N 1.25 1.12 -0.01 0.00 -1.51 -0.76 -3.03 116.25 113.32 1toz h VAL 457 Ca 0.00 -2.88 0.00 0.00 -1.23 0.00 0.00 66.70 62.59 1toz h VAL 457 Cb 0.32 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.10 1toz h VAL 457 CO 0.01 0.72 -0.05 -1.20 -1.23 0.00 0.00 177.57 175.82 1toz n SER 458 N -3.25 1.18 -2.98 4.19 7.64 -1.21 -4.69 113.62 114.50 1toz n SER 458 Ca -0.14 -1.09 -0.14 0.00 1.01 0.00 0.00 58.87 58.51 1toz n SER 458 Cb 1.02 0.21 0.01 0.00 -1.01 0.00 0.00 64.21 64.45 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 -0.01 0.03 0.00 6.43 3.02 -0.98 -4.91 115.26 118.84 1toz n ASN 459 Ca 0.03 -3.10 0.11 0.00 -0.03 0.00 0.00 54.58 51.59 1toz n ASN 459 Cb 0.12 0.07 0.57 0.00 -0.61 0.00 0.00 39.78 39.93 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 0.20 0.30 -1.44 3.52 -0.04 -1.14 -4.47 135.00 131.93 1toz n PRO 460 Ca 0.17 0.07 -0.07 0.00 -0.04 0.00 0.00 63.50 63.63 1toz n PRO 460 Cb 0.70 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.64 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 -2.52 0.00 -1.35 0.00 10.64 -1.26 -1.81 117.38 121.07 1toz n GLN 462 Ca -0.08 0.00 -0.34 0.00 -1.83 0.00 0.00 57.00 54.75 1toz n GLN 462 Cb 0.32 0.00 0.07 0.00 -0.86 0.00 0.00 30.24 29.77 1toz n GLN 462 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1toz n ASN 463 N -3.34 7.59 -0.97 2.61 3.02 -1.26 -4.07 115.26 118.84 1toz n ASN 463 Ca 0.00 -3.73 0.03 0.00 -0.03 0.00 0.00 54.58 50.85 1toz n ASN 463 Cb 0.00 -1.00 0.04 0.00 -0.61 0.00 0.00 39.78 38.21 1toz n ASN 463 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1toz n ASP 464 N -0.77 0.79 0.00 6.41 9.92 -0.75 -5.07 116.55 127.08 1toz n ASP 464 Ca 0.59 -2.24 0.00 0.00 -0.53 0.00 0.00 54.79 52.61 1toz n ASP 464 Cb 0.61 -0.29 0.00 0.00 -0.64 0.00 0.00 41.12 40.80 1toz n ASP 464 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1toz n ALA 465 N 0.05 0.00 -2.59 2.24 0.00 -1.14 -4.54 120.51 114.53 1toz n ALA 465 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.07 1toz n ALA 465 Cb 0.91 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.33 1toz n ALA 465 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1toz s THR 466 N -1.53 4.30 0.53 0.00 2.01 0.21 -4.71 115.64 116.43 1toz s THR 466 Ca 0.00 0.94 -0.22 0.00 0.31 0.00 0.00 61.69 62.72 1toz s THR 466 Cb 0.00 -4.55 -0.05 0.00 0.01 0.00 0.00 72.50 67.91 1toz s THR 466 CO 0.00 -0.99 1.34 0.00 -0.69 0.00 0.00 174.62 174.28 1toz s LEU 468 N -3.42 -1.46 0.31 0.00 1.43 0.13 -4.93 118.68 110.73 1toz s LEU 468 Ca 0.70 -0.86 -0.29 0.00 -1.03 0.00 0.00 54.13 52.65 1toz s LEU 468 Cb -0.39 1.87 -0.10 0.00 0.03 0.00 0.00 46.19 47.60 1toz s LEU 468 CO 0.46 -0.15 1.33 -0.62 0.23 0.00 0.00 176.35 177.61 1toz s ASP 469 N 1.74 6.75 0.00 2.29 3.68 -1.26 0.40 116.67 130.26 1toz s ASP 469 Ca 0.18 2.68 0.00 0.00 2.13 0.00 0.00 52.55 57.54 1toz s ASP 469 Cb -0.03 -2.64 0.00 0.00 -1.45 0.00 0.00 42.92 38.80 1toz s ASP 469 CO -0.07 -0.57 0.00 0.00 0.13 0.00 0.00 175.17 174.66 1toz n GLN 470 N 1.15 1.53 -2.21 4.34 6.02 0.84 -4.85 117.38 124.21 1toz n GLN 470 Ca 0.01 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.58 1toz n GLN 470 Cb 0.41 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.65 1toz n GLN 470 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 1toz s ILE 471 N -1.15 3.93 -0.43 5.09 -5.25 -1.26 -2.98 121.20 119.15 1toz s ILE 471 Ca 0.00 1.12 0.00 0.00 -0.99 0.00 0.00 60.65 60.78 1toz s ILE 471 Cb 0.00 -3.72 0.00 0.00 2.95 0.00 0.00 42.46 41.69 1toz s ILE 471 CO 0.00 -0.10 0.00 0.61 -1.79 0.00 0.00 174.94 173.66 1toz n GLY 472 N 3.88 0.19 3.56 6.27 0.00 -1.26 -4.77 105.19 113.06 1toz n GLY 472 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.96 0.65 0.25 1.61 -1.05 -1.16 -3.25 118.70 112.79 1toz s GLU 473 Ca 0.00 0.01 0.09 0.00 -0.15 0.00 0.00 54.97 54.92 1toz s GLU 473 Cb 0.00 0.30 -0.05 0.00 -0.44 0.00 0.00 34.13 33.94 1toz s GLU 473 CO 0.00 -0.23 -0.14 -0.59 0.95 0.00 0.00 175.26 175.24 1toz s PHE 474 N -1.72 1.97 -0.02 4.83 -0.71 -1.26 0.29 117.98 121.36 1toz s PHE 474 Ca 0.00 -0.52 -0.01 0.00 -1.04 0.00 0.00 56.93 55.37 1toz s PHE 474 Cb -0.01 -0.94 0.01 0.00 -1.21 0.00 0.00 43.02 40.87 1toz s PHE 474 CO -0.01 0.47 0.04 1.14 -1.34 0.00 0.00 175.22 175.51 1toz s GLN 475 N -3.62 0.02 -0.20 1.99 -2.07 0.16 -4.83 119.66 111.12 1toz s GLN 475 Ca 0.27 0.10 -0.00 0.00 -1.82 0.00 0.00 55.36 53.90 1toz s GLN 475 Cb -0.01 -0.06 0.05 0.00 -1.09 0.00 0.00 33.01 31.90 1toz s GLN 475 CO 0.11 -0.05 -0.04 0.00 -1.32 0.00 0.00 175.29 173.98 1toz s ILE 477 N 1.55 4.63 0.39 0.00 -1.09 -0.86 -4.75 121.20 121.07 1toz s ILE 477 Ca -0.02 1.97 0.00 0.00 -2.23 0.00 0.00 60.65 60.37 1toz s ILE 477 Cb -0.17 -4.27 0.00 0.00 -1.58 0.00 0.00 42.46 36.44 1toz s ILE 477 CO -0.07 -0.18 0.01 0.00 -1.23 0.00 0.00 174.94 173.47 1toz s MET 479 N -3.43 4.12 -0.57 0.00 -1.94 -1.26 -4.94 119.30 111.28 1toz s MET 479 Ca 0.01 0.78 -0.06 0.00 -1.71 0.00 0.00 55.69 54.71 1toz s MET 479 Cb -0.00 -2.57 -0.14 0.00 2.01 0.00 0.00 34.83 34.13 1toz s MET 479 CO 0.00 0.23 2.68 -0.35 -0.01 0.00 0.00 175.02 177.57 1toz n PRO 480 N 0.00 2.10 0.00 2.03 -0.04 -1.26 -2.90 135.00 134.93 1toz n PRO 480 Ca 0.02 -1.23 0.00 0.00 -0.04 0.00 0.00 63.50 62.25 1toz n PRO 480 Cb 0.52 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.77 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 3.12 0.10 3.98 0.55 0.00 -1.26 -5.13 105.19 106.55 1toz n GLY 481 Ca 0.45 -0.06 -0.18 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.05 2.58 0.27 1.61 2.02 -1.14 -3.53 117.35 118.10 1toz s TYR 482 Ca 0.00 -0.47 -0.06 0.00 -0.37 0.00 0.00 57.07 56.17 1toz s TYR 482 Cb 0.00 -2.30 0.02 0.00 -0.40 0.00 0.00 41.96 39.29 1toz s TYR 482 CO 0.00 -0.44 0.45 -1.91 -1.57 0.00 0.00 175.55 172.08 1toz n GLU 483 N -1.82 0.65 0.00 -0.62 2.13 0.24 -4.82 120.64 116.40 1toz n GLU 483 Ca 0.08 -1.80 0.00 0.00 0.66 0.00 0.00 57.16 56.09 1toz n GLU 483 Cb 0.60 1.95 0.00 0.00 0.27 0.00 0.00 31.44 34.26 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 -0.40 -1.86 0.16 8.31 0.00 -1.26 -0.11 105.19 110.02 1toz n GLY 484 Ca -0.03 -2.15 0.04 0.00 0.00 0.00 0.00 46.02 43.89 1toz n GLY 484 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1toz h VAL 485 N 0.00 0.72 -0.01 1.61 2.07 -2.01 -3.08 116.25 115.55 1toz h VAL 485 Ca 0.00 -1.96 0.00 0.00 0.82 0.00 0.00 66.70 65.56 1toz h VAL 485 Cb 0.00 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1toz h VAL 485 CO 0.00 0.40 -0.76 1.41 0.02 0.00 0.00 177.57 178.64 1toz n HIS 486 N -3.22 0.00 -1.30 1.57 8.25 -1.26 -4.18 115.22 115.08 1toz n HIS 486 Ca 0.02 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.38 1toz n HIS 486 Cb 0.68 -0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.74 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 -0.86 2.22 -2.91 0.00 -0.00 -1.18 -4.11 120.64 113.81 1toz n GLU 488 Ca -0.10 -1.95 -0.43 0.00 -0.00 0.00 0.00 57.16 54.68 1toz n GLU 488 Cb 0.57 -1.34 -0.05 0.00 -0.00 0.00 0.00 31.44 30.63 1toz n GLU 488 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 1toz s VAL 489 N -1.09 4.49 0.41 3.84 1.01 0.84 -4.85 120.40 125.05 1toz s VAL 489 Ca 0.27 0.00 -0.26 0.00 0.00 0.00 0.00 61.98 61.99 1toz s VAL 489 Cb 0.15 -4.51 -0.08 0.00 0.00 0.00 0.00 36.38 31.94 1toz s VAL 489 CO 0.20 -1.10 1.26 0.21 0.00 0.00 0.00 175.10 175.68 1toz s ASN 490 N 2.94 6.33 0.82 3.32 3.84 -1.26 0.81 114.94 131.73 1toz s ASN 490 Ca 0.26 2.55 -0.16 0.00 0.21 0.00 0.00 52.86 55.72 1toz s ASN 490 Cb -0.15 -2.63 -0.14 0.00 -0.55 0.00 0.00 41.25 37.78 1toz s ASN 490 CO 0.16 -0.82 -0.60 1.07 -2.79 0.00 0.00 177.10 174.12 1toz n THR 491 N 0.06 0.00 -3.09 -5.21 5.66 -1.23 -4.82 114.28 105.64 1toz n THR 491 Ca 0.04 -0.46 -0.32 0.00 -3.05 0.00 0.00 64.05 60.26 1toz n THR 491 Cb 0.45 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.17 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 -0.92 6.77 -0.01 1.09 2.15 -1.26 -4.89 116.67 119.59 1toz s ASP 492 Ca 0.41 1.30 0.12 0.00 0.43 0.00 0.00 52.55 54.81 1toz s ASP 492 Cb -0.23 -2.38 0.20 0.00 -0.30 0.00 0.00 42.92 40.21 1toz s ASP 492 CO 0.73 -0.23 1.08 -1.84 -0.17 0.00 0.00 175.17 174.74 1toz n GLU 493 N -0.46 0.10 0.02 4.34 0.00 -1.26 -4.79 120.64 118.58 1toz n GLU 493 Ca 0.04 -1.56 0.07 0.00 0.00 0.00 0.00 57.16 55.71 1toz n GLU 493 Cb 0.53 -0.37 0.29 0.00 0.00 0.00 0.00 31.44 31.89 1toz n GLU 493 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1toz n ALA 495 N -1.53 1.15 -3.63 0.00 0.00 -1.26 -3.60 120.51 111.63 1toz n ALA 495 Ca 0.03 0.19 -0.39 0.00 0.00 0.00 0.00 53.44 53.26 1toz n ALA 495 Cb 0.15 -1.33 -0.09 0.00 0.00 0.00 0.00 19.45 18.17 1toz n ALA 495 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1toz s SER 496 N -4.09 5.56 -0.24 0.00 0.01 -0.77 -4.81 113.70 109.36 1toz s SER 496 Ca -0.01 -2.17 -0.02 0.00 1.31 0.00 0.00 55.95 55.06 1toz s SER 496 Cb 0.07 -1.94 0.01 0.00 0.21 0.00 0.00 66.02 64.36 1toz s SER 496 CO 0.23 -0.58 0.03 -1.20 0.41 0.00 0.00 173.24 172.13 1toz n SER 497 N 4.50 -5.96 0.22 2.44 7.64 -1.25 -4.91 113.62 116.29 1toz n SER 497 Ca -0.02 1.18 0.11 0.00 1.01 0.00 0.00 58.87 61.15 1toz n SER 497 Cb 0.41 -4.58 0.35 0.00 -1.01 0.00 0.00 64.21 59.38 1toz n SER 497 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1toz h PRO 498 N 2.65 0.00 -7.00 1.43 0.13 -1.87 -3.46 132.00 123.88 1toz h PRO 498 Ca -0.08 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.44 1toz h PRO 498 Cb 0.17 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.23 1toz h PRO 498 CO 0.07 0.17 -1.01 0.00 -0.23 0.00 0.00 178.00 177.00 1toz s LEU 500 N -7.48 3.51 0.00 0.00 2.34 -1.23 -1.96 118.68 113.87 1toz s LEU 500 Ca 0.37 0.80 0.00 0.00 0.06 0.00 0.00 54.13 55.36 1toz s LEU 500 Cb -0.21 -3.71 0.00 0.00 -0.56 0.00 0.00 46.19 41.72 1toz s LEU 500 CO 0.98 -0.73 0.00 1.41 -1.06 0.00 0.00 176.35 176.95 1toz n HIS 501 N -2.34 0.00 1.59 3.48 8.25 -1.26 -3.82 115.22 121.12 1toz n HIS 501 Ca 0.02 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.58 1toz n HIS 501 Cb 0.56 0.00 0.47 0.00 1.12 0.00 0.00 29.99 32.14 1toz n HIS 501 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1toz n ASN 502 N 1.88 0.90 0.00 0.41 0.23 -1.26 -4.63 115.26 112.80 1toz n ASN 502 Ca 0.00 -1.56 0.00 0.00 -0.53 0.00 0.00 54.58 52.49 1toz n ASN 502 Cb 0.00 -0.05 0.00 0.00 -2.08 0.00 0.00 39.78 37.65 1toz n ASN 502 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1toz n GLY 503 N 0.98 -0.81 2.89 4.83 0.00 -0.83 -4.36 105.19 107.89 1toz n GLY 503 Ca 0.15 -1.11 -0.28 0.00 0.00 0.00 0.00 46.02 44.79 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 1.43 -0.25 1.61 3.00 -0.90 -3.49 118.95 118.35 1toz s ARG 504 Ca 0.00 -0.41 -0.29 0.00 -1.00 0.00 0.00 55.73 54.03 1toz s ARG 504 Cb 0.00 -1.84 -0.02 0.00 0.00 0.00 0.00 34.95 33.09 1toz s ARG 504 CO 0.00 -0.38 1.57 0.00 0.00 0.00 0.00 175.30 176.49 1toz s LEU 506 N 5.18 3.91 -0.82 0.00 1.02 -0.49 -4.94 118.68 122.55 1toz s LEU 506 Ca 0.69 0.14 -0.18 0.00 0.02 0.00 0.00 54.13 54.80 1toz s LEU 506 Cb -0.23 -1.98 0.15 0.00 0.02 0.00 0.00 46.19 44.14 1toz s LEU 506 CO 0.29 0.21 0.94 -0.62 0.02 0.00 0.00 176.35 177.18 1toz s ASP 507 N 0.18 6.55 0.40 2.29 3.68 -1.26 -1.67 116.67 126.83 1toz s ASP 507 Ca 0.05 -2.03 0.04 0.00 2.13 0.00 0.00 52.55 52.74 1toz s ASP 507 Cb -0.12 -2.33 -0.00 0.00 -1.45 0.00 0.00 42.92 39.02 1toz s ASP 507 CO 0.00 -0.97 0.58 -0.54 0.13 0.00 0.00 175.17 174.37 1toz s LYS 508 N 2.10 3.03 0.03 4.34 1.02 -0.40 -4.92 119.74 124.94 1toz s LYS 508 Ca 0.24 -0.82 -0.16 0.00 0.02 0.00 0.00 55.97 55.25 1toz s LYS 508 Cb -0.11 -2.69 -0.08 0.00 -0.52 0.00 0.00 37.83 34.43 1toz s LYS 508 CO -0.05 -0.15 1.24 0.82 -0.92 0.00 0.00 175.35 176.29 1toz h ILE 509 N 0.63 0.00 -0.02 2.17 5.03 -1.88 -3.26 117.51 120.17 1toz h ILE 509 Ca -0.45 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.29 1toz h ILE 509 Cb 1.26 0.00 -0.01 0.00 -3.03 0.00 0.00 36.82 35.04 1toz h ILE 509 CO 0.54 0.00 -0.05 -1.13 -0.68 0.00 0.00 178.15 176.83 1toz h ASN 510 N -0.50 -0.15 -0.00 1.72 -0.73 -1.97 -3.45 115.58 110.49 1toz h ASN 510 Ca -0.04 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.15 1toz h ASN 510 Cb 0.41 0.06 0.00 0.00 0.27 0.00 0.00 38.32 39.06 1toz h ASN 510 CO 0.03 -0.04 0.00 1.21 -0.37 0.00 0.00 177.43 178.26 1toz n GLU 511 N -2.86 0.00 -4.13 6.67 2.13 -1.23 -5.15 120.64 116.07 1toz n GLU 511 Ca -0.00 0.00 -0.33 0.00 0.66 0.00 0.00 57.16 57.48 1toz n GLU 511 Cb 0.03 0.00 -0.07 0.00 0.27 0.00 0.00 31.44 31.67 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 -2.33 3.27 -0.11 4.31 -0.71 -1.26 -1.28 117.98 119.87 1toz s PHE 512 Ca 0.00 0.21 -0.02 0.00 -1.04 0.00 0.00 56.93 56.08 1toz s PHE 512 Cb 0.00 -1.74 0.04 0.00 -1.21 0.00 0.00 43.02 40.10 1toz s PHE 512 CO 0.00 0.54 0.01 -1.14 -1.34 0.00 0.00 175.22 173.29 1toz s GLN 513 N -1.63 0.68 -0.77 1.99 0.74 -0.67 -4.93 119.66 115.07 1toz s GLN 513 Ca 0.22 -0.07 -0.24 0.00 0.05 0.00 0.00 55.36 55.32 1toz s GLN 513 Cb -0.12 -1.34 0.05 0.00 1.10 0.00 0.00 33.01 32.70 1toz s GLN 513 CO 0.12 -0.40 1.20 0.00 -0.55 0.00 0.00 175.29 175.66 1toz n GLU 515 N 8.59 -2.87 -3.86 0.00 0.28 0.11 -4.61 120.64 118.29 1toz n GLU 515 Ca 0.07 -1.06 -0.36 0.00 -0.16 0.00 0.00 57.16 55.65 1toz n GLU 515 Cb 0.48 -1.11 -0.06 0.00 1.43 0.00 0.00 31.44 32.19 1toz n GLU 515 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1toz s PRO 517 N -1.41 3.41 0.00 0.00 0.04 -1.26 -4.70 135.00 131.08 1toz s PRO 517 Ca 0.21 0.75 0.00 0.00 0.04 0.00 0.00 61.00 62.00 1toz s PRO 517 Cb -0.13 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.33 1toz s PRO 517 CO 0.10 -1.78 0.00 -2.37 0.04 0.00 0.00 177.00 172.99 1toz n THR 518 N 7.02 0.00 0.19 1.26 5.66 -1.26 -4.70 114.28 122.45 1toz n THR 518 Ca 0.15 0.00 0.13 0.00 -3.05 0.00 0.00 64.05 61.28 1toz n THR 518 Cb 0.49 -0.35 0.68 0.00 -1.55 0.00 0.00 70.33 69.60 1toz n THR 518 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 1toz h GLY 519 N 0.00 0.00 -0.36 1.09 0.00 -2.02 0.10 103.07 101.89 1toz h GLY 519 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1toz h GLY 519 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 176.54 178.51 1toz n PHE 520 N -2.37 0.14 -2.89 5.60 1.16 -1.26 -4.96 117.46 112.88 1toz n PHE 520 Ca -0.02 -0.07 -0.02 0.00 -1.87 0.00 0.00 57.45 55.47 1toz n PHE 520 Cb 0.04 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 37.89 1toz n PHE 520 CO 0.00 0.00 0.00 0.25 -1.87 0.00 0.00 176.76 175.14 1toz n THR 521 N -0.20 -6.09 0.00 1.97 -2.24 0.36 -5.00 114.28 103.07 1toz n THR 521 Ca 0.05 1.19 0.00 0.00 -2.27 0.00 0.00 64.05 63.01 1toz n THR 521 Cb 0.10 -4.26 0.00 0.00 -2.10 0.00 0.00 70.33 64.07 1toz n THR 521 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1toz n GLY 522 N 2.10 -0.11 0.00 3.38 0.00 -1.26 -5.09 105.19 104.21 1toz n GLY 522 Ca -0.17 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 0.00 -3.13 1.61 8.25 -1.26 -5.04 115.22 115.64 1toz n HIS 523 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 1toz n HIS 523 Cb 0.00 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.18 1toz n HIS 523 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1toz n LEU 524 N 0.00 -5.01 0.00 2.41 4.32 -1.26 -4.74 117.00 112.73 1toz n LEU 524 Ca 0.00 -0.63 0.00 0.00 -0.02 0.00 0.00 56.01 55.36 1toz n LEU 524 Cb 0.00 -2.95 0.00 0.00 -1.62 0.00 0.00 43.42 38.85 1toz n LEU 524 CO 0.00 0.14 0.00 0.00 -1.22 0.00 0.00 177.39 176.31