#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmf h SER 516 N 0.00 0.05 0.00 4.52 0.02 -2.05 -0.52 113.55 115.57 2jmf h SER 516 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2jmf h SER 516 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2jmf h SER 516 CO 0.00 0.01 -0.08 0.00 -1.14 0.00 0.00 176.83 175.62 2jmf n LEU 517 N -4.24 1.29 0.00 5.07 -0.00 -1.26 -4.78 117.00 113.09 2jmf n LEU 517 Ca 0.25 -1.63 0.00 0.00 -0.00 0.00 0.00 56.01 54.63 2jmf n LEU 517 Cb 1.20 -0.10 0.00 0.00 -0.00 0.00 0.00 43.42 44.51 2jmf n LEU 517 CO 0.39 0.39 -0.26 -0.38 -0.00 0.00 0.00 177.39 177.52 2jmf n ILE 518 N -0.53 0.00 -2.54 1.47 -0.00 -0.31 -4.77 119.36 112.67 2jmf n ILE 518 Ca 0.04 -0.20 -0.13 0.00 -0.00 0.00 0.00 62.75 62.46 2jmf n ILE 518 Cb 0.48 0.69 0.03 0.00 -0.00 0.00 0.00 39.64 40.84 2jmf n ILE 518 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 2jmf n ASN 519 N -1.19 2.87 -4.74 4.38 2.85 -0.56 -5.02 115.26 113.85 2jmf n ASN 519 Ca 0.00 -2.93 -0.37 0.00 -0.11 0.00 0.00 54.58 51.17 2jmf n ASN 519 Cb 0.00 -0.46 0.06 0.00 1.24 0.00 0.00 39.78 40.62 2jmf n ASN 519 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2jmf s GLU 520 N -3.50 2.69 0.00 1.20 2.02 -1.26 -4.89 118.70 114.95 2jmf s GLU 520 Ca 0.36 2.05 0.00 0.00 0.02 0.00 0.00 54.97 57.40 2jmf s GLU 520 Cb 0.40 -1.91 0.00 0.00 0.10 0.00 0.00 34.13 32.72 2jmf s GLU 520 CO -0.03 -1.49 0.00 0.41 0.02 0.00 0.00 175.26 174.17 2jmf n GLY 521 N 0.82 -0.14 3.79 -1.39 0.00 -1.26 -5.02 105.19 101.99 2jmf n GLY 521 Ca 0.15 -1.89 -0.32 0.00 0.00 0.00 0.00 46.02 43.97 2jmf n GLY 521 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jmf s PRO 522 N -1.20 2.76 0.46 1.61 0.04 -1.26 -5.07 135.00 132.34 2jmf s PRO 522 Ca 0.00 1.13 -0.11 0.00 0.04 0.00 0.00 61.00 62.05 2jmf s PRO 522 Cb 0.00 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.52 2jmf s PRO 522 CO 0.00 -1.25 0.85 -0.48 0.04 0.00 0.00 177.00 176.16 2jmf s LEU 523 N -5.40 3.69 0.70 -3.56 0.05 -1.26 -5.08 118.68 107.82 2jmf s LEU 523 Ca 0.61 1.25 -0.14 0.00 0.05 0.00 0.00 54.13 55.90 2jmf s LEU 523 Cb -0.16 -4.17 0.02 0.00 -2.05 0.00 0.00 46.19 39.83 2jmf s LEU 523 CO 0.50 -0.52 1.11 -2.16 -0.55 0.00 0.00 176.35 174.74 2jmf s PRO 524 N -4.14 2.57 -0.28 1.48 0.04 -1.26 -4.95 135.00 128.44 2jmf s PRO 524 Ca 0.53 1.35 -0.29 0.00 0.04 0.00 0.00 61.00 62.63 2jmf s PRO 524 Cb -0.10 -1.92 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 2jmf s PRO 524 CO 0.35 -1.43 1.50 -1.25 0.04 0.00 0.00 177.00 176.22 2jmf s PRO 525 N -4.32 3.76 -1.43 0.56 0.04 -1.26 -3.50 135.00 128.84 2jmf s PRO 525 Ca 0.66 1.40 0.00 0.00 0.04 0.00 0.00 61.00 63.10 2jmf s PRO 525 Cb -0.20 -4.00 0.00 0.00 0.04 0.00 0.00 34.50 30.34 2jmf s PRO 525 CO 0.46 -1.33 0.00 0.41 0.04 0.00 0.00 177.00 176.58 2jmf n GLY 526 N 4.68 0.24 3.44 0.56 0.00 -1.26 -5.01 105.19 107.83 2jmf n GLY 526 Ca 0.18 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 2jmf n GLY 526 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2jmf s TRP 527 N -2.73 2.03 0.11 1.61 0.52 -1.23 -4.37 118.94 114.89 2jmf s TRP 527 Ca 0.00 -0.57 0.05 0.00 0.02 0.00 0.00 56.10 55.60 2jmf s TRP 527 Cb 0.00 -1.07 -0.04 0.00 -1.15 0.00 0.00 33.47 31.22 2jmf s TRP 527 CO 0.00 0.43 -0.12 -2.00 0.02 0.00 0.00 176.95 175.28 2jmf s GLU 528 N -3.65 0.92 -0.06 4.98 2.56 -0.25 -4.78 118.70 118.43 2jmf s GLU 528 Ca 0.28 -1.18 0.01 0.00 0.00 0.00 0.00 54.97 54.08 2jmf s GLU 528 Cb 0.01 -0.72 0.02 0.00 2.00 0.00 0.00 34.13 35.44 2jmf s GLU 528 CO 0.12 0.13 -0.06 0.42 -0.56 0.00 0.00 175.26 175.31 2jmf s ILE 529 N -2.23 0.66 0.11 -3.70 1.09 -1.26 -0.83 121.20 115.03 2jmf s ILE 529 Ca 0.07 -0.17 0.04 0.00 -1.10 0.00 0.00 60.65 59.49 2jmf s ILE 529 Cb -0.04 -0.68 -0.04 0.00 -1.06 0.00 0.00 42.46 40.65 2jmf s ILE 529 CO 0.02 0.26 -0.11 -0.13 -0.10 0.00 0.00 174.94 174.87 2jmf s ARG 530 N 1.04 0.92 -0.22 2.79 1.81 -0.48 -5.02 118.95 119.80 2jmf s ARG 530 Ca -0.09 -1.21 -0.01 0.00 -1.72 0.00 0.00 55.73 52.69 2jmf s ARG 530 Cb -0.14 -0.66 0.06 0.00 -0.45 0.00 0.00 34.95 33.76 2jmf s ARG 530 CO -0.00 0.11 0.00 0.71 -0.68 0.00 0.00 175.30 175.44 2jmf s TYR 531 N -2.44 1.61 0.66 -0.53 1.51 -1.26 -0.95 117.35 115.95 2jmf s TYR 531 Ca 0.08 -1.26 -0.15 0.00 -1.01 0.00 0.00 57.07 54.72 2jmf s TYR 531 Cb -0.03 -1.28 -0.00 0.00 -0.11 0.00 0.00 41.96 40.54 2jmf s TYR 531 CO 0.01 -0.69 1.11 0.95 -1.11 0.00 0.00 175.55 175.83 2jmf s THR 532 N 1.66 3.21 -0.47 -0.71 -4.23 -0.28 -4.91 115.64 109.90 2jmf s THR 532 Ca -0.03 0.57 0.17 0.00 -1.18 0.00 0.00 61.69 61.22 2jmf s THR 532 Cb -0.18 -3.09 0.17 0.00 1.34 0.00 0.00 72.50 70.74 2jmf s THR 532 CO -0.08 -0.34 1.53 0.00 -0.54 0.00 0.00 174.62 175.19 2jmf n ALA 533 N -2.40 1.21 1.10 3.99 0.00 -1.26 -1.32 120.51 121.84 2jmf n ALA 533 Ca 0.10 0.12 0.14 0.00 0.00 0.00 0.00 53.44 53.81 2jmf n ALA 533 Cb 0.52 -1.26 0.65 0.00 0.00 0.00 0.00 19.45 19.36 2jmf n ALA 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmf n ALA 534 N -1.70 2.37 -0.04 0.00 0.00 -1.26 -4.95 120.51 114.92 2jmf n ALA 534 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.33 2jmf n ALA 534 Cb 0.08 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.05 2jmf n ALA 534 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jmf n GLY 535 N 1.44 1.42 3.12 0.00 0.00 -0.43 -5.11 105.19 105.63 2jmf n GLY 535 Ca 0.09 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 2jmf n GLY 535 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jmf s GLU 536 N -0.53 1.54 0.14 1.61 0.41 -1.25 -4.96 118.70 115.67 2jmf s GLU 536 Ca 0.00 -0.57 -0.20 0.00 -0.41 0.00 0.00 54.97 53.79 2jmf s GLU 536 Cb 0.00 -1.39 -0.07 0.00 -1.78 0.00 0.00 34.13 30.89 2jmf s GLU 536 CO 0.00 0.26 0.66 0.50 -0.49 0.00 0.00 175.26 176.19 2jmf s ARG 537 N -0.08 4.28 0.06 1.61 3.00 -1.26 -1.13 118.95 125.43 2jmf s ARG 537 Ca -0.00 0.84 -0.00 0.00 -1.00 0.00 0.00 55.73 55.57 2jmf s ARG 537 Cb -0.09 -3.12 -0.04 0.00 0.00 0.00 0.00 34.95 31.70 2jmf s ARG 537 CO 0.01 0.54 -0.04 -0.06 0.00 0.00 0.00 175.30 175.76 2jmf s PHE 538 N -1.26 0.59 0.13 5.12 0.40 -0.12 -4.81 117.98 118.02 2jmf s PHE 538 Ca 0.35 -1.01 0.05 0.00 -0.60 0.00 0.00 56.93 55.72 2jmf s PHE 538 Cb -0.19 -0.41 -0.04 0.00 0.51 0.00 0.00 43.02 42.89 2jmf s PHE 538 CO 0.21 -0.32 0.03 -0.06 0.70 0.00 0.00 175.22 175.79 2jmf s PHE 539 N -3.74 3.00 -0.06 0.36 0.08 0.04 -1.38 117.98 116.29 2jmf s PHE 539 Ca 0.07 -0.05 0.00 0.00 0.12 0.00 0.00 56.93 57.08 2jmf s PHE 539 Cb 0.07 -1.50 0.02 0.00 -0.57 0.00 0.00 43.02 41.04 2jmf s PHE 539 CO -0.08 0.50 -0.03 0.08 -0.10 0.00 0.00 175.22 175.59 2jmf s VAL 540 N -1.52 0.49 -0.28 -0.44 1.01 -0.01 -2.00 120.40 117.64 2jmf s VAL 540 Ca 0.28 -0.04 -0.07 0.00 0.00 0.00 0.00 61.98 62.15 2jmf s VAL 540 Cb -0.11 -0.56 -0.00 0.00 0.00 0.00 0.00 36.38 35.71 2jmf s VAL 540 CO 0.20 0.24 0.07 -0.62 0.00 0.00 0.00 175.10 174.98 2jmf s ASP 541 N 1.30 5.06 0.22 3.32 -1.08 -0.14 -1.09 116.67 124.27 2jmf s ASP 541 Ca -0.05 -0.55 0.26 0.00 -0.52 0.00 0.00 52.55 51.69 2jmf s ASP 541 Cb -0.14 -1.88 0.80 0.00 -1.46 0.00 0.00 42.92 40.24 2jmf s ASP 541 CO -0.02 -0.14 1.77 1.41 0.52 0.00 0.00 175.17 178.71 2jmf n HIS 542 N 4.88 0.97 0.08 -5.34 8.25 -1.26 -1.98 115.22 120.82 2jmf n HIS 542 Ca -0.15 0.28 -0.07 0.00 -0.26 0.00 0.00 57.72 57.52 2jmf n HIS 542 Cb 0.49 -0.96 0.04 0.00 1.12 0.00 0.00 29.99 30.68 2jmf n HIS 542 CO 0.00 0.00 0.00 -0.91 0.64 0.00 0.00 176.34 176.07 2jmf h ASN 543 N 0.00 0.28 0.00 0.41 2.35 -1.94 -3.35 115.58 113.33 2jmf h ASN 543 Ca 0.00 -0.20 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2jmf h ASN 543 Cb 0.74 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.03 2jmf h ASN 543 CO 0.00 0.94 0.00 0.35 -1.65 0.00 0.00 177.43 177.07 2jmf n THR 544 N -3.75 0.32 -0.84 2.81 -2.24 -1.26 -5.03 114.28 104.30 2jmf n THR 544 Ca -0.03 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 2jmf n THR 544 Cb 0.73 0.95 0.00 0.00 -2.10 0.00 0.00 70.33 69.91 2jmf n THR 544 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2jmf n ARG 545 N -0.16 -0.45 -1.33 -0.78 0.63 -0.84 -5.01 116.66 108.72 2jmf n ARG 545 Ca 0.00 0.11 -0.30 0.00 -0.92 0.00 0.00 57.85 56.75 2jmf n ARG 545 Cb 0.36 -3.80 0.13 0.00 0.45 0.00 0.00 32.46 29.59 2jmf n ARG 545 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2jmf s ARG 546 N -0.77 1.42 0.06 -0.14 0.52 -1.12 -4.80 118.95 114.11 2jmf s ARG 546 Ca 0.00 0.69 -0.08 0.00 -0.52 0.00 0.00 55.73 55.82 2jmf s ARG 546 Cb 0.00 -1.84 -0.00 0.00 0.52 0.00 0.00 34.95 33.63 2jmf s ARG 546 CO 0.00 -2.10 0.16 0.95 0.02 0.00 0.00 175.30 174.33 2jmf s THR 547 N -3.03 0.14 0.07 0.02 -4.23 -1.26 -0.96 115.64 106.38 2jmf s THR 547 Ca 0.63 -1.12 -0.24 0.00 -1.18 0.00 0.00 61.69 59.78 2jmf s THR 547 Cb -0.17 -1.14 0.06 0.00 1.34 0.00 0.00 72.50 72.60 2jmf s THR 547 CO 0.56 -0.62 0.57 0.28 -0.54 0.00 0.00 174.62 174.87 2jmf s THR 548 N -3.22 0.02 -0.22 3.99 -1.32 -0.85 -5.01 115.64 109.01 2jmf s THR 548 Ca 0.00 -0.13 0.21 0.00 -1.21 0.00 0.00 61.69 60.56 2jmf s THR 548 Cb 0.02 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 70.01 2jmf s THR 548 CO -0.07 -0.07 1.04 0.15 -2.21 0.00 0.00 174.62 173.45 2jmf h PHE 549 N 2.55 0.00 -4.19 9.09 3.57 -1.87 0.16 116.94 126.25 2jmf h PHE 549 Ca -0.31 0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.11 2jmf h PHE 549 Cb 1.23 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.96 2jmf h PHE 549 CO 0.32 0.11 -0.04 -0.85 -2.23 0.00 0.00 178.31 175.62 2jmf n GLU 550 N -2.75 1.56 -3.61 1.11 0.28 -1.26 -4.78 120.64 111.20 2jmf n GLU 550 Ca -0.01 -0.44 -0.30 0.00 -0.16 0.00 0.00 57.16 56.24 2jmf n GLU 550 Cb 0.60 0.08 -0.09 0.00 1.43 0.00 0.00 31.44 33.46 2jmf n GLU 550 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2jmf n ASP 551 N -1.63 3.76 -3.93 -1.84 2.03 -1.26 -4.77 116.55 108.92 2jmf n ASP 551 Ca -0.01 -3.31 -0.30 0.00 0.52 0.00 0.00 54.79 51.69 2jmf n ASP 551 Cb 0.08 -0.81 0.22 0.00 -0.72 0.00 0.00 41.12 39.89 2jmf n ASP 551 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2jmf s PRO 552 N -1.94 -0.61 0.67 -0.67 0.04 -1.26 -5.03 135.00 126.20 2jmf s PRO 552 Ca 0.32 -0.17 -0.17 0.00 0.04 0.00 0.00 61.00 61.01 2jmf s PRO 552 Cb 0.03 -1.68 -0.03 0.00 0.04 0.00 0.00 34.50 32.87 2jmf s PRO 552 CO -0.08 -3.28 0.82 0.54 0.04 0.00 0.00 177.00 175.04 2jmf n ARG 553 N -4.43 0.56 0.00 4.56 3.00 -1.26 -4.91 116.66 114.18 2jmf n ARG 553 Ca 0.14 0.24 0.07 0.00 -0.01 0.00 0.00 57.85 58.28 2jmf n ARG 553 Cb 0.59 -2.07 0.32 0.00 0.00 0.00 0.00 32.46 31.31 2jmf n ARG 553 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.63 177.28 2jmf n PRO 554 N -1.20 0.05 -3.53 5.56 -0.04 -1.26 -4.43 135.00 130.14 2jmf n PRO 554 Ca 0.12 0.23 -0.13 0.00 -0.04 0.00 0.00 63.50 63.69 2jmf n PRO 554 Cb 0.49 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.34 2jmf n PRO 554 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2jmf s GLY 555 N -2.90 -0.21 0.12 0.55 0.00 -1.26 -5.08 107.32 98.55 2jmf s GLY 555 Ca 0.08 0.85 -0.17 0.00 0.00 0.00 0.00 44.72 45.49 2jmf s GLY 555 CO 0.25 2.28 1.66 0.00 0.00 0.00 0.00 173.10 177.28 2jmf h ALA 556 N 8.25 0.46 0.00 3.20 0.00 -2.00 -3.54 119.26 125.62 2jmf h ALA 556 Ca -0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2jmf h ALA 556 Cb 1.13 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2jmf h ALA 556 CO 0.21 0.07 0.00 -0.35 0.00 0.00 0.00 179.25 179.18