#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jw6 n VAL 505 N 7.02 0.55 -0.09 0.00 0.31 -1.12 -3.00 118.33 122.00 2jw6 n VAL 505 Ca 0.37 0.14 -0.14 0.00 -0.01 0.00 0.00 64.34 64.69 2jw6 n VAL 505 Cb 0.28 -0.95 -0.08 0.00 -0.91 0.00 0.00 33.84 32.18 2jw6 n VAL 505 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2jw6 n ASN 506 N -1.22 2.25 0.00 4.52 5.15 -1.26 -5.05 115.26 119.65 2jw6 n ASN 506 Ca 0.06 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.05 2jw6 n ASN 506 Cb 0.08 -0.36 0.00 0.00 -0.53 0.00 0.00 39.78 38.98 2jw6 n ASN 506 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jw6 n GLY 508 N 1.07 1.32 3.04 0.00 0.00 -1.26 -4.87 105.19 104.49 2jw6 n GLY 508 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 2jw6 n GLY 508 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jw6 n ARG 509 N 0.00 -3.47 -0.01 1.61 1.74 -1.26 -3.52 116.66 111.76 2jw6 n ARG 509 Ca 0.00 -1.48 -0.10 0.00 -0.77 0.00 0.00 57.85 55.50 2jw6 n ARG 509 Cb 0.00 -1.54 -0.04 0.00 -1.02 0.00 0.00 32.46 29.86 2jw6 n ARG 509 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 2jw6 h GLU 510 N 0.00 -0.04 0.00 5.56 4.11 -1.94 0.71 114.58 122.97 2jw6 h GLU 510 Ca -0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.07 2jw6 h GLU 510 Cb 1.14 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2jw6 h GLU 510 CO 0.23 -0.03 0.00 0.00 0.07 0.00 0.00 179.01 179.29 2jw6 n ALA 511 N -2.34 0.00 -0.05 1.06 0.00 -1.26 -1.42 120.51 116.51 2jw6 n ALA 511 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.35 2jw6 n ALA 511 Cb 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.55 2jw6 n ALA 511 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jw6 n MET 512 N -0.94 0.33 -4.54 0.00 0.00 -0.69 -4.85 117.12 106.43 2jw6 n MET 512 Ca 0.00 0.13 -0.28 0.00 0.00 0.00 0.00 57.70 57.55 2jw6 n MET 512 Cb 0.00 -1.06 -0.10 0.00 0.00 0.00 0.00 33.22 32.06 2jw6 n MET 512 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 175.97 174.85 2jw6 s SER 513 N -5.65 4.01 0.19 7.83 0.01 -1.26 -5.06 113.70 113.76 2jw6 s SER 513 Ca -0.18 -1.35 0.04 0.00 1.31 0.00 0.00 55.95 55.78 2jw6 s SER 513 Cb 0.02 -0.31 -0.03 0.00 0.21 0.00 0.00 66.02 65.91 2jw6 s SER 513 CO 0.27 -0.51 0.27 -1.61 0.41 0.00 0.00 173.24 172.06 2jw6 s GLU 514 N -3.77 3.27 -0.53 12.44 2.02 -1.26 -3.27 118.70 127.60 2jw6 s GLU 514 Ca 0.33 -0.75 -0.41 0.00 0.02 0.00 0.00 54.97 54.16 2jw6 s GLU 514 Cb 0.08 -2.83 -0.19 0.00 0.10 0.00 0.00 34.13 31.29 2jw6 s GLU 514 CO 0.17 0.47 2.11 0.00 0.02 0.00 0.00 175.26 178.04 2jw6 n THR 516 N 6.34 0.00 0.80 0.00 -2.24 -1.26 0.18 114.28 118.10 2jw6 n THR 516 Ca 0.54 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 62.42 2jw6 n THR 516 Cb -0.03 -0.86 -0.11 0.00 -2.10 0.00 0.00 70.33 67.23 2jw6 n THR 516 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jw6 n GLY 517 N -0.64 -1.02 0.00 3.38 0.00 -1.26 -4.82 105.19 100.82 2jw6 n GLY 517 Ca 0.03 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2jw6 n GLY 517 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jw6 n HIS 519 N -0.92 -0.95 0.85 0.00 -0.00 0.48 -4.92 115.22 109.76 2jw6 n HIS 519 Ca 0.00 0.16 0.13 0.00 -0.00 0.00 0.00 57.72 58.01 2jw6 n HIS 519 Cb 0.00 -3.12 0.35 0.00 -0.00 0.00 0.00 29.99 27.22 2jw6 n HIS 519 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.34 177.97 2jw6 n LYS 520 N -2.59 0.11 -4.04 -0.41 5.02 -1.26 -4.70 118.16 110.29 2jw6 n LYS 520 Ca -0.12 0.05 -0.08 0.00 -2.02 0.00 0.00 58.31 56.14 2jw6 n LYS 520 Cb 0.60 -1.58 -0.10 0.00 -0.02 0.00 0.00 35.03 33.93 2jw6 n LYS 520 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2jw6 s VAL 521 N -3.05 0.20 0.02 -0.18 -7.23 -1.26 -5.01 120.40 103.88 2jw6 s VAL 521 Ca 0.11 -1.63 0.01 0.00 -1.81 0.00 0.00 61.98 58.66 2jw6 s VAL 521 Cb 0.16 -1.39 -0.01 0.00 0.56 0.00 0.00 36.38 35.70 2jw6 s VAL 521 CO 0.65 -0.90 -0.05 0.54 -0.31 0.00 0.00 175.10 175.03 2jw6 s ASN 522 N -2.79 0.52 0.02 4.85 4.22 -1.26 -0.26 114.94 120.24 2jw6 s ASN 522 Ca 0.05 -0.32 0.01 0.00 -2.14 0.00 0.00 52.86 50.45 2jw6 s ASN 522 Cb 0.06 0.01 -0.02 0.00 1.28 0.00 0.00 41.25 42.59 2jw6 s ASN 522 CO -0.09 -0.12 -0.04 -0.31 -2.04 0.00 0.00 177.10 174.50 2jw6 s TYR 523 N -0.82 0.34 0.20 1.54 2.02 -1.20 -2.79 117.35 116.64 2jw6 s TYR 523 Ca -0.06 -0.42 -0.04 0.00 -0.37 0.00 0.00 57.07 56.18 2jw6 s TYR 523 Cb -0.06 -0.23 0.15 0.00 -0.40 0.00 0.00 41.96 41.43 2jw6 s TYR 523 CO -0.00 -0.12 1.57 0.00 -1.57 0.00 0.00 175.55 175.42 2jw6 s SER 525 N -6.84 3.11 0.10 0.00 0.01 -1.26 -3.77 113.70 105.05 2jw6 s SER 525 Ca -0.08 -1.65 -0.14 0.00 1.31 0.00 0.00 55.95 55.39 2jw6 s SER 525 Cb 0.12 0.47 -0.10 0.00 0.21 0.00 0.00 66.02 66.72 2jw6 s SER 525 CO 0.84 -0.89 1.39 0.74 0.41 0.00 0.00 173.24 175.73 2jw6 h THR 526 N 1.70 1.30 -0.55 1.44 2.02 -1.98 -3.26 112.91 113.58 2jw6 h THR 526 Ca -0.38 -1.62 0.04 0.00 0.77 0.00 0.00 66.41 65.22 2jw6 h THR 526 Cb 1.28 1.68 -0.03 0.00 -1.74 0.00 0.00 68.15 69.34 2jw6 h THR 526 CO 0.62 0.52 0.36 2.19 0.37 0.00 0.00 175.52 179.58 2jw6 h PHE 527 N 0.51 0.59 -0.44 3.16 -5.15 -1.99 -1.07 116.94 112.55 2jw6 h PHE 527 Ca 0.02 0.01 0.05 0.00 -0.20 0.00 0.00 57.97 57.86 2jw6 h PHE 527 Cb 1.03 -0.20 -0.05 0.00 0.22 0.00 0.00 35.95 36.95 2jw6 h PHE 527 CO 0.08 0.34 0.17 0.00 -2.00 0.00 0.00 178.31 176.91 2jw6 h GLN 529 N 0.36 0.71 -0.03 0.00 4.15 -1.30 -0.70 115.11 118.31 2jw6 h GLN 529 Ca 0.20 -0.11 -0.19 0.00 0.77 0.00 0.00 58.65 59.32 2jw6 h GLN 529 Cb 0.17 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.72 2jw6 h GLN 529 CO -0.18 0.61 -0.81 0.00 -1.93 0.00 0.00 178.83 176.52 2jw6 h ARG 530 N 0.65 0.29 0.03 1.69 3.08 -1.10 -2.91 114.38 116.11 2jw6 h ARG 530 Ca 0.17 -0.27 -0.00 0.00 0.07 0.00 0.00 59.98 59.94 2jw6 h ARG 530 Cb 0.14 0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.25 2jw6 h ARG 530 CO -0.02 0.95 -0.02 0.87 -1.07 0.00 0.00 179.97 180.69 2jw6 h LYS 531 N 0.18 -0.04 0.00 0.04 1.57 -0.37 -3.33 116.57 114.62 2jw6 h LYS 531 Ca -0.04 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.69 2jw6 h LYS 531 Cb 1.40 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.72 2jw6 h LYS 531 CO 0.13 0.61 -0.24 0.22 -0.57 0.00 0.00 179.45 179.59 2jw6 h ASP 532 N -0.93 0.00 0.00 0.86 3.58 -1.26 -3.05 116.42 115.62 2jw6 h ASP 532 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2jw6 h ASP 532 Cb 0.67 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.72 2jw6 h ASP 532 CO 0.01 0.24 0.00 -2.67 -2.88 0.00 0.00 179.24 173.94 2jw6 n TRP 533 N -3.85 0.00 0.27 0.28 4.27 -1.10 -1.94 117.44 115.37 2jw6 n TRP 533 Ca -0.02 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 53.69 2jw6 n TRP 533 Cb 0.34 0.00 0.71 0.00 -1.36 0.00 0.00 31.31 30.99 2jw6 n TRP 533 CO 0.00 0.00 0.00 0.87 -2.29 0.00 0.00 177.69 176.27 2jw6 h LYS 534 N 0.00 0.00 0.09 -2.67 1.79 -1.71 1.24 116.57 115.30 2jw6 h LYS 534 Ca 0.00 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 58.24 2jw6 h LYS 534 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2jw6 h LYS 534 CO 0.00 0.02 -1.15 0.22 -1.08 0.00 0.00 179.45 177.46 2jw6 h ASP 535 N 0.00 0.29 0.22 0.86 1.82 -1.67 -3.39 116.42 114.55 2jw6 h ASP 535 Ca -0.00 -0.83 -0.09 0.00 -0.39 0.00 0.00 57.03 55.72 2jw6 h ASP 535 Cb 0.03 -0.10 -0.01 0.00 0.68 0.00 0.00 39.33 39.93 2jw6 h ASP 535 CO 0.00 1.50 -0.35 -0.74 -1.61 0.00 0.00 179.24 178.04 2jw6 h HIS 536 N -0.49 0.21 -0.56 0.28 2.76 -1.36 -3.20 115.15 112.80 2jw6 h HIS 536 Ca -0.25 -0.05 0.16 0.00 -2.20 0.00 0.00 60.37 58.03 2jw6 h HIS 536 Cb 1.59 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 30.48 2jw6 h HIS 536 CO 0.15 0.52 0.62 -0.56 -1.30 0.00 0.00 177.93 177.36 2jw6 h GLN 537 N 0.16 0.00 0.00 5.26 3.07 0.13 0.50 115.11 124.24 2jw6 h GLN 537 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.76 2jw6 h GLN 537 Cb 0.70 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.26 2jw6 h GLN 537 CO 0.05 0.00 0.00 0.45 0.09 0.00 0.00 178.83 179.42 2jw6 h HIS 538 N 0.00 0.00 0.00 0.06 3.86 -1.80 -3.26 115.15 114.01 2jw6 h HIS 538 Ca 0.26 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.47 2jw6 h HIS 538 Cb 1.50 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.97 2jw6 h HIS 538 CO 0.00 0.00 0.00 0.44 0.86 0.00 0.00 177.93 179.23 2jw6 n ILE 539 N -2.66 0.00 -2.29 2.45 -5.35 0.17 -5.01 119.36 106.66 2jw6 n ILE 539 Ca 0.03 -0.48 -0.36 0.00 -0.27 0.00 0.00 62.75 61.68 2jw6 n ILE 539 Cb 0.37 1.01 -0.01 0.00 -1.74 0.00 0.00 39.64 39.27 2jw6 n ILE 539 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jw6 n GLY 541 N 0.21 2.67 3.63 0.00 0.00 -1.26 -4.99 105.19 105.45 2jw6 n GLY 541 Ca 0.10 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 2jw6 n GLY 541 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2jw6 s GLN 542 N 0.00 3.84 0.00 1.61 0.74 -1.19 -4.80 119.66 119.86 2jw6 s GLN 542 Ca 0.00 1.67 0.08 0.00 0.05 0.00 0.00 55.36 57.16 2jw6 s GLN 542 Cb 0.00 -4.01 0.13 0.00 1.10 0.00 0.00 33.01 30.22 2jw6 s GLN 542 CO 0.00 -1.24 0.92 0.43 -0.55 0.00 0.00 175.29 174.86 2jw6 n SER 543 N 8.26 2.06 0.00 6.67 7.64 -1.26 -5.11 113.62 131.87 2jw6 n SER 543 Ca 0.18 -1.59 0.00 0.00 1.01 0.00 0.00 58.87 58.47 2jw6 n SER 543 Cb 0.45 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 2jw6 n SER 543 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03