#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfa n LEU 2 N 0.00 0.00 -1.63 3.17 4.77 -1.26 -5.01 117.00 117.04 1cfa n LEU 2 Ca 0.00 -0.66 -0.12 0.00 -0.03 0.00 0.00 56.01 55.19 1cfa n LEU 2 Cb 0.00 0.18 0.09 0.00 -2.33 0.00 0.00 43.42 41.36 1cfa n LEU 2 CO 0.00 -0.10 0.91 0.00 -1.33 0.00 0.00 177.39 176.87 1cfa n GLN 3 N -0.21 1.64 -3.65 3.23 6.02 -1.26 -4.87 117.38 118.28 1cfa n GLN 3 Ca -0.02 -1.54 -0.36 0.00 -0.01 0.00 0.00 57.00 55.07 1cfa n GLN 3 Cb 0.13 -1.60 -0.08 0.00 1.02 0.00 0.00 30.24 29.70 1cfa n GLN 3 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1cfa s LYS 4 N -1.69 4.17 0.00 -1.09 1.02 -1.26 -4.94 119.74 115.95 1cfa s LYS 4 Ca 0.29 -0.14 0.00 0.00 0.02 0.00 0.00 55.97 56.14 1cfa s LYS 4 Cb 0.25 -3.46 0.00 0.00 -0.52 0.00 0.00 37.83 34.09 1cfa s LYS 4 CO 0.06 0.20 0.00 1.63 -0.92 0.00 0.00 175.35 176.31 1cfa n LYS 5 N 3.82 0.00 0.00 1.68 5.02 -1.26 -4.86 118.16 122.56 1cfa n LYS 5 Ca -0.14 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.26 1cfa n LYS 5 Cb 0.52 0.00 0.65 0.00 -0.02 0.00 0.00 35.03 36.17 1cfa n LYS 5 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1cfa n ILE 6 N -0.89 0.12 0.00 -0.18 2.08 -1.26 -3.30 119.36 115.93 1cfa n ILE 6 Ca 0.00 0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.34 1cfa n ILE 6 Cb 0.00 -0.66 0.00 0.00 -0.75 0.00 0.00 39.64 38.23 1cfa n ILE 6 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 1cfa n GLU 7 N -1.12 0.00 0.20 0.38 -0.58 -1.26 -0.51 120.64 117.75 1cfa n GLU 7 Ca 0.15 0.02 0.03 0.00 -0.42 0.00 0.00 57.16 56.94 1cfa n GLU 7 Cb 0.12 -0.62 0.40 0.00 -0.57 0.00 0.00 31.44 30.77 1cfa n GLU 7 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1cfa h GLU 8 N 0.00 0.00 -0.78 3.49 4.11 -1.96 0.10 114.58 119.54 1cfa h GLU 8 Ca 0.00 0.00 0.19 0.00 0.07 0.00 0.00 59.36 59.62 1cfa h GLU 8 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1cfa h GLU 8 CO 0.00 0.32 0.54 0.82 0.07 0.00 0.00 179.01 180.76 1cfa h ILE 9 N 0.00 0.69 0.00 -1.06 2.04 -1.62 1.33 117.51 118.89 1cfa h ILE 9 Ca -0.00 -0.08 -0.23 0.00 1.00 0.00 0.00 64.86 65.55 1cfa h ILE 9 Cb 0.57 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.06 1cfa h ILE 9 CO 0.04 0.04 -1.29 0.00 0.00 0.00 0.00 178.15 176.94 1cfa h ALA 10 N 1.63 0.58 -0.18 1.87 0.00 0.15 -3.26 119.26 120.05 1cfa h ALA 10 Ca 0.39 -1.10 0.05 0.00 0.00 0.00 0.00 54.91 54.26 1cfa h ALA 10 Cb 1.19 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 1cfa h ALA 10 CO -0.08 1.30 0.16 0.00 0.00 0.00 0.00 179.25 180.63 1cfa h ALA 11 N 1.09 1.97 0.00 0.00 0.00 0.38 -0.41 119.26 122.29 1cfa h ALA 11 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1cfa h ALA 11 Cb 1.82 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1cfa h ALA 11 CO 0.09 -0.25 0.00 1.63 0.00 0.00 0.00 179.25 180.72 1cfa n LYS 12 N -4.13 0.55 -2.78 0.00 4.01 -0.22 -4.46 118.16 111.13 1cfa n LYS 12 Ca 0.01 0.00 -0.43 0.00 -0.51 0.00 0.00 58.31 57.39 1cfa n LYS 12 Cb 0.29 -1.36 -0.03 0.00 -0.51 0.00 0.00 35.03 33.42 1cfa n LYS 12 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1cfa s TYR 13 N -2.00 2.85 0.00 2.13 1.51 -0.17 -4.85 117.35 116.82 1cfa s TYR 13 Ca 0.19 -1.09 0.00 0.00 -1.01 0.00 0.00 57.07 55.16 1cfa s TYR 13 Cb 0.09 -4.44 0.00 0.00 -0.11 0.00 0.00 41.96 37.49 1cfa s TYR 13 CO 0.15 -1.68 0.00 1.63 -1.11 0.00 0.00 175.55 174.54 1cfa n LYS 14 N 7.56 0.00 0.08 -0.62 4.01 -1.26 0.86 118.16 128.79 1cfa n LYS 14 Ca 0.25 0.00 0.19 0.00 -0.51 0.00 0.00 58.31 58.24 1cfa n LYS 14 Cb 0.50 0.00 0.56 0.00 -0.51 0.00 0.00 35.03 35.57 1cfa n LYS 14 CO 0.00 0.00 0.00 1.12 -1.11 0.00 0.00 177.40 177.41 1cfa h HIS 15 N 0.31 0.00 0.00 2.13 2.07 -1.89 -0.78 115.15 116.99 1cfa h HIS 15 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1cfa h HIS 15 Cb 0.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.98 1cfa h HIS 15 CO 0.00 0.00 0.00 0.43 -3.07 0.00 0.00 177.93 175.29 1cfa n SER 16 N -3.24 0.00 0.00 3.10 7.64 -1.26 -4.52 113.62 115.35 1cfa n SER 16 Ca 0.09 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.63 1cfa n SER 16 Cb 0.91 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.95 1cfa n SER 16 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1cfa n VAL 17 N -1.51 0.00 0.13 0.44 0.31 -1.11 -4.77 118.33 111.81 1cfa n VAL 17 Ca 0.00 0.00 0.17 0.00 -0.01 0.00 0.00 64.34 64.50 1cfa n VAL 17 Cb 0.00 -0.33 0.52 0.00 -0.91 0.00 0.00 33.84 33.12 1cfa n VAL 17 CO 0.00 0.00 0.00 1.62 -1.32 0.00 0.00 176.83 177.13 1cfa h VAL 18 N 0.00 0.10 0.00 2.52 3.04 -1.75 -0.99 116.25 119.17 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 0.12 0.34 0.00 0.00 -2.01 0.00 0.00 31.29 29.74 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 -3.12 0.00 0.17 4.17 4.81 0.25 -1.30 118.16 123.15 1cfa n LYS 19 Ca 0.08 0.00 0.12 0.00 -0.87 0.00 0.00 58.31 57.64 1cfa n LYS 19 Cb 0.88 -0.56 0.35 0.00 0.02 0.00 0.00 35.03 35.72 1cfa n LYS 19 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1cfa h LYS 20 N 0.00 0.00 0.30 1.64 3.64 -1.76 0.29 116.57 120.68 1cfa h LYS 20 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1cfa h LYS 20 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1cfa h LYS 20 CO 0.00 0.00 -0.15 0.00 -2.27 0.00 0.00 179.45 177.03 1cfa h TYR 23 N 0.74 0.27 -0.47 0.00 -1.99 -1.29 -1.29 116.97 112.94 1cfa h TYR 23 Ca 0.32 -0.01 0.05 0.00 2.00 0.00 0.00 58.73 61.08 1cfa h TYR 23 Cb 0.20 -0.08 -0.05 0.00 2.00 0.00 0.00 36.73 38.79 1cfa h TYR 23 CO -0.07 0.30 0.21 -0.44 -0.00 0.00 0.00 178.16 178.16 1cfa h ASP 24 N 0.27 0.26 0.23 3.88 3.32 0.59 1.79 116.42 126.76 1cfa h ASP 24 Ca 0.06 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1cfa h ASP 24 Cb 0.21 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1cfa h ASP 24 CO 0.01 0.19 -0.11 1.23 -1.72 0.00 0.00 179.24 178.83 1cfa h GLY 25 N 0.41 -0.33 -0.36 2.75 0.00 -0.08 -2.03 103.07 103.43 1cfa h GLY 25 Ca 0.22 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1cfa h GLY 25 CO -0.18 -0.12 0.00 0.00 0.00 0.00 0.00 176.54 176.24 1cfa n ALA 26 N -2.31 2.52 -0.11 3.60 0.00 -0.80 -4.11 120.51 119.30 1cfa n ALA 26 Ca -0.09 -0.32 -0.20 0.00 0.00 0.00 0.00 53.44 52.83 1cfa n ALA 26 Cb 0.19 -1.10 -0.07 0.00 0.00 0.00 0.00 19.45 18.48 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 -0.12 1.88 -3.37 0.00 7.64 0.61 -4.99 113.62 115.28 1cfa n SER 27 Ca 0.11 0.32 -0.29 0.00 1.01 0.00 0.00 58.87 60.02 1cfa n SER 27 Cb 0.18 -0.76 0.26 0.00 -1.01 0.00 0.00 64.21 62.88 1cfa n SER 27 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1cfa n VAL 28 N -4.29 0.00 -0.93 0.44 0.31 -0.80 -4.88 118.33 108.19 1cfa n VAL 28 Ca -0.36 -0.24 -0.33 0.00 -0.01 0.00 0.00 64.34 63.39 1cfa n VAL 28 Cb 0.72 -1.09 0.04 0.00 -0.91 0.00 0.00 33.84 32.59 1cfa n VAL 28 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1cfa n ASN 29 N -5.26 -5.42 -0.28 4.52 4.05 -1.26 -4.53 115.26 107.08 1cfa n ASN 29 Ca 0.14 0.19 0.32 0.00 0.45 0.00 0.00 54.58 55.68 1cfa n ASN 29 Cb 0.57 -0.70 0.56 0.00 1.23 0.00 0.00 39.78 41.44 1cfa n ASN 29 CO 0.00 0.00 0.00 0.78 -3.05 0.00 0.00 177.26 174.99 1cfa h ASN 30 N -0.86 0.00 0.00 1.20 -0.26 -1.90 -2.34 115.58 111.42 1cfa h ASN 30 Ca -0.40 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.34 1cfa h ASN 30 Cb 1.20 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.46 1cfa h ASN 30 CO 0.22 0.00 -0.10 -0.90 -1.06 0.00 0.00 177.43 175.59 1cfa n ASP 31 N -3.46 0.00 0.00 5.81 5.68 -1.26 -4.82 116.55 118.49 1cfa n ASP 31 Ca 0.26 -1.20 0.00 0.00 -0.50 0.00 0.00 54.79 53.35 1cfa n ASP 31 Cb 1.51 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 41.46 1cfa n ASP 31 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1cfa n GLU 32 N 0.00 0.00 0.04 0.11 2.13 -0.88 -2.64 120.64 119.41 1cfa n GLU 32 Ca 0.00 0.33 -0.20 0.00 0.66 0.00 0.00 57.16 57.95 1cfa n GLU 32 Cb 0.54 -1.15 -0.11 0.00 0.27 0.00 0.00 31.44 30.98 1cfa n GLU 32 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 1cfa h THR 33 N 0.00 1.33 -0.61 6.31 2.02 -1.86 -3.06 112.91 117.03 1cfa h THR 33 Ca 0.00 -2.27 0.24 0.00 0.77 0.00 0.00 66.41 65.16 1cfa h THR 33 Cb 0.00 2.55 -0.09 0.00 -1.74 0.00 0.00 68.15 68.87 1cfa h THR 33 CO 0.00 0.69 0.35 0.00 0.37 0.00 0.00 175.52 176.93 1cfa n GLU 35 N -4.14 0.46 -0.47 0.00 4.07 -1.08 -1.29 120.64 118.18 1cfa n GLU 35 Ca 0.22 0.41 0.42 0.00 -0.06 0.00 0.00 57.16 58.14 1cfa n GLU 35 Cb 0.76 -1.56 0.66 0.00 -0.06 0.00 0.00 31.44 31.24 1cfa n GLU 35 CO 0.00 0.00 0.00 0.37 -0.06 0.00 0.00 177.13 177.44 1cfa h GLN 36 N -0.96 0.00 0.00 5.31 5.75 -1.06 0.37 115.11 124.53 1cfa h GLN 36 Ca 0.00 0.00 -0.40 0.00 -0.15 0.00 0.00 58.65 58.10 1cfa h GLN 36 Cb 0.65 0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.13 1cfa h GLN 36 CO 0.00 0.00 -2.41 0.54 -2.65 0.00 0.00 178.83 174.31 1cfa n ARG 37 N -3.66 0.58 0.22 1.69 3.00 0.34 -3.98 116.66 114.85 1cfa n ARG 37 Ca 0.34 0.18 -0.13 0.00 -0.01 0.00 0.00 57.85 58.24 1cfa n ARG 37 Cb 1.75 -1.46 -0.07 0.00 0.00 0.00 0.00 32.46 32.68 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 -0.40 -0.60 -3.00 7.54 0.00 0.57 -3.41 119.26 119.96 1cfa h ALA 38 Ca -0.59 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1cfa h ALA 38 Cb 1.73 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.75 1cfa h ALA 38 CO -0.22 -0.64 0.00 0.00 0.00 0.00 0.00 179.25 178.39 1cfa n ALA 39 N -2.61 0.00 -1.51 0.00 0.00 0.10 -4.57 120.51 111.92 1cfa n ALA 39 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.01 1cfa n ALA 39 Cb 0.29 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.60 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 -0.15 0.23 -3.57 0.00 3.00 -1.17 -4.80 116.66 110.20 1cfa n ARG 40 Ca 0.00 -0.07 -0.29 0.00 -0.01 0.00 0.00 57.85 57.49 1cfa n ARG 40 Cb 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 32.46 30.44 1cfa n ARG 40 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1cfa s ILE 41 N 8.00 0.84 0.06 0.55 1.01 -1.26 -4.18 121.20 126.23 1cfa s ILE 41 Ca 1.25 -2.38 -0.30 0.00 0.00 0.00 0.00 60.65 59.22 1cfa s ILE 41 Cb -0.89 -1.59 -0.18 0.00 0.01 0.00 0.00 42.46 39.81 1cfa s ILE 41 CO 0.44 -1.00 1.56 -1.28 0.00 0.00 0.00 174.94 174.65 1cfa h SER 42 N 6.54 -0.59 0.00 3.58 0.87 -1.94 -3.36 113.55 118.65 1cfa h SER 42 Ca 0.08 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1cfa h SER 42 Cb 0.93 0.15 0.00 0.00 -0.44 0.00 0.00 62.40 63.04 1cfa h SER 42 CO 0.40 -0.37 0.00 0.00 -0.53 0.00 0.00 176.83 176.33 1cfa n LEU 43 N -5.36 0.59 -2.90 2.23 -0.00 -1.26 -5.08 117.00 105.22 1cfa n LEU 43 Ca -0.12 -0.66 -0.01 0.00 -0.00 0.00 0.00 56.01 55.22 1cfa n LEU 43 Cb 0.30 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.72 1cfa n LEU 43 CO 0.36 0.15 -0.48 0.61 -0.00 0.00 0.00 177.39 178.03 1cfa n GLY 44 N 0.14 -2.56 0.27 1.47 0.00 -1.26 -4.90 105.19 98.35 1cfa n GLY 44 Ca 0.00 0.43 -0.10 0.00 0.00 0.00 0.00 46.02 46.35 1cfa n GLY 44 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1cfa h PRO 45 N 3.56 -0.60 0.00 1.61 0.13 -1.97 -3.48 132.00 131.25 1cfa h PRO 45 Ca -0.07 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1cfa h PRO 45 Cb 0.50 0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.77 1cfa h PRO 45 CO 0.05 -0.40 0.00 -2.13 -0.23 0.00 0.00 178.00 175.28 1cfa n ARG 46 N -3.91 0.00 0.29 0.86 3.00 -1.26 -4.93 116.66 110.71 1cfa n ARG 46 Ca -0.08 0.00 0.16 0.00 -0.00 0.00 0.00 57.85 57.93 1cfa n ARG 46 Cb 0.26 0.00 0.91 0.00 0.00 0.00 0.00 32.46 33.63 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 1.00 0.64 0.00 -0.00 -1.92 0.30 117.51 117.53 1cfa h ILE 48 Ca -0.00 -0.76 -0.03 0.00 -0.00 0.00 0.00 64.86 64.07 1cfa h ILE 48 Cb 0.14 1.46 0.01 0.00 -0.00 0.00 0.00 36.82 38.42 1cfa h ILE 48 CO 0.01 0.18 -0.31 0.50 -0.00 0.00 0.00 178.15 178.52 1cfa h LYS 49 N -0.57 -0.83 0.21 0.16 3.64 -1.76 1.01 116.57 118.43 1cfa h LYS 49 Ca -0.02 0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1cfa h LYS 49 Cb 0.44 0.19 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 1cfa h LYS 49 CO 0.03 -0.53 -0.51 0.00 -2.27 0.00 0.00 179.45 176.18 1cfa h ALA 50 N -1.11 -0.99 0.00 5.00 0.00 -1.41 0.13 119.26 120.88 1cfa h ALA 50 Ca -0.09 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1cfa h ALA 50 Cb 0.68 0.83 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1cfa h ALA 50 CO 0.14 -1.12 0.00 1.97 0.00 0.00 0.00 179.25 180.25 1cfa n PHE 51 N -5.50 0.08 0.14 0.00 -1.74 0.10 -1.55 117.46 108.99 1cfa n PHE 51 Ca -0.09 0.03 -0.09 0.00 -0.56 0.00 0.00 57.45 56.74 1cfa n PHE 51 Cb 0.42 -0.55 -0.05 0.00 1.52 0.00 0.00 39.48 40.82 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 0.30 -0.26 1.97 2.02 0.38 0.48 112.91 117.81 1cfa h THR 52 Ca 0.00 -0.78 -0.09 0.00 0.77 0.00 0.00 66.41 66.32 1cfa h THR 52 Cb 0.25 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1cfa h THR 52 CO 0.00 0.08 -0.21 -0.33 0.37 0.00 0.00 175.52 175.42 1cfa h GLU 53 N -1.04 0.47 0.00 6.66 5.08 -1.33 -0.59 114.58 123.84 1cfa h GLU 53 Ca -0.04 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1cfa h GLU 53 Cb 0.45 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1cfa h GLU 53 CO 0.07 0.66 0.00 0.00 -1.00 0.00 0.00 179.01 178.74 1cfa h VAL 56 N 0.00 0.19 -0.92 0.00 -1.51 -1.19 0.23 116.25 113.05 1cfa h VAL 56 Ca 0.36 0.00 0.19 0.00 -1.23 0.00 0.00 66.70 66.03 1cfa h VAL 56 Cb 0.60 0.19 -0.07 0.00 -2.13 0.00 0.00 31.29 29.87 1cfa h VAL 56 CO -0.95 0.00 0.60 1.62 -1.23 0.00 0.00 177.57 177.61 1cfa h VAL 57 N -0.60 0.70 -0.30 7.19 3.04 -0.04 0.32 116.25 126.56 1cfa h VAL 57 Ca 0.03 -0.17 0.07 0.00 -1.01 0.00 0.00 66.70 65.62 1cfa h VAL 57 Cb 0.65 0.15 -0.07 0.00 -2.01 0.00 0.00 31.29 30.01 1cfa h VAL 57 CO -0.26 0.09 -0.14 0.00 -1.01 0.00 0.00 177.57 176.26 1cfa h ALA 58 N 1.61 0.11 0.02 3.17 0.00 0.73 0.18 119.26 125.08 1cfa h ALA 58 Ca 0.49 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.51 1cfa h ALA 58 Cb 1.08 0.33 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1cfa h ALA 58 CO -0.22 -0.53 -0.01 0.77 0.00 0.00 0.00 179.25 179.27 1cfa h SER 59 N -0.09 -0.02 -0.28 0.00 0.02 0.55 -0.12 113.55 113.61 1cfa h SER 59 Ca 0.16 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.13 1cfa h SER 59 Cb 0.32 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 62.83 1cfa h SER 59 CO -0.36 -0.01 -0.18 1.56 -1.14 0.00 0.00 176.83 176.71 1cfa h GLN 60 N -0.04 -0.02 -0.32 3.45 7.50 -0.84 0.72 115.11 125.56 1cfa h GLN 60 Ca -0.00 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.14 1cfa h GLN 60 Cb 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.54 1cfa h GLN 60 CO 0.00 -0.01 0.15 1.37 -1.50 0.00 0.00 178.83 178.84 1cfa h LEU 61 N -0.02 0.43 0.11 1.46 8.10 -0.80 -2.55 115.31 122.05 1cfa h LEU 61 Ca 0.04 -0.14 -0.01 0.00 0.11 0.00 0.00 57.88 57.89 1cfa h LEU 61 Cb 0.13 -0.11 0.00 0.00 -0.44 0.00 0.00 40.66 40.24 1cfa h LEU 61 CO -0.27 0.45 -0.05 0.03 -4.11 0.00 0.00 178.44 174.48 1cfa h ARG 62 N 0.38 -0.14 -1.50 0.17 2.47 -0.42 1.78 114.38 117.13 1cfa h ARG 62 Ca 0.11 0.01 0.45 0.00 -1.26 0.00 0.00 59.98 59.29 1cfa h ARG 62 Cb 0.14 0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.42 1cfa h ARG 62 CO -0.01 -0.10 1.06 0.00 0.56 0.00 0.00 179.97 181.48 1cfa n ALA 63 N -2.23 1.44 0.00 0.04 0.00 0.25 -3.59 120.51 116.42 1cfa n ALA 63 Ca -0.02 0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1cfa n ALA 63 Cb 0.06 -0.90 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1cfa n ALA 63 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1cfa n ASN 64 N -3.68 0.00 -4.52 0.00 5.15 -0.97 -5.05 115.26 106.19 1cfa n ASN 64 Ca 0.35 0.00 -0.26 0.00 -0.60 0.00 0.00 54.58 54.07 1cfa n ASN 64 Cb 1.55 0.00 -0.14 0.00 -0.53 0.00 0.00 39.78 40.66 1cfa n ASN 64 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1cfa n ILE 65 N 0.00 -0.01 0.00 -1.44 -5.35 0.61 -4.33 119.36 108.83 1cfa n ILE 65 Ca 0.00 -0.44 0.00 0.00 -0.27 0.00 0.00 62.75 62.04 1cfa n ILE 65 Cb 0.00 -1.09 0.00 0.00 -1.74 0.00 0.00 39.64 36.81 1cfa n ILE 65 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1cfa n SER 66 N 11.82 0.97 -2.14 7.28 3.41 -1.26 -5.03 113.62 128.67 1cfa n SER 66 Ca 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1cfa n SER 66 Cb 0.26 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1cfa n SER 66 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1cfa n HIS 67 N -2.08 -1.73 -2.08 7.33 8.25 -1.26 -5.03 115.22 118.61 1cfa n HIS 67 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.13 1cfa n HIS 67 Cb 0.17 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.29 1cfa n HIS 67 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1cfa s LYS 68 N -0.87 3.40 0.00 -0.41 1.02 -1.26 -5.01 119.74 116.61 1cfa s LYS 68 Ca 0.00 1.16 0.00 0.00 0.02 0.00 0.00 55.97 57.15 1cfa s LYS 68 Cb 0.00 -2.05 0.00 0.00 -0.52 0.00 0.00 37.83 35.26 1cfa s LYS 68 CO 0.00 -0.74 0.00 -0.40 -0.92 0.00 0.00 175.35 173.29 1cfa n ASP 69 N -2.01 0.00 0.00 2.83 5.68 -1.26 -4.89 116.55 116.90 1cfa n ASP 69 Ca 0.08 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.37 1cfa n ASP 69 Cb 0.53 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1cfa n ASP 69 CO 0.00 0.00 0.00 0.80 -1.33 0.00 0.00 177.20 176.67 1cfa n MET 70 N 0.00 0.00 0.00 0.11 1.56 -1.26 -5.05 117.12 112.48 1cfa n MET 70 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1cfa n MET 70 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 1cfa n MET 70 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24