#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 1.75 0.37 1.08 2.15 -1.26 -4.96 116.67 115.80 1toz s ASP 412 Ca 0.00 -1.75 -0.15 0.00 0.43 0.00 0.00 52.55 51.08 1toz s ASP 412 Cb 0.00 0.55 -0.09 0.00 -0.30 0.00 0.00 42.92 43.09 1toz s ASP 412 CO 0.00 -1.05 0.79 0.54 -0.17 0.00 0.00 175.17 175.28 1toz s VAL 413 N -3.44 4.65 -1.24 1.11 0.11 -1.26 -4.96 120.40 115.37 1toz s VAL 413 Ca 0.39 0.97 -0.14 0.00 -2.93 0.00 0.00 61.98 60.28 1toz s VAL 413 Cb 0.02 -3.64 0.15 0.00 -1.53 0.00 0.00 36.38 31.39 1toz s VAL 413 CO 0.26 -0.30 1.58 -0.67 -3.33 0.00 0.00 175.10 172.64 1toz n ASP 414 N -0.66 5.12 0.16 3.54 4.64 -1.26 -4.62 116.55 123.46 1toz n ASP 414 Ca 0.04 -2.98 0.08 0.00 -1.38 0.00 0.00 54.79 50.55 1toz n ASP 414 Cb 0.53 -1.59 0.43 0.00 -1.04 0.00 0.00 41.12 39.46 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 5.84 0.11 0.10 -0.67 1.02 -1.26 0.22 120.64 125.99 1toz n GLU 415 Ca 0.40 0.59 0.07 0.00 -0.02 0.00 0.00 57.16 58.20 1toz n GLU 415 Cb 0.42 -2.03 -0.00 0.00 -0.02 0.00 0.00 31.44 29.81 1toz n GLU 415 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1toz h SER 417 N 0.00 0.05 0.00 0.00 0.87 0.23 -3.36 113.55 111.34 1toz h SER 417 Ca -0.05 -0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1toz h SER 417 Cb 1.20 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1toz h SER 417 CO 0.02 0.86 0.00 0.18 -0.53 0.00 0.00 176.83 177.36 1toz n LEU 418 N -3.59 0.00 0.00 2.23 4.77 -0.99 -4.82 117.00 114.60 1toz n LEU 418 Ca -0.01 0.63 0.00 0.00 -0.03 0.00 0.00 56.01 56.59 1toz n LEU 418 Cb 0.79 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 1toz n LEU 418 CO 0.45 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1toz n GLY 419 N -0.87 0.00 2.80 -0.72 0.00 -1.26 -5.09 105.19 100.05 1toz n GLY 419 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 2.62 -0.30 4.61 0.00 -1.26 -5.08 121.76 122.35 1toz s ALA 420 Ca 0.00 -2.88 -0.17 0.00 0.00 0.00 0.00 51.96 48.91 1toz s ALA 420 Cb 0.00 -1.99 -0.02 0.00 0.00 0.00 0.00 23.12 21.10 1toz s ALA 420 CO 0.00 -2.05 0.45 1.21 0.00 0.00 0.00 175.76 175.37 1toz s ASN 421 N 0.06 6.31 -0.07 0.00 2.47 -1.26 -4.60 114.94 117.85 1toz s ASN 421 Ca 0.18 0.22 -0.27 0.00 0.42 0.00 0.00 52.86 53.41 1toz s ASN 421 Cb -0.24 -2.24 -0.23 0.00 -1.45 0.00 0.00 41.25 37.09 1toz s ASN 421 CO -0.01 -0.30 1.03 1.55 -3.72 0.00 0.00 177.10 175.65 1toz h PRO 422 N 8.24 0.04 0.00 0.43 0.13 -1.96 -2.99 132.00 135.89 1toz h PRO 422 Ca -0.30 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 1toz h PRO 422 Cb 1.14 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1toz h PRO 422 CO 0.70 0.78 0.01 0.00 -0.23 0.00 0.00 178.00 179.26 1toz n GLU 424 N -1.86 0.00 0.00 0.00 1.02 -1.13 -3.48 120.64 115.19 1toz n GLU 424 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1toz n GLU 424 Cb 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.44 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 -0.40 -2.60 -0.32 1.44 -1.26 -4.84 115.22 107.24 1toz n HIS 425 Ca 0.00 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.28 1toz n HIS 425 Cb 0.00 0.08 0.00 0.00 0.12 0.00 0.00 29.99 30.19 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 -1.62 4.27 0.00 1.59 0.00 -1.23 -4.84 120.51 118.68 1toz n ALA 426 Ca 0.00 -4.12 0.00 0.00 0.00 0.00 0.00 53.44 49.32 1toz n ALA 426 Cb 0.00 -3.24 0.00 0.00 0.00 0.00 0.00 19.45 16.21 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 4.18 -1.64 3.37 0.00 0.00 -1.26 -4.30 105.19 105.54 1toz n GLY 427 Ca 0.42 -1.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.02 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 3.19 -0.20 1.61 2.20 -1.08 -4.96 119.74 118.64 1toz s LYS 428 Ca 0.00 -0.71 -0.04 0.00 -0.36 0.00 0.00 55.97 54.86 1toz s LYS 428 Cb 0.00 -2.55 -0.01 0.00 -1.51 0.00 0.00 37.83 33.76 1toz s LYS 428 CO 0.00 0.28 -0.05 0.00 -0.36 0.00 0.00 175.35 175.23 1toz s ILE 430 N 1.16 1.69 -0.13 0.00 -0.00 1.00 -4.94 121.20 119.98 1toz s ILE 430 Ca 0.02 -2.00 -0.03 0.00 -0.00 0.00 0.00 60.65 58.64 1toz s ILE 430 Cb -0.14 -2.84 -0.03 0.00 -0.00 0.00 0.00 42.46 39.44 1toz s ILE 430 CO -0.01 0.00 -0.01 0.21 -0.00 0.00 0.00 174.94 175.13 1toz s ASN 431 N -3.68 5.08 0.39 4.36 2.47 -1.26 -1.12 114.94 121.19 1toz s ASN 431 Ca 0.32 0.01 0.05 0.00 0.42 0.00 0.00 52.86 53.66 1toz s ASN 431 Cb 0.09 -1.66 -0.07 0.00 -1.45 0.00 0.00 41.25 38.16 1toz s ASN 431 CO 0.16 0.26 0.03 0.42 -3.72 0.00 0.00 177.10 174.25 1toz s THR 432 N -0.16 1.61 -0.15 -5.21 -4.23 -0.42 -4.69 115.64 102.38 1toz s THR 432 Ca 0.04 -2.00 -0.29 0.00 -1.18 0.00 0.00 61.69 58.26 1toz s THR 432 Cb -0.13 -2.83 -0.01 0.00 1.34 0.00 0.00 72.50 70.87 1toz s THR 432 CO 0.02 0.00 1.12 -0.76 -0.54 0.00 0.00 174.62 174.46 1toz s LEU 433 N -3.65 4.19 0.00 4.79 1.43 -1.26 -3.64 118.68 120.54 1toz s LEU 433 Ca 0.33 1.58 0.00 0.00 -1.03 0.00 0.00 54.13 55.00 1toz s LEU 433 Cb 0.09 -3.55 0.00 0.00 0.03 0.00 0.00 46.19 42.76 1toz s LEU 433 CO 0.16 -0.63 0.00 0.61 0.23 0.00 0.00 176.35 176.72 1toz n GLY 434 N 3.36 1.59 3.41 -3.19 0.00 -1.26 -4.87 105.19 104.22 1toz n GLY 434 Ca 0.12 -0.16 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 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 2.05 0.01 1.61 0.01 -1.24 -5.03 113.70 111.11 1toz s SER 435 Ca 0.00 -1.55 0.00 0.00 1.31 0.00 0.00 55.95 55.71 1toz s SER 435 Cb 0.00 0.33 -0.04 0.00 0.21 0.00 0.00 66.02 66.52 1toz s SER 435 CO 0.00 -0.84 0.08 0.72 0.41 0.00 0.00 173.24 173.61 1toz s PHE 436 N -3.44 3.28 0.12 2.43 -0.71 -1.26 -1.30 117.98 117.10 1toz s PHE 436 Ca 0.32 0.19 0.08 0.00 -1.04 0.00 0.00 56.93 56.48 1toz s PHE 436 Cb 0.05 -1.72 -0.04 0.00 -1.21 0.00 0.00 43.02 40.10 1toz s PHE 436 CO 0.16 0.55 -0.12 -2.00 -1.34 0.00 0.00 175.22 172.47 1toz s GLU 437 N -1.84 2.04 -0.08 1.99 2.12 -0.27 -4.77 118.70 117.88 1toz s GLU 437 Ca 0.24 -1.10 -0.03 0.00 0.36 0.00 0.00 54.97 54.44 1toz s GLU 437 Cb -0.12 -2.24 0.05 0.00 0.26 0.00 0.00 34.13 32.08 1toz s GLU 437 CO 0.15 0.49 0.18 0.00 -0.54 0.00 0.00 175.26 175.54 1toz s GLN 439 N 1.72 3.50 0.54 0.00 -0.21 0.89 -4.07 119.66 122.04 1toz s GLN 439 Ca -0.04 1.58 -0.10 0.00 0.02 0.00 0.00 55.36 56.82 1toz s GLN 439 Cb -0.12 -2.08 -0.05 0.00 1.00 0.00 0.00 33.01 31.77 1toz s GLN 439 CO -0.06 -0.72 0.93 0.00 -2.12 0.00 0.00 175.29 173.32 1toz s LEU 441 N -4.73 4.25 0.00 0.00 1.98 -1.26 -4.72 118.68 114.19 1toz s LEU 441 Ca 0.53 -1.81 0.00 0.00 -2.89 0.00 0.00 54.13 49.97 1toz s LEU 441 Cb -0.11 -1.62 0.00 0.00 0.66 0.00 0.00 46.19 45.13 1toz s LEU 441 CO 0.45 -0.31 0.00 0.00 -1.89 0.00 0.00 176.35 174.60 1toz n GLN 442 N 4.37 0.00 -3.55 1.98 3.00 -1.26 -3.69 117.38 118.22 1toz n GLN 442 Ca -0.04 0.00 -0.27 0.00 -0.01 0.00 0.00 57.00 56.68 1toz n GLN 442 Cb 0.42 0.00 -0.10 0.00 0.00 0.00 0.00 30.24 30.56 1toz n GLN 442 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1toz n GLY 443 N 0.00 3.52 3.88 1.08 0.00 -1.23 -5.05 105.19 107.40 1toz n GLY 443 Ca 0.00 -2.14 -0.21 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.25 3.18 0.00 1.61 1.51 -1.24 -4.39 117.35 116.77 1toz s TYR 444 Ca 0.32 -0.11 0.00 0.00 -1.01 0.00 0.00 57.07 56.26 1toz s TYR 444 Cb 0.05 -1.53 0.00 0.00 -0.11 0.00 0.00 41.96 40.37 1toz s TYR 444 CO -0.13 0.43 0.00 -2.37 -1.11 0.00 0.00 175.55 172.36 1toz n THR 445 N -1.29 0.00 0.00 -0.71 5.66 4.66 -4.83 114.28 117.76 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 -1.01 0.12 1.09 0.00 -1.22 -1.93 105.19 107.24 1toz n GLY 446 Ca 0.00 -1.61 -0.04 0.00 0.00 0.00 0.00 46.02 44.37 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 0.05 -0.00 1.61 0.13 -1.96 -3.29 132.00 128.54 1toz h PRO 447 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1toz h PRO 447 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1toz h PRO 447 CO 0.00 0.78 -0.11 0.54 -0.23 0.00 0.00 178.00 178.98 1toz n ARG 448 N -3.66 3.82 0.00 0.86 5.12 -1.26 -5.02 116.66 116.52 1toz n ARG 448 Ca -0.01 -0.24 0.00 0.00 -1.93 0.00 0.00 57.85 55.67 1toz n ARG 448 Cb 0.73 -0.80 0.00 0.00 -1.16 0.00 0.00 32.46 31.24 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 0.00 0.00 -4.36 0.00 0.00 -0.81 -3.43 120.64 112.04 1toz n GLU 450 Ca 0.00 -0.14 -0.21 0.00 0.00 0.00 0.00 57.16 56.81 1toz n GLU 450 Cb 0.00 0.08 -0.13 0.00 0.00 0.00 0.00 31.44 31.39 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 1.27 -0.22 3.84 1.09 -1.13 0.11 121.20 126.15 1toz s ILE 451 Ca 0.00 -1.14 -0.13 0.00 -1.10 0.00 0.00 60.65 58.28 1toz s ILE 451 Cb 0.00 -1.15 -0.05 0.00 -1.06 0.00 0.00 42.46 40.21 1toz s ILE 451 CO 0.00 -0.01 0.26 -0.62 -0.10 0.00 0.00 174.94 174.47 1toz s ASP 452 N -1.33 6.25 0.44 3.58 2.15 -1.26 0.83 116.67 127.33 1toz s ASP 452 Ca 0.02 0.28 0.06 0.00 0.43 0.00 0.00 52.55 53.34 1toz s ASP 452 Cb -0.09 -2.16 0.01 0.00 -0.30 0.00 0.00 42.92 40.39 1toz s ASP 452 CO 0.02 0.01 0.61 0.54 -0.17 0.00 0.00 175.17 176.18 1toz s VAL 453 N 1.15 3.16 -0.45 1.11 0.11 -1.26 -4.74 120.40 119.48 1toz s VAL 453 Ca 0.12 -0.88 -0.14 0.00 -2.93 0.00 0.00 61.98 58.16 1toz s VAL 453 Cb -0.14 -3.10 0.07 0.00 -1.53 0.00 0.00 36.38 31.68 1toz s VAL 453 CO 0.06 -0.05 0.34 0.21 -3.33 0.00 0.00 175.10 172.33 1toz s ASN 454 N -4.33 6.00 0.21 3.54 3.84 -1.26 -4.87 114.94 118.06 1toz s ASN 454 Ca 0.53 -1.31 0.24 0.00 0.21 0.00 0.00 52.86 52.53 1toz s ASN 454 Cb -0.10 -2.12 0.35 0.00 -0.55 0.00 0.00 41.25 38.83 1toz s ASN 454 CO 0.34 -0.59 1.39 1.05 -2.79 0.00 0.00 177.10 176.51 1toz h GLU 455 N 8.64 0.00 -0.32 0.43 9.09 -1.93 -3.15 114.58 127.33 1toz h GLU 455 Ca -0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.14 1toz h GLU 455 Cb 1.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.20 1toz h GLU 455 CO 0.82 0.00 0.00 0.00 0.05 0.00 0.00 179.01 179.88 1toz h VAL 457 N 1.69 0.46 -0.14 0.00 3.04 -1.97 -2.01 116.25 117.33 1toz h VAL 457 Ca 0.00 -1.13 0.00 0.00 -1.01 0.00 0.00 66.70 64.56 1toz h VAL 457 Cb 0.43 0.83 0.00 0.00 -2.01 0.00 0.00 31.29 30.54 1toz h VAL 457 CO 0.01 0.14 0.00 -0.24 -1.01 0.00 0.00 177.57 176.47 1toz n SER 458 N -4.87 1.76 -2.66 3.17 2.88 -1.25 -3.97 113.62 108.68 1toz n SER 458 Ca -0.05 -1.68 -0.09 0.00 -1.33 0.00 0.00 58.87 55.72 1toz n SER 458 Cb 0.18 -0.09 0.03 0.00 -0.75 0.00 0.00 64.21 63.59 1toz n SER 458 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1toz n ASN 459 N 0.38 1.34 0.00 -3.46 3.02 -1.22 -4.88 115.26 110.44 1toz n ASN 459 Ca 0.17 -2.70 0.06 0.00 -0.03 0.00 0.00 54.58 52.08 1toz n ASN 459 Cb 0.36 -0.48 0.36 0.00 -0.61 0.00 0.00 39.78 39.40 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 -0.08 0.75 -1.18 3.52 -0.04 -0.75 -4.58 135.00 132.63 1toz n PRO 460 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1toz n PRO 460 Cb 0.82 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 33.03 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 -2.61 0.00 -0.15 0.00 6.02 -1.26 -2.46 117.38 116.92 1toz n GLN 462 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1toz n GLN 462 Cb 0.10 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.36 1toz n GLN 462 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1toz n ASN 463 N 10.58 0.31 -2.22 1.08 3.02 -1.26 -4.81 115.26 121.96 1toz n ASN 463 Ca 0.00 -1.49 -0.26 0.00 -0.03 0.00 0.00 54.58 52.80 1toz n ASN 463 Cb 0.00 -0.08 0.02 0.00 -0.61 0.00 0.00 39.78 39.11 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 -0.12 5.08 0.00 6.41 8.00 -1.03 -5.00 116.55 129.89 1toz n ASP 464 Ca 0.01 -3.74 0.00 0.00 0.71 0.00 0.00 54.79 51.76 1toz n ASP 464 Cb 0.54 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 -0.64 0.00 -2.55 2.24 0.00 -1.25 -4.45 120.51 113.85 1toz n ALA 465 Ca 0.44 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 1toz n ALA 465 Cb 0.83 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.19 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 -1.97 5.13 0.17 0.00 2.01 0.23 -4.69 115.64 116.52 1toz s THR 466 Ca 0.00 -0.53 -0.30 0.00 0.31 0.00 0.00 61.69 61.16 1toz s THR 466 Cb 0.00 -4.05 -0.08 0.00 0.01 0.00 0.00 72.50 68.38 1toz s THR 466 CO 0.00 -0.45 1.30 0.00 -0.69 0.00 0.00 174.62 174.77 1toz s LEU 468 N 0.20 3.33 0.01 0.00 1.43 0.50 -4.93 118.68 119.21 1toz s LEU 468 Ca 0.58 -2.92 -0.30 0.00 -1.03 0.00 0.00 54.13 50.46 1toz s LEU 468 Cb -0.35 -1.24 -0.07 0.00 0.03 0.00 0.00 46.19 44.55 1toz s LEU 468 CO 0.36 -0.23 1.77 -0.62 0.23 0.00 0.00 176.35 177.86 1toz s ASP 469 N -0.08 6.57 0.07 2.29 -1.08 -1.26 -1.69 116.67 121.50 1toz s ASP 469 Ca 0.19 2.45 0.00 0.00 -0.52 0.00 0.00 52.55 54.67 1toz s ASP 469 Cb -0.20 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 1toz s ASP 469 CO -0.03 -0.97 0.01 0.00 0.52 0.00 0.00 175.17 174.70 1toz n GLN 470 N 6.96 1.73 -2.34 4.34 6.02 0.36 -4.97 117.38 129.48 1toz n GLN 470 Ca 0.18 -0.50 -0.42 0.00 -0.01 0.00 0.00 57.00 56.24 1toz n GLN 470 Cb 0.42 0.12 -0.03 0.00 1.02 0.00 0.00 30.24 31.77 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 -1.06 4.05 -0.08 5.09 -5.25 -1.26 -3.22 121.20 119.46 1toz s ILE 471 Ca 0.01 1.35 0.00 0.00 -0.99 0.00 0.00 60.65 61.02 1toz s ILE 471 Cb -0.00 -3.87 0.00 0.00 2.95 0.00 0.00 42.46 41.54 1toz s ILE 471 CO 0.01 -0.04 0.00 0.61 -1.79 0.00 0.00 174.94 173.72 1toz n GLY 472 N 3.58 -0.26 3.54 6.27 0.00 -1.25 -4.77 105.19 112.30 1toz n GLY 472 Ca 0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.04 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 -3.81 0.77 0.02 1.61 4.04 -1.20 -3.48 118.70 116.65 1toz s GLU 473 Ca 0.00 -0.03 -0.04 0.00 0.04 0.00 0.00 54.97 54.94 1toz s GLU 473 Cb 0.00 0.36 -0.01 0.00 0.02 0.00 0.00 34.13 34.50 1toz s GLU 473 CO 0.00 -0.28 0.07 -0.59 -1.84 0.00 0.00 175.26 172.62 1toz s PHE 474 N -1.97 0.17 -0.06 4.83 -0.12 -1.26 0.14 117.98 119.70 1toz s PHE 474 Ca -0.00 -0.39 -0.04 0.00 -0.05 0.00 0.00 56.93 56.45 1toz s PHE 474 Cb -0.01 -0.13 0.03 0.00 -0.63 0.00 0.00 43.02 42.28 1toz s PHE 474 CO -0.02 -0.28 0.16 1.14 -0.05 0.00 0.00 175.22 176.17 1toz s GLN 475 N -1.84 0.14 -0.18 1.99 -2.07 -0.68 -4.92 119.66 112.10 1toz s GLN 475 Ca -0.12 0.31 -0.04 0.00 -1.82 0.00 0.00 55.36 53.69 1toz s GLN 475 Cb -0.06 -0.05 -0.02 0.00 -1.09 0.00 0.00 33.01 31.79 1toz s GLN 475 CO -0.01 -0.10 -0.03 0.00 -1.32 0.00 0.00 175.29 173.83 1toz s ILE 477 N 0.77 4.59 0.38 0.00 1.09 0.23 -4.75 121.20 123.51 1toz s ILE 477 Ca -0.01 0.49 0.03 0.00 -1.10 0.00 0.00 60.65 60.06 1toz s ILE 477 Cb -0.14 -4.37 0.03 0.00 -1.06 0.00 0.00 42.46 36.92 1toz s ILE 477 CO 0.02 -0.78 0.29 0.00 -0.10 0.00 0.00 174.94 174.37 1toz s MET 479 N -3.57 3.97 -0.73 0.00 -1.94 -1.26 -4.94 119.30 110.83 1toz s MET 479 Ca 0.22 0.72 -0.06 0.00 -1.71 0.00 0.00 55.69 54.86 1toz s MET 479 Cb -0.02 -2.34 -0.12 0.00 2.01 0.00 0.00 34.83 34.36 1toz s MET 479 CO 0.14 0.02 2.62 -0.35 -0.01 0.00 0.00 175.02 177.44 1toz n PRO 480 N -0.81 2.27 0.00 2.03 -0.04 -1.26 -2.97 135.00 134.21 1toz n PRO 480 Ca 0.04 -1.36 0.00 0.00 -0.04 0.00 0.00 63.50 62.14 1toz n PRO 480 Cb 0.54 -2.31 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 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 3.26 -0.03 3.84 0.55 0.00 -1.26 -5.14 105.19 106.42 1toz n GLY 481 Ca 0.48 -0.04 -0.22 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 -1.36 2.62 0.39 1.61 1.51 -1.16 -3.72 117.35 117.24 1toz s TYR 482 Ca 0.00 -0.54 -0.12 0.00 -1.01 0.00 0.00 57.07 55.40 1toz s TYR 482 Cb 0.00 -2.10 0.05 0.00 -0.11 0.00 0.00 41.96 39.79 1toz s TYR 482 CO 0.00 -0.06 0.73 -1.91 -1.11 0.00 0.00 175.55 173.20 1toz n GLU 483 N -1.48 1.05 0.00 -0.62 2.13 -0.72 -4.70 120.64 116.30 1toz n GLU 483 Ca 0.02 -2.40 0.00 0.00 0.66 0.00 0.00 57.16 55.44 1toz n GLU 483 Cb 0.63 2.80 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 -0.55 0.15 0.14 8.31 0.00 -1.26 -2.16 105.19 109.82 1toz n GLY 484 Ca -0.07 -2.26 -0.17 0.00 0.00 0.00 0.00 46.02 43.52 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 1.40 -0.46 1.61 3.04 -2.00 -3.24 116.25 116.59 1toz h VAL 485 Ca 0.00 -2.68 0.00 0.00 -1.01 0.00 0.00 66.70 63.01 1toz h VAL 485 Cb 0.00 2.72 0.00 0.00 -2.01 0.00 0.00 31.29 32.00 1toz h VAL 485 CO 0.00 0.80 0.00 0.00 -1.01 0.00 0.00 177.57 177.36 1toz n HIS 486 N -3.68 0.62 -4.26 3.17 -0.00 -1.26 -4.33 115.22 105.48 1toz n HIS 486 Ca -0.10 -0.49 -0.31 0.00 -0.00 0.00 0.00 57.72 56.82 1toz n HIS 486 Cb 0.96 -0.02 -0.08 0.00 -0.00 0.00 0.00 29.99 30.85 1toz n HIS 486 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1toz n GLU 488 N -4.58 -0.49 -3.22 0.00 4.07 -1.17 -4.50 120.64 110.74 1toz n GLU 488 Ca -0.32 -0.39 -0.39 0.00 -0.06 0.00 0.00 57.16 56.01 1toz n GLU 488 Cb 0.69 -0.83 -0.06 0.00 -0.06 0.00 0.00 31.44 31.19 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 -0.04 5.14 -0.89 6.31 -7.23 -0.92 -4.74 120.40 118.02 1toz s VAL 489 Ca 0.00 1.12 -0.24 0.00 -1.81 0.00 0.00 61.98 61.04 1toz s VAL 489 Cb 0.00 -3.89 0.01 0.00 0.56 0.00 0.00 36.38 33.05 1toz s VAL 489 CO 0.00 0.29 1.65 0.54 -0.31 0.00 0.00 175.10 177.27 1toz s ASN 490 N 0.71 5.84 0.36 4.85 2.20 -1.26 -1.76 114.94 125.89 1toz s ASN 490 Ca 0.30 -0.84 0.00 0.00 -0.94 0.00 0.00 52.86 51.37 1toz s ASN 490 Cb -0.16 -2.56 0.00 0.00 -2.00 0.00 0.00 41.25 36.53 1toz s ASN 490 CO 0.13 -2.08 0.00 0.41 -2.94 0.00 0.00 177.10 172.62 1toz n THR 491 N 7.20 -0.13 -2.59 0.54 -1.04 -1.24 -4.81 114.28 112.20 1toz n THR 491 Ca 0.30 0.41 -0.24 0.00 -2.04 0.00 0.00 64.05 62.47 1toz n THR 491 Cb 0.49 -0.75 0.03 0.00 -1.82 0.00 0.00 70.33 68.29 1toz n THR 491 CO 0.00 0.00 0.00 1.51 -0.64 0.00 0.00 175.07 175.94 1toz s ASP 492 N -6.06 5.47 -0.02 8.00 -4.77 -1.26 -4.91 116.67 113.12 1toz s ASP 492 Ca 0.00 0.39 0.15 0.00 -3.30 0.00 0.00 52.55 49.79 1toz s ASP 492 Cb 0.00 -1.38 0.26 0.00 -1.09 0.00 0.00 42.92 40.71 1toz s ASP 492 CO 0.00 -1.06 1.11 -0.62 0.70 0.00 0.00 175.17 175.30 1toz n GLU 493 N -2.44 0.11 -1.63 2.11 4.71 -1.26 -4.85 120.64 117.39 1toz n GLU 493 Ca 0.05 -1.62 0.03 0.00 -0.01 0.00 0.00 57.16 55.61 1toz n GLU 493 Cb 0.58 0.16 0.02 0.00 -1.01 0.00 0.00 31.44 31.19 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 1.14 1.00 0.03 0.00 0.00 -2.01 -3.16 119.26 116.26 1toz h ALA 495 Ca -0.23 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.29 1toz h ALA 495 Cb 1.82 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.56 1toz h ALA 495 CO 0.10 0.00 -2.33 0.43 0.00 0.00 0.00 179.25 177.45 1toz n SER 496 N -2.32 2.01 -4.22 0.00 7.64 -1.26 -4.80 113.62 110.67 1toz n SER 496 Ca 0.03 0.02 -0.40 0.00 1.01 0.00 0.00 58.87 59.54 1toz n SER 496 Cb 0.32 -0.58 -0.10 0.00 -1.01 0.00 0.00 64.21 62.84 1toz n SER 496 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1toz s SER 497 N -6.77 5.58 0.13 6.43 1.04 -1.19 -4.91 113.70 114.01 1toz s SER 497 Ca -0.32 -1.75 0.24 0.00 0.48 0.00 0.00 55.95 54.59 1toz s SER 497 Cb 0.09 -1.96 0.91 0.00 0.10 0.00 0.00 66.02 65.16 1toz s SER 497 CO 0.62 -0.59 1.73 -0.81 0.98 0.00 0.00 173.24 175.17 1toz n PRO 498 N 4.85 0.13 0.00 4.02 -0.04 -1.25 -4.73 135.00 137.97 1toz n PRO 498 Ca -0.08 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1toz n PRO 498 Cb 0.42 -1.69 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 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 0.00 0.00 -0.09 0.00 -0.00 -1.23 -3.44 117.00 112.24 1toz n LEU 500 Ca 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 56.01 56.09 1toz n LEU 500 Cb 0.00 0.00 0.42 0.00 -0.00 0.00 0.00 43.42 43.84 1toz n LEU 500 CO 0.00 -0.02 0.78 1.41 -0.00 0.00 0.00 177.39 179.56 1toz n HIS 501 N 0.00 0.04 0.81 1.96 8.25 -1.26 -2.65 115.22 122.37 1toz n HIS 501 Ca 0.00 -0.02 0.12 0.00 -0.26 0.00 0.00 57.72 57.56 1toz n HIS 501 Cb 0.00 0.00 0.20 0.00 1.12 0.00 0.00 29.99 31.31 1toz n HIS 501 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1toz n ASN 502 N -0.56 2.94 0.00 0.41 4.13 -1.22 -4.68 115.26 116.28 1toz n ASN 502 Ca 0.12 -1.93 0.00 0.00 1.68 0.00 0.00 54.58 54.44 1toz n ASN 502 Cb 0.09 -0.10 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1toz n ASN 502 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1toz n GLY 503 N 1.38 1.27 3.17 7.41 0.00 -1.08 -4.60 105.19 112.73 1toz n GLY 503 Ca 0.17 -0.70 -0.34 0.00 0.00 0.00 0.00 46.02 45.15 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 2.68 -0.60 1.61 6.06 -0.94 -3.58 118.95 122.19 1toz s ARG 504 Ca 0.00 -1.08 -0.28 0.00 -2.50 0.00 0.00 55.73 51.88 1toz s ARG 504 Cb 0.00 -2.99 0.02 0.00 0.06 0.00 0.00 34.95 32.05 1toz s ARG 504 CO 0.00 -0.45 1.29 0.00 -2.50 0.00 0.00 175.30 173.64 1toz s LEU 506 N 5.51 4.32 -0.97 0.00 1.02 -0.41 -4.85 118.68 123.31 1toz s LEU 506 Ca 0.45 1.93 -0.06 0.00 0.02 0.00 0.00 54.13 56.47 1toz s LEU 506 Cb -0.09 -4.00 0.24 0.00 0.02 0.00 0.00 46.19 42.36 1toz s LEU 506 CO 0.23 -0.17 0.90 -0.62 0.02 0.00 0.00 176.35 176.72 1toz s ASP 507 N -1.52 6.59 0.60 2.29 3.68 -1.26 -2.16 116.67 124.89 1toz s ASP 507 Ca 0.51 -3.54 -0.09 0.00 2.13 0.00 0.00 52.55 51.57 1toz s ASP 507 Cb -0.21 -2.06 -0.02 0.00 -1.45 0.00 0.00 42.92 39.18 1toz s ASP 507 CO 0.27 -0.27 0.96 -0.54 0.13 0.00 0.00 175.17 175.71 1toz s LYS 508 N -1.12 3.33 -1.40 4.34 1.02 -0.69 -4.80 119.74 120.42 1toz s LYS 508 Ca 0.27 0.42 -0.13 0.00 0.02 0.00 0.00 55.97 56.55 1toz s LYS 508 Cb -0.09 -2.18 0.07 0.00 -0.52 0.00 0.00 37.83 35.11 1toz s LYS 508 CO -0.10 -0.59 2.09 -0.89 -0.92 0.00 0.00 175.35 174.95 1toz n ILE 509 N -2.64 3.72 0.00 2.17 -0.00 -1.26 -3.17 119.36 118.17 1toz n ILE 509 Ca 0.04 -3.46 0.00 0.00 -0.00 0.00 0.00 62.75 59.34 1toz n ILE 509 Cb 0.56 -2.53 0.00 0.00 -0.00 0.00 0.00 39.64 37.67 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 5.77 0.00 -3.54 4.38 3.02 -1.26 -4.89 115.26 118.74 1toz n ASN 510 Ca 0.49 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 55.02 1toz n ASN 510 Cb 0.39 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.57 1toz n ASN 510 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1toz s GLU 511 N 0.00 1.08 -0.01 3.52 2.12 -1.19 -5.07 118.70 119.16 1toz s GLU 511 Ca 0.00 -0.66 -0.01 0.00 0.36 0.00 0.00 54.97 54.66 1toz s GLU 511 Cb 0.00 0.33 -0.04 0.00 0.26 0.00 0.00 34.13 34.68 1toz s GLU 511 CO 0.00 -0.50 0.08 -0.06 -0.54 0.00 0.00 175.26 174.24 1toz s PHE 512 N -2.49 3.30 -0.22 5.30 0.40 -1.26 -1.70 117.98 121.31 1toz s PHE 512 Ca 0.19 0.22 -0.01 0.00 -0.60 0.00 0.00 56.93 56.73 1toz s PHE 512 Cb -0.01 -1.75 0.06 0.00 0.51 0.00 0.00 43.02 41.84 1toz s PHE 512 CO 0.03 0.56 0.00 -1.14 0.70 0.00 0.00 175.22 175.37 1toz s GLN 513 N -1.71 1.08 -0.52 0.44 2.00 -0.92 -4.89 119.66 115.14 1toz s GLN 513 Ca 0.23 -0.75 -0.28 0.00 -2.00 0.00 0.00 55.36 52.56 1toz s GLN 513 Cb -0.12 -2.32 0.01 0.00 0.80 0.00 0.00 33.01 31.38 1toz s GLN 513 CO 0.14 -0.66 1.41 0.00 -0.50 0.00 0.00 175.29 175.68 1toz n GLU 515 N 8.50 1.88 -3.81 0.00 0.28 0.94 -4.77 120.64 123.66 1toz n GLU 515 Ca 0.14 0.00 -0.36 0.00 -0.16 0.00 0.00 57.16 56.78 1toz n GLU 515 Cb 0.49 0.00 -0.06 0.00 1.43 0.00 0.00 31.44 33.30 1toz n GLU 515 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1toz n PRO 517 N 1.56 0.66 -2.67 0.00 -0.04 -1.26 -4.59 135.00 128.67 1toz n PRO 517 Ca -0.15 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.26 1toz n PRO 517 Cb 0.54 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.03 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 -0.70 0.00 0.10 0.52 5.66 -1.26 -5.02 114.28 113.58 1toz n THR 518 Ca 0.00 -0.78 0.00 0.00 -3.05 0.00 0.00 64.05 60.22 1toz n THR 518 Cb 0.00 0.75 0.00 0.00 -1.55 0.00 0.00 70.33 69.53 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 -0.31 -0.72 3.35 1.09 0.00 -1.26 -5.06 105.19 102.29 1toz n GLY 519 Ca -0.19 0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 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 -3.03 0.51 -1.77 1.61 -1.74 -1.26 -4.73 117.46 107.05 1toz n PHE 520 Ca 0.00 0.35 -0.40 0.00 -0.56 0.00 0.00 57.45 56.84 1toz n PHE 520 Cb 0.00 -2.20 -0.03 0.00 1.52 0.00 0.00 39.48 38.77 1toz n PHE 520 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1toz s THR 521 N 8.23 3.19 0.00 1.97 -4.23 -1.26 -4.45 115.64 119.09 1toz s THR 521 Ca 1.30 0.16 0.00 0.00 -1.18 0.00 0.00 61.69 61.97 1toz s THR 521 Cb -1.19 -3.34 0.00 0.00 1.34 0.00 0.00 72.50 69.31 1toz s THR 521 CO 0.47 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.88 1toz n GLY 522 N 5.74 -1.22 0.00 3.99 0.00 -1.26 -5.12 105.19 107.32 1toz n GLY 522 Ca 0.28 0.71 0.00 0.00 0.00 0.00 0.00 46.02 47.02 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 -2.68 1.61 8.25 -1.26 -5.08 115.22 116.06 1toz n HIS 523 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.41 1toz n HIS 523 Cb 0.00 0.00 0.08 0.00 1.12 0.00 0.00 29.99 31.19 1toz n HIS 523 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1toz n LEU 524 N 0.00 -1.59 -3.61 2.41 7.94 -1.26 -5.14 117.00 115.75 1toz n LEU 524 Ca 0.00 -2.90 -0.02 0.00 -1.11 0.00 0.00 56.01 51.98 1toz n LEU 524 Cb 0.00 0.29 -0.02 0.00 0.53 0.00 0.00 43.42 44.22 1toz n LEU 524 CO 0.00 1.64 1.09 0.00 -1.11 0.00 0.00 177.39 179.02