#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w1d n LEU 408 N 0.00 3.71 0.00 2.45 -0.00 -1.26 -1.98 117.00 119.92 1w1d n LEU 408 Ca 0.00 1.08 0.00 0.00 -0.00 0.00 0.00 56.01 57.09 1w1d n LEU 408 Cb 0.00 -1.52 0.00 0.00 -0.00 0.00 0.00 43.42 41.90 1w1d n LEU 408 CO 0.00 -0.01 0.00 0.61 -0.00 0.00 0.00 177.39 177.99 1w1d n GLY 409 N 3.45 0.77 0.14 1.47 0.00 -1.26 -4.95 105.19 104.80 1w1d n GLY 409 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.96 1w1d n GLY 409 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1w1d h SER 410 N 0.00 0.69 -6.14 1.61 4.64 -1.93 -3.48 113.55 108.94 1w1d h SER 410 Ca 0.00 -0.71 -0.32 0.00 -0.47 0.00 0.00 61.79 60.29 1w1d h SER 410 Cb 0.00 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 61.87 1w1d h SER 410 CO 0.00 1.55 -0.71 -3.20 -0.87 0.00 0.00 176.83 173.60 1w1d n ASN 411 N -3.66 -3.02 0.29 4.97 5.15 -1.26 -4.80 115.26 112.94 1w1d n ASN 411 Ca -0.13 -0.63 0.16 0.00 -0.60 0.00 0.00 54.58 53.39 1w1d n ASN 411 Cb 1.05 -1.01 0.90 0.00 -0.53 0.00 0.00 39.78 40.20 1w1d n ASN 411 CO 0.00 0.00 0.00 -0.29 1.40 0.00 0.00 177.26 178.37 1w1d h ILE 412 N 0.17 0.35 0.00 -1.44 6.09 -1.96 -2.26 117.51 118.47 1w1d h ILE 412 Ca -0.41 -0.26 0.00 0.00 -1.37 0.00 0.00 64.86 62.81 1w1d h ILE 412 Cb 0.89 1.19 0.00 0.00 0.47 0.00 0.00 36.82 39.37 1w1d h ILE 412 CO 0.24 0.05 0.00 -0.62 -3.07 0.00 0.00 178.15 174.74 1w1d n GLU 413 N -3.49 0.16 0.12 2.19 4.71 -1.26 -2.14 120.64 120.92 1w1d n GLU 413 Ca -0.02 0.57 0.18 0.00 -0.01 0.00 0.00 57.16 57.87 1w1d n GLU 413 Cb 0.16 -1.94 0.74 0.00 -1.01 0.00 0.00 31.44 29.40 1w1d n GLU 413 CO 0.00 0.00 0.00 -0.56 0.09 0.00 0.00 177.13 176.66 1w1d h GLN 414 N 0.00 0.00 -0.00 3.49 3.07 -1.75 -1.68 115.11 118.24 1w1d h GLN 414 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1w1d h GLN 414 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.69 1w1d h GLN 414 CO 0.00 0.00 -0.20 0.66 0.09 0.00 0.00 178.83 179.38 1w1d n TYR 415 N -4.11 0.00 -4.35 0.06 4.01 -0.91 -4.85 117.16 107.01 1w1d n TYR 415 Ca 0.05 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.45 1w1d n TYR 415 Cb 0.45 -0.18 -0.11 0.00 -0.31 0.00 0.00 39.34 39.19 1w1d n TYR 415 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1w1d s ILE 416 N -2.55 4.09 -0.26 -0.72 1.01 -0.63 -1.12 121.20 121.02 1w1d s ILE 416 Ca 0.25 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.61 1w1d s ILE 416 Cb 0.19 -2.78 0.07 0.00 0.01 0.00 0.00 42.46 39.96 1w1d s ILE 416 CO 0.51 0.51 -0.00 -1.00 0.00 0.00 0.00 174.94 174.97 1w1d s HIS 417 N 0.07 2.40 0.14 3.97 3.76 0.06 -5.00 115.29 120.70 1w1d s HIS 417 Ca 0.01 -1.91 -0.29 0.00 -0.15 0.00 0.00 55.06 52.72 1w1d s HIS 417 Cb -0.13 -1.79 -0.07 0.00 1.11 0.00 0.00 32.58 31.70 1w1d s HIS 417 CO 0.02 -0.81 0.92 -0.51 -0.85 0.00 0.00 174.74 173.51 1w1d s ASP 418 N 1.39 7.50 -0.14 1.40 1.01 -1.26 -1.19 116.67 125.37 1w1d s ASP 418 Ca 0.00 1.78 0.17 0.00 0.71 0.00 0.00 52.55 55.21 1w1d s ASP 418 Cb -0.18 -2.57 -0.24 0.00 1.01 0.00 0.00 42.92 40.93 1w1d s ASP 418 CO -0.10 0.02 0.15 0.18 0.21 0.00 0.00 175.17 175.63 1w1d n LEU 419 N 2.37 0.00 -3.88 1.23 4.77 -0.28 -4.96 117.00 116.26 1w1d n LEU 419 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 1w1d n LEU 419 Cb 0.49 0.33 0.02 0.00 -2.33 0.00 0.00 43.42 41.93 1w1d n LEU 419 CO 0.50 0.33 0.75 -1.81 -1.33 0.00 0.00 177.39 175.84 1w1d s ASP 420 N -4.96 0.02 0.51 -1.43 1.11 -1.04 -4.99 116.67 105.89 1w1d s ASP 420 Ca -0.08 -0.81 0.22 0.00 0.18 0.00 0.00 52.55 52.06 1w1d s ASP 420 Cb 0.07 0.58 1.37 0.00 1.07 0.00 0.00 42.92 46.02 1w1d s ASP 420 CO 0.75 -1.16 2.10 0.77 1.18 0.00 0.00 175.17 178.81 1w1d h SER 421 N 2.00 0.00 -0.05 0.27 4.64 -2.02 -2.92 113.55 115.47 1w1d h SER 421 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1w1d h SER 421 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1w1d h SER 421 CO 0.38 0.10 0.00 -0.46 -0.87 0.00 0.00 176.83 175.98 1w1d n ASN 422 N -4.01 2.65 -3.71 4.97 0.23 -1.26 -5.00 115.26 109.12 1w1d n ASN 422 Ca -0.02 -3.06 -0.15 0.00 -0.53 0.00 0.00 54.58 50.81 1w1d n ASN 422 Cb 0.19 -0.45 -0.15 0.00 -2.08 0.00 0.00 39.78 37.29 1w1d n ASN 422 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1w1d s SER 423 N -2.68 0.33 0.25 0.53 0.15 -1.10 -3.71 113.70 107.48 1w1d s SER 423 Ca 0.34 0.28 -0.16 0.00 0.70 0.00 0.00 55.95 57.11 1w1d s SER 423 Cb 0.29 0.18 0.01 0.00 -1.71 0.00 0.00 66.02 64.79 1w1d s SER 423 CO 0.04 -0.19 0.56 0.72 1.20 0.00 0.00 173.24 175.57 1w1d s PHE 424 N 1.69 0.11 0.03 3.44 -0.12 -0.92 -1.12 117.98 121.09 1w1d s PHE 424 Ca -0.03 -0.50 -0.00 0.00 -0.05 0.00 0.00 56.93 56.34 1w1d s PHE 424 Cb -0.12 0.38 -0.03 0.00 -0.63 0.00 0.00 43.02 42.63 1w1d s PHE 424 CO -0.05 -1.06 -0.03 -1.83 -0.05 0.00 0.00 175.22 172.20 1w1d s GLU 425 N -3.96 0.41 -0.09 1.99 -1.05 -0.33 -1.58 118.70 114.08 1w1d s GLU 425 Ca 0.17 -0.80 -0.02 0.00 -0.15 0.00 0.00 54.97 54.16 1w1d s GLU 425 Cb -0.02 0.14 -0.03 0.00 -0.44 0.00 0.00 34.13 33.78 1w1d s GLU 425 CO 0.06 -0.07 -0.01 -0.51 0.95 0.00 0.00 175.26 175.69 1w1d s LEU 426 N -1.93 3.52 0.38 1.83 1.02 0.36 -0.76 118.68 123.10 1w1d s LEU 426 Ca -0.09 0.11 -0.27 0.00 0.02 0.00 0.00 54.13 53.91 1w1d s LEU 426 Cb -0.04 -1.80 -0.09 0.00 0.02 0.00 0.00 46.19 44.27 1w1d s LEU 426 CO -0.04 0.36 1.26 -1.81 0.02 0.00 0.00 176.35 176.15 1w1d s ASP 427 N -0.79 6.52 0.00 2.29 1.01 -0.28 -4.95 116.67 120.48 1w1d s ASP 427 Ca 0.12 2.58 0.25 0.00 0.71 0.00 0.00 52.55 56.20 1w1d s ASP 427 Cb -0.11 -2.64 0.48 0.00 1.01 0.00 0.00 42.92 41.66 1w1d s ASP 427 CO 0.02 -0.70 1.42 0.18 0.21 0.00 0.00 175.17 176.31 1w1d n LEU 428 N 0.34 2.60 -0.86 1.23 4.77 -1.26 -4.53 117.00 119.29 1w1d n LEU 428 Ca 0.03 -0.93 0.10 0.00 -0.03 0.00 0.00 56.01 55.18 1w1d n LEU 428 Cb 0.44 -0.04 0.28 0.00 -2.33 0.00 0.00 43.42 41.76 1w1d n LEU 428 CO 0.55 0.46 0.72 0.00 -1.33 0.00 0.00 177.39 177.80 1w1d n GLN 429 N 1.01 2.11 -1.11 3.23 0.00 -1.26 -4.95 117.38 116.41 1w1d n GLN 429 Ca 0.16 -1.69 -0.31 0.00 0.00 0.00 0.00 57.00 55.16 1w1d n GLN 429 Cb 0.52 -1.43 0.12 0.00 0.00 0.00 0.00 30.24 29.45 1w1d n GLN 429 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.06 176.47 1w1d s PHE 430 N -1.56 2.30 0.69 2.61 -0.12 -1.26 -5.03 117.98 115.62 1w1d s PHE 430 Ca 0.35 1.54 -0.10 0.00 -0.05 0.00 0.00 56.93 58.67 1w1d s PHE 430 Cb 0.19 -3.13 0.03 0.00 -0.63 0.00 0.00 43.02 39.48 1w1d s PHE 430 CO 0.27 -2.17 1.05 -1.54 -0.05 0.00 0.00 175.22 172.79 1w1d s SER 431 N -3.23 5.27 0.25 1.98 1.04 -1.26 -4.85 113.70 112.90 1w1d s SER 431 Ca 0.63 0.90 -0.04 0.00 0.48 0.00 0.00 55.95 57.93 1w1d s SER 431 Cb -0.19 -1.69 0.41 0.00 0.10 0.00 0.00 66.02 64.66 1w1d s SER 431 CO 0.57 -1.39 1.82 -0.08 0.98 0.00 0.00 173.24 175.14 1w1d h GLU 432 N -0.59 0.81 -0.53 4.02 4.81 -1.99 0.11 114.58 121.22 1w1d h GLU 432 Ca -0.45 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.67 1w1d h GLU 432 Cb 1.27 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 1w1d h GLU 432 CO 0.63 0.54 0.08 -0.44 -0.73 0.00 0.00 179.01 179.09 1w1d h ASP 433 N 0.83 0.85 -0.39 1.04 3.32 -2.01 -2.67 116.42 117.39 1w1d h ASP 433 Ca 0.41 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 57.13 1w1d h ASP 433 Cb 0.36 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1w1d h ASP 433 CO -0.24 0.90 0.03 -0.33 -1.72 0.00 0.00 179.24 177.87 1w1d h GLU 434 N 0.76 0.76 -0.87 3.56 5.08 -1.79 -2.66 114.58 119.42 1w1d h GLU 434 Ca 0.16 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.38 1w1d h GLU 434 Cb 0.41 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 1w1d h GLU 434 CO 0.01 0.75 0.55 -0.22 -1.00 0.00 0.00 179.01 179.10 1w1d h LYS 435 N 0.71 1.01 -0.97 2.33 3.64 -0.51 -0.51 116.57 122.28 1w1d h LYS 435 Ca 0.15 -0.06 0.08 0.00 -1.27 0.00 0.00 60.65 59.55 1w1d h LYS 435 Cb 0.40 -0.23 -0.07 0.00 -0.41 0.00 0.00 32.23 31.92 1w1d h LYS 435 CO 0.01 0.67 0.62 -0.09 -2.27 0.00 0.00 179.45 178.39 1w1d h ARG 436 N 1.04 1.03 -0.02 1.90 2.43 -1.15 0.40 114.38 120.01 1w1d h ARG 436 Ca 0.37 -0.06 -0.24 0.00 -0.81 0.00 0.00 59.98 59.23 1w1d h ARG 436 Cb 0.10 -0.23 0.01 0.00 -0.42 0.00 0.00 29.97 29.43 1w1d h ARG 436 CO -0.15 0.68 -0.95 1.25 -1.51 0.00 0.00 179.97 179.29 1w1d h LEU 437 N 1.06 0.74 -0.80 3.80 5.85 -1.29 -1.22 115.31 123.45 1w1d h LEU 437 Ca 0.44 -0.57 0.01 0.00 0.84 0.00 0.00 57.88 58.60 1w1d h LEU 437 Cb 0.29 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.05 1w1d h LEU 437 CO -0.21 1.37 0.53 -0.07 -0.34 0.00 0.00 178.44 179.72 1w1d h LEU 438 N 0.34 0.92 -0.57 2.25 3.38 -0.73 -1.29 115.31 119.61 1w1d h LEU 438 Ca -0.10 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.76 1w1d h LEU 438 Cb 1.59 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 1w1d h LEU 438 CO 0.18 0.66 0.01 0.25 0.09 0.00 0.00 178.44 179.63 1w1d h LEU 439 N 1.08 0.99 -0.64 1.67 5.85 -0.78 -1.28 115.31 122.20 1w1d h LEU 439 Ca 0.30 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1w1d h LEU 439 Cb -0.12 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.62 1w1d h LEU 439 CO -0.07 1.05 0.35 -0.08 -0.34 0.00 0.00 178.44 179.35 1w1d h GLU 440 N 0.90 0.90 -0.30 1.25 4.81 -0.86 0.88 114.58 122.15 1w1d h GLU 440 Ca 0.16 -0.10 0.02 0.00 -0.13 0.00 0.00 59.36 59.31 1w1d h GLU 440 Cb 0.54 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 1w1d h GLU 440 CO 0.03 0.68 0.14 -0.22 -0.73 0.00 0.00 179.01 178.90 1w1d h LYS 441 N 0.88 0.29 -0.26 1.92 3.64 -1.10 -1.76 116.57 120.18 1w1d h LYS 441 Ca 0.23 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1w1d h LYS 441 Cb 0.04 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 1w1d h LYS 441 CO -0.04 0.19 0.12 0.37 -2.27 0.00 0.00 179.45 177.82 1w1d h GLN 442 N 0.29 0.25 -0.51 1.90 4.15 -0.83 -1.32 115.11 119.05 1w1d h GLN 442 Ca 0.13 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1w1d h GLN 442 Cb 0.06 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 1w1d h GLN 442 CO -0.10 0.17 0.34 0.00 -1.93 0.00 0.00 178.83 177.30 1w1d h ALA 443 N 1.14 1.64 0.03 3.38 0.00 -0.60 0.23 119.26 125.08 1w1d h ALA 443 Ca 0.11 -0.04 -0.25 0.00 0.00 0.00 0.00 54.91 54.74 1w1d h ALA 443 Cb 0.05 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.64 1w1d h ALA 443 CO -0.09 0.34 -1.03 0.78 0.00 0.00 0.00 179.25 179.25 1w1d h GLY 444 N 0.69 0.52 0.00 0.00 0.00 -1.04 -3.42 103.07 99.82 1w1d h GLY 444 Ca 0.19 -0.98 0.00 0.00 0.00 0.00 0.00 47.33 46.54 1w1d h GLY 444 CO -0.04 0.87 0.00 0.61 0.00 0.00 0.00 176.54 177.98 1w1d n GLY 445 N 1.09 0.99 3.59 4.60 0.00 -0.52 -4.99 105.19 109.94 1w1d n GLY 445 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 1w1d n GLY 445 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w1d s ASN 446 N -0.62 6.17 0.12 1.61 3.84 0.04 -4.95 114.94 121.14 1w1d s ASN 446 Ca 0.00 0.09 0.15 0.00 0.21 0.00 0.00 52.86 53.31 1w1d s ASN 446 Cb 0.00 -2.18 0.66 0.00 -0.55 0.00 0.00 41.25 39.18 1w1d s ASN 446 CO 0.00 -0.17 1.45 -0.81 -2.79 0.00 0.00 177.10 174.78 1w1d n PRO 447 N 5.26 0.07 -0.04 0.43 -0.04 -1.26 -2.12 135.00 137.30 1w1d n PRO 447 Ca -0.10 0.41 0.12 0.00 -0.04 0.00 0.00 63.50 63.89 1w1d n PRO 447 Cb 0.51 -1.67 0.17 0.00 -0.04 0.00 0.00 33.50 32.47 1w1d n PRO 447 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1w1d n TRP 448 N -1.81 0.10 -0.36 0.54 7.02 -1.26 -4.51 117.44 117.16 1w1d n TRP 448 Ca 0.02 -0.05 0.06 0.00 -1.02 0.00 0.00 57.50 56.50 1w1d n TRP 448 Cb 0.13 0.00 0.22 0.00 -2.42 0.00 0.00 31.31 29.24 1w1d n TRP 448 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1w1d h HIS 449 N 4.36 1.15 -0.02 -5.99 2.76 -1.72 -1.52 115.15 114.17 1w1d h HIS 449 Ca 0.00 0.03 0.01 0.00 -2.20 0.00 0.00 60.37 58.21 1w1d h HIS 449 Cb 0.93 -0.37 -0.00 0.00 1.55 0.00 0.00 27.41 29.52 1w1d h HIS 449 CO 0.05 0.50 0.24 -0.56 -1.30 0.00 0.00 177.93 176.87 1w1d h GLN 450 N 1.05 0.00 0.00 5.26 3.07 -1.83 -2.74 115.11 119.92 1w1d h GLN 450 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.21 1w1d h GLN 450 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.95 1w1d h GLN 450 CO -0.23 0.00 -0.84 1.19 0.09 0.00 0.00 178.83 179.04 1w1d n PHE 451 N -3.00 0.01 -1.01 0.06 3.72 -0.57 -4.50 117.46 112.17 1w1d n PHE 451 Ca -0.02 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.47 1w1d n PHE 451 Cb 0.30 -0.11 0.23 0.00 -0.94 0.00 0.00 39.48 38.96 1w1d n PHE 451 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1w1d n VAL 452 N -1.53 2.20 -3.39 -4.37 0.24 -1.03 -4.98 118.33 105.47 1w1d n VAL 452 Ca 0.04 -1.97 -0.24 0.00 -2.04 0.00 0.00 64.34 60.14 1w1d n VAL 452 Cb 0.34 -0.25 0.06 0.00 -1.47 0.00 0.00 33.84 32.52 1w1d n VAL 452 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1w1d n GLU 453 N -0.72 -6.67 -1.48 7.34 1.02 -1.26 -1.41 120.64 117.45 1w1d n GLU 453 Ca 0.20 0.85 -0.17 0.00 -0.02 0.00 0.00 57.16 58.02 1w1d n GLU 453 Cb 0.84 -5.83 -0.07 0.00 -0.02 0.00 0.00 31.44 26.36 1w1d n GLU 453 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1w1d n ASN 454 N -2.82 -5.58 -4.76 1.62 5.15 -1.26 -4.98 115.26 102.62 1w1d n ASN 454 Ca -0.04 0.41 -0.40 0.00 -0.60 0.00 0.00 54.58 53.96 1w1d n ASN 454 Cb 0.58 -4.55 -0.06 0.00 -0.53 0.00 0.00 39.78 35.22 1w1d n ASN 454 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1w1d s ASN 455 N -2.63 7.38 0.16 1.20 0.01 -0.50 -5.02 114.94 115.53 1w1d s ASN 455 Ca 0.00 1.63 -0.32 0.00 -0.71 0.00 0.00 52.86 53.47 1w1d s ASN 455 Cb 0.00 -2.51 -0.10 0.00 0.41 0.00 0.00 41.25 39.05 1w1d s ASN 455 CO 0.00 0.14 1.65 -0.22 -1.51 0.00 0.00 177.10 177.16 1w1d s LEU 456 N -0.82 4.37 -0.28 0.60 2.96 -1.26 -4.81 118.68 119.45 1w1d s LEU 456 Ca 0.37 2.69 -0.27 0.00 -0.22 0.00 0.00 54.13 56.71 1w1d s LEU 456 Cb -0.23 -3.59 0.01 0.00 0.50 0.00 0.00 46.19 42.88 1w1d s LEU 456 CO 0.26 -0.89 0.95 -0.63 -1.32 0.00 0.00 176.35 174.72 1w1d s ILE 457 N 1.44 4.68 -0.13 6.68 1.01 -1.26 -0.91 121.20 132.72 1w1d s ILE 457 Ca 0.73 1.66 0.18 0.00 0.00 0.00 0.00 60.65 63.21 1w1d s ILE 457 Cb -0.45 -4.27 -0.17 0.00 0.01 0.00 0.00 42.46 37.57 1w1d s ILE 457 CO 0.32 -0.27 0.67 0.18 0.00 0.00 0.00 174.94 175.84 1w1d n LEU 458 N 6.41 0.62 -3.64 2.97 4.77 0.76 -4.79 117.00 124.11 1w1d n LEU 458 Ca 0.09 0.27 -0.13 0.00 -0.03 0.00 0.00 56.01 56.21 1w1d n LEU 458 Cb 0.47 0.13 -0.07 0.00 -2.33 0.00 0.00 43.42 41.61 1w1d n LEU 458 CO 0.53 0.17 0.38 -0.75 -1.33 0.00 0.00 177.39 176.39 1w1d s LYS 459 N -2.94 0.79 0.06 3.23 2.20 -0.77 -0.49 119.74 121.82 1w1d s LYS 459 Ca -0.05 0.98 -0.10 0.00 -0.36 0.00 0.00 55.97 56.44 1w1d s LYS 459 Cb 0.09 0.37 0.00 0.00 -1.51 0.00 0.00 37.83 36.78 1w1d s LYS 459 CO 0.83 -0.10 0.21 0.00 -0.36 0.00 0.00 175.35 175.92 1w1d s MET 460 N 0.48 0.76 0.00 4.03 0.23 -0.61 -0.78 119.30 123.41 1w1d s MET 460 Ca -0.01 -0.73 0.00 0.00 -1.03 0.00 0.00 55.69 53.92 1w1d s MET 460 Cb -0.05 0.31 0.00 0.00 -1.53 0.00 0.00 34.83 33.57 1w1d s MET 460 CO -0.01 -0.23 0.00 0.41 -2.03 0.00 0.00 175.02 173.16 1w1d n GLY 461 N 0.41 1.39 3.77 3.16 0.00 -0.79 -2.17 105.19 110.96 1w1d n GLY 461 Ca -0.17 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.54 1w1d n GLY 461 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w1d s PRO 462 N -2.00 4.44 0.05 1.61 0.04 -1.26 -0.82 135.00 137.05 1w1d s PRO 462 Ca 0.00 1.67 -0.02 0.00 0.04 0.00 0.00 61.00 62.69 1w1d s PRO 462 Cb 0.00 -2.92 -0.03 0.00 0.04 0.00 0.00 34.50 31.60 1w1d s PRO 462 CO 0.00 0.07 0.01 0.14 0.04 0.00 0.00 177.00 177.26 1w1d s VAL 463 N -1.37 0.18 -0.34 -0.36 -7.23 -0.19 -4.85 120.40 106.23 1w1d s VAL 463 Ca 0.50 -1.44 -0.12 0.00 -1.81 0.00 0.00 61.98 59.11 1w1d s VAL 463 Cb -0.28 -1.14 -0.00 0.00 0.56 0.00 0.00 36.38 35.52 1w1d s VAL 463 CO 0.35 -0.80 0.21 -1.81 -0.31 0.00 0.00 175.10 172.75 1w1d s ASP 464 N -2.48 5.84 -0.33 4.85 1.01 0.08 -1.08 116.67 124.56 1w1d s ASP 464 Ca 0.00 -0.61 -0.17 0.00 0.71 0.00 0.00 52.55 52.47 1w1d s ASP 464 Cb 0.03 -2.07 -0.01 0.00 1.01 0.00 0.00 42.92 41.87 1w1d s ASP 464 CO -0.07 -0.27 0.49 -0.75 0.21 0.00 0.00 175.17 174.77 1w1d s LYS 465 N 1.65 3.72 0.08 8.23 2.20 0.10 -0.32 119.74 135.41 1w1d s LYS 465 Ca 0.05 -0.09 -0.30 0.00 -0.36 0.00 0.00 55.97 55.27 1w1d s LYS 465 Cb -0.18 -3.77 -0.05 0.00 -1.51 0.00 0.00 37.83 32.32 1w1d s LYS 465 CO 0.08 -0.55 1.03 1.03 -0.36 0.00 0.00 175.35 176.58 1w1d s ARG 466 N 2.32 4.60 -0.29 4.03 1.81 -0.18 -1.51 118.95 129.73 1w1d s ARG 466 Ca 0.18 1.54 -0.14 0.00 -1.72 0.00 0.00 55.73 55.59 1w1d s ARG 466 Cb -0.16 -3.38 0.11 0.00 -0.45 0.00 0.00 34.95 31.07 1w1d s ARG 466 CO 0.12 0.03 0.73 0.21 -0.68 0.00 0.00 175.30 175.72 1w1d s LYS 467 N 0.41 0.61 3.29 3.54 2.47 -0.86 -4.46 119.74 124.74 1w1d s LYS 467 Ca 0.51 1.19 0.00 0.00 -1.56 0.00 0.00 55.97 56.11 1w1d s LYS 467 Cb -0.25 0.36 0.00 0.00 -1.46 0.00 0.00 37.83 36.49 1w1d s LYS 467 CO 0.30 -0.15 0.00 0.41 0.16 0.00 0.00 175.35 176.07 1w1d n GLY 468 N 4.61 0.03 0.19 5.54 0.00 -1.26 -3.54 105.19 110.75 1w1d n GLY 468 Ca -0.17 -0.96 0.05 0.00 0.00 0.00 0.00 46.02 44.94 1w1d n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1w1d h LEU 469 N 0.00 0.00 0.00 0.99 3.38 -2.02 -3.46 115.31 114.19 1w1d h LEU 469 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1w1d h LEU 469 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1w1d h LEU 469 CO 0.00 0.38 0.00 0.49 0.09 0.00 0.00 178.44 179.40 1w1d n PHE 470 N -3.70 0.00 -3.66 1.13 3.72 -1.23 -5.15 117.46 108.56 1w1d n PHE 470 Ca -0.01 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.36 1w1d n PHE 470 Cb 0.47 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.00 1w1d n PHE 470 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1w1d s ALA 471 N -2.00 -1.84 -0.02 4.37 0.00 -1.26 -2.03 121.76 118.98 1w1d s ALA 471 Ca 0.00 0.53 0.02 0.00 0.00 0.00 0.00 51.96 52.51 1w1d s ALA 471 Cb 0.00 0.48 0.00 0.00 0.00 0.00 0.00 23.12 23.61 1w1d s ALA 471 CO 0.00 -0.94 -0.06 1.03 0.00 0.00 0.00 175.76 175.79 1w1d s ARG 472 N -3.02 0.62 -0.06 0.00 1.81 -0.57 -4.93 118.95 112.80 1w1d s ARG 472 Ca 0.11 -0.20 -0.30 0.00 -1.72 0.00 0.00 55.73 53.62 1w1d s ARG 472 Cb 0.00 -0.61 -0.04 0.00 -0.45 0.00 0.00 34.95 33.85 1w1d s ARG 472 CO -0.02 0.08 1.33 0.50 -0.68 0.00 0.00 175.30 176.51 1w1d s ARG 473 N 0.15 4.28 0.07 3.54 6.06 -1.26 -0.72 118.95 131.07 1w1d s ARG 473 Ca -0.02 1.82 0.05 0.00 -2.50 0.00 0.00 55.73 55.08 1w1d s ARG 473 Cb -0.06 -3.66 -0.03 0.00 0.06 0.00 0.00 34.95 31.26 1w1d s ARG 473 CO -0.00 -0.60 -0.14 1.03 -2.50 0.00 0.00 175.30 173.09 1w1d s ARG 474 N 2.78 0.81 -0.19 5.12 1.81 -0.24 -4.47 118.95 124.56 1w1d s ARG 474 Ca 0.60 -0.95 -0.25 0.00 -1.72 0.00 0.00 55.73 53.40 1w1d s ARG 474 Cb -0.27 -0.81 -0.01 0.00 -0.45 0.00 0.00 34.95 33.41 1w1d s ARG 474 CO 0.22 0.18 0.85 -1.14 -0.68 0.00 0.00 175.30 174.73 1w1d s GLN 475 N -1.76 4.26 -0.18 3.54 2.00 -0.21 -1.02 119.66 126.29 1w1d s GLN 475 Ca -0.02 1.03 -0.08 0.00 -2.00 0.00 0.00 55.36 54.29 1w1d s GLN 475 Cb -0.10 -3.60 -0.04 0.00 0.80 0.00 0.00 33.01 30.07 1w1d s GLN 475 CO 0.02 -0.41 0.09 -1.17 -0.50 0.00 0.00 175.29 173.33 1w1d s LEU 476 N 2.44 4.01 -0.17 3.68 2.96 -0.00 -1.14 118.68 130.45 1w1d s LEU 476 Ca 0.38 0.18 -0.00 0.00 -0.22 0.00 0.00 54.13 54.46 1w1d s LEU 476 Cb -0.16 -2.01 0.04 0.00 0.50 0.00 0.00 46.19 44.56 1w1d s LEU 476 CO 0.10 0.21 -0.05 -0.76 -1.32 0.00 0.00 176.35 174.53 1w1d s LEU 477 N 0.19 1.68 -0.22 -0.68 1.02 0.31 -1.88 118.68 119.10 1w1d s LEU 477 Ca 0.06 -0.70 -0.19 0.00 0.02 0.00 0.00 54.13 53.32 1w1d s LEU 477 Cb -0.12 -0.94 -0.03 0.00 0.02 0.00 0.00 46.19 45.13 1w1d s LEU 477 CO -0.00 -0.18 0.57 -0.22 0.02 0.00 0.00 176.35 176.53 1w1d s LEU 478 N 1.61 4.12 0.31 1.79 2.96 0.04 -1.00 118.68 128.51 1w1d s LEU 478 Ca 0.00 0.71 0.04 0.00 -0.22 0.00 0.00 54.13 54.66 1w1d s LEU 478 Cb -0.15 -2.78 -0.06 0.00 0.50 0.00 0.00 46.19 43.69 1w1d s LEU 478 CO -0.08 -0.25 0.05 0.42 -1.32 0.00 0.00 176.35 175.17 1w1d s THR 479 N 1.94 1.18 0.80 3.68 -4.23 -0.15 -0.17 115.64 118.69 1w1d s THR 479 Ca 0.25 -2.01 -0.14 0.00 -1.18 0.00 0.00 61.69 58.61 1w1d s THR 479 Cb -0.16 -2.72 0.04 0.00 1.34 0.00 0.00 72.50 71.01 1w1d s THR 479 CO 0.10 -0.06 0.94 -1.84 -0.54 0.00 0.00 174.62 173.22 1w1d n GLU 480 N -0.64 0.18 0.00 3.99 0.28 -0.08 -2.27 120.64 122.09 1w1d n GLU 480 Ca -0.03 0.13 0.00 0.00 -0.16 0.00 0.00 57.16 57.10 1w1d n GLU 480 Cb 0.66 -2.22 0.00 0.00 1.43 0.00 0.00 31.44 31.31 1w1d n GLU 480 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1w1d n GLY 481 N 0.95 2.19 3.91 -1.84 0.00 -1.26 -3.45 105.19 105.68 1w1d n GLY 481 Ca 0.12 -0.49 -0.28 0.00 0.00 0.00 0.00 46.02 45.37 1w1d n GLY 481 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w1d s PRO 482 N 0.00 2.90 0.05 1.61 0.04 -1.26 -5.10 135.00 133.25 1w1d s PRO 482 Ca 0.00 0.16 0.03 0.00 0.04 0.00 0.00 61.00 61.23 1w1d s PRO 482 Cb 0.00 -2.19 -0.03 0.00 0.04 0.00 0.00 34.50 32.33 1w1d s PRO 482 CO 0.00 -0.81 -0.09 -1.01 0.04 0.00 0.00 177.00 175.13 1w1d s HIS 483 N -3.12 0.81 -0.40 0.56 3.76 -0.96 -4.84 115.29 111.09 1w1d s HIS 483 Ca 0.55 -0.53 0.02 0.00 -0.15 0.00 0.00 55.06 54.95 1w1d s HIS 483 Cb -0.11 -0.47 0.12 0.00 1.11 0.00 0.00 32.58 33.23 1w1d s HIS 483 CO 0.47 -0.06 0.17 -0.51 -0.85 0.00 0.00 174.74 173.96 1w1d s LEU 484 N -1.77 3.44 0.25 0.89 1.43 -1.25 -0.98 118.68 120.69 1w1d s LEU 484 Ca -0.06 -2.37 -0.14 0.00 -1.03 0.00 0.00 54.13 50.52 1w1d s LEU 484 Cb -0.08 -1.27 -0.08 0.00 0.03 0.00 0.00 46.19 44.78 1w1d s LEU 484 CO 0.00 -0.32 0.65 -0.31 0.23 0.00 0.00 176.35 176.60 1w1d s TYR 485 N 0.63 3.48 -0.03 0.29 2.02 -0.17 -0.57 117.35 123.01 1w1d s TYR 485 Ca 0.14 1.13 0.02 0.00 -0.37 0.00 0.00 57.07 57.99 1w1d s TYR 485 Cb -0.22 -2.45 0.01 0.00 -0.40 0.00 0.00 41.96 38.90 1w1d s TYR 485 CO -0.07 0.25 -0.07 1.52 -1.57 0.00 0.00 175.55 175.60 1w1d s TYR 486 N -1.76 0.82 -0.02 2.71 1.13 -0.04 -0.53 117.35 119.66 1w1d s TYR 486 Ca 0.47 -0.20 0.06 0.00 -1.41 0.00 0.00 57.07 55.99 1w1d s TYR 486 Cb -0.13 -0.61 -0.01 0.00 -1.10 0.00 0.00 41.96 40.11 1w1d s TYR 486 CO 0.19 -0.10 -0.20 0.08 -2.51 0.00 0.00 175.55 173.02 1w1d s VAL 487 N 0.27 1.54 -0.36 -3.49 1.01 -0.29 -0.79 120.40 118.30 1w1d s VAL 487 Ca -0.04 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 1w1d s VAL 487 Cb -0.09 -1.29 0.01 0.00 0.00 0.00 0.00 36.38 35.02 1w1d s VAL 487 CO 0.00 0.44 1.29 -0.62 0.00 0.00 0.00 175.10 176.21 1w1d s ASP 488 N -0.43 6.60 0.15 3.32 -1.08 0.08 -1.04 116.67 124.27 1w1d s ASP 488 Ca 0.07 0.99 0.26 0.00 -0.52 0.00 0.00 52.55 53.35 1w1d s ASP 488 Cb -0.08 -2.54 0.94 0.00 -1.46 0.00 0.00 42.92 39.78 1w1d s ASP 488 CO -0.01 -1.18 1.79 -0.81 0.52 0.00 0.00 175.17 175.48 1w1d n PRO 489 N 7.56 0.17 -0.11 4.34 -0.04 -1.26 -0.55 135.00 145.10 1w1d n PRO 489 Ca 0.15 0.18 -0.24 0.00 -0.04 0.00 0.00 63.50 63.55 1w1d n PRO 489 Cb 0.47 -1.72 -0.11 0.00 -0.04 0.00 0.00 33.50 32.10 1w1d n PRO 489 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1w1d n VAL 490 N -2.02 1.54 0.97 0.52 0.31 -1.26 -4.34 118.33 114.05 1w1d n VAL 490 Ca 0.05 -0.13 0.13 0.00 -0.01 0.00 0.00 64.34 64.38 1w1d n VAL 490 Cb 0.37 -1.99 0.38 0.00 -0.91 0.00 0.00 33.84 31.68 1w1d n VAL 490 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1w1d n ASN 491 N -4.36 0.34 -3.44 4.52 3.02 -1.24 -4.97 115.26 109.14 1w1d n ASN 491 Ca -0.38 0.04 -0.19 0.00 -0.03 0.00 0.00 54.58 54.02 1w1d n ASN 491 Cb 0.74 -0.03 0.07 0.00 -0.61 0.00 0.00 39.78 39.95 1w1d n ASN 491 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1w1d n LYS 492 N -1.55 -3.83 -4.02 3.52 4.76 0.28 -5.03 118.16 112.30 1w1d n LYS 492 Ca 0.06 0.76 -0.16 0.00 -2.87 0.00 0.00 58.31 56.11 1w1d n LYS 492 Cb 0.34 -5.50 -0.15 0.00 -1.84 0.00 0.00 35.03 27.88 1w1d n LYS 492 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1w1d s VAL 493 N -3.44 0.25 0.13 -0.18 1.01 -1.10 -4.99 120.40 112.07 1w1d s VAL 493 Ca 0.25 -0.06 -0.31 0.00 0.00 0.00 0.00 61.98 61.86 1w1d s VAL 493 Cb -0.05 -0.26 -0.09 0.00 0.00 0.00 0.00 36.38 35.98 1w1d s VAL 493 CO 0.77 0.11 1.49 -0.22 0.00 0.00 0.00 175.10 177.25 1w1d s LEU 494 N 0.38 4.37 -0.08 3.92 2.96 -1.26 -0.74 118.68 128.23 1w1d s LEU 494 Ca -0.04 2.46 0.18 0.00 -0.22 0.00 0.00 54.13 56.51 1w1d s LEU 494 Cb -0.07 -3.59 -0.26 0.00 0.50 0.00 0.00 46.19 42.77 1w1d s LEU 494 CO -0.01 -0.75 0.28 0.29 -1.32 0.00 0.00 176.35 174.84 1w1d n LYS 495 N 4.13 0.79 -3.59 1.98 4.76 0.03 -4.89 118.16 121.37 1w1d n LYS 495 Ca 0.13 -0.11 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 1w1d n LYS 495 Cb 0.40 -1.45 0.00 0.00 -1.84 0.00 0.00 35.03 32.15 1w1d n LYS 495 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1w1d n GLY 496 N 1.62 -1.82 3.12 0.72 0.00 -1.11 -5.02 105.19 102.70 1w1d n GLY 496 Ca -0.13 -1.14 -0.19 0.00 0.00 0.00 0.00 46.02 44.57 1w1d n GLY 496 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w1d s GLU 497 N -1.65 0.85 -0.18 1.61 2.02 -1.26 -0.86 118.70 119.22 1w1d s GLU 497 Ca 0.00 -0.72 -0.28 0.00 0.02 0.00 0.00 54.97 53.99 1w1d s GLU 497 Cb 0.00 -0.83 -0.00 0.00 0.10 0.00 0.00 34.13 33.40 1w1d s GLU 497 CO 0.00 0.20 0.95 0.42 0.02 0.00 0.00 175.26 176.85 1w1d s ILE 498 N -0.87 4.78 0.06 -1.63 1.01 0.26 -5.00 121.20 119.82 1w1d s ILE 498 Ca 0.00 1.86 -0.31 0.00 0.00 0.00 0.00 60.65 62.21 1w1d s ILE 498 Cb -0.08 -4.24 -0.06 0.00 0.01 0.00 0.00 42.46 38.09 1w1d s ILE 498 CO 0.01 -0.06 1.28 -2.16 0.00 0.00 0.00 174.94 174.01 1w1d s PRO 499 N 2.53 4.37 0.11 2.79 0.04 -1.26 -4.17 135.00 139.41 1w1d s PRO 499 Ca 0.42 1.88 -0.22 0.00 0.04 0.00 0.00 61.00 63.12 1w1d s PRO 499 Cb -0.16 -3.36 -0.07 0.00 0.04 0.00 0.00 34.50 30.95 1w1d s PRO 499 CO 0.11 -0.36 0.68 -1.58 0.04 0.00 0.00 177.00 175.89 1w1d s TRP 500 N 1.30 3.84 0.28 0.56 0.52 -1.26 -4.87 118.94 119.31 1w1d s TRP 500 Ca 0.61 1.45 -0.21 0.00 0.02 0.00 0.00 56.10 57.96 1w1d s TRP 500 Cb -0.32 -2.65 0.03 0.00 -1.15 0.00 0.00 33.47 29.38 1w1d s TRP 500 CO 0.29 0.52 0.75 -1.54 0.02 0.00 0.00 176.95 176.98 1w1d s SER 501 N -0.99 -0.23 0.61 2.95 1.04 -1.26 -5.01 113.70 110.81 1w1d s SER 501 Ca 0.33 -0.63 0.32 0.00 0.48 0.00 0.00 55.95 56.44 1w1d s SER 501 Cb -0.21 0.72 1.85 0.00 0.10 0.00 0.00 66.02 68.47 1w1d s SER 501 CO 0.22 -1.33 2.20 -0.61 0.98 0.00 0.00 173.24 174.70 1w1d h GLN 502 N 2.00 0.00 -0.00 4.02 4.15 -2.00 -1.01 115.11 122.27 1w1d h GLN 502 Ca -0.20 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.22 1w1d h GLN 502 Cb 1.25 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.94 1w1d h GLN 502 CO 0.24 0.00 -0.07 0.39 -1.93 0.00 0.00 178.83 177.47 1w1d n GLU 503 N -3.66 0.63 -2.21 1.69 4.71 -1.26 -4.87 120.64 115.67 1w1d n GLU 503 Ca -0.01 -0.15 -0.41 0.00 -0.01 0.00 0.00 57.16 56.59 1w1d n GLU 503 Cb 0.19 -1.50 -0.03 0.00 -1.01 0.00 0.00 31.44 29.09 1w1d n GLU 503 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1w1d s LEU 504 N -2.47 4.45 -0.11 -4.62 0.20 -0.38 -4.69 118.68 111.06 1w1d s LEU 504 Ca 0.30 2.56 -0.04 0.00 0.69 0.00 0.00 54.13 57.63 1w1d s LEU 504 Cb 0.20 -3.64 0.05 0.00 -0.43 0.00 0.00 46.19 42.38 1w1d s LEU 504 CO 0.46 -0.44 0.23 -0.60 -0.29 0.00 0.00 176.35 175.71 1w1d s ARG 505 N -1.49 0.13 0.46 1.98 3.52 -0.58 -4.97 118.95 117.99 1w1d s ARG 505 Ca 0.49 0.62 -0.10 0.00 -0.13 0.00 0.00 55.73 56.61 1w1d s ARG 505 Cb -0.38 -0.12 -0.06 0.00 -1.56 0.00 0.00 34.95 32.84 1w1d s ARG 505 CO 0.48 -0.25 0.82 -1.25 -0.81 0.00 0.00 175.30 174.30 1w1d s PRO 506 N 1.98 3.71 -0.16 5.12 0.04 -1.26 -0.39 135.00 144.03 1w1d s PRO 506 Ca -0.02 0.48 -0.08 0.00 0.04 0.00 0.00 61.00 61.41 1w1d s PRO 506 Cb -0.12 -2.33 0.06 0.00 0.04 0.00 0.00 34.50 32.16 1w1d s PRO 506 CO -0.08 -0.16 0.39 -2.00 0.04 0.00 0.00 177.00 175.19 1w1d s GLU 507 N -4.24 0.36 -0.22 4.56 2.12 -0.51 -4.96 118.70 115.80 1w1d s GLU 507 Ca 0.51 0.77 -0.10 0.00 0.36 0.00 0.00 54.97 56.52 1w1d s GLU 507 Cb -0.10 -0.01 -0.05 0.00 0.26 0.00 0.00 34.13 34.23 1w1d s GLU 507 CO 0.37 -0.17 0.13 0.00 -0.54 0.00 0.00 175.26 175.05 1w1d s ALA 508 N 1.49 3.56 0.01 6.30 0.00 -1.26 -0.26 121.76 131.61 1w1d s ALA 508 Ca -0.09 -0.84 -0.18 0.00 0.00 0.00 0.00 51.96 50.86 1w1d s ALA 508 Cb -0.09 -2.20 -0.33 0.00 0.00 0.00 0.00 23.12 20.50 1w1d s ALA 508 CO -0.12 -0.07 0.99 0.87 0.00 0.00 0.00 175.76 177.43 1w1d h LYS 509 N 7.23 0.49 0.00 0.00 1.57 -1.65 -3.49 116.57 120.72 1w1d h LYS 509 Ca -0.38 -0.79 0.00 0.00 -1.87 0.00 0.00 60.65 57.60 1w1d h LYS 509 Cb 1.17 0.29 0.00 0.00 0.08 0.00 0.00 32.23 33.76 1w1d h LYS 509 CO 0.68 1.37 0.00 0.27 -0.57 0.00 0.00 179.45 181.20 1w1d n ASN 510 N -3.86 0.00 0.15 0.86 0.23 -1.18 -5.00 115.26 106.46 1w1d n ASN 510 Ca -0.15 -0.07 0.13 0.00 -0.53 0.00 0.00 54.58 53.95 1w1d n ASN 510 Cb 1.00 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 39.12 1w1d n ASN 510 CO 0.00 0.00 0.00 -0.26 -0.93 0.00 0.00 177.26 176.07 1w1d h PHE 511 N 0.07 0.00 0.00 -2.53 0.04 -1.96 -3.25 116.94 109.31 1w1d h PHE 511 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 1w1d h PHE 511 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 1w1d h PHE 511 CO 0.00 0.00 0.00 1.63 -0.60 0.00 0.00 178.31 179.34 1w1d n LYS 512 N -2.48 1.69 -3.73 1.51 5.02 -1.26 -0.95 118.16 117.96 1w1d n LYS 512 Ca 0.04 -1.14 -0.17 0.00 -2.02 0.00 0.00 58.31 55.02 1w1d n LYS 512 Cb 0.38 -0.95 -0.17 0.00 -0.02 0.00 0.00 35.03 34.27 1w1d n LYS 512 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1w1d s THR 513 N -0.65 -0.09 0.07 -0.18 2.01 -1.23 -1.09 115.64 114.49 1w1d s THR 513 Ca 0.00 0.31 0.03 0.00 0.31 0.00 0.00 61.69 62.33 1w1d s THR 513 Cb 0.00 -0.12 -0.03 0.00 0.01 0.00 0.00 72.50 72.36 1w1d s THR 513 CO 0.00 0.13 -0.08 0.72 -0.69 0.00 0.00 174.62 174.69 1w1d s PHE 514 N 1.57 0.86 0.13 4.92 -0.12 -0.30 -1.54 117.98 123.50 1w1d s PHE 514 Ca -0.03 -0.65 0.09 0.00 -0.05 0.00 0.00 56.93 56.29 1w1d s PHE 514 Cb -0.13 -0.49 -0.04 0.00 -0.63 0.00 0.00 43.02 41.73 1w1d s PHE 514 CO -0.03 -0.07 -0.15 -0.06 -0.05 0.00 0.00 175.22 174.85 1w1d s PHE 515 N -2.24 2.57 -0.24 3.49 0.08 0.65 -0.99 117.98 121.29 1w1d s PHE 515 Ca 0.00 -0.25 0.02 0.00 0.12 0.00 0.00 56.93 56.83 1w1d s PHE 515 Cb -0.04 -1.33 0.06 0.00 -0.57 0.00 0.00 43.02 41.13 1w1d s PHE 515 CO -0.01 0.43 -0.10 0.08 -0.10 0.00 0.00 175.22 175.52 1w1d s VAL 516 N -1.31 1.90 -0.06 -0.44 1.01 -0.27 -1.42 120.40 119.81 1w1d s VAL 516 Ca 0.20 -1.39 -0.26 0.00 0.00 0.00 0.00 61.98 60.52 1w1d s VAL 516 Cb -0.10 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1w1d s VAL 516 CO 0.12 0.00 0.84 -1.00 0.00 0.00 0.00 175.10 175.06 1w1d s HIS 517 N 1.24 3.57 0.20 5.22 0.09 0.47 -0.89 115.29 125.20 1w1d s HIS 517 Ca -0.06 1.43 0.04 0.00 -0.00 0.00 0.00 55.06 56.47 1w1d s HIS 517 Cb -0.19 -2.98 -0.05 0.00 -0.00 0.00 0.00 32.58 29.37 1w1d s HIS 517 CO -0.06 -0.02 -0.05 0.95 -0.00 0.00 0.00 174.74 175.55 1w1d s THR 518 N 1.19 1.17 0.29 1.30 -4.23 0.07 -1.53 115.64 113.90 1w1d s THR 518 Ca 0.43 -2.06 0.03 0.00 -1.18 0.00 0.00 61.69 58.91 1w1d s THR 518 Cb -0.19 -2.16 0.28 0.00 1.34 0.00 0.00 72.50 71.77 1w1d s THR 518 CO 0.20 -0.48 1.79 -0.65 -0.54 0.00 0.00 174.62 174.94 1w1d h PRO 519 N 2.57 0.78 -0.34 3.99 0.11 -1.94 -2.37 132.00 134.79 1w1d h PRO 519 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1w1d h PRO 519 Cb 1.21 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1w1d h PRO 519 CO 0.64 0.52 0.00 0.09 -0.21 0.00 0.00 178.00 179.04 1w1d n ASN 520 N -4.74 2.92 -3.64 -2.05 3.02 -1.26 -4.99 115.26 104.51 1w1d n ASN 520 Ca 0.20 -2.01 -0.06 0.00 -0.03 0.00 0.00 54.58 52.68 1w1d n ASN 520 Cb 0.47 -0.23 -0.07 0.00 -0.61 0.00 0.00 39.78 39.34 1w1d n ASN 520 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1w1d s ARG 521 N -1.01 0.47 -0.22 3.52 3.52 -0.89 -5.13 118.95 119.21 1w1d s ARG 521 Ca 0.23 0.67 -0.08 0.00 -0.13 0.00 0.00 55.73 56.42 1w1d s ARG 521 Cb 0.12 0.17 -0.04 0.00 -1.56 0.00 0.00 34.95 33.65 1w1d s ARG 521 CO 0.15 -0.07 0.09 0.99 -0.81 0.00 0.00 175.30 175.65 1w1d s THR 522 N 0.76 4.78 0.00 4.11 2.01 -1.26 -0.75 115.64 125.30 1w1d s THR 522 Ca -0.02 -0.02 -0.20 0.00 0.31 0.00 0.00 61.69 61.76 1w1d s THR 522 Cb -0.04 -3.21 -0.06 0.00 0.01 0.00 0.00 72.50 69.20 1w1d s THR 522 CO -0.10 0.38 0.57 -0.31 -0.69 0.00 0.00 174.62 174.46 1w1d s TYR 523 N 1.03 3.70 -0.26 4.92 1.51 -0.07 -4.92 117.35 123.26 1w1d s TYR 523 Ca 0.05 1.18 0.01 0.00 -1.01 0.00 0.00 57.07 57.29 1w1d s TYR 523 Cb -0.14 -2.56 0.05 0.00 -0.11 0.00 0.00 41.96 39.20 1w1d s TYR 523 CO 0.03 0.41 -0.08 -0.47 -1.11 0.00 0.00 175.55 174.33 1w1d s TYR 524 N -0.39 3.19 -0.08 2.71 6.14 -1.26 -1.11 117.35 126.54 1w1d s TYR 524 Ca 0.30 -2.01 0.04 0.00 0.64 0.00 0.00 57.07 56.04 1w1d s TYR 524 Cb -0.18 -2.00 -0.01 0.00 0.42 0.00 0.00 41.96 40.19 1w1d s TYR 524 CO 0.17 -0.83 -0.22 -0.51 0.64 0.00 0.00 175.55 174.80 1w1d s LEU 525 N 1.20 2.23 -0.10 6.97 2.01 -0.16 -1.01 118.68 129.81 1w1d s LEU 525 Ca -0.05 -0.47 -0.02 0.00 0.01 0.00 0.00 54.13 53.60 1w1d s LEU 525 Cb -0.19 -1.43 -0.03 0.00 0.01 0.00 0.00 46.19 44.55 1w1d s LEU 525 CO -0.05 0.22 -0.02 -0.04 1.01 0.00 0.00 176.35 177.48 1w1d s MET 526 N -0.01 3.14 -0.47 1.70 -1.94 0.57 -1.15 119.30 121.14 1w1d s MET 526 Ca -0.07 -0.46 0.03 0.00 -1.71 0.00 0.00 55.69 53.48 1w1d s MET 526 Cb -0.15 -2.80 0.13 0.00 2.01 0.00 0.00 34.83 34.02 1w1d s MET 526 CO 0.05 0.57 0.23 0.34 -0.01 0.00 0.00 175.02 176.20 1w1d s ASP 527 N -0.52 4.04 0.00 3.03 2.15 -0.25 -0.74 116.67 124.38 1w1d s ASP 527 Ca 0.09 -2.75 0.09 0.00 0.43 0.00 0.00 52.55 50.41 1w1d s ASP 527 Cb -0.12 -1.35 0.47 0.00 -0.30 0.00 0.00 42.92 41.62 1w1d s ASP 527 CO 0.02 -0.26 1.17 -0.81 -0.17 0.00 0.00 175.17 175.12 1w1d n PRO 528 N 3.42 0.14 0.03 4.34 -0.04 -1.26 -2.07 135.00 139.56 1w1d n PRO 528 Ca 0.06 0.19 0.12 0.00 -0.04 0.00 0.00 63.50 63.83 1w1d n PRO 528 Cb 0.34 -1.50 0.49 0.00 -0.04 0.00 0.00 33.50 32.79 1w1d n PRO 528 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1w1d n SER 529 N -1.27 0.22 -0.01 3.54 3.41 -1.26 -4.92 113.62 113.33 1w1d n SER 529 Ca 0.04 0.53 -0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1w1d n SER 529 Cb 0.07 -0.59 -0.00 0.00 -0.26 0.00 0.00 64.21 63.43 1w1d n SER 529 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w1d n GLY 530 N 0.95 0.38 1.09 5.00 0.00 -0.88 -4.97 105.19 106.76 1w1d n GLY 530 Ca 0.05 -1.05 -0.01 0.00 0.00 0.00 0.00 46.02 45.01 1w1d n GLY 530 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1w1d n ASN 531 N 1.99 2.94 -0.02 1.61 3.02 -0.98 -4.71 115.26 119.10 1w1d n ASN 531 Ca -0.00 -3.53 0.04 0.00 -0.03 0.00 0.00 54.58 51.06 1w1d n ASN 531 Cb 0.10 -0.61 0.41 0.00 -0.61 0.00 0.00 39.78 39.07 1w1d n ASN 531 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1w1d h ALA 532 N 1.21 1.69 -0.12 5.41 0.00 -1.31 -0.95 119.26 125.19 1w1d h ALA 532 Ca 0.17 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1w1d h ALA 532 Cb 1.62 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1w1d h ALA 532 CO 0.36 0.28 -0.18 0.45 0.00 0.00 0.00 179.25 180.16 1w1d h HIS 533 N 0.59 0.21 -0.31 0.00 3.86 -1.78 -1.15 115.15 116.58 1w1d h HIS 533 Ca 0.16 -0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.24 1w1d h HIS 533 Cb -0.06 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.34 1w1d h HIS 533 CO -0.00 0.38 -0.24 0.87 0.86 0.00 0.00 177.93 179.79 1w1d h LYS 534 N 0.19 0.60 -0.21 2.45 1.57 -1.54 -0.30 116.57 119.32 1w1d h LYS 534 Ca 0.04 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.54 1w1d h LYS 534 Cb 0.43 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.70 1w1d h LYS 534 CO 0.03 0.79 -0.01 -1.49 -0.57 0.00 0.00 179.45 178.20 1w1d h TRP 535 N 0.53 0.43 -0.22 -1.35 4.06 -1.21 -1.80 115.95 116.39 1w1d h TRP 535 Ca 0.08 -0.08 0.02 0.00 2.06 0.00 0.00 58.89 60.97 1w1d h TRP 535 Cb 0.70 -0.11 -0.02 0.00 -1.00 0.00 0.00 29.16 28.73 1w1d h TRP 535 CO 0.03 0.59 0.07 0.00 -3.56 0.00 0.00 178.44 175.56 1w1d h ARG 537 N 0.17 0.87 -0.31 0.00 3.08 -1.03 -0.39 114.38 116.77 1w1d h ARG 537 Ca 0.09 -0.15 -0.15 0.00 0.07 0.00 0.00 59.98 59.85 1w1d h ARG 537 Cb 0.07 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 1w1d h ARG 537 CO -0.10 0.73 -0.40 -0.22 -1.07 0.00 0.00 179.97 178.91 1w1d h LYS 538 N 0.81 0.81 -0.97 0.04 1.63 -1.11 -0.61 116.57 117.16 1w1d h LYS 538 Ca 0.20 -0.46 0.00 0.00 -0.85 0.00 0.00 60.65 59.54 1w1d h LYS 538 Cb 0.18 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 31.79 1w1d h LYS 538 CO -0.02 1.10 0.62 0.82 -3.45 0.00 0.00 179.45 178.52 1w1d h ILE 539 N 0.58 1.26 -0.25 2.00 2.04 -1.02 -0.94 117.51 121.18 1w1d h ILE 539 Ca 0.04 -0.51 -0.14 0.00 1.00 0.00 0.00 64.86 65.25 1w1d h ILE 539 Cb 0.99 -0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1w1d h ILE 539 CO 0.09 0.26 -0.44 -0.61 0.00 0.00 0.00 178.15 177.45 1w1d h GLN 540 N 1.33 0.61 -0.40 2.37 5.75 -0.86 -0.08 115.11 123.83 1w1d h GLN 540 Ca 0.35 -0.33 0.01 0.00 -0.15 0.00 0.00 58.65 58.53 1w1d h GLN 540 Cb -0.11 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.43 1w1d h GLN 540 CO -0.07 0.93 0.26 1.49 -2.65 0.00 0.00 178.83 178.78 1w1d h GLU 541 N 0.50 0.51 -0.49 1.69 4.81 -0.79 -0.46 114.58 120.35 1w1d h GLU 541 Ca 0.03 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1w1d h GLU 541 Cb 0.96 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 1w1d h GLU 541 CO 0.09 0.34 0.22 0.28 -0.73 0.00 0.00 179.01 179.21 1w1d h VAL 542 N 0.52 1.20 -0.53 0.32 2.07 -0.89 -1.86 116.25 117.09 1w1d h VAL 542 Ca 0.15 -0.57 0.04 0.00 0.82 0.00 0.00 66.70 67.14 1w1d h VAL 542 Cb -0.05 0.67 -0.04 0.00 -1.52 0.00 0.00 31.29 30.35 1w1d h VAL 542 CO -0.04 0.22 0.28 -0.25 0.02 0.00 0.00 177.57 177.80 1w1d h TRP 543 N 0.64 0.51 -0.59 1.57 7.01 -0.64 0.34 115.95 124.79 1w1d h TRP 543 Ca 0.17 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.19 1w1d h TRP 543 Cb 0.14 -0.15 -0.03 0.00 -2.10 0.00 0.00 29.16 27.02 1w1d h TRP 543 CO -0.00 0.25 0.37 0.00 -2.79 0.00 0.00 178.44 176.27 1w1d h ARG 544 N 0.53 0.80 -0.21 2.65 3.08 -0.82 -0.06 114.38 120.35 1w1d h ARG 544 Ca 0.23 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.16 1w1d h ARG 544 Cb 0.13 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1w1d h ARG 544 CO -0.15 0.56 -0.14 1.96 -1.07 0.00 0.00 179.97 181.12 1w1d h GLN 545 N 0.80 0.35 0.24 0.04 4.20 -0.72 -0.91 115.11 119.12 1w1d h GLN 545 Ca 0.21 -0.09 -0.34 0.00 0.06 0.00 0.00 58.65 58.49 1w1d h GLN 545 Cb -0.05 -0.04 0.03 0.00 0.30 0.00 0.00 27.48 27.73 1w1d h GLN 545 CO -0.04 0.50 -1.52 -0.09 -0.67 0.00 0.00 178.83 177.00 1w1d h ARG 546 N 0.33 0.51 0.00 1.46 9.65 -0.45 -3.40 114.38 122.48 1w1d h ARG 546 Ca 0.06 -0.87 0.00 0.00 -1.10 0.00 0.00 59.98 58.07 1w1d h ARG 546 Cb 0.45 0.32 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1w1d h ARG 546 CO 0.03 1.42 -0.71 0.66 2.80 0.00 0.00 179.97 184.16 1w1d n TYR 547 N -3.69 0.00 -4.25 2.20 4.01 -0.08 -4.99 117.16 110.37 1w1d n TYR 547 Ca -0.18 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.33 1w1d n TYR 547 Cb 1.10 -0.06 -0.07 0.00 -0.31 0.00 0.00 39.34 40.00 1w1d n TYR 547 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1w1d s GLN 548 N -2.02 2.44 0.33 -0.72 -0.21 -0.35 -5.05 119.66 114.08 1w1d s GLN 548 Ca 0.01 -1.30 -0.29 0.00 0.02 0.00 0.00 55.36 53.80 1w1d s GLN 548 Cb 0.06 -2.27 -0.11 0.00 1.00 0.00 0.00 33.01 31.69 1w1d s GLN 548 CO 0.33 0.38 1.52 -1.12 -2.12 0.00 0.00 175.29 174.28 1w1d s SER 549 N -3.62 6.41 0.00 5.90 0.01 -1.26 -4.73 113.70 116.41 1w1d s SER 549 Ca 0.31 2.95 0.00 0.00 1.31 0.00 0.00 55.95 60.53 1w1d s SER 549 Cb -0.07 -2.65 0.00 0.00 0.21 0.00 0.00 66.02 63.51 1w1d s SER 549 CO 0.21 -0.86 0.00 1.57 0.41 0.00 0.00 173.24 174.57