#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfn n SER 4 N 0.00 -7.98 -2.88 7.83 7.64 -1.26 -4.93 113.62 112.04 1pfn n SER 4 Ca 0.00 1.16 -0.09 0.00 1.01 0.00 0.00 58.87 60.96 1pfn n SER 4 Cb 0.00 -4.70 0.01 0.00 -1.01 0.00 0.00 64.21 58.51 1pfn n SER 4 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1pfn n ALA 5 N -3.70 -3.04 -3.06 -0.43 0.00 -1.26 -5.05 120.51 103.97 1pfn n ALA 5 Ca -0.06 0.98 -0.11 0.00 0.00 0.00 0.00 53.44 54.24 1pfn n ALA 5 Cb 0.67 -3.11 -0.04 0.00 0.00 0.00 0.00 19.45 16.97 1pfn n ALA 5 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1pfn s LYS 6 N -2.38 1.72 1.04 0.00 2.20 -1.26 -5.06 119.74 116.00 1pfn s LYS 6 Ca 0.21 -1.48 -0.14 0.00 -0.36 0.00 0.00 55.97 54.20 1pfn s LYS 6 Cb -0.05 0.46 0.12 0.00 -1.51 0.00 0.00 37.83 36.85 1pfn s LYS 6 CO 0.77 -0.72 0.48 -1.91 -0.36 0.00 0.00 175.35 173.62 1pfn n GLU 7 N -0.45 -1.14 0.00 4.03 2.13 -1.26 -4.80 120.64 119.15 1pfn n GLU 7 Ca -0.01 -0.30 0.00 0.00 0.66 0.00 0.00 57.16 57.51 1pfn n GLU 7 Cb 0.62 -1.93 0.00 0.00 0.27 0.00 0.00 31.44 30.40 1pfn n GLU 7 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1pfn n LEU 8 N -2.49 0.00 -1.88 4.31 0.00 -1.26 -5.02 117.00 110.66 1pfn n LEU 8 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 56.01 56.05 1pfn n LEU 8 Cb 0.56 0.00 -0.01 0.00 0.00 0.00 0.00 43.42 43.98 1pfn n LEU 8 CO 0.52 0.00 0.38 -1.14 0.00 0.00 0.00 177.39 177.15 1pfn n ARG 9 N 0.00 0.05 -2.20 1.96 3.00 -1.13 -5.01 116.66 113.31 1pfn n ARG 9 Ca 0.00 -0.20 -0.32 0.00 -0.00 0.00 0.00 57.85 57.33 1pfn n ARG 9 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 32.46 32.45 1pfn n ARG 9 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1pfn n GLN 11 N -1.99 0.21 -3.39 0.00 1.13 -1.26 -4.37 117.38 107.71 1pfn n GLN 11 Ca 0.06 0.32 -0.21 0.00 -1.94 0.00 0.00 57.00 55.23 1pfn n GLN 11 Cb 0.54 -1.82 -0.09 0.00 0.11 0.00 0.00 30.24 28.98 1pfn n GLN 11 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1pfn h VAL 13 N 5.00 1.14 -2.21 0.00 3.04 -2.00 -3.43 116.25 117.79 1pfn h VAL 13 Ca 0.07 -0.27 -0.57 0.00 -1.01 0.00 0.00 66.70 64.92 1pfn h VAL 13 Cb 1.02 0.29 -0.14 0.00 -2.01 0.00 0.00 31.29 30.46 1pfn h VAL 13 CO 0.22 0.14 -0.66 -0.54 -1.01 0.00 0.00 177.57 175.72 1pfn s LYS 14 N -5.67 1.73 0.02 4.17 1.02 -1.26 -5.11 119.74 114.64 1pfn s LYS 14 Ca -0.10 -1.91 -0.25 0.00 0.02 0.00 0.00 55.97 53.73 1pfn s LYS 14 Cb 0.18 -1.44 -0.05 0.00 -0.52 0.00 0.00 37.83 35.99 1pfn s LYS 14 CO 0.76 0.05 0.78 0.99 -0.92 0.00 0.00 175.35 177.02 1pfn s THR 15 N -2.81 4.79 -0.83 2.17 2.01 -1.26 -4.95 115.64 114.76 1pfn s THR 15 Ca 0.32 1.66 -0.04 0.00 0.31 0.00 0.00 61.69 63.94 1pfn s THR 15 Cb 0.04 -4.13 0.10 0.00 0.01 0.00 0.00 72.50 68.52 1pfn s THR 15 CO 0.15 0.32 2.56 0.41 -0.69 0.00 0.00 174.62 177.37 1pfn n THR 16 N 3.10 4.20 0.76 -0.82 -1.04 0.02 -4.59 114.28 115.91 1pfn n THR 16 Ca -0.01 -3.67 0.09 0.00 -2.04 0.00 0.00 64.05 58.42 1pfn n THR 16 Cb 0.50 -1.77 0.43 0.00 -1.82 0.00 0.00 70.33 67.68 1pfn n THR 16 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1pfn n SER 17 N 1.13 0.00 0.21 8.00 7.64 -1.25 -3.21 113.62 126.14 1pfn n SER 17 Ca 0.54 0.29 0.18 0.00 1.01 0.00 0.00 58.87 60.89 1pfn n SER 17 Cb 0.41 -0.41 0.80 0.00 -1.01 0.00 0.00 64.21 64.00 1pfn n SER 17 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1pfn h GLN 18 N 0.00 0.00 -6.58 1.43 4.20 -1.91 -3.40 115.11 108.86 1pfn h GLN 18 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 1pfn h GLN 18 Cb 0.26 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1pfn h GLN 18 CO 0.00 0.00 0.09 0.08 -0.67 0.00 0.00 178.83 178.33 1pfn s VAL 19 N -4.39 4.62 -0.09 -0.54 1.01 -1.20 -5.06 120.40 114.74 1pfn s VAL 19 Ca -0.04 1.17 -0.09 0.00 0.00 0.00 0.00 61.98 63.03 1pfn s VAL 19 Cb 0.13 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 1pfn s VAL 19 CO 0.43 0.13 0.20 -0.13 0.00 0.00 0.00 175.10 175.73 1pfn s ARG 20 N -2.17 3.54 -0.11 2.72 0.52 -1.26 -5.06 118.95 117.12 1pfn s ARG 20 Ca 0.45 -0.02 -0.30 0.00 -0.52 0.00 0.00 55.73 55.34 1pfn s ARG 20 Cb -0.15 -3.20 -0.01 0.00 0.52 0.00 0.00 34.95 32.11 1pfn s ARG 20 CO 0.20 0.76 1.03 -1.25 0.02 0.00 0.00 175.30 176.06 1pfn s PRO 21 N -1.04 4.40 0.00 3.54 0.04 -1.26 -4.68 135.00 136.00 1pfn s PRO 21 Ca 0.17 1.42 0.00 0.00 0.04 0.00 0.00 61.00 62.63 1pfn s PRO 21 Cb -0.13 -3.55 0.00 0.00 0.04 0.00 0.00 34.50 30.86 1pfn s PRO 21 CO 0.06 -0.36 0.00 -2.13 0.04 0.00 0.00 177.00 174.61 1pfn n ARG 22 N 5.16 0.00 -1.49 4.56 0.63 -1.26 -4.96 116.66 119.30 1pfn n ARG 22 Ca 0.09 0.00 -0.27 0.00 -0.92 0.00 0.00 57.85 56.75 1pfn n ARG 22 Cb 0.48 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.34 1pfn n ARG 22 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 1pfn n HIS 23 N -1.24 1.64 -2.09 -0.14 1.44 -1.26 -4.94 115.22 108.62 1pfn n HIS 23 Ca 0.00 -1.96 -0.28 0.00 -2.01 0.00 0.00 57.72 53.47 1pfn n HIS 23 Cb 0.00 -1.36 0.16 0.00 0.12 0.00 0.00 29.99 28.91 1pfn n HIS 23 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 1pfn s ILE 24 N -2.34 2.04 0.00 0.61 2.07 -1.26 -2.19 121.20 120.13 1pfn s ILE 24 Ca 0.58 -0.15 0.00 0.00 -1.41 0.00 0.00 60.65 59.67 1pfn s ILE 24 Cb 0.38 -2.89 0.00 0.00 0.13 0.00 0.00 42.46 40.08 1pfn s ILE 24 CO -0.22 0.00 0.00 0.35 -1.91 0.00 0.00 174.94 173.16 1pfn n THR 25 N -3.52 0.00 -3.51 4.00 -2.24 -0.88 -4.55 114.28 103.59 1pfn n THR 25 Ca 0.15 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.82 1pfn n THR 25 Cb 0.60 -0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 68.01 1pfn n THR 25 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1pfn s SER 26 N -5.00 -0.44 -0.08 3.42 0.01 -1.16 -5.04 113.70 105.41 1pfn s SER 26 Ca 0.00 0.20 -0.10 0.00 1.31 0.00 0.00 55.95 57.36 1pfn s SER 26 Cb 0.00 0.42 0.02 0.00 0.21 0.00 0.00 66.02 66.67 1pfn s SER 26 CO 0.00 -0.60 0.26 -1.48 0.41 0.00 0.00 173.24 171.83 1pfn s LEU 27 N -2.01 1.01 0.54 2.44 0.05 -1.26 0.70 118.68 120.15 1pfn s LEU 27 Ca 0.00 0.41 -0.00 0.00 0.05 0.00 0.00 54.13 54.59 1pfn s LEU 27 Cb -0.01 0.95 0.03 0.00 -2.05 0.00 0.00 46.19 45.11 1pfn s LEU 27 CO -0.04 -0.17 0.78 -1.61 -0.55 0.00 0.00 176.35 174.76 1pfn s GLU 28 N -0.21 2.67 -0.28 1.48 2.02 0.11 -4.92 118.70 119.57 1pfn s GLU 28 Ca -0.03 -0.60 0.01 0.00 0.02 0.00 0.00 54.97 54.36 1pfn s GLU 28 Cb -0.03 -2.46 0.16 0.00 0.10 0.00 0.00 34.13 31.90 1pfn s GLU 28 CO 0.01 -0.65 0.45 0.08 0.02 0.00 0.00 175.26 175.17 1pfn s VAL 29 N -2.77 -0.72 0.08 2.63 1.01 -1.26 -1.63 120.40 117.74 1pfn s VAL 29 Ca 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 61.98 62.36 1pfn s VAL 29 Cb -0.10 -0.95 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 1pfn s VAL 29 CO 0.39 -0.18 0.24 0.27 0.00 0.00 0.00 175.10 175.83 1pfn s ILE 30 N 2.62 5.35 0.64 2.22 -4.36 0.52 -4.94 121.20 123.25 1pfn s ILE 30 Ca 0.12 -0.35 -0.11 0.00 -0.26 0.00 0.00 60.65 60.05 1pfn s ILE 30 Cb -0.13 -3.64 0.15 0.00 1.25 0.00 0.00 42.46 40.09 1pfn s ILE 30 CO -0.25 0.10 0.87 1.17 0.24 0.00 0.00 174.94 177.07 1pfn n LYS 31 N 0.19 -0.85 -2.48 0.37 4.81 -1.26 -2.02 118.16 116.92 1pfn n LYS 31 Ca -0.05 -1.34 -0.39 0.00 -0.87 0.00 0.00 58.31 55.66 1pfn n LYS 31 Cb 0.51 -0.89 -0.03 0.00 0.02 0.00 0.00 35.03 34.64 1pfn n LYS 31 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1pfn s ALA 32 N -3.98 2.59 1.00 3.14 0.00 -1.25 -4.25 121.76 119.01 1pfn s ALA 32 Ca 0.49 -1.92 0.00 0.00 0.00 0.00 0.00 51.96 50.53 1pfn s ALA 32 Cb -0.01 -4.46 0.00 0.00 0.00 0.00 0.00 23.12 18.64 1pfn s ALA 32 CO 0.34 -3.69 0.00 0.41 0.00 0.00 0.00 175.76 172.83 1pfn n GLY 33 N 6.51 -0.32 0.00 0.00 0.00 0.45 -4.58 105.19 107.25 1pfn n GLY 33 Ca 0.27 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1pfn n GLY 33 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pfn n PRO 34 N 0.00 0.00 0.22 1.61 -0.04 -1.26 -2.32 135.00 133.21 1pfn n PRO 34 Ca 0.00 0.49 0.18 0.00 -0.04 0.00 0.00 63.50 64.13 1pfn n PRO 34 Cb 0.00 -1.03 0.85 0.00 -0.04 0.00 0.00 33.50 33.28 1pfn n PRO 34 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1pfn h HIS 35 N 0.00 0.00 -2.83 0.54 2.07 -1.95 -3.01 115.15 109.97 1pfn h HIS 35 Ca 0.00 0.00 -0.61 0.00 -2.85 0.00 0.00 60.37 56.91 1pfn h HIS 35 Cb 0.00 0.00 -0.41 0.00 2.57 0.00 0.00 27.41 29.57 1pfn h HIS 35 CO 0.02 0.00 -0.64 0.00 -3.07 0.00 0.00 177.93 174.24 1pfn n PRO 37 N 1.86 0.09 -3.38 0.00 -0.04 -0.98 0.17 135.00 132.73 1pfn n PRO 37 Ca 0.23 0.32 -0.29 0.00 -0.04 0.00 0.00 63.50 63.72 1pfn n PRO 37 Cb 0.38 -1.66 -0.03 0.00 -0.04 0.00 0.00 33.50 32.15 1pfn n PRO 37 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1pfn s THR 38 N -3.13 5.04 0.18 0.52 -1.32 -1.26 -4.63 115.64 111.03 1pfn s THR 38 Ca 0.06 0.03 -0.31 0.00 -1.21 0.00 0.00 61.69 60.27 1pfn s THR 38 Cb 0.10 -3.73 -0.09 0.00 -1.51 0.00 0.00 72.50 67.26 1pfn s THR 38 CO 0.33 -0.30 1.46 0.00 -2.21 0.00 0.00 174.62 173.90 1pfn s ALA 39 N -2.05 3.66 0.10 11.08 0.00 -1.26 -3.77 121.76 129.52 1pfn s ALA 39 Ca 0.44 1.27 0.04 0.00 0.00 0.00 0.00 51.96 53.70 1pfn s ALA 39 Cb -0.11 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.41 1pfn s ALA 39 CO 0.29 -0.70 -0.10 -1.14 0.00 0.00 0.00 175.76 174.11 1pfn s GLN 40 N 0.49 0.87 -0.23 0.00 0.74 -0.86 -4.73 119.66 115.95 1pfn s GLN 40 Ca 0.64 -1.18 -0.20 0.00 0.05 0.00 0.00 55.36 54.67 1pfn s GLN 40 Cb -0.41 -0.57 0.06 0.00 1.10 0.00 0.00 33.01 33.19 1pfn s GLN 40 CO 0.36 0.09 0.61 -0.48 -0.55 0.00 0.00 175.29 175.32 1pfn s LEU 41 N -2.47 -0.42 0.40 3.68 2.34 -1.26 -0.36 118.68 120.59 1pfn s LEU 41 Ca 0.06 1.26 0.08 0.00 0.06 0.00 0.00 54.13 55.59 1pfn s LEU 41 Cb -0.03 2.11 -0.04 0.00 -0.56 0.00 0.00 46.19 47.67 1pfn s LEU 41 CO 0.00 -0.22 0.26 -0.63 -1.06 0.00 0.00 176.35 174.71 1pfn s ILE 42 N 0.57 2.60 0.33 1.48 -1.09 -0.64 -2.57 121.20 121.88 1pfn s ILE 42 Ca -0.02 -1.53 0.06 0.00 -2.23 0.00 0.00 60.65 56.93 1pfn s ILE 42 Cb -0.05 -3.01 -0.03 0.00 -1.58 0.00 0.00 42.46 37.80 1pfn s ILE 42 CO -0.03 -0.03 0.30 0.00 -1.23 0.00 0.00 174.94 173.95 1pfn s ALA 43 N -2.51 1.76 -0.09 9.38 0.00 -0.95 0.09 121.76 129.45 1pfn s ALA 43 Ca 0.44 -2.03 -0.07 0.00 0.00 0.00 0.00 51.96 50.29 1pfn s ALA 43 Cb -0.00 1.45 0.03 0.00 0.00 0.00 0.00 23.12 24.59 1pfn s ALA 43 CO 0.25 -0.68 0.23 0.99 0.00 0.00 0.00 175.76 176.55 1pfn s THR 44 N -3.39 -0.01 0.00 0.00 2.01 0.22 -3.08 115.64 111.40 1pfn s THR 44 Ca 0.40 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.43 1pfn s THR 44 Cb 0.02 -0.33 0.00 0.00 0.01 0.00 0.00 72.50 72.20 1pfn s THR 44 CO 0.27 0.01 0.00 0.18 -0.69 0.00 0.00 174.62 174.39 1pfn n LEU 45 N 3.19 0.00 -0.05 4.42 7.99 -1.06 -2.06 117.00 129.43 1pfn n LEU 45 Ca -0.15 0.00 -0.15 0.00 -0.01 0.00 0.00 56.01 55.70 1pfn n LEU 45 Cb 0.57 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 43.82 1pfn n LEU 45 CO 0.18 -0.35 0.42 0.11 -1.51 0.00 0.00 177.39 176.24 1pfn h LYS 46 N 0.00 0.63 -6.09 3.23 1.79 -1.68 -3.30 116.57 111.15 1pfn h LYS 46 Ca 0.00 -0.45 -0.58 0.00 -2.18 0.00 0.00 60.65 57.45 1pfn h LYS 46 Cb 0.00 0.07 -0.10 0.00 -1.58 0.00 0.00 32.23 30.62 1pfn h LYS 46 CO 0.00 1.06 1.44 -0.80 -1.08 0.00 0.00 179.45 180.07 1pfn s ASN 47 N -6.71 6.40 -0.06 0.86 0.01 -1.26 -4.79 114.94 109.39 1pfn s ASN 47 Ca -0.12 -1.36 -0.01 0.00 -0.71 0.00 0.00 52.86 50.66 1pfn s ASN 47 Cb 0.07 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 39.14 1pfn s ASN 47 CO 0.84 -1.60 0.65 0.61 -1.51 0.00 0.00 177.10 176.09 1pfn n GLY 48 N 6.83 -0.03 3.35 0.66 0.00 -1.24 -4.76 105.19 110.00 1pfn n GLY 48 Ca 0.32 -0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.14 1pfn n GLY 48 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1pfn s ARG 49 N 3.04 1.74 -0.12 1.61 1.70 -1.26 -4.96 118.95 120.70 1pfn s ARG 49 Ca 0.08 -2.02 -0.05 0.00 -0.47 0.00 0.00 55.73 53.27 1pfn s ARG 49 Cb -0.05 -0.01 0.06 0.00 -0.57 0.00 0.00 34.95 34.38 1pfn s ARG 49 CO 0.03 -0.55 0.26 0.15 -1.08 0.00 0.00 175.30 174.11 1pfn s LYS 50 N -3.64 0.18 0.00 3.89 3.01 -1.26 -2.55 119.74 119.37 1pfn s LYS 50 Ca 0.35 0.66 0.00 0.00 -1.01 0.00 0.00 55.97 55.97 1pfn s LYS 50 Cb 0.03 -0.07 0.00 0.00 -1.01 0.00 0.00 37.83 36.78 1pfn s LYS 50 CO 0.21 -0.23 0.00 0.44 0.51 0.00 0.00 175.35 176.28 1pfn n ILE 51 N 4.86 0.00 -3.63 2.17 -6.64 -1.18 -4.85 119.36 110.08 1pfn n ILE 51 Ca -0.15 0.00 -0.03 0.00 -1.77 0.00 0.00 62.75 60.80 1pfn n ILE 51 Cb 0.51 0.00 -0.04 0.00 -1.44 0.00 0.00 39.64 38.67 1pfn n ILE 51 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1pfn n LEU 53 N 0.42 0.00 -4.88 0.00 4.77 -1.06 -0.80 117.00 115.45 1pfn n LEU 53 Ca -0.01 -2.41 -0.26 0.00 -0.03 0.00 0.00 56.01 53.31 1pfn n LEU 53 Cb 0.58 0.92 -0.04 0.00 -2.33 0.00 0.00 43.42 42.55 1pfn n LEU 53 CO 0.08 -0.38 -0.15 1.51 -1.33 0.00 0.00 177.39 177.13 1pfn s ASP 54 N -2.89 5.98 -0.03 -1.43 1.47 -1.26 -4.13 116.67 114.38 1pfn s ASP 54 Ca 0.20 0.03 0.21 0.00 1.18 0.00 0.00 52.55 54.17 1pfn s ASP 54 Cb 0.01 -1.70 -0.27 0.00 -0.34 0.00 0.00 42.92 40.62 1pfn s ASP 54 CO 0.14 0.05 0.49 -0.11 0.68 0.00 0.00 175.17 176.42 1pfn n LEU 55 N -0.50 0.17 -2.32 2.11 0.00 -1.26 -4.36 117.00 110.84 1pfn n LEU 55 Ca -0.08 0.07 -0.23 0.00 0.00 0.00 0.00 56.01 55.78 1pfn n LEU 55 Cb 0.54 0.10 -0.06 0.00 0.00 0.00 0.00 43.42 44.00 1pfn n LEU 55 CO 0.46 0.09 1.54 1.67 0.00 0.00 0.00 177.39 181.15 1pfn n GLN 56 N -2.46 2.24 -3.50 1.96 7.27 -1.26 -4.86 117.38 116.78 1pfn n GLN 56 Ca -0.10 -2.00 -0.14 0.00 0.07 0.00 0.00 57.00 54.83 1pfn n GLN 56 Cb 0.71 -2.04 -0.04 0.00 2.41 0.00 0.00 30.24 31.28 1pfn n GLN 56 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1pfn s ALA 57 N -1.27 -1.51 -1.78 1.69 0.00 -1.26 -5.02 121.76 112.60 1pfn s ALA 57 Ca 0.56 0.65 0.29 0.00 0.00 0.00 0.00 51.96 53.46 1pfn s ALA 57 Cb 0.35 0.57 1.66 0.00 0.00 0.00 0.00 23.12 25.69 1pfn s ALA 57 CO -0.16 -0.61 2.07 -0.35 0.00 0.00 0.00 175.76 176.71 1pfn n PRO 58 N 0.09 0.74 0.23 0.00 -0.04 -1.26 -3.89 135.00 130.87 1pfn n PRO 58 Ca -0.18 0.01 -0.15 0.00 -0.04 0.00 0.00 63.50 63.14 1pfn n PRO 58 Cb 0.62 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.50 1pfn n PRO 58 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1pfn h LEU 59 N 0.00 -0.50 -1.24 1.53 5.85 -1.95 -2.17 115.31 116.83 1pfn h LEU 59 Ca 0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1pfn h LEU 59 Cb 0.10 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.26 1pfn h LEU 59 CO 0.00 -0.20 0.00 0.10 -0.34 0.00 0.00 178.44 178.00 1pfn h TYR 60 N -0.82 0.00 0.00 1.25 -0.00 -1.78 -1.68 116.97 113.93 1pfn h TYR 60 Ca -0.06 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.62 1pfn h TYR 60 Cb 0.55 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.28 1pfn h TYR 60 CO 0.00 0.00 -0.26 -0.22 -0.00 0.00 0.00 178.16 177.69 1pfn h LYS 61 N 0.00 0.00 0.00 0.10 3.64 -1.58 -0.54 116.57 118.19 1pfn h LYS 61 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1pfn h LYS 61 Cb 0.43 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1pfn h LYS 61 CO 0.00 0.26 -0.01 1.57 -2.27 0.00 0.00 179.45 179.00 1pfn h LYS 62 N 0.00 0.00 0.18 1.90 2.10 -0.69 -1.61 116.57 118.45 1pfn h LYS 62 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1pfn h LYS 62 Cb 0.74 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.08 1pfn h LYS 62 CO 0.03 0.01 -0.09 0.82 -2.00 0.00 0.00 179.45 178.23 1pfn h ILE 63 N 0.00 0.28 -0.90 0.07 2.04 -1.10 -1.60 117.51 116.31 1pfn h ILE 63 Ca -0.00 -0.97 0.07 0.00 1.00 0.00 0.00 64.86 64.96 1pfn h ILE 63 Cb 0.93 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 1pfn h ILE 63 CO 0.00 0.08 0.58 0.40 0.00 0.00 0.00 178.15 179.22 1pfn h ILE 64 N -1.03 1.05 -0.61 -0.67 2.04 -1.38 0.19 117.51 117.11 1pfn h ILE 64 Ca -0.02 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1pfn h ILE 64 Cb 0.32 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.33 1pfn h ILE 64 CO 0.04 0.18 0.33 0.07 0.00 0.00 0.00 178.15 178.78 1pfn h LYS 65 N 1.00 0.85 0.00 2.37 2.10 -1.35 -0.26 116.57 121.28 1pfn h LYS 65 Ca 0.39 -0.10 -0.00 0.00 -2.00 0.00 0.00 60.65 58.94 1pfn h LYS 65 Cb 0.23 -0.17 -0.00 0.00 -0.90 0.00 0.00 32.23 31.39 1pfn h LYS 65 CO -0.15 0.64 -0.02 0.87 -2.00 0.00 0.00 179.45 178.80 1pfn h LYS 66 N 0.82 0.00 0.04 0.07 1.57 0.05 -1.22 116.57 117.90 1pfn h LYS 66 Ca 0.21 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.72 1pfn h LYS 66 Cb 0.04 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.32 1pfn h LYS 66 CO -0.03 0.02 -1.45 -0.07 -0.57 0.00 0.00 179.45 177.34 1pfn h LEU 67 N 0.00 0.12 -0.80 2.94 -0.00 -0.15 -3.30 115.31 114.12 1pfn h LEU 67 Ca -0.00 -0.18 -0.13 0.00 -0.00 0.00 0.00 57.88 57.58 1pfn h LEU 67 Cb 0.09 -0.04 -0.01 0.00 -0.00 0.00 0.00 40.66 40.70 1pfn h LEU 67 CO 0.00 1.15 -0.49 -0.07 -0.00 0.00 0.00 178.44 179.03 1pfn h LEU 68 N 0.02 0.29 -1.46 1.67 3.38 -0.16 -2.87 115.31 116.18 1pfn h LEU 68 Ca -0.19 -0.14 0.27 0.00 0.09 0.00 0.00 57.88 57.91 1pfn h LEU 68 Cb 1.94 -0.08 -0.09 0.00 0.09 0.00 0.00 40.66 42.52 1pfn h LEU 68 CO 0.12 0.74 0.68 -0.33 0.09 0.00 0.00 178.44 179.74 1pfn h GLU 69 N 0.21 0.33 0.00 1.13 5.08 -1.40 -3.52 114.58 116.42 1pfn h GLU 69 Ca 0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1pfn h GLU 69 Cb 0.95 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.12 1pfn h GLU 69 CO 0.08 0.22 0.00 0.45 -1.00 0.00 0.00 179.01 178.76