#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfa s LEU 2 N 0.00 0.43 -0.00 4.03 1.43 -1.26 -5.04 118.68 118.27 1cfa s LEU 2 Ca 0.00 0.54 0.03 0.00 -1.03 0.00 0.00 54.13 53.67 1cfa s LEU 2 Cb 0.00 1.52 0.06 0.00 0.03 0.00 0.00 46.19 47.80 1cfa s LEU 2 CO 0.00 -0.32 1.02 0.00 0.23 0.00 0.00 176.35 177.28 1cfa n GLN 3 N 1.98 0.00 -1.72 1.70 10.64 -1.26 -5.10 117.38 123.63 1cfa n GLN 3 Ca -0.17 -1.13 -0.29 0.00 -1.83 0.00 0.00 57.00 53.57 1cfa n GLN 3 Cb 0.57 -0.44 0.21 0.00 -0.86 0.00 0.00 30.24 29.72 1cfa n GLN 3 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 1cfa n LYS 4 N 0.06 -1.67 0.00 2.61 0.00 -1.26 -5.08 118.16 112.83 1cfa n LYS 4 Ca 0.01 -1.98 0.00 0.00 -0.00 0.00 0.00 58.31 56.33 1cfa n LYS 4 Cb 0.76 -1.42 0.00 0.00 -0.00 0.00 0.00 35.03 34.37 1cfa n LYS 4 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1cfa n LYS 5 N -4.01 0.00 0.30 -1.58 5.02 -1.26 -4.82 118.16 111.81 1cfa n LYS 5 Ca 0.16 0.00 0.20 0.00 -2.02 0.00 0.00 58.31 56.66 1cfa n LYS 5 Cb 0.58 0.00 1.06 0.00 -0.02 0.00 0.00 35.03 36.65 1cfa n LYS 5 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1cfa h ILE 6 N 0.00 0.00 0.09 -0.18 1.08 -1.98 -2.76 117.51 113.77 1cfa h ILE 6 Ca 0.00 -0.06 0.00 0.00 -0.39 0.00 0.00 64.86 64.41 1cfa h ILE 6 Cb 0.00 0.99 -0.01 0.00 -3.07 0.00 0.00 36.82 34.72 1cfa h ILE 6 CO 0.00 0.00 -0.18 -0.08 -0.69 0.00 0.00 178.15 177.20 1cfa h GLU 7 N 0.00 -0.28 0.00 2.37 4.81 -1.99 -0.21 114.58 119.28 1cfa h GLU 7 Ca 0.00 0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.19 1cfa h GLU 7 Cb 0.07 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 1cfa h GLU 7 CO 0.00 -0.19 -0.28 1.05 -0.73 0.00 0.00 179.01 178.87 1cfa h GLU 8 N -0.29 0.00 -0.99 1.92 4.11 -1.85 0.56 114.58 118.04 1cfa h GLU 8 Ca -0.01 0.00 0.26 0.00 0.07 0.00 0.00 59.36 59.68 1cfa h GLU 8 Cb 0.27 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 1cfa h GLU 8 CO -0.07 0.28 0.67 0.82 0.07 0.00 0.00 179.01 180.78 1cfa h ILE 9 N 0.00 0.56 0.15 -1.06 2.04 -1.05 2.00 117.51 120.15 1cfa h ILE 9 Ca -0.00 -0.09 -0.30 0.00 1.00 0.00 0.00 64.86 65.47 1cfa h ILE 9 Cb 0.51 0.28 0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1cfa h ILE 9 CO 0.04 0.05 -1.40 0.00 0.00 0.00 0.00 178.15 176.84 1cfa h ALA 10 N 1.57 0.11 -0.34 1.87 0.00 0.83 -3.17 119.26 120.12 1cfa h ALA 10 Ca 0.52 -0.96 0.10 0.00 0.00 0.00 0.00 54.91 54.56 1cfa h ALA 10 Cb 1.57 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1cfa h ALA 10 CO -0.15 0.98 0.46 0.00 0.00 0.00 0.00 179.25 180.54 1cfa h ALA 11 N 0.46 1.99 0.00 0.00 0.00 0.45 0.14 119.26 122.29 1cfa h ALA 11 Ca -0.20 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.59 1cfa h ALA 11 Cb 2.03 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.82 1cfa h ALA 11 CO 0.20 -0.64 -1.66 1.63 0.00 0.00 0.00 179.25 178.78 1cfa n LYS 12 N -3.50 0.64 -1.54 0.00 5.02 0.17 -4.80 118.16 114.16 1cfa n LYS 12 Ca 0.06 0.04 -0.31 0.00 -2.02 0.00 0.00 58.31 56.07 1cfa n LYS 12 Cb 0.61 -1.68 -0.08 0.00 -0.02 0.00 0.00 35.03 33.86 1cfa n LYS 12 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1cfa n TYR 13 N -2.63 1.06 0.00 2.13 4.02 0.47 -4.49 117.16 117.72 1cfa n TYR 13 Ca -0.10 0.14 0.00 0.00 -0.01 0.00 0.00 57.90 57.94 1cfa n TYR 13 Cb 0.75 -2.39 0.00 0.00 -0.02 0.00 0.00 39.34 37.68 1cfa n TYR 13 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02 1cfa n LYS 14 N 8.55 0.00 0.33 -0.72 3.00 -1.26 0.98 118.16 129.04 1cfa n LYS 14 Ca 0.48 0.00 0.21 0.00 -0.00 0.00 0.00 58.31 59.00 1cfa n LYS 14 Cb 0.37 0.00 1.11 0.00 0.00 0.00 0.00 35.03 36.52 1cfa n LYS 14 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.40 178.52 1cfa h HIS 15 N 0.25 0.00 -0.89 5.64 2.07 -1.87 0.11 115.15 120.46 1cfa h HIS 15 Ca 0.00 0.00 0.23 0.00 -2.85 0.00 0.00 60.37 57.75 1cfa h HIS 15 Cb 0.00 0.00 -0.16 0.00 2.57 0.00 0.00 27.41 29.82 1cfa h HIS 15 CO 0.00 0.00 0.04 0.77 -3.07 0.00 0.00 177.93 175.67 1cfa h SER 16 N 0.00 -0.38 0.00 3.10 0.02 -1.98 -3.42 113.55 110.89 1cfa h SER 16 Ca 0.00 0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.19 1cfa h SER 16 Cb 0.11 0.41 0.00 0.00 0.14 0.00 0.00 62.40 63.06 1cfa h SER 16 CO -0.00 -0.26 0.00 0.55 -1.14 0.00 0.00 176.83 175.98 1cfa n VAL 17 N -5.41 0.00 0.11 2.27 3.14 -1.06 -4.92 118.33 112.46 1cfa n VAL 17 Ca 0.19 0.00 0.17 0.00 -2.96 0.00 0.00 64.34 61.75 1cfa n VAL 17 Cb 0.64 0.00 0.52 0.00 -1.06 0.00 0.00 33.84 33.94 1cfa n VAL 17 CO 0.00 0.00 0.00 1.62 -6.46 0.00 0.00 176.83 171.99 1cfa h VAL 18 N 0.00 0.10 0.00 1.55 3.04 -1.74 -1.74 116.25 117.46 1cfa h VAL 18 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1cfa h VAL 18 Cb 0.00 0.33 0.00 0.00 -2.01 0.00 0.00 31.29 29.61 1cfa h VAL 18 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.57 177.73 1cfa n LYS 19 N -3.14 0.00 0.29 4.17 4.81 0.28 -1.17 118.16 123.40 1cfa n LYS 19 Ca 0.08 0.33 0.12 0.00 -0.87 0.00 0.00 58.31 57.97 1cfa n LYS 19 Cb 0.91 -1.16 0.57 0.00 0.02 0.00 0.00 35.03 35.37 1cfa n LYS 19 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1cfa h LYS 20 N 0.00 0.00 0.07 1.64 1.57 -1.63 -1.42 116.57 116.81 1cfa h LYS 20 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1cfa h LYS 20 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1cfa h LYS 20 CO 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 179.45 178.85 1cfa h TYR 23 N 0.28 -0.03 -1.04 0.00 -1.99 -1.30 -0.16 116.97 112.73 1cfa h TYR 23 Ca 0.70 -0.00 0.28 0.00 2.00 0.00 0.00 58.73 61.71 1cfa h TYR 23 Cb 1.89 0.01 -0.12 0.00 2.00 0.00 0.00 36.73 40.51 1cfa h TYR 23 CO -0.00 0.01 0.63 -0.44 -0.00 0.00 0.00 178.16 178.36 1cfa h ASP 24 N -0.06 0.55 0.74 3.88 5.19 0.52 1.01 116.42 128.25 1cfa h ASP 24 Ca -0.00 0.14 -0.04 0.00 -0.62 0.00 0.00 57.03 56.51 1cfa h ASP 24 Cb 0.06 0.06 0.01 0.00 0.18 0.00 0.00 39.33 39.63 1cfa h ASP 24 CO 0.01 0.02 -0.36 1.23 -3.12 0.00 0.00 179.24 177.02 1cfa h GLY 25 N 0.44 -1.04 -0.10 2.75 0.00 0.76 -1.73 103.07 104.15 1cfa h GLY 25 Ca 0.67 0.39 0.00 0.00 0.00 0.00 0.00 47.33 48.38 1cfa h GLY 25 CO -0.46 -0.38 0.00 0.00 0.00 0.00 0.00 176.54 175.70 1cfa n ALA 26 N -2.55 2.54 -0.11 3.60 0.00 -0.50 -4.00 120.51 119.49 1cfa n ALA 26 Ca -0.12 -0.21 -0.19 0.00 0.00 0.00 0.00 53.44 52.91 1cfa n ALA 26 Cb 0.39 -1.12 -0.06 0.00 0.00 0.00 0.00 19.45 18.66 1cfa n ALA 26 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1cfa n SER 27 N -0.33 1.84 -4.45 0.00 7.64 0.34 -4.99 113.62 113.67 1cfa n SER 27 Ca 0.09 0.31 -0.31 0.00 1.01 0.00 0.00 58.87 59.97 1cfa n SER 27 Cb 0.12 -0.74 0.18 0.00 -1.01 0.00 0.00 64.21 62.76 1cfa n SER 27 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1cfa n VAL 28 N -4.25 0.00 -0.95 0.44 0.24 -0.66 -4.88 118.33 108.26 1cfa n VAL 28 Ca -0.34 -0.24 -0.37 0.00 -2.04 0.00 0.00 64.34 61.35 1cfa n VAL 28 Cb 0.69 -0.78 0.06 0.00 -1.47 0.00 0.00 33.84 32.33 1cfa n VAL 28 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1cfa n ASN 29 N -2.89 -3.87 -0.28 -1.34 2.85 -1.26 -4.56 115.26 103.91 1cfa n ASN 29 Ca 0.05 0.07 0.33 0.00 -0.11 0.00 0.00 54.58 54.92 1cfa n ASN 29 Cb 0.56 -0.68 0.60 0.00 1.24 0.00 0.00 39.78 41.49 1cfa n ASN 29 CO 0.00 0.00 0.00 0.78 -2.11 0.00 0.00 177.26 175.93 1cfa h ASN 30 N -1.16 0.00 0.00 1.20 4.21 -1.92 -2.19 115.58 115.72 1cfa h ASN 30 Ca -0.43 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.08 1cfa h ASN 30 Cb 1.35 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.55 1cfa h ASN 30 CO 0.25 0.00 -0.09 -0.90 -1.29 0.00 0.00 177.43 175.39 1cfa n ASP 31 N -3.56 0.00 0.00 5.81 5.75 -1.26 -4.79 116.55 118.50 1cfa n ASP 31 Ca 0.26 -1.18 0.00 0.00 -0.01 0.00 0.00 54.79 53.85 1cfa n ASP 31 Cb 1.47 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 41.52 1cfa n ASP 31 CO 0.00 0.00 0.00 1.21 -0.11 0.00 0.00 177.20 178.30 1cfa n GLU 32 N 0.00 0.00 -0.01 0.11 2.13 -0.82 -3.23 120.64 118.81 1cfa n GLU 32 Ca 0.00 0.38 -0.01 0.00 0.66 0.00 0.00 57.16 58.19 1cfa n GLU 32 Cb 0.54 -1.12 -0.12 0.00 0.27 0.00 0.00 31.44 31.01 1cfa n GLU 32 CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 1cfa n THR 33 N -1.18 1.10 -0.35 6.31 -1.04 -1.26 -3.48 114.28 114.39 1cfa n THR 33 Ca 0.00 -0.71 0.32 0.00 -2.04 0.00 0.00 64.05 61.62 1cfa n THR 33 Cb 0.00 -0.60 0.58 0.00 -1.82 0.00 0.00 70.33 68.49 1cfa n THR 33 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1cfa n GLU 35 N -5.13 0.49 -0.27 0.00 2.13 -1.20 -1.27 120.64 115.39 1cfa n GLU 35 Ca 0.37 0.40 0.32 0.00 0.66 0.00 0.00 57.16 58.91 1cfa n GLU 35 Cb 1.28 -1.59 0.58 0.00 0.27 0.00 0.00 31.44 31.98 1cfa n GLU 35 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1cfa h GLN 36 N -1.00 0.00 0.00 5.31 4.20 -1.50 0.27 115.11 122.39 1cfa h GLN 36 Ca -0.03 0.00 -0.42 0.00 0.06 0.00 0.00 58.65 58.25 1cfa h GLN 36 Cb 0.76 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.47 1cfa h GLN 36 CO -0.02 0.00 -2.47 0.54 -0.67 0.00 0.00 178.83 176.20 1cfa n ARG 37 N -3.52 0.59 0.50 1.46 3.00 0.75 -3.74 116.66 115.69 1cfa n ARG 37 Ca 0.25 0.21 -0.19 0.00 -0.01 0.00 0.00 57.85 58.11 1cfa n ARG 37 Cb 1.46 -1.47 -0.09 0.00 0.00 0.00 0.00 32.46 32.35 1cfa n ARG 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1cfa h ALA 38 N -0.61 -1.31 -3.00 7.54 0.00 0.56 -3.41 119.26 119.02 1cfa h ALA 38 Ca -0.64 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.00 1cfa h ALA 38 Cb 1.70 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.97 1cfa h ALA 38 CO -0.29 -1.22 0.00 0.00 0.00 0.00 0.00 179.25 177.73 1cfa n ALA 39 N -2.65 0.00 -1.51 0.00 0.00 0.69 -4.66 120.51 112.38 1cfa n ALA 39 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 1cfa n ALA 39 Cb 0.50 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.78 1cfa n ALA 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1cfa n ARG 40 N -0.60 0.11 -3.58 0.00 5.12 -1.13 -4.78 116.66 111.80 1cfa n ARG 40 Ca 0.00 -0.06 -0.28 0.00 -1.93 0.00 0.00 57.85 55.59 1cfa n ARG 40 Cb 0.00 -1.56 -0.11 0.00 -1.16 0.00 0.00 32.46 29.63 1cfa n ARG 40 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1cfa s ILE 41 N 5.76 1.18 -0.12 0.55 1.01 -1.26 -4.05 121.20 124.27 1cfa s ILE 41 Ca 1.29 -3.03 0.26 0.00 0.00 0.00 0.00 60.65 59.16 1cfa s ILE 41 Cb -0.94 -1.80 0.27 0.00 0.01 0.00 0.00 42.46 40.00 1cfa s ILE 41 CO 0.48 -1.11 1.79 0.28 0.00 0.00 0.00 174.94 176.38 1cfa h SER 42 N 5.80 0.00 0.00 3.58 0.02 -1.93 -3.36 113.55 117.67 1cfa h SER 42 Ca 0.18 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 1cfa h SER 42 Cb 0.87 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1cfa h SER 42 CO 0.48 0.00 0.00 -0.11 -1.14 0.00 0.00 176.83 176.06 1cfa n LEU 43 N -2.42 0.00 -1.85 5.07 -0.00 -1.26 -5.08 117.00 111.46 1cfa n LEU 43 Ca -0.01 0.00 -0.01 0.00 -0.00 0.00 0.00 56.01 55.99 1cfa n LEU 43 Cb 0.09 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.52 1cfa n LEU 43 CO 0.14 0.00 0.05 0.61 -0.00 0.00 0.00 177.39 178.19 1cfa n GLY 44 N 0.03 -0.10 0.22 -3.96 0.00 -1.26 -4.96 105.19 95.17 1cfa n GLY 44 Ca 0.00 -0.07 -0.07 0.00 0.00 0.00 0.00 46.02 45.88 1cfa n GLY 44 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1cfa h PRO 45 N -0.04 -0.17 0.00 1.61 0.11 -1.96 -3.46 132.00 128.09 1cfa h PRO 45 Ca -0.05 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1cfa h PRO 45 Cb 1.03 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1cfa h PRO 45 CO 0.08 -0.12 0.00 -2.13 -0.21 0.00 0.00 178.00 175.62 1cfa n ARG 46 N -4.00 0.00 0.25 1.05 3.00 -1.26 -4.94 116.66 110.76 1cfa n ARG 46 Ca -0.02 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 57.93 1cfa n ARG 46 Cb 0.16 0.00 0.64 0.00 0.00 0.00 0.00 32.46 33.27 1cfa n ARG 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1cfa h ILE 48 N 0.00 1.31 0.66 0.00 -0.00 -1.90 0.28 117.51 117.86 1cfa h ILE 48 Ca -0.00 -1.02 -0.03 0.00 -0.00 0.00 0.00 64.86 63.80 1cfa h ILE 48 Cb 0.31 1.83 0.01 0.00 -0.00 0.00 0.00 36.82 38.96 1cfa h ILE 48 CO 0.02 0.29 -0.32 0.11 -0.00 0.00 0.00 178.15 178.25 1cfa h LYS 49 N -0.19 -0.85 0.14 0.16 1.57 -1.78 1.03 116.57 116.65 1cfa h LYS 49 Ca 0.02 0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.86 1cfa h LYS 49 Cb 0.47 0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.94 1cfa h LYS 49 CO 0.01 -0.57 -0.41 0.00 -0.57 0.00 0.00 179.45 177.91 1cfa h ALA 50 N -1.42 -0.93 0.00 3.86 0.00 -1.40 0.86 119.26 120.24 1cfa h ALA 50 Ca -0.09 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1cfa h ALA 50 Cb 0.68 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1cfa h ALA 50 CO 0.15 -1.02 0.00 1.97 0.00 0.00 0.00 179.25 180.35 1cfa n PHE 51 N -4.80 0.00 0.05 0.00 -1.74 0.99 -1.46 117.46 110.50 1cfa n PHE 51 Ca -0.07 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.74 1cfa n PHE 51 Cb 0.33 -0.44 -0.05 0.00 1.52 0.00 0.00 39.48 40.83 1cfa n PHE 51 CO 0.00 0.00 0.00 1.15 -0.56 0.00 0.00 176.76 177.35 1cfa h THR 52 N 0.00 0.49 -0.00 1.97 2.02 0.36 0.55 112.91 118.29 1cfa h THR 52 Ca 0.00 -1.06 -0.07 0.00 0.77 0.00 0.00 66.41 66.05 1cfa h THR 52 Cb 0.16 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.41 1cfa h THR 52 CO 0.00 0.14 -0.31 -0.33 0.37 0.00 0.00 175.52 175.39 1cfa h GLU 53 N -0.99 0.00 0.00 6.66 5.08 -1.26 -0.86 114.58 123.22 1cfa h GLU 53 Ca -0.02 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1cfa h GLU 53 Cb 0.41 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1cfa h GLU 53 CO 0.04 0.32 0.00 0.00 -1.00 0.00 0.00 179.01 178.37 1cfa h VAL 56 N 0.00 0.47 -1.01 0.00 -1.51 -1.25 -1.62 116.25 111.33 1cfa h VAL 56 Ca 0.61 -0.22 0.26 0.00 -1.23 0.00 0.00 66.70 66.11 1cfa h VAL 56 Cb 1.32 0.57 -0.12 0.00 -2.13 0.00 0.00 31.29 30.93 1cfa h VAL 56 CO -0.87 0.04 0.60 1.62 -1.23 0.00 0.00 177.57 177.73 1cfa h VAL 57 N -0.82 0.51 0.03 7.19 3.04 0.28 0.29 116.25 126.77 1cfa h VAL 57 Ca -0.07 -0.18 0.01 0.00 -1.01 0.00 0.00 66.70 65.45 1cfa h VAL 57 Cb 0.58 -0.07 -0.01 0.00 -2.01 0.00 0.00 31.29 29.77 1cfa h VAL 57 CO 0.11 0.10 -0.08 0.00 -1.01 0.00 0.00 177.57 176.69 1cfa h ALA 58 N 1.73 -0.12 0.08 3.17 0.00 -0.70 -1.76 119.26 121.66 1cfa h ALA 58 Ca 0.65 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.55 1cfa h ALA 58 Cb 1.31 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1cfa h ALA 58 CO -0.47 -0.59 -0.04 0.77 0.00 0.00 0.00 179.25 178.92 1cfa h SER 59 N -0.16 -0.09 -0.59 0.00 0.02 0.31 -0.17 113.55 112.87 1cfa h SER 59 Ca 0.02 0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1cfa h SER 59 Cb 0.18 0.02 -0.08 0.00 0.14 0.00 0.00 62.40 62.67 1cfa h SER 59 CO -0.06 -0.04 -0.31 0.00 -1.14 0.00 0.00 176.83 175.27 1cfa n GLN 60 N -2.42 -0.22 0.11 3.45 1.13 0.69 0.01 117.38 120.12 1cfa n GLN 60 Ca -0.01 0.89 -0.12 0.00 -1.94 0.00 0.00 57.00 55.81 1cfa n GLN 60 Cb 0.04 -1.31 -0.08 0.00 0.11 0.00 0.00 30.24 29.01 1cfa n GLN 60 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1cfa h LEU 61 N 0.00 -0.28 -0.62 1.08 3.38 -1.41 -3.06 115.31 114.41 1cfa h LEU 61 Ca 0.13 -0.25 0.25 0.00 0.09 0.00 0.00 57.88 58.10 1cfa h LEU 61 Cb 0.27 0.07 -0.10 0.00 0.09 0.00 0.00 40.66 41.00 1cfa h LEU 61 CO -0.56 0.16 0.35 0.54 0.09 0.00 0.00 178.44 179.02 1cfa n ARG 62 N -5.04 -0.03 0.51 1.13 5.12 0.10 0.30 116.66 118.74 1cfa n ARG 62 Ca -0.09 0.78 -0.20 0.00 -1.93 0.00 0.00 57.85 56.41 1cfa n ARG 62 Cb 0.26 -1.43 -0.10 0.00 -1.16 0.00 0.00 32.46 30.04 1cfa n ARG 62 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1cfa h ALA 63 N 1.10 -1.29 -2.01 7.54 0.00 -1.11 -3.36 119.26 120.13 1cfa h ALA 63 Ca 0.49 -0.28 -0.51 0.00 0.00 0.00 0.00 54.91 54.61 1cfa h ALA 63 Cb 1.36 0.50 -0.41 0.00 0.00 0.00 0.00 17.79 19.24 1cfa h ALA 63 CO -0.41 -1.20 -1.04 -1.71 0.00 0.00 0.00 179.25 174.90 1cfa n ASN 64 N -5.63 1.96 -4.53 0.00 2.85 0.81 -5.07 115.26 105.65 1cfa n ASN 64 Ca -0.16 -3.20 -0.44 0.00 -0.11 0.00 0.00 54.58 50.67 1cfa n ASN 64 Cb 0.51 -0.59 -0.05 0.00 1.24 0.00 0.00 39.78 40.88 1cfa n ASN 64 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1cfa n ILE 65 N 0.10 0.18 0.05 -1.44 5.41 0.86 -4.05 119.36 120.47 1cfa n ILE 65 Ca 0.26 -0.44 0.00 0.00 1.00 0.00 0.00 62.75 63.57 1cfa n ILE 65 Cb 0.59 -2.20 0.00 0.00 -0.71 0.00 0.00 39.64 37.33 1cfa n ILE 65 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1cfa n SER 66 N 11.90 -0.94 0.00 4.38 2.88 -1.26 -5.01 113.62 125.57 1cfa n SER 66 Ca 0.37 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1cfa n SER 66 Cb 0.37 1.24 0.00 0.00 -0.75 0.00 0.00 64.21 65.08 1cfa n SER 66 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1cfa n HIS 67 N -3.04 0.00 -2.69 0.66 8.25 -1.26 -4.93 115.22 112.22 1cfa n HIS 67 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1cfa n HIS 67 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1cfa n HIS 67 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 1cfa n LYS 68 N 0.00 2.00 -3.80 -0.41 3.00 -1.26 -5.17 118.16 112.52 1cfa n LYS 68 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 1cfa n LYS 68 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 35.03 34.91 1cfa n LYS 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1cfa s ASP 69 N 1.00 -0.19 0.00 3.14 1.01 -1.26 -4.96 116.67 115.41 1cfa s ASP 69 Ca 0.00 0.38 0.00 0.00 0.71 0.00 0.00 52.55 53.64 1cfa s ASP 69 Cb 0.00 0.36 0.00 0.00 1.01 0.00 0.00 42.92 44.29 1cfa s ASP 69 CO 0.00 -0.08 0.00 0.80 0.21 0.00 0.00 175.17 176.10 1cfa n MET 70 N 3.17 3.52 0.00 8.23 1.56 -1.26 -5.15 117.12 127.18 1cfa n MET 70 Ca -0.15 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.28 1cfa n MET 70 Cb 0.58 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.95 1cfa n MET 70 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24