#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 -0.49 0.15 4.03 0.05 -1.26 -5.13 118.68 116.04 1cfa s LEU 2 Ca 0.00 0.28 -0.31 0.00 0.05 0.00 0.00 54.13 54.15 1cfa s LEU 2 Cb 0.00 2.25 -0.10 0.00 -2.05 0.00 0.00 46.19 46.29 1cfa s LEU 2 CO 0.00 -0.63 1.56 -1.10 -0.55 0.00 0.00 176.35 175.63 1cfa s GLN 3 N -2.29 4.22 0.28 1.48 -0.21 -1.26 -5.00 119.66 116.89 1cfa s GLN 3 Ca -0.02 2.33 0.11 0.00 0.02 0.00 0.00 55.36 57.80 1cfa s GLN 3 Cb -0.01 -3.22 -0.05 0.00 1.00 0.00 0.00 33.01 30.74 1cfa s GLN 3 CO -0.02 -0.61 -0.10 0.15 -2.12 0.00 0.00 175.29 172.59 1cfa s LYS 4 N 1.34 1.96 0.00 2.91 1.02 -1.26 -5.11 119.74 120.60 1cfa s LYS 4 Ca 0.70 -1.64 0.00 0.00 0.02 0.00 0.00 55.97 55.06 1cfa s LYS 4 Cb -0.43 -1.94 0.00 0.00 -0.52 0.00 0.00 37.83 34.95 1cfa s LYS 4 CO 0.31 0.32 0.00 1.63 -0.92 0.00 0.00 175.35 176.69 1cfa n LYS 5 N -0.76 0.00 -0.01 1.68 4.76 -1.26 -4.77 118.16 117.80 1cfa n LYS 5 Ca -0.05 0.00 0.13 0.00 -2.87 0.00 0.00 58.31 55.52 1cfa n LYS 5 Cb 0.60 0.00 0.72 0.00 -1.84 0.00 0.00 35.03 34.51 1cfa n LYS 5 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1cfa n ILE 6 N 0.00 0.02 0.00 -0.18 2.08 -1.26 -3.72 119.36 116.30 1cfa n ILE 6 Ca 0.00 -0.07 0.00 0.00 0.56 0.00 0.00 62.75 63.24 1cfa n ILE 6 Cb 0.00 -0.22 0.00 0.00 -0.75 0.00 0.00 39.64 38.67 1cfa n ILE 6 CO 0.00 0.00 0.00 1.21 0.56 0.00 0.00 176.55 178.32 1cfa n GLU 7 N -0.65 0.00 0.23 0.38 2.13 -1.26 -0.82 120.64 120.64 1cfa n GLU 7 Ca 0.20 0.26 0.08 0.00 0.66 0.00 0.00 57.16 58.36 1cfa n GLU 7 Cb 0.15 -1.24 0.56 0.00 0.27 0.00 0.00 31.44 31.18 1cfa n GLU 7 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 1cfa h GLU 8 N 0.00 0.00 -0.76 5.31 4.11 -1.89 0.13 114.58 121.48 1cfa h GLU 8 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 59.36 59.54 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 0.21 0.50 0.82 0.07 0.00 0.00 179.01 180.61 1cfa h ILE 9 N 0.00 0.89 0.00 -1.06 1.08 -1.63 1.05 117.51 117.84 1cfa h ILE 9 Ca -0.00 -0.20 -0.17 0.00 -0.39 0.00 0.00 64.86 64.09 1cfa h ILE 9 Cb 0.46 0.24 -0.02 0.00 -3.07 0.00 0.00 36.82 34.42 1cfa h ILE 9 CO 0.03 0.11 -0.80 0.00 -0.69 0.00 0.00 178.15 176.79 1cfa h ALA 10 N 1.63 0.48 -0.38 1.87 0.00 0.12 -3.18 119.26 119.80 1cfa h ALA 10 Ca 0.36 -0.73 0.03 0.00 0.00 0.00 0.00 54.91 54.56 1cfa h ALA 10 Cb 0.59 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1cfa h ALA 10 CO -0.13 1.00 0.25 0.00 0.00 0.00 0.00 179.25 180.38 1cfa h ALA 11 N 1.20 1.84 0.00 0.00 0.00 0.31 -0.53 119.26 122.07 1cfa h ALA 11 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1cfa h ALA 11 Cb 1.62 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.29 1cfa h ALA 11 CO 0.10 0.12 0.00 1.63 0.00 0.00 0.00 179.25 181.10 1cfa n LYS 12 N -4.48 0.06 -2.19 0.00 4.01 -0.16 -4.51 118.16 110.89 1cfa n LYS 12 Ca 0.04 0.13 -0.31 0.00 -0.51 0.00 0.00 58.31 57.66 1cfa n LYS 12 Cb 0.14 -1.50 -0.04 0.00 -0.51 0.00 0.00 35.03 33.11 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 -2.91 2.01 0.00 2.13 1.51 -0.21 -4.73 117.35 115.15 1cfa s TYR 13 Ca 0.12 0.22 0.00 0.00 -1.01 0.00 0.00 57.07 56.40 1cfa s TYR 13 Cb 0.14 -4.23 0.00 0.00 -0.11 0.00 0.00 41.96 37.76 1cfa s TYR 13 CO 0.37 -1.80 0.00 1.63 -1.11 0.00 0.00 175.55 174.64 1cfa n LYS 14 N 8.86 0.00 0.16 -0.62 4.01 -1.26 0.80 118.16 130.11 1cfa n LYS 14 Ca 0.38 0.00 0.16 0.00 -0.51 0.00 0.00 58.31 58.34 1cfa n LYS 14 Cb 0.48 0.00 0.55 0.00 -0.51 0.00 0.00 35.03 35.55 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 0.35 0.00 0.00 2.13 2.07 -1.85 -0.90 115.15 116.95 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 -3.09 0.00 0.00 3.10 7.64 -1.26 -4.53 113.62 115.48 1cfa n SER 16 Ca 0.06 0.63 0.00 0.00 1.01 0.00 0.00 58.87 60.57 1cfa n SER 16 Cb 0.80 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.87 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 -1.41 0.00 0.10 0.44 0.31 -1.09 -4.78 118.33 111.90 1cfa n VAL 17 Ca 0.00 0.00 0.16 0.00 -0.01 0.00 0.00 64.34 64.49 1cfa n VAL 17 Cb 0.00 -0.49 0.43 0.00 -0.91 0.00 0.00 33.84 32.86 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 0.07 0.00 2.52 3.04 -1.75 -1.58 116.25 118.54 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 0.15 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 29.66 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 -3.04 0.00 -0.08 4.17 4.81 0.24 -1.23 118.16 123.02 1cfa n LYS 19 Ca 0.09 0.00 0.24 0.00 -0.87 0.00 0.00 58.31 57.77 1cfa n LYS 19 Cb 1.01 -0.54 0.49 0.00 0.02 0.00 0.00 35.03 36.01 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 0.48 1.64 1.57 -1.76 0.27 116.57 118.77 1cfa h LYS 20 Ca 0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 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 -0.23 0.00 -0.57 0.00 0.00 179.45 178.65 1cfa h TYR 23 N 0.70 0.58 -0.43 0.00 -1.99 -1.28 -0.06 116.97 114.48 1cfa h TYR 23 Ca 0.29 0.01 0.05 0.00 2.00 0.00 0.00 58.73 61.09 1cfa h TYR 23 Cb 0.16 -0.19 -0.05 0.00 2.00 0.00 0.00 36.73 38.65 1cfa h TYR 23 CO -0.07 0.35 0.17 -0.44 -0.00 0.00 0.00 178.16 178.16 1cfa h ASP 24 N 0.61 0.19 0.65 3.88 3.32 0.47 1.39 116.42 126.93 1cfa h ASP 24 Ca 0.20 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.26 1cfa h ASP 24 Cb 0.05 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.62 1cfa h ASP 24 CO -0.05 0.15 -0.37 1.23 -1.72 0.00 0.00 179.24 178.48 1cfa h GLY 25 N 0.34 -1.01 -0.12 2.75 0.00 0.51 -1.86 103.07 103.68 1cfa h GLY 25 Ca 0.20 0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.93 1cfa h GLY 25 CO -0.19 -0.36 0.00 0.00 0.00 0.00 0.00 176.54 175.99 1cfa n ALA 26 N -2.57 2.54 -0.12 3.60 0.00 -0.82 -4.10 120.51 119.04 1cfa n ALA 26 Ca -0.13 -0.25 -0.25 0.00 0.00 0.00 0.00 53.44 52.81 1cfa n ALA 26 Cb 0.40 -1.14 -0.08 0.00 0.00 0.00 0.00 19.45 18.63 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 -0.30 1.87 -3.06 0.00 7.64 0.47 -4.99 113.62 115.26 1cfa n SER 27 Ca 0.11 0.32 -0.14 0.00 1.01 0.00 0.00 58.87 60.17 1cfa n SER 27 Cb 0.14 -0.77 0.13 0.00 -1.01 0.00 0.00 64.21 62.70 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 -4.23 0.00 -0.94 0.44 0.31 -0.75 -4.90 118.33 108.25 1cfa n VAL 28 Ca -0.45 -0.09 -0.37 0.00 -0.01 0.00 0.00 64.34 63.42 1cfa n VAL 28 Cb 0.80 -0.73 0.06 0.00 -0.91 0.00 0.00 33.84 33.05 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 -4.13 -3.65 -0.35 4.52 4.05 -1.26 -4.55 115.26 109.89 1cfa n ASN 29 Ca 0.07 0.05 0.36 0.00 0.45 0.00 0.00 54.58 55.50 1cfa n ASN 29 Cb 0.28 -0.67 0.61 0.00 1.23 0.00 0.00 39.78 41.23 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 -1.18 0.00 0.00 1.20 4.21 -1.91 -2.67 115.58 115.23 1cfa h ASN 30 Ca -0.43 0.00 -0.04 0.00 1.21 0.00 0.00 56.30 57.04 1cfa h ASN 30 Cb 1.36 0.00 -0.05 0.00 -1.12 0.00 0.00 38.32 38.51 1cfa h ASN 30 CO 0.25 0.00 -0.15 -0.90 -1.29 0.00 0.00 177.43 175.33 1cfa n ASP 31 N -3.58 -0.23 0.00 5.81 5.68 -1.26 -4.91 116.55 118.07 1cfa n ASP 31 Ca 0.28 -1.38 0.00 0.00 -0.50 0.00 0.00 54.79 53.20 1cfa n ASP 31 Cb 1.57 0.05 0.00 0.00 -1.14 0.00 0.00 41.12 41.60 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 0.02 0.00 -0.18 0.11 2.13 -1.01 -1.80 120.64 119.91 1cfa n GLU 32 Ca -0.07 0.11 -0.09 0.00 0.66 0.00 0.00 57.16 57.77 1cfa n GLU 32 Cb 0.59 -0.71 0.01 0.00 0.27 0.00 0.00 31.44 31.60 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 1.26 -0.80 6.31 2.02 -1.86 -2.75 112.91 117.09 1cfa h THR 33 Ca 0.00 -0.99 0.29 0.00 0.77 0.00 0.00 66.41 66.48 1cfa h THR 33 Cb 0.00 0.89 -0.10 0.00 -1.74 0.00 0.00 68.15 67.21 1cfa h THR 33 CO 0.00 0.35 0.49 0.00 0.37 0.00 0.00 175.52 176.74 1cfa n GLU 35 N -4.08 0.00 -0.37 0.00 2.13 -0.74 -1.28 120.64 116.30 1cfa n GLU 35 Ca 0.25 0.25 0.36 0.00 0.66 0.00 0.00 57.16 58.68 1cfa n GLU 35 Cb 0.94 -0.75 0.57 0.00 0.27 0.00 0.00 31.44 32.47 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 -0.00 0.00 0.00 5.31 1.08 -1.34 0.40 115.11 120.56 1cfa h GLN 36 Ca 0.00 0.00 -0.40 0.00 -1.45 0.00 0.00 58.65 56.80 1cfa h GLN 36 Cb 0.00 0.00 -0.07 0.00 -0.05 0.00 0.00 27.48 27.36 1cfa h GLN 36 CO 0.00 0.00 -2.47 0.54 -0.95 0.00 0.00 178.83 175.95 1cfa n ARG 37 N -3.49 0.62 0.00 1.46 5.12 0.09 -2.93 116.66 117.52 1cfa n ARG 37 Ca 0.30 0.18 0.10 0.00 -1.93 0.00 0.00 57.85 56.49 1cfa n ARG 37 Cb 1.66 -1.50 0.57 0.00 -1.16 0.00 0.00 32.46 32.03 1cfa n ARG 37 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1cfa n ALA 38 N -3.52 2.39 0.04 7.54 0.00 0.45 -4.06 120.51 123.36 1cfa n ALA 38 Ca -0.47 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1cfa n ALA 38 Cb 0.95 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 19.09 1cfa n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1cfa n ALA 39 N -0.88 3.00 -2.39 0.00 0.00 0.11 -4.87 120.51 115.48 1cfa n ALA 39 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.21 1cfa n ALA 39 Cb 0.07 0.16 -0.02 0.00 0.00 0.00 0.00 19.45 19.65 1cfa n ALA 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1cfa s ARG 40 N -1.68 3.41 -0.65 0.00 3.52 -1.15 -4.86 118.95 117.55 1cfa s ARG 40 Ca 0.00 -1.60 -0.01 0.00 -0.13 0.00 0.00 55.73 53.99 1cfa s ARG 40 Cb 0.00 -5.41 0.16 0.00 -1.56 0.00 0.00 34.95 28.14 1cfa s ARG 40 CO 0.00 -2.88 0.46 0.42 -0.81 0.00 0.00 175.30 172.49 1cfa s ILE 41 N 6.77 3.52 0.10 4.11 1.01 -1.26 -4.70 121.20 130.75 1cfa s ILE 41 Ca 0.59 -3.27 -0.22 0.00 0.00 0.00 0.00 60.65 57.75 1cfa s ILE 41 Cb 0.02 -3.30 -0.12 0.00 0.01 0.00 0.00 42.46 39.07 1cfa s ILE 41 CO 0.08 -0.90 1.75 0.77 0.00 0.00 0.00 174.94 176.63 1cfa h SER 42 N 6.64 0.04 0.00 3.58 4.64 -1.95 -3.36 113.55 123.14 1cfa h SER 42 Ca 0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1cfa h SER 42 Cb 0.90 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1cfa h SER 42 CO 0.73 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 176.72 1cfa n LEU 43 N -5.07 0.05 -2.73 5.97 -0.00 -1.26 -5.06 117.00 108.90 1cfa n LEU 43 Ca -0.06 -0.05 -0.07 0.00 -0.00 0.00 0.00 56.01 55.84 1cfa n LEU 43 Cb 0.04 0.00 0.01 0.00 -0.00 0.00 0.00 43.42 43.47 1cfa n LEU 43 CO 0.32 0.01 0.07 0.61 -0.00 0.00 0.00 177.39 178.40 1cfa n GLY 44 N -0.01 -1.25 0.43 1.47 0.00 -1.26 -4.91 105.19 99.66 1cfa n GLY 44 Ca 0.00 1.07 -0.15 0.00 0.00 0.00 0.00 46.02 46.95 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 1.69 -0.64 0.00 1.61 0.10 -1.97 -3.47 132.00 129.32 1cfa h PRO 45 Ca 0.00 0.04 0.00 0.00 0.10 0.00 0.00 66.00 66.14 1cfa h PRO 45 Cb 0.91 0.15 0.00 0.00 0.10 0.00 0.00 31.00 32.15 1cfa h PRO 45 CO 0.19 -0.43 0.00 -2.13 0.10 0.00 0.00 178.00 175.73 1cfa n ARG 46 N -5.15 0.00 0.24 1.05 3.00 -1.26 -4.95 116.66 109.59 1cfa n ARG 46 Ca -0.07 0.00 0.08 0.00 -0.00 0.00 0.00 57.85 57.85 1cfa n ARG 46 Cb 0.37 0.00 0.61 0.00 0.00 0.00 0.00 32.46 33.43 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 0.48 0.80 0.00 -0.00 -1.92 0.44 117.51 117.31 1cfa h ILE 48 Ca -0.00 -0.48 -0.04 0.00 -0.00 0.00 0.00 64.86 64.34 1cfa h ILE 48 Cb 0.24 0.67 0.01 0.00 -0.00 0.00 0.00 36.82 37.74 1cfa h ILE 48 CO 0.02 0.07 -0.39 0.50 -0.00 0.00 0.00 178.15 178.35 1cfa h LYS 49 N -0.90 -1.04 0.11 0.16 3.64 -1.85 1.01 116.57 117.70 1cfa h LYS 49 Ca -0.06 0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1cfa h LYS 49 Cb 0.56 0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 1cfa h LYS 49 CO 0.10 -0.69 -0.39 0.00 -2.27 0.00 0.00 179.45 176.19 1cfa h ALA 50 N -1.50 -0.90 0.00 5.00 0.00 -1.39 -0.17 119.26 120.30 1cfa h ALA 50 Ca -0.11 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1cfa h ALA 50 Cb 0.83 0.78 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1cfa h ALA 50 CO 0.18 -0.99 0.00 1.97 0.00 0.00 0.00 179.25 180.41 1cfa n PHE 51 N -4.69 0.00 0.03 0.00 -1.74 0.15 -1.39 117.46 109.82 1cfa n PHE 51 Ca -0.06 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 56.62 1cfa n PHE 51 Cb 0.31 -0.32 -0.14 0.00 1.52 0.00 0.00 39.48 40.85 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 1.37 0.00 1.97 2.02 0.29 0.25 112.91 118.81 1cfa h THR 52 Ca 0.00 -2.48 -0.15 0.00 0.77 0.00 0.00 66.41 64.55 1cfa h THR 52 Cb 0.14 3.05 -0.02 0.00 -1.74 0.00 0.00 68.15 69.57 1cfa h THR 52 CO 0.00 0.70 -0.69 -0.08 0.37 0.00 0.00 175.52 175.81 1cfa h GLU 53 N -0.40 0.00 0.07 6.66 4.81 -1.14 -0.95 114.58 123.63 1cfa h GLU 53 Ca -0.19 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.79 1cfa h GLU 53 Cb 1.64 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.02 1cfa h GLU 53 CO 0.11 0.69 -1.09 0.00 -0.73 0.00 0.00 179.01 177.99 1cfa h VAL 56 N -0.16 1.08 0.04 0.00 -1.51 -1.26 -1.63 116.25 112.82 1cfa h VAL 56 Ca -0.09 -0.24 0.01 0.00 -1.23 0.00 0.00 66.70 65.15 1cfa h VAL 56 Cb 1.38 1.11 -0.01 0.00 -2.13 0.00 0.00 31.29 31.64 1cfa h VAL 56 CO 0.12 0.07 -0.06 1.62 -1.23 0.00 0.00 177.57 178.10 1cfa h VAL 57 N 0.03 0.86 -0.43 7.19 3.04 -1.34 0.84 116.25 126.43 1cfa h VAL 57 Ca 0.03 0.00 0.08 0.00 -1.01 0.00 0.00 66.70 65.79 1cfa h VAL 57 Cb 0.08 0.86 -0.09 0.00 -2.01 0.00 0.00 31.29 30.13 1cfa h VAL 57 CO -0.00 0.00 -0.40 0.00 -1.01 0.00 0.00 177.57 176.15 1cfa h ALA 58 N 0.84 -0.35 0.21 3.17 0.00 -1.02 -1.82 119.26 120.29 1cfa h ALA 58 Ca 0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1cfa h ALA 58 Cb 0.13 0.86 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1cfa h ALA 58 CO -0.03 -0.82 -0.10 0.77 0.00 0.00 0.00 179.25 179.07 1cfa h SER 59 N -0.29 -0.23 -0.45 0.00 0.02 -1.09 -0.69 113.55 110.82 1cfa h SER 59 Ca 0.15 0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.18 1cfa h SER 59 Cb 0.57 0.06 -0.07 0.00 0.14 0.00 0.00 62.40 63.10 1cfa h SER 59 CO -0.59 -0.14 -0.18 0.00 -1.14 0.00 0.00 176.83 174.79 1cfa n GLN 60 N -2.92 -0.11 -0.05 3.45 6.02 0.27 0.54 117.38 124.58 1cfa n GLN 60 Ca -0.03 0.69 -0.14 0.00 -0.01 0.00 0.00 57.00 57.51 1cfa n GLN 60 Cb 0.11 -1.03 -0.12 0.00 1.02 0.00 0.00 30.24 30.22 1cfa n GLN 60 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1cfa h LEU 61 N 0.00 -0.00 -0.97 1.08 3.38 -1.39 -3.22 115.31 114.20 1cfa h LEU 61 Ca 0.15 -0.84 0.35 0.00 0.09 0.00 0.00 57.88 57.63 1cfa h LEU 61 Cb 0.26 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.90 1cfa h LEU 61 CO -0.45 0.85 0.60 0.54 0.09 0.00 0.00 178.44 180.07 1cfa n ARG 62 N -4.68 -0.03 0.37 1.13 5.12 0.19 0.33 116.66 119.09 1cfa n ARG 62 Ca -0.10 0.96 -0.17 0.00 -1.93 0.00 0.00 57.85 56.62 1cfa n ARG 62 Cb 0.41 -1.85 -0.08 0.00 -1.16 0.00 0.00 32.46 29.78 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 1.26 -0.95 -2.05 7.54 0.00 -1.25 -3.37 119.26 120.44 1cfa h ALA 63 Ca 0.65 -0.22 -0.52 0.00 0.00 0.00 0.00 54.91 54.82 1cfa h ALA 63 Cb 2.02 0.37 -0.40 0.00 0.00 0.00 0.00 17.79 19.78 1cfa h ALA 63 CO -0.40 -0.96 -1.07 0.09 0.00 0.00 0.00 179.25 176.90 1cfa n ASN 64 N -5.45 1.39 -4.55 0.00 4.13 0.83 -5.06 115.26 106.55 1cfa n ASN 64 Ca -0.13 -3.07 -0.30 0.00 1.68 0.00 0.00 54.58 52.76 1cfa n ASN 64 Cb 0.39 -0.62 -0.06 0.00 -1.54 0.00 0.00 39.78 37.96 1cfa n ASN 64 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1cfa n ILE 65 N 0.44 -0.06 0.13 2.41 5.41 1.01 -3.90 119.36 124.80 1cfa n ILE 65 Ca 0.25 -0.65 0.00 0.00 1.00 0.00 0.00 62.75 63.35 1cfa n ILE 65 Cb 0.58 -2.31 0.00 0.00 -0.71 0.00 0.00 39.64 37.21 1cfa n ILE 65 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1cfa n SER 66 N 15.90 -2.33 -0.12 4.38 3.41 -1.26 -4.99 113.62 128.62 1cfa n SER 66 Ca 0.43 0.63 -0.07 0.00 -0.26 0.00 0.00 58.87 59.60 1cfa n SER 66 Cb 0.46 2.35 -0.06 0.00 -0.26 0.00 0.00 64.21 66.70 1cfa n SER 66 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1cfa h HIS 67 N 0.00 -0.99 -0.29 7.33 3.86 -1.99 -3.46 115.15 119.61 1cfa h HIS 67 Ca 0.00 0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1cfa h HIS 67 Cb 0.00 0.47 0.00 0.00 1.06 0.00 0.00 27.41 28.94 1cfa h HIS 67 CO 0.00 -0.26 0.00 1.17 0.86 0.00 0.00 177.93 179.70 1cfa n LYS 68 N -4.22 0.00 -3.49 2.45 4.81 -1.26 -5.16 118.16 111.29 1cfa n LYS 68 Ca -0.01 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.42 1cfa n LYS 68 Cb 0.18 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.19 1cfa n LYS 68 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 1cfa s ASP 69 N 1.99 -1.05 0.00 3.14 -4.77 -1.26 -4.91 116.67 109.82 1cfa s ASP 69 Ca 0.00 1.23 0.00 0.00 -3.30 0.00 0.00 52.55 50.48 1cfa s ASP 69 Cb 0.00 2.10 0.00 0.00 -1.09 0.00 0.00 42.92 43.93 1cfa s ASP 69 CO 0.00 -0.24 0.00 0.80 0.70 0.00 0.00 175.17 176.43 1cfa n MET 70 N 5.43 2.66 0.00 2.11 1.56 -1.26 -5.14 117.12 122.48 1cfa n MET 70 Ca -0.08 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.35 1cfa n MET 70 Cb 0.50 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.87 1cfa n MET 70 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24