#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kpe s PRO 484 N 0.00 4.39 0.03 -7.13 0.04 -1.26 -5.13 135.00 125.95 3kpe s PRO 484 Ca 0.00 0.86 0.23 0.00 0.04 0.00 0.00 61.00 62.13 3kpe s PRO 484 Cb 0.00 -3.36 0.03 0.00 0.04 0.00 0.00 34.50 31.21 3kpe s PRO 484 CO 0.00 0.30 1.02 -1.13 0.04 0.00 0.00 177.00 177.23 3kpe n SER 485 N 2.89 0.63 -2.47 6.66 3.41 -1.26 -4.94 113.62 118.54 3kpe n SER 485 Ca -0.05 -0.33 -0.02 0.00 -0.26 0.00 0.00 58.87 58.22 3kpe n SER 485 Cb 0.51 0.84 0.01 0.00 -0.26 0.00 0.00 64.21 65.31 3kpe n SER 485 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3kpe n ASP 486 N -1.86 -1.08 0.23 4.04 5.68 -1.26 -5.03 116.55 117.27 3kpe n ASP 486 Ca 0.02 -1.55 0.10 0.00 -0.50 0.00 0.00 54.79 52.86 3kpe n ASP 486 Cb 0.42 1.75 0.55 0.00 -1.14 0.00 0.00 41.12 42.70 3kpe n ASP 486 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3kpe h GLU 487 N 0.00 0.00 -0.01 0.11 9.09 -1.98 -0.86 114.58 120.93 3kpe h GLU 487 Ca -0.17 0.00 -0.01 0.00 0.05 0.00 0.00 59.36 59.23 3kpe h GLU 487 Cb 0.76 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.86 3kpe h GLU 487 CO 0.23 0.21 -0.01 0.35 0.05 0.00 0.00 179.01 179.83 3kpe h PHE 488 N 0.00 0.03 -0.81 2.06 3.57 -1.99 -1.41 116.94 118.39 3kpe h PHE 488 Ca -0.00 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.48 3kpe h PHE 488 Cb 0.59 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.29 3kpe h PHE 488 CO 0.00 0.53 0.50 -0.44 -2.23 0.00 0.00 178.31 176.67 3kpe h ASP 489 N -0.47 0.96 -0.76 0.41 3.32 -1.92 -1.42 116.42 116.55 3kpe h ASP 489 Ca 0.00 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 3kpe h ASP 489 Cb 0.53 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 3kpe h ASP 489 CO 0.00 0.73 0.31 0.00 -1.72 0.00 0.00 179.24 178.56 3kpe h ALA 490 N 1.43 1.09 -0.71 3.45 0.00 -1.10 -0.89 119.26 122.54 3kpe h ALA 490 Ca 0.29 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3kpe h ALA 490 Cb -0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 3kpe h ALA 490 CO -0.06 0.65 0.20 0.77 0.00 0.00 0.00 179.25 180.82 3kpe h SER 491 N 1.11 1.04 -0.67 0.00 0.02 -0.64 -1.49 113.55 112.92 3kpe h SER 491 Ca 0.26 -0.20 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3kpe h SER 491 Cb 0.21 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 3kpe h SER 491 CO -0.02 0.97 0.44 0.40 -1.14 0.00 0.00 176.83 177.48 3kpe h ILE 492 N 1.06 1.18 -0.77 3.27 1.08 -0.75 -0.77 117.51 121.81 3kpe h ILE 492 Ca 0.23 -0.33 -0.01 0.00 -0.39 0.00 0.00 64.86 64.36 3kpe h ILE 492 Cb 0.32 0.20 -0.04 0.00 -3.07 0.00 0.00 36.82 34.23 3kpe h ILE 492 CO -0.00 0.17 0.46 0.28 -0.69 0.00 0.00 178.15 178.37 3kpe h SER 493 N 0.91 0.92 -0.71 1.72 0.02 -0.84 -1.44 113.55 114.13 3kpe h SER 493 Ca 0.24 -0.05 -0.05 0.00 -0.84 0.00 0.00 61.79 61.09 3kpe h SER 493 Cb -0.09 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.18 3kpe h SER 493 CO -0.05 0.71 0.26 -0.61 -1.14 0.00 0.00 176.83 176.00 3kpe h GLN 494 N 1.06 1.07 -0.35 3.45 4.15 -0.51 -0.28 115.11 123.71 3kpe h GLN 494 Ca 0.28 -0.21 0.01 0.00 0.77 0.00 0.00 58.65 59.49 3kpe h GLN 494 Cb -0.04 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.47 3kpe h GLN 494 CO -0.05 0.90 0.23 0.28 -1.93 0.00 0.00 178.83 178.26 3kpe h VAL 495 N 1.02 1.08 -0.94 2.39 2.07 -0.34 -0.69 116.25 120.83 3kpe h VAL 495 Ca 0.23 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.60 3kpe h VAL 495 Cb 0.25 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 3kpe h VAL 495 CO -0.01 0.08 0.62 0.78 0.02 0.00 0.00 177.57 179.06 3kpe h ASN 496 N 0.46 1.08 -0.51 0.57 2.35 -0.88 -0.40 115.58 118.25 3kpe h ASN 496 Ca 0.13 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.85 3kpe h ASN 496 Cb -0.04 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.03 3kpe h ASN 496 CO -0.04 0.79 0.34 -0.08 -1.65 0.00 0.00 177.43 176.79 3kpe h GLU 497 N 1.28 0.68 -0.37 0.81 4.81 -0.48 -0.92 114.58 120.39 3kpe h GLU 497 Ca 0.34 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.45 3kpe h GLU 497 Cb -0.14 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.07 3kpe h GLU 497 CO -0.07 0.46 -0.09 0.87 -0.73 0.00 0.00 179.01 179.44 3kpe h LYS 498 N 0.69 0.63 -0.52 1.92 1.79 -0.47 -0.65 116.57 119.96 3kpe h LYS 498 Ca 0.19 -0.18 -0.03 0.00 -2.18 0.00 0.00 60.65 58.45 3kpe h LYS 498 Cb -0.07 -0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.49 3kpe h LYS 498 CO -0.04 0.71 0.22 0.82 -1.08 0.00 0.00 179.45 180.09 3kpe h ILE 499 N 0.58 1.21 -0.36 1.86 2.04 -0.75 -0.81 117.51 121.28 3kpe h ILE 499 Ca 0.11 -0.63 -0.09 0.00 1.00 0.00 0.00 64.86 65.24 3kpe h ILE 499 Cb 0.51 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 3kpe h ILE 499 CO 0.03 0.24 -0.17 0.78 0.00 0.00 0.00 178.15 179.04 3kpe h ASN 500 N 0.69 0.65 -0.51 1.72 2.35 -0.75 -0.85 115.58 118.90 3kpe h ASN 500 Ca 0.17 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.69 3kpe h ASN 500 Cb 0.17 -0.18 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3kpe h ASN 500 CO -0.02 0.83 0.21 1.56 -1.65 0.00 0.00 177.43 178.37 3kpe h GLN 501 N 0.59 0.75 -0.03 0.81 4.20 -0.92 -0.99 115.11 119.52 3kpe h GLN 501 Ca 0.10 -0.13 0.03 0.00 0.06 0.00 0.00 58.65 58.70 3kpe h GLN 501 Cb 0.62 -0.12 -0.04 0.00 0.30 0.00 0.00 27.48 28.24 3kpe h GLN 501 CO 0.04 0.66 -0.16 1.03 -0.67 0.00 0.00 178.83 179.73 3kpe h SER 502 N 0.68 -0.48 -0.58 1.46 0.87 -0.59 -1.22 113.55 113.68 3kpe h SER 502 Ca 0.17 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.80 3kpe h SER 502 Cb 0.18 0.21 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 3kpe h SER 502 CO -0.02 -0.22 0.34 -0.07 -0.53 0.00 0.00 176.83 176.34 3kpe h LEU 503 N -0.25 0.72 -0.31 2.23 3.38 -0.99 -1.32 115.31 118.77 3kpe h LEU 503 Ca 0.06 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3kpe h LEU 503 Cb 0.33 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 3kpe h LEU 503 CO -0.18 0.57 0.09 0.00 0.09 0.00 0.00 178.44 179.01 3kpe h ALA 504 N 1.55 0.41 -0.57 1.53 0.00 -0.78 -0.22 119.26 121.18 3kpe h ALA 504 Ca 0.21 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3kpe h ALA 504 Cb -0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3kpe h ALA 504 CO -0.04 0.06 0.18 0.74 0.00 0.00 0.00 179.25 180.19 3kpe h PHE 505 N 0.35 0.87 -0.57 0.00 0.05 -0.87 -1.72 116.94 115.04 3kpe h PHE 505 Ca 0.10 -0.07 -0.05 0.00 3.82 0.00 0.00 57.97 61.77 3kpe h PHE 505 Cb 0.26 -0.26 -0.02 0.00 2.00 0.00 0.00 35.95 37.93 3kpe h PHE 505 CO 0.01 0.70 0.15 0.82 -0.18 0.00 0.00 178.31 179.81 3kpe h ILE 506 N 0.83 1.25 -0.33 -0.55 1.08 -1.03 -1.57 117.51 117.18 3kpe h ILE 506 Ca 0.19 -0.87 0.04 0.00 -0.39 0.00 0.00 64.86 63.83 3kpe h ILE 506 Cb 0.24 0.72 -0.04 0.00 -3.07 0.00 0.00 36.82 34.67 3kpe h ILE 506 CO -0.01 0.32 0.08 -0.09 -0.69 0.00 0.00 178.15 177.77 3kpe h ARG 507 N 0.82 0.20 -0.56 2.37 2.43 -0.60 0.14 114.38 119.18 3kpe h ARG 507 Ca 0.18 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 3kpe h ARG 507 Cb 0.33 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.81 3kpe h ARG 507 CO 0.00 0.13 0.33 -0.22 -1.51 0.00 0.00 179.97 178.70 3kpe h LYS 508 N 0.21 0.76 -0.12 0.20 1.63 -1.16 -0.72 116.57 117.37 3kpe h LYS 508 Ca 0.15 -0.08 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 3kpe h LYS 508 Cb 0.16 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.62 3kpe h LYS 508 CO -0.19 0.57 0.07 1.03 -3.45 0.00 0.00 179.45 177.48 3kpe h SER 509 N 0.75 0.12 -0.67 4.20 0.87 -0.57 -1.63 113.55 116.62 3kpe h SER 509 Ca 0.20 -0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.83 3kpe h SER 509 Cb 0.01 -0.03 -0.06 0.00 -0.44 0.00 0.00 62.40 61.88 3kpe h SER 509 CO -0.04 0.09 0.35 0.44 -0.53 0.00 0.00 176.83 177.14 3kpe h ASP 510 N 0.15 0.48 -0.46 6.23 3.32 -0.53 -1.68 116.42 123.94 3kpe h ASP 510 Ca 0.05 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.10 3kpe h ASP 510 Cb -0.01 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3kpe h ASP 510 CO -0.02 0.29 0.13 -0.33 -1.72 0.00 0.00 179.24 177.60 3kpe h GLU 511 N 0.62 0.72 -0.90 3.56 5.08 -0.82 -1.04 114.58 121.81 3kpe h GLU 511 Ca 0.32 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.56 3kpe h GLU 511 Cb 0.28 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 3kpe h GLU 511 CO -0.23 0.70 0.58 -0.07 -1.00 0.00 0.00 179.01 178.99 3kpe h LEU 512 N 0.60 0.95 -0.58 1.33 3.38 -0.99 -2.91 115.31 117.08 3kpe h LEU 512 Ca 0.15 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.96 3kpe h LEU 512 Cb 0.29 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3kpe h LEU 512 CO -0.00 0.64 -0.65 -0.07 0.09 0.00 0.00 178.44 178.45 3kpe h LEU 513 N 1.10 0.29 -0.03 1.67 3.38 -0.99 -2.72 115.31 118.01 3kpe h LEU 513 Ca 0.37 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3kpe h LEU 513 Cb 0.05 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.71 3kpe h LEU 513 CO -0.13 0.86 0.00 1.41 0.09 0.00 0.00 178.44 180.66 3kpe n HIS 514 N -3.84 0.08 1.17 1.13 8.25 -0.42 -1.13 115.22 120.45 3kpe n HIS 514 Ca -0.03 0.03 0.12 0.00 -0.26 0.00 0.00 57.72 57.58 3kpe n HIS 514 Cb 0.65 -0.54 0.37 0.00 1.12 0.00 0.00 29.99 31.58 3kpe n HIS 514 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3kpe n ASN 515 N -1.57 2.05 -4.81 0.41 5.15 -1.03 -4.93 115.26 110.52 3kpe n ASN 515 Ca 0.05 -1.72 -0.38 0.00 -0.60 0.00 0.00 54.58 51.94 3kpe n ASN 515 Cb 0.26 -0.07 -0.06 0.00 -0.53 0.00 0.00 39.78 39.37 3kpe n ASN 515 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3kpe s VAL 516 N -1.86 5.17 0.00 3.44 1.01 -0.28 -5.10 120.40 122.78 3kpe s VAL 516 Ca 0.34 0.70 0.00 0.00 0.00 0.00 0.00 61.98 63.02 3kpe s VAL 516 Cb 0.20 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.92 3kpe s VAL 516 CO 0.30 0.53 0.05 -0.46 0.00 0.00 0.00 175.10 175.52