#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kbh s THR 483 N 0.00 2.04 0.48 0.61 -1.32 -1.26 -5.08 115.64 111.12 3kbh s THR 483 Ca 0.00 -1.42 -0.05 0.00 -1.21 0.00 0.00 61.69 59.01 3kbh s THR 483 Cb 0.00 -2.11 -0.03 0.00 -1.51 0.00 0.00 72.50 68.85 3kbh s THR 483 CO 0.00 0.08 0.78 1.51 -2.21 0.00 0.00 174.62 174.78 3kbh s ASP 484 N 1.19 6.21 -0.32 8.08 1.47 -1.26 -2.77 116.67 129.26 3kbh s ASP 484 Ca -0.06 0.88 -0.01 0.00 1.18 0.00 0.00 52.55 54.55 3kbh s ASP 484 Cb -0.18 -2.19 0.13 0.00 -0.34 0.00 0.00 42.92 40.34 3kbh s ASP 484 CO -0.07 -0.61 0.23 -0.63 0.68 0.00 0.00 175.17 174.77 3kbh s ILE 485 N -2.74 -0.12 -0.21 2.11 1.01 0.15 -4.89 121.20 116.51 3kbh s ILE 485 Ca 0.48 -1.03 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 3kbh s ILE 485 Cb -0.10 -0.97 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 3kbh s ILE 485 CO 0.44 -0.74 1.83 0.20 0.00 0.00 0.00 174.94 176.68 3kbh s ASN 486 N 1.73 6.09 -0.61 3.58 -0.87 -1.26 -1.18 114.94 122.41 3kbh s ASN 486 Ca 0.13 1.76 -0.14 0.00 -1.57 0.00 0.00 52.86 53.05 3kbh s ASN 486 Cb -0.18 -2.53 0.16 0.00 -0.02 0.00 0.00 41.25 38.68 3kbh s ASN 486 CO -0.19 -1.48 0.54 0.12 -2.57 0.00 0.00 177.10 173.53 3kbh s PHE 487 N 6.12 3.44 -0.10 2.20 5.36 0.15 -1.16 117.98 133.99 3kbh s PHE 487 Ca 0.82 -1.67 -0.06 0.00 -0.96 0.00 0.00 56.93 55.06 3kbh s PHE 487 Cb -0.29 -3.72 -0.04 0.00 -0.34 0.00 0.00 43.02 38.63 3kbh s PHE 487 CO 0.33 -1.00 0.14 0.95 -1.46 0.00 0.00 175.22 174.18 3kbh s THR 488 N 1.06 5.40 -0.30 0.12 -4.23 0.26 -2.14 115.64 115.81 3kbh s THR 488 Ca 0.08 0.11 0.01 0.00 -1.18 0.00 0.00 61.69 60.71 3kbh s THR 488 Cb -0.23 -3.38 0.09 0.00 1.34 0.00 0.00 72.50 70.32 3kbh s THR 488 CO -0.01 0.57 0.05 0.00 -0.54 0.00 0.00 174.62 174.68 3kbh s ALA 489 N -1.07 2.05 -0.18 3.99 0.00 -0.53 -0.42 121.76 125.59 3kbh s ALA 489 Ca 0.17 -1.86 -0.11 0.00 0.00 0.00 0.00 51.96 50.17 3kbh s ALA 489 Cb -0.12 -1.68 -0.05 0.00 0.00 0.00 0.00 23.12 21.27 3kbh s ALA 489 CO 0.06 -1.56 0.17 0.99 0.00 0.00 0.00 175.76 175.42 3kbh s THR 490 N 1.35 5.39 0.04 0.00 2.01 -0.36 -0.89 115.64 123.18 3kbh s THR 490 Ca 0.07 0.28 0.08 0.00 0.31 0.00 0.00 61.69 62.43 3kbh s THR 490 Cb -0.18 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 3kbh s THR 490 CO -0.15 0.45 -0.23 0.00 -0.69 0.00 0.00 174.62 174.00 3kbh s ALA 491 N 0.24 1.92 0.36 7.40 0.00 0.22 -1.29 121.76 130.61 3kbh s ALA 491 Ca 0.11 -1.12 0.08 0.00 0.00 0.00 0.00 51.96 51.03 3kbh s ALA 491 Cb -0.12 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 3kbh s ALA 491 CO 0.00 0.44 0.14 -1.54 0.00 0.00 0.00 175.76 174.80 3kbh s SER 492 N -1.18 4.57 -0.01 0.00 1.04 -0.57 0.09 113.70 117.65 3kbh s SER 492 Ca 0.09 -0.86 0.01 0.00 0.48 0.00 0.00 55.95 55.67 3kbh s SER 492 Cb -0.09 -0.65 0.01 0.00 0.10 0.00 0.00 66.02 65.39 3kbh s SER 492 CO 0.02 -0.35 -0.02 -0.36 0.98 0.00 0.00 173.24 173.51 3kbh s PHE 493 N -2.47 0.35 0.00 5.02 0.08 -1.26 -0.89 117.98 118.80 3kbh s PHE 493 Ca 0.38 -0.05 0.00 0.00 0.12 0.00 0.00 56.93 57.38 3kbh s PHE 493 Cb -0.01 -0.31 0.00 0.00 -0.57 0.00 0.00 43.02 42.13 3kbh s PHE 493 CO 0.22 -0.06 0.00 0.41 -0.10 0.00 0.00 175.22 175.69 3kbh n GLY 494 N 3.46 0.77 0.00 4.36 0.00 -1.26 -4.76 105.19 107.75 3kbh n GLY 494 Ca -0.19 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.20 3kbh n GLY 494 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kbh n GLY 495 N 0.00 0.77 0.25 -0.02 0.00 -1.26 -4.80 105.19 100.12 3kbh n GLY 495 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3kbh n GLY 495 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3kbh h SER 496 N 0.00 0.00 -3.18 1.61 4.64 -2.00 -3.40 113.55 111.22 3kbh h SER 496 Ca 0.00 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.06 3kbh h SER 496 Cb 0.00 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 61.75 3kbh h SER 496 CO 0.00 0.16 -0.60 0.00 -0.87 0.00 0.00 176.83 175.52 3kbh s TYR 498 N 1.91 3.74 0.00 0.00 6.14 -1.26 -3.76 117.35 124.12 3kbh s TYR 498 Ca -0.02 1.80 0.00 0.00 0.64 0.00 0.00 57.07 59.50 3kbh s TYR 498 Cb -0.12 -3.07 0.00 0.00 0.42 0.00 0.00 41.96 39.19 3kbh s TYR 498 CO -0.06 0.01 0.00 0.28 0.64 0.00 0.00 175.55 176.42 3kbh n VAL 499 N 1.05 0.00 0.19 3.14 0.31 -1.26 -4.84 118.33 116.92 3kbh n VAL 499 Ca -0.00 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 3kbh n VAL 499 Cb 0.47 0.00 -0.07 0.00 -0.91 0.00 0.00 33.84 33.33 3kbh n VAL 499 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kbh s LYS 501 N -6.00 0.94 0.82 0.00 -2.85 -1.26 -4.82 119.74 106.57 3kbh s LYS 501 Ca -0.16 -0.23 -0.12 0.00 -1.00 0.00 0.00 55.97 54.46 3kbh s LYS 501 Cb 0.07 0.42 0.09 0.00 -2.06 0.00 0.00 37.83 36.35 3kbh s LYS 501 CO 0.64 -0.32 1.16 -1.25 0.10 0.00 0.00 175.35 175.68 3kbh s PRO 502 N -2.16 1.63 0.02 1.78 0.04 -1.26 -4.60 135.00 130.45 3kbh s PRO 502 Ca -0.07 1.57 -0.14 0.00 0.04 0.00 0.00 61.00 62.40 3kbh s PRO 502 Cb -0.01 -1.79 -0.07 0.00 0.04 0.00 0.00 34.50 32.66 3kbh s PRO 502 CO 0.00 -2.18 1.19 1.25 0.04 0.00 0.00 177.00 177.30 3kbh h HIS 503 N -1.18 -0.45 -3.80 0.56 2.76 -1.31 -3.46 115.15 108.26 3kbh h HIS 503 Ca -0.45 -0.01 -0.23 0.00 -2.20 0.00 0.00 60.37 57.48 3kbh h HIS 503 Cb 1.27 0.15 -0.15 0.00 1.55 0.00 0.00 27.41 30.23 3kbh h HIS 503 CO 0.50 -0.28 -0.70 -1.14 -1.30 0.00 0.00 177.93 175.01 3kbh s GLN 504 N -4.04 0.82 -0.27 5.26 0.74 -1.23 -4.93 119.66 116.00 3kbh s GLN 504 Ca -0.07 -1.29 -0.01 0.00 0.05 0.00 0.00 55.36 54.04 3kbh s GLN 504 Cb 0.01 -0.24 0.16 0.00 1.10 0.00 0.00 33.01 34.04 3kbh s GLN 504 CO 0.21 -0.00 0.49 0.54 -0.55 0.00 0.00 175.29 175.97 3kbh s VAL 505 N -3.39 -0.79 -0.14 1.34 0.11 -1.26 -1.51 120.40 114.76 3kbh s VAL 505 Ca 0.10 -0.06 -0.29 0.00 -2.93 0.00 0.00 61.98 58.80 3kbh s VAL 505 Cb 0.04 -0.92 -0.01 0.00 -1.53 0.00 0.00 36.38 33.96 3kbh s VAL 505 CO -0.04 -0.08 0.98 0.20 -3.33 0.00 0.00 175.10 172.83 3kbh s ASN 506 N 2.69 7.17 -0.12 3.54 0.01 -0.41 -4.93 114.94 122.89 3kbh s ASN 506 Ca 0.15 1.45 -0.02 0.00 -0.71 0.00 0.00 52.86 53.73 3kbh s ASN 506 Cb -0.14 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 38.95 3kbh s ASN 506 CO -0.20 -0.48 -0.04 -0.63 -1.51 0.00 0.00 177.10 174.24 3kbh s ILE 507 N 2.23 3.86 -0.15 0.60 1.01 -1.26 -1.22 121.20 126.28 3kbh s ILE 507 Ca 0.46 -0.39 -0.12 0.00 0.00 0.00 0.00 60.65 60.60 3kbh s ILE 507 Cb -0.17 -2.65 0.04 0.00 0.01 0.00 0.00 42.46 39.69 3kbh s ILE 507 CO 0.15 0.54 0.38 -0.55 0.00 0.00 0.00 174.94 175.45 3kbh s SER 508 N -0.12 -0.42 -0.54 3.58 0.15 0.44 -4.92 113.70 111.87 3kbh s SER 508 Ca 0.02 0.78 -0.10 0.00 0.70 0.00 0.00 55.95 57.35 3kbh s SER 508 Cb -0.13 0.75 0.14 0.00 -1.71 0.00 0.00 66.02 65.06 3kbh s SER 508 CO 0.03 -0.15 0.43 -0.76 1.20 0.00 0.00 173.24 173.99 3kbh s LEU 509 N 0.58 5.86 -1.22 3.45 2.01 0.47 -0.58 118.68 129.26 3kbh s LEU 509 Ca -0.03 -2.10 -0.22 0.00 0.01 0.00 0.00 54.13 51.79 3kbh s LEU 509 Cb -0.05 -2.05 0.01 0.00 0.01 0.00 0.00 46.19 44.12 3kbh s LEU 509 CO -0.04 -0.67 0.68 0.59 1.01 0.00 0.00 176.35 177.92 3kbh n ASN 510 N 4.68 -4.00 0.00 2.29 5.03 -0.31 -2.69 115.26 120.26 3kbh n ASN 510 Ca -0.04 -1.12 0.00 0.00 0.87 0.00 0.00 54.58 54.29 3kbh n ASN 510 Cb 0.41 -2.72 0.00 0.00 -1.02 0.00 0.00 39.78 36.45 3kbh n ASN 510 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3kbh n GLY 511 N -1.89 1.16 2.27 7.41 0.00 -1.26 -4.93 105.19 107.94 3kbh n GLY 511 Ca -0.14 -0.01 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 3kbh n GLY 511 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3kbh n ASN 512 N 2.28 1.09 -0.34 1.61 5.03 -1.09 -4.93 115.26 118.91 3kbh n ASN 512 Ca 0.00 -1.82 0.11 0.00 0.87 0.00 0.00 54.58 53.74 3kbh n ASN 512 Cb 0.00 -0.29 0.02 0.00 -1.02 0.00 0.00 39.78 38.49 3kbh n ASN 512 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 3kbh n THR 513 N -1.90 0.00 -3.52 3.41 -2.24 -1.26 -0.39 114.28 108.38 3kbh n THR 513 Ca 0.10 -0.18 -0.18 0.00 -2.27 0.00 0.00 64.05 61.52 3kbh n THR 513 Cb 0.35 1.07 -0.06 0.00 -2.10 0.00 0.00 70.33 69.59 3kbh n THR 513 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3kbh s SER 514 N -2.62 -0.65 -0.06 3.42 1.04 -1.26 -1.86 113.70 111.70 3kbh s SER 514 Ca 0.16 0.69 -0.03 0.00 0.48 0.00 0.00 55.95 57.26 3kbh s SER 514 Cb 0.18 0.54 0.04 0.00 0.10 0.00 0.00 66.02 66.87 3kbh s SER 514 CO 0.64 -0.62 0.12 0.54 0.98 0.00 0.00 173.24 174.90 3kbh s VAL 515 N -1.25 -0.19 -0.19 5.02 0.11 -0.95 -4.96 120.40 117.99 3kbh s VAL 515 Ca -0.11 0.37 -0.09 0.00 -2.93 0.00 0.00 61.98 59.23 3kbh s VAL 515 Cb -0.00 -0.23 -0.05 0.00 -1.53 0.00 0.00 36.38 34.57 3kbh s VAL 515 CO 0.09 0.16 0.11 0.00 -3.33 0.00 0.00 175.10 172.13 3kbh s VAL 517 N 0.26 4.43 0.00 0.00 1.01 -1.12 -4.94 120.40 120.03 3kbh s VAL 517 Ca 0.07 2.07 0.00 0.00 0.00 0.00 0.00 61.98 64.12 3kbh s VAL 517 Cb -0.11 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 31.94 3kbh s VAL 517 CO -0.01 0.35 0.37 0.54 0.00 0.00 0.00 175.10 176.35 3kbh n ARG 518 N 2.55 0.49 -3.83 2.72 1.74 -1.26 -4.78 116.66 114.30 3kbh n ARG 518 Ca 0.01 -0.37 -0.30 0.00 -0.77 0.00 0.00 57.85 56.42 3kbh n ARG 518 Cb 0.49 -0.86 -0.15 0.00 -1.02 0.00 0.00 32.46 30.92 3kbh n ARG 518 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 3kbh s THR 519 N -0.18 1.45 0.49 0.55 -1.32 -1.26 -5.11 115.64 110.27 3kbh s THR 519 Ca 0.00 -1.92 -0.21 0.00 -1.21 0.00 0.00 61.69 58.35 3kbh s THR 519 Cb 0.00 -2.07 -0.09 0.00 -1.51 0.00 0.00 72.50 68.83 3kbh s THR 519 CO 0.00 -0.68 0.83 -0.24 -2.21 0.00 0.00 174.62 172.32 3kbh n SER 520 N 4.43 0.36 -1.37 8.08 2.88 -1.26 -4.32 113.62 122.42 3kbh n SER 520 Ca 0.01 0.90 0.00 0.00 -1.33 0.00 0.00 58.87 58.45 3kbh n SER 520 Cb 0.41 -1.29 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 3kbh n SER 520 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3kbh n HIS 521 N -1.09 -1.70 -2.87 0.66 -0.00 -1.26 -5.02 115.22 103.94 3kbh n HIS 521 Ca 0.11 0.90 0.00 0.00 -0.00 0.00 0.00 57.72 58.73 3kbh n HIS 521 Cb 0.43 -1.64 0.00 0.00 -0.00 0.00 0.00 29.99 28.78 3kbh n HIS 521 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.34 178.31 3kbh n PHE 522 N -0.55 -0.04 -3.66 -1.40 1.16 -1.26 -4.18 117.46 107.53 3kbh n PHE 522 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.48 3kbh n PHE 522 Cb 0.00 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 37.79 3kbh n PHE 522 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 3kbh s SER 523 N 0.94 -0.76 -0.03 5.98 0.01 -1.12 -4.94 113.70 113.78 3kbh s SER 523 Ca 0.00 1.29 0.04 0.00 1.31 0.00 0.00 55.95 58.59 3kbh s SER 523 Cb 0.00 1.21 -0.01 0.00 0.21 0.00 0.00 66.02 67.43 3kbh s SER 523 CO 0.00 -0.22 -0.15 -0.51 0.41 0.00 0.00 173.24 172.77 3kbh s ILE 524 N 1.21 1.24 0.03 1.44 -1.16 -1.26 0.29 121.20 122.99 3kbh s ILE 524 Ca -0.07 -0.64 0.01 0.00 -0.51 0.00 0.00 60.65 59.44 3kbh s ILE 524 Cb -0.06 -1.06 -0.02 0.00 0.61 0.00 0.00 42.46 41.93 3kbh s ILE 524 CO -0.12 0.36 -0.05 0.00 -2.81 0.00 0.00 174.94 172.31 3kbh s ARG 525 N -0.08 0.44 -0.40 3.50 1.70 -0.32 -4.97 118.95 118.81 3kbh s ARG 525 Ca 0.00 -0.72 -0.13 0.00 -0.47 0.00 0.00 55.73 54.40 3kbh s ARG 525 Cb -0.09 -0.08 0.03 0.00 -0.57 0.00 0.00 34.95 34.24 3kbh s ARG 525 CO 0.01 -0.01 0.26 -0.47 -1.08 0.00 0.00 175.30 174.02 3kbh s TYR 526 N -1.60 3.24 -0.08 5.89 5.04 -1.26 -0.67 117.35 127.91 3kbh s TYR 526 Ca -0.11 -0.78 -0.15 0.00 -2.44 0.00 0.00 57.07 53.59 3kbh s TYR 526 Cb -0.09 -2.55 -0.05 0.00 0.35 0.00 0.00 41.96 39.62 3kbh s TYR 526 CO -0.01 -0.63 0.37 0.42 -1.34 0.00 0.00 175.55 174.36 3kbh s ILE 527 N 1.62 5.19 -0.18 3.14 1.01 -0.91 -4.96 121.20 126.10 3kbh s ILE 527 Ca 0.04 0.73 -0.02 0.00 0.00 0.00 0.00 60.65 61.40 3kbh s ILE 527 Cb -0.19 -3.69 -0.00 0.00 0.01 0.00 0.00 42.46 38.59 3kbh s ILE 527 CO 0.08 0.47 -0.11 -0.47 0.00 0.00 0.00 174.94 174.92 3kbh s TYR 528 N -0.23 2.87 -0.24 3.97 5.04 -1.26 -1.45 117.35 126.05 3kbh s TYR 528 Ca 0.21 -1.00 0.02 0.00 -2.44 0.00 0.00 57.07 53.86 3kbh s TYR 528 Cb -0.15 -1.98 0.05 0.00 0.35 0.00 0.00 41.96 40.23 3kbh s TYR 528 CO 0.09 -0.50 -0.10 -0.80 -1.34 0.00 0.00 175.55 172.90 3kbh s ASN 529 N 1.09 4.04 -0.14 4.32 0.01 -0.07 -4.99 114.94 119.20 3kbh s ASN 529 Ca 0.00 -1.21 -0.18 0.00 -0.71 0.00 0.00 52.86 50.76 3kbh s ASN 529 Cb -0.15 -1.39 -0.04 0.00 0.41 0.00 0.00 41.25 40.08 3kbh s ASN 529 CO -0.02 -0.18 0.48 -0.13 -1.51 0.00 0.00 177.10 175.73 3kbh s ARG 530 N 1.24 4.30 -0.14 -0.60 0.52 -1.26 0.73 118.95 123.73 3kbh s ARG 530 Ca -0.06 0.43 -0.27 0.00 -0.52 0.00 0.00 55.73 55.31 3kbh s ARG 530 Cb -0.19 -3.47 -0.01 0.00 0.52 0.00 0.00 34.95 31.80 3kbh s ARG 530 CO -0.06 0.07 0.90 0.14 0.02 0.00 0.00 175.30 176.37 3kbh s VAL 531 N 0.90 4.85 0.00 3.52 -7.23 0.11 -4.93 120.40 117.62 3kbh s VAL 531 Ca 0.25 1.79 -0.38 0.00 -1.81 0.00 0.00 61.98 61.83 3kbh s VAL 531 Cb -0.15 -4.20 -0.19 0.00 0.56 0.00 0.00 36.38 32.40 3kbh s VAL 531 CO 0.10 0.02 1.00 0.29 -0.31 0.00 0.00 175.10 176.20 3kbh n LYS 532 N 5.13 0.00 -0.02 4.82 4.76 -1.26 -4.70 118.16 126.89 3kbh n LYS 532 Ca 0.06 0.00 -0.02 0.00 -2.87 0.00 0.00 58.31 55.48 3kbh n LYS 532 Cb 0.49 -1.41 -0.03 0.00 -1.84 0.00 0.00 35.03 32.24 3kbh n LYS 532 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 3kbh n SER 533 N 1.42 3.94 0.00 4.39 3.41 -1.26 -4.98 113.62 120.53 3kbh n SER 533 Ca 0.19 -0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.79 3kbh n SER 533 Cb 0.08 0.49 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 3kbh n SER 533 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kbh n GLY 534 N 2.84 1.74 3.53 5.00 0.00 -1.26 -5.11 105.19 111.93 3kbh n GLY 534 Ca -0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 3kbh n GLY 534 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kbh s SER 535 N -1.53 4.06 0.00 1.61 1.04 -1.26 -4.96 113.70 112.65 3kbh s SER 535 Ca 0.00 -0.56 0.00 0.00 0.48 0.00 0.00 55.95 55.87 3kbh s SER 535 Cb 0.00 -0.63 0.00 0.00 0.10 0.00 0.00 66.02 65.49 3kbh s SER 535 CO 0.00 0.15 0.50 -2.65 0.98 0.00 0.00 173.24 172.22 3kbh n PRO 536 N 0.51 0.70 -0.08 4.02 -0.02 -1.26 -2.57 135.00 136.30 3kbh n PRO 536 Ca -0.13 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.21 3kbh n PRO 536 Cb 0.54 -1.20 -0.05 0.00 -0.02 0.00 0.00 33.50 32.77 3kbh n PRO 536 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3kbh h GLY 537 N 3.96 0.76 -1.60 -1.23 0.00 -2.00 -3.40 103.07 99.55 3kbh h GLY 537 Ca 0.00 -0.82 -0.53 0.00 0.00 0.00 0.00 47.33 45.98 3kbh h GLY 537 CO 0.00 0.74 0.10 1.22 0.00 0.00 0.00 176.54 178.61 3kbh n ASP 538 N -4.23 0.15 0.00 0.19 10.43 -1.06 -1.93 116.55 120.10 3kbh n ASP 538 Ca -0.05 0.49 0.00 0.00 2.57 0.00 0.00 54.79 57.80 3kbh n ASP 538 Cb 0.51 -1.43 0.00 0.00 1.84 0.00 0.00 41.12 42.03 3kbh n ASP 538 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 3kbh n SER 539 N -3.15 0.00 -0.54 -2.24 3.41 -1.26 -4.56 113.62 105.28 3kbh n SER 539 Ca 0.12 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.81 3kbh n SER 539 Cb 0.51 0.00 0.04 0.00 -0.26 0.00 0.00 64.21 64.50 3kbh n SER 539 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3kbh n SER 540 N 0.00 2.07 -4.59 4.04 7.64 -0.81 -4.88 113.62 117.09 3kbh n SER 540 Ca 0.00 -1.54 -0.39 0.00 1.01 0.00 0.00 58.87 57.95 3kbh n SER 540 Cb 0.00 0.19 -0.09 0.00 -1.01 0.00 0.00 64.21 63.30 3kbh n SER 540 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 3kbh s TRP 541 N -1.59 3.23 -0.10 1.43 0.52 -1.21 -0.08 118.94 121.13 3kbh s TRP 541 Ca 0.17 0.26 0.03 0.00 0.02 0.00 0.00 56.10 56.58 3kbh s TRP 541 Cb 0.13 -2.60 0.01 0.00 -1.15 0.00 0.00 33.47 29.86 3kbh s TRP 541 CO 0.29 -0.29 -0.21 -1.01 0.02 0.00 0.00 176.95 175.75 3kbh s HIS 542 N 2.04 2.34 -0.16 -1.98 3.76 0.74 -4.98 115.29 117.04 3kbh s HIS 542 Ca 0.14 -1.00 0.02 0.00 -0.15 0.00 0.00 55.06 54.06 3kbh s HIS 542 Cb -0.16 -1.59 0.01 0.00 1.11 0.00 0.00 32.58 31.95 3kbh s HIS 542 CO 0.11 -0.43 -0.21 0.42 -0.85 0.00 0.00 174.74 173.77 3kbh s ILE 543 N 0.54 2.08 0.25 0.60 1.01 -1.26 -0.10 121.20 124.32 3kbh s ILE 543 Ca -0.15 -0.95 0.01 0.00 0.00 0.00 0.00 60.65 59.56 3kbh s ILE 543 Cb -0.17 -1.85 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 3kbh s ILE 543 CO 0.05 0.54 0.14 -0.72 0.00 0.00 0.00 174.94 174.96 3kbh s TYR 544 N 1.07 1.43 -0.10 3.97 -0.85 -0.97 -4.91 117.35 116.98 3kbh s TYR 544 Ca -0.01 -1.36 0.02 0.00 -0.52 0.00 0.00 57.07 55.21 3kbh s TYR 544 Cb -0.14 -0.74 -0.01 0.00 0.38 0.00 0.00 41.96 41.45 3kbh s TYR 544 CO -0.08 -0.56 -0.17 -0.48 -1.52 0.00 0.00 175.55 172.74 3kbh s LEU 545 N -3.28 2.50 1.25 -3.49 2.34 -1.26 -1.34 118.68 115.40 3kbh s LEU 545 Ca 0.38 -0.39 -0.21 0.00 0.06 0.00 0.00 54.13 53.98 3kbh s LEU 545 Cb 0.06 -1.53 0.31 0.00 -0.56 0.00 0.00 46.19 44.47 3kbh s LEU 545 CO 0.15 0.20 1.10 -0.54 -1.06 0.00 0.00 176.35 176.20 3kbh s LYS 546 N 0.15 -1.62 0.76 1.48 1.02 -0.66 -4.97 119.74 115.90 3kbh s LYS 546 Ca -0.09 -0.17 -0.03 0.00 0.02 0.00 0.00 55.97 55.70 3kbh s LYS 546 Cb -0.15 -1.56 0.14 0.00 -0.52 0.00 0.00 37.83 35.74 3kbh s LYS 546 CO 0.06 -3.96 1.04 -1.54 -0.92 0.00 0.00 175.35 170.03 3kbh s SER 547 N -3.94 4.16 0.00 2.83 1.04 -1.26 -4.38 113.70 112.15 3kbh s SER 547 Ca 0.72 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.87 3kbh s SER 547 Cb -0.08 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 65.99 3kbh s SER 547 CO 0.56 -2.00 0.00 0.61 0.98 0.00 0.00 173.24 173.39 3kbh n GLY 548 N -2.97 0.60 0.62 7.32 0.00 -1.26 -4.57 105.19 104.92 3kbh n GLY 548 Ca 0.15 0.26 0.43 0.00 0.00 0.00 0.00 46.02 46.86 3kbh n GLY 548 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3kbh h THR 549 N 0.00 0.18 -3.52 2.61 2.02 -1.61 -3.44 112.91 109.16 3kbh h THR 549 Ca 0.00 0.00 -0.36 0.00 0.77 0.00 0.00 66.41 66.82 3kbh h THR 549 Cb 0.00 0.19 -0.14 0.00 -1.74 0.00 0.00 68.15 66.46 3kbh h THR 549 CO 0.00 0.00 -0.64 0.00 0.37 0.00 0.00 175.52 175.25 3kbh h PRO 551 N 2.46 -0.17 -7.26 0.00 0.11 -1.96 -3.44 132.00 121.74 3kbh h PRO 551 Ca -0.38 0.01 -0.49 0.00 0.11 0.00 0.00 66.00 65.25 3kbh h PRO 551 Cb 1.23 0.04 0.18 0.00 0.11 0.00 0.00 31.00 32.56 3kbh h PRO 551 CO 0.63 -0.11 0.18 -0.59 -0.21 0.00 0.00 178.00 177.90 3kbh s PHE 552 N -3.50 1.82 0.00 0.65 -0.12 -1.26 -5.02 117.98 110.54 3kbh s PHE 552 Ca -0.03 1.46 0.00 0.00 -0.05 0.00 0.00 56.93 58.31 3kbh s PHE 552 Cb 0.01 -3.20 0.00 0.00 -0.63 0.00 0.00 43.02 39.20 3kbh s PHE 552 CO 0.11 -2.90 0.45 0.45 -0.05 0.00 0.00 175.22 173.28 3kbh n SER 553 N -4.27 0.38 0.00 1.98 2.88 -1.26 -4.94 113.62 108.38 3kbh n SER 553 Ca 0.08 -1.15 0.00 0.00 -1.33 0.00 0.00 58.87 56.47 3kbh n SER 553 Cb 0.54 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 3kbh n SER 553 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 3kbh n PHE 554 N -0.08 0.00 0.00 0.66 3.72 -1.26 -5.02 117.46 115.48 3kbh n PHE 554 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3kbh n PHE 554 Cb 0.36 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.90 3kbh n PHE 554 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 3kbh n ILE 566 N 0.00 0.00 -4.43 4.37 5.41 -1.25 -5.22 119.36 118.23 3kbh n ILE 566 Ca 0.00 0.00 -0.21 0.00 1.00 0.00 0.00 62.75 63.54 3kbh n ILE 566 Cb 0.00 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.83 3kbh n ILE 566 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3kbh s PHE 568 N -2.99 1.75 -0.30 0.00 0.08 -0.85 -1.87 117.98 113.81 3kbh s PHE 568 Ca 0.30 -0.55 -0.16 0.00 0.12 0.00 0.00 56.93 56.64 3kbh s PHE 568 Cb 0.04 -0.81 0.16 0.00 -0.57 0.00 0.00 43.02 41.83 3kbh s PHE 568 CO 0.12 0.38 1.02 0.45 -0.10 0.00 0.00 175.22 177.09 3kbh s SER 569 N -3.27 -0.49 0.74 1.36 0.15 0.22 -2.24 113.70 110.18 3kbh s SER 569 Ca 0.22 0.71 -0.16 0.00 0.70 0.00 0.00 55.95 57.43 3kbh s SER 569 Cb -0.01 1.41 0.00 0.00 -1.71 0.00 0.00 66.02 65.71 3kbh s SER 569 CO 0.07 -0.11 0.83 0.41 1.20 0.00 0.00 173.24 175.65 3kbh n THR 570 N 4.34 2.32 -0.85 6.45 -1.04 -0.78 0.22 114.28 124.93 3kbh n THR 570 Ca -0.13 -0.36 0.01 0.00 -2.04 0.00 0.00 64.05 61.53 3kbh n THR 570 Cb 0.55 -0.98 -0.01 0.00 -1.82 0.00 0.00 70.33 68.07 3kbh n THR 570 CO 0.00 0.00 0.00 0.55 -0.64 0.00 0.00 175.07 174.98 3kbh n VAL 571 N -2.58 -1.47 -2.36 12.58 3.14 -1.26 -4.82 118.33 121.56 3kbh n VAL 571 Ca 0.12 0.77 -0.42 0.00 -2.96 0.00 0.00 64.34 61.85 3kbh n VAL 571 Cb 0.50 -1.27 -0.03 0.00 -1.06 0.00 0.00 33.84 31.98 3kbh n VAL 571 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 3kbh s GLU 572 N -4.66 4.42 -0.06 1.45 2.02 -1.26 -4.71 118.70 115.90 3kbh s GLU 572 Ca 0.00 1.86 0.01 0.00 0.02 0.00 0.00 54.97 56.86 3kbh s GLU 572 Cb 0.00 -3.31 0.02 0.00 0.10 0.00 0.00 34.13 30.94 3kbh s GLU 572 CO 0.00 -0.27 -0.08 0.08 0.02 0.00 0.00 175.26 175.02 3kbh s VAL 573 N 0.88 0.81 -0.09 2.63 1.01 -1.26 -5.12 120.40 119.26 3kbh s VAL 573 Ca 0.59 -0.26 -0.39 0.00 0.00 0.00 0.00 61.98 61.91 3kbh s VAL 573 Cb -0.32 -0.80 -0.17 0.00 0.00 0.00 0.00 36.38 35.09 3kbh s VAL 573 CO 0.31 0.29 1.43 -2.65 0.00 0.00 0.00 175.10 174.47 3kbh n PRO 574 N 4.12 0.82 -2.44 2.72 -0.02 -1.26 -2.63 135.00 136.31 3kbh n PRO 574 Ca -0.22 0.30 -0.05 0.00 -2.02 0.00 0.00 63.50 61.51 3kbh n PRO 574 Cb 0.51 -1.91 0.03 0.00 -0.02 0.00 0.00 33.50 32.11 3kbh n PRO 574 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kbh n GLY 575 N 2.93 0.19 0.00 -1.23 0.00 -1.26 -5.05 105.19 100.77 3kbh n GLY 575 Ca 0.22 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3kbh n GLY 575 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kbh n SER 576 N -1.69 0.00 -0.19 1.61 3.41 -1.08 -4.64 113.62 111.04 3kbh n SER 576 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 3kbh n SER 576 Cb 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 3kbh n SER 576 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kbh n ASN 578 N 0.00 0.00 -4.50 0.00 5.03 -1.25 -3.96 115.26 110.57 3kbh n ASN 578 Ca 0.00 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.03 3kbh n ASN 578 Cb 0.36 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.08 3kbh n ASN 578 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3kbh s PHE 579 N 0.00 2.55 0.34 3.10 0.08 -0.54 -2.44 117.98 121.06 3kbh s PHE 579 Ca 0.00 -0.48 -0.26 0.00 0.12 0.00 0.00 56.93 56.31 3kbh s PHE 579 Cb 0.00 -4.48 -0.10 0.00 -0.57 0.00 0.00 43.02 37.88 3kbh s PHE 579 CO 0.00 -1.84 0.99 -1.25 -0.10 0.00 0.00 175.22 173.02 3kbh s PRO 580 N 4.70 4.49 -0.25 0.24 0.04 -1.26 -1.23 135.00 141.73 3kbh s PRO 580 Ca 0.31 1.43 -0.17 0.00 0.04 0.00 0.00 61.00 62.62 3kbh s PRO 580 Cb -0.10 -2.79 -0.03 0.00 0.04 0.00 0.00 34.50 31.62 3kbh s PRO 580 CO 0.07 0.17 0.45 -1.17 0.04 0.00 0.00 177.00 176.57 3kbh s LEU 581 N -2.11 4.07 -0.14 -3.56 2.96 0.27 -1.66 118.68 118.51 3kbh s LEU 581 Ca 0.51 0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 54.86 3kbh s LEU 581 Cb -0.21 -2.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.89 3kbh s LEU 581 CO 0.27 -0.21 -0.07 -0.70 -1.32 0.00 0.00 176.35 174.31 3kbh s GLU 582 N 2.03 3.55 -0.11 1.98 2.12 -0.45 -0.27 118.70 127.55 3kbh s GLU 582 Ca 0.19 -0.58 0.01 0.00 0.36 0.00 0.00 54.97 54.95 3kbh s GLU 582 Cb -0.16 -2.81 -0.01 0.00 0.26 0.00 0.00 34.13 31.41 3kbh s GLU 582 CO 0.09 0.24 -0.15 0.00 -0.54 0.00 0.00 175.26 174.90 3kbh s ALA 583 N 0.33 2.54 -0.01 6.30 0.00 0.12 -2.29 121.76 128.74 3kbh s ALA 583 Ca -0.06 -0.92 -0.01 0.00 0.00 0.00 0.00 51.96 50.97 3kbh s ALA 583 Cb -0.15 -1.10 0.01 0.00 0.00 0.00 0.00 23.12 21.88 3kbh s ALA 583 CO 0.04 0.31 0.03 -0.08 0.00 0.00 0.00 175.76 176.06 3kbh s THR 584 N 0.17 -0.01 -0.55 0.00 -1.32 0.85 -1.27 115.64 113.51 3kbh s THR 584 Ca -0.09 0.04 -0.19 0.00 -1.21 0.00 0.00 61.69 60.25 3kbh s THR 584 Cb -0.15 -0.06 0.09 0.00 -1.51 0.00 0.00 72.50 70.86 3kbh s THR 584 CO 0.05 0.02 0.64 0.86 -2.21 0.00 0.00 174.62 173.98 3kbh s TRP 585 N 0.23 3.05 -1.58 9.09 -0.00 -1.20 -0.19 118.94 128.34 3kbh s TRP 585 Ca -0.02 -0.85 0.00 0.00 -0.00 0.00 0.00 56.10 55.23 3kbh s TRP 585 Cb -0.03 -3.79 0.00 0.00 -0.00 0.00 0.00 33.47 29.65 3kbh s TRP 585 CO -0.01 -1.16 0.00 1.58 -0.00 0.00 0.00 176.95 177.36 3kbh n HIS 586 N 6.13 -0.65 -2.19 5.86 -0.00 0.88 -2.11 115.22 123.13 3kbh n HIS 586 Ca -0.09 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.43 3kbh n HIS 586 Cb 0.43 -3.39 -0.03 0.00 -0.00 0.00 0.00 29.99 27.00 3kbh n HIS 586 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 3kbh n TYR 587 N -3.68 -0.71 0.00 1.57 4.01 -1.26 -4.90 117.16 112.18 3kbh n TYR 587 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 3kbh n TYR 587 Cb 0.64 -3.67 0.00 0.00 -0.31 0.00 0.00 39.34 36.00 3kbh n TYR 587 CO 0.00 0.00 0.00 2.41 -0.46 0.00 0.00 176.86 178.81 3kbh n THR 588 N -3.65 0.00 -3.89 -0.72 -1.04 -0.90 -4.98 114.28 99.10 3kbh n THR 588 Ca -0.22 0.40 -0.36 0.00 -2.04 0.00 0.00 64.05 61.83 3kbh n THR 588 Cb 0.67 -1.29 -0.06 0.00 -1.82 0.00 0.00 70.33 67.83 3kbh n THR 588 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3kbh s SER 589 N -2.96 6.37 0.03 8.00 1.04 -1.26 -5.03 113.70 119.89 3kbh s SER 589 Ca 0.00 0.43 0.06 0.00 0.48 0.00 0.00 55.95 56.92 3kbh s SER 589 Cb 0.00 -2.04 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 3kbh s SER 589 CO 0.00 0.37 -0.14 -0.31 0.98 0.00 0.00 173.24 174.13 3kbh s TYR 590 N -1.12 2.67 -0.17 5.02 1.51 -1.26 -3.24 117.35 120.76 3kbh s TYR 590 Ca 0.19 -0.18 -0.07 0.00 -1.01 0.00 0.00 57.07 55.99 3kbh s TYR 590 Cb -0.12 -1.52 0.07 0.00 -0.11 0.00 0.00 41.96 40.28 3kbh s TYR 590 CO 0.08 0.29 0.37 -0.08 -1.11 0.00 0.00 175.55 175.10 3kbh s THR 591 N -0.94 -0.38 -0.36 -0.71 -1.32 -0.40 -5.00 115.64 106.54 3kbh s THR 591 Ca 0.15 0.17 -0.25 0.00 -1.21 0.00 0.00 61.69 60.55 3kbh s THR 591 Cb -0.11 -0.58 0.01 0.00 -1.51 0.00 0.00 72.50 70.32 3kbh s THR 591 CO 0.06 0.07 0.90 0.27 -2.21 0.00 0.00 174.62 173.71 3kbh s ILE 592 N 2.13 4.61 -1.82 5.08 -5.25 -1.26 0.14 121.20 124.83 3kbh s ILE 592 Ca -0.04 1.17 0.13 0.00 -0.99 0.00 0.00 60.65 60.92 3kbh s ILE 592 Cb -0.11 -4.31 0.41 0.00 2.95 0.00 0.00 42.46 41.40 3kbh s ILE 592 CO -0.11 -0.50 1.32 1.33 -1.79 0.00 0.00 174.94 175.18 3kbh n VAL 593 N 5.92 0.73 -1.08 8.37 0.24 0.62 -4.92 118.33 128.22 3kbh n VAL 593 Ca 0.06 -0.63 0.00 0.00 -2.04 0.00 0.00 64.34 61.74 3kbh n VAL 593 Cb 0.48 0.22 0.00 0.00 -1.47 0.00 0.00 33.84 33.07 3kbh n VAL 593 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3kbh n GLY 594 N 1.11 0.51 3.57 7.63 0.00 -1.20 -4.96 105.19 111.85 3kbh n GLY 594 Ca 0.15 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.38 3kbh n GLY 594 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kbh s ALA 595 N -1.00 -1.12 -0.31 4.61 0.00 -1.26 0.97 121.76 123.65 3kbh s ALA 595 Ca 0.00 -0.11 -0.07 0.00 0.00 0.00 0.00 51.96 51.78 3kbh s ALA 595 Cb 0.00 0.86 0.02 0.00 0.00 0.00 0.00 23.12 24.00 3kbh s ALA 595 CO 0.00 -0.85 0.10 -1.17 0.00 0.00 0.00 175.76 173.85 3kbh s LEU 596 N -2.86 4.06 -0.13 0.00 2.96 -0.37 -4.43 118.68 117.92 3kbh s LEU 596 Ca 0.08 -0.83 -0.17 0.00 -0.22 0.00 0.00 54.13 52.99 3kbh s LEU 596 Cb -0.02 -1.90 -0.04 0.00 0.50 0.00 0.00 46.19 44.73 3kbh s LEU 596 CO -0.03 -0.24 0.43 -0.31 -1.32 0.00 0.00 176.35 174.88 3kbh s TYR 597 N 1.49 3.50 0.16 5.38 2.02 0.13 -1.46 117.35 128.58 3kbh s TYR 597 Ca 0.02 0.81 0.11 0.00 -0.37 0.00 0.00 57.07 57.64 3kbh s TYR 597 Cb -0.18 -2.49 -0.04 0.00 -0.40 0.00 0.00 41.96 38.85 3kbh s TYR 597 CO 0.03 0.19 -0.24 0.08 -1.57 0.00 0.00 175.55 174.04 3kbh s VAL 598 N 0.56 2.39 -0.15 0.71 1.01 -1.26 -0.61 120.40 123.05 3kbh s VAL 598 Ca 0.23 -1.88 -0.04 0.00 0.00 0.00 0.00 61.98 60.29 3kbh s VAL 598 Cb -0.15 -2.11 0.06 0.00 0.00 0.00 0.00 36.38 34.19 3kbh s VAL 598 CO 0.09 -0.03 0.14 0.28 0.00 0.00 0.00 175.10 175.58 3kbh s THR 599 N -1.41 -0.20 0.58 3.92 -1.32 -0.78 -3.22 115.64 113.21 3kbh s THR 599 Ca 0.18 0.02 -0.00 0.00 -1.21 0.00 0.00 61.69 60.68 3kbh s THR 599 Cb -0.09 -0.50 0.12 0.00 -1.51 0.00 0.00 72.50 70.51 3kbh s THR 599 CO 0.09 -0.12 0.80 -2.67 -2.21 0.00 0.00 174.62 170.51 3kbh n TRP 600 N 5.30 -3.02 0.00 9.09 -0.00 -1.26 -0.91 117.44 126.64 3kbh n TRP 600 Ca -0.06 -1.42 0.00 0.00 -0.00 0.00 0.00 57.50 56.02 3kbh n TRP 600 Cb 0.49 -0.58 0.00 0.00 -0.00 0.00 0.00 31.31 31.22 3kbh n TRP 600 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 177.69 178.14 3kbh n SER 601 N -2.92 0.00 0.00 -0.67 2.88 -1.26 -4.77 113.62 106.88 3kbh n SER 601 Ca 0.13 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.67 3kbh n SER 601 Cb 0.47 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 3kbh n SER 601 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19