#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 0.37 0.33 2.61 2.15 -1.26 -4.81 116.67 116.06 1toz s ASP 412 Ca 0.00 -1.30 -0.16 0.00 0.43 0.00 0.00 52.55 51.52 1toz s ASP 412 Cb 0.00 0.79 -0.09 0.00 -0.30 0.00 0.00 42.92 43.32 1toz s ASP 412 CO 0.00 -1.57 0.76 0.54 -0.17 0.00 0.00 175.17 174.73 1toz s VAL 413 N -2.49 4.63 -1.20 1.11 0.11 -1.26 -4.96 120.40 116.34 1toz s VAL 413 Ca 0.21 1.04 -0.11 0.00 -2.93 0.00 0.00 61.98 60.19 1toz s VAL 413 Cb -0.03 -3.63 0.20 0.00 -1.53 0.00 0.00 36.38 31.39 1toz s VAL 413 CO 0.15 -0.18 1.48 -0.67 -3.33 0.00 0.00 175.10 172.55 1toz n ASP 414 N -0.33 5.32 0.29 3.54 4.64 -1.26 -4.58 116.55 124.17 1toz n ASP 414 Ca 0.04 -3.04 0.15 0.00 -1.38 0.00 0.00 54.79 50.56 1toz n ASP 414 Cb 0.53 -1.50 0.82 0.00 -1.04 0.00 0.00 41.12 39.93 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 6.67 0.00 0.00 -0.67 3.07 -1.89 1.75 114.58 123.51 1toz h GLU 415 Ca 0.30 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.16 1toz h GLU 415 Cb 0.81 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.72 1toz h GLU 415 CO 1.29 0.00 -0.12 0.00 -1.40 0.00 0.00 179.01 178.78 1toz n SER 417 N -2.90 0.07 0.00 0.00 2.88 0.57 -4.51 113.62 109.73 1toz n SER 417 Ca 0.04 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.60 1toz n SER 417 Cb 0.51 1.87 0.00 0.00 -0.75 0.00 0.00 64.21 65.84 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 -2.30 1.93 -0.70 2.46 4.77 0.29 -4.92 117.00 118.53 1toz n LEU 418 Ca -0.04 0.19 -0.03 0.00 -0.03 0.00 0.00 56.01 56.10 1toz n LEU 418 Cb 0.57 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.60 1toz n LEU 418 CO 0.46 -0.03 0.23 0.61 -1.33 0.00 0.00 177.39 177.32 1toz n GLY 419 N 1.51 0.37 2.68 -0.72 0.00 -1.17 -5.04 105.19 102.83 1toz n GLY 419 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 3.30 -4.03 4.61 0.00 0.73 -5.04 120.51 120.07 1toz n ALA 420 Ca -0.14 -4.13 -0.31 0.00 0.00 0.00 0.00 53.44 48.86 1toz n ALA 420 Cb 0.50 -0.93 -0.15 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.16 4.49 0.27 0.00 2.47 -1.26 -3.57 114.94 116.17 1toz s ASN 421 Ca 0.29 -1.65 0.12 0.00 0.42 0.00 0.00 52.86 52.05 1toz s ASN 421 Cb 0.01 -1.52 0.28 0.00 -1.45 0.00 0.00 41.25 38.56 1toz s ASN 421 CO -0.16 -0.27 1.55 1.55 -3.72 0.00 0.00 177.10 176.05 1toz h PRO 422 N 7.74 0.00 0.00 0.43 0.13 -1.96 -2.97 132.00 135.38 1toz h PRO 422 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.99 1toz h PRO 422 Cb 1.04 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1toz h PRO 422 CO 0.48 0.63 0.47 0.00 -0.23 0.00 0.00 178.00 179.35 1toz n GLU 424 N -2.69 0.00 0.00 0.00 -0.58 -1.12 -2.79 120.64 113.46 1toz n GLU 424 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 1toz n GLU 424 Cb 0.51 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.38 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 0.00 -3.36 -0.32 1.44 -1.26 -5.01 115.22 106.71 1toz n HIS 425 Ca 0.00 0.00 -0.45 0.00 -2.01 0.00 0.00 57.72 55.26 1toz n HIS 425 Cb 0.00 0.21 -0.05 0.00 0.12 0.00 0.00 29.99 30.26 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 -1.43 3.64 0.00 1.59 0.00 -1.12 -4.97 121.76 119.48 1toz s ALA 426 Ca 0.00 -2.62 0.00 0.00 0.00 0.00 0.00 51.96 49.34 1toz s ALA 426 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.92 1toz s ALA 426 CO 0.00 -2.02 0.00 0.41 0.00 0.00 0.00 175.76 174.15 1toz n GLY 427 N 5.05 2.19 3.71 0.00 0.00 -1.26 -4.00 105.19 110.88 1toz n GLY 427 Ca -0.10 -0.90 -0.35 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.00 4.16 -0.22 1.61 2.36 -0.91 -4.92 119.74 119.81 1toz s LYS 428 Ca 0.00 -0.23 -0.04 0.00 -2.55 0.00 0.00 55.97 53.15 1toz s LYS 428 Cb 0.00 -3.45 -0.01 0.00 -1.05 0.00 0.00 37.83 33.32 1toz s LYS 428 CO 0.00 0.23 -0.05 0.00 1.55 0.00 0.00 175.35 177.08 1toz s ILE 430 N 1.46 1.83 -0.12 0.00 -0.00 0.89 -4.94 121.20 120.34 1toz s ILE 430 Ca 0.05 -2.00 -0.03 0.00 -0.00 0.00 0.00 60.65 58.67 1toz s ILE 430 Cb -0.14 -2.95 -0.03 0.00 -0.00 0.00 0.00 42.46 39.33 1toz s ILE 430 CO -0.04 -0.00 -0.01 0.21 -0.00 0.00 0.00 174.94 175.10 1toz s ASN 431 N -3.66 5.09 0.27 4.36 2.47 -1.26 -1.24 114.94 120.97 1toz s ASN 431 Ca 0.35 0.03 0.06 0.00 0.42 0.00 0.00 52.86 53.73 1toz s ASN 431 Cb 0.10 -1.60 -0.06 0.00 -1.45 0.00 0.00 41.25 38.24 1toz s ASN 431 CO 0.17 0.29 -0.04 0.42 -3.72 0.00 0.00 177.10 174.22 1toz s THR 432 N -0.34 1.51 -0.07 -5.21 -4.23 -0.28 -4.67 115.64 102.35 1toz s THR 432 Ca 0.06 -2.10 -0.30 0.00 -1.18 0.00 0.00 61.69 58.18 1toz s THR 432 Cb -0.12 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 71.24 1toz s THR 432 CO 0.02 -0.29 1.35 -0.76 -0.54 0.00 0.00 174.62 174.40 1toz s LEU 433 N -3.42 4.27 0.00 4.79 1.43 -1.26 -3.32 118.68 121.17 1toz s LEU 433 Ca 0.29 1.93 0.00 0.00 -1.03 0.00 0.00 54.13 55.33 1toz s LEU 433 Cb 0.04 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.71 1toz s LEU 433 CO 0.11 -0.74 0.00 0.61 0.23 0.00 0.00 176.35 176.57 1toz n GLY 434 N 3.65 1.42 3.35 -3.19 0.00 -1.26 -4.86 105.19 104.29 1toz n GLY 434 Ca 0.14 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 1toz n GLY 434 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1toz s SER 435 N 0.00 1.49 -0.02 1.61 0.15 -1.21 -5.01 113.70 110.71 1toz s SER 435 Ca 0.00 -1.38 -0.01 0.00 0.70 0.00 0.00 55.95 55.27 1toz s SER 435 Cb 0.00 0.10 -0.04 0.00 -1.71 0.00 0.00 66.02 64.37 1toz s SER 435 CO 0.00 -0.69 0.07 0.72 1.20 0.00 0.00 173.24 174.53 1toz s PHE 436 N -3.64 3.27 -0.02 3.44 -0.12 -1.26 -1.13 117.98 118.53 1toz s PHE 436 Ca 0.37 0.21 0.01 0.00 -0.05 0.00 0.00 56.93 57.47 1toz s PHE 436 Cb 0.08 -1.75 -0.04 0.00 -0.63 0.00 0.00 43.02 40.69 1toz s PHE 436 CO 0.14 0.54 0.02 -2.00 -0.05 0.00 0.00 175.22 173.87 1toz s GLU 437 N -1.60 2.87 -0.08 1.99 2.12 -0.37 -4.78 118.70 118.85 1toz s GLU 437 Ca 0.21 -0.56 -0.03 0.00 0.36 0.00 0.00 54.97 54.95 1toz s GLU 437 Cb -0.12 -2.72 0.04 0.00 0.26 0.00 0.00 34.13 31.59 1toz s GLU 437 CO 0.12 0.64 0.16 0.00 -0.54 0.00 0.00 175.26 175.64 1toz s GLN 439 N 1.76 3.81 0.44 0.00 -0.21 0.86 -4.19 119.66 122.13 1toz s GLN 439 Ca -0.03 0.73 -0.08 0.00 0.02 0.00 0.00 55.36 56.00 1toz s GLN 439 Cb -0.12 -2.22 -0.05 0.00 1.00 0.00 0.00 33.01 31.62 1toz s GLN 439 CO -0.06 -0.25 0.78 0.00 -2.12 0.00 0.00 175.29 173.64 1toz s LEU 441 N -4.24 2.75 0.00 0.00 1.98 -1.26 -4.65 118.68 113.26 1toz s LEU 441 Ca 0.50 -0.23 0.00 0.00 -2.89 0.00 0.00 54.13 51.50 1toz s LEU 441 Cb -0.10 -1.58 0.00 0.00 0.66 0.00 0.00 46.19 45.17 1toz s LEU 441 CO 0.37 0.28 0.00 0.00 -1.89 0.00 0.00 176.35 175.12 1toz n GLN 442 N 2.74 0.00 -3.43 1.98 1.13 -1.26 -1.36 117.38 117.18 1toz n GLN 442 Ca -0.18 0.00 -0.27 0.00 -1.94 0.00 0.00 57.00 54.62 1toz n GLN 442 Cb 0.52 0.00 -0.08 0.00 0.11 0.00 0.00 30.24 30.79 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 4.53 3.97 1.08 0.00 -1.22 -5.05 105.19 108.50 1toz n GLY 443 Ca 0.00 -2.62 -0.21 0.00 0.00 0.00 0.00 46.02 43.20 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 -2.25 3.38 0.00 1.61 1.51 -0.46 -4.38 117.35 116.75 1toz s TYR 444 Ca 0.38 -0.06 0.00 0.00 -1.01 0.00 0.00 57.07 56.39 1toz s TYR 444 Cb 0.14 -1.63 0.00 0.00 -0.11 0.00 0.00 41.96 40.36 1toz s TYR 444 CO -0.03 0.37 0.00 -2.37 -1.11 0.00 0.00 175.55 172.41 1toz n THR 445 N -1.44 0.00 -0.06 -0.71 5.66 3.10 -4.84 114.28 115.99 1toz n THR 445 Ca -0.08 0.00 0.01 0.00 -3.05 0.00 0.00 64.05 60.93 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 -2.70 0.18 1.09 0.00 -1.23 -2.29 105.19 105.25 1toz n GLY 446 Ca 0.00 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.04 0.00 -0.01 1.61 0.13 -1.97 -3.14 132.00 128.58 1toz h PRO 447 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1toz h PRO 447 Cb 0.05 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.18 1toz h PRO 447 CO 0.00 0.38 -0.28 0.54 -0.23 0.00 0.00 178.00 178.42 1toz n ARG 448 N -3.37 2.36 -1.03 0.86 5.12 -1.26 -4.99 116.66 114.34 1toz n ARG 448 Ca 0.01 -0.50 0.00 0.00 -1.93 0.00 0.00 57.85 55.43 1toz n ARG 448 Cb 0.58 -1.08 0.00 0.00 -1.16 0.00 0.00 32.46 30.79 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 -0.76 0.00 -4.18 0.00 -0.00 -0.97 0.19 120.64 114.92 1toz n GLU 450 Ca 0.00 -0.24 -0.32 0.00 -0.00 0.00 0.00 57.16 56.60 1toz n GLU 450 Cb 0.30 -0.38 -0.08 0.00 -0.00 0.00 0.00 31.44 31.28 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 4.28 -0.23 3.84 1.09 -1.11 -1.12 121.20 127.94 1toz s ILE 451 Ca 0.00 -0.69 -0.10 0.00 -1.10 0.00 0.00 60.65 58.76 1toz s ILE 451 Cb 0.00 -2.97 -0.05 0.00 -1.06 0.00 0.00 42.46 38.38 1toz s ILE 451 CO 0.00 0.27 0.14 -0.62 -0.10 0.00 0.00 174.94 174.63 1toz s ASP 452 N -1.91 6.01 0.42 3.58 3.68 -1.26 0.67 116.67 127.86 1toz s ASP 452 Ca 0.23 0.10 0.05 0.00 2.13 0.00 0.00 52.55 55.06 1toz s ASP 452 Cb -0.12 -2.08 0.01 0.00 -1.45 0.00 0.00 42.92 39.28 1toz s ASP 452 CO 0.15 0.08 0.59 0.54 0.13 0.00 0.00 175.17 176.66 1toz s VAL 453 N 0.95 3.37 -0.80 1.11 0.11 -1.26 -4.74 120.40 119.13 1toz s VAL 453 Ca 0.07 -0.88 -0.13 0.00 -2.93 0.00 0.00 61.98 58.11 1toz s VAL 453 Cb -0.13 -3.17 0.21 0.00 -1.53 0.00 0.00 36.38 31.75 1toz s VAL 453 CO 0.03 -0.08 0.73 0.21 -3.33 0.00 0.00 175.10 172.66 1toz s ASN 454 N -4.30 6.61 0.00 3.54 2.47 -1.26 -4.86 114.94 117.15 1toz s ASN 454 Ca 0.52 -2.67 0.07 0.00 0.42 0.00 0.00 52.86 51.19 1toz s ASN 454 Cb -0.10 -2.18 0.34 0.00 -1.45 0.00 0.00 41.25 37.86 1toz s ASN 454 CO 0.34 -0.57 1.06 -1.84 -3.72 0.00 0.00 177.10 172.37 1toz n GLU 455 N 3.98 0.10 -0.19 0.43 0.00 -1.26 -0.65 120.64 123.05 1toz n GLU 455 Ca 0.12 0.21 0.05 0.00 0.00 0.00 0.00 57.16 57.54 1toz n GLU 455 Cb 0.46 -1.50 0.15 0.00 0.00 0.00 0.00 31.44 30.55 1toz n GLU 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1toz n VAL 457 N 0.42 0.20 0.22 0.00 0.24 0.18 -4.19 118.33 115.40 1toz n VAL 457 Ca 0.11 -0.31 0.02 0.00 -2.04 0.00 0.00 64.34 62.13 1toz n VAL 457 Cb 0.32 -0.02 -0.01 0.00 -1.47 0.00 0.00 33.84 32.66 1toz n VAL 457 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1toz n SER 458 N -2.02 0.53 -3.15 -1.34 3.41 -1.20 -4.70 113.62 105.15 1toz n SER 458 Ca -0.06 -0.77 -0.17 0.00 -0.26 0.00 0.00 58.87 57.61 1toz n SER 458 Cb 0.44 0.75 -0.02 0.00 -0.26 0.00 0.00 64.21 65.11 1toz n SER 458 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1toz n ASN 459 N -0.75 0.83 0.00 4.04 3.02 -0.32 -4.90 115.26 117.18 1toz n ASN 459 Ca 0.01 -3.00 0.12 0.00 -0.03 0.00 0.00 54.58 51.68 1toz n ASN 459 Cb 0.09 -0.58 0.65 0.00 -0.61 0.00 0.00 39.78 39.33 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 0.26 0.55 -1.16 3.52 -0.04 -1.26 -4.61 135.00 132.25 1toz n PRO 460 Ca 0.24 0.03 -0.05 0.00 -0.04 0.00 0.00 63.50 63.68 1toz n PRO 460 Cb 0.67 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.61 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 -2.83 0.00 0.00 0.00 7.27 -1.26 -4.01 117.38 116.54 1toz n GLN 462 Ca -0.05 0.00 0.02 0.00 0.07 0.00 0.00 57.00 57.04 1toz n GLN 462 Cb 0.18 0.00 0.01 0.00 2.41 0.00 0.00 30.24 32.84 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 2.89 1.12 -2.76 1.69 0.23 -1.26 -4.66 115.26 112.51 1toz n ASN 463 Ca 0.00 -1.06 -0.29 0.00 -0.53 0.00 0.00 54.58 52.70 1toz n ASN 463 Cb 0.00 0.16 -0.01 0.00 -2.08 0.00 0.00 39.78 37.85 1toz n ASN 463 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1toz n ASP 464 N 0.00 5.11 0.00 0.53 8.00 -1.26 -4.93 116.55 124.00 1toz n ASP 464 Ca 0.02 -3.72 0.00 0.00 0.71 0.00 0.00 54.79 51.80 1toz n ASP 464 Cb 0.09 -0.60 0.00 0.00 -0.02 0.00 0.00 41.12 40.58 1toz n ASP 464 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1toz n ALA 465 N -0.38 0.00 -1.93 2.24 0.00 -1.26 -4.74 120.51 114.45 1toz n ALA 465 Ca 0.38 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.41 1toz n ALA 465 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 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 0.00 3.36 0.95 0.00 2.01 0.93 -4.62 115.64 118.27 1toz s THR 466 Ca 0.00 0.33 -0.11 0.00 0.31 0.00 0.00 61.69 62.22 1toz s THR 466 Cb 0.00 -3.59 0.16 0.00 0.01 0.00 0.00 72.50 69.08 1toz s THR 466 CO 0.00 -0.45 1.10 0.00 -0.69 0.00 0.00 174.62 174.59 1toz s LEU 468 N -6.58 -0.77 0.51 0.00 1.43 0.56 -4.80 118.68 109.04 1toz s LEU 468 Ca 0.66 -0.36 -0.19 0.00 -1.03 0.00 0.00 54.13 53.21 1toz s LEU 468 Cb -0.22 1.00 -0.07 0.00 0.03 0.00 0.00 46.19 46.93 1toz s LEU 468 CO 0.59 -0.09 1.03 -0.62 0.23 0.00 0.00 176.35 177.49 1toz s ASP 469 N 1.98 6.29 0.00 2.29 -1.08 -1.26 0.23 116.67 125.11 1toz s ASP 469 Ca 0.15 1.85 0.00 0.00 -0.52 0.00 0.00 52.55 54.03 1toz s ASP 469 Cb 0.00 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.92 1toz s ASP 469 CO -0.13 -0.82 0.00 0.00 0.52 0.00 0.00 175.17 174.75 1toz n GLN 470 N -1.25 0.00 -1.67 4.34 10.64 0.83 -4.84 117.38 125.43 1toz n GLN 470 Ca 0.09 0.00 -0.50 0.00 -1.83 0.00 0.00 57.00 54.75 1toz n GLN 470 Cb 0.53 0.00 -0.05 0.00 -0.86 0.00 0.00 30.24 29.85 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 0.49 -2.40 -0.39 -6.64 -1.26 -2.26 119.36 106.91 1toz n ILE 471 Ca 0.00 -0.12 -0.10 0.00 -1.77 0.00 0.00 62.75 60.76 1toz n ILE 471 Cb 0.00 -1.75 -0.02 0.00 -1.44 0.00 0.00 39.64 36.43 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 4.60 -0.09 3.55 3.28 0.00 -1.26 -4.71 105.19 110.56 1toz n GLY 472 Ca 0.25 0.02 -0.09 0.00 0.00 0.00 0.00 46.02 46.21 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 -2.86 0.64 -0.01 1.61 -1.05 -0.96 -3.38 118.70 112.70 1toz s GLU 473 Ca 0.18 -0.06 0.02 0.00 -0.15 0.00 0.00 54.97 54.95 1toz s GLU 473 Cb -0.10 0.30 -0.00 0.00 -0.44 0.00 0.00 34.13 33.88 1toz s GLU 473 CO 0.26 -0.24 -0.05 -0.59 0.95 0.00 0.00 175.26 175.58 1toz s PHE 474 N -2.04 0.50 0.04 4.83 -0.12 -1.26 0.29 117.98 120.22 1toz s PHE 474 Ca 0.02 -0.09 0.08 0.00 -0.05 0.00 0.00 56.93 56.89 1toz s PHE 474 Cb -0.01 -0.33 -0.03 0.00 -0.63 0.00 0.00 43.02 42.03 1toz s PHE 474 CO -0.03 -0.01 -0.24 1.14 -0.05 0.00 0.00 175.22 176.02 1toz s GLN 475 N -0.10 1.66 -0.03 1.99 -2.07 0.62 -4.93 119.66 116.80 1toz s GLN 475 Ca 0.02 -1.02 0.05 0.00 -1.82 0.00 0.00 55.36 52.59 1toz s GLN 475 Cb -0.02 -1.79 -0.01 0.00 -1.09 0.00 0.00 33.01 30.10 1toz s GLN 475 CO -0.00 0.46 -0.16 0.00 -1.32 0.00 0.00 175.29 174.27 1toz s ILE 477 N -0.15 4.78 0.34 0.00 -1.09 0.15 -4.85 121.20 120.38 1toz s ILE 477 Ca 0.01 -0.37 0.03 0.00 -2.23 0.00 0.00 60.65 58.09 1toz s ILE 477 Cb -0.09 -3.44 0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1toz s ILE 477 CO 0.01 0.05 0.22 0.00 -1.23 0.00 0.00 174.94 173.98 1toz s MET 479 N -3.38 3.93 -0.63 0.00 -1.94 -1.26 -4.94 119.30 111.09 1toz s MET 479 Ca 0.16 0.67 -0.06 0.00 -1.71 0.00 0.00 55.69 54.76 1toz s MET 479 Cb -0.01 -2.35 -0.13 0.00 2.01 0.00 0.00 34.83 34.34 1toz s MET 479 CO 0.10 0.01 2.67 -0.35 -0.01 0.00 0.00 175.02 177.44 1toz n PRO 480 N -0.90 2.16 0.00 2.03 -0.04 -1.26 -2.94 135.00 134.05 1toz n PRO 480 Ca 0.04 -1.28 0.00 0.00 -0.04 0.00 0.00 63.50 62.22 1toz n PRO 480 Cb 0.54 -2.25 0.00 0.00 -0.04 0.00 0.00 33.50 31.75 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 3.16 0.02 3.83 0.55 0.00 -1.26 -5.14 105.19 106.35 1toz n GLY 481 Ca 0.46 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 46.21 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 -1.27 2.61 0.38 1.61 1.51 -1.15 -3.03 117.35 118.02 1toz s TYR 482 Ca 0.00 -0.55 -0.08 0.00 -1.01 0.00 0.00 57.07 55.43 1toz s TYR 482 Cb 0.00 -2.09 0.03 0.00 -0.11 0.00 0.00 41.96 39.80 1toz s TYR 482 CO 0.00 -0.04 0.65 -1.91 -1.11 0.00 0.00 175.55 173.14 1toz n GLU 483 N -1.45 0.94 0.00 -0.62 2.13 0.24 -4.69 120.64 117.18 1toz n GLU 483 Ca 0.02 -2.57 0.00 0.00 0.66 0.00 0.00 57.16 55.26 1toz n GLU 483 Cb 0.63 2.79 0.00 0.00 0.27 0.00 0.00 31.44 35.13 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 -0.57 0.76 0.22 8.31 0.00 -1.26 -1.57 105.19 111.08 1toz n GLY 484 Ca -0.04 -2.29 -0.05 0.00 0.00 0.00 0.00 46.02 43.65 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 1.29 -0.02 1.61 2.07 -1.98 -2.92 116.25 116.31 1toz h VAL 485 Ca 0.00 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 66.05 1toz h VAL 485 Cb 0.00 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1toz h VAL 485 CO 0.00 0.46 -0.09 1.41 0.02 0.00 0.00 177.57 179.36 1toz n HIS 486 N -4.05 0.00 -2.26 1.57 8.25 -1.26 -4.57 115.22 112.90 1toz n HIS 486 Ca -0.01 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.24 1toz n HIS 486 Cb 0.47 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.56 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 -2.88 2.05 -4.25 0.00 0.28 -1.22 -4.38 120.64 110.24 1toz n GLU 488 Ca -0.24 -1.92 -0.34 0.00 -0.16 0.00 0.00 57.16 54.50 1toz n GLU 488 Cb 0.68 -1.40 -0.12 0.00 1.43 0.00 0.00 31.44 32.03 1toz n GLU 488 CO 0.00 0.00 0.00 0.14 -0.16 0.00 0.00 177.13 177.11 1toz s VAL 489 N -1.41 4.08 0.44 3.84 -7.23 -0.61 -4.97 120.40 114.54 1toz s VAL 489 Ca 0.29 -0.28 -0.24 0.00 -1.81 0.00 0.00 61.98 59.93 1toz s VAL 489 Cb 0.18 -2.81 -0.08 0.00 0.56 0.00 0.00 36.38 34.23 1toz s VAL 489 CO 0.25 0.47 1.23 0.21 -0.31 0.00 0.00 175.10 176.95 1toz s ASN 490 N 0.52 6.21 1.09 4.85 3.84 -1.26 0.79 114.94 130.99 1toz s ASN 490 Ca -0.01 2.47 -0.15 0.00 0.21 0.00 0.00 52.86 55.38 1toz s ASN 490 Cb -0.14 -2.62 0.21 0.00 -0.55 0.00 0.00 41.25 38.15 1toz s ASN 490 CO 0.02 -0.90 0.41 1.07 -2.79 0.00 0.00 177.10 174.92 1toz n THR 491 N -0.20 0.00 -1.63 -5.21 5.66 -1.17 -4.70 114.28 107.03 1toz n THR 491 Ca 0.06 -0.05 -0.29 0.00 -3.05 0.00 0.00 64.05 60.71 1toz n THR 491 Cb 0.46 -0.58 0.17 0.00 -1.55 0.00 0.00 70.33 68.82 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 -2.16 2.92 -0.32 1.09 2.15 -1.26 -4.77 116.67 114.32 1toz s ASP 492 Ca 0.42 0.61 0.16 0.00 0.43 0.00 0.00 52.55 54.18 1toz s ASP 492 Cb -0.08 -0.90 0.45 0.00 -0.30 0.00 0.00 42.92 42.09 1toz s ASP 492 CO 0.39 -2.88 1.28 -1.84 -0.17 0.00 0.00 175.17 171.95 1toz n GLU 493 N -3.93 1.42 -2.73 4.34 0.00 -1.26 -4.91 120.64 113.57 1toz n GLU 493 Ca 0.11 -2.38 -0.05 0.00 0.00 0.00 0.00 57.16 54.84 1toz n GLU 493 Cb 0.60 -0.58 0.04 0.00 0.00 0.00 0.00 31.44 31.50 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 -0.30 1.95 -0.10 0.00 0.00 -1.26 -3.78 120.51 117.02 1toz n ALA 495 Ca 0.07 0.04 -0.12 0.00 0.00 0.00 0.00 53.44 53.44 1toz n ALA 495 Cb 0.81 -1.43 -0.04 0.00 0.00 0.00 0.00 19.45 18.80 1toz n ALA 495 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1toz n SER 496 N -2.27 1.93 -4.45 0.00 2.88 -1.26 -4.89 113.62 105.56 1toz n SER 496 Ca 0.04 0.35 -0.42 0.00 -1.33 0.00 0.00 58.87 57.51 1toz n SER 496 Cb 0.32 -0.76 -0.10 0.00 -0.75 0.00 0.00 64.21 62.92 1toz n SER 496 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1toz s SER 497 N -6.12 5.98 0.34 -3.46 0.01 -1.25 -4.93 113.70 104.27 1toz s SER 497 Ca -0.29 -0.81 0.17 0.00 1.31 0.00 0.00 55.95 56.33 1toz s SER 497 Cb 0.05 -2.12 0.45 0.00 0.21 0.00 0.00 66.02 64.62 1toz s SER 497 CO 0.43 -0.38 1.62 1.55 0.41 0.00 0.00 173.24 176.87 1toz h PRO 498 N 8.54 0.00 -5.89 12.44 0.13 -1.91 -3.43 132.00 141.89 1toz h PRO 498 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1toz h PRO 498 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1toz h PRO 498 CO 0.69 0.44 -0.82 0.00 -0.23 0.00 0.00 178.00 178.08 1toz n LEU 500 N 1.55 0.34 0.00 0.00 -0.00 -0.80 -2.65 117.00 115.45 1toz n LEU 500 Ca -0.06 -1.73 0.00 0.00 -0.00 0.00 0.00 56.01 54.22 1toz n LEU 500 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.71 1toz n LEU 500 CO 0.14 0.68 -0.20 1.41 -0.00 0.00 0.00 177.39 179.43 1toz n HIS 501 N 0.27 0.00 0.03 1.47 8.25 -1.26 -4.07 115.22 119.91 1toz n HIS 501 Ca -0.02 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.55 1toz n HIS 501 Cb 0.93 0.18 -0.16 0.00 1.12 0.00 0.00 29.99 32.06 1toz n HIS 501 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 1toz n ASN 502 N -2.39 0.06 -3.71 0.41 5.15 -1.26 -4.69 115.26 108.82 1toz n ASN 502 Ca 0.00 -0.02 0.03 0.00 -0.60 0.00 0.00 54.58 53.98 1toz n ASN 502 Cb 0.20 1.92 0.01 0.00 -0.53 0.00 0.00 39.78 41.38 1toz n ASN 502 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1toz n GLY 503 N 1.27 0.23 3.26 8.20 0.00 -1.26 -4.57 105.19 112.33 1toz n GLY 503 Ca -0.04 -1.04 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.01 3.20 -0.33 1.61 6.06 -0.88 -1.90 118.95 124.70 1toz s ARG 504 Ca 0.29 -0.74 -0.27 0.00 -2.50 0.00 0.00 55.73 52.51 1toz s ARG 504 Cb -0.01 -2.97 -0.06 0.00 0.06 0.00 0.00 34.95 31.98 1toz s ARG 504 CO -0.01 -0.25 2.30 0.00 -2.50 0.00 0.00 175.30 174.84 1toz s LEU 506 N 9.87 4.26 -0.87 0.00 1.98 0.40 -4.94 118.68 129.39 1toz s LEU 506 Ca 1.00 0.39 -0.25 0.00 -2.89 0.00 0.00 54.13 52.38 1toz s LEU 506 Cb -0.28 -2.20 0.02 0.00 0.66 0.00 0.00 46.19 44.38 1toz s LEU 506 CO 0.32 0.19 1.52 -0.62 -1.89 0.00 0.00 176.35 175.87 1toz s ASP 507 N 0.12 6.05 -0.10 3.68 3.68 -1.26 -2.29 116.67 126.55 1toz s ASP 507 Ca 0.13 -0.82 -0.16 0.00 2.13 0.00 0.00 52.55 53.83 1toz s ASP 507 Cb -0.12 -2.56 -0.05 0.00 -1.45 0.00 0.00 42.92 38.74 1toz s ASP 507 CO 0.02 -1.90 0.39 -0.54 0.13 0.00 0.00 175.17 173.26 1toz s LYS 508 N 5.76 4.19 -0.77 4.34 3.01 -0.63 -4.95 119.74 130.69 1toz s LYS 508 Ca 0.49 0.31 -0.12 0.00 -1.01 0.00 0.00 55.97 55.63 1toz s LYS 508 Cb -0.05 -3.38 -0.10 0.00 -1.01 0.00 0.00 37.83 33.30 1toz s LYS 508 CO 0.03 0.33 1.94 -0.89 0.51 0.00 0.00 175.35 177.26 1toz n ILE 509 N 3.16 1.95 0.00 2.17 -0.00 -1.26 -2.05 119.36 123.32 1toz n ILE 509 Ca -0.11 -1.35 0.00 0.00 -0.00 0.00 0.00 62.75 61.29 1toz n ILE 509 Cb 0.52 -2.15 0.00 0.00 -0.00 0.00 0.00 39.64 38.01 1toz n ILE 509 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 1toz n ASN 510 N 5.61 0.00 -1.43 4.38 5.15 -1.26 -4.94 115.26 122.78 1toz n ASN 510 Ca 0.43 0.00 -0.03 0.00 -0.60 0.00 0.00 54.58 54.38 1toz n ASN 510 Cb 0.23 0.00 -0.00 0.00 -0.53 0.00 0.00 39.78 39.48 1toz n ASN 510 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1toz n GLU 511 N 0.00 0.18 -4.26 1.20 1.02 -0.87 -5.15 120.64 112.76 1toz n GLU 511 Ca 0.00 -0.58 -0.33 0.00 -0.02 0.00 0.00 57.16 56.22 1toz n GLU 511 Cb 0.00 0.60 -0.15 0.00 -0.02 0.00 0.00 31.44 31.86 1toz n GLU 511 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1toz s PHE 512 N -5.34 2.80 0.27 -0.32 -0.12 -1.26 -1.61 117.98 112.40 1toz s PHE 512 Ca 0.06 -1.32 0.07 0.00 -0.05 0.00 0.00 56.93 55.69 1toz s PHE 512 Cb -0.00 -1.93 -0.03 0.00 -0.63 0.00 0.00 43.02 40.42 1toz s PHE 512 CO 0.04 -0.65 0.22 -1.14 -0.05 0.00 0.00 175.22 173.64 1toz s GLN 513 N 1.14 2.87 -0.57 1.99 -0.44 -0.97 -4.90 119.66 118.78 1toz s GLN 513 Ca 0.01 -1.12 0.04 0.00 -2.50 0.00 0.00 55.36 51.79 1toz s GLN 513 Cb -0.14 -2.54 0.15 0.00 -1.64 0.00 0.00 33.01 28.83 1toz s GLN 513 CO -0.06 0.32 0.34 0.00 0.50 0.00 0.00 175.29 176.39 1toz n GLU 515 N 2.78 2.90 -3.62 0.00 -0.58 0.15 -4.00 120.64 118.26 1toz n GLU 515 Ca 0.12 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.48 1toz n GLU 515 Cb 0.34 0.00 -0.06 0.00 -0.57 0.00 0.00 31.44 31.15 1toz n GLU 515 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1toz n PRO 517 N 2.39 -1.16 -2.70 0.00 -0.04 -1.26 -3.59 135.00 128.63 1toz n PRO 517 Ca -0.15 -0.75 -0.07 0.00 -0.04 0.00 0.00 63.50 62.49 1toz n PRO 517 Cb 0.53 -0.59 0.11 0.00 -0.04 0.00 0.00 33.50 33.51 1toz n PRO 517 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1toz n THR 518 N -3.06 0.00 0.00 0.52 5.66 -1.26 -4.48 114.28 111.66 1toz n THR 518 Ca 0.06 -1.46 0.00 0.00 -3.05 0.00 0.00 64.05 59.60 1toz n THR 518 Cb 0.23 1.07 0.00 0.00 -1.55 0.00 0.00 70.33 70.08 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 -0.42 -0.32 0.29 1.09 0.00 -1.26 -2.32 105.19 102.26 1toz n GLY 519 Ca -0.02 0.02 0.27 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.31 1.00 -0.02 1.61 -1.74 -1.26 0.38 117.46 115.11 1toz n PHE 520 Ca 0.00 1.07 -0.20 0.00 -0.56 0.00 0.00 57.45 57.76 1toz n PHE 520 Cb 0.00 -1.44 -0.14 0.00 1.52 0.00 0.00 39.48 39.43 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 -5.07 1.71 0.00 1.97 5.66 -1.26 -5.01 114.28 112.28 1toz n THR 521 Ca 0.33 -0.65 0.00 0.00 -3.05 0.00 0.00 64.05 60.68 1toz n THR 521 Cb 1.11 -1.63 0.00 0.00 -1.55 0.00 0.00 70.33 68.26 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 2.03 0.16 2.91 1.09 0.00 0.16 -4.98 105.19 106.56 1toz n GLY 522 Ca -0.34 -0.49 -0.07 0.00 0.00 0.00 0.00 46.02 45.12 1toz n GLY 522 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1toz n HIS 523 N 0.00 -3.15 -2.80 1.61 -0.00 -0.98 -4.91 115.22 104.99 1toz n HIS 523 Ca 0.00 1.34 -0.03 0.00 0.46 0.00 0.00 57.72 59.50 1toz n HIS 523 Cb 0.00 -3.39 0.01 0.00 -0.12 0.00 0.00 29.99 26.50 1toz n HIS 523 CO 0.00 0.00 0.00 -1.17 0.46 0.00 0.00 176.34 175.63 1toz s LEU 524 N -1.95 -1.04 -0.33 0.27 1.98 -1.26 -4.97 118.68 111.38 1toz s LEU 524 Ca 0.12 -1.09 0.03 0.00 -2.89 0.00 0.00 54.13 50.31 1toz s LEU 524 Cb -0.03 1.36 0.19 0.00 0.66 0.00 0.00 46.19 48.37 1toz s LEU 524 CO 0.68 -0.05 1.21 0.00 -1.89 0.00 0.00 176.35 176.30