#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fk6 s ILE 2 N 0.00 5.20 0.35 0.00 1.01 -1.26 -5.09 121.20 121.40 1fk6 s ILE 2 Ca 0.00 0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.86 1fk6 s ILE 2 Cb 0.00 -3.47 -0.03 0.00 0.01 0.00 0.00 42.46 38.98 1fk6 s ILE 2 CO 0.00 0.27 0.31 -0.94 0.00 0.00 0.00 174.94 174.58 1fk6 s SER 3 N 1.70 5.27 0.48 3.58 1.04 -1.26 -4.73 113.70 119.77 1fk6 s SER 3 Ca 0.07 -0.53 0.27 0.00 0.48 0.00 0.00 55.95 56.24 1fk6 s SER 3 Cb -0.16 -0.91 1.04 0.00 0.10 0.00 0.00 66.02 66.09 1fk6 s SER 3 CO 0.10 -0.40 1.87 0.00 0.98 0.00 0.00 173.24 175.78 1fk6 h GLY 5 N 2.16 0.71 0.87 0.00 0.00 -1.99 -0.01 103.07 104.82 1fk6 h GLY 5 Ca -0.00 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.70 1fk6 h GLY 5 CO 0.02 0.57 -0.23 1.46 0.00 0.00 0.00 176.54 178.35 1fk6 h GLN 6 N 0.42 -0.56 -0.34 4.80 4.20 -1.90 -1.51 115.11 120.23 1fk6 h GLN 6 Ca 0.08 0.04 0.06 0.00 0.06 0.00 0.00 58.65 58.88 1fk6 h GLN 6 Cb 0.65 0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.50 1fk6 h GLN 6 CO 0.04 -0.37 0.02 0.28 -0.67 0.00 0.00 178.83 178.13 1fk6 h VAL 7 N -0.58 0.77 -0.65 -0.54 2.07 -1.36 -1.90 116.25 114.06 1fk6 h VAL 7 Ca -0.04 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.49 1fk6 h VAL 7 Cb 0.48 0.64 -0.05 0.00 -1.52 0.00 0.00 31.29 30.84 1fk6 h VAL 7 CO 0.03 0.02 0.37 0.00 0.02 0.00 0.00 177.57 178.01 1fk6 h ALA 8 N 1.28 0.86 -0.12 1.67 0.00 -0.72 -1.60 119.26 120.63 1fk6 h ALA 8 Ca 0.16 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1fk6 h ALA 8 Cb 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1fk6 h ALA 8 CO -0.26 0.06 -0.30 0.77 0.00 0.00 0.00 179.25 179.52 1fk6 h SER 9 N 0.69 0.23 -0.19 0.00 0.02 -1.04 -1.57 113.55 111.69 1fk6 h SER 9 Ca 0.28 -0.08 -0.20 0.00 -0.84 0.00 0.00 61.79 60.96 1fk6 h SER 9 Cb 0.14 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.62 1fk6 h SER 9 CO -0.16 0.53 -0.64 0.00 -1.14 0.00 0.00 176.83 175.42 1fk6 h ALA 10 N 1.49 0.43 -0.01 3.77 0.00 -0.55 -3.32 119.26 121.07 1fk6 h ALA 10 Ca 0.03 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1fk6 h ALA 10 Cb 0.64 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1fk6 h ALA 10 CO 0.05 0.69 -0.44 0.44 0.00 0.00 0.00 179.25 179.99 1fk6 n ILE 11 N -3.97 0.00 -0.31 0.00 -5.35 -0.68 -4.05 119.36 105.01 1fk6 n ILE 11 Ca -0.05 -0.10 0.13 0.00 -0.27 0.00 0.00 62.75 62.46 1fk6 n ILE 11 Cb 0.67 0.57 0.29 0.00 -1.74 0.00 0.00 39.64 39.43 1fk6 n ILE 11 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1fk6 h ALA 12 N 3.47 1.23 0.00 -1.28 0.00 -1.38 0.33 119.26 121.63 1fk6 h ALA 12 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1fk6 h ALA 12 Cb 0.55 0.41 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1fk6 h ALA 12 CO 0.00 -0.52 0.00 -2.30 0.00 0.00 0.00 179.25 176.43 1fk6 n PRO 13 N -5.32 0.10 0.12 0.00 -0.02 -1.26 -2.59 135.00 126.04 1fk6 n PRO 13 Ca 0.22 0.41 0.09 0.00 -2.02 0.00 0.00 63.50 62.20 1fk6 n PRO 13 Cb 0.71 -1.73 0.03 0.00 -0.02 0.00 0.00 33.50 32.49 1fk6 n PRO 13 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fk6 h ILE 15 N 0.00 0.36 -0.85 0.00 1.08 -1.55 -1.11 117.51 115.44 1fk6 h ILE 15 Ca -0.03 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.54 1fk6 h ILE 15 Cb 1.12 0.36 -0.07 0.00 -3.07 0.00 0.00 36.82 35.16 1fk6 h ILE 15 CO 0.01 0.00 0.50 0.77 -0.69 0.00 0.00 178.15 178.74 1fk6 h SER 16 N -0.10 0.72 -0.41 1.72 4.64 -1.81 0.95 113.55 119.27 1fk6 h SER 16 Ca 0.24 0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.50 1fk6 h SER 16 Cb 0.46 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1fk6 h SER 16 CO -0.57 0.42 -0.15 0.22 -0.87 0.00 0.00 176.83 175.89 1fk6 h TYR 17 N 0.84 0.93 -0.44 4.77 3.20 -1.47 0.17 116.97 124.98 1fk6 h TYR 17 Ca 0.41 -0.22 0.06 0.00 3.14 0.00 0.00 58.73 62.12 1fk6 h TYR 17 Cb 0.35 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1fk6 h TYR 17 CO -0.05 0.96 0.30 0.00 -1.64 0.00 0.00 178.16 177.73 1fk6 h ALA 18 N 0.83 1.99 0.00 1.82 0.00 -0.30 -0.03 119.26 123.57 1fk6 h ALA 18 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1fk6 h ALA 18 Cb 0.69 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1fk6 h ALA 18 CO 0.05 -0.07 0.00 0.54 0.00 0.00 0.00 179.25 179.77 1fk6 n ARG 19 N -4.47 0.06 0.00 0.00 1.74 0.24 0.43 116.66 114.66 1fk6 n ARG 19 Ca 0.06 0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 1fk6 n ARG 19 Cb 0.27 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.21 1fk6 n ARG 19 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fk6 n GLY 20 N 1.23 0.79 3.71 -0.13 0.00 -0.03 -4.37 105.19 106.40 1fk6 n GLY 20 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1fk6 n GLY 20 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fk6 s GLN 21 N -0.47 4.54 0.00 1.61 -0.21 0.02 -4.91 119.66 120.23 1fk6 s GLN 21 Ca 0.00 1.28 0.00 0.00 0.02 0.00 0.00 55.36 56.66 1fk6 s GLN 21 Cb 0.00 -3.45 0.00 0.00 1.00 0.00 0.00 33.01 30.56 1fk6 s GLN 21 CO 0.00 0.01 0.00 0.41 -2.12 0.00 0.00 175.29 173.59 1fk6 n GLY 22 N 2.89 0.45 0.08 3.09 0.00 -1.26 -3.30 105.19 107.14 1fk6 n GLY 22 Ca 0.04 -1.77 -0.05 0.00 0.00 0.00 0.00 46.02 44.24 1fk6 n GLY 22 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1fk6 h SER 23 N 0.00 0.00 -2.50 1.61 0.02 -1.99 -3.49 113.55 107.20 1fk6 h SER 23 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1fk6 h SER 23 Cb 0.00 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.55 1fk6 h SER 23 CO 0.00 0.87 0.24 0.61 -1.14 0.00 0.00 176.83 177.41 1fk6 n GLY 24 N 1.37 1.17 3.81 -3.77 0.00 -1.26 -5.14 105.19 101.37 1fk6 n GLY 24 Ca -0.04 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 1fk6 n GLY 24 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fk6 s PRO 25 N -2.07 3.54 0.61 1.61 0.04 -1.26 -4.92 135.00 132.55 1fk6 s PRO 25 Ca 0.13 1.19 -0.08 0.00 0.04 0.00 0.00 61.00 62.27 1fk6 s PRO 25 Cb -0.04 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 1fk6 s PRO 25 CO 0.09 -0.63 0.97 -1.54 0.04 0.00 0.00 177.00 175.92 1fk6 s SER 26 N -2.68 5.79 0.34 6.66 1.04 -1.26 -4.85 113.70 118.73 1fk6 s SER 26 Ca 0.63 1.01 0.02 0.00 0.48 0.00 0.00 55.95 58.10 1fk6 s SER 26 Cb -0.15 -2.01 0.60 0.00 0.10 0.00 0.00 66.02 64.55 1fk6 s SER 26 CO 0.32 -1.03 1.97 0.00 0.98 0.00 0.00 173.24 175.49 1fk6 h ALA 27 N -0.28 1.48 -0.25 5.32 0.00 -1.97 0.10 119.26 123.66 1fk6 h ALA 27 Ca -0.45 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.28 1fk6 h ALA 27 Cb 1.23 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1fk6 h ALA 27 CO 0.62 0.44 -0.26 0.78 0.00 0.00 0.00 179.25 180.83 1fk6 h GLY 28 N 0.88 0.53 0.55 0.00 0.00 -1.94 -0.70 103.07 102.39 1fk6 h GLY 28 Ca 0.22 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 47.11 1fk6 h GLY 28 CO -0.04 0.40 -0.06 0.00 0.00 0.00 0.00 176.54 176.84 1fk6 h SER 31 N 0.42 0.36 -0.74 0.00 0.87 -1.09 -0.25 113.55 113.11 1fk6 h SER 31 Ca 0.10 -0.24 -0.06 0.00 -1.23 0.00 0.00 61.79 60.35 1fk6 h SER 31 Cb 0.19 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 1fk6 h SER 31 CO -0.00 0.51 0.22 1.23 -0.53 0.00 0.00 176.83 178.26 1fk6 h GLY 32 N 0.20 1.24 0.99 5.77 0.00 -0.81 -1.20 103.07 109.25 1fk6 h GLY 32 Ca 0.07 -0.75 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 1fk6 h GLY 32 CO 0.00 0.70 0.33 -2.08 0.00 0.00 0.00 176.54 175.49 1fk6 h VAL 33 N 1.10 1.19 -0.10 4.60 2.07 -0.97 -1.92 116.25 122.22 1fk6 h VAL 33 Ca 0.24 -0.46 -0.13 0.00 0.82 0.00 0.00 66.70 67.16 1fk6 h VAL 33 Cb 0.32 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.51 1fk6 h VAL 33 CO -0.01 0.20 -0.53 -0.09 0.02 0.00 0.00 177.57 177.17 1fk6 h ARG 34 N 0.79 0.27 -0.60 1.57 2.43 -0.75 -1.93 114.38 116.16 1fk6 h ARG 34 Ca 0.21 -0.16 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1fk6 h ARG 34 Cb 0.03 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.57 1fk6 h ARG 34 CO -0.03 0.73 0.15 0.77 -1.51 0.00 0.00 179.97 180.08 1fk6 h SER 35 N 0.21 0.90 -0.29 -3.80 0.02 -0.97 -1.68 113.55 107.94 1fk6 h SER 35 Ca 0.01 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 60.67 1fk6 h SER 35 Cb 1.00 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.29 1fk6 h SER 35 CO 0.08 0.90 -0.02 0.25 -1.14 0.00 0.00 176.83 176.91 1fk6 h LEU 36 N 0.87 0.52 -0.77 5.07 5.85 -1.21 -1.03 115.31 124.60 1fk6 h LEU 36 Ca 0.19 -0.32 0.07 0.00 0.84 0.00 0.00 57.88 58.65 1fk6 h LEU 36 Cb 0.34 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 1fk6 h LEU 36 CO 0.00 0.71 0.45 -1.13 -0.34 0.00 0.00 178.44 178.14 1fk6 h ASN 37 N 0.30 0.69 0.14 1.25 -0.00 -1.12 -1.80 115.58 115.04 1fk6 h ASN 37 Ca 0.08 0.03 -0.17 0.00 -0.00 0.00 0.00 56.30 56.23 1fk6 h ASN 37 Cb 0.46 -0.11 -0.00 0.00 -0.00 0.00 0.00 38.32 38.66 1fk6 h ASN 37 CO 0.02 0.43 -0.65 0.78 -0.00 0.00 0.00 177.43 178.01 1fk6 h ASN 38 N 0.82 0.56 0.83 1.15 -0.26 -1.21 -3.20 115.58 114.26 1fk6 h ASN 38 Ca 0.35 -0.33 -0.10 0.00 -0.56 0.00 0.00 56.30 55.66 1fk6 h ASN 38 Cb 0.21 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 37.30 1fk6 h ASN 38 CO -0.19 1.06 -0.47 0.00 -1.06 0.00 0.00 177.43 176.77 1fk6 h ALA 39 N 0.94 0.95 -0.84 -0.83 0.00 -0.94 -3.38 119.26 115.16 1fk6 h ALA 39 Ca -0.01 -0.42 -0.67 0.00 0.00 0.00 0.00 54.91 53.80 1fk6 h ALA 39 Cb 1.20 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 1fk6 h ALA 39 CO 0.12 0.58 2.19 0.00 0.00 0.00 0.00 179.25 182.14 1fk6 n ALA 40 N -2.33 3.52 1.12 0.00 0.00 -0.70 -4.77 120.51 117.36 1fk6 n ALA 40 Ca -0.00 -3.83 0.12 0.00 0.00 0.00 0.00 53.44 49.73 1fk6 n ALA 40 Cb 0.56 -3.61 0.19 0.00 0.00 0.00 0.00 19.45 16.60 1fk6 n ALA 40 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1fk6 n ARG 41 N 8.37 1.83 -4.29 0.00 0.00 -1.26 -4.71 116.66 116.60 1fk6 n ARG 41 Ca 0.49 -1.41 -0.15 0.00 -0.00 0.00 0.00 57.85 56.77 1fk6 n ARG 41 Cb 0.46 -1.47 -0.10 0.00 -0.00 0.00 0.00 32.46 31.35 1fk6 n ARG 41 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1fk6 s THR 42 N -2.14 0.53 0.20 8.89 -4.23 -1.26 -5.02 115.64 112.60 1fk6 s THR 42 Ca 0.28 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.69 1fk6 s THR 42 Cb 0.20 -2.52 0.12 0.00 1.34 0.00 0.00 72.50 71.64 1fk6 s THR 42 CO 0.38 -0.10 1.82 0.74 -0.54 0.00 0.00 174.62 176.93 1fk6 h THR 43 N 2.47 1.04 -0.55 3.99 2.02 -1.95 -1.14 112.91 118.77 1fk6 h THR 43 Ca -0.38 -0.25 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 1fk6 h THR 43 Cb 1.24 0.24 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 1fk6 h THR 43 CO 0.60 0.13 0.21 0.00 0.37 0.00 0.00 175.52 176.84 1fk6 h ALA 44 N 1.30 0.72 -0.46 6.16 0.00 -1.97 -0.55 119.26 124.46 1fk6 h ALA 44 Ca 0.27 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 1fk6 h ALA 44 Cb 0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1fk6 h ALA 44 CO -0.13 0.34 0.09 -0.44 0.00 0.00 0.00 179.25 179.11 1fk6 h ASP 45 N 0.76 0.66 0.39 0.00 3.45 -1.84 -2.31 116.42 117.52 1fk6 h ASP 45 Ca 0.18 -0.11 -0.20 0.00 0.43 0.00 0.00 57.03 57.33 1fk6 h ASP 45 Cb 0.22 -0.17 -0.01 0.00 -0.56 0.00 0.00 39.33 38.81 1fk6 h ASP 45 CO -0.01 0.67 -0.83 0.03 -1.57 0.00 0.00 179.24 177.53 1fk6 h ARG 46 N 0.68 0.33 -0.00 3.56 3.08 -0.81 -1.97 114.38 119.24 1fk6 h ARG 46 Ca 0.15 -0.32 -0.14 0.00 0.07 0.00 0.00 59.98 59.75 1fk6 h ARG 46 Cb 0.29 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1fk6 h ARG 46 CO 0.00 0.99 -0.64 0.00 -1.07 0.00 0.00 179.97 179.25 1fk6 h ARG 47 N 0.20 0.00 -0.02 0.04 3.08 -0.98 -1.61 114.38 115.10 1fk6 h ARG 47 Ca -0.05 -0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.77 1fk6 h ARG 47 Cb 1.43 0.00 0.02 0.00 0.08 0.00 0.00 29.97 31.50 1fk6 h ARG 47 CO 0.14 0.64 -0.90 0.00 -1.07 0.00 0.00 179.97 178.78 1fk6 h ALA 48 N 1.36 0.14 -0.61 0.04 0.00 -1.39 -2.15 119.26 116.65 1fk6 h ALA 48 Ca -0.01 -0.65 -0.10 0.00 0.00 0.00 0.00 54.91 54.16 1fk6 h ALA 48 Cb 1.14 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1fk6 h ALA 48 CO 0.08 0.60 0.01 0.00 0.00 0.00 0.00 179.25 179.94 1fk6 h ALA 49 N 0.41 0.86 -0.07 0.00 0.00 -1.28 -1.00 119.26 118.17 1fk6 h ALA 49 Ca -0.11 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1fk6 h ALA 49 Cb 1.56 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.10 1fk6 h ALA 49 CO 0.18 0.67 -0.06 0.00 0.00 0.00 0.00 179.25 180.04 1fk6 h ASN 51 N -0.07 1.12 -0.57 0.00 2.35 -1.17 0.11 115.58 117.35 1fk6 h ASN 51 Ca 0.05 -0.15 -0.09 0.00 -0.55 0.00 0.00 56.30 55.55 1fk6 h ASN 51 Cb 0.14 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.20 1fk6 h ASN 51 CO -0.11 0.96 0.00 0.00 -1.65 0.00 0.00 177.43 176.64 1fk6 h LEU 53 N 0.90 0.51 -0.77 0.00 3.38 -0.55 -0.16 115.31 118.61 1fk6 h LEU 53 Ca 0.16 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.83 1fk6 h LEU 53 Cb 0.54 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1fk6 h LEU 53 CO 0.03 0.90 0.21 0.50 0.09 0.00 0.00 178.44 180.17 1fk6 h LYS 54 N 0.38 1.13 -0.19 1.13 3.64 -0.71 0.18 116.57 122.13 1fk6 h LYS 54 Ca 0.02 -0.25 -0.08 0.00 -1.27 0.00 0.00 60.65 59.07 1fk6 h LYS 54 Cb 0.97 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 32.63 1fk6 h LYS 54 CO 0.08 0.97 -0.21 -0.97 -2.27 0.00 0.00 179.45 177.06 1fk6 h ASN 55 N 1.08 0.51 -0.88 4.20 -0.73 -1.31 -2.25 115.58 116.20 1fk6 h ASN 55 Ca 0.23 -0.49 0.03 0.00 1.87 0.00 0.00 56.30 57.94 1fk6 h ASN 55 Cb 0.32 -0.14 -0.05 0.00 0.27 0.00 0.00 38.32 38.72 1fk6 h ASN 55 CO -0.00 0.89 0.58 0.00 -0.37 0.00 0.00 177.43 178.52 1fk6 h ALA 56 N 0.63 1.15 -0.52 1.57 0.00 -0.83 -2.86 119.26 118.40 1fk6 h ALA 56 Ca 0.03 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1fk6 h ALA 56 Cb 0.76 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1fk6 h ALA 56 CO 0.05 0.45 0.15 0.00 0.00 0.00 0.00 179.25 179.90 1fk6 h ALA 57 N 1.35 0.69 0.00 0.00 0.00 -0.45 -3.14 119.26 117.71 1fk6 h ALA 57 Ca 0.34 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1fk6 h ALA 57 Cb -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1fk6 h ALA 57 CO -0.10 0.36 0.00 0.00 0.00 0.00 0.00 179.25 179.51 1fk6 n ALA 58 N -2.38 2.08 -1.20 0.00 0.00 -0.86 -3.58 120.51 114.56 1fk6 n ALA 58 Ca 0.02 -0.10 0.07 0.00 0.00 0.00 0.00 53.44 53.43 1fk6 n ALA 58 Cb 0.21 -1.29 0.09 0.00 0.00 0.00 0.00 19.45 18.46 1fk6 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fk6 n GLY 59 N 0.16 3.55 3.49 0.00 0.00 -1.18 -4.95 105.19 106.26 1fk6 n GLY 59 Ca 0.11 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.93 1fk6 n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fk6 s VAL 60 N -2.01 4.64 0.12 1.61 1.01 -1.23 -5.02 120.40 119.52 1fk6 s VAL 60 Ca 0.22 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 61.84 1fk6 s VAL 60 Cb 0.19 -4.40 -0.07 0.00 0.00 0.00 0.00 36.38 32.10 1fk6 s VAL 60 CO 0.02 -0.93 1.20 -0.94 0.00 0.00 0.00 175.10 174.46 1fk6 s SER 61 N 2.68 7.08 -0.11 3.32 1.04 -1.26 -2.59 113.70 123.87 1fk6 s SER 61 Ca 0.23 2.13 0.00 0.00 0.48 0.00 0.00 55.95 58.79 1fk6 s SER 61 Cb -0.15 -2.59 0.00 0.00 0.10 0.00 0.00 66.02 63.37 1fk6 s SER 61 CO 0.16 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.57 1fk6 n GLY 62 N 2.73 0.43 3.56 7.32 0.00 -1.26 -4.90 105.19 113.07 1fk6 n GLY 62 Ca 0.07 -0.99 -0.47 0.00 0.00 0.00 0.00 46.02 44.62 1fk6 n GLY 62 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fk6 n LEU 63 N -0.13 1.27 -4.12 0.99 7.94 -1.07 -4.56 117.00 117.33 1fk6 n LEU 63 Ca -0.01 1.16 -0.37 0.00 -1.11 0.00 0.00 56.01 55.68 1fk6 n LEU 63 Cb 0.16 -1.21 -0.11 0.00 0.53 0.00 0.00 43.42 42.79 1fk6 n LEU 63 CO 0.02 -1.57 -0.08 0.21 -1.11 0.00 0.00 177.39 174.86 1fk6 s ASN 64 N -0.37 5.28 0.19 1.96 3.04 0.17 -4.95 114.94 120.25 1fk6 s ASN 64 Ca 0.66 -2.35 -0.17 0.00 0.04 0.00 0.00 52.86 51.04 1fk6 s ASN 64 Cb -0.80 -1.85 0.16 0.00 -1.54 0.00 0.00 41.25 37.22 1fk6 s ASN 64 CO 0.56 -0.48 1.62 0.00 -3.04 0.00 0.00 177.10 175.76 1fk6 h ALA 65 N 7.67 0.20 -0.15 1.71 0.00 -1.93 0.86 119.26 127.63 1fk6 h ALA 65 Ca -0.09 0.19 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1fk6 h ALA 65 Cb 1.01 0.55 -0.05 0.00 0.00 0.00 0.00 17.79 19.30 1fk6 h ALA 65 CO 0.71 -0.53 -0.18 0.78 0.00 0.00 0.00 179.25 180.03 1fk6 h GLY 66 N -0.09 -0.13 0.96 0.00 0.00 -1.95 -1.46 103.07 100.41 1fk6 h GLY 66 Ca 0.25 0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.82 1fk6 h GLY 66 CO -0.60 -0.17 0.27 3.43 0.00 0.00 0.00 176.54 179.47 1fk6 h ASN 67 N -0.23 0.46 -0.98 0.19 4.21 -1.73 -2.67 115.58 114.84 1fk6 h ASN 67 Ca 0.10 -0.01 0.08 0.00 1.21 0.00 0.00 56.30 57.69 1fk6 h ASN 67 Cb 0.38 -0.11 -0.07 0.00 -1.12 0.00 0.00 38.32 37.40 1fk6 h ASN 67 CO -0.28 0.33 0.63 0.00 -1.29 0.00 0.00 177.43 176.83 1fk6 h ALA 68 N 1.17 1.47 0.00 -0.83 0.00 -0.13 -2.41 119.26 118.52 1fk6 h ALA 68 Ca 0.16 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1fk6 h ALA 68 Cb -0.04 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1fk6 h ALA 68 CO -0.05 0.37 -0.24 0.00 0.00 0.00 0.00 179.25 179.33 1fk6 h ALA 69 N 1.49 0.92 0.00 0.00 0.00 -1.10 -3.18 119.26 117.39 1fk6 h ALA 69 Ca 0.44 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1fk6 h ALA 69 Cb 0.25 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1fk6 h ALA 69 CO -0.19 0.30 -0.19 0.66 0.00 0.00 0.00 179.25 179.84 1fk6 h SER 70 N 0.00 0.00 -0.43 0.00 4.64 -1.09 -3.38 113.55 113.28 1fk6 h SER 70 Ca -0.00 0.00 0.08 0.00 -0.47 0.00 0.00 61.79 61.40 1fk6 h SER 70 Cb 0.95 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.94 1fk6 h SER 70 CO 0.03 0.19 -0.32 0.40 -0.87 0.00 0.00 176.83 176.26 1fk6 h ILE 71 N 0.00 0.23 -0.56 0.95 2.04 -1.52 -0.55 117.51 118.10 1fk6 h ILE 71 Ca -0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1fk6 h ILE 71 Cb 0.92 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1fk6 h ILE 71 CO 0.02 0.00 0.18 -0.65 0.00 0.00 0.00 178.15 177.71 1fk6 h PRO 72 N -0.23 0.83 0.00 2.37 0.11 -1.82 -1.10 132.00 132.16 1fk6 h PRO 72 Ca 0.18 -0.14 -0.14 0.00 0.11 0.00 0.00 66.00 66.01 1fk6 h PRO 72 Cb 0.54 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 1fk6 h PRO 72 CO -0.56 0.71 -0.71 0.66 -0.21 0.00 0.00 178.00 177.89 1fk6 h SER 73 N 0.81 0.00 1.63 -2.05 4.64 -1.62 0.24 113.55 117.19 1fk6 h SER 73 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1fk6 h SER 73 Cb 0.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1fk6 h SER 73 CO -0.01 0.67 0.00 0.11 -0.87 0.00 0.00 176.83 176.73 1fk6 h LYS 74 N 0.00 0.00 -0.34 4.77 1.57 -0.81 -3.20 116.57 118.56 1fk6 h LYS 74 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1fk6 h LYS 74 Cb 1.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.84 1fk6 h LYS 74 CO 0.09 0.00 0.00 0.00 -0.57 0.00 0.00 179.45 178.97 1fk6 n GLY 76 N 1.21 0.79 3.54 0.00 0.00 -0.89 -4.93 105.19 104.91 1fk6 n GLY 76 Ca 0.16 -0.42 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 1fk6 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fk6 s VAL 77 N -2.07 4.05 -0.16 1.61 1.01 0.80 -5.00 120.40 120.64 1fk6 s VAL 77 Ca 0.00 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 61.65 1fk6 s VAL 77 Cb 0.00 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 1fk6 s VAL 77 CO 0.00 0.51 -0.08 -0.94 0.00 0.00 0.00 175.10 174.59 1fk6 s SER 78 N 0.17 4.35 0.08 3.32 1.04 -1.26 -3.87 113.70 117.53 1fk6 s SER 78 Ca -0.01 -0.28 0.05 0.00 0.48 0.00 0.00 55.95 56.20 1fk6 s SER 78 Cb -0.13 -1.70 -0.03 0.00 0.10 0.00 0.00 66.02 64.25 1fk6 s SER 78 CO 0.02 0.12 -0.13 0.27 0.98 0.00 0.00 173.24 174.50 1fk6 s ILE 79 N 0.64 1.11 -2.00 -1.02 -4.36 -1.26 -5.06 121.20 109.25 1fk6 s ILE 79 Ca -0.04 -1.41 0.06 0.00 -0.26 0.00 0.00 60.65 59.00 1fk6 s ILE 79 Cb -0.15 -1.17 0.17 0.00 1.25 0.00 0.00 42.46 42.57 1fk6 s ILE 79 CO 0.03 -0.31 1.01 -0.81 0.24 0.00 0.00 174.94 175.10 1fk6 n PRO 80 N 1.06 0.75 -3.74 0.37 -0.04 -1.26 -4.84 135.00 127.31 1fk6 n PRO 80 Ca -0.20 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.15 1fk6 n PRO 80 Cb 0.55 -1.13 -0.07 0.00 -0.04 0.00 0.00 33.50 32.82 1fk6 n PRO 80 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1fk6 s TYR 81 N -2.00 -0.10 -0.14 0.54 1.13 -1.26 -5.15 117.35 110.37 1fk6 s TYR 81 Ca 0.09 -0.12 -0.18 0.00 -1.41 0.00 0.00 57.07 55.45 1fk6 s TYR 81 Cb 0.04 0.12 -0.04 0.00 -1.10 0.00 0.00 41.96 40.98 1fk6 s TYR 81 CO 0.07 -0.56 0.47 0.99 -2.51 0.00 0.00 175.55 174.01 1fk6 s THR 82 N -3.06 5.18 -0.26 -3.49 2.01 -1.26 -5.02 115.64 109.75 1fk6 s THR 82 Ca -0.01 0.91 -0.28 0.00 0.31 0.00 0.00 61.69 62.61 1fk6 s THR 82 Cb 0.01 -3.80 -0.03 0.00 0.01 0.00 0.00 72.50 68.68 1fk6 s THR 82 CO -0.07 0.29 1.93 -0.63 -0.69 0.00 0.00 174.62 175.46 1fk6 s ILE 83 N 0.87 3.32 0.13 1.82 -1.09 -1.26 -4.73 121.20 120.26 1fk6 s ILE 83 Ca 0.25 0.34 -0.11 0.00 -2.23 0.00 0.00 60.65 58.89 1fk6 s ILE 83 Cb -0.15 -3.40 0.01 0.00 -1.58 0.00 0.00 42.46 37.33 1fk6 s ILE 83 CO 0.10 -0.24 0.29 -0.55 -1.23 0.00 0.00 174.94 173.31 1fk6 s SER 84 N 6.52 -0.00 0.27 3.58 0.15 -1.26 -4.96 113.70 117.99 1fk6 s SER 84 Ca 0.86 -0.65 0.23 0.00 0.70 0.00 0.00 55.95 57.10 1fk6 s SER 84 Cb -0.27 0.42 1.01 0.00 -1.71 0.00 0.00 66.02 65.46 1fk6 s SER 84 CO 0.34 -0.84 1.71 0.35 1.20 0.00 0.00 173.24 176.00 1fk6 n THR 85 N -0.17 0.85 0.92 6.45 -2.24 -1.26 -2.32 114.28 116.52 1fk6 n THR 85 Ca -0.12 0.29 0.12 0.00 -2.27 0.00 0.00 64.05 62.07 1fk6 n THR 85 Cb 0.63 -1.24 0.22 0.00 -2.10 0.00 0.00 70.33 67.84 1fk6 n THR 85 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1fk6 n SER 86 N -2.25 0.54 -4.73 3.42 7.64 -1.26 -4.91 113.62 112.08 1fk6 n SER 86 Ca 0.02 -0.23 -0.42 0.00 1.01 0.00 0.00 58.87 59.25 1fk6 n SER 86 Cb 0.21 0.29 -0.03 0.00 -1.01 0.00 0.00 64.21 63.67 1fk6 n SER 86 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1fk6 s THR 87 N -3.03 2.32 -0.64 0.44 2.01 -0.98 -4.96 115.64 110.79 1fk6 s THR 87 Ca 0.10 0.24 -0.15 0.00 0.31 0.00 0.00 61.69 62.19 1fk6 s THR 87 Cb 0.17 -3.15 0.16 0.00 0.01 0.00 0.00 72.50 69.69 1fk6 s THR 87 CO 0.71 0.02 0.59 -0.62 -0.69 0.00 0.00 174.62 174.64 1fk6 s ASP 88 N 0.97 6.38 0.19 3.53 3.68 -1.26 -4.90 116.67 125.26 1fk6 s ASP 88 Ca 0.70 -2.12 0.17 0.00 2.13 0.00 0.00 52.55 53.43 1fk6 s ASP 88 Cb -0.46 -2.20 0.81 0.00 -1.45 0.00 0.00 42.92 39.61 1fk6 s ASP 88 CO 0.35 -0.75 1.53 0.00 0.13 0.00 0.00 175.17 176.43 1fk6 h SER 90 N 0.00 0.00 0.27 0.00 4.64 -1.92 -2.98 113.55 113.56 1fk6 h SER 90 Ca 0.00 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.28 1fk6 h SER 90 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1fk6 h SER 90 CO 0.00 0.02 -0.49 -1.14 -0.87 0.00 0.00 176.83 174.35 1fk6 n ARG 91 N -2.46 0.43 -2.27 4.77 0.63 -0.61 -4.88 116.66 112.27 1fk6 n ARG 91 Ca 0.04 -0.29 -0.42 0.00 -0.92 0.00 0.00 57.85 56.26 1fk6 n ARG 91 Cb 0.46 -1.49 -0.03 0.00 0.45 0.00 0.00 32.46 31.85 1fk6 n ARG 91 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1fk6 s VAL 92 N -2.77 3.95 0.00 5.15 1.01 -1.13 -5.11 120.40 121.50 1fk6 s VAL 92 Ca 0.16 1.22 0.00 0.00 0.00 0.00 0.00 61.98 63.36 1fk6 s VAL 92 Cb 0.18 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.77 1fk6 s VAL 92 CO 0.65 -0.07 0.00 0.59 0.00 0.00 0.00 175.10 176.27