#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wz1 s PRO 413 N 0.00 2.97 0.42 5.55 0.02 -1.26 -4.58 135.00 138.11 2wz1 s PRO 413 Ca 0.00 0.80 -0.27 0.00 0.02 0.00 0.00 61.00 61.56 2wz1 s PRO 413 Cb 0.00 -2.00 -0.10 0.00 0.02 0.00 0.00 34.50 32.42 2wz1 s PRO 413 CO 0.00 -1.04 1.47 0.00 -0.33 0.00 0.00 177.00 177.10 2wz1 n ALA 414 N -3.07 2.24 -3.05 -1.55 0.00 -1.26 -4.86 120.51 108.97 2wz1 n ALA 414 Ca 0.07 0.29 -0.12 0.00 0.00 0.00 0.00 53.44 53.68 2wz1 n ALA 414 Cb 0.54 -2.41 -0.12 0.00 0.00 0.00 0.00 19.45 17.46 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 -2.29 0.22 -0.11 0.00 2.20 -0.90 -5.01 119.74 113.85 2wz1 s LYS 415 Ca 0.57 0.18 -0.11 0.00 -0.36 0.00 0.00 55.97 56.25 2wz1 s LYS 415 Cb -0.46 0.10 -0.05 0.00 -1.51 0.00 0.00 37.83 35.92 2wz1 s LYS 415 CO 0.61 -0.03 0.24 0.50 -0.36 0.00 0.00 175.35 176.31 2wz1 s ARG 416 N -0.04 3.86 -0.08 4.03 3.52 -1.26 -0.95 118.95 128.02 2wz1 s ARG 416 Ca -0.01 0.05 0.03 0.00 -0.13 0.00 0.00 55.73 55.66 2wz1 s ARG 416 Cb -0.02 -3.29 -0.02 0.00 -1.56 0.00 0.00 34.95 30.07 2wz1 s ARG 416 CO 0.00 0.56 -0.18 0.71 -0.81 0.00 0.00 175.30 175.59 2wz1 s TYR 417 N -0.49 2.66 0.32 5.12 2.02 0.38 -5.00 117.35 122.35 2wz1 s TYR 417 Ca 0.17 -0.56 0.06 0.00 -0.37 0.00 0.00 57.07 56.36 2wz1 s TYR 417 Cb -0.13 -1.71 -0.02 0.00 -0.40 0.00 0.00 41.96 39.71 2wz1 s TYR 417 CO 0.05 -0.12 0.45 -0.51 -1.57 0.00 0.00 175.55 173.86 2wz1 s ASP 418 N -0.09 6.07 -1.08 2.29 1.01 -1.26 -0.97 116.67 122.64 2wz1 s ASP 418 Ca -0.03 -0.06 -0.01 0.00 0.71 0.00 0.00 52.55 53.15 2wz1 s ASP 418 Cb -0.14 -1.46 -0.01 0.00 1.01 0.00 0.00 42.92 42.32 2wz1 s ASP 418 CO 0.04 -0.34 0.91 0.59 0.21 0.00 0.00 175.17 176.58 2wz1 n ASN 419 N -1.61 -2.92 -4.42 0.27 3.02 -1.25 -4.96 115.26 103.39 2wz1 n ASN 419 Ca -0.03 -0.59 -0.33 0.00 -0.03 0.00 0.00 54.58 53.61 2wz1 n ASN 419 Cb 0.58 -4.79 -0.14 0.00 -0.61 0.00 0.00 39.78 34.82 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 -3.34 3.05 -0.11 2.41 1.01 -0.98 -4.53 120.40 117.92 2wz1 s VAL 420 Ca 0.09 -0.70 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 2wz1 s VAL 420 Cb -0.01 -2.24 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 2wz1 s VAL 420 CO 0.68 0.56 -0.09 -0.89 0.00 0.00 0.00 175.10 175.36 2wz1 s THR 421 N -0.20 3.49 -0.00 3.92 2.01 -0.47 -1.10 115.64 123.28 2wz1 s THR 421 Ca 0.00 -0.53 0.07 0.00 0.31 0.00 0.00 61.69 61.55 2wz1 s THR 421 Cb -0.13 -2.46 -0.03 0.00 0.01 0.00 0.00 72.50 69.89 2wz1 s THR 421 CO 0.03 0.55 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.66 2wz1 s ILE 422 N -0.12 2.47 -0.07 1.82 1.01 -0.33 -1.00 121.20 124.97 2wz1 s ILE 422 Ca 0.01 -1.07 0.05 0.00 0.00 0.00 0.00 60.65 59.64 2wz1 s ILE 422 Cb -0.13 -1.94 -0.01 0.00 0.01 0.00 0.00 42.46 40.39 2wz1 s ILE 422 CO 0.03 0.50 -0.24 -0.22 0.00 0.00 0.00 174.94 175.01 2wz1 s LEU 423 N -0.91 2.07 -0.03 2.97 0.20 0.31 -2.22 118.68 121.08 2wz1 s LEU 423 Ca 0.12 -0.53 0.05 0.00 0.69 0.00 0.00 54.13 54.46 2wz1 s LEU 423 Cb -0.10 -1.37 -0.03 0.00 -0.43 0.00 0.00 46.19 44.26 2wz1 s LEU 423 CO 0.01 0.21 -0.18 -0.36 -0.29 0.00 0.00 176.35 175.74 2wz1 s PHE 424 N 0.05 2.60 -0.06 5.38 0.40 -0.54 -1.72 117.98 124.08 2wz1 s PHE 424 Ca -0.10 -0.24 0.03 0.00 -0.60 0.00 0.00 56.93 56.03 2wz1 s PHE 424 Cb -0.15 -1.58 0.01 0.00 0.51 0.00 0.00 43.02 41.80 2wz1 s PHE 424 CO 0.06 0.14 -0.15 0.45 0.70 0.00 0.00 175.22 176.42 2wz1 s SER 425 N -0.78 2.03 0.39 1.36 0.15 0.25 -0.97 113.70 116.13 2wz1 s SER 425 Ca 0.11 -0.34 0.05 0.00 0.70 0.00 0.00 55.95 56.47 2wz1 s SER 425 Cb -0.10 -0.81 -0.06 0.00 -1.71 0.00 0.00 66.02 63.33 2wz1 s SER 425 CO 0.01 0.09 0.04 -0.83 1.20 0.00 0.00 173.24 173.74 2wz1 s GLY 426 N 0.41 2.40 -0.20 9.45 0.00 -0.10 -1.49 107.32 117.80 2wz1 s GLY 426 Ca -0.11 -1.87 -0.05 0.00 0.00 0.00 0.00 44.72 42.68 2wz1 s GLY 426 CO 0.04 -1.97 0.01 -0.42 0.00 0.00 0.00 173.10 170.76 2wz1 s ILE 427 N -3.02 4.06 0.22 0.90 1.01 -1.26 -1.25 121.20 121.86 2wz1 s ILE 427 Ca 0.31 -0.28 -0.31 0.00 0.00 0.00 0.00 60.65 60.38 2wz1 s ILE 427 Cb 0.08 -2.84 -0.10 0.00 0.01 0.00 0.00 42.46 39.60 2wz1 s ILE 427 CO 0.15 0.42 1.54 -0.69 0.00 0.00 0.00 174.94 176.36 2wz1 s VAL 428 N 0.97 2.52 -0.15 2.92 1.01 0.24 -2.44 120.40 125.48 2wz1 s VAL 428 Ca 0.02 0.40 0.00 0.00 0.00 0.00 0.00 61.98 62.40 2wz1 s VAL 428 Cb -0.14 -3.26 0.00 0.00 0.00 0.00 0.00 36.38 32.98 2wz1 s VAL 428 CO 0.02 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.78 2wz1 n GLY 429 N 2.99 0.46 0.24 4.51 0.00 -1.26 -4.76 105.19 107.36 2wz1 n GLY 429 Ca 0.11 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 0.79 -0.57 1.61 3.57 -1.89 -0.22 116.94 120.24 2wz1 h PHE 430 Ca -0.03 -0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.47 2wz1 h PHE 430 Cb 0.34 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.79 2wz1 h PHE 430 CO 0.20 0.64 0.29 -0.91 -2.23 0.00 0.00 178.31 176.30 2wz1 h ASN 431 N 0.71 0.41 0.05 0.41 2.35 -1.92 0.83 115.58 118.41 2wz1 h ASN 431 Ca 0.18 0.03 -0.13 0.00 -0.55 0.00 0.00 56.30 55.83 2wz1 h ASN 431 Cb 0.18 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 2wz1 h ASN 431 CO -0.02 0.27 -0.42 0.00 -1.65 0.00 0.00 177.43 175.61 2wz1 h ALA 432 N 1.31 0.91 -0.11 -0.83 0.00 -1.89 -2.62 119.26 116.03 2wz1 h ALA 432 Ca 0.26 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2wz1 h ALA 432 Cb 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2wz1 h ALA 432 CO -0.18 0.64 0.07 0.35 0.00 0.00 0.00 179.25 180.13 2wz1 h PHE 433 N 0.38 0.14 -0.98 0.00 3.57 -0.43 -1.78 116.94 117.84 2wz1 h PHE 433 Ca 0.03 0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.55 2wz1 h PHE 433 Cb 0.90 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.54 2wz1 h PHE 433 CO 0.03 0.11 0.65 0.00 -2.23 0.00 0.00 178.31 176.86 2wz1 n SER 435 N -4.42 0.39 -0.00 0.00 3.41 -1.00 -1.08 113.62 110.92 2wz1 n SER 435 Ca 0.12 0.52 -0.11 0.00 -0.26 0.00 0.00 58.87 59.14 2wz1 n SER 435 Cb 0.03 -0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 63.22 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 0.00 0.05 -0.39 4.33 3.64 -1.05 -3.37 116.57 119.78 2wz1 h LYS 436 Ca 0.00 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.27 2wz1 h LYS 436 Cb 0.61 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 2wz1 h LYS 436 CO 0.00 0.68 0.01 0.72 -2.27 0.00 0.00 179.45 178.59 2wz1 n HIS 437 N -3.16 1.41 -1.57 1.91 8.25 -0.33 -4.87 115.22 116.86 2wz1 n HIS 437 Ca -0.17 -0.86 -0.35 0.00 -0.26 0.00 0.00 57.72 56.08 2wz1 n HIS 437 Cb 1.04 -0.41 -0.07 0.00 1.12 0.00 0.00 29.99 31.68 2wz1 n HIS 437 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2wz1 n ALA 438 N -0.13 2.26 -0.27 -1.41 0.00 -0.24 -2.56 120.51 118.16 2wz1 n ALA 438 Ca 0.25 -3.07 0.00 0.00 0.00 0.00 0.00 53.44 50.61 2wz1 n ALA 438 Cb 1.03 -3.55 0.00 0.00 0.00 0.00 0.00 19.45 16.92 2wz1 n ALA 438 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2wz1 n SER 439 N 11.59 0.00 0.00 0.00 3.41 -1.26 -4.97 113.62 122.39 2wz1 n SER 439 Ca 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.08 2wz1 n SER 439 Cb 0.44 0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.76 2wz1 n SER 439 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2wz1 n GLY 442 N -1.36 0.80 0.28 5.00 0.00 -1.26 -4.95 105.19 103.70 2wz1 n GLY 442 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 1.27 0.00 4.61 0.00 -1.87 -2.51 119.26 120.76 2wz1 h ALA 443 Ca 0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 2wz1 h ALA 443 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2wz1 h ALA 443 CO 0.00 0.50 -0.40 1.98 0.00 0.00 0.00 179.25 181.33 2wz1 h MET 444 N 0.63 0.00 -0.84 0.00 1.85 -1.92 -2.83 114.93 111.82 2wz1 h MET 444 Ca 0.13 0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.20 2wz1 h MET 444 Cb 0.36 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.35 2wz1 h MET 444 CO 0.01 0.40 0.43 0.87 -0.40 0.00 0.00 176.91 178.22 2wz1 h LYS 445 N 0.00 1.18 0.15 0.39 1.57 -1.83 -0.36 116.57 117.67 2wz1 h LYS 445 Ca -0.00 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 2wz1 h LYS 445 Cb 0.84 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.93 2wz1 h LYS 445 CO 0.05 0.89 -0.07 0.82 -0.57 0.00 0.00 179.45 180.57 2wz1 h ILE 446 N 1.18 0.87 -0.53 1.86 2.04 -1.41 -1.71 117.51 119.81 2wz1 h ILE 446 Ca 0.29 -0.06 0.01 0.00 1.00 0.00 0.00 64.86 66.10 2wz1 h ILE 446 Cb 0.07 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 2wz1 h ILE 446 CO -0.04 0.01 0.35 0.58 0.00 0.00 0.00 178.15 179.05 2wz1 h VAL 447 N -0.23 1.13 -0.65 1.67 2.07 -1.29 -1.77 116.25 117.19 2wz1 h VAL 447 Ca -0.02 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.22 2wz1 h VAL 447 Cb 0.18 0.36 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 2wz1 h VAL 447 CO 0.03 0.13 0.27 0.78 0.02 0.00 0.00 177.57 178.80 2wz1 h ASN 448 N 0.71 0.88 0.06 0.57 2.35 -1.08 -0.29 115.58 118.78 2wz1 h ASN 448 Ca 0.19 -0.16 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 2wz1 h ASN 448 Cb -0.08 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.06 2wz1 h ASN 448 CO -0.04 0.80 -0.05 0.25 -1.65 0.00 0.00 177.43 176.74 2wz1 h LEU 449 N 0.91 -0.13 -0.54 1.61 5.85 -1.02 -0.40 115.31 121.58 2wz1 h LEU 449 Ca 0.22 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.89 2wz1 h LEU 449 Cb 0.19 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 2wz1 h LEU 449 CO -0.02 -0.08 0.11 -0.07 -0.34 0.00 0.00 178.44 178.04 2wz1 h LEU 450 N -0.12 0.83 -0.54 2.25 3.38 -1.09 -0.96 115.31 119.05 2wz1 h LEU 450 Ca 0.00 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.60 2wz1 h LEU 450 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2wz1 h LEU 450 CO -0.01 0.86 -0.18 0.78 0.09 0.00 0.00 178.44 179.98 2wz1 h ASN 451 N 0.76 1.01 0.44 -0.43 2.35 -0.93 0.12 115.58 118.89 2wz1 h ASN 451 Ca 0.17 -0.36 -0.02 0.00 -0.55 0.00 0.00 56.30 55.53 2wz1 h ASN 451 Cb 0.37 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.47 2wz1 h ASN 451 CO 0.01 1.15 -0.21 -0.78 -1.65 0.00 0.00 177.43 175.95 2wz1 h ASP 452 N 0.86 -0.50 -0.19 5.81 1.82 -0.94 -1.66 116.42 121.64 2wz1 h ASP 452 Ca 0.12 -0.04 -0.01 0.00 -0.39 0.00 0.00 57.03 56.70 2wz1 h ASP 452 Cb 0.75 0.13 -0.01 0.00 0.68 0.00 0.00 39.33 40.88 2wz1 h ASP 452 CO 0.06 -0.26 0.07 0.25 -1.61 0.00 0.00 179.24 177.75 2wz1 h LEU 453 N -0.71 0.26 -0.70 2.28 5.85 -1.12 -2.56 115.31 118.61 2wz1 h LEU 453 Ca -0.06 -0.17 -0.14 0.00 0.84 0.00 0.00 57.88 58.35 2wz1 h LEU 453 Cb 0.51 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 2wz1 h LEU 453 CO 0.10 0.36 -0.60 1.88 -0.34 0.00 0.00 178.44 179.83 2wz1 h TYR 454 N 0.14 0.20 -0.54 1.25 0.05 -0.99 -0.47 116.97 116.62 2wz1 h TYR 454 Ca 0.06 -0.08 -0.08 0.00 0.05 0.00 0.00 58.73 58.69 2wz1 h TYR 454 Cb 0.18 -0.04 -0.02 0.00 1.01 0.00 0.00 36.73 37.87 2wz1 h TYR 454 CO -0.01 0.72 0.02 1.15 -1.05 0.00 0.00 178.16 178.99 2wz1 h THR 455 N 0.11 1.25 -0.35 -2.88 2.02 -1.26 0.50 112.91 112.30 2wz1 h THR 455 Ca -0.01 -1.03 -0.10 0.00 0.77 0.00 0.00 66.41 66.04 2wz1 h THR 455 Cb 1.09 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 2wz1 h THR 455 CO 0.09 0.37 -0.15 0.03 0.37 0.00 0.00 175.52 176.23 2wz1 h ARG 456 N 0.83 0.73 -0.81 6.66 3.08 -0.93 -2.60 114.38 121.34 2wz1 h ARG 456 Ca 0.16 -0.31 0.06 0.00 0.07 0.00 0.00 59.98 59.96 2wz1 h ARG 456 Cb 0.46 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.44 2wz1 h ARG 456 CO 0.02 0.92 0.53 0.74 -1.07 0.00 0.00 179.97 181.10 2wz1 h PHE 457 N 0.51 0.89 0.00 3.04 0.04 -0.84 -2.39 116.94 118.19 2wz1 h PHE 457 Ca 0.08 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.86 2wz1 h PHE 457 Cb 0.69 -0.29 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 2wz1 h PHE 457 CO 0.06 0.47 -0.04 -0.44 -0.60 0.00 0.00 178.31 177.75 2wz1 h ASP 458 N 0.88 0.00 0.47 2.17 3.32 -0.52 -0.60 116.42 122.14 2wz1 h ASP 458 Ca 0.35 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.38 2wz1 h ASP 458 Cb 0.23 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.78 2wz1 h ASP 458 CO -0.12 0.04 -0.08 0.71 -1.72 0.00 0.00 179.24 178.07 2wz1 h THR 459 N 0.00 0.33 0.00 0.35 1.35 -1.22 -0.77 112.91 112.96 2wz1 h THR 459 Ca -0.00 -0.46 -0.33 0.00 -0.55 0.00 0.00 66.41 65.06 2wz1 h THR 459 Cb 0.09 1.34 -0.06 0.00 -1.73 0.00 0.00 68.15 67.79 2wz1 h THR 459 CO 0.01 0.08 -2.06 0.18 -0.25 0.00 0.00 175.52 173.47 2wz1 n LEU 460 N -3.40 0.62 -0.02 3.87 4.77 -0.30 -4.45 117.00 118.09 2wz1 n LEU 460 Ca -0.01 0.20 0.11 0.00 -0.03 0.00 0.00 56.01 56.27 2wz1 n LEU 460 Cb 0.23 0.23 0.06 0.00 -2.33 0.00 0.00 43.42 41.62 2wz1 n LEU 460 CO 0.28 0.48 0.20 0.35 -1.33 0.00 0.00 177.39 177.37 2wz1 n THR 461 N -2.93 0.00 -1.69 -5.08 -2.24 -0.83 -4.46 114.28 97.06 2wz1 n THR 461 Ca -0.26 -0.01 -0.44 0.00 -2.27 0.00 0.00 64.05 61.07 2wz1 n THR 461 Cb 1.10 0.66 -0.02 0.00 -2.10 0.00 0.00 70.33 69.97 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 -1.43 2.88 0.28 3.42 2.03 -0.31 -4.69 116.55 118.73 2wz1 n ASP 462 Ca 0.05 1.17 0.14 0.00 0.52 0.00 0.00 54.79 56.66 2wz1 n ASP 462 Cb 0.34 -1.47 0.83 0.00 -0.72 0.00 0.00 41.12 40.10 2wz1 n ASP 462 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2wz1 h SER 463 N 3.65 0.00 0.52 1.67 4.64 -1.89 0.11 113.55 122.25 2wz1 h SER 463 Ca -0.46 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.81 2wz1 h SER 463 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 2wz1 h SER 463 CO 0.71 0.04 -0.24 0.03 -0.87 0.00 0.00 176.83 176.50 2wz1 h ARG 464 N 0.00 0.00 0.11 4.77 3.08 -1.99 -3.26 114.38 117.09 2wz1 h ARG 464 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 2wz1 h ARG 464 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 2wz1 h ARG 464 CO 0.01 0.24 -1.91 1.17 -1.07 0.00 0.00 179.97 178.41 2wz1 n LYS 465 N -3.72 0.73 -3.47 0.04 3.00 -0.02 -4.91 118.16 109.82 2wz1 n LYS 465 Ca -0.01 0.30 -0.23 0.00 -0.00 0.00 0.00 58.31 58.38 2wz1 n LYS 465 Cb 0.35 -1.71 -0.12 0.00 0.00 0.00 0.00 35.03 33.55 2wz1 n LYS 465 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 2wz1 s ASN 466 N -7.02 2.53 0.00 3.14 3.84 0.19 -5.01 114.94 112.61 2wz1 s ASN 466 Ca -0.23 -0.99 0.25 0.00 0.21 0.00 0.00 52.86 52.10 2wz1 s ASN 466 Cb 0.07 0.11 1.36 0.00 -0.55 0.00 0.00 41.25 42.24 2wz1 s ASN 466 CO 0.74 -0.41 1.86 -0.81 -2.79 0.00 0.00 177.10 175.69 2wz1 n PRO 467 N 5.28 0.53 0.00 0.43 -0.04 -1.25 -3.66 135.00 136.29 2wz1 n PRO 467 Ca -0.04 0.03 0.11 0.00 -0.04 0.00 0.00 63.50 63.57 2wz1 n PRO 467 Cb 0.44 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.51 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 -1.18 0.00 -4.35 0.54 3.72 -1.26 -4.94 117.46 109.99 2wz1 n PHE 468 Ca 0.15 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.33 2wz1 n PHE 468 Cb 0.16 -0.13 -0.11 0.00 -0.94 0.00 0.00 39.48 38.46 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 -2.91 1.89 -0.12 -4.37 -7.23 -1.24 -4.41 120.40 102.01 2wz1 s VAL 469 Ca 0.12 -2.01 -0.02 0.00 -1.81 0.00 0.00 61.98 58.26 2wz1 s VAL 469 Cb 0.17 -1.93 0.04 0.00 0.56 0.00 0.00 36.38 35.23 2wz1 s VAL 469 CO 0.73 -0.35 0.01 -0.47 -0.31 0.00 0.00 175.10 174.71 2wz1 s TYR 470 N -2.20 0.82 0.03 2.82 5.04 0.18 -4.85 117.35 119.19 2wz1 s TYR 470 Ca 0.18 -0.42 -0.30 0.00 -2.44 0.00 0.00 57.07 54.08 2wz1 s TYR 470 Cb -0.05 -0.90 -0.05 0.00 0.35 0.00 0.00 41.96 41.32 2wz1 s TYR 470 CO 0.07 -0.43 1.18 0.21 -1.34 0.00 0.00 175.55 175.24 2wz1 s LYS 471 N 1.93 4.42 -0.19 4.97 2.20 -1.26 -1.13 119.74 130.68 2wz1 s LYS 471 Ca 0.03 1.72 -0.06 0.00 -0.36 0.00 0.00 55.97 57.29 2wz1 s LYS 471 Cb -0.14 -3.41 -0.03 0.00 -1.51 0.00 0.00 37.83 32.74 2wz1 s LYS 471 CO -0.06 -0.28 0.04 0.08 -0.36 0.00 0.00 175.35 174.76 2wz1 s VAL 472 N 1.33 4.44 -0.08 4.02 1.01 -0.89 -4.98 120.40 125.25 2wz1 s VAL 472 Ca 0.58 -0.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.11 2wz1 s VAL 472 Cb -0.28 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 2wz1 s VAL 472 CO 0.27 0.44 1.55 -1.61 0.00 0.00 0.00 175.10 175.75 2wz1 s GLU 473 N 0.70 4.20 0.22 2.72 0.41 -1.26 -4.24 118.70 121.44 2wz1 s GLU 473 Ca 0.02 2.05 0.03 0.00 -0.41 0.00 0.00 54.97 56.66 2wz1 s GLU 473 Cb -0.14 -3.92 -0.01 0.00 -1.78 0.00 0.00 34.13 28.28 2wz1 s GLU 473 CO 0.02 -0.81 0.11 -2.37 -0.49 0.00 0.00 175.26 171.72 2wz1 n THR 474 N 5.44 0.00 -1.39 3.63 5.66 -1.26 -5.07 114.28 121.29 2wz1 n THR 474 Ca 0.16 -1.36 -0.36 0.00 -3.05 0.00 0.00 64.05 59.44 2wz1 n THR 474 Cb 0.43 0.56 0.07 0.00 -1.55 0.00 0.00 70.33 69.85 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 -0.46 2.68 -0.33 1.08 0.24 -1.26 -4.89 118.33 115.39 2wz1 n VAL 475 Ca -0.00 -0.42 0.04 0.00 -2.04 0.00 0.00 64.34 61.92 2wz1 n VAL 475 Cb 0.35 -0.97 0.19 0.00 -1.47 0.00 0.00 33.84 31.93 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 -0.11 1.43 0.28 7.63 0.00 -2.03 -2.66 103.07 107.61 2wz1 h GLY 476 Ca -0.47 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.48 2wz1 h GLY 476 CO 0.46 0.18 0.00 2.09 0.00 0.00 0.00 176.54 179.27 2wz1 n ASP 477 N -4.66 0.64 -4.22 0.19 5.75 -1.26 -4.82 116.55 108.17 2wz1 n ASP 477 Ca 0.15 -1.30 -0.21 0.00 -0.01 0.00 0.00 54.79 53.42 2wz1 n ASP 477 Cb 0.28 -0.01 -0.12 0.00 -1.03 0.00 0.00 41.12 40.23 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 -1.97 0.99 -0.10 0.11 -0.14 -1.00 -4.35 119.74 113.27 2wz1 s LYS 478 Ca 0.40 -1.03 0.01 0.00 -1.36 0.00 0.00 55.97 53.99 2wz1 s LYS 478 Cb 0.20 -1.11 -0.02 0.00 -1.68 0.00 0.00 37.83 35.21 2wz1 s LYS 478 CO 0.32 0.26 -0.13 -0.47 -0.76 0.00 0.00 175.35 174.57 2wz1 s TYR 479 N -1.17 2.79 -0.04 3.18 6.14 -0.55 -4.62 117.35 123.08 2wz1 s TYR 479 Ca 0.02 -0.45 0.04 0.00 0.64 0.00 0.00 57.07 57.32 2wz1 s TYR 479 Cb -0.10 -1.78 -0.00 0.00 0.42 0.00 0.00 41.96 40.50 2wz1 s TYR 479 CO 0.03 -0.06 -0.17 1.41 0.64 0.00 0.00 175.55 177.40 2wz1 s MET 480 N -0.02 1.76 -0.02 4.97 -2.45 -1.26 -0.58 119.30 121.70 2wz1 s MET 480 Ca -0.03 -0.61 -0.07 0.00 -1.25 0.00 0.00 55.69 53.73 2wz1 s MET 480 Cb -0.14 -1.54 0.01 0.00 1.25 0.00 0.00 34.83 34.41 2wz1 s MET 480 CO 0.04 0.25 0.16 0.99 1.05 0.00 0.00 175.02 177.51 2wz1 s THR 481 N 0.01 0.05 0.19 10.11 2.01 -0.70 -2.09 115.64 125.22 2wz1 s THR 481 Ca -0.03 -0.43 0.04 0.00 0.31 0.00 0.00 61.69 61.58 2wz1 s THR 481 Cb -0.11 -0.38 -0.05 0.00 0.01 0.00 0.00 72.50 71.97 2wz1 s THR 481 CO 0.02 -0.23 -0.04 0.68 -0.69 0.00 0.00 174.62 174.35 2wz1 s VAL 482 N -0.83 1.03 -0.01 3.82 -7.23 -0.28 -0.53 120.40 116.37 2wz1 s VAL 482 Ca -0.09 -2.04 0.01 0.00 -1.81 0.00 0.00 61.98 58.06 2wz1 s VAL 482 Cb -0.05 -2.10 -0.00 0.00 0.56 0.00 0.00 36.38 34.79 2wz1 s VAL 482 CO 0.01 -0.53 -0.05 -0.55 -0.31 0.00 0.00 175.10 173.68 2wz1 s SER 483 N -3.23 0.59 0.00 4.85 0.15 -0.17 -0.65 113.70 115.24 2wz1 s SER 483 Ca 0.23 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.79 2wz1 s SER 483 Cb 0.04 -0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.26 2wz1 s SER 483 CO 0.04 0.05 0.00 0.61 1.20 0.00 0.00 173.24 175.14 2wz1 n GLY 484 N 3.06 0.64 3.29 9.45 0.00 -1.25 -1.37 105.19 119.01 2wz1 n GLY 484 Ca -0.14 0.00 -0.13 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 0.58 0.07 0.99 0.05 -1.26 -3.84 118.68 115.27 2wz1 s LEU 485 Ca 0.00 0.05 0.20 0.00 0.05 0.00 0.00 54.13 54.43 2wz1 s LEU 485 Cb 0.00 1.55 0.84 0.00 -2.05 0.00 0.00 46.19 46.53 2wz1 s LEU 485 CO 0.00 -0.57 1.64 -0.81 -0.55 0.00 0.00 176.35 176.06 2wz1 n PRO 486 N 0.84 0.06 -3.89 1.48 -0.04 -1.26 -4.69 135.00 127.50 2wz1 n PRO 486 Ca -0.20 0.23 -0.35 0.00 -0.04 0.00 0.00 63.50 63.14 2wz1 n PRO 486 Cb 0.58 -1.60 -0.09 0.00 -0.04 0.00 0.00 33.50 32.35 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 -3.07 4.03 0.67 0.54 0.41 -1.26 -5.09 118.70 114.93 2wz1 s GLU 487 Ca 0.08 -0.31 -0.16 0.00 -0.41 0.00 0.00 54.97 54.17 2wz1 s GLU 487 Cb 0.12 -3.30 0.01 0.00 -1.78 0.00 0.00 34.13 29.17 2wz1 s GLU 487 CO 0.38 0.25 1.19 -2.14 -0.49 0.00 0.00 175.26 174.44 2wz1 s PRO 488 N 0.46 2.55 -0.10 0.39 0.02 -1.25 -3.76 135.00 133.32 2wz1 s PRO 488 Ca 0.05 1.71 -0.03 0.00 0.02 0.00 0.00 61.00 62.75 2wz1 s PRO 488 Cb -0.12 -1.89 0.04 0.00 0.02 0.00 0.00 34.50 32.55 2wz1 s PRO 488 CO 0.00 -1.51 0.08 0.00 -0.33 0.00 0.00 177.00 175.25 2wz1 h ILE 490 N 6.42 0.97 -1.01 0.00 2.04 -1.94 -2.27 117.51 121.72 2wz1 h ILE 490 Ca -0.13 -0.14 -0.66 0.00 1.00 0.00 0.00 64.86 64.93 2wz1 h ILE 490 Cb 1.13 0.54 -0.31 0.00 -0.74 0.00 0.00 36.82 37.44 2wz1 h ILE 490 CO 0.21 0.07 0.59 0.00 0.00 0.00 0.00 178.15 179.02 2wz1 n HIS 491 N -4.47 3.15 -0.25 1.37 1.44 -1.26 -4.69 115.22 110.50 2wz1 n HIS 491 Ca 0.06 -2.87 0.00 0.00 -2.01 0.00 0.00 57.72 52.90 2wz1 n HIS 491 Cb 0.24 -1.25 0.12 0.00 0.12 0.00 0.00 29.99 29.23 2wz1 n HIS 491 CO 0.00 0.00 0.00 1.12 -2.81 0.00 0.00 176.34 174.65 2wz1 h HIS 492 N 2.08 0.73 -0.13 -1.40 2.07 -1.73 -1.26 115.15 115.52 2wz1 h HIS 492 Ca 0.57 0.03 -0.23 0.00 -2.85 0.00 0.00 60.37 57.88 2wz1 h HIS 492 Cb 0.89 -0.22 0.01 0.00 2.57 0.00 0.00 27.41 30.66 2wz1 h HIS 492 CO 1.32 0.32 -0.82 0.00 -3.07 0.00 0.00 177.93 175.69 2wz1 h ALA 493 N 1.39 0.28 -0.57 6.11 0.00 -1.88 -1.89 119.26 122.70 2wz1 h ALA 493 Ca 0.34 -0.62 0.03 0.00 0.00 0.00 0.00 54.91 54.66 2wz1 h ALA 493 Cb 0.26 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2wz1 h ALA 493 CO -0.21 0.68 0.33 -0.09 0.00 0.00 0.00 179.25 179.96 2wz1 h ARG 494 N 0.53 0.63 -0.56 0.00 2.43 -1.64 -0.86 114.38 114.91 2wz1 h ARG 494 Ca -0.06 -0.04 -0.07 0.00 -0.81 0.00 0.00 59.98 58.99 2wz1 h ARG 494 Cb 1.46 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.84 2wz1 h ARG 494 CO 0.17 0.42 0.06 0.77 -1.51 0.00 0.00 179.97 179.88 2wz1 h SER 495 N 0.65 0.91 0.07 -3.80 0.02 -1.17 -1.25 113.55 108.97 2wz1 h SER 495 Ca 0.24 -0.28 -0.16 0.00 -0.84 0.00 0.00 61.79 60.75 2wz1 h SER 495 Cb 0.06 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 2wz1 h SER 495 CO -0.12 0.96 -0.55 0.40 -1.14 0.00 0.00 176.83 176.38 2wz1 h ILE 496 N 0.84 1.33 -0.43 3.27 1.08 -1.06 -1.82 117.51 120.70 2wz1 h ILE 496 Ca 0.17 -1.80 -0.09 0.00 -0.39 0.00 0.00 64.86 62.74 2wz1 h ILE 496 Cb 0.46 1.79 -0.01 0.00 -3.07 0.00 0.00 36.82 35.98 2wz1 h ILE 496 CO 0.02 0.56 -0.08 0.00 -0.69 0.00 0.00 178.15 177.95 2wz1 h HIS 498 N 0.65 0.90 -0.47 0.00 3.86 -1.15 -1.92 115.15 117.01 2wz1 h HIS 498 Ca 0.11 -0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 2wz1 h HIS 498 Cb 0.61 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 2wz1 h HIS 498 CO 0.05 0.70 0.21 1.25 0.86 0.00 0.00 177.93 181.00 2wz1 h LEU 499 N 0.87 0.63 -0.52 2.43 5.85 -0.94 -2.32 115.31 121.31 2wz1 h LEU 499 Ca 0.20 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.79 2wz1 h LEU 499 Cb 0.20 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2wz1 h LEU 499 CO -0.02 0.61 0.32 0.00 -0.34 0.00 0.00 178.44 179.01 2wz1 h ALA 500 N 1.05 0.67 -0.87 1.25 0.00 -0.60 0.97 119.26 121.74 2wz1 h ALA 500 Ca 0.16 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.08 2wz1 h ALA 500 Cb 0.15 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 2wz1 h ALA 500 CO -0.02 0.05 0.56 -0.07 0.00 0.00 0.00 179.25 179.77 2wz1 h LEU 501 N 0.65 0.93 -0.61 0.00 3.38 -1.20 -1.52 115.31 116.93 2wz1 h LEU 501 Ca 0.20 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 58.02 2wz1 h LEU 501 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2wz1 h LEU 501 CO -0.08 0.64 -0.45 0.44 0.09 0.00 0.00 178.44 179.09 2wz1 h ASP 502 N 1.09 0.62 -0.60 -0.43 3.32 -0.80 -2.77 116.42 116.85 2wz1 h ASP 502 Ca 0.34 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2wz1 h ASP 502 Cb 0.00 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 2wz1 h ASP 502 CO -0.11 0.98 0.29 0.24 -1.72 0.00 0.00 179.24 178.92 2wz1 h MET 503 N 0.47 0.86 -0.68 3.56 2.86 -0.56 -1.57 114.93 119.86 2wz1 h MET 503 Ca 0.03 -0.12 0.05 0.00 -2.06 0.00 0.00 59.70 57.60 2wz1 h MET 503 Cb 0.96 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 32.42 2wz1 h MET 503 CO 0.09 0.69 0.40 1.98 1.06 0.00 0.00 176.91 181.12 2wz1 h MET 504 N 0.81 0.74 -0.36 1.72 -1.53 -1.17 -1.40 114.93 113.74 2wz1 h MET 504 Ca 0.21 -0.04 -0.13 0.00 -3.44 0.00 0.00 59.70 56.30 2wz1 h MET 504 Cb 0.11 -0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 30.98 2wz1 h MET 504 CO -0.03 0.49 -0.27 0.93 0.14 0.00 0.00 176.91 178.18 2wz1 h GLU 505 N 0.76 0.82 0.00 0.39 5.08 -1.24 -3.23 114.58 117.15 2wz1 h GLU 505 Ca 0.29 -0.40 -0.16 0.00 -1.00 0.00 0.00 59.36 58.10 2wz1 h GLU 505 Cb 0.11 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2wz1 h GLU 505 CO -0.15 1.03 -0.75 0.97 -1.00 0.00 0.00 179.01 179.11 2wz1 h ILE 506 N 0.61 1.44 -0.15 3.13 2.10 -1.04 -2.94 117.51 120.65 2wz1 h ILE 506 Ca 0.07 -2.65 0.01 0.00 1.08 0.00 0.00 64.86 63.37 2wz1 h ILE 506 Cb 0.84 2.47 -0.01 0.00 -1.09 0.00 0.00 36.82 39.03 2wz1 h ILE 506 CO 0.07 0.73 0.10 0.00 -1.08 0.00 0.00 178.15 177.97 2wz1 h ALA 507 N 1.25 1.95 0.00 0.18 0.00 -1.28 -0.57 119.26 120.80 2wz1 h ALA 507 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2wz1 h ALA 507 Cb 1.41 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2wz1 h ALA 507 CO 0.10 0.04 0.04 0.78 0.00 0.00 0.00 179.25 180.20 2wz1 h GLY 508 N 0.16 0.00 2.00 0.00 0.00 -1.60 -1.64 103.07 101.99 2wz1 h GLY 508 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.38 2wz1 h GLY 508 CO -0.01 0.00 -0.06 1.46 0.00 0.00 0.00 176.54 177.93 2wz1 h GLN 509 N 0.00 0.00 -6.03 4.80 4.20 -1.29 -3.44 115.11 113.34 2wz1 h GLN 509 Ca 0.00 0.00 -0.57 0.00 0.06 0.00 0.00 58.65 58.14 2wz1 h GLN 509 Cb 0.07 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.79 2wz1 h GLN 509 CO 0.00 0.06 -0.01 0.08 -0.67 0.00 0.00 178.83 178.28 2wz1 s VAL 510 N -3.62 4.97 -0.05 -0.54 1.01 -0.62 -5.03 120.40 116.52 2wz1 s VAL 510 Ca 0.02 1.24 0.03 0.00 0.00 0.00 0.00 61.98 63.27 2wz1 s VAL 510 Cb 0.09 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 32.54 2wz1 s VAL 510 CO 0.58 0.38 -0.15 -1.10 0.00 0.00 0.00 175.10 174.80 2wz1 s GLN 511 N 0.09 1.75 -0.08 2.72 -1.52 -1.26 -1.03 119.66 120.33 2wz1 s GLN 511 Ca 0.32 -0.53 0.01 0.00 -1.95 0.00 0.00 55.36 53.21 2wz1 s GLN 511 Cb -0.18 -1.48 0.02 0.00 -0.22 0.00 0.00 33.01 31.15 2wz1 s GLN 511 CO 0.16 0.15 -0.09 0.08 -0.25 0.00 0.00 175.29 175.34 2wz1 s VAL 512 N 0.29 0.98 -1.27 1.09 1.01 -0.44 -4.82 120.40 117.24 2wz1 s VAL 512 Ca -0.09 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 2wz1 s VAL 512 Cb -0.13 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.30 2wz1 s VAL 512 CO 0.03 0.34 0.85 0.47 0.00 0.00 0.00 175.10 176.79 2wz1 n ASP 513 N 4.33 -1.76 -1.85 3.32 8.00 -1.26 -2.07 116.55 125.26 2wz1 n ASP 513 Ca -0.19 -0.72 -0.11 0.00 0.71 0.00 0.00 54.79 54.48 2wz1 n ASP 513 Cb 0.51 -4.55 -0.03 0.00 -0.02 0.00 0.00 41.12 37.03 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 -1.39 0.30 3.18 0.44 0.00 -1.26 -4.98 105.19 101.48 2wz1 n GLY 514 Ca -0.28 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 2wz1 n GLY 514 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wz1 s GLU 515 N -3.91 0.85 0.31 1.61 2.56 -0.88 -5.10 118.70 114.13 2wz1 s GLU 515 Ca 0.00 -1.15 -0.29 0.00 0.00 0.00 0.00 54.97 53.53 2wz1 s GLU 515 Cb 0.00 -0.54 -0.10 0.00 2.00 0.00 0.00 34.13 35.49 2wz1 s GLU 515 CO 0.00 0.08 1.29 -1.12 -0.56 0.00 0.00 175.26 174.95 2wz1 s SER 516 N -2.42 6.85 0.44 -1.70 0.01 -1.26 -1.33 113.70 114.28 2wz1 s SER 516 Ca 0.05 2.60 -0.24 0.00 1.31 0.00 0.00 55.95 59.68 2wz1 s SER 516 Cb -0.03 -2.64 -0.08 0.00 0.21 0.00 0.00 66.02 63.48 2wz1 s SER 516 CO 0.00 -0.49 1.15 -0.69 0.41 0.00 0.00 173.24 173.62 2wz1 s VAL 517 N -0.94 3.20 0.02 3.43 1.01 -0.20 -4.88 120.40 122.04 2wz1 s VAL 517 Ca 0.50 0.93 0.07 0.00 0.00 0.00 0.00 61.98 63.47 2wz1 s VAL 517 Cb -0.38 -3.48 -0.03 0.00 0.00 0.00 0.00 36.38 32.48 2wz1 s VAL 517 CO 0.49 0.01 -0.18 -1.58 0.00 0.00 0.00 175.10 173.84 2wz1 s GLN 518 N -2.58 2.15 0.24 2.72 0.74 -1.26 -4.46 119.66 117.21 2wz1 s GLN 518 Ca 0.61 -0.93 0.08 0.00 0.05 0.00 0.00 55.36 55.18 2wz1 s GLN 518 Cb -0.28 -2.21 -0.05 0.00 1.10 0.00 0.00 33.01 31.57 2wz1 s GLN 518 CO 0.35 0.56 -0.13 0.96 -0.55 0.00 0.00 175.29 176.48 2wz1 s ILE 519 N -0.86 1.81 -0.03 -2.34 -4.36 -1.26 -0.59 121.20 113.57 2wz1 s ILE 519 Ca 0.14 -2.21 0.04 0.00 -0.26 0.00 0.00 60.65 58.35 2wz1 s ILE 519 Cb -0.10 -2.19 -0.00 0.00 1.25 0.00 0.00 42.46 41.41 2wz1 s ILE 519 CO 0.04 -0.49 -0.14 -0.89 0.24 0.00 0.00 174.94 173.70 2wz1 s THR 520 N -2.92 1.19 -0.03 8.37 2.01 -0.38 -2.86 115.64 121.01 2wz1 s THR 520 Ca 0.25 -0.61 0.07 0.00 0.31 0.00 0.00 61.69 61.72 2wz1 s THR 520 Cb -0.00 -1.02 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 2wz1 s THR 520 CO 0.09 0.35 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.48 2wz1 s ILE 521 N -0.07 2.03 -0.04 1.82 1.01 -0.63 -0.93 121.20 124.41 2wz1 s ILE 521 Ca -0.00 -1.09 0.06 0.00 0.00 0.00 0.00 60.65 59.62 2wz1 s ILE 521 Cb -0.09 -1.69 -0.02 0.00 0.01 0.00 0.00 42.46 40.67 2wz1 s ILE 521 CO 0.01 0.57 -0.22 -0.83 0.00 0.00 0.00 174.94 174.47 2wz1 s GLY 522 N -0.48 1.36 -0.05 6.18 0.00 -0.14 -0.83 107.32 113.36 2wz1 s GLY 522 Ca 0.06 -1.06 0.01 0.00 0.00 0.00 0.00 44.72 43.73 2wz1 s GLY 522 CO 0.00 -0.83 -0.04 -0.42 0.00 0.00 0.00 173.10 171.81 2wz1 s ILE 523 N -0.57 0.55 0.08 0.90 1.01 -0.03 -1.47 121.20 121.67 2wz1 s ILE 523 Ca 0.08 -0.12 -0.06 0.00 0.00 0.00 0.00 60.65 60.56 2wz1 s ILE 523 Cb -0.11 -0.58 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 2wz1 s ILE 523 CO 0.00 0.23 0.12 -2.28 0.00 0.00 0.00 174.94 173.01 2wz1 s HIS 524 N 0.99 0.30 -0.01 3.97 2.46 -0.94 -0.75 115.29 121.30 2wz1 s HIS 524 Ca -0.10 -0.77 0.04 0.00 0.47 0.00 0.00 55.06 54.70 2wz1 s HIS 524 Cb -0.14 -0.18 -0.01 0.00 -0.13 0.00 0.00 32.58 32.12 2wz1 s HIS 524 CO -0.00 -0.49 -0.13 0.99 -2.47 0.00 0.00 174.74 172.64 2wz1 s THR 525 N -3.89 1.02 -1.70 0.89 2.01 -1.26 -1.19 115.64 111.52 2wz1 s THR 525 Ca 0.06 -0.54 0.00 0.00 0.31 0.00 0.00 61.69 61.53 2wz1 s THR 525 Cb 0.06 -0.86 0.00 0.00 0.01 0.00 0.00 72.50 71.71 2wz1 s THR 525 CO -0.10 0.29 0.00 0.61 -0.69 0.00 0.00 174.62 174.73 2wz1 n GLY 526 N 2.87 -0.82 3.88 4.40 0.00 -0.26 -4.72 105.19 110.53 2wz1 n GLY 526 Ca -0.15 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.68 3.79 -0.00 1.61 -1.05 -1.26 -2.32 118.70 118.78 2wz1 s GLU 527 Ca 0.00 0.26 0.00 0.00 -0.15 0.00 0.00 54.97 55.08 2wz1 s GLU 527 Cb 0.00 -2.64 0.00 0.00 -0.44 0.00 0.00 34.13 31.05 2wz1 s GLU 527 CO 0.00 0.31 0.00 0.08 0.95 0.00 0.00 175.26 176.60 2wz1 s VAL 528 N -1.84 0.02 -0.18 1.83 1.01 -0.14 -4.26 120.40 116.83 2wz1 s VAL 528 Ca 0.47 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 62.37 2wz1 s VAL 528 Cb -0.11 -0.03 -0.05 0.00 0.00 0.00 0.00 36.38 36.19 2wz1 s VAL 528 CO 0.22 0.01 0.13 -0.69 0.00 0.00 0.00 175.10 174.77 2wz1 s VAL 529 N 0.10 5.38 0.23 2.92 1.01 -0.79 -0.47 120.40 128.77 2wz1 s VAL 529 Ca -0.01 0.18 0.11 0.00 0.00 0.00 0.00 61.98 62.26 2wz1 s VAL 529 Cb -0.01 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 2wz1 s VAL 529 CO -0.00 0.48 -0.22 0.42 0.00 0.00 0.00 175.10 175.78 2wz1 s THR 530 N 0.08 2.37 -0.04 3.92 -4.23 -0.13 0.09 115.64 117.70 2wz1 s THR 530 Ca 0.09 -2.20 -0.31 0.00 -1.18 0.00 0.00 61.69 58.09 2wz1 s THR 530 Cb -0.11 -2.19 0.12 0.00 1.34 0.00 0.00 72.50 71.66 2wz1 s THR 530 CO -0.01 -0.27 1.29 -0.83 -0.54 0.00 0.00 174.62 174.27 2wz1 s GLY 531 N -3.07 -0.41 -0.27 3.99 0.00 -0.81 -2.12 107.32 104.63 2wz1 s GLY 531 Ca 0.25 0.81 -0.09 0.00 0.00 0.00 0.00 44.72 45.69 2wz1 s GLY 531 CO 0.12 0.17 0.13 0.14 0.00 0.00 0.00 173.10 173.66 2wz1 s VAL 532 N -2.39 4.81 -0.20 1.40 1.01 -1.26 -0.29 120.40 123.47 2wz1 s VAL 532 Ca 0.14 -0.04 -0.09 0.00 0.00 0.00 0.00 61.98 61.99 2wz1 s VAL 532 Cb 0.04 -3.29 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 2wz1 s VAL 532 CO -0.04 0.27 0.10 -0.63 0.00 0.00 0.00 175.10 174.80 2wz1 s ILE 533 N 1.68 5.08 0.00 2.22 -1.09 0.19 -4.78 121.20 124.50 2wz1 s ILE 533 Ca 0.07 0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.56 2wz1 s ILE 533 Cb -0.16 -3.31 0.00 0.00 -1.58 0.00 0.00 42.46 37.41 2wz1 s ILE 533 CO 0.07 0.43 0.00 0.61 -1.23 0.00 0.00 174.94 174.82 2wz1 n GLY 534 N 3.69 2.24 0.12 6.18 0.00 -1.26 -0.51 105.19 115.66 2wz1 n GLY 534 Ca -0.16 -1.81 -0.23 0.00 0.00 0.00 0.00 46.02 43.82 2wz1 n GLY 534 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2wz1 n GLN 535 N 1.92 0.57 -2.71 1.61 7.27 -1.26 -4.07 117.38 120.70 2wz1 n GLN 535 Ca 0.00 0.30 -0.41 0.00 0.07 0.00 0.00 57.00 56.96 2wz1 n GLN 535 Cb 0.00 -1.52 -0.04 0.00 2.41 0.00 0.00 30.24 31.09 2wz1 n GLN 535 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 2wz1 s ARG 536 N -2.56 4.70 -1.24 3.69 0.52 -1.26 -4.23 118.95 118.56 2wz1 s ARG 536 Ca -0.35 1.47 -0.07 0.00 -0.52 0.00 0.00 55.73 56.27 2wz1 s ARG 536 Cb 0.11 -3.37 0.01 0.00 0.52 0.00 0.00 34.95 32.22 2wz1 s ARG 536 CO 0.48 0.22 1.08 -0.12 0.02 0.00 0.00 175.30 176.97 2wz1 n MET 537 N 2.71 -7.24 -1.62 3.54 1.56 -1.26 -4.91 117.12 109.89 2wz1 n MET 537 Ca 0.02 0.77 -0.40 0.00 -0.27 0.00 0.00 57.70 57.83 2wz1 n MET 537 Cb 0.49 -5.64 0.03 0.00 2.15 0.00 0.00 33.22 30.25 2wz1 n MET 537 CO 0.00 0.00 0.00 -2.30 -0.73 0.00 0.00 175.97 172.94 2wz1 n PRO 538 N -4.58 1.24 -3.85 2.12 -0.02 -1.26 -4.88 135.00 123.77 2wz1 n PRO 538 Ca -0.03 0.45 -0.13 0.00 -2.02 0.00 0.00 63.50 61.78 2wz1 n PRO 538 Cb 0.57 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.76 2wz1 n PRO 538 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2wz1 s ARG 539 N -2.36 0.00 -0.22 -0.52 3.52 0.34 -4.89 118.95 114.82 2wz1 s ARG 539 Ca 0.68 0.05 -0.29 0.00 -0.13 0.00 0.00 55.73 56.05 2wz1 s ARG 539 Cb -0.49 -0.05 -0.00 0.00 -1.56 0.00 0.00 34.95 32.85 2wz1 s ARG 539 CO 0.53 -0.04 1.19 -0.47 -0.81 0.00 0.00 175.30 175.70 2wz1 s TYR 540 N 0.24 2.99 0.13 5.12 5.04 -1.26 0.57 117.35 130.19 2wz1 s TYR 540 Ca -0.02 1.14 0.04 0.00 -2.44 0.00 0.00 57.07 55.79 2wz1 s TYR 540 Cb -0.03 -3.52 -0.04 0.00 0.35 0.00 0.00 41.96 38.72 2wz1 s TYR 540 CO -0.01 -1.27 -0.10 0.00 -1.34 0.00 0.00 175.55 172.84 2wz1 s LEU 542 N -2.95 2.92 0.20 0.00 1.02 -1.26 -1.93 118.68 116.68 2wz1 s LEU 542 Ca 0.13 -0.22 0.08 0.00 0.02 0.00 0.00 54.13 54.14 2wz1 s LEU 542 Cb 0.01 -1.66 -0.05 0.00 0.02 0.00 0.00 46.19 44.51 2wz1 s LEU 542 CO 0.00 0.21 -0.15 -0.36 0.02 0.00 0.00 176.35 176.07 2wz1 s PHE 543 N 0.09 1.71 0.00 0.29 0.40 0.11 -4.99 117.98 115.59 2wz1 s PHE 543 Ca -0.04 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.72 2wz1 s PHE 543 Cb -0.14 -0.80 0.00 0.00 0.51 0.00 0.00 43.02 42.59 2wz1 s PHE 543 CO 0.04 0.35 0.00 0.41 0.70 0.00 0.00 175.22 176.72 2wz1 n GLY 544 N -0.32 1.73 0.26 4.36 0.00 -1.26 -1.89 105.19 108.06 2wz1 n GLY 544 Ca -0.08 -2.23 0.13 0.00 0.00 0.00 0.00 46.02 43.84 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 0.00 -0.48 1.61 -1.24 -1.99 -2.16 115.58 111.33 2wz1 h ASN 545 Ca 0.00 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 56.94 2wz1 h ASN 545 Cb 0.00 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.03 2wz1 h ASN 545 CO 0.00 0.13 0.02 0.74 -1.29 0.00 0.00 177.43 177.03 2wz1 h THR 546 N 0.00 1.26 -0.13 -3.57 2.02 -1.88 0.23 112.91 110.84 2wz1 h THR 546 Ca -0.00 -1.02 -0.00 0.00 0.77 0.00 0.00 66.41 66.15 2wz1 h THR 546 Cb 0.45 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 2wz1 h THR 546 CO 0.02 0.36 0.08 0.58 0.37 0.00 0.00 175.52 176.92 2wz1 h VAL 547 N 0.69 1.06 -0.21 3.16 2.07 -1.69 -1.44 116.25 119.89 2wz1 h VAL 547 Ca 0.14 -0.16 0.03 0.00 0.82 0.00 0.00 66.70 67.53 2wz1 h VAL 547 Cb 0.48 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 2wz1 h VAL 547 CO 0.02 0.06 0.05 -1.13 0.02 0.00 0.00 177.57 176.59 2wz1 h ASN 548 N 0.14 0.03 0.27 0.57 -1.24 -0.99 -1.81 115.58 112.56 2wz1 h ASN 548 Ca 0.05 0.03 -0.07 0.00 0.71 0.00 0.00 56.30 57.02 2wz1 h ASN 548 Cb 0.03 0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.10 2wz1 h ASN 548 CO -0.01 0.05 -0.30 -0.07 -1.29 0.00 0.00 177.43 175.81 2wz1 h LEU 549 N 0.13 0.06 -0.40 0.34 3.38 -0.48 -0.86 115.31 117.48 2wz1 h LEU 549 Ca 0.09 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 2wz1 h LEU 549 Cb 0.08 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2wz1 h LEU 549 CO -0.12 0.36 -0.13 0.74 0.09 0.00 0.00 178.44 179.38 2wz1 h THR 550 N 0.05 1.28 -0.70 0.22 2.02 -0.93 0.88 112.91 115.73 2wz1 h THR 550 Ca 0.01 -1.24 0.00 0.00 0.77 0.00 0.00 66.41 65.95 2wz1 h THR 550 Cb 0.56 1.25 -0.03 0.00 -1.74 0.00 0.00 68.15 68.18 2wz1 h THR 550 CO 0.04 0.41 0.45 -1.28 0.37 0.00 0.00 175.52 175.52 2wz1 h SER 551 N 0.60 0.81 0.13 4.18 0.87 -0.92 -1.86 113.55 117.35 2wz1 h SER 551 Ca 0.10 -0.03 -0.13 0.00 -1.23 0.00 0.00 61.79 60.50 2wz1 h SER 551 Cb 0.66 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.41 2wz1 h SER 551 CO 0.05 0.60 -0.45 0.03 -0.53 0.00 0.00 176.83 176.52 2wz1 h ARG 552 N 0.94 0.39 -0.94 2.24 3.08 -1.02 0.08 114.38 119.15 2wz1 h ARG 552 Ca 0.25 -0.21 0.04 0.00 0.07 0.00 0.00 59.98 60.14 2wz1 h ARG 552 Cb -0.09 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 29.91 2wz1 h ARG 552 CO -0.05 0.76 0.61 1.15 -1.07 0.00 0.00 179.97 181.38 2wz1 h THR 553 N 0.31 1.16 -0.04 2.04 2.02 -0.26 0.39 112.91 118.53 2wz1 h THR 553 Ca 0.02 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 66.76 2wz1 h THR 553 Cb 0.92 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 67.21 2wz1 h THR 553 CO 0.08 0.21 -0.15 -0.08 0.37 0.00 0.00 175.52 175.95 2wz1 h GLU 554 N 1.17 0.17 0.00 6.66 4.22 -0.99 -2.71 114.58 123.09 2wz1 h GLU 554 Ca 0.37 -0.13 -0.09 0.00 0.08 0.00 0.00 59.36 59.59 2wz1 h GLU 554 Cb 0.02 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2wz1 h GLU 554 CO -0.12 0.77 -0.45 1.79 -2.18 0.00 0.00 179.01 178.83 2wz1 h THR 555 N -0.41 1.00 -0.25 0.32 1.35 -0.82 -1.85 112.91 112.25 2wz1 h THR 555 Ca -0.01 -1.77 0.00 0.00 -0.55 0.00 0.00 66.41 64.08 2wz1 h THR 555 Cb 0.80 2.06 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 2wz1 h THR 555 CO 0.03 0.44 0.00 0.35 -0.25 0.00 0.00 175.52 176.09 2wz1 n THR 556 N -3.53 0.33 -2.21 6.82 -2.24 0.11 -4.99 114.28 108.58 2wz1 n THR 556 Ca -0.00 -0.43 -0.34 0.00 -2.27 0.00 0.00 64.05 61.00 2wz1 n THR 556 Cb 0.57 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 69.18 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 -1.38 2.48 0.18 3.38 0.00 -0.70 -4.98 107.32 106.31 2wz1 s GLY 557 Ca 0.31 0.70 -0.31 0.00 0.00 0.00 0.00 44.72 45.42 2wz1 s GLY 557 CO 0.24 1.04 1.43 1.85 0.00 0.00 0.00 173.10 177.66 2wz1 s GLU 558 N -3.49 4.29 0.24 2.90 2.12 -1.26 -4.94 118.70 118.57 2wz1 s GLU 558 Ca 0.70 2.21 -0.31 0.00 0.36 0.00 0.00 54.97 57.92 2wz1 s GLU 558 Cb -0.21 -3.18 -0.12 0.00 0.26 0.00 0.00 34.13 30.88 2wz1 s GLU 558 CO 0.29 -0.44 1.65 1.63 -0.54 0.00 0.00 175.26 177.85 2wz1 n LYS 559 N 3.27 2.69 -0.74 4.30 4.76 -1.26 -2.44 118.16 128.75 2wz1 n LYS 559 Ca 0.10 0.97 0.00 0.00 -2.87 0.00 0.00 58.31 56.50 2wz1 n LYS 559 Cb 0.41 -2.78 0.00 0.00 -1.84 0.00 0.00 35.03 30.82 2wz1 n LYS 559 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2wz1 n GLY 560 N 3.11 0.83 3.63 0.72 0.00 -1.14 -5.02 105.19 107.34 2wz1 n GLY 560 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.26 2.23 -0.42 1.61 -0.14 -1.02 -4.90 119.74 116.83 2wz1 s LYS 561 Ca 0.00 -1.48 -0.19 0.00 -1.36 0.00 0.00 55.97 52.93 2wz1 s LYS 561 Cb 0.00 -2.11 0.02 0.00 -1.68 0.00 0.00 37.83 34.06 2wz1 s LYS 561 CO 0.00 0.33 0.57 0.42 -0.76 0.00 0.00 175.35 175.90 2wz1 s ILE 562 N -2.36 4.93 -0.28 2.17 1.01 -1.26 -1.60 121.20 123.80 2wz1 s ILE 562 Ca 0.32 -0.00 -0.10 0.00 0.00 0.00 0.00 60.65 60.86 2wz1 s ILE 562 Cb -0.06 -4.13 -0.04 0.00 0.01 0.00 0.00 42.46 38.24 2wz1 s ILE 562 CO 0.20 -0.51 0.17 0.20 0.00 0.00 0.00 174.94 175.00 2wz1 s ASN 563 N 1.92 5.82 -0.14 3.58 0.01 -0.01 -1.34 114.94 124.78 2wz1 s ASN 563 Ca 0.19 -0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.24 2wz1 s ASN 563 Cb -0.15 -2.08 0.00 0.00 0.41 0.00 0.00 41.25 39.44 2wz1 s ASN 563 CO 0.17 -0.08 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.79 2wz1 s VAL 564 N 1.72 2.23 0.80 1.60 1.01 0.65 -0.86 120.40 127.55 2wz1 s VAL 564 Ca 0.07 -0.93 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 2wz1 s VAL 564 Cb -0.16 -1.90 0.07 0.00 0.00 0.00 0.00 36.38 34.39 2wz1 s VAL 564 CO 0.09 0.54 1.09 -0.94 0.00 0.00 0.00 175.10 175.88 2wz1 s SER 565 N 0.73 4.33 0.53 3.32 1.04 0.07 -1.06 113.70 122.67 2wz1 s SER 565 Ca -0.09 1.73 0.20 0.00 0.48 0.00 0.00 55.95 58.27 2wz1 s SER 565 Cb -0.16 -2.43 1.37 0.00 0.10 0.00 0.00 66.02 64.90 2wz1 s SER 565 CO 0.00 -2.13 2.14 1.05 0.98 0.00 0.00 173.24 175.28 2wz1 h GLU 566 N -1.19 0.00 -0.24 4.02 4.11 -1.40 -0.52 114.58 119.35 2wz1 h GLU 566 Ca -0.45 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.92 2wz1 h GLU 566 Cb 1.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 2wz1 h GLU 566 CO 0.52 0.00 -0.09 1.88 0.07 0.00 0.00 179.01 181.40 2wz1 h TYR 567 N 0.00 0.56 -0.50 2.06 0.05 -1.90 -1.33 116.97 115.90 2wz1 h TYR 567 Ca 0.04 -0.13 -0.02 0.00 0.05 0.00 0.00 58.73 58.67 2wz1 h TYR 567 Cb 0.18 -0.13 -0.02 0.00 1.01 0.00 0.00 36.73 37.76 2wz1 h TYR 567 CO 0.00 0.74 0.22 1.15 -1.05 0.00 0.00 178.16 179.21 2wz1 h THR 568 N 0.22 1.21 -0.62 -2.88 2.02 -1.72 -2.87 112.91 108.25 2wz1 h THR 568 Ca 0.06 -0.61 0.11 0.00 0.77 0.00 0.00 66.41 66.73 2wz1 h THR 568 Cb 0.57 0.68 -0.08 0.00 -1.74 0.00 0.00 68.15 67.58 2wz1 h THR 568 CO 0.03 0.24 0.18 0.22 0.37 0.00 0.00 175.52 176.56 2wz1 h TYR 569 N 0.67 0.30 -0.41 3.16 3.20 -0.97 -1.46 116.97 121.47 2wz1 h TYR 569 Ca 0.17 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.00 2wz1 h TYR 569 Cb 0.16 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 2wz1 h TYR 569 CO 0.00 0.02 -0.04 0.00 -1.64 0.00 0.00 178.16 176.51 2wz1 h ARG 570 N 0.33 0.68 -0.82 1.82 3.08 -1.17 -1.72 114.38 116.58 2wz1 h ARG 570 Ca 0.33 -0.18 0.02 0.00 0.07 0.00 0.00 59.98 60.22 2wz1 h ARG 570 Cb 0.46 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.39 2wz1 h ARG 570 CO -0.37 0.72 0.53 0.00 -1.07 0.00 0.00 179.97 179.78 2wz1 n LEU 572 N -4.55 0.00 -0.86 0.00 4.77 -0.64 -2.08 117.00 113.64 2wz1 n LEU 572 Ca 0.09 0.50 0.11 0.00 -0.03 0.00 0.00 56.01 56.68 2wz1 n LEU 572 Cb 0.05 -0.50 0.28 0.00 -2.33 0.00 0.00 43.42 40.93 2wz1 n LEU 572 CO 0.35 -0.29 0.73 0.23 -1.33 0.00 0.00 177.39 177.08 2wz1 n MET 573 N -1.50 2.12 -4.39 3.23 2.81 -0.95 -3.84 117.12 114.60 2wz1 n MET 573 Ca 0.03 -1.69 -0.26 0.00 -1.81 0.00 0.00 57.70 53.97 2wz1 n MET 573 Cb 0.14 -1.45 -0.10 0.00 -0.71 0.00 0.00 33.22 31.10 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 -1.49 3.74 0.53 7.83 1.04 -0.89 -4.97 113.70 119.50 2wz1 s SER 574 Ca 0.35 -0.82 0.34 0.00 0.48 0.00 0.00 55.95 56.31 2wz1 s SER 574 Cb 0.20 -0.42 1.56 0.00 0.10 0.00 0.00 66.02 67.46 2wz1 s SER 574 CO 0.28 0.09 2.03 1.55 0.98 0.00 0.00 173.24 178.17 2wz1 h PRO 575 N 2.83 0.00 0.00 4.02 0.13 -1.91 -0.27 132.00 136.80 2wz1 h PRO 575 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 2wz1 h PRO 575 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2wz1 h PRO 575 CO 0.53 0.00 -0.26 0.93 -0.23 0.00 0.00 178.00 178.97 2wz1 h GLU 576 N 0.00 0.00 0.00 0.86 3.07 -1.91 -3.33 114.58 113.27 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 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 2wz1 h GLU 576 CO 0.00 0.26 0.00 0.09 -1.40 0.00 0.00 179.01 177.96 2wz1 n ASN 577 N -3.72 0.41 -4.81 1.42 3.02 -0.81 -4.16 115.26 106.61 2wz1 n ASN 577 Ca -0.01 -0.79 -0.31 0.00 -0.03 0.00 0.00 54.58 53.44 2wz1 n ASN 577 Cb 0.37 0.18 0.06 0.00 -0.61 0.00 0.00 39.78 39.77 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 -0.18 5.24 -0.23 6.41 1.04 -0.18 -4.13 113.70 121.68 2wz1 s SER 578 Ca 0.00 1.66 -0.10 0.00 0.48 0.00 0.00 55.95 57.99 2wz1 s SER 578 Cb 0.00 -2.50 0.09 0.00 0.10 0.00 0.00 66.02 63.71 2wz1 s SER 578 CO 0.00 -1.54 0.52 -0.62 0.98 0.00 0.00 173.24 172.58 2wz1 s ASP 579 N -3.70 -0.64 0.57 7.02 -1.08 -1.26 -4.99 116.67 112.59 2wz1 s ASP 579 Ca 0.59 1.19 0.37 0.00 -0.52 0.00 0.00 52.55 54.18 2wz1 s ASP 579 Cb -0.15 1.41 2.01 0.00 -1.46 0.00 0.00 42.92 44.73 2wz1 s ASP 579 CO 0.55 -0.22 2.13 1.55 0.52 0.00 0.00 175.17 179.69 2wz1 h PRO 580 N 7.64 0.00 0.00 4.34 0.13 -1.98 -2.22 132.00 139.91 2wz1 h PRO 580 Ca -0.24 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.86 2wz1 h PRO 580 Cb 1.15 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 2wz1 h PRO 580 CO 0.17 0.00 -0.14 1.96 -0.23 0.00 0.00 178.00 179.76 2wz1 h GLN 581 N 0.00 0.00 -6.39 0.86 4.20 -1.98 -3.45 115.11 108.35 2wz1 h GLN 581 Ca 0.00 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.17 2wz1 h GLN 581 Cb 0.08 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 2wz1 h GLN 581 CO 0.00 0.14 0.13 -0.06 -0.67 0.00 0.00 178.83 178.36 2wz1 s PHE 582 N -3.86 3.83 -0.16 2.96 0.08 -0.84 -1.04 117.98 118.96 2wz1 s PHE 582 Ca -0.01 1.51 -0.00 0.00 0.12 0.00 0.00 56.93 58.54 2wz1 s PHE 582 Cb 0.11 -2.72 -0.00 0.00 -0.57 0.00 0.00 43.02 39.83 2wz1 s PHE 582 CO 0.59 0.46 -0.13 -1.58 -0.10 0.00 0.00 175.22 174.45 2wz1 s HIS 583 N -0.81 2.81 -0.19 0.36 5.65 -0.06 -4.68 115.29 118.38 2wz1 s HIS 583 Ca 0.35 -0.99 0.00 0.00 0.25 0.00 0.00 55.06 54.67 2wz1 s HIS 583 Cb -0.22 -1.92 0.02 0.00 -1.18 0.00 0.00 32.58 29.29 2wz1 s HIS 583 CO 0.24 -0.46 -0.16 -0.51 -0.65 0.00 0.00 174.74 173.20 2wz1 s LEU 584 N 0.86 2.38 -0.11 8.88 1.43 -1.26 -1.01 118.68 129.86 2wz1 s LEU 584 Ca -0.04 -0.67 -0.00 0.00 -1.03 0.00 0.00 54.13 52.38 2wz1 s LEU 584 Cb -0.15 -1.53 -0.02 0.00 0.03 0.00 0.00 46.19 44.51 2wz1 s LEU 584 CO -0.00 -0.02 -0.09 -0.70 0.23 0.00 0.00 176.35 175.77 2wz1 s GLU 585 N 1.31 3.18 0.20 1.70 2.12 -0.21 -4.93 118.70 122.07 2wz1 s GLU 585 Ca 0.04 -0.59 -0.30 0.00 0.36 0.00 0.00 54.97 54.47 2wz1 s GLU 585 Cb -0.14 -2.67 -0.09 0.00 0.26 0.00 0.00 34.13 31.49 2wz1 s GLU 585 CO -0.11 0.41 1.27 -1.58 -0.54 0.00 0.00 175.26 174.71 2wz1 s HIS 586 N -0.13 3.31 -0.14 5.30 5.65 -1.26 -0.00 115.29 128.02 2wz1 s HIS 586 Ca 0.01 1.31 -0.10 0.00 0.25 0.00 0.00 55.06 56.53 2wz1 s HIS 586 Cb -0.13 -3.54 -0.03 0.00 -1.18 0.00 0.00 32.58 27.69 2wz1 s HIS 586 CO 0.03 -1.62 -0.20 -2.13 -0.65 0.00 0.00 174.74 170.17 2wz1 n ARG 587 N 2.43 0.42 -1.95 2.88 0.63 -0.04 -4.82 116.66 116.21 2wz1 n ARG 587 Ca 0.05 0.43 0.00 0.00 -0.92 0.00 0.00 57.85 57.41 2wz1 n ARG 587 Cb 0.43 -1.54 0.00 0.00 0.45 0.00 0.00 32.46 31.80 2wz1 n ARG 587 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2wz1 n GLY 588 N 1.59 -0.74 3.75 5.14 0.00 -1.08 -5.01 105.19 108.85 2wz1 n GLY 588 Ca -0.08 -1.63 -0.40 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.61 4.74 -0.08 1.61 0.04 -1.26 -1.37 135.00 137.07 2wz1 s PRO 589 Ca 0.00 1.63 -0.01 0.00 0.04 0.00 0.00 61.00 62.67 2wz1 s PRO 589 Cb 0.00 -3.25 0.03 0.00 0.04 0.00 0.00 34.50 31.31 2wz1 s PRO 589 CO 0.00 0.33 -0.03 0.08 0.04 0.00 0.00 177.00 177.42 2wz1 s VAL 590 N -0.99 0.64 0.13 -0.36 1.01 0.47 -4.93 120.40 116.37 2wz1 s VAL 590 Ca 0.44 -0.05 -0.31 0.00 0.00 0.00 0.00 61.98 62.06 2wz1 s VAL 590 Cb -0.28 -0.73 -0.08 0.00 0.00 0.00 0.00 36.38 35.29 2wz1 s VAL 590 CO 0.36 0.30 1.30 -0.55 0.00 0.00 0.00 175.10 176.50 2wz1 s SER 591 N 1.77 6.94 -0.04 3.32 0.15 -1.26 -1.03 113.70 123.54 2wz1 s SER 591 Ca 0.03 2.25 -0.02 0.00 0.70 0.00 0.00 55.95 58.92 2wz1 s SER 591 Cb -0.13 -2.59 0.03 0.00 -1.71 0.00 0.00 66.02 61.63 2wz1 s SER 591 CO -0.06 -0.55 0.08 -0.04 1.20 0.00 0.00 173.24 173.87 2wz1 s MET 592 N 0.67 -0.03 0.24 5.44 -1.94 -1.26 -4.94 119.30 117.49 2wz1 s MET 592 Ca 0.60 0.34 -0.31 0.00 -1.71 0.00 0.00 55.69 54.60 2wz1 s MET 592 Cb -0.34 -0.34 -0.13 0.00 2.01 0.00 0.00 34.83 36.03 2wz1 s MET 592 CO 0.32 -0.25 1.48 1.17 -0.01 0.00 0.00 175.02 177.74 2wz1 n LYS 593 N 4.75 2.23 0.00 2.03 4.81 -1.26 -2.63 118.16 128.09 2wz1 n LYS 593 Ca -0.16 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 2wz1 n LYS 593 Cb 0.50 -2.50 0.00 0.00 0.02 0.00 0.00 35.03 33.05 2wz1 n LYS 593 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2wz1 n GLY 594 N 2.33 0.46 2.79 3.14 0.00 -1.26 -4.80 105.19 107.85 2wz1 n GLY 594 Ca 0.11 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.84 0.02 0.06 1.61 2.20 -1.08 -5.03 119.74 116.69 2wz1 s LYS 595 Ca 0.00 0.15 -0.27 0.00 -0.36 0.00 0.00 55.97 55.49 2wz1 s LYS 595 Cb 0.00 -0.26 -0.17 0.00 -1.51 0.00 0.00 37.83 35.89 2wz1 s LYS 595 CO 0.00 -0.14 1.59 -0.22 -0.36 0.00 0.00 175.35 176.22 2wz1 h LYS 596 N 7.17 -0.35 -6.50 4.03 1.63 -1.97 -3.43 116.57 117.15 2wz1 h LYS 596 Ca -0.43 0.02 -0.47 0.00 -0.85 0.00 0.00 60.65 58.92 2wz1 h LYS 596 Cb 1.13 0.08 0.01 0.00 -0.60 0.00 0.00 32.23 32.85 2wz1 h LYS 596 CO 0.48 -0.17 -0.21 -1.21 -3.45 0.00 0.00 179.45 174.90 2wz1 s GLU 597 N -5.78 3.48 0.37 1.90 0.41 -1.26 -5.04 118.70 112.78 2wz1 s GLU 597 Ca -0.15 -0.35 -0.27 0.00 -0.41 0.00 0.00 54.97 53.79 2wz1 s GLU 597 Cb 0.04 -2.68 -0.12 0.00 -1.78 0.00 0.00 34.13 29.60 2wz1 s GLU 597 CO 0.63 0.17 1.24 -2.30 -0.49 0.00 0.00 175.26 174.51 2wz1 n PRO 598 N -1.74 1.95 -2.54 0.39 -0.02 -1.26 -4.78 135.00 126.99 2wz1 n PRO 598 Ca -0.05 0.69 -0.42 0.00 -2.02 0.00 0.00 63.50 61.69 2wz1 n PRO 598 Cb 0.56 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2wz1 n PRO 598 CO 0.00 0.00 0.00 1.41 1.98 0.00 0.00 175.50 178.89 2wz1 s MET 599 N -1.97 4.39 0.00 -0.52 1.75 -0.20 -4.76 119.30 118.00 2wz1 s MET 599 Ca 0.58 1.58 -0.30 0.00 -1.25 0.00 0.00 55.69 56.30 2wz1 s MET 599 Cb -0.56 -3.54 -0.04 0.00 2.84 0.00 0.00 34.83 33.53 2wz1 s MET 599 CO 0.60 -0.38 1.13 -1.14 -0.65 0.00 0.00 175.02 174.58 2wz1 s GLN 600 N 2.04 4.44 0.02 4.11 0.74 -1.26 -0.39 119.66 129.36 2wz1 s GLN 600 Ca 0.53 1.63 0.09 0.00 0.05 0.00 0.00 55.36 57.66 2wz1 s GLN 600 Cb -0.23 -3.44 -0.03 0.00 1.10 0.00 0.00 33.01 30.41 2wz1 s GLN 600 CO 0.21 -0.26 -0.25 0.08 -0.55 0.00 0.00 175.29 174.52 2wz1 s VAL 601 N 1.41 2.19 0.20 1.34 1.01 -0.47 -0.96 120.40 125.13 2wz1 s VAL 601 Ca 0.56 -1.26 0.10 0.00 0.00 0.00 0.00 61.98 61.38 2wz1 s VAL 601 Cb -0.25 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 2wz1 s VAL 601 CO 0.26 0.44 -0.21 0.26 0.00 0.00 0.00 175.10 175.85 2wz1 s TRP 602 N -0.75 2.11 -0.15 5.22 0.52 -0.23 -0.86 118.94 124.81 2wz1 s TRP 602 Ca 0.11 -0.40 -0.07 0.00 0.02 0.00 0.00 56.10 55.77 2wz1 s TRP 602 Cb -0.10 -1.02 -0.04 0.00 -1.15 0.00 0.00 33.47 31.16 2wz1 s TRP 602 CO 0.01 0.48 0.09 -0.06 0.02 0.00 0.00 176.95 177.50 2wz1 s PHE 603 N -2.04 3.39 -0.14 -1.98 0.08 0.99 -0.25 117.98 118.03 2wz1 s PHE 603 Ca 0.21 0.30 -0.06 0.00 0.12 0.00 0.00 56.93 57.50 2wz1 s PHE 603 Cb -0.06 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 2wz1 s PHE 603 CO 0.10 0.44 0.08 -1.17 -0.10 0.00 0.00 175.22 174.57 2wz1 s LEU 604 N -0.36 4.00 0.27 -0.37 2.96 -0.45 -1.04 118.68 123.68 2wz1 s LEU 604 Ca 0.10 0.24 -0.07 0.00 -0.22 0.00 0.00 54.13 54.18 2wz1 s LEU 604 Cb -0.12 -1.98 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 2wz1 s LEU 604 CO 0.02 0.30 0.41 -0.94 -1.32 0.00 0.00 176.35 174.82 2wz1 s SER 605 N -0.39 0.29 -0.03 3.68 1.04 -0.18 -4.46 113.70 113.64 2wz1 s SER 605 Ca 0.10 -1.20 -0.29 0.00 0.48 0.00 0.00 55.95 55.04 2wz1 s SER 605 Cb -0.12 0.58 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 2wz1 s SER 605 CO 0.02 -1.14 0.95 -0.13 0.98 0.00 0.00 173.24 173.92 2wz1 s ARG 606 N -3.71 4.51 0.22 4.02 0.52 -1.26 -0.88 118.95 122.37 2wz1 s ARG 606 Ca 0.28 1.35 -0.09 0.00 -0.52 0.00 0.00 55.73 56.75 2wz1 s ARG 606 Cb 0.01 -3.48 0.36 0.00 0.52 0.00 0.00 34.95 32.35 2wz1 s ARG 606 CO 0.13 -0.10 1.67 0.87 0.02 0.00 0.00 175.30 177.89 2wz1 h LYS 607 N 6.87 0.15 -4.14 3.54 1.79 -1.36 -3.40 116.57 120.03 2wz1 h LYS 607 Ca -0.39 -0.01 -0.50 0.00 -2.18 0.00 0.00 60.65 57.58 2wz1 h LYS 607 Cb 1.20 -0.03 -0.36 0.00 -1.58 0.00 0.00 32.23 31.45 2wz1 h LYS 607 CO 0.77 0.10 -0.79 -0.80 -1.08 0.00 0.00 179.45 177.65 2wz1 s ASN 608 N -5.23 1.89 0.00 0.86 0.01 -1.26 -5.02 114.94 106.18 2wz1 s ASN 608 Ca -0.13 -0.24 0.27 0.00 -0.71 0.00 0.00 52.86 52.05 2wz1 s ASN 608 Cb 0.20 -0.72 0.87 0.00 0.41 0.00 0.00 41.25 42.01 2wz1 s ASN 608 CO 0.74 -0.11 1.64 0.35 -1.51 0.00 0.00 177.10 178.21 2wz1 n THR 609 N 4.76 0.00 1.74 1.60 -2.24 -1.26 -5.14 114.28 113.73 2wz1 n THR 609 Ca -0.14 -0.23 0.15 0.00 -2.27 0.00 0.00 64.05 61.56 2wz1 n THR 609 Cb 0.50 0.56 0.72 0.00 -2.10 0.00 0.00 70.33 70.02 2wz1 n THR 609 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11