#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mz8 n ARG 447 N 0.00 0.14 -0.15 -1.58 1.85 -1.26 -2.36 116.66 113.30 1mz8 n ARG 447 Ca 0.00 0.15 0.12 0.00 -1.00 0.00 0.00 57.85 57.12 1mz8 n ARG 447 Cb 0.00 -1.50 0.19 0.00 -1.05 0.00 0.00 32.46 30.10 1mz8 n ARG 447 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1mz8 n ASN 448 N -1.39 3.36 -4.92 2.89 4.13 -1.26 -0.58 115.26 117.50 1mz8 n ASN 448 Ca 0.07 -1.99 -0.27 0.00 1.68 0.00 0.00 54.58 54.07 1mz8 n ASN 448 Cb 0.17 -0.20 -0.04 0.00 -1.54 0.00 0.00 39.78 38.18 1mz8 n ASN 448 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1mz8 s LYS 449 N -1.56 3.35 1.01 3.52 3.01 -1.00 -4.67 119.74 123.40 1mz8 s LYS 449 Ca 0.36 -0.61 -0.12 0.00 -1.01 0.00 0.00 55.97 54.59 1mz8 s LYS 449 Cb 0.22 -2.93 0.20 0.00 -1.01 0.00 0.00 37.83 34.31 1mz8 s LYS 449 CO 0.31 0.53 1.08 -1.25 0.51 0.00 0.00 175.35 176.53 1mz8 s PRO 450 N -3.08 0.29 0.00 -1.68 0.04 -1.16 -4.27 135.00 125.14 1mz8 s PRO 450 Ca 0.34 0.70 0.00 0.00 0.04 0.00 0.00 61.00 62.08 1mz8 s PRO 450 Cb -0.11 -1.71 0.00 0.00 0.04 0.00 0.00 34.50 32.72 1mz8 s PRO 450 CO 0.28 -2.87 0.00 0.41 0.04 0.00 0.00 177.00 174.86 1mz8 n GLY 451 N -0.59 0.54 3.71 0.56 0.00 -0.78 -4.97 105.19 103.67 1mz8 n GLY 451 Ca 0.05 -0.88 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 1mz8 n GLY 451 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mz8 s LYS 452 N -2.00 3.15 0.28 1.61 3.01 -1.26 -0.28 119.74 124.26 1mz8 s LYS 452 Ca 0.00 -0.35 -0.29 0.00 -1.01 0.00 0.00 55.97 54.32 1mz8 s LYS 452 Cb 0.00 -2.90 -0.09 0.00 -1.01 0.00 0.00 37.83 33.83 1mz8 s LYS 452 CO 0.00 0.68 1.03 0.00 0.51 0.00 0.00 175.35 177.57 1mz8 s ALA 453 N -0.80 3.34 0.11 5.17 0.00 -0.36 -4.75 121.76 124.47 1mz8 s ALA 453 Ca 0.12 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.84 1mz8 s ALA 453 Cb -0.12 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.69 1mz8 s ALA 453 CO 0.02 -0.02 0.02 0.95 0.00 0.00 0.00 175.76 176.74 1mz8 s THR 454 N -1.25 0.23 0.00 0.00 -4.23 -0.85 -0.28 115.64 109.26 1mz8 s THR 454 Ca 0.45 -1.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1mz8 s THR 454 Cb -0.28 -1.90 0.00 0.00 1.34 0.00 0.00 72.50 71.66 1mz8 s THR 454 CO 0.35 -0.63 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 1mz8 n GLY 455 N -0.05 3.02 0.02 3.99 0.00 -1.26 0.21 105.19 111.11 1mz8 n GLY 455 Ca -0.08 -2.03 0.05 0.00 0.00 0.00 0.00 46.02 43.96 1mz8 n GLY 455 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mz8 n LYS 456 N -0.91 0.69 0.00 1.61 5.02 -1.26 -4.80 118.16 118.51 1mz8 n LYS 456 Ca 0.00 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.18 1mz8 n LYS 456 Cb 0.00 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1mz8 n LYS 456 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1mz8 n GLY 457 N 1.78 -1.19 3.16 0.72 0.00 -1.26 -4.18 105.19 104.22 1mz8 n GLY 457 Ca -0.06 -1.23 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 1mz8 n GLY 457 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mz8 s LYS 458 N 0.00 0.69 0.44 1.61 1.02 -0.24 -4.64 119.74 118.61 1mz8 s LYS 458 Ca 0.00 -0.76 -0.24 0.00 0.02 0.00 0.00 55.97 54.99 1mz8 s LYS 458 Cb 0.00 0.28 -0.08 0.00 -0.52 0.00 0.00 37.83 37.51 1mz8 s LYS 458 CO 0.00 -0.19 1.19 -1.25 -0.92 0.00 0.00 175.35 174.17 1mz8 s PRO 459 N -2.90 3.84 0.09 -1.68 0.04 -1.26 -0.60 135.00 132.53 1mz8 s PRO 459 Ca -0.02 1.85 0.04 0.00 0.04 0.00 0.00 61.00 62.90 1mz8 s PRO 459 Cb 0.01 -2.51 -0.03 0.00 0.04 0.00 0.00 34.50 32.00 1mz8 s PRO 459 CO -0.06 -0.51 -0.10 0.14 0.04 0.00 0.00 177.00 176.52 1mz8 s VAL 460 N -1.47 0.92 0.00 -0.36 -7.23 -1.26 -4.92 120.40 106.08 1mz8 s VAL 460 Ca 0.61 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 59.18 1mz8 s VAL 460 Cb -0.30 -1.31 0.00 0.00 0.56 0.00 0.00 36.38 35.32 1mz8 s VAL 460 CO 0.38 -0.54 0.00 -0.46 -0.31 0.00 0.00 175.10 174.16 1mz8 n ASN 461 N 0.62 0.00 -0.48 4.85 6.94 -1.26 -4.98 115.26 120.95 1mz8 n ASN 461 Ca -0.17 -0.02 0.02 0.00 -0.02 0.00 0.00 54.58 54.40 1mz8 n ASN 461 Cb 0.57 0.00 0.08 0.00 -2.36 0.00 0.00 39.78 38.08 1mz8 n ASN 461 CO 0.00 0.00 0.00 -0.46 -1.03 0.00 0.00 177.26 175.77 1mz8 n ASN 462 N -0.05 1.30 -2.56 0.53 2.04 -1.26 -3.46 115.26 111.80 1mz8 n ASN 462 Ca 0.00 -2.07 -0.09 0.00 -0.44 0.00 0.00 54.58 51.98 1mz8 n ASN 462 Cb 0.00 -0.25 0.04 0.00 -2.53 0.00 0.00 39.78 37.03 1mz8 n ASN 462 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 1mz8 n LYS 463 N 0.05 2.33 -0.28 -3.83 4.76 -1.26 -4.93 118.16 115.00 1mz8 n LYS 463 Ca 0.06 -3.73 -0.05 0.00 -2.87 0.00 0.00 58.31 51.72 1mz8 n LYS 463 Cb 0.25 -1.81 0.01 0.00 -1.84 0.00 0.00 35.03 31.64 1mz8 n LYS 463 CO 0.00 0.00 0.00 2.35 -1.37 0.00 0.00 177.40 178.38 1mz8 h TRP 464 N 2.52 -1.09 -0.50 2.13 7.01 -1.94 -1.89 115.95 122.19 1mz8 h TRP 464 Ca 0.04 0.09 0.00 0.00 2.11 0.00 0.00 58.89 61.13 1mz8 h TRP 464 Cb 1.32 0.58 0.00 0.00 -2.10 0.00 0.00 29.16 28.97 1mz8 h TRP 464 CO 0.62 -0.40 0.00 1.28 -2.79 0.00 0.00 178.44 177.15 1mz8 n LEU 465 N -5.44 3.18 0.20 0.65 4.77 -1.26 -4.44 117.00 114.67 1mz8 n LEU 465 Ca 0.06 -1.60 0.14 0.00 -0.03 0.00 0.00 56.01 54.58 1mz8 n LEU 465 Cb 0.37 -0.42 0.75 0.00 -2.33 0.00 0.00 43.42 41.78 1mz8 n LEU 465 CO -0.05 0.66 1.12 0.78 -1.33 0.00 0.00 177.39 178.57 1mz8 h ASN 466 N 3.01 0.00 -0.44 -1.43 4.21 -1.75 -1.88 115.58 117.30 1mz8 h ASN 466 Ca 0.00 0.00 -0.13 0.00 1.21 0.00 0.00 56.30 57.38 1mz8 h ASN 466 Cb 0.91 0.00 -0.08 0.00 -1.12 0.00 0.00 38.32 38.03 1mz8 h ASN 466 CO 0.08 0.00 0.07 0.59 -1.29 0.00 0.00 177.43 176.89 1mz8 n ASN 467 N -4.21 3.73 0.29 5.81 5.03 -1.26 -4.53 115.26 120.13 1mz8 n ASN 467 Ca 0.01 -3.31 0.17 0.00 0.87 0.00 0.00 54.58 52.32 1mz8 n ASN 467 Cb 0.24 -0.64 0.86 0.00 -1.02 0.00 0.00 39.78 39.23 1mz8 n ASN 467 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1mz8 h ALA 468 N 1.77 1.10 -0.59 5.41 0.00 -1.60 -2.26 119.26 123.10 1mz8 h ALA 468 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1mz8 h ALA 468 Cb 1.79 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1mz8 h ALA 468 CO 0.44 0.06 0.00 0.41 0.00 0.00 0.00 179.25 180.16 1mz8 n GLY 469 N -0.56 2.78 2.99 0.00 0.00 -1.26 -2.09 105.19 107.05 1mz8 n GLY 469 Ca -0.01 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 45.01 1mz8 n GLY 469 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mz8 s LYS 470 N -2.29 0.43 5.20 1.61 2.20 -0.85 -4.78 119.74 121.27 1mz8 s LYS 470 Ca 0.51 -0.41 0.00 0.00 -0.36 0.00 0.00 55.97 55.71 1mz8 s LYS 470 Cb 0.36 -0.32 0.00 0.00 -1.51 0.00 0.00 37.83 36.37 1mz8 s LYS 470 CO 0.19 0.07 0.00 -0.25 -0.36 0.00 0.00 175.35 175.01 1mz8 n ASP 471 N 2.33 0.00 -1.49 1.43 10.43 -1.26 -1.01 116.55 126.98 1mz8 n ASP 471 Ca -0.17 0.00 0.10 0.00 2.57 0.00 0.00 54.79 57.29 1mz8 n ASP 471 Cb 0.57 0.00 0.34 0.00 1.84 0.00 0.00 41.12 43.87 1mz8 n ASP 471 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1mz8 n LEU 472 N 0.00 4.47 0.00 0.64 4.77 -1.26 -4.95 117.00 120.68 1mz8 n LEU 472 Ca 0.00 -2.30 0.00 0.00 -0.03 0.00 0.00 56.01 53.68 1mz8 n LEU 472 Cb 0.00 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.55 1mz8 n LEU 472 CO 0.00 0.87 0.00 0.61 -1.33 0.00 0.00 177.39 177.54 1mz8 n GLY 473 N 1.28 -1.01 3.90 -0.72 0.00 -0.18 -4.59 105.19 103.87 1mz8 n GLY 473 Ca 0.25 -1.37 -0.34 0.00 0.00 0.00 0.00 46.02 44.56 1mz8 n GLY 473 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mz8 s SER 474 N -4.00 6.40 0.63 1.61 0.01 0.35 -4.75 113.70 113.95 1mz8 s SER 474 Ca 0.00 0.41 -0.11 0.00 1.31 0.00 0.00 55.95 57.56 1mz8 s SER 474 Cb 0.00 -2.03 -0.03 0.00 0.21 0.00 0.00 66.02 64.17 1mz8 s SER 474 CO 0.00 0.28 1.04 -2.16 0.41 0.00 0.00 173.24 172.80 1mz8 s PRO 475 N -1.80 3.43 0.08 12.44 0.04 -1.26 -0.32 135.00 147.60 1mz8 s PRO 475 Ca 0.26 0.66 -0.31 0.00 0.04 0.00 0.00 61.00 61.65 1mz8 s PRO 475 Cb -0.13 -2.08 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 1mz8 s PRO 475 CO 0.16 -0.66 1.43 0.08 0.04 0.00 0.00 177.00 178.05 1mz8 s VAL 476 N -3.20 3.37 0.31 -0.36 1.01 -1.25 -4.80 120.40 115.48 1mz8 s VAL 476 Ca 0.55 0.92 -0.29 0.00 0.00 0.00 0.00 61.98 63.16 1mz8 s VAL 476 Cb -0.11 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.58 1mz8 s VAL 476 CO 0.53 0.04 1.43 -2.84 0.00 0.00 0.00 175.10 174.27 1mz8 s PRO 477 N 1.65 4.24 0.29 2.72 0.02 -1.26 -1.08 135.00 141.57 1mz8 s PRO 477 Ca 0.66 2.38 0.03 0.00 0.02 0.00 0.00 61.00 64.08 1mz8 s PRO 477 Cb -0.36 -3.05 0.64 0.00 0.02 0.00 0.00 34.50 31.75 1mz8 s PRO 477 CO 0.29 -0.41 1.79 0.38 -0.33 0.00 0.00 177.00 178.73 1mz8 h ASP 478 N 4.08 0.77 -0.67 2.53 3.04 -1.02 0.78 116.42 125.94 1mz8 h ASP 478 Ca -0.48 0.08 -0.01 0.00 -3.24 0.00 0.00 57.03 53.38 1mz8 h ASP 478 Cb 1.23 -0.06 -0.03 0.00 -1.04 0.00 0.00 39.33 39.42 1mz8 h ASP 478 CO 0.71 0.32 0.37 0.03 -2.04 0.00 0.00 179.24 178.64 1mz8 h ARG 479 N 0.80 0.95 -0.25 4.15 3.08 -1.86 0.66 114.38 121.91 1mz8 h ARG 479 Ca 0.53 -0.11 -0.14 0.00 0.07 0.00 0.00 59.98 60.34 1mz8 h ARG 479 Cb 0.73 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 1mz8 h ARG 479 CO -0.35 0.71 -0.39 0.82 -1.07 0.00 0.00 179.97 179.69 1mz8 h ILE 480 N 0.96 1.31 -0.60 2.04 1.08 -1.33 -2.75 117.51 118.21 1mz8 h ILE 480 Ca 0.24 -1.59 0.05 0.00 -0.39 0.00 0.00 64.86 63.17 1mz8 h ILE 480 Cb 0.04 1.71 -0.05 0.00 -3.07 0.00 0.00 36.82 35.45 1mz8 h ILE 480 CO -0.04 0.50 0.32 0.00 -0.69 0.00 0.00 178.15 178.25 1mz8 h ALA 481 N 0.66 0.78 -0.88 1.87 0.00 -0.38 -1.33 119.26 119.97 1mz8 h ALA 481 Ca 0.02 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.05 1mz8 h ALA 481 Cb 0.98 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 1mz8 h ALA 481 CO 0.09 -0.00 0.57 -0.91 0.00 0.00 0.00 179.25 179.00 1mz8 h ASN 482 N 0.61 0.78 0.88 0.00 2.35 -0.65 0.34 115.58 119.89 1mz8 h ASN 482 Ca 0.26 0.02 -0.15 0.00 -0.55 0.00 0.00 56.30 55.89 1mz8 h ASN 482 Cb 0.15 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.36 1mz8 h ASN 482 CO -0.17 0.46 -0.72 0.11 -1.65 0.00 0.00 177.43 175.46 1mz8 h LYS 483 N 0.86 0.00 0.00 0.81 1.79 -0.99 -3.33 116.57 115.71 1mz8 h LYS 483 Ca 0.41 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.88 1mz8 h LYS 483 Cb 0.43 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1mz8 h LYS 483 CO -0.18 0.72 -1.53 1.28 -1.08 0.00 0.00 179.45 178.66 1mz8 n LEU 484 N -3.54 0.37 -4.62 2.94 4.77 -0.74 -4.92 117.00 111.27 1mz8 n LEU 484 Ca -0.00 0.07 -0.48 0.00 -0.03 0.00 0.00 56.01 55.56 1mz8 n LEU 484 Cb 0.74 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.76 1mz8 n LEU 484 CO 0.43 -0.03 0.89 -1.14 -1.33 0.00 0.00 177.39 176.21 1mz8 n ARG 485 N -2.30 1.51 -0.86 3.23 0.63 0.04 -1.79 116.66 117.12 1mz8 n ARG 485 Ca -0.02 0.54 0.00 0.00 -0.92 0.00 0.00 57.85 57.45 1mz8 n ARG 485 Cb 0.53 -2.14 0.00 0.00 0.45 0.00 0.00 32.46 31.30 1mz8 n ARG 485 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1mz8 n ASP 486 N 2.32 -1.88 -4.87 6.15 8.00 0.61 -4.95 116.55 121.93 1mz8 n ASP 486 Ca 0.15 0.00 -0.31 0.00 0.71 0.00 0.00 54.79 55.34 1mz8 n ASP 486 Cb 0.26 -1.51 -0.04 0.00 -0.02 0.00 0.00 41.12 39.81 1mz8 n ASP 486 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1mz8 s LYS 487 N -0.68 3.85 -0.03 -1.24 1.02 -0.74 -4.78 119.74 117.14 1mz8 s LYS 487 Ca 0.00 0.49 -0.02 0.00 0.02 0.00 0.00 55.97 56.45 1mz8 s LYS 487 Cb 0.00 -2.45 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 1mz8 s LYS 487 CO 0.00 0.09 0.13 -1.83 -0.92 0.00 0.00 175.35 172.82 1mz8 s GLU 488 N -3.40 3.28 0.08 1.68 1.03 -1.26 -1.22 118.70 118.89 1mz8 s GLU 488 Ca 0.51 -0.36 0.06 0.00 0.03 0.00 0.00 54.97 55.21 1mz8 s GLU 488 Cb -0.10 -3.01 -0.03 0.00 -0.80 0.00 0.00 34.13 30.19 1mz8 s GLU 488 CO 0.25 0.68 -0.16 -0.06 -1.33 0.00 0.00 175.26 174.64 1mz8 s PHE 489 N -1.22 1.35 0.18 4.83 0.08 0.61 -4.95 117.98 118.87 1mz8 s PHE 489 Ca 0.23 -0.45 0.14 0.00 0.12 0.00 0.00 56.93 56.98 1mz8 s PHE 489 Cb -0.12 -0.76 0.45 0.00 -0.57 0.00 0.00 43.02 42.02 1mz8 s PHE 489 CO 0.14 0.09 1.64 0.87 -0.10 0.00 0.00 175.22 177.86 1mz8 h LYS 490 N 4.26 0.00 -2.79 0.44 1.57 -1.88 -2.08 116.57 116.08 1mz8 h LYS 490 Ca -0.42 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.42 1mz8 h LYS 490 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 1mz8 h LYS 490 CO 0.40 0.52 0.40 -1.54 -0.57 0.00 0.00 179.45 178.66 1mz8 s SER 491 N -6.62 -0.01 0.25 0.86 1.04 -1.26 -2.99 113.70 104.96 1mz8 s SER 491 Ca -0.00 -0.91 0.07 0.00 0.48 0.00 0.00 55.95 55.58 1mz8 s SER 491 Cb 0.11 0.70 0.29 0.00 0.10 0.00 0.00 66.02 67.22 1mz8 s SER 491 CO 0.73 -1.38 1.58 0.15 0.98 0.00 0.00 173.24 175.30 1mz8 h PHE 492 N 2.00 0.18 -0.45 5.02 3.57 -1.10 -1.98 116.94 124.18 1mz8 h PHE 492 Ca -0.30 -0.07 -0.04 0.00 3.53 0.00 0.00 57.97 61.09 1mz8 h PHE 492 Cb 1.24 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.92 1mz8 h PHE 492 CO 1.29 0.71 0.10 0.22 -2.23 0.00 0.00 178.31 178.40 1mz8 h ASP 493 N 0.10 0.62 -0.34 0.41 3.58 -1.96 0.26 116.42 119.08 1mz8 h ASP 493 Ca -0.01 -0.10 -0.17 0.00 0.42 0.00 0.00 57.03 57.17 1mz8 h ASP 493 Cb 1.11 -0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.99 1mz8 h ASP 493 CO 0.09 0.62 -0.45 -0.78 -2.88 0.00 0.00 179.24 175.84 1mz8 h ASP 494 N 0.65 0.99 -0.69 2.28 3.58 -1.83 -1.83 116.42 119.57 1mz8 h ASP 494 Ca 0.15 -0.48 -0.04 0.00 0.42 0.00 0.00 57.03 57.08 1mz8 h ASP 494 Cb 0.25 -0.28 -0.03 0.00 1.72 0.00 0.00 39.33 40.99 1mz8 h ASP 494 CO -0.00 1.29 0.29 0.15 -2.88 0.00 0.00 179.24 178.08 1mz8 h PHE 495 N 0.73 1.04 -0.62 0.28 3.57 -0.80 -1.99 116.94 119.16 1mz8 h PHE 495 Ca 0.04 -0.07 0.01 0.00 3.53 0.00 0.00 57.97 61.48 1mz8 h PHE 495 Cb 1.05 -0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 1mz8 h PHE 495 CO 0.07 0.80 0.40 -0.09 -2.23 0.00 0.00 178.31 177.26 1mz8 h ARG 496 N 0.98 0.79 -0.37 1.11 2.43 -0.19 0.22 114.38 119.34 1mz8 h ARG 496 Ca 0.23 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.33 1mz8 h ARG 496 Cb 0.19 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1mz8 h ARG 496 CO -0.02 0.52 0.14 0.87 -1.51 0.00 0.00 179.97 179.97 1mz8 h LYS 497 N 0.81 0.57 -0.39 0.20 1.57 -1.07 -1.80 116.57 116.46 1mz8 h LYS 497 Ca 0.23 -0.11 -0.07 0.00 -1.87 0.00 0.00 60.65 58.83 1mz8 h LYS 497 Cb -0.06 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1mz8 h LYS 497 CO -0.06 0.56 -0.05 -0.22 -0.57 0.00 0.00 179.45 179.10 1mz8 h LYS 498 N 0.46 0.66 0.28 3.15 3.11 -0.92 -1.68 116.57 121.61 1mz8 h LYS 498 Ca 0.12 -0.18 -0.01 0.00 -2.81 0.00 0.00 60.65 57.78 1mz8 h LYS 498 Cb 0.21 -0.08 -0.00 0.00 -1.00 0.00 0.00 32.23 31.36 1mz8 h LYS 498 CO -0.01 0.71 -0.17 0.35 -2.81 0.00 0.00 179.45 177.52 1mz8 h PHE 499 N 0.61 -0.44 -0.46 1.91 3.57 -0.14 -1.41 116.94 120.59 1mz8 h PHE 499 Ca 0.12 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 1mz8 h PHE 499 Cb 0.46 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.34 1mz8 h PHE 499 CO 0.02 -0.27 0.07 -1.49 -2.23 0.00 0.00 178.31 174.41 1mz8 h TRP 500 N -0.43 0.75 -0.32 0.41 4.06 -1.16 -1.63 115.95 117.62 1mz8 h TRP 500 Ca -0.03 -0.07 0.01 0.00 2.06 0.00 0.00 58.89 60.86 1mz8 h TRP 500 Cb 0.36 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 28.28 1mz8 h TRP 500 CO -0.09 0.66 0.19 0.93 -3.56 0.00 0.00 178.44 176.58 1mz8 h GLU 501 N 0.69 0.38 -0.70 0.49 5.08 -1.02 -1.97 114.58 117.54 1mz8 h GLU 501 Ca 0.15 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.51 1mz8 h GLU 501 Cb 0.33 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 1mz8 h GLU 501 CO 0.01 0.25 0.44 0.93 -1.00 0.00 0.00 179.01 179.64 1mz8 h GLU 502 N 0.40 0.85 -0.69 2.33 4.39 -0.86 -1.65 114.58 119.35 1mz8 h GLU 502 Ca 0.12 -0.05 0.07 0.00 0.34 0.00 0.00 59.36 59.84 1mz8 h GLU 502 Cb -0.01 -0.19 -0.06 0.00 -0.10 0.00 0.00 28.75 28.38 1mz8 h GLU 502 CO -0.05 0.56 0.39 0.28 -1.16 0.00 0.00 179.01 179.03 1mz8 h VAL 503 N 0.88 0.95 0.00 3.13 2.07 -0.76 -0.66 116.25 121.86 1mz8 h VAL 503 Ca 0.27 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1mz8 h VAL 503 Cb -0.01 0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1mz8 h VAL 503 CO -0.09 0.13 -0.03 0.77 0.02 0.00 0.00 177.57 178.37 1mz8 h SER 504 N 0.70 0.00 0.63 0.57 4.64 -0.58 -2.48 113.55 117.03 1mz8 h SER 504 Ca 0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.64 1mz8 h SER 504 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1mz8 h SER 504 CO -0.20 0.03 -0.77 0.29 -0.87 0.00 0.00 176.83 175.31 1mz8 n LYS 505 N -3.29 0.24 -2.92 4.77 5.02 -0.30 -4.78 118.16 116.90 1mz8 n LYS 505 Ca -0.02 0.04 -0.43 0.00 -2.02 0.00 0.00 58.31 55.88 1mz8 n LYS 505 Cb 0.16 -1.62 -0.05 0.00 -0.02 0.00 0.00 35.03 33.50 1mz8 n LYS 505 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1mz8 s ASP 506 N -3.90 6.40 0.35 4.39 -1.08 -0.91 -4.94 116.67 116.98 1mz8 s ASP 506 Ca 0.06 -0.17 0.10 0.00 -0.52 0.00 0.00 52.55 52.02 1mz8 s ASP 506 Cb 0.14 -2.40 0.87 0.00 -1.46 0.00 0.00 42.92 40.07 1mz8 s ASP 506 CO 0.75 -1.00 1.82 -0.65 0.52 0.00 0.00 175.17 176.61 1mz8 h PRO 507 N 9.07 0.62 0.00 4.34 0.11 -1.87 0.14 132.00 144.41 1mz8 h PRO 507 Ca -0.25 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.74 1mz8 h PRO 507 Cb 1.08 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.04 1mz8 h PRO 507 CO 1.00 0.41 -0.40 0.93 -0.21 0.00 0.00 178.00 179.73 1mz8 h GLU 508 N 0.64 0.00 0.06 1.05 4.39 -1.94 -2.86 114.58 115.92 1mz8 h GLU 508 Ca 0.52 0.00 -0.36 0.00 0.34 0.00 0.00 59.36 59.86 1mz8 h GLU 508 Cb 0.96 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.57 1mz8 h GLU 508 CO -0.28 0.40 -2.02 1.28 -1.16 0.00 0.00 179.01 177.23 1mz8 n LEU 509 N -3.77 2.48 -0.12 1.33 4.77 -0.69 -4.35 117.00 116.64 1mz8 n LEU 509 Ca -0.01 0.19 0.11 0.00 -0.03 0.00 0.00 56.01 56.27 1mz8 n LEU 509 Cb 0.47 -1.01 0.47 0.00 -2.33 0.00 0.00 43.42 41.02 1mz8 n LEU 509 CO 0.38 0.72 1.20 0.77 -1.33 0.00 0.00 177.39 179.13 1mz8 h SER 510 N -0.29 0.44 0.41 -1.43 4.64 -0.82 0.21 113.55 116.71 1mz8 h SER 510 Ca -0.48 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1mz8 h SER 510 Cb 1.81 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.82 1mz8 h SER 510 CO -0.07 0.26 0.00 0.50 -0.87 0.00 0.00 176.83 176.65 1mz8 h LYS 511 N 0.48 0.00 -0.12 4.77 3.64 -1.70 -2.21 116.57 121.44 1mz8 h LYS 511 Ca 0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.68 1mz8 h LYS 511 Cb 0.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1mz8 h LYS 511 CO -0.09 0.00 0.00 1.04 -2.27 0.00 0.00 179.45 178.13 1mz8 n GLN 512 N -2.49 1.55 -4.26 1.90 6.02 0.73 -4.89 117.38 115.94 1mz8 n GLN 512 Ca -0.00 -0.83 -0.21 0.00 -0.01 0.00 0.00 57.00 55.95 1mz8 n GLN 512 Cb 0.15 -1.38 -0.12 0.00 1.02 0.00 0.00 30.24 29.92 1mz8 n GLN 512 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1mz8 s PHE 513 N -1.85 1.57 1.01 1.08 0.08 -0.83 -5.07 117.98 113.96 1mz8 s PHE 513 Ca 0.32 -0.48 -0.12 0.00 0.12 0.00 0.00 56.93 56.77 1mz8 s PHE 513 Cb 0.17 -0.83 0.20 0.00 -0.57 0.00 0.00 43.02 41.98 1mz8 s PHE 513 CO 0.26 0.19 1.08 -1.54 -0.10 0.00 0.00 175.22 175.10 1mz8 s SER 514 N -2.21 2.44 0.19 1.36 1.04 -1.26 -4.75 113.70 110.51 1mz8 s SER 514 Ca 0.08 1.37 -0.11 0.00 0.48 0.00 0.00 55.95 57.77 1mz8 s SER 514 Cb -0.07 -2.06 0.12 0.00 0.10 0.00 0.00 66.02 64.11 1mz8 s SER 514 CO 0.04 -3.27 1.82 0.03 0.98 0.00 0.00 173.24 172.84 1mz8 h ARG 515 N -1.99 0.93 -0.43 4.02 3.08 -1.99 0.20 114.38 118.21 1mz8 h ARG 515 Ca -0.55 -0.09 -0.10 0.00 0.07 0.00 0.00 59.98 59.32 1mz8 h ARG 515 Cb 1.32 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.16 1mz8 h ARG 515 CO 0.55 0.68 -0.12 -0.91 -1.07 0.00 0.00 179.97 179.09 1mz8 h ASN 516 N 0.93 0.77 0.01 7.04 4.21 -2.00 -1.49 115.58 125.05 1mz8 h ASN 516 Ca 0.24 -0.23 -0.15 0.00 1.21 0.00 0.00 56.30 57.37 1mz8 h ASN 516 Cb -0.00 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 36.98 1mz8 h ASN 516 CO -0.04 0.91 -0.48 0.78 -1.29 0.00 0.00 177.43 177.31 1mz8 h ASN 517 N 0.70 0.59 -0.55 5.81 2.35 -1.82 -2.95 115.58 119.72 1mz8 h ASN 517 Ca 0.12 -0.29 -0.07 0.00 -0.55 0.00 0.00 56.30 55.51 1mz8 h ASN 517 Cb 0.60 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 1mz8 h ASN 517 CO 0.04 0.98 0.08 0.78 -1.65 0.00 0.00 177.43 177.65 1mz8 h ASN 518 N 0.43 0.92 -0.85 5.81 4.21 -0.62 -2.21 115.58 123.28 1mz8 h ASN 518 Ca 0.02 -0.21 -0.00 0.00 1.21 0.00 0.00 56.30 57.32 1mz8 h ASN 518 Cb 1.00 -0.24 -0.04 0.00 -1.12 0.00 0.00 38.32 37.91 1mz8 h ASN 518 CO 0.09 0.94 0.51 0.44 -1.29 0.00 0.00 177.43 178.12 1mz8 h ASP 519 N 0.91 1.02 -0.34 5.81 3.32 -1.18 -0.98 116.42 124.98 1mz8 h ASP 519 Ca 0.18 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1mz8 h ASP 519 Cb 0.42 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 1mz8 h ASP 519 CO 0.01 0.78 0.15 0.03 -1.72 0.00 0.00 179.24 178.49 1mz8 h ARG 520 N 1.17 0.50 -0.23 3.56 3.08 -1.29 -2.89 114.38 118.29 1mz8 h ARG 520 Ca 0.31 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 60.19 1mz8 h ARG 520 Cb -0.05 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 1mz8 h ARG 520 CO -0.06 0.48 -0.20 0.52 -1.07 0.00 0.00 179.97 179.65 1mz8 h MET 521 N 0.41 0.40 0.00 0.04 2.86 -1.05 -1.03 114.93 116.56 1mz8 h MET 521 Ca 0.11 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1mz8 h MET 521 Cb 0.16 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1mz8 h MET 521 CO -0.01 0.59 -0.02 -0.22 1.06 0.00 0.00 176.91 178.31 1mz8 h LYS 522 N 0.37 0.00 -0.57 1.72 1.63 -0.97 0.52 116.57 119.27 1mz8 h LYS 522 Ca 0.06 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 1mz8 h LYS 522 Cb 0.56 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.19 1mz8 h LYS 522 CO 0.04 0.02 0.00 1.33 -3.45 0.00 0.00 179.45 177.39 1mz8 n VAL 523 N -4.06 1.58 -0.50 2.00 0.24 -0.82 -4.80 118.33 111.96 1mz8 n VAL 523 Ca -0.03 -1.20 0.00 0.00 -2.04 0.00 0.00 64.34 61.07 1mz8 n VAL 523 Cb 0.10 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 32.70 1mz8 n VAL 523 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1mz8 n GLY 524 N 0.94 0.74 3.90 7.63 0.00 0.16 -5.00 105.19 113.56 1mz8 n GLY 524 Ca 0.23 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 1mz8 n GLY 524 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1mz8 s LYS 525 N -0.57 3.43 0.48 1.61 1.02 -0.46 -4.12 119.74 121.14 1mz8 s LYS 525 Ca 0.00 -0.34 -0.22 0.00 0.02 0.00 0.00 55.97 55.43 1mz8 s LYS 525 Cb 0.00 -3.08 -0.07 0.00 -0.52 0.00 0.00 37.83 34.16 1mz8 s LYS 525 CO 0.00 0.67 1.17 0.00 -0.92 0.00 0.00 175.35 176.27 1mz8 s ALA 526 N -1.35 2.90 0.70 5.17 0.00 -1.26 -2.95 121.76 124.97 1mz8 s ALA 526 Ca 0.28 0.95 -0.15 0.00 0.00 0.00 0.00 51.96 53.04 1mz8 s ALA 526 Cb -0.13 -3.39 0.02 0.00 0.00 0.00 0.00 23.12 19.62 1mz8 s ALA 526 CO 0.20 -0.74 1.16 -1.25 0.00 0.00 0.00 175.76 175.13 1mz8 s PRO 527 N -2.83 2.45 0.36 0.00 0.04 -1.26 -4.70 135.00 129.06 1mz8 s PRO 527 Ca 0.66 1.57 -0.26 0.00 0.04 0.00 0.00 61.00 63.02 1mz8 s PRO 527 Cb -0.29 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 1mz8 s PRO 527 CO 0.34 -1.56 1.08 0.15 0.04 0.00 0.00 177.00 177.05 1mz8 s LYS 528 N -4.01 4.29 0.77 4.56 -0.14 -1.26 -1.66 119.74 122.30 1mz8 s LYS 528 Ca 0.71 1.64 -0.06 0.00 -1.36 0.00 0.00 55.97 56.90 1mz8 s LYS 528 Cb -0.25 -2.76 0.12 0.00 -1.68 0.00 0.00 37.83 33.27 1mz8 s LYS 528 CO 0.43 -0.06 1.07 0.95 -0.76 0.00 0.00 175.35 176.99 1mz8 s THR 529 N -1.47 2.17 0.64 2.17 -4.23 -0.58 -4.81 115.64 109.53 1mz8 s THR 529 Ca 0.54 -0.35 -0.16 0.00 -1.18 0.00 0.00 61.69 60.53 1mz8 s THR 529 Cb -0.26 -2.81 -0.01 0.00 1.34 0.00 0.00 72.50 70.76 1mz8 s THR 529 CO 0.33 0.00 1.12 -0.13 -0.54 0.00 0.00 174.62 175.40 1mz8 s ARG 530 N -5.35 2.87 0.25 3.99 0.52 -1.26 -4.91 118.95 115.07 1mz8 s ARG 530 Ca 0.66 1.44 -0.03 0.00 -0.52 0.00 0.00 55.73 57.29 1mz8 s ARG 530 Cb -0.07 -1.96 0.50 0.00 0.52 0.00 0.00 34.95 33.94 1mz8 s ARG 530 CO 0.46 -1.20 1.73 1.15 0.02 0.00 0.00 175.30 177.47 1mz8 h THR 531 N 0.22 0.66 0.00 0.02 2.02 -1.96 -0.83 112.91 113.04 1mz8 h THR 531 Ca -0.47 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1mz8 h THR 531 Cb 1.25 0.13 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1mz8 h THR 531 CO 0.54 0.09 0.00 0.00 0.37 0.00 0.00 175.52 176.52 1mz8 n GLN 532 N -4.97 0.00 -0.16 6.66 10.64 -1.26 -2.81 117.38 125.48 1mz8 n GLN 532 Ca 0.16 0.38 0.08 0.00 -1.83 0.00 0.00 57.00 55.79 1mz8 n GLN 532 Cb 0.44 -1.50 0.16 0.00 -0.86 0.00 0.00 30.24 28.48 1mz8 n GLN 532 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1mz8 n ASP 533 N -1.50 2.95 -4.84 2.61 8.00 -0.32 -5.00 116.55 118.45 1mz8 n ASP 533 Ca 0.02 -1.87 -0.32 0.00 0.71 0.00 0.00 54.79 53.33 1mz8 n ASP 533 Cb 0.08 -0.21 0.01 0.00 -0.02 0.00 0.00 41.12 40.98 1mz8 n ASP 533 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1mz8 s VAL 534 N -1.13 4.36 -0.31 2.53 1.01 -1.12 -2.47 120.40 123.26 1mz8 s VAL 534 Ca 0.28 0.92 -0.02 0.00 0.00 0.00 0.00 61.98 63.15 1mz8 s VAL 534 Cb 0.16 -3.64 0.11 0.00 0.00 0.00 0.00 36.38 33.01 1mz8 s VAL 534 CO 0.22 -0.85 0.15 -0.55 0.00 0.00 0.00 175.10 174.07 1mz8 s SER 535 N -3.55 3.45 1.97 3.32 0.15 -0.03 -4.49 113.70 114.52 1mz8 s SER 535 Ca 0.58 -1.59 0.00 0.00 0.70 0.00 0.00 55.95 55.64 1mz8 s SER 535 Cb -0.12 -0.44 0.00 0.00 -1.71 0.00 0.00 66.02 63.75 1mz8 s SER 535 CO 0.45 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 175.10 1mz8 n GLY 536 N 4.85 3.59 0.00 9.45 0.00 -1.26 -1.47 105.19 120.35 1mz8 n GLY 536 Ca -0.01 -0.09 0.10 0.00 0.00 0.00 0.00 46.02 46.02 1mz8 n GLY 536 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1mz8 n LYS 537 N 13.93 0.15 -3.01 1.61 5.02 -1.26 -4.58 118.16 130.03 1mz8 n LYS 537 Ca 0.00 0.11 -0.43 0.00 -2.02 0.00 0.00 58.31 55.97 1mz8 n LYS 537 Cb 0.00 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.46 1mz8 n LYS 537 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1mz8 s ARG 538 N -2.79 3.25 -0.04 1.97 0.52 -0.54 -4.83 118.95 116.49 1mz8 s ARG 538 Ca 0.15 -0.51 0.05 0.00 -0.52 0.00 0.00 55.73 54.90 1mz8 s ARG 538 Cb 0.14 -4.05 0.08 0.00 0.52 0.00 0.00 34.95 31.64 1mz8 s ARG 538 CO 0.35 -1.30 0.94 0.25 0.02 0.00 0.00 175.30 175.57 1mz8 n THR 539 N 5.92 0.88 -4.19 0.02 -2.24 -1.26 -0.85 114.28 112.56 1mz8 n THR 539 Ca -0.02 -0.99 -0.19 0.00 -2.27 0.00 0.00 64.05 60.59 1mz8 n THR 539 Cb 0.47 0.39 -0.12 0.00 -2.10 0.00 0.00 70.33 68.97 1mz8 n THR 539 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1mz8 s SER 540 N -1.33 1.72 0.43 3.42 0.15 -1.26 -1.52 113.70 115.31 1mz8 s SER 540 Ca 0.09 -0.61 -0.25 0.00 0.70 0.00 0.00 55.95 55.88 1mz8 s SER 540 Cb 0.08 -0.06 -0.10 0.00 -1.71 0.00 0.00 66.02 64.24 1mz8 s SER 540 CO 0.01 -0.06 1.26 0.49 1.20 0.00 0.00 173.24 176.14 1mz8 n PHE 541 N 1.31 2.10 -4.44 3.44 3.72 -0.66 -4.46 117.46 118.47 1mz8 n PHE 541 Ca -0.21 0.50 -0.24 0.00 -0.05 0.00 0.00 57.45 57.45 1mz8 n PHE 541 Cb 0.54 -2.37 -0.10 0.00 -0.94 0.00 0.00 39.48 36.62 1mz8 n PHE 541 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1mz8 s GLU 542 N -2.23 1.81 -0.14 -1.08 2.02 0.61 -4.79 118.70 114.91 1mz8 s GLU 542 Ca 0.61 -1.72 -0.07 0.00 0.02 0.00 0.00 54.97 53.82 1mz8 s GLU 542 Cb -0.51 -1.84 -0.04 0.00 0.10 0.00 0.00 34.13 31.85 1mz8 s GLU 542 CO 0.58 0.31 0.10 -0.51 0.02 0.00 0.00 175.26 175.76 1mz8 s LEU 543 N -3.55 4.10 -0.05 1.80 1.43 -1.26 -0.66 118.68 120.48 1mz8 s LEU 543 Ca 0.31 0.30 0.06 0.00 -1.03 0.00 0.00 54.13 53.76 1mz8 s LEU 543 Cb -0.04 -2.00 -0.01 0.00 0.03 0.00 0.00 46.19 44.16 1mz8 s LEU 543 CO 0.16 0.32 -0.24 -2.28 0.23 0.00 0.00 176.35 174.55 1mz8 s HIS 544 N -0.52 2.46 -0.24 0.29 5.65 0.37 -4.96 115.29 118.34 1mz8 s HIS 544 Ca 0.11 -0.60 -0.17 0.00 0.25 0.00 0.00 55.06 54.65 1mz8 s HIS 544 Cb -0.12 -1.59 -0.03 0.00 -1.18 0.00 0.00 32.58 29.65 1mz8 s HIS 544 CO 0.02 -0.14 0.45 -1.01 -0.65 0.00 0.00 174.74 173.41 1mz8 s HIS 545 N -0.29 3.30 0.07 3.88 3.76 -1.26 -1.67 115.29 123.09 1mz8 s HIS 545 Ca 0.00 0.59 -0.24 0.00 -0.15 0.00 0.00 55.06 55.26 1mz8 s HIS 545 Cb -0.13 -2.62 -0.16 0.00 1.11 0.00 0.00 32.58 30.78 1mz8 s HIS 545 CO 0.02 -0.17 1.67 1.49 -0.85 0.00 0.00 174.74 176.90 1mz8 h GLU 546 N 7.81 -0.06 -4.66 1.40 4.81 -1.13 -3.37 114.58 119.38 1mz8 h GLU 546 Ca -0.32 0.00 -0.70 0.00 -0.13 0.00 0.00 59.36 58.22 1mz8 h GLU 546 Cb 1.15 0.01 -0.26 0.00 0.63 0.00 0.00 28.75 30.29 1mz8 h GLU 546 CO 0.70 0.02 -0.55 0.21 -0.73 0.00 0.00 179.01 178.65 1mz8 s LYS 547 N -5.92 2.86 0.44 1.92 2.20 -1.26 -5.07 119.74 114.90 1mz8 s LYS 547 Ca -0.14 -1.04 -0.23 0.00 -0.36 0.00 0.00 55.97 54.20 1mz8 s LYS 547 Cb 0.05 -3.60 -0.11 0.00 -1.51 0.00 0.00 37.83 32.66 1mz8 s LYS 547 CO 0.66 -0.63 0.79 -0.35 -0.36 0.00 0.00 175.35 175.45 1mz8 n PRO 548 N 4.93 0.93 0.27 4.03 -0.04 -1.26 -4.13 135.00 139.74 1mz8 n PRO 548 Ca -0.12 0.34 0.11 0.00 -0.04 0.00 0.00 63.50 63.78 1mz8 n PRO 548 Cb 0.46 -1.80 0.72 0.00 -0.04 0.00 0.00 33.50 32.84 1mz8 n PRO 548 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 1mz8 h ILE 549 N 1.09 0.80 0.00 0.52 6.09 -1.94 -1.92 117.51 122.15 1mz8 h ILE 549 Ca -0.43 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 62.85 1mz8 h ILE 549 Cb 1.37 1.13 0.00 0.00 0.47 0.00 0.00 36.82 39.78 1mz8 h ILE 549 CO 0.54 0.06 0.00 -1.54 -3.07 0.00 0.00 178.15 174.13 1mz8 n SER 550 N -4.12 1.58 -2.67 2.19 3.41 -1.26 -3.65 113.62 109.11 1mz8 n SER 550 Ca -0.03 -1.37 -0.04 0.00 -0.26 0.00 0.00 58.87 57.18 1mz8 n SER 550 Cb 0.14 -0.34 0.11 0.00 -0.26 0.00 0.00 64.21 63.86 1mz8 n SER 550 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1mz8 n GLN 551 N 0.49 0.22 -1.79 4.33 10.64 -0.83 -4.96 117.38 125.48 1mz8 n GLN 551 Ca 0.00 -0.81 -0.20 0.00 -1.83 0.00 0.00 57.00 54.16 1mz8 n GLN 551 Cb 0.28 -0.21 -0.06 0.00 -0.86 0.00 0.00 30.24 29.39 1mz8 n GLN 551 CO 0.00 0.00 0.00 -1.71 -1.83 0.00 0.00 177.06 173.52 1mz8 n ASN 552 N 0.41 -5.46 -4.67 2.61 5.15 -1.24 -4.83 115.26 107.23 1mz8 n ASN 552 Ca -0.06 0.35 -0.42 0.00 -0.60 0.00 0.00 54.58 53.86 1mz8 n ASN 552 Cb 0.75 -4.64 -0.04 0.00 -0.53 0.00 0.00 39.78 35.32 1mz8 n ASN 552 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1mz8 s GLY 553 N -2.61 2.15 -0.10 8.20 0.00 -0.78 -4.99 107.32 109.19 1mz8 s GLY 553 Ca 0.00 0.10 -0.29 0.00 0.00 0.00 0.00 44.72 44.53 1mz8 s GLY 553 CO 0.00 1.71 1.80 -0.32 0.00 0.00 0.00 173.10 176.29 1mz8 s GLY 554 N 1.13 1.29 0.29 0.20 0.00 -1.26 -4.16 107.32 104.82 1mz8 s GLY 554 Ca 0.40 0.89 0.00 0.00 0.00 0.00 0.00 44.72 46.01 1mz8 s GLY 554 CO 0.13 3.24 1.81 -2.08 0.00 0.00 0.00 173.10 176.20 1mz8 h VAL 555 N 5.95 1.23 -0.22 1.40 2.07 -1.94 -3.12 116.25 121.62 1mz8 h VAL 555 Ca -0.41 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.22 1mz8 h VAL 555 Cb 1.19 0.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.82 1mz8 h VAL 555 CO 0.96 0.32 0.00 -1.22 0.02 0.00 0.00 177.57 177.65 1mz8 n TYR 556 N -4.25 0.55 -2.71 1.57 4.02 -1.26 -4.95 117.16 110.14 1mz8 n TYR 556 Ca 0.03 -0.73 -0.43 0.00 -0.01 0.00 0.00 57.90 56.75 1mz8 n TYR 556 Cb 0.27 -0.17 -0.03 0.00 -0.02 0.00 0.00 39.34 39.38 1mz8 n TYR 556 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1mz8 s ASP 557 N -1.67 6.53 0.22 7.72 2.15 -1.18 -2.00 116.67 128.44 1mz8 s ASP 557 Ca 0.30 0.20 0.20 0.00 0.43 0.00 0.00 52.55 53.68 1mz8 s ASP 557 Cb 0.22 -2.50 0.91 0.00 -0.30 0.00 0.00 42.92 41.25 1mz8 s ASP 557 CO 0.09 -1.19 1.61 0.23 -0.17 0.00 0.00 175.17 175.73 1mz8 n MET 558 N 7.60 0.14 0.00 4.34 2.81 0.13 -0.91 117.12 131.22 1mz8 n MET 558 Ca 0.08 0.47 0.13 0.00 -1.81 0.00 0.00 57.70 56.57 1mz8 n MET 558 Cb 0.49 -1.82 0.43 0.00 -0.71 0.00 0.00 33.22 31.61 1mz8 n MET 558 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1mz8 n ASP 559 N -2.09 1.44 -0.48 7.83 8.00 -1.26 -3.39 116.55 126.60 1mz8 n ASP 559 Ca 0.01 -1.31 0.04 0.00 0.71 0.00 0.00 54.79 54.24 1mz8 n ASP 559 Cb 0.15 0.06 0.11 0.00 -0.02 0.00 0.00 41.12 41.43 1mz8 n ASP 559 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1mz8 n ASN 560 N -0.05 2.68 -4.24 -2.24 5.15 -0.09 -4.99 115.26 111.47 1mz8 n ASN 560 Ca 0.16 -1.98 -0.30 0.00 -0.60 0.00 0.00 54.58 51.85 1mz8 n ASN 560 Cb 0.37 -0.17 -0.16 0.00 -0.53 0.00 0.00 39.78 39.29 1mz8 n ASN 560 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1mz8 s ILE 561 N -0.99 1.93 0.06 -1.44 1.01 -1.12 -0.42 121.20 120.24 1mz8 s ILE 561 Ca 0.17 -0.99 -0.00 0.00 0.00 0.00 0.00 60.65 59.83 1mz8 s ILE 561 Cb 0.09 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 1mz8 s ILE 561 CO 0.12 0.54 -0.04 -0.94 0.00 0.00 0.00 174.94 174.62 1mz8 s SER 562 N -0.08 0.68 -0.21 3.58 1.04 -0.67 -3.82 113.70 114.21 1mz8 s SER 562 Ca -0.05 -0.99 -0.12 0.00 0.48 0.00 0.00 55.95 55.27 1mz8 s SER 562 Cb -0.14 0.16 -0.05 0.00 0.10 0.00 0.00 66.02 66.10 1mz8 s SER 562 CO 0.04 -0.55 0.24 -0.69 0.98 0.00 0.00 173.24 173.25 1mz8 s VAL 563 N -3.76 5.32 0.12 5.02 1.01 0.56 -0.48 120.40 128.19 1mz8 s VAL 563 Ca 0.08 0.37 0.03 0.00 0.00 0.00 0.00 61.98 62.45 1mz8 s VAL 563 Cb 0.07 -3.57 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1mz8 s VAL 563 CO -0.08 0.34 -0.08 0.68 0.00 0.00 0.00 175.10 175.96 1mz8 s VAL 564 N 0.96 0.89 0.56 2.92 -7.23 0.16 -0.50 120.40 118.16 1mz8 s VAL 564 Ca 0.12 -1.98 -0.13 0.00 -1.81 0.00 0.00 61.98 58.18 1mz8 s VAL 564 Cb -0.13 -1.74 -0.06 0.00 0.56 0.00 0.00 36.38 35.01 1mz8 s VAL 564 CO 0.04 -0.82 0.99 0.42 -0.31 0.00 0.00 175.10 175.43 1mz8 s THR 565 N -3.48 4.64 0.13 5.32 -4.23 -0.89 -0.28 115.64 116.86 1mz8 s THR 565 Ca 0.14 1.01 -0.19 0.00 -1.18 0.00 0.00 61.69 61.46 1mz8 s THR 565 Cb 0.04 -3.80 -0.01 0.00 1.34 0.00 0.00 72.50 70.08 1mz8 s THR 565 CO -0.03 -0.91 1.70 -0.65 -0.54 0.00 0.00 174.62 174.19 1mz8 h PRO 566 N 0.32 0.00 -0.47 3.99 0.11 -1.78 -0.23 132.00 133.95 1mz8 h PRO 566 Ca -0.45 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.72 1mz8 h PRO 566 Cb 1.19 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.24 1mz8 h PRO 566 CO 0.62 0.00 0.16 -0.22 -0.21 0.00 0.00 178.00 178.35 1mz8 h LYS 567 N 0.00 0.32 -0.40 1.05 3.64 -1.71 -1.40 116.57 118.07 1mz8 h LYS 567 Ca 0.11 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.37 1mz8 h LYS 567 Cb 0.17 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1mz8 h LYS 567 CO -0.24 0.21 -0.16 -0.09 -2.27 0.00 0.00 179.45 176.90 1mz8 h ARG 568 N 0.33 0.75 -0.38 1.90 9.65 -1.77 -2.90 114.38 121.96 1mz8 h ARG 568 Ca 0.22 -0.27 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 1mz8 h ARG 568 Cb 0.23 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.74 1mz8 h ARG 568 CO -0.23 0.87 0.25 1.25 2.80 0.00 0.00 179.97 184.90 1mz8 h HIS 569 N 0.67 0.49 -0.71 2.20 2.76 -0.33 0.45 115.15 120.69 1mz8 h HIS 569 Ca 0.11 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.25 1mz8 h HIS 569 Cb 0.65 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.41 1mz8 h HIS 569 CO 0.03 0.32 0.31 0.82 -1.30 0.00 0.00 177.93 178.11 1mz8 h ILE 570 N 0.51 1.24 -0.35 6.26 2.04 -1.25 -2.56 117.51 123.40 1mz8 h ILE 570 Ca 0.14 -0.71 -0.06 0.00 1.00 0.00 0.00 64.86 65.23 1mz8 h ILE 570 Cb -0.04 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1mz8 h ILE 570 CO -0.03 0.29 -0.02 0.44 0.00 0.00 0.00 178.15 178.83 1mz8 h ASP 571 N 1.02 0.62 -0.33 1.72 3.45 -1.20 -2.61 116.42 119.09 1mz8 h ASP 571 Ca 0.24 -0.33 0.06 0.00 0.43 0.00 0.00 57.03 57.44 1mz8 h ASP 571 Cb 0.16 -0.17 -0.06 0.00 -0.56 0.00 0.00 39.33 38.70 1mz8 h ASP 571 CO -0.03 0.80 -0.05 0.40 -1.57 0.00 0.00 179.24 178.79 1mz8 h ILE 572 N 0.43 0.70 0.00 0.35 2.04 -0.63 -0.37 117.51 120.03 1mz8 h ILE 572 Ca 0.10 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.94 1mz8 h ILE 572 Cb 0.49 0.66 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1mz8 h ILE 572 CO 0.02 0.01 0.00 0.45 0.00 0.00 0.00 178.15 178.63 1mz8 h HIS 573 N 0.03 0.00 -0.63 1.37 3.86 -1.42 -3.01 115.15 115.36 1mz8 h HIS 573 Ca 0.16 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1mz8 h HIS 573 Cb 0.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.71 1mz8 h HIS 573 CO -0.28 0.00 0.00 2.89 0.86 0.00 0.00 177.93 181.40 1mz8 n ARG 574 N -2.81 2.60 -0.84 2.45 1.85 -0.61 -4.94 116.66 114.37 1mz8 n ARG 574 Ca 0.01 -2.48 0.00 0.00 -1.00 0.00 0.00 57.85 54.38 1mz8 n ARG 574 Cb 0.29 -1.54 0.00 0.00 -1.05 0.00 0.00 32.46 30.16 1mz8 n ARG 574 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1mz8 n GLY 575 N 1.60 1.13 0.21 2.89 0.00 -1.01 -5.07 105.19 104.94 1mz8 n GLY 575 Ca 0.23 -0.44 0.03 0.00 0.00 0.00 0.00 46.02 45.84 1mz8 n GLY 575 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60