#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 5.16 0.50 -0.04 0.00 0.31 -0.95 -3.22 118.33 120.08 2jw6 n VAL 505 Ca 0.10 0.13 -0.08 0.00 -0.01 0.00 0.00 64.34 64.48 2jw6 n VAL 505 Cb 0.47 -0.92 -0.04 0.00 -0.91 0.00 0.00 33.84 32.44 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 -1.21 2.21 0.00 4.52 5.15 -1.26 -5.06 115.26 119.60 2jw6 n ASN 506 Ca 0.07 0.02 0.00 0.00 -0.60 0.00 0.00 54.58 54.07 2jw6 n ASN 506 Cb 0.08 -0.19 0.00 0.00 -0.53 0.00 0.00 39.78 39.14 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 1.90 2.17 2.61 0.00 0.00 -1.26 -4.78 105.19 105.82 2jw6 n GLY 508 Ca 0.00 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 2jw6 n GLY 508 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jw6 n ARG 509 N 0.00 0.00 0.00 1.61 3.00 -1.26 -0.80 116.66 119.21 2jw6 n ARG 509 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2jw6 n ARG 509 Cb 0.00 -0.78 0.00 0.00 0.00 0.00 0.00 32.46 31.68 2jw6 n ARG 509 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 2jw6 n GLU 510 N 0.88 0.44 -0.55 -0.14 0.00 -1.26 -1.60 120.64 118.41 2jw6 n GLU 510 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.28 2jw6 n GLU 510 Cb 0.24 -1.22 0.00 0.00 0.00 0.00 0.00 31.44 30.46 2jw6 n GLU 510 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2jw6 n ALA 511 N 0.29 -1.90 -0.09 -1.84 0.00 -1.26 -4.71 120.51 111.00 2jw6 n ALA 511 Ca 0.00 0.15 -0.21 0.00 0.00 0.00 0.00 53.44 53.38 2jw6 n ALA 511 Cb 0.11 -0.81 -0.12 0.00 0.00 0.00 0.00 19.45 18.64 2jw6 n ALA 511 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 2jw6 h MET 512 N 0.65 0.03 -6.19 0.00 0.00 -1.72 -3.47 114.93 104.23 2jw6 h MET 512 Ca 0.00 -0.05 -0.60 0.00 0.00 0.00 0.00 59.70 59.06 2jw6 h MET 512 Cb 0.00 0.02 -0.13 0.00 0.00 0.00 0.00 31.60 31.49 2jw6 h MET 512 CO 0.00 1.02 -0.73 -1.12 0.00 0.00 0.00 176.91 176.09 2jw6 s SER 513 N -6.84 3.82 0.47 1.22 0.01 -1.26 -5.14 113.70 105.98 2jw6 s SER 513 Ca -0.28 -0.96 -0.05 0.00 1.31 0.00 0.00 55.95 55.98 2jw6 s SER 513 Cb 0.05 -0.43 -0.03 0.00 0.21 0.00 0.00 66.02 65.82 2jw6 s SER 513 CO 0.61 0.01 0.76 -1.61 0.41 0.00 0.00 173.24 173.43 2jw6 s GLU 514 N -3.56 3.50 -0.49 12.44 2.02 -1.26 -4.16 118.70 127.19 2jw6 s GLU 514 Ca 0.31 0.12 -0.44 0.00 0.02 0.00 0.00 54.97 54.98 2jw6 s GLU 514 Cb -0.05 -2.40 -0.19 0.00 0.10 0.00 0.00 34.13 31.59 2jw6 s GLU 514 CO 0.16 -0.19 2.01 0.00 0.02 0.00 0.00 175.26 177.26 2jw6 n THR 516 N 5.91 0.00 0.65 0.00 -2.24 -1.26 0.13 114.28 117.48 2jw6 n THR 516 Ca 0.48 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 62.35 2jw6 n THR 516 Cb -0.03 -0.89 -0.11 0.00 -2.10 0.00 0.00 70.33 67.20 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 -0.58 -0.73 0.00 3.38 0.00 -1.26 -4.83 105.19 101.16 2jw6 n GLY 517 Ca 0.05 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -1.46 -2.01 0.76 0.00 -0.00 0.34 -4.90 115.22 107.95 2jw6 n HIS 519 Ca 0.00 0.59 0.12 0.00 -0.00 0.00 0.00 57.72 58.43 2jw6 n HIS 519 Cb 0.00 -4.31 0.15 0.00 -0.00 0.00 0.00 29.99 25.83 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 -3.95 0.16 -3.94 -0.41 4.01 -1.26 -4.81 118.16 107.96 2jw6 n LYS 520 Ca -0.07 0.02 -0.09 0.00 -0.51 0.00 0.00 58.31 57.66 2jw6 n LYS 520 Cb 0.59 -1.58 -0.07 0.00 -0.51 0.00 0.00 35.03 33.46 2jw6 n LYS 520 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2jw6 s VAL 521 N -3.10 0.09 0.01 -0.18 -7.23 -1.26 -5.04 120.40 103.69 2jw6 s VAL 521 Ca 0.07 -1.35 -0.00 0.00 -1.81 0.00 0.00 61.98 58.89 2jw6 s VAL 521 Cb 0.15 -1.70 -0.01 0.00 0.56 0.00 0.00 36.38 35.38 2jw6 s VAL 521 CO 0.74 -0.42 -0.02 0.54 -0.31 0.00 0.00 175.10 175.64 2jw6 s ASN 522 N -2.94 0.17 -0.01 4.85 4.22 -1.26 -0.48 114.94 119.49 2jw6 s ASN 522 Ca 0.14 -0.35 -0.01 0.00 -2.14 0.00 0.00 52.86 50.50 2jw6 s ASN 522 Cb 0.04 0.07 -0.00 0.00 1.28 0.00 0.00 41.25 42.64 2jw6 s ASN 522 CO -0.03 -0.22 0.02 -0.31 -2.04 0.00 0.00 177.10 174.52 2jw6 s TYR 523 N -1.04 0.02 0.22 1.54 2.02 -1.26 -2.25 117.35 116.60 2jw6 s TYR 523 Ca -0.11 -0.03 -0.07 0.00 -0.37 0.00 0.00 57.07 56.48 2jw6 s TYR 523 Cb -0.07 -0.02 0.36 0.00 -0.40 0.00 0.00 41.96 41.83 2jw6 s TYR 523 CO -0.01 -0.05 1.72 0.00 -1.57 0.00 0.00 175.55 175.64 2jw6 n SER 525 N -5.05 2.36 -0.05 0.00 7.64 -1.26 -4.01 113.62 113.25 2jw6 n SER 525 Ca 0.11 -3.14 -0.16 0.00 1.01 0.00 0.00 58.87 56.70 2jw6 n SER 525 Cb 0.35 0.65 -0.07 0.00 -1.01 0.00 0.00 64.21 64.14 2jw6 n SER 525 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 2jw6 h THR 526 N 1.44 1.31 -0.72 0.44 2.02 -1.99 -3.31 112.91 112.10 2jw6 h THR 526 Ca -0.36 -1.78 0.05 0.00 0.77 0.00 0.00 66.41 65.09 2jw6 h THR 526 Cb 1.21 1.93 -0.04 0.00 -1.74 0.00 0.00 68.15 69.50 2jw6 h THR 526 CO 0.59 0.56 0.48 2.19 0.37 0.00 0.00 175.52 179.70 2jw6 h PHE 527 N 0.39 0.81 -0.84 3.16 -5.15 -1.97 -0.79 116.94 112.55 2jw6 h PHE 527 Ca -0.02 0.02 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2jw6 h PHE 527 Cb 1.16 -0.27 -0.04 0.00 0.22 0.00 0.00 35.95 37.03 2jw6 h PHE 527 CO 0.09 0.45 0.52 0.00 -2.00 0.00 0.00 178.31 177.37 2jw6 h GLN 529 N 1.14 1.01 -0.04 0.00 4.15 -1.27 -2.53 115.11 117.58 2jw6 h GLN 529 Ca 0.30 -0.20 -0.11 0.00 0.77 0.00 0.00 58.65 59.42 2jw6 h GLN 529 Cb -0.06 -0.16 0.01 0.00 0.21 0.00 0.00 27.48 27.48 2jw6 h GLN 529 CO -0.06 0.86 -0.38 0.00 -1.93 0.00 0.00 178.83 177.32 2jw6 h ARG 530 N 0.95 0.34 -0.05 1.69 2.47 -0.92 -2.58 114.38 116.28 2jw6 h ARG 530 Ca 0.22 -0.30 0.03 0.00 -1.26 0.00 0.00 59.98 58.66 2jw6 h ARG 530 Cb 0.25 0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.61 2jw6 h ARG 530 CO -0.01 0.97 -0.11 0.87 0.56 0.00 0.00 179.97 182.24 2jw6 h LYS 531 N -0.18 -0.16 -0.31 0.04 1.57 -0.69 -2.32 116.57 114.52 2jw6 h LYS 531 Ca -0.04 0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 2jw6 h LYS 531 Cb 1.07 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.40 2jw6 h LYS 531 CO 0.08 -0.11 -0.06 0.22 -0.57 0.00 0.00 179.45 179.01 2jw6 h ASP 532 N -0.17 0.47 0.39 0.86 3.58 -1.55 -3.17 116.42 116.83 2jw6 h ASP 532 Ca 0.06 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.41 2jw6 h ASP 532 Cb 0.25 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.18 2jw6 h ASP 532 CO -0.15 0.58 0.00 1.87 -2.88 0.00 0.00 179.24 178.66 2jw6 n TRP 533 N -4.25 0.00 0.28 0.28 -0.00 -0.87 -1.16 117.44 111.72 2jw6 n TRP 533 Ca 0.01 0.00 0.13 0.00 -0.00 0.00 0.00 57.50 57.64 2jw6 n TRP 533 Cb 0.28 -0.46 0.83 0.00 -0.00 0.00 0.00 31.31 31.96 2jw6 n TRP 533 CO 0.00 0.00 0.00 0.87 -0.00 0.00 0.00 177.69 178.56 2jw6 h LYS 534 N 0.00 0.00 0.00 5.87 1.79 -1.59 1.20 116.57 123.85 2jw6 h LYS 534 Ca 0.00 0.00 -0.40 0.00 -2.18 0.00 0.00 60.65 58.07 2jw6 h LYS 534 Cb 0.20 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 30.78 2jw6 h LYS 534 CO 0.00 0.02 -2.48 -0.25 -1.08 0.00 0.00 179.45 175.66 2jw6 n ASP 535 N -3.98 1.98 0.24 0.86 9.92 -0.31 -4.54 116.55 120.73 2jw6 n ASP 535 Ca -0.03 -0.04 0.08 0.00 -0.53 0.00 0.00 54.79 54.27 2jw6 n ASP 535 Cb 0.10 -0.50 0.59 0.00 -0.64 0.00 0.00 41.12 40.68 2jw6 n ASP 535 CO 0.00 0.00 0.00 -0.74 0.13 0.00 0.00 177.20 176.59 2jw6 h HIS 536 N -0.20 0.00 -1.01 1.24 2.76 -0.86 -2.81 115.15 114.27 2jw6 h HIS 536 Ca -0.60 0.00 0.29 0.00 -2.20 0.00 0.00 60.37 57.86 2jw6 h HIS 536 Cb 1.84 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.76 2jw6 h HIS 536 CO 0.01 0.12 0.81 -0.56 -1.30 0.00 0.00 177.93 177.01 2jw6 h GLN 537 N 0.00 0.00 0.00 5.26 3.07 0.12 0.59 115.11 124.15 2jw6 h GLN 537 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2jw6 h GLN 537 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.79 2jw6 h GLN 537 CO 0.02 0.00 0.00 0.45 0.09 0.00 0.00 178.83 179.39 2jw6 h HIS 538 N 0.00 0.00 0.00 0.06 3.86 -1.74 -3.20 115.15 114.13 2jw6 h HIS 538 Ca 0.48 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.69 2jw6 h HIS 538 Cb 2.10 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.57 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 -2.55 0.00 -2.36 2.45 -5.35 0.19 -4.83 119.36 106.91 2jw6 n ILE 539 Ca 0.03 -0.49 -0.43 0.00 -0.27 0.00 0.00 62.75 61.59 2jw6 n ILE 539 Cb 0.34 1.01 -0.02 0.00 -1.74 0.00 0.00 39.64 39.22 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 3.67 0.56 3.48 0.00 0.00 -1.26 -4.93 105.19 106.71 2jw6 n GLY 541 Ca 0.14 -0.94 -0.47 0.00 0.00 0.00 0.00 46.02 44.75 2jw6 n GLY 541 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2jw6 n GLN 542 N -2.76 1.14 -3.80 1.61 7.27 -0.92 -4.91 117.38 115.01 2jw6 n GLN 542 Ca -0.03 0.28 -0.13 0.00 0.07 0.00 0.00 57.00 57.20 2jw6 n GLN 542 Cb 0.13 -2.63 -0.10 0.00 2.41 0.00 0.00 30.24 30.05 2jw6 n GLN 542 CO 0.00 0.00 0.00 -1.54 0.07 0.00 0.00 177.06 175.59 2jw6 s SER 543 N 8.11 -0.17 0.00 1.69 1.04 -1.26 -5.14 113.70 117.97 2jw6 s SER 543 Ca 1.09 0.17 0.13 0.00 0.48 0.00 0.00 55.95 57.82 2jw6 s SER 543 Cb -0.73 0.37 0.11 0.00 0.10 0.00 0.00 66.02 65.86 2jw6 s SER 543 CO 0.44 -0.31 0.92 0.00 0.98 0.00 0.00 173.24 175.28