#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sf8 h SER 510 N 0.00 -1.05 -0.46 1.61 0.87 -2.03 0.58 113.55 113.07 1sf8 h SER 510 Ca 0.00 0.16 0.08 0.00 -1.23 0.00 0.00 61.79 60.79 1sf8 h SER 510 Cb 0.00 0.45 -0.06 0.00 -0.44 0.00 0.00 62.40 62.34 1sf8 h SER 510 CO 0.00 -0.36 0.08 0.15 -0.53 0.00 0.00 176.83 176.17 1sf8 h PHE 511 N -0.39 0.13 -0.03 2.24 3.57 -1.99 0.26 116.94 120.74 1sf8 h PHE 511 Ca 0.10 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.63 1sf8 h PHE 511 Cb 0.55 0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 1sf8 h PHE 511 CO -0.43 -0.01 0.01 0.82 -2.23 0.00 0.00 178.31 176.47 1sf8 h ILE 512 N 0.22 1.12 -0.49 1.41 1.08 -1.71 -1.25 117.51 117.88 1sf8 h ILE 512 Ca 0.23 -0.35 0.09 0.00 -0.39 0.00 0.00 64.86 64.43 1sf8 h ILE 512 Cb 0.29 1.31 -0.07 0.00 -3.07 0.00 0.00 36.82 35.28 1sf8 h ILE 512 CO -0.30 0.10 0.05 0.44 -0.69 0.00 0.00 178.15 177.74 1sf8 h ASP 513 N -0.10 -0.10 -0.81 1.72 3.32 0.74 0.15 116.42 121.34 1sf8 h ASP 513 Ca 0.01 0.10 0.01 0.00 0.02 0.00 0.00 57.03 57.17 1sf8 h ASP 513 Cb 0.14 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.81 1sf8 h ASP 513 CO -0.00 -0.02 0.54 0.03 -1.72 0.00 0.00 179.24 178.07 1sf8 h ARG 514 N 0.17 1.07 -0.15 3.56 3.08 -0.30 0.22 114.38 122.03 1sf8 h ARG 514 Ca 0.24 -0.06 -0.17 0.00 0.07 0.00 0.00 59.98 60.06 1sf8 h ARG 514 Cb 0.35 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1sf8 h ARG 514 CO -0.36 0.71 -0.60 0.28 -1.07 0.00 0.00 179.97 178.93 1sf8 h VAL 515 N 1.10 1.33 -0.39 2.04 2.07 0.06 -1.59 116.25 120.87 1sf8 h VAL 515 Ca 0.30 -1.88 -0.05 0.00 0.82 0.00 0.00 66.70 65.89 1sf8 h VAL 515 Cb -0.12 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1sf8 h VAL 515 CO -0.07 0.58 0.05 0.11 0.02 0.00 0.00 177.57 178.27 1sf8 h LYS 516 N 0.38 0.66 0.06 1.57 1.57 -0.11 -2.10 116.57 118.60 1sf8 h LYS 516 Ca -0.00 -0.18 0.01 0.00 -1.87 0.00 0.00 60.65 58.61 1sf8 h LYS 516 Cb 1.14 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.36 1sf8 h LYS 516 CO 0.11 0.71 -0.14 0.00 -0.57 0.00 0.00 179.45 179.56 1sf8 h ALA 517 N 0.91 -0.21 -0.71 3.86 0.00 -0.38 -1.62 119.26 121.11 1sf8 h ALA 517 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1sf8 h ALA 517 Cb 0.38 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1sf8 h ALA 517 CO 0.01 -0.65 0.43 1.25 0.00 0.00 0.00 179.25 180.29 1sf8 h LEU 518 N -0.27 0.84 0.00 0.00 5.85 -1.18 -3.13 115.31 117.42 1sf8 h LEU 518 Ca 0.03 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1sf8 h LEU 518 Cb 0.30 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 1sf8 h LEU 518 CO -0.09 0.64 -0.99 -0.07 -0.34 0.00 0.00 178.44 177.58 1sf8 h LEU 519 N 0.97 0.00 0.00 2.25 3.38 -1.26 -3.49 115.31 117.16 1sf8 h LEU 519 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1sf8 h LEU 519 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1sf8 h LEU 519 CO -0.05 0.11 0.00 0.61 0.09 0.00 0.00 178.44 179.20 1sf8 n GLY 520 N 1.21 3.00 0.04 0.83 0.00 -0.62 -1.84 105.19 107.82 1sf8 n GLY 520 Ca -0.01 -0.12 0.10 0.00 0.00 0.00 0.00 46.02 45.98 1sf8 n GLY 520 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1sf8 n GLU 521 N 14.00 0.07 0.31 1.61 0.28 -1.26 -3.25 120.64 132.39 1sf8 n GLU 521 Ca 0.00 0.27 0.21 0.00 -0.16 0.00 0.00 57.16 57.47 1sf8 n GLU 521 Cb 0.00 -1.63 1.06 0.00 1.43 0.00 0.00 31.44 32.31 1sf8 n GLU 521 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1sf8 h ARG 522 N 0.00 0.00 -4.59 3.44 3.08 -1.78 -3.41 114.38 111.12 1sf8 h ARG 522 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 59.98 59.64 1sf8 h ARG 522 Cb 0.35 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 30.10 1sf8 h ARG 522 CO 0.00 0.00 -0.78 0.08 -1.07 0.00 0.00 179.97 178.20 1sf8 s VAL 523 N -3.99 0.73 0.20 2.04 1.01 -1.20 -4.74 120.40 114.44 1sf8 s VAL 523 Ca -0.04 -0.35 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 1sf8 s VAL 523 Cb 0.12 -0.64 0.06 0.00 0.00 0.00 0.00 36.38 35.92 1sf8 s VAL 523 CO 0.40 0.22 1.65 0.50 0.00 0.00 0.00 175.10 177.88 1sf8 h LYS 524 N 6.27 0.93 -2.63 2.72 3.64 -0.97 -3.46 116.57 123.07 1sf8 h LYS 524 Ca -0.32 -0.32 0.08 0.00 -1.27 0.00 0.00 60.65 58.82 1sf8 h LYS 524 Cb 1.17 -0.07 -0.11 0.00 -0.41 0.00 0.00 32.23 32.81 1sf8 h LYS 524 CO 0.49 0.97 0.36 0.34 -2.27 0.00 0.00 179.45 179.35 1sf8 s ASP 525 N -6.66 -0.36 -0.09 4.20 2.15 -1.22 -5.02 116.67 109.68 1sf8 s ASP 525 Ca -0.11 -0.21 -0.01 0.00 0.43 0.00 0.00 52.55 52.66 1sf8 s ASP 525 Cb 0.14 0.53 0.03 0.00 -0.30 0.00 0.00 42.92 43.31 1sf8 s ASP 525 CO 0.84 -0.92 -0.04 -0.69 -0.17 0.00 0.00 175.17 174.20 1sf8 s VAL 526 N -3.48 0.72 0.06 1.11 1.01 -1.26 -0.72 120.40 117.84 1sf8 s VAL 526 Ca 0.07 -0.10 -0.00 0.00 0.00 0.00 0.00 61.98 61.94 1sf8 s VAL 526 Cb -0.02 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 1sf8 s VAL 526 CO -0.05 0.31 -0.04 0.00 0.00 0.00 0.00 175.10 175.32 1sf8 s ARG 527 N 1.74 0.66 0.10 2.72 1.70 -0.09 -4.98 118.95 120.79 1sf8 s ARG 527 Ca 0.03 -1.21 -0.16 0.00 -0.47 0.00 0.00 55.73 53.92 1sf8 s ARG 527 Cb -0.13 0.08 -0.07 0.00 -0.57 0.00 0.00 34.95 34.26 1sf8 s ARG 527 CO -0.06 -0.08 0.53 -0.51 -1.08 0.00 0.00 175.30 174.10 1sf8 s LEU 528 N -2.86 4.42 0.12 -1.89 1.43 -1.26 -1.51 118.68 117.13 1sf8 s LEU 528 Ca 0.07 1.11 0.03 0.00 -1.03 0.00 0.00 54.13 54.31 1sf8 s LEU 528 Cb 0.06 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 43.21 1sf8 s LEU 528 CO -0.08 0.20 -0.08 0.28 0.23 0.00 0.00 176.35 176.90 1sf8 s THR 529 N -1.28 0.89 -0.13 5.49 -1.32 -0.38 -4.86 115.64 114.05 1sf8 s THR 529 Ca 0.32 -1.98 0.04 0.00 -1.21 0.00 0.00 61.69 58.86 1sf8 s THR 529 Cb -0.17 -1.75 -0.05 0.00 -1.51 0.00 0.00 72.50 69.03 1sf8 s THR 529 CO 0.18 -0.82 0.14 1.41 -2.21 0.00 0.00 174.62 173.32 1sf8 n HIS 530 N -0.10 0.00 0.04 9.09 8.25 -1.26 -4.41 115.22 126.82 1sf8 n HIS 530 Ca -0.11 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.36 1sf8 n HIS 530 Cb 0.61 -0.03 0.10 0.00 1.12 0.00 0.00 29.99 31.78 1sf8 n HIS 530 CO 0.00 0.00 0.00 2.89 0.64 0.00 0.00 176.34 179.87 1sf8 n ARG 531 N -1.26 0.02 -3.76 -0.41 1.85 -1.26 -4.55 116.66 107.29 1sf8 n ARG 531 Ca 0.00 0.40 -0.28 0.00 -1.00 0.00 0.00 57.85 56.97 1sf8 n ARG 531 Cb 0.07 -1.75 -0.04 0.00 -1.05 0.00 0.00 32.46 29.70 1sf8 n ARG 531 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1sf8 s LEU 532 N -3.04 4.27 0.00 2.89 1.43 -1.26 -5.06 118.68 117.91 1sf8 s LEU 532 Ca -0.00 0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 1sf8 s LEU 532 Cb 0.01 -3.12 0.00 0.00 0.03 0.00 0.00 46.19 43.11 1sf8 s LEU 532 CO 0.03 0.02 0.00 0.35 0.23 0.00 0.00 176.35 176.98 1sf8 n THR 533 N -0.37 0.00 -0.73 5.49 -2.24 -1.26 -4.86 114.28 110.31 1sf8 n THR 533 Ca -0.05 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.82 1sf8 n THR 533 Cb 0.53 -0.62 0.37 0.00 -2.10 0.00 0.00 70.33 68.51 1sf8 n THR 533 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1sf8 n ASP 534 N -1.13 5.07 -4.43 3.42 3.85 -1.26 -4.75 116.55 117.33 1sf8 n ASP 534 Ca 0.00 -2.63 -0.32 0.00 -0.71 0.00 0.00 54.79 51.13 1sf8 n ASP 534 Cb 0.00 -0.61 -0.14 0.00 -1.35 0.00 0.00 41.12 39.02 1sf8 n ASP 534 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 1sf8 s THR 535 N -2.19 2.72 -0.01 2.12 2.01 -1.26 -5.06 115.64 113.96 1sf8 s THR 535 Ca 0.52 -0.95 0.06 0.00 0.31 0.00 0.00 61.69 61.62 1sf8 s THR 535 Cb 0.36 -2.06 -0.24 0.00 0.01 0.00 0.00 72.50 70.57 1sf8 s THR 535 CO 0.21 0.52 0.80 1.55 -0.69 0.00 0.00 174.62 177.01 1sf8 h PRO 536 N 5.16 0.09 -2.89 4.92 0.13 -1.90 -3.43 132.00 134.07 1sf8 h PRO 536 Ca -0.46 -0.15 -0.08 0.00 -0.87 0.00 0.00 66.00 64.44 1sf8 h PRO 536 Cb 1.14 0.06 -0.18 0.00 0.13 0.00 0.00 31.00 32.15 1sf8 h PRO 536 CO 0.49 0.81 -0.10 0.00 -0.23 0.00 0.00 178.00 178.97 1sf8 s ALA 537 N -2.62 -1.07 0.12 -0.56 0.00 -1.26 -0.25 121.76 116.12 1sf8 s ALA 537 Ca -0.06 0.45 -0.15 0.00 0.00 0.00 0.00 51.96 52.20 1sf8 s ALA 537 Cb 0.08 0.25 0.03 0.00 0.00 0.00 0.00 23.12 23.47 1sf8 s ALA 537 CO 0.83 -0.41 0.36 -1.50 0.00 0.00 0.00 175.76 175.04 1sf8 s ILE 538 N -2.06 0.08 0.13 0.00 -1.16 -0.19 -4.64 121.20 113.36 1sf8 s ILE 538 Ca -0.08 -0.68 0.09 0.00 -0.51 0.00 0.00 60.65 59.47 1sf8 s ILE 538 Cb -0.02 -1.19 -0.04 0.00 0.61 0.00 0.00 42.46 41.82 1sf8 s ILE 538 CO 0.01 -0.38 -0.22 0.54 -2.81 0.00 0.00 174.94 172.08 1sf8 s VAL 539 N -3.78 1.93 0.28 4.00 0.11 -1.26 -0.61 120.40 121.07 1sf8 s VAL 539 Ca 0.03 -1.73 -0.11 0.00 -2.93 0.00 0.00 61.98 57.25 1sf8 s VAL 539 Cb 0.02 -1.78 0.00 0.00 -1.53 0.00 0.00 36.38 33.10 1sf8 s VAL 539 CO -0.12 -0.09 0.51 -0.94 -3.33 0.00 0.00 175.10 171.13 1sf8 s SER 540 N -2.19 0.16 0.01 3.54 1.04 -0.20 -4.92 113.70 111.14 1sf8 s SER 540 Ca 0.12 -1.08 0.02 0.00 0.48 0.00 0.00 55.95 55.48 1sf8 s SER 540 Cb -0.09 0.63 -0.01 0.00 0.10 0.00 0.00 66.02 66.65 1sf8 s SER 540 CO 0.06 -1.23 -0.06 0.42 0.98 0.00 0.00 173.24 173.41 1sf8 s THR 541 N -3.63 0.43 0.33 2.02 -4.23 -1.26 0.75 115.64 110.05 1sf8 s THR 541 Ca 0.24 -0.39 -0.29 0.00 -1.18 0.00 0.00 61.69 60.07 1sf8 s THR 541 Cb -0.01 -0.39 -0.11 0.00 1.34 0.00 0.00 72.50 73.32 1sf8 s THR 541 CO 0.12 0.01 1.56 -1.81 -0.54 0.00 0.00 174.62 173.96 1sf8 s ASP 542 N -0.41 6.33 0.61 3.99 1.01 -1.26 -4.85 116.67 122.08 1sf8 s ASP 542 Ca -0.00 3.02 0.30 0.00 0.71 0.00 0.00 52.55 56.58 1sf8 s ASP 542 Cb -0.04 -2.65 1.68 0.00 1.01 0.00 0.00 42.92 42.92 1sf8 s ASP 542 CO -0.00 -0.92 2.05 0.00 0.21 0.00 0.00 175.17 176.51 1sf8 h ALA 543 N 3.99 1.74 -0.11 5.23 0.00 -2.01 0.40 119.26 128.49 1sf8 h ALA 543 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1sf8 h ALA 543 Cb 1.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1sf8 h ALA 543 CO 0.72 -0.36 0.00 -0.40 0.00 0.00 0.00 179.25 179.21 1sf8 n ASP 544 N -3.59 2.40 0.00 0.00 5.75 -1.26 -5.01 116.55 114.84 1sf8 n ASP 544 Ca 0.02 -1.80 0.00 0.00 -0.01 0.00 0.00 54.79 53.00 1sf8 n ASP 544 Cb 0.38 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1sf8 n ASP 544 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1sf8 n GLU 545 N 0.84 0.00 -3.69 0.11 1.02 0.13 -5.25 120.64 113.79 1sf8 n GLU 545 Ca 0.17 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.19 1sf8 n GLU 545 Cb 0.48 -0.08 -0.06 0.00 -0.02 0.00 0.00 31.44 31.76 1sf8 n GLU 545 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1sf8 s SER 547 N -1.96 -0.20 0.18 1.62 1.04 -1.26 -4.82 113.70 108.30 1sf8 s SER 547 Ca 0.00 -0.17 -0.19 0.00 0.48 0.00 0.00 55.95 56.08 1sf8 s SER 547 Cb 0.00 0.41 0.14 0.00 0.10 0.00 0.00 66.02 66.67 1sf8 s SER 547 CO 0.00 -0.70 1.61 0.74 0.98 0.00 0.00 173.24 175.88 1sf8 h THR 548 N 2.91 0.31 0.00 2.02 2.02 -2.00 -0.96 112.91 117.21 1sf8 h THR 548 Ca -0.32 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1sf8 h THR 548 Cb 1.21 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1sf8 h THR 548 CO 0.46 0.00 0.00 0.00 0.37 0.00 0.00 175.52 176.35 1sf8 n GLN 549 N -5.41 0.37 0.00 6.66 0.00 -1.26 -1.81 117.38 115.93 1sf8 n GLN 549 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.04 1sf8 n GLN 549 Cb 0.32 -1.32 0.00 0.00 0.00 0.00 0.00 30.24 29.25 1sf8 n GLN 549 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1sf8 n ALA 551 N 1.17 0.00 -0.34 2.61 0.00 -0.37 -1.49 120.51 122.09 1sf8 n ALA 551 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1sf8 n ALA 551 Cb 0.18 0.00 0.32 0.00 0.00 0.00 0.00 19.45 19.95 1sf8 n ALA 551 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1sf8 h LYS 552 N 0.00 0.78 -0.34 0.00 1.57 -1.62 0.11 116.57 117.07 1sf8 h LYS 552 Ca 0.00 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.70 1sf8 h LYS 552 Cb 0.00 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 1sf8 h LYS 552 CO 0.00 0.52 0.08 -0.07 -0.57 0.00 0.00 179.45 179.41 1sf8 h LEU 553 N 0.80 0.45 -0.21 2.94 3.38 -1.56 -0.59 115.31 120.53 1sf8 h LEU 553 Ca 0.54 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.43 1sf8 h LEU 553 Cb 0.78 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1sf8 h LEU 553 CO -0.32 0.47 0.08 -0.26 0.09 0.00 0.00 178.44 178.50 1sf8 h PHE 554 N 0.49 0.33 -0.06 1.13 -1.00 -1.07 -0.42 116.94 116.33 1sf8 h PHE 554 Ca 0.12 -0.03 0.02 0.00 2.81 0.00 0.00 57.97 60.89 1sf8 h PHE 554 Cb 0.20 -0.10 -0.03 0.00 3.61 0.00 0.00 35.95 39.64 1sf8 h PHE 554 CO 0.01 0.37 -0.08 0.00 -1.61 0.00 0.00 178.31 177.00 1sf8 h ALA 555 N 0.92 -0.04 -0.06 2.45 0.00 -1.08 0.24 119.26 121.69 1sf8 h ALA 555 Ca 0.07 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.03 1sf8 h ALA 555 Cb 0.19 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1sf8 h ALA 555 CO -0.01 -0.56 0.18 0.00 0.00 0.00 0.00 179.25 178.87 1sf8 h ALA 556 N 0.92 1.38 -0.40 0.00 0.00 -0.76 0.73 119.26 121.13 1sf8 h ALA 556 Ca 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1sf8 h ALA 556 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1sf8 h ALA 556 CO -0.13 -0.21 0.00 0.00 0.00 0.00 0.00 179.25 178.91 1sf8 n ALA 557 N -2.10 2.44 -3.00 0.00 0.00 -0.12 -4.93 120.51 112.81 1sf8 n ALA 557 Ca -0.01 -0.87 -0.13 0.00 0.00 0.00 0.00 53.44 52.44 1sf8 n ALA 557 Cb 0.26 -0.96 0.04 0.00 0.00 0.00 0.00 19.45 18.79 1sf8 n ALA 557 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sf8 n GLY 558 N 1.36 0.14 3.63 0.00 0.00 0.26 -5.04 105.19 105.53 1sf8 n GLY 558 Ca 0.18 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1sf8 n GLY 558 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sf8 s GLN 559 N -5.59 2.15 0.27 1.61 -1.52 -0.12 -5.01 119.66 111.46 1sf8 s GLN 559 Ca 0.28 -1.58 -0.29 0.00 -1.95 0.00 0.00 55.36 51.81 1sf8 s GLN 559 Cb -0.12 -2.04 -0.10 0.00 -0.22 0.00 0.00 33.01 30.53 1sf8 s GLN 559 CO 0.35 0.26 1.31 0.21 -0.25 0.00 0.00 175.29 177.17 1sf8 s LYS 560 N -3.68 4.37 -0.20 2.91 2.20 -1.26 -4.11 119.74 119.97 1sf8 s LYS 560 Ca 0.33 2.15 -0.29 0.00 -0.36 0.00 0.00 55.97 57.80 1sf8 s LYS 560 Cb -0.04 -3.12 -0.01 0.00 -1.51 0.00 0.00 37.83 33.15 1sf8 s LYS 560 CO 0.19 -0.22 1.21 0.08 -0.36 0.00 0.00 175.35 176.25 1sf8 s VAL 561 N -0.56 4.38 0.46 4.02 1.01 -1.26 -4.82 120.40 123.62 1sf8 s VAL 561 Ca 0.53 1.65 -0.25 0.00 0.00 0.00 0.00 61.98 63.91 1sf8 s VAL 561 Cb -0.39 -4.10 -0.08 0.00 0.00 0.00 0.00 36.38 31.81 1sf8 s VAL 561 CO 0.46 -0.19 1.41 -2.84 0.00 0.00 0.00 175.10 173.94 1sf8 s PRO 562 N 3.49 3.62 0.34 2.72 0.02 -1.26 -4.90 135.00 139.03 1sf8 s PRO 562 Ca 0.52 2.37 -0.29 0.00 0.02 0.00 0.00 61.00 63.62 1sf8 s PRO 562 Cb -0.19 -2.60 -0.12 0.00 0.02 0.00 0.00 34.50 31.61 1sf8 s PRO 562 CO 0.13 -0.85 1.42 -1.91 -0.33 0.00 0.00 177.00 175.46 1sf8 n GLU 563 N -0.30 2.41 -3.97 5.54 2.13 -1.26 -4.91 120.64 120.28 1sf8 n GLU 563 Ca 0.06 0.85 -0.34 0.00 0.66 0.00 0.00 57.16 58.38 1sf8 n GLU 563 Cb 0.42 -2.52 -0.15 0.00 0.27 0.00 0.00 31.44 29.47 1sf8 n GLU 563 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1sf8 s VAL 564 N -0.86 2.90 -0.44 6.31 1.01 -1.26 -4.96 120.40 123.09 1sf8 s VAL 564 Ca 0.57 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 61.57 1sf8 s VAL 564 Cb -0.53 -2.36 0.04 0.00 0.00 0.00 0.00 36.38 33.52 1sf8 s VAL 564 CO 0.60 0.35 0.46 -0.54 0.00 0.00 0.00 175.10 175.97 1sf8 s LYS 565 N 1.38 3.08 0.01 2.72 1.02 -1.26 -4.97 119.74 121.71 1sf8 s LYS 565 Ca 0.03 -0.89 -0.21 0.00 0.02 0.00 0.00 55.97 54.93 1sf8 s LYS 565 Cb -0.15 -4.02 -0.05 0.00 -0.52 0.00 0.00 37.83 33.09 1sf8 s LYS 565 CO -0.06 -0.94 0.61 0.71 -0.92 0.00 0.00 175.35 174.75 1sf8 s TYR 566 N 2.13 3.70 -0.21 3.18 1.51 -1.26 -4.60 117.35 121.79 1sf8 s TYR 566 Ca 0.11 1.23 -0.14 0.00 -1.01 0.00 0.00 57.07 57.26 1sf8 s TYR 566 Cb -0.19 -2.61 -0.04 0.00 -0.11 0.00 0.00 41.96 39.01 1sf8 s TYR 566 CO 0.12 0.37 0.30 0.42 -1.11 0.00 0.00 175.55 175.65 1sf8 s ILE 567 N -0.27 5.27 -0.30 2.71 1.01 0.23 -0.40 121.20 129.44 1sf8 s ILE 567 Ca 0.31 0.50 -0.15 0.00 0.00 0.00 0.00 60.65 61.31 1sf8 s ILE 567 Cb -0.19 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.62 1sf8 s ILE 567 CO 0.18 0.30 0.39 0.12 0.00 0.00 0.00 174.94 175.92 1sf8 s PHE 568 N 1.15 3.23 -0.14 3.97 5.36 0.10 -1.03 117.98 130.62 1sf8 s PHE 568 Ca 0.14 0.28 0.00 0.00 -0.96 0.00 0.00 56.93 56.40 1sf8 s PHE 568 Cb -0.14 -2.64 -0.01 0.00 -0.34 0.00 0.00 43.02 39.90 1sf8 s PHE 568 CO 0.06 -0.31 -0.15 -1.21 -1.46 0.00 0.00 175.22 172.15 1sf8 s GLU 569 N 2.10 3.25 -0.00 10.12 2.02 0.22 -0.92 118.70 135.49 1sf8 s GLU 569 Ca 0.15 -0.74 0.04 0.00 0.02 0.00 0.00 54.97 54.44 1sf8 s GLU 569 Cb -0.16 -2.61 -0.03 0.00 0.10 0.00 0.00 34.13 31.43 1sf8 s GLU 569 CO 0.11 0.08 -0.11 -0.51 0.02 0.00 0.00 175.26 174.85 1sf8 s LEU 570 N 0.65 2.92 -0.56 1.80 1.43 -0.57 -1.03 118.68 123.33 1sf8 s LEU 570 Ca -0.08 -0.22 -0.17 0.00 -1.03 0.00 0.00 54.13 52.63 1sf8 s LEU 570 Cb -0.16 -1.67 0.11 0.00 0.03 0.00 0.00 46.19 44.51 1sf8 s LEU 570 CO 0.02 0.30 0.59 0.21 0.23 0.00 0.00 176.35 177.70 1sf8 s ASN 571 N -1.22 6.19 0.17 2.29 2.47 0.66 -1.25 114.94 124.25 1sf8 s ASN 571 Ca 0.15 -1.59 0.11 0.00 0.42 0.00 0.00 52.86 51.95 1sf8 s ASN 571 Cb -0.11 -2.25 0.59 0.00 -1.45 0.00 0.00 41.25 38.03 1sf8 s ASN 571 CO 0.05 -0.97 1.32 -0.81 -3.72 0.00 0.00 177.10 172.97 1sf8 n PRO 572 N 5.77 0.07 0.03 0.43 -0.04 -1.26 -1.44 135.00 138.55 1sf8 n PRO 572 Ca -0.12 0.56 0.02 0.00 -0.04 0.00 0.00 63.50 63.92 1sf8 n PRO 572 Cb 0.41 -1.75 -0.08 0.00 -0.04 0.00 0.00 33.50 32.04 1sf8 n PRO 572 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1sf8 n ASP 573 N -1.88 0.77 -4.76 3.54 8.00 -1.26 -4.62 116.55 116.34 1sf8 n ASP 573 Ca -0.01 0.33 -0.38 0.00 0.71 0.00 0.00 54.79 55.45 1sf8 n ASP 573 Cb 0.04 0.35 0.02 0.00 -0.02 0.00 0.00 41.12 41.50 1sf8 n ASP 573 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1sf8 s HIS 574 N -3.00 2.54 0.09 1.24 2.46 -0.52 -4.90 115.29 113.19 1sf8 s HIS 574 Ca -0.03 1.45 -0.28 0.00 0.47 0.00 0.00 55.06 56.67 1sf8 s HIS 574 Cb 0.09 -3.61 -0.14 0.00 -0.13 0.00 0.00 32.58 28.79 1sf8 s HIS 574 CO 0.81 -2.29 1.66 0.28 -2.47 0.00 0.00 174.74 172.73 1sf8 h VAL 575 N 1.61 0.56 -0.67 0.89 2.07 -1.92 -2.27 116.25 116.51 1sf8 h VAL 575 Ca -0.50 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.15 1sf8 h VAL 575 Cb 1.28 0.56 -0.09 0.00 -1.52 0.00 0.00 31.29 31.51 1sf8 h VAL 575 CO 0.58 0.00 0.20 -0.07 0.02 0.00 0.00 177.57 178.31 1sf8 h LEU 576 N -0.49 0.12 -0.64 2.57 3.38 -1.94 0.37 115.31 118.67 1sf8 h LEU 576 Ca -0.02 0.11 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 1sf8 h LEU 576 Cb 0.43 0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1sf8 h LEU 576 CO -0.00 0.05 0.34 0.58 0.09 0.00 0.00 178.44 179.49 1sf8 h VAL 577 N 0.34 1.21 -0.25 1.22 2.07 -1.78 -0.69 116.25 118.37 1sf8 h VAL 577 Ca 0.36 -0.55 -0.07 0.00 0.82 0.00 0.00 66.70 67.26 1sf8 h VAL 577 Cb 0.55 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1sf8 h VAL 577 CO -0.41 0.24 -0.13 0.11 0.02 0.00 0.00 177.57 177.40 1sf8 h LYS 578 N 0.88 0.42 -0.50 1.57 1.57 -0.59 0.66 116.57 120.59 1sf8 h LYS 578 Ca 0.22 -0.11 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 1sf8 h LYS 578 Cb 0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1sf8 h LYS 578 CO -0.03 0.55 0.17 -0.09 -0.57 0.00 0.00 179.45 179.47 1sf8 h ARG 579 N 0.39 0.76 -0.31 3.15 2.43 0.66 -1.12 114.38 120.35 1sf8 h ARG 579 Ca 0.07 -0.16 -0.09 0.00 -0.81 0.00 0.00 59.98 59.00 1sf8 h ARG 579 Cb 0.46 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 1sf8 h ARG 579 CO 0.03 0.71 -0.16 0.00 -1.51 0.00 0.00 179.97 179.03 1sf8 h ALA 580 N 1.02 0.43 0.00 2.80 0.00 -0.69 -2.51 119.26 120.31 1sf8 h ALA 580 Ca 0.16 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1sf8 h ALA 580 Cb 0.25 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1sf8 h ALA 580 CO -0.01 0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.59 1sf8 n ALA 581 N -2.45 1.52 0.43 0.00 0.00 0.18 -2.80 120.51 117.39 1sf8 n ALA 581 Ca -0.03 0.02 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1sf8 n ALA 581 Cb 0.39 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1sf8 n ALA 581 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1sf8 n ASP 582 N -1.80 0.67 -4.70 0.00 8.00 -0.44 -4.97 116.55 113.31 1sf8 n ASP 582 Ca 0.02 -0.84 -0.42 0.00 0.71 0.00 0.00 54.79 54.26 1sf8 n ASP 582 Cb 0.15 0.83 -0.03 0.00 -0.02 0.00 0.00 41.12 42.05 1sf8 n ASP 582 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1sf8 s THR 583 N -1.68 3.89 0.00 -3.53 2.01 -0.97 -4.94 115.64 110.43 1sf8 s THR 583 Ca 0.05 1.31 -0.15 0.00 0.31 0.00 0.00 61.69 63.20 1sf8 s THR 583 Cb 0.07 -3.84 -0.34 0.00 0.01 0.00 0.00 72.50 68.40 1sf8 s THR 583 CO 0.33 0.05 0.90 -0.33 -0.69 0.00 0.00 174.62 174.88 1sf8 h GLU 584 N 7.25 0.49 -6.25 4.92 4.39 -1.92 -3.45 114.58 120.01 1sf8 h GLU 584 Ca -0.39 -0.84 -0.56 0.00 0.34 0.00 0.00 59.36 57.92 1sf8 h GLU 584 Cb 1.19 0.31 -0.01 0.00 -0.10 0.00 0.00 28.75 30.15 1sf8 h GLU 584 CO 0.86 1.40 1.19 0.34 -1.16 0.00 0.00 179.01 181.64 1sf8 s ASP 585 N -7.48 6.36 0.46 1.42 2.15 -1.26 -4.88 116.67 113.44 1sf8 s ASP 585 Ca -0.11 2.07 0.18 0.00 0.43 0.00 0.00 52.55 55.12 1sf8 s ASP 585 Cb 0.04 -2.53 1.14 0.00 -0.30 0.00 0.00 42.92 41.27 1sf8 s ASP 585 CO 0.92 -1.20 1.96 -0.33 -0.17 0.00 0.00 175.17 176.34 1sf8 h GLU 586 N 10.90 0.29 -0.06 4.34 4.39 -1.99 -0.57 114.58 131.89 1sf8 h GLU 586 Ca -0.40 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.26 1sf8 h GLU 586 Cb 1.19 -0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.77 1sf8 h GLU 586 CO 0.97 0.19 -0.05 0.00 -1.16 0.00 0.00 179.01 178.96 1sf8 h ALA 587 N 1.69 0.09 -0.28 3.43 0.00 -1.99 0.00 119.26 122.20 1sf8 h ALA 587 Ca 0.31 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1sf8 h ALA 587 Cb 0.80 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1sf8 h ALA 587 CO -0.08 -0.12 0.17 -0.22 0.00 0.00 0.00 179.25 179.00 1sf8 h LYS 588 N -0.28 0.39 -0.22 0.00 1.63 -1.84 -0.03 116.57 116.21 1sf8 h LYS 588 Ca 0.01 -0.04 0.06 0.00 -0.85 0.00 0.00 60.65 59.83 1sf8 h LYS 588 Cb 0.54 -0.08 -0.06 0.00 -0.60 0.00 0.00 32.23 32.03 1sf8 h LYS 588 CO 0.01 0.30 -0.18 0.35 -3.45 0.00 0.00 179.45 176.48 1sf8 h PHE 589 N 0.36 -0.46 -0.57 1.91 3.57 -1.08 -0.11 116.94 120.56 1sf8 h PHE 589 Ca 0.10 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.70 1sf8 h PHE 589 Cb 0.01 0.24 -0.06 0.00 2.79 0.00 0.00 35.95 38.94 1sf8 h PHE 589 CO -0.04 -0.26 0.25 1.03 -2.23 0.00 0.00 178.31 177.06 1sf8 h SER 590 N -0.18 0.32 -0.45 0.41 0.87 -0.58 -1.59 113.55 112.35 1sf8 h SER 590 Ca 0.13 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.77 1sf8 h SER 590 Cb 0.38 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 1sf8 h SER 590 CO -0.33 0.21 0.25 -0.33 -0.53 0.00 0.00 176.83 176.09 1sf8 h GLU 591 N 0.47 0.48 0.40 2.24 4.39 0.36 0.11 114.58 123.03 1sf8 h GLU 591 Ca 0.27 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.92 1sf8 h GLU 591 Cb 0.26 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 28.80 1sf8 h GLU 591 CO -0.23 0.32 -0.19 -1.49 -1.16 0.00 0.00 179.01 176.25 1sf8 h TRP 592 N 0.49 -0.49 -1.01 4.33 4.06 -0.58 -1.49 115.95 121.27 1sf8 h TRP 592 Ca 0.19 -0.01 0.03 0.00 2.06 0.00 0.00 58.89 61.16 1sf8 h TRP 592 Cb 0.06 0.16 -0.06 0.00 -1.00 0.00 0.00 29.16 28.33 1sf8 h TRP 592 CO -0.09 -0.26 0.66 0.28 -3.56 0.00 0.00 178.44 175.47 1sf8 h VAL 593 N -0.61 1.20 -0.43 1.49 2.07 -1.20 -0.60 116.25 118.17 1sf8 h VAL 593 Ca -0.05 -0.45 -0.01 0.00 0.82 0.00 0.00 66.70 67.01 1sf8 h VAL 593 Cb 0.45 -0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1sf8 h VAL 593 CO 0.09 0.24 0.24 -0.33 0.02 0.00 0.00 177.57 177.83 1sf8 h GLU 594 N 1.30 0.58 -0.16 1.57 4.39 -0.58 -0.70 114.58 120.98 1sf8 h GLU 594 Ca 0.39 -0.05 -0.15 0.00 0.34 0.00 0.00 59.36 59.89 1sf8 h GLU 594 Cb -0.04 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.49 1sf8 h GLU 594 CO -0.11 0.42 -0.50 1.25 -1.16 0.00 0.00 179.01 178.91 1sf8 h LEU 595 N 0.59 0.71 -0.52 1.33 5.85 -0.17 -2.10 115.31 121.00 1sf8 h LEU 595 Ca 0.15 -0.60 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 1sf8 h LEU 595 Cb 0.00 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 40.80 1sf8 h LEU 595 CO -0.03 1.18 0.27 -0.07 -0.34 0.00 0.00 178.44 179.46 1sf8 h LEU 596 N 0.27 0.66 -0.65 2.25 3.38 -0.62 -2.19 115.31 118.41 1sf8 h LEU 596 Ca -0.02 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1sf8 h LEU 596 Cb 1.12 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1sf8 h LEU 596 CO 0.11 0.58 -0.13 0.25 0.09 0.00 0.00 178.44 179.34 1sf8 h LEU 597 N 0.69 0.93 -0.17 1.67 5.85 -1.18 -2.59 115.31 120.51 1sf8 h LEU 597 Ca 0.18 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.60 1sf8 h LEU 597 Cb 0.08 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.85 1sf8 h LEU 597 CO -0.03 1.06 0.10 0.44 -0.34 0.00 0.00 178.44 179.67 1sf8 h ASP 598 N 0.82 0.20 -0.75 1.25 3.32 -1.05 -0.74 116.42 119.48 1sf8 h ASP 598 Ca 0.13 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1sf8 h ASP 598 Cb 0.66 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 40.13 1sf8 h ASP 598 CO 0.05 0.18 0.28 0.06 -1.72 0.00 0.00 179.24 178.09 1sf8 h GLN 599 N 0.21 1.14 -0.54 3.56 3.07 -1.38 0.99 115.11 122.16 1sf8 h GLN 599 Ca 0.06 -0.21 0.01 0.00 0.09 0.00 0.00 58.65 58.59 1sf8 h GLN 599 Cb 0.01 -0.18 -0.03 0.00 0.08 0.00 0.00 27.48 27.36 1sf8 h GLN 599 CO -0.01 0.93 0.36 0.00 0.09 0.00 0.00 178.83 180.20 1sf8 h ALA 600 N 1.20 0.69 -0.38 0.06 0.00 -1.25 -0.01 119.26 119.57 1sf8 h ALA 600 Ca 0.25 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 1sf8 h ALA 600 Cb 0.24 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1sf8 h ALA 600 CO -0.02 0.13 -0.28 -0.07 0.00 0.00 0.00 179.25 179.01 1sf8 h LEU 601 N 0.73 0.83 -0.11 0.00 3.38 -0.45 -1.27 115.31 118.42 1sf8 h LEU 601 Ca 0.20 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1sf8 h LEU 601 Cb -0.08 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.44 1sf8 h LEU 601 CO -0.04 1.05 0.05 0.25 0.09 0.00 0.00 178.44 179.83 1sf8 h LEU 602 N 0.68 0.15 -0.98 1.67 5.85 -0.56 0.25 115.31 122.37 1sf8 h LEU 602 Ca 0.08 -0.16 0.14 0.00 0.84 0.00 0.00 57.88 58.79 1sf8 h LEU 602 Cb 0.81 -0.04 -0.09 0.00 0.37 0.00 0.00 40.66 41.71 1sf8 h LEU 602 CO 0.07 0.27 0.60 0.00 -0.34 0.00 0.00 178.44 179.04 1sf8 h ALA 603 N 0.89 1.52 0.15 1.25 0.00 -0.82 0.65 119.26 122.90 1sf8 h ALA 603 Ca 0.04 0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.69 1sf8 h ALA 603 Cb 0.16 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1sf8 h ALA 603 CO -0.00 0.11 -1.43 1.49 0.00 0.00 0.00 179.25 179.41 1sf8 h GLU 604 N 0.88 0.32 0.00 0.00 4.57 -0.85 -3.38 114.58 116.11 1sf8 h GLU 604 Ca 0.51 -0.54 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1sf8 h GLU 604 Cb 0.62 0.20 0.00 0.00 -0.16 0.00 0.00 28.75 29.41 1sf8 h GLU 604 CO -0.31 1.22 -0.74 0.54 -1.18 0.00 0.00 179.01 178.54 1sf8 n ARG 605 N -3.53 2.25 -0.95 1.92 1.74 0.86 -4.98 116.66 113.96 1sf8 n ARG 605 Ca -0.14 -0.01 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1sf8 n ARG 605 Cb 1.05 -1.17 0.00 0.00 -1.02 0.00 0.00 32.46 31.32 1sf8 n ARG 605 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sf8 n GLY 606 N 1.36 0.57 3.85 -0.13 0.00 0.23 -4.96 105.19 106.10 1sf8 n GLY 606 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.97 1sf8 n GLY 606 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1sf8 s THR 607 N -2.49 0.00 0.08 2.61 -4.23 -1.25 -5.03 115.64 105.32 1sf8 s THR 607 Ca 0.00 -0.97 0.03 0.00 -1.18 0.00 0.00 61.69 59.57 1sf8 s THR 607 Cb 0.00 -2.10 -0.03 0.00 1.34 0.00 0.00 72.50 71.70 1sf8 s THR 607 CO 0.00 0.00 -0.08 -0.76 -0.54 0.00 0.00 174.62 173.24 1sf8 s LEU 608 N -2.94 2.39 0.15 4.79 1.43 -1.26 -4.28 118.68 118.96 1sf8 s LEU 608 Ca 0.12 -0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 52.30 1sf8 s LEU 608 Cb -0.05 -0.19 0.03 0.00 0.03 0.00 0.00 46.19 46.00 1sf8 s LEU 608 CO 0.07 -0.31 1.63 -0.08 0.23 0.00 0.00 176.35 177.89 1sf8 h GLU 609 N 3.66 0.86 -2.74 1.70 4.81 -2.00 -3.37 114.58 117.49 1sf8 h GLU 609 Ca -0.36 -0.24 -0.60 0.00 -0.13 0.00 0.00 59.36 58.02 1sf8 h GLU 609 Cb 1.19 -0.09 -0.40 0.00 0.63 0.00 0.00 28.75 30.07 1sf8 h GLU 609 CO 0.53 0.86 -0.78 0.34 -0.73 0.00 0.00 179.01 179.23 1sf8 s ASP 610 N -6.28 3.11 0.20 1.04 -1.08 -1.26 -4.98 116.67 107.42 1sf8 s ASP 610 Ca -0.13 -3.27 -0.10 0.00 -0.52 0.00 0.00 52.55 48.53 1sf8 s ASP 610 Cb 0.12 -0.99 0.24 0.00 -1.46 0.00 0.00 42.92 40.84 1sf8 s ASP 610 CO 0.81 -0.16 1.77 -0.65 0.52 0.00 0.00 175.17 177.46 1sf8 h PRO 611 N 5.76 0.47 -0.97 4.34 0.11 -1.99 -2.25 132.00 137.47 1sf8 h PRO 611 Ca 0.17 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.27 1sf8 h PRO 611 Cb 0.86 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 31.81 1sf8 h PRO 611 CO 0.52 0.31 0.64 -0.91 -0.21 0.00 0.00 178.00 178.35 1sf8 h ASN 612 N 0.48 1.09 -0.11 -2.05 2.35 -1.96 0.12 115.58 115.50 1sf8 h ASN 612 Ca 0.29 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1sf8 h ASN 612 Cb 0.29 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.39 1sf8 h ASN 612 CO -0.25 0.78 0.05 0.25 -1.65 0.00 0.00 177.43 176.60 1sf8 h LEU 613 N 1.28 0.14 -0.24 1.61 5.85 -1.85 0.14 115.31 122.24 1sf8 h LEU 613 Ca 0.37 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 59.02 1sf8 h LEU 613 Cb -0.09 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 40.83 1sf8 h LEU 613 CO -0.09 0.23 -0.29 0.15 -0.34 0.00 0.00 178.44 178.10 1sf8 h PHE 614 N 0.04 -0.80 0.03 1.25 3.57 -0.77 0.60 116.94 120.86 1sf8 h PHE 614 Ca 0.04 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.59 1sf8 h PHE 614 Cb 0.13 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1sf8 h PHE 614 CO -0.03 -0.37 -0.09 0.82 -2.23 0.00 0.00 178.31 176.42 1sf8 h ILE 615 N -0.31 0.78 -0.13 1.41 2.04 -0.54 -2.71 117.51 118.05 1sf8 h ILE 615 Ca 0.13 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.03 1sf8 h ILE 615 Cb 0.51 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 1sf8 h ILE 615 CO -0.41 0.00 -0.11 -0.09 0.00 0.00 0.00 178.15 177.54 1sf8 h ARG 616 N -0.16 -0.12 -0.98 2.37 2.43 -0.25 -0.27 114.38 117.39 1sf8 h ARG 616 Ca 0.03 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1sf8 h ARG 616 Cb 0.19 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1sf8 h ARG 616 CO -0.07 -0.08 0.00 -2.13 -1.51 0.00 0.00 179.97 176.18 1sf8 n ARG 617 N -5.25 0.00 0.00 0.20 0.63 0.21 -1.72 116.66 110.72 1sf8 n ARG 617 Ca -0.03 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.90 1sf8 n ARG 617 Cb 0.18 -1.18 0.00 0.00 0.45 0.00 0.00 32.46 31.90 1sf8 n ARG 617 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1sf8 n ASN 619 N 0.71 0.00 -0.14 6.15 3.02 -0.11 -2.57 115.26 122.32 1sf8 n ASN 619 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.46 1sf8 n ASN 619 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 1sf8 n ASN 619 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 1sf8 h GLN 620 N 0.00 0.61 0.00 3.52 5.75 -1.59 -2.57 115.11 120.83 1sf8 h GLN 620 Ca 0.00 -0.12 -0.08 0.00 -0.15 0.00 0.00 58.65 58.30 1sf8 h GLN 620 Cb 0.00 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 1sf8 h GLN 620 CO 0.00 0.59 -0.36 -0.07 -2.65 0.00 0.00 178.83 176.34 1sf8 h LEU 621 N 0.50 0.00 -1.96 -2.39 3.38 -1.77 -2.36 115.31 110.70 1sf8 h LEU 621 Ca 0.13 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1sf8 h LEU 621 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1sf8 h LEU 621 CO -0.01 0.36 -0.05 -0.07 0.09 0.00 0.00 178.44 178.77 1sf8 h LEU 622 N 0.00 0.00 0.00 1.67 3.38 -1.75 -3.18 115.31 115.43 1sf8 h LEU 622 Ca -0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 1sf8 h LEU 622 Cb 0.83 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.52 1sf8 h LEU 622 CO 0.05 0.05 -2.28 0.52 0.09 0.00 0.00 178.44 176.87 1sf8 n VAL 623 N -3.25 1.28 1.26 1.22 0.31 -1.05 -5.09 118.33 113.01 1sf8 n VAL 623 Ca -0.01 -0.59 0.10 0.00 -0.01 0.00 0.00 64.34 63.83 1sf8 n VAL 623 Cb 0.23 -1.03 0.60 0.00 -0.91 0.00 0.00 33.84 32.73 1sf8 n VAL 623 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97