#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wz1 n PRO 413 N 0.00 1.35 -1.70 5.55 -0.02 -1.26 -4.47 135.00 134.44 2wz1 n PRO 413 Ca 0.00 0.49 -0.41 0.00 -2.02 0.00 0.00 63.50 61.56 2wz1 n PRO 413 Cb 0.00 -2.24 0.01 0.00 -0.02 0.00 0.00 33.50 31.25 2wz1 n PRO 413 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wz1 n ALA 414 N -0.98 1.32 -3.37 3.55 0.00 -1.26 -4.82 120.51 114.94 2wz1 n ALA 414 Ca 0.11 0.27 -0.15 0.00 0.00 0.00 0.00 53.44 53.66 2wz1 n ALA 414 Cb 0.43 -2.27 -0.08 0.00 0.00 0.00 0.00 19.45 17.53 2wz1 n ALA 414 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2wz1 s LYS 415 N -2.20 0.80 -0.09 0.00 2.20 -0.42 -4.99 119.74 115.05 2wz1 s LYS 415 Ca 0.61 0.14 -0.09 0.00 -0.36 0.00 0.00 55.97 56.27 2wz1 s LYS 415 Cb -0.51 0.37 -0.05 0.00 -1.51 0.00 0.00 37.83 36.13 2wz1 s LYS 415 CO 0.58 -0.22 0.22 0.50 -0.36 0.00 0.00 175.35 176.08 2wz1 s ARG 416 N -0.97 3.61 -0.06 4.03 3.52 -1.26 0.80 118.95 128.62 2wz1 s ARG 416 Ca -0.10 0.03 0.02 0.00 -0.13 0.00 0.00 55.73 55.55 2wz1 s ARG 416 Cb -0.03 -3.21 0.02 0.00 -1.56 0.00 0.00 34.95 30.17 2wz1 s ARG 416 CO 0.06 0.73 -0.10 0.71 -0.81 0.00 0.00 175.30 175.89 2wz1 s TYR 417 N -0.98 1.24 0.49 5.12 2.02 0.24 -5.00 117.35 120.49 2wz1 s TYR 417 Ca 0.17 -0.44 0.02 0.00 -0.37 0.00 0.00 57.07 56.46 2wz1 s TYR 417 Cb -0.13 -0.94 0.02 0.00 -0.40 0.00 0.00 41.96 40.50 2wz1 s TYR 417 CO 0.07 -0.25 0.70 0.34 -1.57 0.00 0.00 175.55 174.83 2wz1 s ASP 418 N 0.75 5.52 -1.18 2.29 2.15 -1.26 -1.00 116.67 123.94 2wz1 s ASP 418 Ca -0.13 0.00 -0.01 0.00 0.43 0.00 0.00 52.55 52.84 2wz1 s ASP 418 Cb -0.15 -1.05 -0.01 0.00 -0.30 0.00 0.00 42.92 41.41 2wz1 s ASP 418 CO 0.03 -0.93 0.96 0.59 -0.17 0.00 0.00 175.17 175.65 2wz1 n ASN 419 N -2.16 -2.82 -4.47 -0.34 3.02 -1.21 -4.95 115.26 102.33 2wz1 n ASN 419 Ca 0.06 -0.66 -0.33 0.00 -0.03 0.00 0.00 54.58 53.62 2wz1 n ASN 419 Cb 0.59 -5.04 -0.13 0.00 -0.61 0.00 0.00 39.78 34.59 2wz1 n ASN 419 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2wz1 s VAL 420 N -3.39 3.22 -0.11 2.41 1.01 -0.74 -4.55 120.40 118.24 2wz1 s VAL 420 Ca 0.09 -0.65 -0.01 0.00 0.00 0.00 0.00 61.98 61.40 2wz1 s VAL 420 Cb -0.01 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 2wz1 s VAL 420 CO 0.74 0.57 -0.05 -0.89 0.00 0.00 0.00 175.10 175.48 2wz1 s THR 421 N -0.47 3.83 0.00 3.92 2.01 -0.42 -0.73 115.64 123.78 2wz1 s THR 421 Ca 0.06 -0.40 0.08 0.00 0.31 0.00 0.00 61.69 61.74 2wz1 s THR 421 Cb -0.12 -2.62 -0.02 0.00 0.01 0.00 0.00 72.50 69.74 2wz1 s THR 421 CO 0.02 0.55 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.62 2wz1 s ILE 422 N -0.27 2.01 -0.04 1.82 1.01 0.08 -1.30 121.20 124.52 2wz1 s ILE 422 Ca 0.04 -1.17 0.07 0.00 0.00 0.00 0.00 60.65 59.59 2wz1 s ILE 422 Cb -0.13 -1.69 -0.01 0.00 0.01 0.00 0.00 42.46 40.64 2wz1 s ILE 422 CO 0.02 0.49 -0.25 -0.22 0.00 0.00 0.00 174.94 174.98 2wz1 s LEU 423 N -0.81 2.06 -0.03 2.97 0.20 0.69 -2.00 118.68 121.77 2wz1 s LEU 423 Ca 0.10 -0.49 0.06 0.00 0.69 0.00 0.00 54.13 54.49 2wz1 s LEU 423 Cb -0.10 -1.35 -0.01 0.00 -0.43 0.00 0.00 46.19 44.30 2wz1 s LEU 423 CO 0.00 0.27 -0.20 -0.36 -0.29 0.00 0.00 176.35 175.77 2wz1 s PHE 424 N -0.33 1.85 -0.05 5.38 0.40 -0.51 -1.90 117.98 122.82 2wz1 s PHE 424 Ca 0.02 -0.41 0.02 0.00 -0.60 0.00 0.00 56.93 55.96 2wz1 s PHE 424 Cb -0.12 -1.21 0.01 0.00 0.51 0.00 0.00 43.02 42.21 2wz1 s PHE 424 CO 0.02 -0.08 -0.11 0.45 0.70 0.00 0.00 175.22 176.20 2wz1 s SER 425 N -0.33 1.51 0.32 1.36 0.15 0.14 -0.75 113.70 116.10 2wz1 s SER 425 Ca 0.04 -0.24 0.06 0.00 0.70 0.00 0.00 55.95 56.50 2wz1 s SER 425 Cb -0.09 -0.57 -0.06 0.00 -1.71 0.00 0.00 66.02 63.59 2wz1 s SER 425 CO 0.00 0.05 -0.00 -0.83 1.20 0.00 0.00 173.24 173.66 2wz1 s GLY 426 N 0.45 2.03 -0.21 9.45 0.00 0.06 -1.27 107.32 117.83 2wz1 s GLY 426 Ca -0.09 -2.03 -0.10 0.00 0.00 0.00 0.00 44.72 42.51 2wz1 s GLY 426 CO 0.02 -1.87 0.13 -0.42 0.00 0.00 0.00 173.10 170.96 2wz1 s ILE 427 N -3.07 5.35 0.01 0.90 1.01 -1.26 -1.16 121.20 122.98 2wz1 s ILE 427 Ca 0.33 0.17 -0.30 0.00 0.00 0.00 0.00 60.65 60.85 2wz1 s ILE 427 Cb 0.07 -3.45 -0.06 0.00 0.01 0.00 0.00 42.46 39.03 2wz1 s ILE 427 CO 0.14 0.42 1.37 -0.69 0.00 0.00 0.00 174.94 176.18 2wz1 s VAL 428 N 0.53 3.74 -1.04 2.92 1.01 -0.29 -2.93 120.40 124.33 2wz1 s VAL 428 Ca 0.08 1.15 -0.05 0.00 0.00 0.00 0.00 61.98 63.16 2wz1 s VAL 428 Cb -0.12 -3.74 0.01 0.00 0.00 0.00 0.00 36.38 32.53 2wz1 s VAL 428 CO -0.00 0.01 0.61 0.61 0.00 0.00 0.00 175.10 176.33 2wz1 n GLY 429 N 3.58 -0.14 0.17 4.51 0.00 -1.26 -4.79 105.19 107.25 2wz1 n GLY 429 Ca 0.12 -0.09 -0.12 0.00 0.00 0.00 0.00 46.02 45.94 2wz1 n GLY 429 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2wz1 h PHE 430 N -1.39 -0.29 -0.28 1.61 3.57 -1.94 -1.16 116.94 117.06 2wz1 h PHE 430 Ca -0.39 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.09 2wz1 h PHE 430 Cb 1.26 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 40.08 2wz1 h PHE 430 CO 0.36 0.08 0.10 -0.91 -2.23 0.00 0.00 178.31 175.71 2wz1 h ASN 431 N -0.78 0.35 -0.52 0.41 2.35 -1.93 0.20 115.58 115.65 2wz1 h ASN 431 Ca -0.03 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 2wz1 h ASN 431 Cb 0.51 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 2wz1 h ASN 431 CO 0.05 0.34 0.12 0.00 -1.65 0.00 0.00 177.43 176.29 2wz1 h ALA 432 N 1.72 0.69 -0.77 -0.83 0.00 -1.97 -2.23 119.26 115.87 2wz1 h ALA 432 Ca 0.10 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.82 2wz1 h ALA 432 Cb 0.11 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2wz1 h ALA 432 CO -0.01 0.39 0.49 0.35 0.00 0.00 0.00 179.25 180.48 2wz1 h PHE 433 N 0.73 0.93 -0.73 0.00 3.57 -0.47 -1.18 116.94 119.78 2wz1 h PHE 433 Ca 0.16 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.69 2wz1 h PHE 433 Cb 0.35 -0.31 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 2wz1 h PHE 433 CO 0.02 0.54 0.48 0.00 -2.23 0.00 0.00 178.31 177.13 2wz1 n SER 435 N -4.57 3.98 0.00 0.00 3.41 -0.96 -3.16 113.62 112.31 2wz1 n SER 435 Ca 0.07 -2.52 -0.10 0.00 -0.26 0.00 0.00 58.87 56.06 2wz1 n SER 435 Cb 0.02 -0.47 -0.14 0.00 -0.26 0.00 0.00 64.21 63.36 2wz1 n SER 435 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2wz1 h LYS 436 N 2.73 0.03 -1.86 4.33 3.64 -0.94 -3.39 116.57 121.12 2wz1 h LYS 436 Ca 0.00 -0.06 -0.70 0.00 -1.27 0.00 0.00 60.65 58.62 2wz1 h LYS 436 Cb 1.26 0.02 -0.33 0.00 -0.41 0.00 0.00 32.23 32.77 2wz1 h LYS 436 CO 0.17 0.67 0.33 0.72 -2.27 0.00 0.00 179.45 179.07 2wz1 n HIS 437 N -3.16 3.18 -2.34 1.91 -0.00 -0.61 -4.90 115.22 109.30 2wz1 n HIS 437 Ca -0.15 -2.72 -0.42 0.00 -0.00 0.00 0.00 57.72 54.44 2wz1 n HIS 437 Cb 1.03 -0.75 0.00 0.00 -0.00 0.00 0.00 29.99 30.27 2wz1 n HIS 437 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2wz1 n ALA 438 N -0.47 5.66 -2.45 -1.41 0.00 -1.19 -4.04 120.51 116.61 2wz1 n ALA 438 Ca 0.47 -4.33 0.00 0.00 0.00 0.00 0.00 53.44 49.58 2wz1 n ALA 438 Cb 0.40 -2.86 0.00 0.00 0.00 0.00 0.00 19.45 16.99 2wz1 n ALA 438 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2wz1 n SER 439 N 3.09 0.00 0.00 0.00 2.88 -1.26 -4.97 113.62 113.36 2wz1 n SER 439 Ca 0.43 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.97 2wz1 n SER 439 Cb 0.33 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.79 2wz1 n SER 439 CO 0.00 0.00 0.00 -1.84 -1.23 0.00 0.00 175.04 171.97 2wz1 n GLU 441 N 0.00 0.00 -0.29 -1.46 -0.00 -1.26 -4.61 120.64 113.02 2wz1 n GLU 441 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.16 57.08 2wz1 n GLU 441 Cb 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 31.44 31.37 2wz1 n GLU 441 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wz1 n GLY 442 N 0.00 -1.93 0.37 -1.84 0.00 -1.26 -0.53 105.19 99.99 2wz1 n GLY 442 Ca 0.00 0.84 0.27 0.00 0.00 0.00 0.00 46.02 47.13 2wz1 n GLY 442 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wz1 h ALA 443 N 0.29 2.16 -0.14 4.61 0.00 -1.82 -2.41 119.26 121.94 2wz1 h ALA 443 Ca 0.11 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 55.12 2wz1 h ALA 443 Cb 0.28 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 2wz1 h ALA 443 CO -0.64 -0.77 -0.17 1.98 0.00 0.00 0.00 179.25 179.65 2wz1 h MET 444 N 0.25 0.36 0.00 0.00 1.85 -1.20 -1.61 114.93 114.59 2wz1 h MET 444 Ca 0.75 -0.20 -0.01 0.00 -0.61 0.00 0.00 59.70 59.63 2wz1 h MET 444 Cb 1.89 0.01 -0.00 0.00 0.43 0.00 0.00 31.60 33.94 2wz1 h MET 444 CO -0.56 0.77 -0.03 0.87 -0.40 0.00 0.00 176.91 177.56 2wz1 h LYS 445 N -0.02 0.00 0.03 0.39 1.57 -1.48 0.36 116.57 117.43 2wz1 h LYS 445 Ca 0.02 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 2wz1 h LYS 445 Cb 0.71 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.03 2wz1 h LYS 445 CO 0.04 0.03 -0.20 0.82 -0.57 0.00 0.00 179.45 179.57 2wz1 h ILE 446 N 0.00 1.73 -0.21 1.86 2.04 -1.19 -3.00 117.51 118.74 2wz1 h ILE 446 Ca -0.00 -2.39 -0.12 0.00 1.00 0.00 0.00 64.86 63.34 2wz1 h ILE 446 Cb 0.11 3.35 -0.01 0.00 -0.74 0.00 0.00 36.82 39.53 2wz1 h ILE 446 CO 0.00 0.64 -0.40 0.58 0.00 0.00 0.00 178.15 178.97 2wz1 h VAL 447 N -0.85 1.30 -0.53 1.67 2.07 -1.07 -2.31 116.25 116.53 2wz1 h VAL 447 Ca -0.03 -1.54 -0.12 0.00 0.82 0.00 0.00 66.70 65.82 2wz1 h VAL 447 Cb 1.16 1.58 -0.02 0.00 -1.52 0.00 0.00 31.29 32.48 2wz1 h VAL 447 CO 0.04 0.48 -0.13 0.78 0.02 0.00 0.00 177.57 178.76 2wz1 h ASN 448 N 0.40 1.02 -0.21 0.57 2.35 -0.43 -0.07 115.58 119.21 2wz1 h ASN 448 Ca 0.04 -0.35 -0.02 0.00 -0.55 0.00 0.00 56.30 55.41 2wz1 h ASN 448 Cb 0.87 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.95 2wz1 h ASN 448 CO 0.07 1.14 0.04 0.25 -1.65 0.00 0.00 177.43 177.29 2wz1 h LEU 449 N 0.90 0.34 -0.27 1.61 5.85 -1.34 0.36 115.31 122.76 2wz1 h LEU 449 Ca 0.13 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.58 2wz1 h LEU 449 Cb 0.70 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2wz1 h LEU 449 CO 0.05 0.51 0.07 -0.07 -0.34 0.00 0.00 178.44 178.66 2wz1 h LEU 450 N 0.16 0.40 -0.70 2.25 3.38 -1.34 -0.52 115.31 118.94 2wz1 h LEU 450 Ca 0.07 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.83 2wz1 h LEU 450 Cb 0.31 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 2wz1 h LEU 450 CO 0.00 0.52 0.45 0.78 0.09 0.00 0.00 178.44 180.28 2wz1 h ASN 451 N 0.26 0.77 0.59 -0.43 2.35 -0.90 0.20 115.58 118.43 2wz1 h ASN 451 Ca 0.08 -0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2wz1 h ASN 451 Cb 0.27 -0.19 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 2wz1 h ASN 451 CO -0.00 0.55 -0.35 -0.78 -1.65 0.00 0.00 177.43 175.21 2wz1 h ASP 452 N 0.92 -0.86 -0.37 5.81 3.58 0.10 0.22 116.42 125.81 2wz1 h ASP 452 Ca 0.26 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.75 2wz1 h ASP 452 Cb -0.07 0.25 -0.02 0.00 1.72 0.00 0.00 39.33 41.21 2wz1 h ASP 452 CO -0.07 -0.55 0.21 0.25 -2.88 0.00 0.00 179.24 176.20 2wz1 h LEU 453 N -0.88 0.49 0.17 2.28 5.85 -0.95 -2.45 115.31 119.80 2wz1 h LEU 453 Ca -0.07 -0.03 -0.35 0.00 0.84 0.00 0.00 57.88 58.26 2wz1 h LEU 453 Cb 0.71 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.62 2wz1 h LEU 453 CO 0.09 0.41 -1.78 1.88 -0.34 0.00 0.00 178.44 178.69 2wz1 h TYR 454 N 0.56 0.65 -1.01 1.25 -1.99 -0.62 0.00 116.97 115.81 2wz1 h TYR 454 Ca 0.14 -0.47 0.24 0.00 2.00 0.00 0.00 58.73 60.64 2wz1 h TYR 454 Cb 0.04 -0.03 -0.09 0.00 2.00 0.00 0.00 36.73 38.65 2wz1 h TYR 454 CO 0.00 1.66 0.64 1.15 -0.00 0.00 0.00 178.16 181.62 2wz1 h THR 455 N 0.10 0.59 0.01 -2.88 2.02 -0.60 0.19 112.91 112.33 2wz1 h THR 455 Ca -0.35 -0.16 -0.15 0.00 0.77 0.00 0.00 66.41 66.51 2wz1 h THR 455 Cb 2.08 0.06 0.01 0.00 -1.74 0.00 0.00 68.15 68.57 2wz1 h THR 455 CO 0.16 0.09 -0.61 0.03 0.37 0.00 0.00 175.52 175.56 2wz1 h ARG 456 N 0.48 0.40 -0.78 6.66 3.08 -1.04 -2.97 114.38 120.20 2wz1 h ARG 456 Ca 0.57 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 60.19 2wz1 h ARG 456 Cb 1.31 0.13 -0.04 0.00 0.08 0.00 0.00 29.97 31.45 2wz1 h ARG 456 CO -0.31 1.11 0.50 0.74 -1.07 0.00 0.00 179.97 180.94 2wz1 h PHE 457 N -0.13 1.01 -0.78 3.04 0.04 -0.70 -2.21 116.94 117.21 2wz1 h PHE 457 Ca -0.08 0.01 0.11 0.00 2.80 0.00 0.00 57.97 60.81 2wz1 h PHE 457 Cb 1.33 -0.34 -0.05 0.00 2.20 0.00 0.00 35.95 39.09 2wz1 h PHE 457 CO 0.15 0.65 0.51 -0.44 -0.60 0.00 0.00 178.31 178.58 2wz1 h ASP 458 N 1.07 0.59 -0.39 2.17 3.32 -0.68 -0.02 116.42 122.49 2wz1 h ASP 458 Ca 0.28 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.36 2wz1 h ASP 458 Cb -0.09 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 2wz1 h ASP 458 CO -0.06 0.34 0.25 0.71 -1.72 0.00 0.00 179.24 178.77 2wz1 h THR 459 N 0.65 1.10 0.00 0.35 1.35 -1.22 -1.42 112.91 113.72 2wz1 h THR 459 Ca 0.36 -0.20 -0.16 0.00 -0.55 0.00 0.00 66.41 65.86 2wz1 h THR 459 Cb 0.53 0.54 -0.02 0.00 -1.73 0.00 0.00 68.15 67.46 2wz1 h THR 459 CO -0.14 0.10 -0.78 -0.07 -0.25 0.00 0.00 175.52 174.38 2wz1 h LEU 460 N 0.53 0.00 -1.80 3.87 3.38 -1.03 -3.30 115.31 116.95 2wz1 h LEU 460 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2wz1 h LEU 460 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2wz1 h LEU 460 CO -0.03 0.78 0.00 0.35 0.09 0.00 0.00 178.44 179.63 2wz1 n THR 461 N -3.48 0.15 -1.68 0.22 -2.24 -0.75 -4.63 114.28 101.87 2wz1 n THR 461 Ca -0.00 -0.51 -0.45 0.00 -2.27 0.00 0.00 64.05 60.81 2wz1 n THR 461 Cb 0.79 1.09 -0.04 0.00 -2.10 0.00 0.00 70.33 70.07 2wz1 n THR 461 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2wz1 n ASP 462 N 1.10 3.58 0.30 3.42 -0.08 -0.56 -4.61 116.55 119.70 2wz1 n ASP 462 Ca 0.16 1.00 0.19 0.00 -1.51 0.00 0.00 54.79 54.63 2wz1 n ASP 462 Cb 0.54 -1.45 0.88 0.00 2.34 0.00 0.00 41.12 43.43 2wz1 n ASP 462 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 2wz1 h SER 463 N 8.18 0.00 0.93 1.67 4.64 -1.89 0.30 113.55 127.38 2wz1 h SER 463 Ca -0.47 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 60.82 2wz1 h SER 463 Cb 1.25 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.33 2wz1 h SER 463 CO 0.93 0.02 -0.17 0.03 -0.87 0.00 0.00 176.83 176.77 2wz1 h ARG 464 N 0.00 0.00 0.00 4.77 3.08 -1.98 -3.33 114.38 116.91 2wz1 h ARG 464 Ca -0.00 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.67 2wz1 h ARG 464 Cb 0.31 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.30 2wz1 h ARG 464 CO 0.00 0.17 -2.36 1.17 -1.07 0.00 0.00 179.97 177.88 2wz1 n LYS 465 N -3.33 0.56 -3.73 0.04 4.81 -0.44 -4.92 118.16 111.14 2wz1 n LYS 465 Ca 0.00 0.18 -0.30 0.00 -0.87 0.00 0.00 58.31 57.32 2wz1 n LYS 465 Cb 0.40 -1.44 -0.14 0.00 0.02 0.00 0.00 35.03 33.87 2wz1 n LYS 465 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 2wz1 s ASN 466 N -6.68 3.90 0.00 3.14 3.84 -0.03 -4.98 114.94 114.13 2wz1 s ASN 466 Ca -0.33 -2.03 0.29 0.00 0.21 0.00 0.00 52.86 51.00 2wz1 s ASN 466 Cb 0.10 -0.95 1.49 0.00 -0.55 0.00 0.00 41.25 41.34 2wz1 s ASN 466 CO 0.50 -0.36 2.00 -0.81 -2.79 0.00 0.00 177.10 175.64 2wz1 n PRO 467 N 4.33 0.49 0.00 0.43 -0.04 -1.25 -3.40 135.00 135.56 2wz1 n PRO 467 Ca 0.03 0.02 0.12 0.00 -0.04 0.00 0.00 63.50 63.62 2wz1 n PRO 467 Cb 0.39 -1.50 0.28 0.00 -0.04 0.00 0.00 33.50 32.63 2wz1 n PRO 467 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2wz1 n PHE 468 N -1.24 0.00 -4.33 0.54 3.72 -1.26 -4.91 117.46 109.98 2wz1 n PHE 468 Ca 0.15 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.34 2wz1 n PHE 468 Cb 0.21 -0.16 -0.11 0.00 -0.94 0.00 0.00 39.48 38.48 2wz1 n PHE 468 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 2wz1 s VAL 469 N -2.72 1.81 -0.15 -4.37 -7.23 -1.22 -4.53 120.40 101.99 2wz1 s VAL 469 Ca 0.18 -1.97 -0.03 0.00 -1.81 0.00 0.00 61.98 58.35 2wz1 s VAL 469 Cb 0.18 -1.87 0.05 0.00 0.56 0.00 0.00 36.38 35.30 2wz1 s VAL 469 CO 0.61 -0.36 0.05 -0.47 -0.31 0.00 0.00 175.10 174.62 2wz1 s TYR 470 N -2.20 0.59 0.09 2.82 5.04 0.11 -4.84 117.35 118.97 2wz1 s TYR 470 Ca 0.17 -0.43 -0.31 0.00 -2.44 0.00 0.00 57.07 54.05 2wz1 s TYR 470 Cb -0.05 -0.82 -0.07 0.00 0.35 0.00 0.00 41.96 41.37 2wz1 s TYR 470 CO 0.07 -0.48 1.32 0.21 -1.34 0.00 0.00 175.55 175.32 2wz1 s LYS 471 N 2.00 4.36 -0.14 4.97 2.20 -1.26 -0.70 119.74 131.18 2wz1 s LYS 471 Ca 0.02 1.96 -0.00 0.00 -0.36 0.00 0.00 55.97 57.58 2wz1 s LYS 471 Cb -0.15 -3.29 -0.01 0.00 -1.51 0.00 0.00 37.83 32.86 2wz1 s LYS 471 CO -0.07 -0.37 -0.12 0.08 -0.36 0.00 0.00 175.35 174.50 2wz1 s VAL 472 N 1.12 3.09 0.35 4.02 1.01 -0.87 -4.96 120.40 124.16 2wz1 s VAL 472 Ca 0.62 -0.64 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 2wz1 s VAL 472 Cb -0.34 -2.31 -0.11 0.00 0.00 0.00 0.00 36.38 33.62 2wz1 s VAL 472 CO 0.30 0.52 1.52 -0.62 0.00 0.00 0.00 175.10 176.82 2wz1 n GLU 473 N 3.61 2.67 -1.89 2.72 -0.58 -1.26 -4.22 120.64 121.70 2wz1 n GLU 473 Ca -0.18 0.94 0.00 0.00 -0.42 0.00 0.00 57.16 57.50 2wz1 n GLU 473 Cb 0.53 -2.69 0.00 0.00 -0.57 0.00 0.00 31.44 28.71 2wz1 n GLU 473 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 2wz1 n THR 474 N 1.01 0.00 -1.40 2.62 5.66 -1.26 -4.99 114.28 115.93 2wz1 n THR 474 Ca 0.04 0.00 -0.37 0.00 -3.05 0.00 0.00 64.05 60.67 2wz1 n THR 474 Cb 0.38 0.00 0.06 0.00 -1.55 0.00 0.00 70.33 69.23 2wz1 n THR 474 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 2wz1 n VAL 475 N 0.00 2.55 -0.37 1.08 0.24 -1.26 -4.89 118.33 115.67 2wz1 n VAL 475 Ca 0.00 -0.43 0.03 0.00 -2.04 0.00 0.00 64.34 61.90 2wz1 n VAL 475 Cb 0.00 -0.90 0.18 0.00 -1.47 0.00 0.00 33.84 31.65 2wz1 n VAL 475 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2wz1 h GLY 476 N -0.07 1.54 -0.39 7.63 0.00 -2.04 -2.62 103.07 107.13 2wz1 h GLY 476 Ca -0.47 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.39 2wz1 h GLY 476 CO 0.46 0.32 0.00 2.09 0.00 0.00 0.00 176.54 179.41 2wz1 n ASP 477 N -4.51 1.40 -4.57 0.19 5.75 -1.26 -4.85 116.55 108.70 2wz1 n ASP 477 Ca 0.16 -1.48 -0.24 0.00 -0.01 0.00 0.00 54.79 53.22 2wz1 n ASP 477 Cb 0.20 -0.01 -0.09 0.00 -1.03 0.00 0.00 41.12 40.19 2wz1 n ASP 477 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 2wz1 s LYS 478 N -1.98 2.01 -0.04 0.11 -0.14 -0.99 -4.41 119.74 114.30 2wz1 s LYS 478 Ca 0.38 -1.61 0.06 0.00 -1.36 0.00 0.00 55.97 53.44 2wz1 s LYS 478 Cb 0.21 -1.96 -0.01 0.00 -1.68 0.00 0.00 37.83 34.38 2wz1 s LYS 478 CO 0.33 0.32 -0.22 -0.47 -0.76 0.00 0.00 175.35 174.55 2wz1 s TYR 479 N -2.43 2.09 -0.01 3.18 6.14 -0.40 -4.66 117.35 121.27 2wz1 s TYR 479 Ca 0.31 -0.54 0.03 0.00 0.64 0.00 0.00 57.07 57.51 2wz1 s TYR 479 Cb -0.05 -1.37 -0.01 0.00 0.42 0.00 0.00 41.96 40.95 2wz1 s TYR 479 CO 0.18 -0.14 -0.09 1.41 0.64 0.00 0.00 175.55 177.55 2wz1 s MET 480 N -0.24 0.69 -0.02 4.97 -2.45 -1.26 -0.68 119.30 120.31 2wz1 s MET 480 Ca 0.01 -0.31 -0.12 0.00 -1.25 0.00 0.00 55.69 54.02 2wz1 s MET 480 Cb -0.11 -0.67 0.02 0.00 1.25 0.00 0.00 34.83 35.32 2wz1 s MET 480 CO 0.02 0.18 0.25 0.99 1.05 0.00 0.00 175.02 177.51 2wz1 s THR 481 N -0.21 0.06 0.17 10.11 2.01 -0.80 -2.05 115.64 124.94 2wz1 s THR 481 Ca 0.03 -0.46 0.04 0.00 0.31 0.00 0.00 61.69 61.62 2wz1 s THR 481 Cb -0.03 -0.52 -0.05 0.00 0.01 0.00 0.00 72.50 71.91 2wz1 s THR 481 CO -0.00 -0.25 -0.07 0.68 -0.69 0.00 0.00 174.62 174.29 2wz1 s VAL 482 N -1.09 1.10 -0.01 3.82 -7.23 0.12 -0.22 120.40 116.89 2wz1 s VAL 482 Ca -0.12 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.02 2wz1 s VAL 482 Cb -0.05 -2.02 -0.00 0.00 0.56 0.00 0.00 36.38 34.87 2wz1 s VAL 482 CO 0.03 -0.60 -0.06 -0.55 -0.31 0.00 0.00 175.10 173.61 2wz1 s SER 483 N -3.21 0.76 0.00 4.85 0.15 -0.42 0.09 113.70 115.92 2wz1 s SER 483 Ca 0.21 -0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.74 2wz1 s SER 483 Cb 0.04 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.21 2wz1 s SER 483 CO 0.03 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.14 2wz1 n GLY 484 N 3.11 0.80 3.23 9.45 0.00 -1.25 -1.30 105.19 119.23 2wz1 n GLY 484 Ca -0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.75 2wz1 n GLY 484 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2wz1 s LEU 485 N 0.00 0.94 0.15 0.99 0.05 -1.26 -3.59 118.68 115.95 2wz1 s LEU 485 Ca 0.00 -0.09 0.23 0.00 0.05 0.00 0.00 54.13 54.32 2wz1 s LEU 485 Cb 0.00 1.25 0.90 0.00 -2.05 0.00 0.00 46.19 46.30 2wz1 s LEU 485 CO 0.00 -0.53 1.72 -0.81 -0.55 0.00 0.00 176.35 176.18 2wz1 n PRO 486 N 0.91 0.14 -4.47 1.48 -0.04 -1.26 -4.72 135.00 127.04 2wz1 n PRO 486 Ca -0.20 0.26 -0.34 0.00 -0.04 0.00 0.00 63.50 63.17 2wz1 n PRO 486 Cb 0.58 -1.71 -0.11 0.00 -0.04 0.00 0.00 33.50 32.22 2wz1 n PRO 486 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2wz1 s GLU 487 N -3.14 3.03 0.77 0.54 0.41 -1.26 -5.11 118.70 113.94 2wz1 s GLU 487 Ca 0.08 -0.48 -0.13 0.00 -0.41 0.00 0.00 54.97 54.03 2wz1 s GLU 487 Cb 0.12 -2.74 0.06 0.00 -1.78 0.00 0.00 34.13 29.79 2wz1 s GLU 487 CO 0.45 0.60 1.17 -1.25 -0.49 0.00 0.00 175.26 175.74 2wz1 s PRO 488 N -0.62 1.97 -0.20 0.39 0.04 -1.24 -3.92 135.00 131.43 2wz1 s PRO 488 Ca 0.10 1.60 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 2wz1 s PRO 488 Cb -0.12 -1.83 0.10 0.00 0.04 0.00 0.00 34.50 32.69 2wz1 s PRO 488 CO 0.02 -1.93 0.33 0.00 0.04 0.00 0.00 177.00 175.46 2wz1 h ILE 490 N 6.23 0.52 -0.84 0.00 2.04 -1.96 -2.16 117.51 121.33 2wz1 h ILE 490 Ca -0.17 -0.07 -0.47 0.00 1.00 0.00 0.00 64.86 65.15 2wz1 h ILE 490 Cb 1.13 0.29 -0.26 0.00 -0.74 0.00 0.00 36.82 37.24 2wz1 h ILE 490 CO 0.20 0.04 0.47 1.41 0.00 0.00 0.00 178.15 180.27 2wz1 n HIS 491 N -4.42 2.63 -0.26 1.37 8.25 -1.26 -4.74 115.22 116.79 2wz1 n HIS 491 Ca 0.23 -1.98 0.00 0.00 -0.26 0.00 0.00 57.72 55.72 2wz1 n HIS 491 Cb 0.97 -0.90 0.13 0.00 1.12 0.00 0.00 29.99 31.31 2wz1 n HIS 491 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 2wz1 h HIS 492 N 1.18 0.77 -0.18 4.41 2.07 -1.72 -0.45 115.15 121.23 2wz1 h HIS 492 Ca 0.53 0.03 -0.12 0.00 -2.85 0.00 0.00 60.37 57.96 2wz1 h HIS 492 Cb 2.27 -0.23 0.00 0.00 2.57 0.00 0.00 27.41 32.01 2wz1 h HIS 492 CO 1.43 0.34 -0.37 0.00 -3.07 0.00 0.00 177.93 176.26 2wz1 h ALA 493 N 1.40 0.29 -0.81 6.11 0.00 -1.87 -2.48 119.26 121.89 2wz1 h ALA 493 Ca 0.35 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 2wz1 h ALA 493 Cb 0.26 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2wz1 h ALA 493 CO -0.21 0.36 0.33 -0.09 0.00 0.00 0.00 179.25 179.64 2wz1 h ARG 494 N 0.22 1.21 -0.26 0.00 2.43 -1.68 -1.52 114.38 114.78 2wz1 h ARG 494 Ca 0.00 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 58.95 2wz1 h ARG 494 Cb 0.97 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.31 2wz1 h ARG 494 CO 0.08 0.97 0.12 0.77 -1.51 0.00 0.00 179.97 180.40 2wz1 h SER 495 N 1.18 0.35 -0.43 -3.80 0.02 -0.98 -1.06 113.55 108.83 2wz1 h SER 495 Ca 0.27 -0.14 -0.12 0.00 -0.84 0.00 0.00 61.79 60.95 2wz1 h SER 495 Cb 0.21 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 2wz1 h SER 495 CO -0.02 0.39 -0.20 0.40 -1.14 0.00 0.00 176.83 176.26 2wz1 h ILE 496 N 0.28 1.27 -0.52 3.27 1.08 -1.32 -2.61 117.51 118.96 2wz1 h ILE 496 Ca 0.09 -1.35 -0.10 0.00 -0.39 0.00 0.00 64.86 63.11 2wz1 h ILE 496 Cb 0.15 1.13 -0.02 0.00 -3.07 0.00 0.00 36.82 35.00 2wz1 h ILE 496 CO -0.01 0.47 -0.05 0.00 -0.69 0.00 0.00 178.15 177.86 2wz1 h HIS 498 N 0.85 1.00 -0.46 0.00 3.86 -1.14 -2.01 115.15 117.24 2wz1 h HIS 498 Ca 0.15 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.35 2wz1 h HIS 498 Cb 0.57 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.69 2wz1 h HIS 498 CO 0.04 0.67 0.26 1.25 0.86 0.00 0.00 177.93 181.01 2wz1 h LEU 499 N 1.04 0.57 -0.61 2.43 5.85 -1.06 -1.90 115.31 121.63 2wz1 h LEU 499 Ca 0.27 -0.08 0.07 0.00 0.84 0.00 0.00 57.88 58.98 2wz1 h LEU 499 Cb -0.04 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 40.79 2wz1 h LEU 499 CO -0.05 0.48 0.30 0.00 -0.34 0.00 0.00 178.44 178.83 2wz1 h ALA 500 N 1.11 0.81 -0.76 1.25 0.00 -0.59 0.61 119.26 121.68 2wz1 h ALA 500 Ca 0.16 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.12 2wz1 h ALA 500 Cb 0.03 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2wz1 h ALA 500 CO -0.03 -0.06 0.48 -0.07 0.00 0.00 0.00 179.25 179.57 2wz1 h LEU 501 N 0.55 0.89 -0.91 0.00 3.38 -1.07 -1.13 115.31 117.02 2wz1 h LEU 501 Ca 0.28 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 2wz1 h LEU 501 Cb 0.24 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2wz1 h LEU 501 CO -0.22 0.67 -0.16 0.44 0.09 0.00 0.00 178.44 179.25 2wz1 h ASP 502 N 1.03 0.61 -0.60 -0.43 3.32 -0.66 -2.33 116.42 117.36 2wz1 h ASP 502 Ca 0.28 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 2wz1 h ASP 502 Cb -0.08 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 2wz1 h ASP 502 CO -0.06 0.79 0.13 0.24 -1.72 0.00 0.00 179.24 178.62 2wz1 h MET 503 N 0.55 0.97 -0.48 3.56 2.86 -0.52 -1.53 114.93 120.34 2wz1 h MET 503 Ca 0.09 -0.24 -0.06 0.00 -2.06 0.00 0.00 59.70 57.43 2wz1 h MET 503 Cb 0.60 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 2wz1 h MET 503 CO 0.04 0.90 0.04 0.52 1.06 0.00 0.00 176.91 179.47 2wz1 h MET 504 N 0.88 0.76 -0.42 1.72 2.86 -0.92 -0.93 114.93 118.88 2wz1 h MET 504 Ca 0.19 -0.18 -0.14 0.00 -2.06 0.00 0.00 59.70 57.50 2wz1 h MET 504 Cb 0.38 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.93 2wz1 h MET 504 CO 0.01 0.74 -0.30 1.49 1.06 0.00 0.00 176.91 179.91 2wz1 h GLU 505 N 0.72 0.92 -0.16 1.72 4.81 -1.20 -2.82 114.58 118.57 2wz1 h GLU 505 Ca 0.15 -0.43 -0.19 0.00 -0.13 0.00 0.00 59.36 58.76 2wz1 h GLU 505 Cb 0.38 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 2wz1 h GLU 505 CO 0.01 1.09 -0.66 0.97 -0.73 0.00 0.00 179.01 179.69 2wz1 h ILE 506 N 0.78 1.32 -0.84 2.32 6.09 -0.65 -3.00 117.51 123.52 2wz1 h ILE 506 Ca 0.08 -1.93 0.06 0.00 -1.37 0.00 0.00 64.86 61.71 2wz1 h ILE 506 Cb 0.87 1.90 -0.05 0.00 0.47 0.00 0.00 36.82 40.01 2wz1 h ILE 506 CO 0.08 0.60 0.55 0.00 -3.07 0.00 0.00 178.15 176.31 2wz1 h ALA 507 N 0.81 1.58 -0.04 0.18 0.00 -1.12 -1.65 119.26 119.02 2wz1 h ALA 507 Ca -0.02 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2wz1 h ALA 507 Cb 1.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.79 2wz1 h ALA 507 CO 0.13 0.30 0.06 0.78 0.00 0.00 0.00 179.25 180.52 2wz1 h GLY 508 N 0.94 0.00 1.32 0.00 0.00 -1.35 -2.92 103.07 101.06 2wz1 h GLY 508 Ca 0.36 0.00 -0.25 0.00 0.00 0.00 0.00 47.33 47.44 2wz1 h GLY 508 CO -0.13 0.00 -1.43 1.46 0.00 0.00 0.00 176.54 176.44 2wz1 h GLN 509 N 0.00 0.00 -6.78 4.80 4.20 -1.39 -3.44 115.11 112.50 2wz1 h GLN 509 Ca 0.02 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.21 2wz1 h GLN 509 Cb 0.14 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.96 2wz1 h GLN 509 CO -0.00 0.62 0.57 0.08 -0.67 0.00 0.00 178.83 179.43 2wz1 s VAL 510 N -2.67 3.22 0.04 -0.54 1.01 -1.10 -5.00 120.40 115.36 2wz1 s VAL 510 Ca -0.02 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.12 2wz1 s VAL 510 Cb 0.09 -3.73 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 2wz1 s VAL 510 CO 0.82 0.24 -0.08 -1.10 0.00 0.00 0.00 175.10 174.97 2wz1 s GLN 511 N -1.10 0.56 -0.04 2.72 -0.21 -1.26 -3.33 119.66 117.00 2wz1 s GLN 511 Ca 0.49 -0.73 -0.02 0.00 0.02 0.00 0.00 55.36 55.13 2wz1 s GLN 511 Cb -0.35 -0.38 0.03 0.00 1.00 0.00 0.00 33.01 33.30 2wz1 s GLN 511 CO 0.43 0.08 0.08 0.54 -2.12 0.00 0.00 175.29 174.30 2wz1 s VAL 512 N -1.24 -0.04 -0.91 1.09 0.11 -0.82 -4.78 120.40 113.82 2wz1 s VAL 512 Ca -0.08 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.11 2wz1 s VAL 512 Cb -0.09 -0.15 0.00 0.00 -1.53 0.00 0.00 36.38 34.61 2wz1 s VAL 512 CO 0.01 0.06 0.00 0.47 -3.33 0.00 0.00 175.10 172.30 2wz1 n ASP 513 N 3.83 -2.86 0.00 3.54 8.00 -1.26 0.22 116.55 128.03 2wz1 n ASP 513 Ca -0.22 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.52 2wz1 n ASP 513 Cb 0.54 -2.63 0.00 0.00 -0.02 0.00 0.00 41.12 39.01 2wz1 n ASP 513 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wz1 n GLY 514 N -0.45 0.75 3.66 0.44 0.00 -1.26 -5.04 105.19 103.29 2wz1 n GLY 514 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.56 2wz1 n GLY 514 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wz1 s GLU 515 N -0.26 4.06 0.67 1.61 1.03 0.13 -5.07 118.70 120.86 2wz1 s GLU 515 Ca 0.00 -0.29 -0.16 0.00 0.03 0.00 0.00 54.97 54.55 2wz1 s GLU 515 Cb 0.00 -3.40 0.00 0.00 -0.80 0.00 0.00 34.13 29.94 2wz1 s GLU 515 CO 0.00 0.18 1.18 -1.12 -1.33 0.00 0.00 175.26 174.17 2wz1 s SER 516 N 0.68 4.76 -0.04 0.83 0.01 -1.26 -1.94 113.70 116.73 2wz1 s SER 516 Ca 0.06 2.28 0.06 0.00 1.31 0.00 0.00 55.95 59.66 2wz1 s SER 516 Cb -0.12 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.50 2wz1 s SER 516 CO 0.01 -1.88 -0.21 0.54 0.41 0.00 0.00 173.24 172.11 2wz1 s VAL 517 N -1.94 2.46 0.20 3.43 0.11 -1.21 -4.92 120.40 118.53 2wz1 s VAL 517 Ca 0.73 -0.95 0.10 0.00 -2.93 0.00 0.00 61.98 58.94 2wz1 s VAL 517 Cb -0.27 -1.91 -0.04 0.00 -1.53 0.00 0.00 36.38 32.62 2wz1 s VAL 517 CO 0.40 0.58 -0.17 0.00 -3.33 0.00 0.00 175.10 172.58 2wz1 s GLN 518 N -0.54 1.78 0.17 1.54 -2.07 -1.26 -4.24 119.66 115.03 2wz1 s GLN 518 Ca 0.07 -1.46 0.05 0.00 -1.82 0.00 0.00 55.36 52.20 2wz1 s GLN 518 Cb -0.11 -1.96 -0.05 0.00 -1.09 0.00 0.00 33.01 29.80 2wz1 s GLN 518 CO 0.01 0.40 -0.10 0.96 -1.32 0.00 0.00 175.29 175.23 2wz1 s ILE 519 N -1.83 1.28 -0.04 3.63 -4.36 -1.26 -1.13 121.20 117.48 2wz1 s ILE 519 Ca 0.24 -2.09 0.04 0.00 -0.26 0.00 0.00 60.65 58.58 2wz1 s ILE 519 Cb -0.08 -1.93 -0.00 0.00 1.25 0.00 0.00 42.46 41.70 2wz1 s ILE 519 CO 0.13 -0.68 -0.18 -0.89 0.24 0.00 0.00 174.94 173.56 2wz1 s THR 520 N -3.26 1.48 -0.00 8.37 2.01 -0.31 -2.70 115.64 121.23 2wz1 s THR 520 Ca 0.19 -0.74 0.08 0.00 0.31 0.00 0.00 61.69 61.52 2wz1 s THR 520 Cb 0.02 -1.27 -0.02 0.00 0.01 0.00 0.00 72.50 71.24 2wz1 s THR 520 CO 0.03 0.42 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.50 2wz1 s ILE 521 N 0.02 1.94 -0.05 1.82 1.01 -0.67 -0.76 121.20 124.51 2wz1 s ILE 521 Ca -0.04 -1.11 0.05 0.00 0.00 0.00 0.00 60.65 59.56 2wz1 s ILE 521 Cb -0.12 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.72 2wz1 s ILE 521 CO 0.02 0.49 -0.23 -0.83 0.00 0.00 0.00 174.94 174.40 2wz1 s GLY 522 N -0.72 1.18 -0.04 6.18 0.00 0.07 -0.71 107.32 113.27 2wz1 s GLY 522 Ca 0.10 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 43.90 2wz1 s GLY 522 CO -0.00 -0.54 -0.09 -0.42 0.00 0.00 0.00 173.10 172.04 2wz1 s ILE 523 N -0.08 0.83 0.10 0.90 1.01 0.45 -1.43 121.20 122.98 2wz1 s ILE 523 Ca -0.04 -0.33 -0.09 0.00 0.00 0.00 0.00 60.65 60.18 2wz1 s ILE 523 Cb -0.13 -0.77 0.00 0.00 0.01 0.00 0.00 42.46 41.57 2wz1 s ILE 523 CO 0.03 0.27 0.22 -2.28 0.00 0.00 0.00 174.94 173.19 2wz1 s HIS 524 N 0.53 0.14 -0.01 3.97 2.46 -0.84 -1.12 115.29 120.42 2wz1 s HIS 524 Ca -0.09 -0.56 0.04 0.00 0.47 0.00 0.00 55.06 54.92 2wz1 s HIS 524 Cb -0.13 -0.03 -0.01 0.00 -0.13 0.00 0.00 32.58 32.29 2wz1 s HIS 524 CO 0.01 -0.58 -0.12 0.99 -2.47 0.00 0.00 174.74 172.57 2wz1 s THR 525 N -3.87 0.97 -1.62 0.89 2.01 -1.26 -0.74 115.64 112.02 2wz1 s THR 525 Ca 0.06 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 61.50 2wz1 s THR 525 Cb 0.04 -0.81 0.00 0.00 0.01 0.00 0.00 72.50 71.74 2wz1 s THR 525 CO -0.10 0.25 0.00 0.61 -0.69 0.00 0.00 174.62 174.69 2wz1 n GLY 526 N 2.71 -0.65 3.90 4.40 0.00 0.09 -4.72 105.19 110.92 2wz1 n GLY 526 Ca -0.14 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 2wz1 n GLY 526 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2wz1 s GLU 527 N -0.65 3.32 0.00 1.61 -1.05 -1.26 -1.80 118.70 118.87 2wz1 s GLU 527 Ca 0.00 -0.58 -0.01 0.00 -0.15 0.00 0.00 54.97 54.23 2wz1 s GLU 527 Cb 0.00 -2.93 -0.01 0.00 -0.44 0.00 0.00 34.13 30.75 2wz1 s GLU 527 CO 0.00 0.56 0.01 0.14 0.95 0.00 0.00 175.26 176.91 2wz1 s VAL 528 N -1.62 0.04 -0.11 1.83 -7.23 -0.17 -4.21 120.40 108.93 2wz1 s VAL 528 Ca 0.34 -0.31 -0.05 0.00 -1.81 0.00 0.00 61.98 60.15 2wz1 s VAL 528 Cb -0.12 -0.12 -0.04 0.00 0.56 0.00 0.00 36.38 36.67 2wz1 s VAL 528 CO 0.27 -0.17 0.08 -0.69 -0.31 0.00 0.00 175.10 174.28 2wz1 s VAL 529 N -0.50 4.98 0.13 1.32 1.01 -0.89 -0.59 120.40 125.86 2wz1 s VAL 529 Ca -0.06 0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.01 2wz1 s VAL 529 Cb -0.03 -3.14 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 2wz1 s VAL 529 CO -0.00 0.61 -0.18 0.42 0.00 0.00 0.00 175.10 175.95 2wz1 s THR 530 N -0.96 1.67 -0.05 3.92 -4.23 0.24 -0.28 115.64 115.95 2wz1 s THR 530 Ca 0.14 -1.71 -0.31 0.00 -1.18 0.00 0.00 61.69 58.63 2wz1 s THR 530 Cb -0.12 -1.65 0.11 0.00 1.34 0.00 0.00 72.50 72.19 2wz1 s THR 530 CO 0.03 -0.23 1.08 -0.83 -0.54 0.00 0.00 174.62 174.14 2wz1 s GLY 531 N -2.29 -0.36 -0.35 3.99 0.00 -0.62 -1.30 107.32 106.38 2wz1 s GLY 531 Ca 0.10 1.02 -0.13 0.00 0.00 0.00 0.00 44.72 45.71 2wz1 s GLY 531 CO 0.05 0.31 0.25 0.14 0.00 0.00 0.00 173.10 173.86 2wz1 s VAL 532 N -2.78 5.28 -0.13 1.40 1.01 -1.26 -0.79 120.40 123.12 2wz1 s VAL 532 Ca 0.09 -0.30 -0.04 0.00 0.00 0.00 0.00 61.98 61.73 2wz1 s VAL 532 Cb -0.00 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 2wz1 s VAL 532 CO -0.05 -0.07 0.01 -0.63 0.00 0.00 0.00 175.10 174.37 2wz1 s ILE 533 N 1.71 4.38 0.00 2.22 -1.09 -0.28 -4.84 121.20 123.30 2wz1 s ILE 533 Ca 0.06 -0.20 0.00 0.00 -2.23 0.00 0.00 60.65 58.28 2wz1 s ILE 533 Cb -0.18 -2.90 0.00 0.00 -1.58 0.00 0.00 42.46 37.80 2wz1 s ILE 533 CO 0.10 0.53 0.00 0.61 -1.23 0.00 0.00 174.94 174.96 2wz1 n GLY 534 N 2.92 2.60 0.11 6.18 0.00 -1.26 -1.47 105.19 114.27 2wz1 n GLY 534 Ca -0.18 -1.56 -0.14 0.00 0.00 0.00 0.00 46.02 44.14 2wz1 n GLY 534 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2wz1 n GLN 535 N 1.31 0.68 -0.08 1.61 3.00 -1.26 -4.06 117.38 118.58 2wz1 n GLN 535 Ca 0.00 0.16 -0.13 0.00 -0.01 0.00 0.00 57.00 57.02 2wz1 n GLN 535 Cb 0.00 -1.63 -0.08 0.00 0.00 0.00 0.00 30.24 28.53 2wz1 n GLN 535 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2wz1 h ARG 536 N 0.02 0.00 -2.37 -1.09 2.43 -2.05 -3.42 114.38 107.91 2wz1 h ARG 536 Ca -0.47 0.00 -0.60 0.00 -0.81 0.00 0.00 59.98 58.10 2wz1 h ARG 536 Cb 2.06 0.00 -0.42 0.00 -0.42 0.00 0.00 29.97 31.19 2wz1 h ARG 536 CO 0.02 0.64 -0.61 -0.12 -1.51 0.00 0.00 179.97 178.40 2wz1 n MET 537 N -4.56 2.32 -1.79 0.20 0.00 -1.26 -5.10 117.12 106.93 2wz1 n MET 537 Ca -0.17 -4.58 -0.40 0.00 0.00 0.00 0.00 57.70 52.54 2wz1 n MET 537 Cb 0.45 -2.23 0.01 0.00 0.00 0.00 0.00 33.22 31.45 2wz1 n MET 537 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 175.97 173.83 2wz1 s PRO 538 N -2.22 3.86 -0.02 2.12 0.02 -1.26 -4.80 135.00 132.70 2wz1 s PRO 538 Ca 0.37 2.50 -0.00 0.00 0.02 0.00 0.00 61.00 63.88 2wz1 s PRO 538 Cb 0.11 -2.79 0.02 0.00 0.02 0.00 0.00 34.50 31.86 2wz1 s PRO 538 CO -0.05 -0.70 0.03 0.50 -0.33 0.00 0.00 177.00 176.45 2wz1 s ARG 539 N -2.30 -0.00 -0.35 5.54 3.52 -0.54 -4.95 118.95 119.86 2wz1 s ARG 539 Ca 0.57 0.13 -0.25 0.00 -0.13 0.00 0.00 55.73 56.06 2wz1 s ARG 539 Cb -0.45 -0.13 0.01 0.00 -1.56 0.00 0.00 34.95 32.82 2wz1 s ARG 539 CO 0.60 -0.10 0.89 -0.47 -0.81 0.00 0.00 175.30 175.40 2wz1 s TYR 540 N 0.63 3.12 0.07 5.12 5.04 -1.26 -1.13 117.35 128.94 2wz1 s TYR 540 Ca -0.05 0.78 0.09 0.00 -2.44 0.00 0.00 57.07 55.45 2wz1 s TYR 540 Cb -0.07 -3.51 -0.03 0.00 0.35 0.00 0.00 41.96 38.69 2wz1 s TYR 540 CO -0.02 -0.75 -0.24 0.00 -1.34 0.00 0.00 175.55 173.20 2wz1 s LEU 542 N -1.53 2.99 0.20 0.00 1.02 -1.26 -1.59 118.68 118.50 2wz1 s LEU 542 Ca 0.10 -0.16 0.07 0.00 0.02 0.00 0.00 54.13 54.16 2wz1 s LEU 542 Cb -0.10 -1.66 -0.05 0.00 0.02 0.00 0.00 46.19 44.40 2wz1 s LEU 542 CO 0.03 0.26 -0.13 -0.36 0.02 0.00 0.00 176.35 176.17 2wz1 s PHE 543 N -0.22 1.64 0.00 0.29 0.40 0.61 -4.99 117.98 115.72 2wz1 s PHE 543 Ca 0.02 -0.61 0.00 0.00 -0.60 0.00 0.00 56.93 55.74 2wz1 s PHE 543 Cb -0.13 -0.78 0.00 0.00 0.51 0.00 0.00 43.02 42.62 2wz1 s PHE 543 CO 0.03 0.30 0.00 0.41 0.70 0.00 0.00 175.22 176.66 2wz1 n GLY 544 N -0.36 2.26 0.27 4.36 0.00 -1.26 -2.10 105.19 108.36 2wz1 n GLY 544 Ca -0.08 -2.17 0.09 0.00 0.00 0.00 0.00 46.02 43.86 2wz1 n GLY 544 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2wz1 h ASN 545 N 0.00 0.04 -0.69 1.61 -1.24 -2.00 -1.82 115.58 111.49 2wz1 h ASN 545 Ca 0.00 -0.00 -0.03 0.00 0.71 0.00 0.00 56.30 56.98 2wz1 h ASN 545 Cb 0.00 -0.01 -0.03 0.00 0.73 0.00 0.00 38.32 39.01 2wz1 h ASN 545 CO 0.00 0.03 0.30 0.74 -1.29 0.00 0.00 177.43 177.21 2wz1 h THR 546 N 0.05 1.24 -0.22 -3.57 2.02 -1.88 0.21 112.91 110.75 2wz1 h THR 546 Ca 0.03 -0.71 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 2wz1 h THR 546 Cb 0.07 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 2wz1 h THR 546 CO -0.00 0.29 0.11 0.58 0.37 0.00 0.00 175.52 176.86 2wz1 h VAL 547 N 0.97 1.13 -0.63 3.16 2.07 -1.62 -1.51 116.25 119.83 2wz1 h VAL 547 Ca 0.23 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 2wz1 h VAL 547 Cb 0.17 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 2wz1 h VAL 547 CO -0.02 0.13 0.11 0.78 0.02 0.00 0.00 177.57 178.59 2wz1 h ASN 548 N 0.23 0.99 0.43 0.57 2.35 -1.12 -1.81 115.58 117.21 2wz1 h ASN 548 Ca 0.08 -0.25 -0.08 0.00 -0.55 0.00 0.00 56.30 55.50 2wz1 h ASN 548 Cb 0.11 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 2wz1 h ASN 548 CO -0.01 0.99 -0.36 -0.07 -1.65 0.00 0.00 177.43 176.32 2wz1 h LEU 549 N 0.94 0.00 -0.43 1.61 3.38 -0.52 -0.70 115.31 119.59 2wz1 h LEU 549 Ca 0.19 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.04 2wz1 h LEU 549 Cb 0.41 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2wz1 h LEU 549 CO 0.01 0.36 -0.19 0.74 0.09 0.00 0.00 178.44 179.45 2wz1 h THR 550 N 0.00 1.28 -0.63 0.22 2.02 -0.73 0.10 112.91 115.17 2wz1 h THR 550 Ca -0.00 -1.34 -0.02 0.00 0.77 0.00 0.00 66.41 65.82 2wz1 h THR 550 Cb 0.68 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 68.28 2wz1 h THR 550 CO 0.05 0.45 0.30 -1.28 0.37 0.00 0.00 175.52 175.42 2wz1 h SER 551 N 0.71 0.82 -0.20 4.18 0.87 -1.04 -2.02 113.55 116.87 2wz1 h SER 551 Ca 0.10 -0.13 -0.07 0.00 -1.23 0.00 0.00 61.79 60.46 2wz1 h SER 551 Cb 0.76 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 62.49 2wz1 h SER 551 CO 0.06 0.72 -0.08 0.03 -0.53 0.00 0.00 176.83 177.03 2wz1 h ARG 552 N 0.86 0.55 -0.59 2.24 3.08 -0.91 -0.10 114.38 119.51 2wz1 h ARG 552 Ca 0.22 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 2wz1 h ARG 552 Cb 0.11 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 2wz1 h ARG 552 CO -0.03 0.63 0.34 1.15 -1.07 0.00 0.00 179.97 180.99 2wz1 h THR 553 N 0.51 1.17 0.04 2.04 2.02 -0.47 -0.21 112.91 118.01 2wz1 h THR 553 Ca 0.10 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 2wz1 h THR 553 Cb 0.45 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2wz1 h THR 553 CO 0.02 0.19 -0.02 -0.08 0.37 0.00 0.00 175.52 176.00 2wz1 h GLU 554 N 0.82 -0.05 -0.01 6.66 4.22 -0.75 -2.74 114.58 122.74 2wz1 h GLU 554 Ca 0.21 0.00 -0.13 0.00 0.08 0.00 0.00 59.36 59.53 2wz1 h GLU 554 Cb -0.01 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2wz1 h GLU 554 CO -0.04 0.47 -0.59 1.79 -2.18 0.00 0.00 179.01 178.46 2wz1 h THR 555 N -0.59 1.42 -0.01 0.32 1.35 -0.81 -1.78 112.91 112.81 2wz1 h THR 555 Ca -0.00 -2.02 0.00 0.00 -0.55 0.00 0.00 66.41 63.84 2wz1 h THR 555 Cb 0.54 2.08 0.00 0.00 -1.73 0.00 0.00 68.15 69.04 2wz1 h THR 555 CO 0.01 0.58 0.00 0.35 -0.25 0.00 0.00 175.52 176.21 2wz1 n THR 556 N -3.84 0.00 -2.10 6.82 -2.24 -0.11 -4.98 114.28 107.83 2wz1 n THR 556 Ca -0.01 -0.19 -0.35 0.00 -2.27 0.00 0.00 64.05 61.23 2wz1 n THR 556 Cb 0.60 0.25 0.02 0.00 -2.10 0.00 0.00 70.33 69.09 2wz1 n THR 556 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2wz1 s GLY 557 N -1.99 2.54 0.17 3.38 0.00 -0.67 -4.97 107.32 105.77 2wz1 s GLY 557 Ca 0.40 0.79 -0.31 0.00 0.00 0.00 0.00 44.72 45.61 2wz1 s GLY 557 CO 0.34 1.15 1.38 1.85 0.00 0.00 0.00 173.10 177.82 2wz1 s GLU 558 N -3.48 4.33 0.35 2.90 2.12 -1.26 -4.93 118.70 118.73 2wz1 s GLU 558 Ca 0.72 2.11 -0.29 0.00 0.36 0.00 0.00 54.97 57.88 2wz1 s GLU 558 Cb -0.24 -3.20 -0.11 0.00 0.26 0.00 0.00 34.13 30.83 2wz1 s GLU 558 CO 0.31 -0.38 1.54 0.15 -0.54 0.00 0.00 175.26 176.34 2wz1 s LYS 559 N 0.48 4.10 0.00 4.30 1.02 -1.26 -2.51 119.74 125.87 2wz1 s LYS 559 Ca 0.61 2.60 0.00 0.00 0.02 0.00 0.00 55.97 59.20 2wz1 s LYS 559 Cb -0.38 -2.98 0.00 0.00 -0.52 0.00 0.00 37.83 33.95 2wz1 s LYS 559 CO 0.35 -0.59 0.00 0.41 -0.92 0.00 0.00 175.35 174.60 2wz1 n GLY 560 N 1.12 0.83 3.69 -3.33 0.00 -1.10 -5.01 105.19 101.39 2wz1 n GLY 560 Ca 0.04 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.83 2wz1 n GLY 560 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wz1 s LYS 561 N -0.08 2.31 -0.40 1.61 -0.14 -1.04 -4.83 119.74 117.17 2wz1 s LYS 561 Ca 0.00 -1.52 -0.17 0.00 -1.36 0.00 0.00 55.97 52.92 2wz1 s LYS 561 Cb 0.00 -2.14 0.01 0.00 -1.68 0.00 0.00 37.83 34.02 2wz1 s LYS 561 CO 0.00 0.21 0.41 0.42 -0.76 0.00 0.00 175.35 175.63 2wz1 s ILE 562 N -2.40 5.11 -0.34 2.17 1.01 -1.26 -1.68 121.20 123.82 2wz1 s ILE 562 Ca 0.35 -0.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.62 2wz1 s ILE 562 Cb -0.04 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.44 2wz1 s ILE 562 CO 0.21 -0.33 0.23 0.20 0.00 0.00 0.00 174.94 175.25 2wz1 s ASN 563 N 1.78 5.99 -0.19 3.58 0.01 0.11 -1.32 114.94 124.90 2wz1 s ASN 563 Ca 0.12 -0.46 -0.03 0.00 -0.71 0.00 0.00 52.86 51.78 2wz1 s ASN 563 Cb -0.17 -2.12 -0.01 0.00 0.41 0.00 0.00 41.25 39.36 2wz1 s ASN 563 CO 0.13 -0.24 -0.07 -0.69 -1.51 0.00 0.00 177.10 174.72 2wz1 s VAL 564 N 1.70 3.29 0.85 1.60 1.01 0.56 -0.41 120.40 129.01 2wz1 s VAL 564 Ca 0.06 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 2wz1 s VAL 564 Cb -0.17 -2.46 0.10 0.00 0.00 0.00 0.00 36.38 33.84 2wz1 s VAL 564 CO 0.10 0.46 1.09 -0.94 0.00 0.00 0.00 175.10 175.81 2wz1 s SER 565 N 1.11 3.89 0.53 3.32 1.04 -0.28 -0.90 113.70 122.41 2wz1 s SER 565 Ca 0.01 1.51 0.26 0.00 0.48 0.00 0.00 55.95 58.21 2wz1 s SER 565 Cb -0.15 -2.21 1.46 0.00 0.10 0.00 0.00 66.02 65.23 2wz1 s SER 565 CO -0.01 -2.38 2.09 1.05 0.98 0.00 0.00 173.24 174.98 2wz1 h GLU 566 N -1.37 0.00 -0.14 4.02 4.11 -1.46 0.53 114.58 120.27 2wz1 h GLU 566 Ca -0.48 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 58.79 2wz1 h GLU 566 Cb 1.27 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.53 2wz1 h GLU 566 CO 0.55 0.11 -0.54 1.88 0.07 0.00 0.00 179.01 181.08 2wz1 h TYR 567 N 0.00 0.81 -0.60 2.06 -1.99 -1.89 -0.94 116.97 114.41 2wz1 h TYR 567 Ca -0.00 -0.34 -0.09 0.00 2.00 0.00 0.00 58.73 60.30 2wz1 h TYR 567 Cb 0.28 -0.13 -0.02 0.00 2.00 0.00 0.00 36.73 38.85 2wz1 h TYR 567 CO 0.00 1.13 0.03 1.15 -0.00 0.00 0.00 178.16 180.46 2wz1 h THR 568 N 0.26 1.26 -0.82 -2.88 2.02 -1.74 -3.16 112.91 107.85 2wz1 h THR 568 Ca -0.03 -1.11 0.03 0.00 0.77 0.00 0.00 66.41 66.08 2wz1 h THR 568 Cb 1.17 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 68.33 2wz1 h THR 568 CO 0.11 0.40 0.53 0.22 0.37 0.00 0.00 175.52 177.15 2wz1 h TYR 569 N 0.93 0.99 -0.85 3.16 3.20 -0.79 -1.17 116.97 122.45 2wz1 h TYR 569 Ca 0.17 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 2wz1 h TYR 569 Cb 0.52 -0.33 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 2wz1 h TYR 569 CO 0.04 0.57 0.49 0.00 -1.64 0.00 0.00 178.16 177.61 2wz1 h ARG 570 N 1.02 1.16 -0.58 1.82 3.08 -1.17 -1.32 114.38 118.39 2wz1 h ARG 570 Ca 0.33 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.27 2wz1 h ARG 570 Cb 0.02 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 29.80 2wz1 h ARG 570 CO -0.12 0.83 0.37 0.00 -1.07 0.00 0.00 179.97 179.99 2wz1 h LEU 572 N 0.79 0.00 -1.40 0.00 3.38 -0.15 -1.33 115.31 116.61 2wz1 h LEU 572 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2wz1 h LEU 572 Cb -0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2wz1 h LEU 572 CO -0.04 0.00 0.00 0.23 0.09 0.00 0.00 178.44 178.72 2wz1 n MET 573 N -3.09 1.94 -3.91 1.13 2.81 -0.80 -3.39 117.12 111.80 2wz1 n MET 573 Ca -0.02 -1.39 -0.29 0.00 -1.81 0.00 0.00 57.70 54.20 2wz1 n MET 573 Cb 0.16 -1.45 -0.04 0.00 -0.71 0.00 0.00 33.22 31.18 2wz1 n MET 573 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 2wz1 s SER 574 N -1.78 6.36 0.50 7.83 1.04 -0.50 -4.95 113.70 122.20 2wz1 s SER 574 Ca 0.34 0.24 0.23 0.00 0.48 0.00 0.00 55.95 57.25 2wz1 s SER 574 Cb 0.20 -1.95 1.34 0.00 0.10 0.00 0.00 66.02 65.71 2wz1 s SER 574 CO 0.30 0.10 2.07 -0.65 0.98 0.00 0.00 173.24 176.05 2wz1 h PRO 575 N 2.60 0.00 0.00 4.02 0.11 -1.90 -0.64 132.00 136.19 2wz1 h PRO 575 Ca -0.47 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 2wz1 h PRO 575 Cb 1.18 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.29 2wz1 h PRO 575 CO 0.72 0.12 -0.06 0.93 -0.21 0.00 0.00 178.00 179.50 2wz1 h GLU 576 N 0.00 0.00 0.00 1.05 3.07 -1.92 -3.30 114.58 113.48 2wz1 h GLU 576 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2wz1 h GLU 576 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 2wz1 h GLU 576 CO 0.02 0.06 0.00 0.09 -1.40 0.00 0.00 179.01 177.78 2wz1 n ASN 577 N -3.40 0.56 -4.81 1.42 3.02 -0.74 -4.43 115.26 106.88 2wz1 n ASN 577 Ca -0.02 -1.07 -0.33 0.00 -0.03 0.00 0.00 54.58 53.13 2wz1 n ASN 577 Cb 0.21 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.37 2wz1 n ASN 577 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2wz1 s SER 578 N -0.07 6.10 -0.18 6.41 1.04 -0.32 -4.18 113.70 122.50 2wz1 s SER 578 Ca 0.00 1.80 -0.11 0.00 0.48 0.00 0.00 55.95 58.12 2wz1 s SER 578 Cb 0.00 -2.54 0.06 0.00 0.10 0.00 0.00 66.02 63.64 2wz1 s SER 578 CO 0.00 -0.95 0.44 -0.62 0.98 0.00 0.00 173.24 173.09 2wz1 s ASP 579 N -2.61 -0.53 0.60 7.02 -1.08 -1.26 -5.01 116.67 113.78 2wz1 s ASP 579 Ca 0.64 0.94 0.37 0.00 -0.52 0.00 0.00 52.55 53.98 2wz1 s ASP 579 Cb -0.15 0.85 1.81 0.00 -1.46 0.00 0.00 42.92 43.97 2wz1 s ASP 579 CO 0.31 -0.19 2.15 1.55 0.52 0.00 0.00 175.17 179.52 2wz1 h PRO 580 N 6.66 0.00 0.00 4.34 0.13 -1.99 -1.87 132.00 139.27 2wz1 h PRO 580 Ca -0.34 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.79 2wz1 h PRO 580 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2wz1 h PRO 580 CO 0.27 0.02 -0.02 1.96 -0.23 0.00 0.00 178.00 179.99 2wz1 h GLN 581 N 0.00 0.00 -5.99 0.86 4.20 -1.96 -3.44 115.11 108.78 2wz1 h GLN 581 Ca -0.00 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.12 2wz1 h GLN 581 Cb 0.29 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.98 2wz1 h GLN 581 CO 0.00 0.02 0.57 -0.06 -0.67 0.00 0.00 178.83 178.70 2wz1 s PHE 582 N -4.11 3.17 -0.26 2.96 0.08 -0.70 -0.49 117.98 118.62 2wz1 s PHE 582 Ca -0.03 0.93 -0.11 0.00 0.12 0.00 0.00 56.93 57.84 2wz1 s PHE 582 Cb 0.12 -3.43 -0.05 0.00 -0.57 0.00 0.00 43.02 39.09 2wz1 s PHE 582 CO 0.49 -0.67 0.19 -1.58 -0.10 0.00 0.00 175.22 173.55 2wz1 s HIS 583 N 3.26 3.26 -0.12 0.36 5.65 -0.22 -4.80 115.29 122.67 2wz1 s HIS 583 Ca 0.37 0.18 0.03 0.00 0.25 0.00 0.00 55.06 55.89 2wz1 s HIS 583 Cb -0.13 -2.35 0.01 0.00 -1.18 0.00 0.00 32.58 28.93 2wz1 s HIS 583 CO 0.14 -0.08 -0.20 -0.51 -0.65 0.00 0.00 174.74 173.44 2wz1 s LEU 584 N 1.52 1.99 -0.15 8.88 1.43 -1.26 -0.91 118.68 130.19 2wz1 s LEU 584 Ca 0.08 -0.54 0.01 0.00 -1.03 0.00 0.00 54.13 52.65 2wz1 s LEU 584 Cb -0.15 -1.32 -0.00 0.00 0.03 0.00 0.00 46.19 44.75 2wz1 s LEU 584 CO 0.09 0.08 -0.17 -0.70 0.23 0.00 0.00 176.35 175.88 2wz1 s GLU 585 N 0.76 3.19 0.06 1.70 2.12 -0.05 -4.93 118.70 121.54 2wz1 s GLU 585 Ca -0.10 -0.77 -0.31 0.00 0.36 0.00 0.00 54.97 54.16 2wz1 s GLU 585 Cb -0.16 -2.57 -0.06 0.00 0.26 0.00 0.00 34.13 31.60 2wz1 s GLU 585 CO 0.01 0.04 1.29 -1.58 -0.54 0.00 0.00 175.26 174.48 2wz1 s HIS 586 N 0.74 3.27 -0.16 5.30 5.65 -1.26 0.19 115.29 129.01 2wz1 s HIS 586 Ca -0.07 1.10 -0.14 0.00 0.25 0.00 0.00 55.06 56.20 2wz1 s HIS 586 Cb -0.16 -3.55 -0.10 0.00 -1.18 0.00 0.00 32.58 27.60 2wz1 s HIS 586 CO 0.01 -1.83 0.05 -0.09 -0.65 0.00 0.00 174.74 172.23 2wz1 h ARG 587 N 7.01 0.00 0.00 2.88 2.43 -1.38 -3.46 114.38 121.85 2wz1 h ARG 587 Ca -0.41 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.76 2wz1 h ARG 587 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 2wz1 h ARG 587 CO 0.85 0.43 0.00 0.41 -1.51 0.00 0.00 179.97 180.15 2wz1 n GLY 588 N 1.57 0.99 3.66 2.80 0.00 -1.15 -5.00 105.19 108.06 2wz1 n GLY 588 Ca -0.15 -1.98 -0.43 0.00 0.00 0.00 0.00 46.02 43.46 2wz1 n GLY 588 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2wz1 s PRO 589 N -1.18 4.24 -0.19 1.61 0.04 -1.26 -2.03 135.00 136.24 2wz1 s PRO 589 Ca 0.00 1.71 -0.04 0.00 0.04 0.00 0.00 61.00 62.71 2wz1 s PRO 589 Cb 0.00 -3.75 -0.02 0.00 0.04 0.00 0.00 34.50 30.77 2wz1 s PRO 589 CO 0.00 -0.68 -0.02 0.08 0.04 0.00 0.00 177.00 176.42 2wz1 s VAL 590 N 3.35 3.86 0.03 -0.36 1.01 0.52 -4.90 120.40 123.91 2wz1 s VAL 590 Ca 0.56 -0.35 -0.30 0.00 0.00 0.00 0.00 61.98 61.89 2wz1 s VAL 590 Cb -0.23 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2wz1 s VAL 590 CO 0.17 0.44 1.12 -0.44 0.00 0.00 0.00 175.10 176.39 2wz1 s SER 591 N 0.89 7.18 -0.03 3.32 0.01 -1.26 -0.14 113.70 123.68 2wz1 s SER 591 Ca 0.00 1.87 0.01 0.00 1.31 0.00 0.00 55.95 59.14 2wz1 s SER 591 Cb -0.14 -2.57 0.02 0.00 0.21 0.00 0.00 66.02 63.53 2wz1 s SER 591 CO 0.02 -0.41 -0.02 -0.04 0.41 0.00 0.00 173.24 173.20 2wz1 s MET 592 N 1.15 0.41 0.25 12.44 -1.94 -1.26 -4.95 119.30 125.40 2wz1 s MET 592 Ca 0.56 -0.01 -0.30 0.00 -1.71 0.00 0.00 55.69 54.22 2wz1 s MET 592 Cb -0.26 -0.51 -0.14 0.00 2.01 0.00 0.00 34.83 35.93 2wz1 s MET 592 CO 0.28 -0.07 1.25 1.63 -0.01 0.00 0.00 175.02 178.10 2wz1 n LYS 593 N 3.84 1.72 -0.52 2.03 4.01 -1.26 -2.73 118.16 125.26 2wz1 n LYS 593 Ca -0.24 0.61 0.00 0.00 -0.51 0.00 0.00 58.31 58.17 2wz1 n LYS 593 Cb 0.52 -2.16 0.00 0.00 -0.51 0.00 0.00 35.03 32.88 2wz1 n LYS 593 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2wz1 n GLY 594 N 1.69 0.73 2.97 0.72 0.00 -1.26 -4.92 105.19 105.12 2wz1 n GLY 594 Ca 0.11 -0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 2wz1 n GLY 594 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wz1 s LYS 595 N -0.56 0.13 -0.02 1.61 2.20 -1.10 -5.04 119.74 116.96 2wz1 s LYS 595 Ca 0.00 0.35 -0.21 0.00 -0.36 0.00 0.00 55.97 55.75 2wz1 s LYS 595 Cb 0.00 -0.11 -0.13 0.00 -1.51 0.00 0.00 37.83 36.08 2wz1 s LYS 595 CO 0.00 -0.13 0.92 -0.22 -0.36 0.00 0.00 175.35 175.57 2wz1 h LYS 596 N 6.90 -0.55 -7.37 4.03 3.64 -1.96 -3.43 116.57 117.83 2wz1 h LYS 596 Ca -0.38 0.04 -0.48 0.00 -1.27 0.00 0.00 60.65 58.55 2wz1 h LYS 596 Cb 1.16 0.12 0.07 0.00 -0.41 0.00 0.00 32.23 33.17 2wz1 h LYS 596 CO 0.41 -0.26 0.33 -1.21 -2.27 0.00 0.00 179.45 176.45 2wz1 s GLU 597 N -3.98 2.74 0.72 1.90 0.41 -1.26 -5.03 118.70 114.20 2wz1 s GLU 597 Ca -0.12 0.23 -0.14 0.00 -0.41 0.00 0.00 54.97 54.54 2wz1 s GLU 597 Cb 0.01 -2.10 0.04 0.00 -1.78 0.00 0.00 34.13 30.30 2wz1 s GLU 597 CO 0.39 -1.01 1.14 -2.14 -0.49 0.00 0.00 175.26 173.15 2wz1 s PRO 598 N -5.26 2.35 -0.27 0.39 0.02 -1.26 -4.79 135.00 126.18 2wz1 s PRO 598 Ca 0.57 1.46 -0.21 0.00 0.02 0.00 0.00 61.00 62.84 2wz1 s PRO 598 Cb -0.11 -1.89 -0.01 0.00 0.02 0.00 0.00 34.50 32.51 2wz1 s PRO 598 CO 0.49 -1.61 0.68 1.41 -0.33 0.00 0.00 177.00 177.64 2wz1 s MET 599 N -4.25 4.08 0.18 5.54 1.75 0.81 -4.81 119.30 122.60 2wz1 s MET 599 Ca 0.68 0.58 -0.30 0.00 -1.25 0.00 0.00 55.69 55.40 2wz1 s MET 599 Cb -0.22 -3.67 -0.08 0.00 2.84 0.00 0.00 34.83 33.70 2wz1 s MET 599 CO 0.47 -0.48 1.21 -0.65 -0.65 0.00 0.00 175.02 174.91 2wz1 s GLN 600 N 2.62 4.48 0.05 4.11 -1.52 -1.26 -0.36 119.66 127.79 2wz1 s GLN 600 Ca 0.28 1.89 0.05 0.00 -1.95 0.00 0.00 55.36 55.63 2wz1 s GLN 600 Cb -0.15 -3.24 -0.03 0.00 -0.22 0.00 0.00 33.01 29.37 2wz1 s GLN 600 CO 0.09 -0.11 -0.15 0.08 -0.25 0.00 0.00 175.29 174.95 2wz1 s VAL 601 N 0.00 1.17 0.18 1.09 1.01 -0.86 -1.10 120.40 121.89 2wz1 s VAL 601 Ca 0.53 -1.15 0.10 0.00 0.00 0.00 0.00 61.98 61.47 2wz1 s VAL 601 Cb -0.33 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 2wz1 s VAL 601 CO 0.36 -0.07 -0.21 0.26 0.00 0.00 0.00 175.10 175.44 2wz1 s TRP 602 N -1.01 2.06 -0.19 5.22 0.51 -0.08 -0.95 118.94 124.50 2wz1 s TRP 602 Ca 0.01 -0.41 -0.12 0.00 -2.12 0.00 0.00 56.10 53.46 2wz1 s TRP 602 Cb -0.09 -1.02 -0.05 0.00 -0.81 0.00 0.00 33.47 31.50 2wz1 s TRP 602 CO 0.02 0.42 0.22 -0.06 -0.51 0.00 0.00 176.95 177.03 2wz1 s PHE 603 N -1.85 3.42 -0.16 -1.98 0.08 0.13 -0.32 117.98 117.30 2wz1 s PHE 603 Ca 0.18 0.44 -0.09 0.00 0.12 0.00 0.00 56.93 57.59 2wz1 s PHE 603 Cb -0.07 -2.27 -0.05 0.00 -0.57 0.00 0.00 43.02 40.07 2wz1 s PHE 603 CO 0.08 0.23 0.14 -1.17 -0.10 0.00 0.00 175.22 174.40 2wz1 s LEU 604 N 0.54 4.30 0.25 -0.37 2.96 -0.43 -0.87 118.68 125.05 2wz1 s LEU 604 Ca 0.12 0.35 -0.02 0.00 -0.22 0.00 0.00 54.13 54.36 2wz1 s LEU 604 Cb -0.12 -2.08 -0.02 0.00 0.50 0.00 0.00 46.19 44.46 2wz1 s LEU 604 CO 0.02 0.29 0.28 -0.94 -1.32 0.00 0.00 176.35 174.68 2wz1 s SER 605 N -0.31 0.47 -0.16 3.68 1.04 -0.09 -4.30 113.70 114.03 2wz1 s SER 605 Ca 0.11 -1.37 -0.19 0.00 0.48 0.00 0.00 55.95 54.99 2wz1 s SER 605 Cb -0.12 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.47 2wz1 s SER 605 CO 0.01 -1.01 0.54 -0.60 0.98 0.00 0.00 173.24 173.16 2wz1 s ARG 606 N -3.84 4.27 0.32 4.02 3.52 -1.26 -1.06 118.95 124.91 2wz1 s ARG 606 Ca 0.35 0.50 -0.29 0.00 -0.13 0.00 0.00 55.73 56.16 2wz1 s ARG 606 Cb 0.03 -3.51 -0.12 0.00 -1.56 0.00 0.00 34.95 29.79 2wz1 s ARG 606 CO 0.15 -0.03 1.35 1.17 -0.81 0.00 0.00 175.30 177.13 2wz1 n LYS 607 N 4.33 2.19 0.00 5.12 4.81 0.36 -4.82 118.16 130.15 2wz1 n LYS 607 Ca -0.05 0.77 0.12 0.00 -0.87 0.00 0.00 58.31 58.29 2wz1 n LYS 607 Cb 0.51 -2.40 0.12 0.00 0.02 0.00 0.00 35.03 33.28 2wz1 n LYS 607 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84