#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w1g n LEU 408 N 0.00 1.79 0.00 2.45 -0.00 -1.26 -0.82 117.00 119.16 1w1g n LEU 408 Ca 0.00 1.11 0.00 0.00 -0.00 0.00 0.00 56.01 57.12 1w1g n LEU 408 Cb 0.00 -1.16 0.00 0.00 -0.00 0.00 0.00 43.42 42.26 1w1g n LEU 408 CO 0.00 -0.90 0.00 0.61 -0.00 0.00 0.00 177.39 177.10 1w1g n GLY 409 N 2.97 0.68 0.14 1.47 0.00 -1.26 -4.93 105.19 104.26 1w1g n GLY 409 Ca 0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.06 1w1g n GLY 409 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1w1g h SER 410 N 0.00 0.59 -6.87 1.61 4.64 -1.51 -3.48 113.55 108.53 1w1g h SER 410 Ca 0.00 -0.55 -0.54 0.00 -0.47 0.00 0.00 61.79 60.23 1w1g h SER 410 Cb 0.02 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 1w1g h SER 410 CO 0.00 1.38 -1.04 -3.20 -0.87 0.00 0.00 176.83 173.11 1w1g n ASN 411 N -3.68 -4.31 0.29 4.97 4.05 -1.26 -4.81 115.26 110.52 1w1g n ASN 411 Ca -0.09 -1.13 0.15 0.00 0.45 0.00 0.00 54.58 53.96 1w1g n ASN 411 Cb 0.95 -1.54 0.86 0.00 1.23 0.00 0.00 39.78 41.28 1w1g n ASN 411 CO 0.00 0.00 0.00 -0.29 -3.05 0.00 0.00 177.26 173.92 1w1g h ILE 412 N -1.44 0.46 0.00 -1.44 6.09 -1.95 -1.79 117.51 117.44 1w1g h ILE 412 Ca -0.67 -0.26 0.00 0.00 -1.37 0.00 0.00 64.86 62.57 1w1g h ILE 412 Cb 1.37 1.17 0.00 0.00 0.47 0.00 0.00 36.82 39.83 1w1g h ILE 412 CO 0.44 0.05 0.00 -0.62 -3.07 0.00 0.00 178.15 174.95 1w1g n GLU 413 N -3.64 0.12 0.07 2.19 4.71 -1.26 -2.27 120.64 120.57 1w1g n GLU 413 Ca -0.02 0.58 0.16 0.00 -0.01 0.00 0.00 57.16 57.86 1w1g n GLU 413 Cb 0.16 -1.86 0.66 0.00 -1.01 0.00 0.00 31.44 29.38 1w1g n GLU 413 CO 0.00 0.00 0.00 -0.56 0.09 0.00 0.00 177.13 176.66 1w1g h GLN 414 N 0.00 0.04 -0.00 3.49 3.07 -1.67 -1.56 115.11 118.48 1w1g h GLN 414 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1w1g h GLN 414 Cb 0.06 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 27.61 1w1g h GLN 414 CO 0.00 0.03 -0.16 0.66 0.09 0.00 0.00 178.83 179.45 1w1g n TYR 415 N -4.44 0.00 -4.14 0.06 4.01 -0.96 -4.87 117.16 106.82 1w1g n TYR 415 Ca 0.06 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.46 1w1g n TYR 415 Cb 0.43 -0.30 -0.10 0.00 -0.31 0.00 0.00 39.34 39.06 1w1g n TYR 415 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1w1g s ILE 416 N -2.76 4.54 -0.34 -0.72 1.01 -0.59 -0.96 121.20 121.39 1w1g s ILE 416 Ca 0.20 -0.13 0.01 0.00 0.00 0.00 0.00 60.65 60.74 1w1g s ILE 416 Cb 0.19 -3.02 0.10 0.00 0.01 0.00 0.00 42.46 39.75 1w1g s ILE 416 CO 0.54 0.49 0.10 -1.00 0.00 0.00 0.00 174.94 175.07 1w1g s HIS 417 N 0.17 2.55 0.10 3.97 3.76 0.37 -5.00 115.29 121.20 1w1g s HIS 417 Ca 0.03 -2.31 -0.30 0.00 -0.15 0.00 0.00 55.06 52.32 1w1g s HIS 417 Cb -0.13 -2.22 -0.06 0.00 1.11 0.00 0.00 32.58 31.28 1w1g s HIS 417 CO 0.01 -0.89 1.14 -0.51 -0.85 0.00 0.00 174.74 173.64 1w1g s ASP 418 N 1.19 7.18 -0.19 1.40 1.01 -1.26 -0.93 116.67 125.07 1w1g s ASP 418 Ca 0.11 2.02 0.14 0.00 0.71 0.00 0.00 52.55 55.53 1w1g s ASP 418 Cb -0.19 -2.59 -0.21 0.00 1.01 0.00 0.00 42.92 40.94 1w1g s ASP 418 CO -0.16 -0.35 0.02 0.18 0.21 0.00 0.00 175.17 175.07 1w1g n LEU 419 N 3.27 0.45 -3.83 1.23 4.77 0.54 -4.95 117.00 118.49 1w1g n LEU 419 Ca 0.06 -0.02 -0.05 0.00 -0.03 0.00 0.00 56.01 55.97 1w1g n LEU 419 Cb 0.47 0.26 0.01 0.00 -2.33 0.00 0.00 43.42 41.82 1w1g n LEU 419 CO 0.55 0.52 0.69 -0.62 -1.33 0.00 0.00 177.39 177.19 1w1g s ASP 420 N -5.39 -0.05 0.55 -1.43 -1.08 -0.74 -4.96 116.67 103.56 1w1g s ASP 420 Ca -0.12 -0.74 0.27 0.00 -0.52 0.00 0.00 52.55 51.43 1w1g s ASP 420 Cb 0.06 0.61 1.59 0.00 -1.46 0.00 0.00 42.92 43.72 1w1g s ASP 420 CO 0.71 -1.19 2.16 0.77 0.52 0.00 0.00 175.17 178.14 1w1g h SER 421 N 2.00 0.00 -0.08 -0.34 4.64 -2.02 -2.34 113.55 115.41 1w1g h SER 421 Ca -0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 1w1g h SER 421 Cb 1.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1w1g h SER 421 CO 0.34 0.06 -0.03 -0.46 -0.87 0.00 0.00 176.83 175.87 1w1g n ASN 422 N -3.85 2.74 -3.71 4.97 2.04 -1.26 -5.02 115.26 111.17 1w1g n ASN 422 Ca -0.03 -3.14 -0.14 0.00 -0.44 0.00 0.00 54.58 50.84 1w1g n ASN 422 Cb 0.15 -0.47 -0.15 0.00 -2.53 0.00 0.00 39.78 36.78 1w1g n ASN 422 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 1w1g s SER 423 N -2.63 0.16 0.25 0.53 0.01 -0.88 -3.82 113.70 107.31 1w1g s SER 423 Ca 0.36 0.36 -0.18 0.00 1.31 0.00 0.00 55.95 57.80 1w1g s SER 423 Cb 0.31 0.28 0.02 0.00 0.21 0.00 0.00 66.02 66.83 1w1g s SER 423 CO 0.04 -0.19 0.59 0.72 0.41 0.00 0.00 173.24 174.82 1w1g s PHE 424 N 1.61 -0.01 0.04 2.43 -0.12 -0.94 -0.34 117.98 120.66 1w1g s PHE 424 Ca -0.05 -0.39 -0.02 0.00 -0.05 0.00 0.00 56.93 56.43 1w1g s PHE 424 Cb -0.12 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 1w1g s PHE 424 CO -0.06 -1.07 0.00 -1.83 -0.05 0.00 0.00 175.22 172.21 1w1g s GLU 425 N -3.93 0.52 0.01 1.99 -1.05 -0.10 -1.61 118.70 114.52 1w1g s GLU 425 Ca 0.14 -0.93 0.03 0.00 -0.15 0.00 0.00 54.97 54.05 1w1g s GLU 425 Cb -0.03 0.19 -0.04 0.00 -0.44 0.00 0.00 34.13 33.81 1w1g s GLU 425 CO 0.05 -0.10 -0.03 -0.51 0.95 0.00 0.00 175.26 175.61 1w1g s LEU 426 N -2.31 3.33 0.36 1.83 1.02 0.64 -0.48 118.68 123.07 1w1g s LEU 426 Ca -0.02 -0.09 -0.26 0.00 0.02 0.00 0.00 54.13 53.77 1w1g s LEU 426 Cb 0.01 -1.92 -0.09 0.00 0.02 0.00 0.00 46.19 44.21 1w1g s LEU 426 CO -0.06 0.28 1.12 -1.81 0.02 0.00 0.00 176.35 175.89 1w1g s ASP 427 N -1.53 6.82 0.00 2.29 1.01 -0.13 -4.95 116.67 120.18 1w1g s ASP 427 Ca 0.19 2.25 0.24 0.00 0.71 0.00 0.00 52.55 55.93 1w1g s ASP 427 Cb -0.11 -2.61 0.19 0.00 1.01 0.00 0.00 42.92 41.39 1w1g s ASP 427 CO 0.09 -0.46 1.23 0.18 0.21 0.00 0.00 175.17 176.43 1w1g n LEU 428 N 0.40 2.42 0.00 1.23 4.77 -1.26 -4.50 117.00 120.06 1w1g n LEU 428 Ca 0.03 -0.84 0.16 0.00 -0.03 0.00 0.00 56.01 55.33 1w1g n LEU 428 Cb 0.47 -0.01 0.93 0.00 -2.33 0.00 0.00 43.42 42.48 1w1g n LEU 428 CO 0.50 0.42 1.09 0.00 -1.33 0.00 0.00 177.39 178.08 1w1g n GLN 429 N 0.62 0.95 -0.90 3.23 0.00 -1.26 -4.94 117.38 115.09 1w1g n GLN 429 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 57.00 56.82 1w1g n GLN 429 Cb 0.52 -1.50 0.15 0.00 0.00 0.00 0.00 30.24 29.41 1w1g n GLN 429 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.06 176.47 1w1g s PHE 430 N -2.03 1.94 0.78 2.61 -0.12 -1.26 -5.03 117.98 114.86 1w1g s PHE 430 Ca 0.46 1.60 -0.10 0.00 -0.05 0.00 0.00 56.93 58.84 1w1g s PHE 430 Cb 0.22 -3.21 0.08 0.00 -0.63 0.00 0.00 43.02 39.48 1w1g s PHE 430 CO 0.37 -2.60 1.12 -1.54 -0.05 0.00 0.00 175.22 172.52 1w1g s SER 431 N -2.95 4.53 0.27 1.98 1.04 -1.26 -4.85 113.70 112.46 1w1g s SER 431 Ca 0.65 0.59 -0.03 0.00 0.48 0.00 0.00 55.95 57.64 1w1g s SER 431 Cb -0.21 -1.12 0.34 0.00 0.10 0.00 0.00 66.02 65.14 1w1g s SER 431 CO 0.58 -1.84 1.87 -0.08 0.98 0.00 0.00 173.24 174.75 1w1g h GLU 432 N -0.90 1.05 -0.52 4.02 4.81 -1.99 0.94 114.58 121.99 1w1g h GLU 432 Ca -0.45 -0.14 -0.10 0.00 -0.13 0.00 0.00 59.36 58.54 1w1g h GLU 432 Cb 1.32 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 30.48 1w1g h GLU 432 CO 0.61 0.80 -0.07 -0.44 -0.73 0.00 0.00 179.01 179.19 1w1g h ASP 433 N 1.05 0.96 -0.79 1.04 3.32 -2.01 -2.44 116.42 117.55 1w1g h ASP 433 Ca 0.26 -0.34 0.01 0.00 0.02 0.00 0.00 57.03 56.97 1w1g h ASP 433 Cb 0.10 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 1w1g h ASP 433 CO -0.03 1.07 0.52 -0.33 -1.72 0.00 0.00 179.24 178.75 1w1g h GLU 434 N 0.82 1.04 -0.64 3.56 5.08 -1.82 -2.67 114.58 119.95 1w1g h GLU 434 Ca 0.14 -0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.53 1w1g h GLU 434 Cb 0.62 -0.23 -0.07 0.00 0.50 0.00 0.00 28.75 29.56 1w1g h GLU 434 CO 0.04 0.69 0.26 -0.22 -1.00 0.00 0.00 179.01 178.77 1w1g h LYS 435 N 1.07 0.43 -0.81 2.33 3.64 -0.59 -0.56 116.57 122.08 1w1g h LYS 435 Ca 0.29 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.71 1w1g h LYS 435 Cb -0.12 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.54 1w1g h LYS 435 CO -0.06 0.29 0.49 -0.09 -2.27 0.00 0.00 179.45 177.80 1w1g h ARG 436 N 0.44 0.85 -0.33 1.90 2.43 -1.09 0.49 114.38 119.08 1w1g h ARG 436 Ca 0.33 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.33 1w1g h ARG 436 Cb 0.40 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1w1g h ARG 436 CO -0.31 0.56 -0.22 -0.07 -1.51 0.00 0.00 179.97 178.42 1w1g h LEU 437 N 0.88 0.77 -0.83 3.80 3.38 -1.26 -0.34 115.31 121.70 1w1g h LEU 437 Ca 0.36 -0.43 0.06 0.00 0.09 0.00 0.00 57.88 57.96 1w1g h LEU 437 Cb 0.21 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 1w1g h LEU 437 CO -0.19 1.03 0.51 -0.07 0.09 0.00 0.00 178.44 179.81 1w1g h LEU 438 N 0.50 0.79 -0.42 1.67 3.38 -0.56 -0.56 115.31 120.11 1w1g h LEU 438 Ca 0.07 0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.93 1w1g h LEU 438 Cb 0.78 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1w1g h LEU 438 CO 0.06 0.50 -0.23 0.25 0.09 0.00 0.00 178.44 179.11 1w1g h LEU 439 N 0.92 0.92 -0.50 1.67 5.85 -0.70 -0.87 115.31 122.60 1w1g h LEU 439 Ca 0.37 -0.41 0.04 0.00 0.84 0.00 0.00 57.88 58.72 1w1g h LEU 439 Cb 0.19 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1w1g h LEU 439 CO -0.18 1.13 0.26 -0.33 -0.34 0.00 0.00 178.44 178.98 1w1g h GLU 440 N 0.71 0.50 -0.32 1.25 5.08 -0.51 0.12 114.58 121.41 1w1g h GLU 440 Ca 0.09 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.47 1w1g h GLU 440 Cb 0.80 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.89 1w1g h GLU 440 CO 0.07 0.33 0.02 -0.22 -1.00 0.00 0.00 179.01 178.21 1w1g h LYS 441 N 0.51 0.12 0.06 2.33 3.64 -0.92 -1.96 116.57 120.35 1w1g h LYS 441 Ca 0.22 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1w1g h LYS 441 Cb 0.11 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 1w1g h LYS 441 CO -0.14 0.08 -0.13 0.37 -2.27 0.00 0.00 179.45 177.36 1w1g h GLN 442 N 0.12 -0.23 -0.89 1.90 4.15 -0.60 -1.22 115.11 118.34 1w1g h GLN 442 Ca 0.15 0.02 0.15 0.00 0.77 0.00 0.00 58.65 59.73 1w1g h GLN 442 Cb 0.19 0.05 -0.09 0.00 0.21 0.00 0.00 27.48 27.84 1w1g h GLN 442 CO -0.23 -0.16 0.49 0.00 -1.93 0.00 0.00 178.83 177.00 1w1g h ALA 443 N 0.66 1.36 -0.01 3.38 0.00 -0.56 0.20 119.26 124.29 1w1g h ALA 443 Ca 0.02 0.07 -0.19 0.00 0.00 0.00 0.00 54.91 54.82 1w1g h ALA 443 Cb 0.27 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1w1g h ALA 443 CO -0.08 -0.04 -0.83 0.78 0.00 0.00 0.00 179.25 179.08 1w1g h GLY 444 N 0.69 0.25 0.00 0.00 0.00 -1.14 -3.41 103.07 99.46 1w1g h GLY 444 Ca 0.48 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.40 1w1g h GLY 444 CO -0.35 0.36 -0.69 0.61 0.00 0.00 0.00 176.54 176.48 1w1g n GLY 445 N 0.77 0.19 3.58 4.60 0.00 -0.48 -5.01 105.19 108.85 1w1g n GLY 445 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1w1g n GLY 445 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w1g s ASN 446 N -1.54 6.22 0.63 1.61 3.84 0.67 -4.95 114.94 121.43 1w1g s ASN 446 Ca 0.00 0.10 0.30 0.00 0.21 0.00 0.00 52.86 53.48 1w1g s ASN 446 Cb 0.00 -2.21 1.63 0.00 -0.55 0.00 0.00 41.25 40.13 1w1g s ASN 446 CO 0.00 -0.24 1.97 -0.65 -2.79 0.00 0.00 177.10 175.39 1w1g h PRO 447 N 8.29 0.00 -0.30 0.43 0.11 -1.95 -2.14 132.00 136.43 1w1g h PRO 447 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1w1g h PRO 447 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1w1g h PRO 447 CO 0.66 0.00 0.00 0.91 -0.21 0.00 0.00 178.00 179.36 1w1g n TRP 448 N -3.29 0.38 -0.32 0.65 7.02 -1.26 -4.55 117.44 116.06 1w1g n TRP 448 Ca 0.01 -0.20 0.03 0.00 -1.02 0.00 0.00 57.50 56.32 1w1g n TRP 448 Cb 0.44 -0.00 0.17 0.00 -2.42 0.00 0.00 31.31 29.50 1w1g n TRP 448 CO 0.00 0.00 0.00 1.25 -2.02 0.00 0.00 177.69 176.92 1w1g h HIS 449 N 4.35 1.01 0.00 -5.99 2.76 -1.68 -2.11 115.15 113.49 1w1g h HIS 449 Ca 0.00 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.20 1w1g h HIS 449 Cb 0.96 -0.32 -0.00 0.00 1.55 0.00 0.00 27.41 29.60 1w1g h HIS 449 CO 0.19 0.47 -0.00 -0.56 -1.30 0.00 0.00 177.93 176.72 1w1g h GLN 450 N 0.96 0.00 -0.00 5.26 3.07 -1.83 -2.71 115.11 119.85 1w1g h GLN 450 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.16 1w1g h GLN 450 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.85 1w1g h GLN 450 CO -0.21 0.00 -0.47 1.19 0.09 0.00 0.00 178.83 179.43 1w1g n PHE 451 N -3.20 0.00 -0.87 0.06 3.72 -0.79 -4.46 117.46 111.91 1w1g n PHE 451 Ca -0.03 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.45 1w1g n PHE 451 Cb 0.09 -0.15 0.27 0.00 -0.94 0.00 0.00 39.48 38.75 1w1g n PHE 451 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 1w1g n VAL 452 N -1.07 2.17 -3.27 -4.37 0.24 -1.02 -4.96 118.33 106.05 1w1g n VAL 452 Ca 0.08 -1.70 -0.24 0.00 -2.04 0.00 0.00 64.34 60.45 1w1g n VAL 452 Cb 0.35 -0.15 0.04 0.00 -1.47 0.00 0.00 33.84 32.61 1w1g n VAL 452 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1w1g n GLU 453 N -0.20 -5.66 -1.68 7.34 1.02 -1.26 -1.48 120.64 118.72 1w1g n GLU 453 Ca 0.21 0.83 -0.21 0.00 -0.02 0.00 0.00 57.16 57.97 1w1g n GLU 453 Cb 0.87 -5.74 -0.08 0.00 -0.02 0.00 0.00 31.44 26.47 1w1g n GLU 453 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1w1g n ASN 454 N -2.66 -5.55 -4.76 1.62 5.15 -1.26 -4.98 115.26 102.82 1w1g n ASN 454 Ca -0.06 0.46 -0.40 0.00 -0.60 0.00 0.00 54.58 53.99 1w1g n ASN 454 Cb 0.59 -4.86 -0.05 0.00 -0.53 0.00 0.00 39.78 34.93 1w1g n ASN 454 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1w1g s ASN 455 N -2.71 7.30 0.19 1.20 0.02 -0.55 -5.03 114.94 115.35 1w1g s ASN 455 Ca 0.00 1.55 -0.31 0.00 -1.02 0.00 0.00 52.86 53.07 1w1g s ASN 455 Cb 0.00 -2.48 -0.10 0.00 0.02 0.00 0.00 41.25 38.68 1w1g s ASN 455 CO 0.00 0.10 1.57 -0.22 0.02 0.00 0.00 177.10 178.57 1w1g s LEU 456 N -0.54 4.37 -0.24 0.60 2.96 -1.26 -4.81 118.68 119.75 1w1g s LEU 456 Ca 0.37 2.67 -0.26 0.00 -0.22 0.00 0.00 54.13 56.69 1w1g s LEU 456 Cb -0.22 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 42.87 1w1g s LEU 456 CO 0.25 -0.83 0.90 -0.63 -1.32 0.00 0.00 176.35 174.71 1w1g s ILE 457 N 0.94 4.78 -0.14 6.68 1.01 -1.26 -1.07 121.20 132.14 1w1g s ILE 457 Ca 0.69 1.71 0.09 0.00 0.00 0.00 0.00 60.65 63.13 1w1g s ILE 457 Cb -0.44 -4.18 -0.23 0.00 0.01 0.00 0.00 42.46 37.61 1w1g s ILE 457 CO 0.34 -0.12 0.30 0.18 0.00 0.00 0.00 174.94 175.64 1w1g n LEU 458 N 6.12 1.26 -3.73 2.97 4.77 0.34 -4.82 117.00 123.91 1w1g n LEU 458 Ca 0.08 0.17 -0.13 0.00 -0.03 0.00 0.00 56.01 56.10 1w1g n LEU 458 Cb 0.47 -0.13 -0.10 0.00 -2.33 0.00 0.00 43.42 41.33 1w1g n LEU 458 CO 0.49 0.59 0.10 -0.75 -1.33 0.00 0.00 177.39 176.49 1w1g s LYS 459 N -2.55 0.53 0.10 3.23 2.20 -0.88 -0.26 119.74 122.12 1w1g s LYS 459 Ca -0.14 0.48 -0.06 0.00 -0.36 0.00 0.00 55.97 55.89 1w1g s LYS 459 Cb 0.07 0.25 -0.02 0.00 -1.51 0.00 0.00 37.83 36.63 1w1g s LYS 459 CO 0.78 -0.08 0.15 0.00 -0.36 0.00 0.00 175.35 175.84 1w1g s MET 460 N 0.00 0.88 0.00 4.03 0.23 -0.63 -0.56 119.30 123.25 1w1g s MET 460 Ca -0.02 -1.13 0.00 0.00 -1.03 0.00 0.00 55.69 53.51 1w1g s MET 460 Cb -0.03 0.31 0.00 0.00 -1.53 0.00 0.00 34.83 33.58 1w1g s MET 460 CO 0.01 -0.27 0.00 0.41 -2.03 0.00 0.00 175.02 173.14 1w1g n GLY 461 N -0.06 1.67 3.77 3.16 0.00 -0.78 -2.20 105.19 110.74 1w1g n GLY 461 Ca -0.12 -0.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.86 1w1g n GLY 461 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w1g s PRO 462 N -2.00 4.27 0.05 1.61 0.04 -1.26 -1.14 135.00 136.57 1w1g s PRO 462 Ca 0.00 1.66 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 1w1g s PRO 462 Cb 0.00 -2.75 -0.02 0.00 0.04 0.00 0.00 34.50 31.77 1w1g s PRO 462 CO 0.00 -0.08 0.05 0.14 0.04 0.00 0.00 177.00 177.15 1w1g s VAL 463 N -1.47 0.17 -0.26 -0.36 -7.23 -0.23 -4.78 120.40 106.23 1w1g s VAL 463 Ca 0.54 -1.37 -0.12 0.00 -1.81 0.00 0.00 61.98 59.22 1w1g s VAL 463 Cb -0.26 -1.16 -0.05 0.00 0.56 0.00 0.00 36.38 35.47 1w1g s VAL 463 CO 0.33 -0.76 0.24 -1.81 -0.31 0.00 0.00 175.10 172.80 1w1g s ASP 464 N -2.51 6.13 -0.33 4.85 1.01 -0.22 -0.53 116.67 125.06 1w1g s ASP 464 Ca 0.01 0.12 -0.12 0.00 0.71 0.00 0.00 52.55 53.27 1w1g s ASP 464 Cb 0.03 -2.15 -0.01 0.00 1.01 0.00 0.00 42.92 41.80 1w1g s ASP 464 CO -0.08 -0.06 0.21 -0.75 0.21 0.00 0.00 175.17 174.71 1w1g s LYS 465 N 1.65 3.43 0.11 8.23 2.20 -0.08 -0.96 119.74 134.33 1w1g s LYS 465 Ca 0.10 -0.68 -0.30 0.00 -0.36 0.00 0.00 55.97 54.73 1w1g s LYS 465 Cb -0.15 -3.73 -0.06 0.00 -1.51 0.00 0.00 37.83 32.37 1w1g s LYS 465 CO 0.09 -0.44 1.03 1.03 -0.36 0.00 0.00 175.35 176.70 1w1g s ARG 466 N 1.69 4.62 -0.29 4.03 1.81 -0.14 -1.89 118.95 128.77 1w1g s ARG 466 Ca 0.06 1.56 -0.12 0.00 -1.72 0.00 0.00 55.73 55.50 1w1g s ARG 466 Cb -0.17 -3.35 0.12 0.00 -0.45 0.00 0.00 34.95 31.09 1w1g s ARG 466 CO 0.09 0.09 0.70 0.21 -0.68 0.00 0.00 175.30 175.72 1w1g s LYS 467 N 0.12 0.59 2.43 3.54 2.47 -0.75 -4.41 119.74 123.72 1w1g s LYS 467 Ca 0.49 1.30 0.00 0.00 -1.56 0.00 0.00 55.97 56.21 1w1g s LYS 467 Cb -0.25 0.60 0.00 0.00 -1.46 0.00 0.00 37.83 36.72 1w1g s LYS 467 CO 0.31 -0.17 0.00 0.41 0.16 0.00 0.00 175.35 176.06 1w1g n GLY 468 N 5.02 -0.94 0.17 5.54 0.00 -1.26 -3.78 105.19 109.95 1w1g n GLY 468 Ca -0.14 -1.24 0.03 0.00 0.00 0.00 0.00 46.02 44.66 1w1g n GLY 468 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1w1g h LEU 469 N 0.00 0.00 0.00 0.99 3.38 -2.03 -3.46 115.31 114.19 1w1g h LEU 469 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1w1g h LEU 469 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1w1g h LEU 469 CO 0.00 0.44 0.00 0.49 0.09 0.00 0.00 178.44 179.46 1w1g n PHE 470 N -3.83 0.00 -3.83 1.13 3.72 -1.25 -5.14 117.46 108.26 1w1g n PHE 470 Ca -0.01 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.32 1w1g n PHE 470 Cb 0.49 0.00 -0.00 0.00 -0.94 0.00 0.00 39.48 39.03 1w1g n PHE 470 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1w1g s ALA 471 N -2.00 -1.13 -0.02 4.37 0.00 -1.26 -1.82 121.76 119.90 1w1g s ALA 471 Ca 0.00 -0.42 0.01 0.00 0.00 0.00 0.00 51.96 51.56 1w1g s ALA 471 Cb 0.00 0.76 0.01 0.00 0.00 0.00 0.00 23.12 23.88 1w1g s ALA 471 CO 0.00 -1.02 -0.05 1.03 0.00 0.00 0.00 175.76 175.72 1w1g s ARG 472 N -3.14 0.55 -0.06 0.00 1.81 -0.79 -4.94 118.95 112.37 1w1g s ARG 472 Ca 0.14 -0.13 -0.30 0.00 -1.72 0.00 0.00 55.73 53.71 1w1g s ARG 472 Cb -0.05 -0.57 -0.03 0.00 -0.45 0.00 0.00 34.95 33.86 1w1g s ARG 472 CO 0.08 0.03 1.13 0.50 -0.68 0.00 0.00 175.30 176.35 1w1g s ARG 473 N 0.34 4.39 0.10 3.54 6.06 -1.26 -0.90 118.95 131.22 1w1g s ARG 473 Ca -0.04 1.58 0.05 0.00 -2.50 0.00 0.00 55.73 54.82 1w1g s ARG 473 Cb -0.08 -3.53 -0.04 0.00 0.06 0.00 0.00 34.95 31.37 1w1g s ARG 473 CO -0.00 -0.37 -0.12 1.03 -2.50 0.00 0.00 175.30 173.34 1w1g s ARG 474 N 2.00 0.90 -0.27 5.12 1.81 0.31 -4.46 118.95 124.35 1w1g s ARG 474 Ca 0.54 -1.15 -0.21 0.00 -1.72 0.00 0.00 55.73 53.18 1w1g s ARG 474 Cb -0.23 -0.70 -0.01 0.00 -0.45 0.00 0.00 34.95 33.56 1w1g s ARG 474 CO 0.22 0.13 0.68 -1.14 -0.68 0.00 0.00 175.30 174.50 1w1g s GLN 475 N -2.60 4.05 -0.12 3.54 2.00 -0.15 -1.07 119.66 125.32 1w1g s GLN 475 Ca 0.05 0.55 -0.11 0.00 -2.00 0.00 0.00 55.36 53.86 1w1g s GLN 475 Cb -0.05 -3.68 -0.05 0.00 0.80 0.00 0.00 33.01 30.04 1w1g s GLN 475 CO 0.01 -0.50 0.23 -1.17 -0.50 0.00 0.00 175.29 173.37 1w1g s LEU 476 N 2.63 4.34 -0.14 3.68 2.96 -0.29 -0.97 118.68 130.90 1w1g s LEU 476 Ca 0.28 0.54 -0.02 0.00 -0.22 0.00 0.00 54.13 54.71 1w1g s LEU 476 Cb -0.15 -2.25 0.04 0.00 0.50 0.00 0.00 46.19 44.33 1w1g s LEU 476 CO 0.10 0.28 0.01 -0.76 -1.32 0.00 0.00 176.35 174.65 1w1g s LEU 477 N -0.43 0.95 -0.21 -0.68 1.02 0.38 -1.87 118.68 117.85 1w1g s LEU 477 Ca 0.16 -0.47 -0.13 0.00 0.02 0.00 0.00 54.13 53.71 1w1g s LEU 477 Cb -0.13 -0.56 -0.04 0.00 0.02 0.00 0.00 46.19 45.47 1w1g s LEU 477 CO 0.05 -0.24 0.28 -0.22 0.02 0.00 0.00 176.35 176.24 1w1g s LEU 478 N 1.89 4.16 0.22 1.79 2.96 0.28 -0.79 118.68 129.19 1w1g s LEU 478 Ca 0.02 0.36 0.01 0.00 -0.22 0.00 0.00 54.13 54.30 1w1g s LEU 478 Cb -0.15 -2.32 -0.05 0.00 0.50 0.00 0.00 46.19 44.17 1w1g s LEU 478 CO -0.07 0.02 0.07 0.42 -1.32 0.00 0.00 176.35 175.47 1w1g s THR 479 N 1.03 0.50 0.84 3.68 -4.23 -0.29 -0.51 115.64 116.66 1w1g s THR 479 Ca 0.14 -1.99 -0.13 0.00 -1.18 0.00 0.00 61.69 58.52 1w1g s THR 479 Cb -0.14 -2.46 0.06 0.00 1.34 0.00 0.00 72.50 71.30 1w1g s THR 479 CO 0.05 -0.14 0.90 -1.84 -0.54 0.00 0.00 174.62 173.05 1w1g n GLU 480 N -0.37 0.02 0.00 3.99 0.28 -0.24 -2.27 120.64 122.06 1w1g n GLU 480 Ca -0.02 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.06 1w1g n GLU 480 Cb 0.65 -2.19 0.00 0.00 1.43 0.00 0.00 31.44 31.33 1w1g n GLU 480 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1w1g n GLY 481 N 0.93 2.08 3.91 -1.84 0.00 -1.26 -3.50 105.19 105.51 1w1g n GLY 481 Ca 0.11 -0.43 -0.28 0.00 0.00 0.00 0.00 46.02 45.42 1w1g n GLY 481 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1w1g s PRO 482 N 0.00 2.89 0.10 1.61 0.04 -1.26 -5.10 135.00 133.28 1w1g s PRO 482 Ca 0.00 0.16 0.03 0.00 0.04 0.00 0.00 61.00 61.23 1w1g s PRO 482 Cb 0.00 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 1w1g s PRO 482 CO 0.00 -0.82 -0.08 -1.01 0.04 0.00 0.00 177.00 175.13 1w1g s HIS 483 N -3.12 0.98 -0.33 0.56 3.76 -0.96 -4.85 115.29 111.33 1w1g s HIS 483 Ca 0.55 -0.79 -0.00 0.00 -0.15 0.00 0.00 55.06 54.67 1w1g s HIS 483 Cb -0.11 -0.54 0.10 0.00 1.11 0.00 0.00 32.58 33.14 1w1g s HIS 483 CO 0.47 -0.07 0.11 -0.51 -0.85 0.00 0.00 174.74 173.90 1w1g s LEU 484 N -2.80 2.40 0.20 0.89 1.43 -1.25 -1.13 118.68 118.41 1w1g s LEU 484 Ca 0.09 -1.79 -0.13 0.00 -1.03 0.00 0.00 54.13 51.27 1w1g s LEU 484 Cb 0.02 -0.92 -0.07 0.00 0.03 0.00 0.00 46.19 45.25 1w1g s LEU 484 CO -0.02 -0.39 0.58 -0.31 0.23 0.00 0.00 176.35 176.43 1w1g s TYR 485 N 1.42 3.52 -0.02 0.29 2.02 0.03 -0.75 117.35 123.87 1w1g s TYR 485 Ca 0.11 1.03 0.05 0.00 -0.37 0.00 0.00 57.07 57.89 1w1g s TYR 485 Cb -0.18 -2.36 -0.01 0.00 -0.40 0.00 0.00 41.96 39.01 1w1g s TYR 485 CO -0.21 0.34 -0.17 1.52 -1.57 0.00 0.00 175.55 175.46 1w1g s TYR 486 N -1.64 1.54 0.01 2.71 1.13 0.19 -0.47 117.35 120.83 1w1g s TYR 486 Ca 0.43 -0.32 0.06 0.00 -1.41 0.00 0.00 57.07 55.82 1w1g s TYR 486 Cb -0.13 -1.01 -0.02 0.00 -1.10 0.00 0.00 41.96 39.70 1w1g s TYR 486 CO 0.20 -0.05 -0.17 0.08 -2.51 0.00 0.00 175.55 173.09 1w1g s VAL 487 N -0.30 1.36 -0.36 -3.49 1.01 -0.14 -1.32 120.40 117.16 1w1g s VAL 487 Ca 0.04 -0.89 -0.29 0.00 0.00 0.00 0.00 61.98 60.85 1w1g s VAL 487 Cb -0.08 -1.17 0.00 0.00 0.00 0.00 0.00 36.38 35.14 1w1g s VAL 487 CO -0.00 0.26 1.40 -0.62 0.00 0.00 0.00 175.10 176.14 1w1g s ASP 488 N -0.73 6.43 0.16 3.32 -1.08 0.32 -0.97 116.67 124.12 1w1g s ASP 488 Ca 0.06 1.01 0.26 0.00 -0.52 0.00 0.00 52.55 53.36 1w1g s ASP 488 Cb -0.07 -2.54 0.92 0.00 -1.46 0.00 0.00 42.92 39.76 1w1g s ASP 488 CO 0.00 -1.32 1.80 -0.81 0.52 0.00 0.00 175.17 175.37 1w1g n PRO 489 N 7.82 0.19 -0.08 4.34 -0.04 -1.26 -0.56 135.00 145.41 1w1g n PRO 489 Ca 0.16 0.18 -0.22 0.00 -0.04 0.00 0.00 63.50 63.59 1w1g n PRO 489 Cb 0.47 -1.73 -0.12 0.00 -0.04 0.00 0.00 33.50 32.08 1w1g n PRO 489 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1w1g h VAL 490 N 0.00 0.91 0.00 0.52 2.07 -1.91 -3.38 116.25 114.45 1w1g h VAL 490 Ca 0.00 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.30 1w1g h VAL 490 Cb 0.65 2.32 0.00 0.00 -1.52 0.00 0.00 31.29 32.75 1w1g h VAL 490 CO 0.00 0.42 -0.42 0.59 0.02 0.00 0.00 177.57 178.19 1w1g n ASN 491 N -4.28 0.42 -3.30 0.57 3.02 -1.24 -4.97 115.26 105.49 1w1g n ASN 491 Ca -0.31 -0.10 -0.16 0.00 -0.03 0.00 0.00 54.58 53.98 1w1g n ASN 491 Cb 0.74 0.11 0.07 0.00 -0.61 0.00 0.00 39.78 40.10 1w1g n ASN 491 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1w1g n LYS 492 N -1.53 -3.33 -4.00 3.52 4.76 0.27 -5.03 118.16 112.83 1w1g n LYS 492 Ca 0.06 0.86 -0.15 0.00 -2.87 0.00 0.00 58.31 56.21 1w1g n LYS 492 Cb 0.34 -5.84 -0.15 0.00 -1.84 0.00 0.00 35.03 27.55 1w1g n LYS 492 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 1w1g s VAL 493 N -3.38 0.21 0.15 -0.18 -7.23 -1.11 -4.99 120.40 103.86 1w1g s VAL 493 Ca 0.35 -0.06 -0.31 0.00 -1.81 0.00 0.00 61.98 60.14 1w1g s VAL 493 Cb -0.05 -0.21 -0.10 0.00 0.56 0.00 0.00 36.38 36.58 1w1g s VAL 493 CO 0.74 0.09 1.66 -0.22 -0.31 0.00 0.00 175.10 177.05 1w1g s LEU 494 N 0.24 4.37 -0.15 1.32 2.96 -1.26 -0.52 118.68 125.64 1w1g s LEU 494 Ca -0.02 2.66 0.16 0.00 -0.22 0.00 0.00 54.13 56.71 1w1g s LEU 494 Cb -0.05 -3.58 -0.22 0.00 0.50 0.00 0.00 46.19 42.84 1w1g s LEU 494 CO -0.01 -0.89 0.11 0.29 -1.32 0.00 0.00 176.35 174.53 1w1g n LYS 495 N 4.56 1.11 -3.23 1.98 4.76 -0.43 -4.88 118.16 122.03 1w1g n LYS 495 Ca 0.15 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1w1g n LYS 495 Cb 0.38 -1.44 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 1w1g n LYS 495 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1w1g n GLY 496 N 1.87 -1.30 3.12 0.72 0.00 -1.03 -5.02 105.19 103.56 1w1g n GLY 496 Ca -0.24 -0.92 -0.15 0.00 0.00 0.00 0.00 46.02 44.71 1w1g n GLY 496 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w1g s GLU 497 N -0.63 0.68 -0.27 1.61 2.02 -1.26 -0.63 118.70 120.21 1w1g s GLU 497 Ca 0.00 -0.91 -0.23 0.00 0.02 0.00 0.00 54.97 53.85 1w1g s GLU 497 Cb 0.00 -0.47 -0.01 0.00 0.10 0.00 0.00 34.13 33.75 1w1g s GLU 497 CO 0.00 0.09 0.77 0.42 0.02 0.00 0.00 175.26 176.56 1w1g s ILE 498 N -1.65 4.85 0.10 -1.63 1.01 0.07 -4.98 121.20 118.98 1w1g s ILE 498 Ca -0.04 1.31 -0.30 0.00 0.00 0.00 0.00 60.65 61.62 1w1g s ILE 498 Cb -0.08 -4.09 -0.07 0.00 0.01 0.00 0.00 42.46 38.24 1w1g s ILE 498 CO 0.01 -0.13 1.21 -2.16 0.00 0.00 0.00 174.94 173.87 1w1g s PRO 499 N 2.82 4.45 0.16 2.79 0.04 -1.26 -4.14 135.00 139.85 1w1g s PRO 499 Ca 0.32 1.82 -0.25 0.00 0.04 0.00 0.00 61.00 62.93 1w1g s PRO 499 Cb -0.15 -3.31 -0.08 0.00 0.04 0.00 0.00 34.50 31.01 1w1g s PRO 499 CO 0.10 -0.21 0.76 -1.58 0.04 0.00 0.00 177.00 176.11 1w1g s TRP 500 N 0.72 3.90 0.31 0.56 0.52 -1.26 -4.91 118.94 118.77 1w1g s TRP 500 Ca 0.57 1.61 -0.16 0.00 0.02 0.00 0.00 56.10 58.14 1w1g s TRP 500 Cb -0.31 -2.75 0.02 0.00 -1.15 0.00 0.00 33.47 29.28 1w1g s TRP 500 CO 0.31 0.52 0.66 -1.54 0.02 0.00 0.00 176.95 176.92 1w1g s SER 501 N -1.12 -0.05 0.49 2.95 1.04 -1.26 -5.02 113.70 110.73 1w1g s SER 501 Ca 0.35 -0.90 0.19 0.00 0.48 0.00 0.00 55.95 56.07 1w1g s SER 501 Cb -0.23 0.72 1.23 0.00 0.10 0.00 0.00 66.02 67.85 1w1g s SER 501 CO 0.26 -1.39 2.02 -0.61 0.98 0.00 0.00 173.24 174.50 1w1g h GLN 502 N 2.07 0.15 0.00 4.02 4.15 -2.00 -2.15 115.11 121.35 1w1g h GLN 502 Ca -0.25 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1w1g h GLN 502 Cb 1.25 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1w1g h GLN 502 CO 0.32 0.10 0.00 0.39 -1.93 0.00 0.00 178.83 177.70 1w1g n GLU 503 N -4.45 0.12 -1.88 1.69 1.02 -1.26 -4.85 120.64 111.04 1w1g n GLU 503 Ca 0.07 0.03 -0.41 0.00 -0.02 0.00 0.00 57.16 56.83 1w1g n GLU 503 Cb 0.41 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.31 1w1g n GLU 503 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1w1g s LEU 504 N -2.87 4.36 -0.15 -4.62 0.20 -0.81 -4.73 118.68 110.06 1w1g s LEU 504 Ca 0.17 2.84 -0.07 0.00 0.69 0.00 0.00 54.13 57.76 1w1g s LEU 504 Cb 0.18 -3.63 0.07 0.00 -0.43 0.00 0.00 46.19 42.37 1w1g s LEU 504 CO 0.47 -0.82 0.35 -0.60 -0.29 0.00 0.00 176.35 175.46 1w1g s ARG 505 N -0.55 0.28 0.42 1.98 3.52 -0.77 -4.98 118.95 118.86 1w1g s ARG 505 Ca 0.61 0.79 -0.13 0.00 -0.13 0.00 0.00 55.73 56.86 1w1g s ARG 505 Cb -0.45 0.04 -0.07 0.00 -1.56 0.00 0.00 34.95 32.90 1w1g s ARG 505 CO 0.47 -0.21 0.83 -1.25 -0.81 0.00 0.00 175.30 174.33 1w1g s PRO 506 N 1.89 3.88 -0.16 5.12 0.04 -1.26 -0.46 135.00 144.05 1w1g s PRO 506 Ca -0.05 0.67 -0.06 0.00 0.04 0.00 0.00 61.00 61.60 1w1g s PRO 506 Cb -0.10 -2.31 0.07 0.00 0.04 0.00 0.00 34.50 32.19 1w1g s PRO 506 CO -0.11 -0.07 0.34 -2.00 0.04 0.00 0.00 177.00 175.20 1w1g s GLU 507 N -3.74 0.25 -0.14 4.56 2.12 -0.30 -4.96 118.70 116.49 1w1g s GLU 507 Ca 0.54 0.86 -0.19 0.00 0.36 0.00 0.00 54.97 56.54 1w1g s GLU 507 Cb -0.10 0.12 -0.04 0.00 0.26 0.00 0.00 34.13 34.37 1w1g s GLU 507 CO 0.28 -0.25 0.54 0.00 -0.54 0.00 0.00 175.26 175.29 1w1g s ALA 508 N 2.32 3.48 -0.02 6.30 0.00 -1.26 -0.27 121.76 132.30 1w1g s ALA 508 Ca -0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 51.96 51.70 1w1g s ALA 508 Cb -0.12 -2.78 -0.28 0.00 0.00 0.00 0.00 23.12 19.95 1w1g s ALA 508 CO -0.11 -0.19 0.76 0.87 0.00 0.00 0.00 175.76 177.09 1w1g h LYS 509 N 7.00 0.26 0.00 0.00 1.57 -1.34 -3.49 116.57 120.57 1w1g h LYS 509 Ca -0.38 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 57.95 1w1g h LYS 509 Cb 1.17 0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.65 1w1g h LYS 509 CO 0.75 1.12 0.00 0.27 -0.57 0.00 0.00 179.45 181.02 1w1g n ASN 510 N -3.45 0.00 0.00 0.86 0.23 -1.10 -4.99 115.26 106.81 1w1g n ASN 510 Ca -0.20 0.00 0.14 0.00 -0.53 0.00 0.00 54.58 53.99 1w1g n ASN 510 Cb 1.05 0.00 0.55 0.00 -2.08 0.00 0.00 39.78 39.30 1w1g n ASN 510 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1w1g n PHE 511 N 0.00 0.00 -0.06 -2.53 3.72 -1.26 -4.06 117.46 113.27 1w1g n PHE 511 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 1w1g n PHE 511 Cb 0.00 -0.45 -0.05 0.00 -0.94 0.00 0.00 39.48 38.04 1w1g n PHE 511 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1w1g n LYS 512 N -1.50 0.27 -3.41 -1.08 5.02 -1.26 -0.52 118.16 115.68 1w1g n LYS 512 Ca 0.07 0.08 -0.37 0.00 -2.02 0.00 0.00 58.31 56.06 1w1g n LYS 512 Cb 0.34 -1.11 -0.06 0.00 -0.02 0.00 0.00 35.03 34.17 1w1g n LYS 512 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1w1g s THR 513 N -2.22 5.21 0.03 -0.18 2.01 -1.26 -0.17 115.64 119.06 1w1g s THR 513 Ca -0.15 0.81 -0.11 0.00 0.31 0.00 0.00 61.69 62.54 1w1g s THR 513 Cb 0.05 -3.75 0.01 0.00 0.01 0.00 0.00 72.50 68.82 1w1g s THR 513 CO 0.24 0.37 0.24 0.72 -0.69 0.00 0.00 174.62 175.50 1w1g s PHE 514 N 0.40 -0.03 0.15 4.92 -0.12 0.03 -0.80 117.98 122.52 1w1g s PHE 514 Ca 0.23 -0.11 0.07 0.00 -0.05 0.00 0.00 56.93 57.07 1w1g s PHE 514 Cb -0.15 0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.23 1w1g s PHE 514 CO 0.08 -0.43 -0.04 -0.06 -0.05 0.00 0.00 175.22 174.72 1w1g s PHE 515 N -2.26 2.79 -0.21 3.49 0.08 0.63 -0.56 117.98 121.94 1w1g s PHE 515 Ca -0.07 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 56.83 1w1g s PHE 515 Cb -0.02 -1.39 0.05 0.00 -0.57 0.00 0.00 43.02 41.10 1w1g s PHE 515 CO -0.02 0.49 -0.05 0.08 -0.10 0.00 0.00 175.22 175.62 1w1g s VAL 516 N -1.57 1.37 -0.04 -0.44 1.01 -0.19 -1.15 120.40 119.39 1w1g s VAL 516 Ca 0.25 -1.02 -0.28 0.00 0.00 0.00 0.00 61.98 60.93 1w1g s VAL 516 Cb -0.10 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 1w1g s VAL 516 CO 0.17 -0.03 0.92 -1.00 0.00 0.00 0.00 175.10 175.15 1w1g s HIS 517 N 1.48 3.61 0.24 5.22 3.76 0.39 -1.02 115.29 128.98 1w1g s HIS 517 Ca -0.04 1.57 0.06 0.00 -0.15 0.00 0.00 55.06 56.50 1w1g s HIS 517 Cb -0.18 -3.06 -0.05 0.00 1.11 0.00 0.00 32.58 30.40 1w1g s HIS 517 CO -0.07 -0.03 -0.06 0.95 -0.85 0.00 0.00 174.74 174.68 1w1g s THR 518 N 1.16 1.44 0.23 1.30 -4.23 0.26 -1.85 115.64 113.95 1w1g s THR 518 Ca 0.48 -2.10 -0.07 0.00 -1.18 0.00 0.00 61.69 58.81 1w1g s THR 518 Cb -0.20 -2.31 0.18 0.00 1.34 0.00 0.00 72.50 71.51 1w1g s THR 518 CO 0.24 -0.39 1.75 -0.65 -0.54 0.00 0.00 174.62 175.03 1w1g h PRO 519 N 2.42 0.45 -0.39 3.99 0.11 -1.95 -2.60 132.00 134.04 1w1g h PRO 519 Ca -0.39 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1w1g h PRO 519 Cb 1.22 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1w1g h PRO 519 CO 0.65 0.30 0.00 0.09 -0.21 0.00 0.00 178.00 178.83 1w1g n ASN 520 N -4.97 3.07 -3.62 -2.05 3.02 -1.26 -4.97 115.26 104.48 1w1g n ASN 520 Ca 0.11 -1.93 -0.11 0.00 -0.03 0.00 0.00 54.58 52.62 1w1g n ASN 520 Cb 0.33 -0.26 -0.07 0.00 -0.61 0.00 0.00 39.78 39.17 1w1g n ASN 520 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1w1g s ARG 521 N -1.04 0.60 -0.15 3.52 3.52 -0.98 -5.14 118.95 119.29 1w1g s ARG 521 Ca 0.29 0.59 -0.05 0.00 -0.13 0.00 0.00 55.73 56.43 1w1g s ARG 521 Cb 0.16 0.29 -0.04 0.00 -1.56 0.00 0.00 34.95 33.80 1w1g s ARG 521 CO 0.21 -0.10 0.03 0.99 -0.81 0.00 0.00 175.30 175.61 1w1g s THR 522 N 0.00 4.49 -0.12 4.11 2.01 -1.26 -0.57 115.64 124.30 1w1g s THR 522 Ca 0.01 -0.15 -0.12 0.00 0.31 0.00 0.00 61.69 61.73 1w1g s THR 522 Cb -0.04 -2.97 -0.05 0.00 0.01 0.00 0.00 72.50 69.45 1w1g s THR 522 CO -0.03 0.51 0.28 -0.31 -0.69 0.00 0.00 174.62 174.38 1w1g s TYR 523 N -0.02 3.55 -0.30 4.92 1.51 -0.19 -4.92 117.35 121.90 1w1g s TYR 523 Ca 0.04 0.66 -0.02 0.00 -1.01 0.00 0.00 57.07 56.75 1w1g s TYR 523 Cb -0.13 -2.23 0.05 0.00 -0.11 0.00 0.00 41.96 39.55 1w1g s TYR 523 CO 0.02 0.45 0.00 0.71 -1.11 0.00 0.00 175.55 175.62 1w1g s TYR 524 N -0.24 3.27 0.13 2.71 2.02 -1.26 -1.02 117.35 122.97 1w1g s TYR 524 Ca 0.17 -1.89 0.10 0.00 -0.37 0.00 0.00 57.07 55.08 1w1g s TYR 524 Cb -0.14 -2.13 -0.04 0.00 -0.40 0.00 0.00 41.96 39.26 1w1g s TYR 524 CO 0.06 -0.81 -0.20 -0.51 -1.57 0.00 0.00 175.55 172.52 1w1g s LEU 525 N 1.25 2.60 -0.06 -1.29 2.01 0.28 -0.97 118.68 122.50 1w1g s LEU 525 Ca -0.05 -0.64 0.02 0.00 0.01 0.00 0.00 54.13 53.47 1w1g s LEU 525 Cb -0.20 -1.44 0.01 0.00 0.01 0.00 0.00 46.19 44.58 1w1g s LEU 525 CO -0.01 0.17 -0.11 -0.04 1.01 0.00 0.00 176.35 177.37 1w1g s MET 526 N -2.23 1.46 -0.46 1.70 -1.94 -0.13 -0.79 119.30 116.90 1w1g s MET 526 Ca 0.18 -0.35 0.00 0.00 -1.71 0.00 0.00 55.69 53.81 1w1g s MET 526 Cb -0.10 -1.25 0.12 0.00 2.01 0.00 0.00 34.83 35.61 1w1g s MET 526 CO 0.09 0.03 0.23 0.34 -0.01 0.00 0.00 175.02 175.70 1w1g s ASP 527 N 0.62 4.95 0.05 3.03 2.15 0.76 -1.05 116.67 127.18 1w1g s ASP 527 Ca -0.12 -2.44 0.07 0.00 0.43 0.00 0.00 52.55 50.49 1w1g s ASP 527 Cb -0.15 -1.75 0.33 0.00 -0.30 0.00 0.00 42.92 41.05 1w1g s ASP 527 CO 0.03 -0.40 1.22 -0.81 -0.17 0.00 0.00 175.17 175.03 1w1g n PRO 528 N 3.98 0.02 0.00 4.34 -0.04 -1.26 -2.00 135.00 140.04 1w1g n PRO 528 Ca 0.03 0.45 0.13 0.00 -0.04 0.00 0.00 63.50 64.07 1w1g n PRO 528 Cb 0.39 -1.57 0.58 0.00 -0.04 0.00 0.00 33.50 32.86 1w1g n PRO 528 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1w1g n SER 529 N -1.62 0.00 -0.18 3.54 3.41 -1.26 -4.92 113.62 112.59 1w1g n SER 529 Ca 0.01 0.48 -0.02 0.00 -0.26 0.00 0.00 58.87 59.08 1w1g n SER 529 Cb 0.05 -0.49 -0.00 0.00 -0.26 0.00 0.00 64.21 63.51 1w1g n SER 529 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1w1g n GLY 530 N 1.29 0.39 0.86 5.00 0.00 -0.85 -4.97 105.19 106.92 1w1g n GLY 530 Ca 0.07 -0.90 0.03 0.00 0.00 0.00 0.00 46.02 45.22 1w1g n GLY 530 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1w1g n ASN 531 N 1.67 2.84 -0.25 1.61 3.02 -0.88 -4.69 115.26 118.57 1w1g n ASN 531 Ca -0.02 -3.44 0.15 0.00 -0.03 0.00 0.00 54.58 51.24 1w1g n ASN 531 Cb 0.31 -0.57 0.44 0.00 -0.61 0.00 0.00 39.78 39.36 1w1g n ASN 531 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1w1g h ALA 532 N 1.10 2.00 -0.22 5.41 0.00 -1.04 -1.03 119.26 125.47 1w1g h ALA 532 Ca 0.10 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 1w1g h ALA 532 Cb 1.43 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1w1g h ALA 532 CO 0.24 -0.26 -0.23 0.45 0.00 0.00 0.00 179.25 179.45 1w1g h HIS 533 N 0.55 0.44 -0.62 0.00 3.86 -1.80 -0.80 115.15 116.79 1w1g h HIS 533 Ca 0.46 -0.08 -0.09 0.00 -1.16 0.00 0.00 60.37 59.50 1w1g h HIS 533 Cb 0.92 -0.11 -0.02 0.00 1.06 0.00 0.00 27.41 29.26 1w1g h HIS 533 CO -0.00 0.60 0.05 0.87 0.86 0.00 0.00 177.93 180.31 1w1g h LYS 534 N 0.36 1.06 -0.17 2.45 1.57 -1.56 0.12 116.57 120.39 1w1g h LYS 534 Ca 0.06 -0.31 0.02 0.00 -1.87 0.00 0.00 60.65 58.55 1w1g h LYS 534 Cb 0.60 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 1w1g h LYS 534 CO 0.04 1.01 0.05 -1.49 -0.57 0.00 0.00 179.45 178.49 1w1g h TRP 535 N 0.96 0.08 -0.35 -1.35 4.06 -1.12 -1.43 115.95 116.81 1w1g h TRP 535 Ca 0.18 0.01 -0.04 0.00 2.06 0.00 0.00 58.89 61.10 1w1g h TRP 535 Cb 0.50 -0.01 -0.01 0.00 -1.00 0.00 0.00 29.16 28.64 1w1g h TRP 535 CO 0.04 0.04 0.07 0.00 -3.56 0.00 0.00 178.44 175.02 1w1g h ARG 537 N 0.41 0.30 -0.28 0.00 3.08 -0.67 0.40 114.38 117.63 1w1g h ARG 537 Ca 0.11 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.98 1w1g h ARG 537 Cb 0.33 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.31 1w1g h ARG 537 CO 0.00 0.20 -0.46 -0.22 -1.07 0.00 0.00 179.97 178.43 1w1g h LYS 538 N 0.31 0.80 -0.75 0.04 1.63 -1.11 0.13 116.57 117.63 1w1g h LYS 538 Ca 0.16 -0.49 -0.02 0.00 -0.85 0.00 0.00 60.65 59.45 1w1g h LYS 538 Cb 0.12 0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.76 1w1g h LYS 538 CO -0.15 1.12 0.37 0.82 -3.45 0.00 0.00 179.45 178.16 1w1g h ILE 539 N 0.56 1.24 -0.71 2.00 2.04 -1.11 -0.97 117.51 120.56 1w1g h ILE 539 Ca 0.02 -0.65 -0.07 0.00 1.00 0.00 0.00 64.86 65.16 1w1g h ILE 539 Cb 1.06 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1w1g h ILE 539 CO 0.10 0.28 0.16 -0.61 0.00 0.00 0.00 178.15 178.08 1w1g h GLN 540 N 1.04 1.15 -0.26 2.37 5.75 -0.53 0.38 115.11 125.01 1w1g h GLN 540 Ca 0.26 -0.28 0.03 0.00 -0.15 0.00 0.00 58.65 58.51 1w1g h GLN 540 Cb 0.10 -0.15 -0.03 0.00 1.07 0.00 0.00 27.48 28.47 1w1g h GLN 540 CO -0.03 1.01 0.06 1.49 -2.65 0.00 0.00 178.83 178.71 1w1g h GLU 541 N 1.08 0.16 -0.43 1.69 4.81 -0.41 -0.13 114.58 121.34 1w1g h GLU 541 Ca 0.22 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1w1g h GLU 541 Cb 0.39 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1w1g h GLU 541 CO 0.00 0.10 0.21 0.28 -0.73 0.00 0.00 179.01 178.88 1w1g h VAL 542 N 0.16 1.18 -0.69 0.32 2.07 -0.96 -1.51 116.25 116.82 1w1g h VAL 542 Ca 0.12 -0.50 0.11 0.00 0.82 0.00 0.00 66.70 67.25 1w1g h VAL 542 Cb 0.11 0.71 -0.08 0.00 -1.52 0.00 0.00 31.29 30.51 1w1g h VAL 542 CO -0.15 0.19 0.29 -0.25 0.02 0.00 0.00 177.57 177.68 1w1g h TRP 543 N 0.56 0.51 -0.47 1.57 7.01 -0.43 0.19 115.95 124.88 1w1g h TRP 543 Ca 0.15 0.03 -0.09 0.00 2.11 0.00 0.00 58.89 61.09 1w1g h TRP 543 Cb 0.11 -0.12 -0.02 0.00 -2.10 0.00 0.00 29.16 27.03 1w1g h TRP 543 CO -0.01 0.13 -0.05 0.00 -2.79 0.00 0.00 178.44 175.71 1w1g h ARG 544 N 0.48 0.86 -0.03 2.65 3.08 -0.61 0.08 114.38 120.89 1w1g h ARG 544 Ca 0.35 -0.30 -0.12 0.00 0.07 0.00 0.00 59.98 59.98 1w1g h ARG 544 Cb 0.45 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 1w1g h ARG 544 CO -0.32 0.93 -0.54 1.96 -1.07 0.00 0.00 179.97 180.93 1w1g h GLN 545 N 0.71 0.09 -0.04 0.04 4.20 -0.78 0.44 115.11 119.76 1w1g h GLN 545 Ca 0.13 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.66 1w1g h GLN 545 Cb 0.58 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.37 1w1g h GLN 545 CO 0.03 0.60 -0.47 -0.09 -0.67 0.00 0.00 178.83 178.24 1w1g h ARG 546 N 0.07 0.39 0.00 1.46 9.65 -0.12 -3.40 114.38 122.43 1w1g h ARG 546 Ca -0.00 -0.37 0.00 0.00 -1.10 0.00 0.00 59.98 58.51 1w1g h ARG 546 Cb 0.97 0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.64 1w1g h ARG 546 CO 0.07 1.02 -1.03 0.66 2.80 0.00 0.00 179.97 183.50 1w1g n TYR 547 N -4.30 0.00 -3.30 2.20 4.01 -0.03 -5.02 117.16 110.72 1w1g n TYR 547 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 1w1g n TYR 547 Cb 0.59 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.49 1w1g n TYR 547 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1w1g n GLN 548 N -1.58 3.34 -0.97 -0.72 6.02 0.14 -5.05 117.38 118.55 1w1g n GLN 548 Ca -0.00 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.01 1w1g n GLN 548 Cb 0.23 0.00 -0.01 0.00 1.02 0.00 0.00 30.24 31.48 1w1g n GLN 548 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1w1g n SER 549 N -0.33 -5.23 0.00 1.08 7.64 -1.26 -4.73 113.62 110.79 1w1g n SER 549 Ca 0.00 1.13 0.00 0.00 1.01 0.00 0.00 58.87 61.01 1w1g n SER 549 Cb 0.00 -2.87 0.00 0.00 -1.01 0.00 0.00 64.21 60.33 1w1g n SER 549 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60