#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1guo h SER 4 N 0.00 0.37 -1.97 9.51 4.64 -2.03 -3.43 113.55 120.64 1guo h SER 4 Ca 0.00 -0.08 -0.62 0.00 -0.47 0.00 0.00 61.79 60.62 1guo h SER 4 Cb 0.00 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.01 1guo h SER 4 CO 0.00 0.52 1.14 0.00 -0.87 0.00 0.00 176.83 177.62 1guo n ALA 5 N -2.48 0.93 1.52 5.18 0.00 -1.26 -4.83 120.51 119.57 1guo n ALA 5 Ca 0.00 0.24 0.14 0.00 0.00 0.00 0.00 53.44 53.82 1guo n ALA 5 Cb 0.29 -2.52 0.60 0.00 0.00 0.00 0.00 19.45 17.82 1guo n ALA 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1guo n ARG 6 N 6.87 1.12 -3.70 0.00 1.74 -1.25 -4.70 116.66 116.74 1guo n ARG 6 Ca 0.24 -0.50 -0.38 0.00 -0.77 0.00 0.00 57.85 56.44 1guo n ARG 6 Cb 0.30 -1.49 -0.12 0.00 -1.02 0.00 0.00 32.46 30.13 1guo n ARG 6 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1guo s ASN 7 N -2.22 5.41 -0.30 0.55 0.01 -1.01 -5.00 114.94 112.37 1guo s ASN 7 Ca 0.35 -0.97 -0.03 0.00 -0.71 0.00 0.00 52.86 51.50 1guo s ASN 7 Cb 0.21 -1.92 0.10 0.00 0.41 0.00 0.00 41.25 40.05 1guo s ASN 7 CO 0.41 -0.31 0.13 -1.10 -1.51 0.00 0.00 177.10 174.72 1guo s GLN 8 N 1.48 0.36 -0.19 -0.60 -0.21 -1.24 0.34 119.66 119.59 1guo s GLN 8 Ca 0.01 -0.73 -0.04 0.00 0.02 0.00 0.00 55.36 54.62 1guo s GLN 8 Cb -0.19 -1.41 -0.02 0.00 1.00 0.00 0.00 33.01 32.40 1guo s GLN 8 CO 0.04 -1.02 -0.03 -0.51 -2.12 0.00 0.00 175.29 171.65 1guo s LEU 9 N 1.91 3.10 0.14 2.90 1.43 0.15 -4.89 118.68 123.41 1guo s LEU 9 Ca 0.10 -0.26 -0.28 0.00 -1.03 0.00 0.00 54.13 52.66 1guo s LEU 9 Cb -0.17 -1.77 -0.07 0.00 0.03 0.00 0.00 46.19 44.21 1guo s LEU 9 CO -0.32 0.07 0.88 -0.54 0.23 0.00 0.00 176.35 176.67 1guo s LYS 10 N 0.96 4.68 0.21 1.70 1.02 -1.26 0.89 119.74 127.93 1guo s LYS 10 Ca 0.00 1.33 -0.09 0.00 0.02 0.00 0.00 55.97 57.23 1guo s LYS 10 Cb -0.15 -3.33 0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1guo s LYS 10 CO 0.01 0.37 0.49 0.41 -0.92 0.00 0.00 175.35 175.71 1guo n GLY 11 N 1.96 1.32 3.21 -3.33 0.00 0.12 -4.24 105.19 104.23 1guo n GLY 11 Ca -0.01 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.54 1guo n GLY 11 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1guo s LYS 12 N -2.05 3.07 -0.16 1.61 2.20 -0.47 -0.87 119.74 123.06 1guo s LYS 12 Ca 0.10 -0.84 -0.29 0.00 -0.36 0.00 0.00 55.97 54.58 1guo s LYS 12 Cb -0.03 -2.42 -0.06 0.00 -1.51 0.00 0.00 37.83 33.82 1guo s LYS 12 CO 0.06 0.07 2.11 0.08 -0.36 0.00 0.00 175.35 177.31 1guo s VAL 13 N 0.63 3.07 -0.72 4.02 1.01 0.86 -1.43 120.40 127.83 1guo s VAL 13 Ca -0.11 0.07 0.07 0.00 0.00 0.00 0.00 61.98 62.02 1guo s VAL 13 Cb -0.16 -3.08 0.17 0.00 0.00 0.00 0.00 36.38 33.31 1guo s VAL 13 CO 0.02 -0.04 1.06 1.33 0.00 0.00 0.00 175.10 177.47 1guo n VAL 14 N 7.15 0.73 -3.61 2.92 0.24 0.03 -0.20 118.33 125.58 1guo n VAL 14 Ca 0.27 -0.86 -0.08 0.00 -2.04 0.00 0.00 64.34 61.62 1guo n VAL 14 Cb 0.44 0.68 -0.06 0.00 -1.47 0.00 0.00 33.84 33.43 1guo n VAL 14 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1guo s GLY 15 N -0.90 -0.11 -0.22 7.63 0.00 -1.09 -4.96 107.32 107.67 1guo s GLY 15 Ca 0.14 2.51 -0.10 0.00 0.00 0.00 0.00 44.72 47.27 1guo s GLY 15 CO 0.10 1.41 0.50 -2.27 0.00 0.00 0.00 173.10 172.85 1guo s LEU 16 N -0.52 -0.61 -0.15 0.66 2.96 -1.26 -1.28 118.68 118.47 1guo s LEU 16 Ca 0.02 1.15 -0.00 0.00 -0.22 0.00 0.00 54.13 55.08 1guo s LEU 16 Cb -0.03 1.69 0.03 0.00 0.50 0.00 0.00 46.19 48.39 1guo s LEU 16 CO -0.04 -0.22 -0.09 -0.75 -1.32 0.00 0.00 176.35 173.93 1guo s LYS 17 N 2.12 1.73 -0.28 1.98 2.20 0.51 -4.96 119.74 123.03 1guo s LYS 17 Ca -0.06 -0.49 -0.12 0.00 -0.36 0.00 0.00 55.97 54.93 1guo s LYS 17 Cb -0.10 -1.96 -0.04 0.00 -1.51 0.00 0.00 37.83 34.22 1guo s LYS 17 CO -0.15 -0.34 0.24 0.15 -0.36 0.00 0.00 175.35 174.89 1guo s LYS 18 N 1.59 3.93 0.00 4.03 1.02 -1.26 -0.27 119.74 128.78 1guo s LYS 18 Ca 0.03 -0.26 0.00 0.00 0.02 0.00 0.00 55.97 55.76 1guo s LYS 18 Cb -0.14 -3.67 0.00 0.00 -0.52 0.00 0.00 37.83 33.50 1guo s LYS 18 CO -0.09 -0.22 0.00 0.41 -0.92 0.00 0.00 175.35 174.53 1guo n GLY 19 N 4.98 1.62 0.13 -3.33 0.00 -0.51 -5.02 105.19 103.06 1guo n GLY 19 Ca -0.13 -1.71 -0.25 0.00 0.00 0.00 0.00 46.02 43.93 1guo n GLY 19 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1guo n VAL 20 N 0.00 1.53 -0.09 1.61 0.31 -1.26 -4.80 118.33 115.63 1guo n VAL 20 Ca 0.00 -0.43 -0.13 0.00 -0.01 0.00 0.00 64.34 63.77 1guo n VAL 20 Cb 0.00 -1.74 -0.08 0.00 -0.91 0.00 0.00 33.84 31.11 1guo n VAL 20 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1guo n VAL 21 N -3.90 1.01 -3.90 2.52 0.31 -1.26 -4.83 118.33 108.28 1guo n VAL 21 Ca -0.49 -0.37 -0.23 0.00 -0.01 0.00 0.00 64.34 63.24 1guo n VAL 21 Cb 0.91 -1.21 -0.00 0.00 -0.91 0.00 0.00 33.84 32.62 1guo n VAL 21 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1guo n THR 22 N -3.13 0.00 -3.59 2.52 -2.24 -1.26 -0.92 114.28 105.66 1guo n THR 22 Ca -0.32 -1.92 -0.16 0.00 -2.27 0.00 0.00 64.05 59.38 1guo n THR 22 Cb 0.82 -0.05 -0.07 0.00 -2.10 0.00 0.00 70.33 68.94 1guo n THR 22 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1guo s ALA 23 N -2.70 -1.61 -0.15 6.98 0.00 0.89 -1.42 121.76 123.76 1guo s ALA 23 Ca 0.25 1.36 -0.05 0.00 0.00 0.00 0.00 51.96 53.52 1guo s ALA 23 Cb -0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 1guo s ALA 23 CO 0.16 -0.34 0.03 -2.00 0.00 0.00 0.00 175.76 173.61 1guo s GLU 24 N -0.76 3.61 -0.08 0.00 2.12 0.63 -1.02 118.70 123.21 1guo s GLU 24 Ca -0.08 -0.39 0.04 0.00 0.36 0.00 0.00 54.97 54.90 1guo s GLU 24 Cb -0.02 -3.03 0.00 0.00 0.26 0.00 0.00 34.13 31.34 1guo s GLU 24 CO 0.07 0.41 -0.20 0.08 -0.54 0.00 0.00 175.26 175.07 1guo s VAL 25 N -0.04 1.71 -0.27 3.70 1.01 0.49 -0.36 120.40 126.64 1guo s VAL 25 Ca 0.04 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.22 1guo s VAL 25 Cb -0.13 -1.49 0.06 0.00 0.00 0.00 0.00 36.38 34.83 1guo s VAL 25 CO 0.02 0.48 -0.10 -0.69 0.00 0.00 0.00 175.10 174.81 1guo s VAL 26 N 0.31 2.21 -0.04 2.92 1.01 -0.41 -1.37 120.40 125.03 1guo s VAL 26 Ca -0.13 -1.67 -0.03 0.00 0.00 0.00 0.00 61.98 60.15 1guo s VAL 26 Cb -0.16 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1guo s VAL 26 CO 0.06 -0.06 0.13 -0.76 0.00 0.00 0.00 175.10 174.46 1guo s LEU 27 N 1.10 4.18 -0.27 3.92 1.43 -0.52 -0.79 118.68 127.74 1guo s LEU 27 Ca -0.08 0.31 -0.11 0.00 -1.03 0.00 0.00 54.13 53.22 1guo s LEU 27 Cb -0.20 -2.31 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 1guo s LEU 27 CO -0.05 0.31 0.19 -0.70 0.23 0.00 0.00 176.35 176.33 1guo s GLU 28 N -1.56 3.99 0.12 1.70 2.12 -0.51 -0.36 118.70 124.21 1guo s GLU 28 Ca 0.22 -0.29 0.01 0.00 0.36 0.00 0.00 54.97 55.27 1guo s GLU 28 Cb -0.12 -3.62 0.01 0.00 0.26 0.00 0.00 34.13 30.66 1guo s GLU 28 CO 0.12 -0.10 0.10 0.44 -0.54 0.00 0.00 175.26 175.28 1guo n ILE 29 N 4.80 0.00 -1.58 -3.70 -6.64 -0.18 -1.37 119.36 110.68 1guo n ILE 29 Ca -0.14 -0.48 -0.47 0.00 -1.77 0.00 0.00 62.75 59.89 1guo n ILE 29 Cb 0.52 -0.46 -0.03 0.00 -1.44 0.00 0.00 39.64 38.23 1guo n ILE 29 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1guo n ALA 30 N -2.76 -0.55 -1.02 -1.28 0.00 -1.26 -2.54 120.51 111.11 1guo n ALA 30 Ca -0.04 0.43 -0.01 0.00 0.00 0.00 0.00 53.44 53.82 1guo n ALA 30 Cb 0.14 -2.01 -0.00 0.00 0.00 0.00 0.00 19.45 17.57 1guo n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1guo n GLY 31 N 1.64 0.46 2.12 0.00 0.00 -1.26 -3.56 105.19 104.59 1guo n GLY 31 Ca 0.12 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1guo n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1guo n GLY 32 N -2.31 1.22 3.76 -0.02 0.00 -1.05 -5.03 105.19 101.75 1guo n GLY 32 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1guo n GLY 32 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1guo s ASN 33 N -3.12 6.07 -0.04 1.61 0.01 -1.23 -4.82 114.94 113.41 1guo s ASN 33 Ca 0.00 2.59 0.01 0.00 -0.71 0.00 0.00 52.86 54.75 1guo s ASN 33 Cb 0.00 -2.63 -0.03 0.00 0.41 0.00 0.00 41.25 39.00 1guo s ASN 33 CO 0.00 -1.01 -0.04 -0.54 -1.51 0.00 0.00 177.10 174.00 1guo s LYS 34 N -2.48 2.75 -0.14 -0.60 1.02 -1.26 -1.01 119.74 118.01 1guo s LYS 34 Ca 0.61 -0.58 -0.01 0.00 0.02 0.00 0.00 55.97 56.02 1guo s LYS 34 Cb -0.36 -2.62 -0.01 0.00 -0.52 0.00 0.00 37.83 34.32 1guo s LYS 34 CO 0.45 0.65 -0.12 0.42 -0.92 0.00 0.00 175.35 175.83 1guo s ILE 35 N -0.92 3.03 -0.15 2.17 -1.09 0.52 -4.97 121.20 119.78 1guo s ILE 35 Ca 0.15 -0.66 -0.04 0.00 -2.23 0.00 0.00 60.65 57.87 1guo s ILE 35 Cb -0.11 -2.28 -0.03 0.00 -1.58 0.00 0.00 42.46 38.45 1guo s ILE 35 CO 0.05 0.51 -0.02 -0.89 -1.23 0.00 0.00 174.94 173.37 1guo s THR 36 N 0.54 4.10 -0.04 2.92 2.01 -1.26 -1.44 115.64 122.47 1guo s THR 36 Ca -0.08 -0.29 0.01 0.00 0.31 0.00 0.00 61.69 61.64 1guo s THR 36 Cb -0.16 -2.80 0.02 0.00 0.01 0.00 0.00 72.50 69.58 1guo s THR 36 CO 0.04 0.50 -0.03 -0.55 -0.69 0.00 0.00 174.62 173.88 1guo s SER 37 N 0.25 0.77 -0.28 3.53 0.15 -0.47 -5.01 113.70 112.65 1guo s SER 37 Ca -0.01 -0.10 -0.05 0.00 0.70 0.00 0.00 55.95 56.48 1guo s SER 37 Cb -0.14 -0.37 0.01 0.00 -1.71 0.00 0.00 66.02 63.81 1guo s SER 37 CO 0.02 -0.06 0.04 -0.63 1.20 0.00 0.00 173.24 173.81 1guo s ILE 38 N 0.87 3.67 0.05 6.45 1.01 -1.26 -0.38 121.20 131.61 1guo s ILE 38 Ca -0.11 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.80 1guo s ILE 38 Cb -0.14 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.46 1guo s ILE 38 CO -0.00 0.14 0.01 2.30 0.00 0.00 0.00 174.94 177.39 1guo n ILE 39 N 4.81 0.00 -2.65 2.92 -5.35 -0.19 -4.89 119.36 114.01 1guo n ILE 39 Ca -0.15 -0.28 -0.37 0.00 -0.27 0.00 0.00 62.75 61.68 1guo n ILE 39 Cb 0.48 0.09 -0.05 0.00 -1.74 0.00 0.00 39.64 38.41 1guo n ILE 39 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1guo s SER 40 N -1.30 7.14 0.22 7.28 1.04 -1.26 -0.08 113.70 126.74 1guo s SER 40 Ca 0.02 1.97 -0.08 0.00 0.48 0.00 0.00 55.95 58.34 1guo s SER 40 Cb 0.00 -2.59 0.32 0.00 0.10 0.00 0.00 66.02 63.85 1guo s SER 40 CO 0.01 -0.22 1.76 0.25 0.98 0.00 0.00 173.24 176.02 1guo h LEU 41 N 3.06 0.33 -0.78 2.42 5.85 -1.21 -1.65 115.31 123.32 1guo h LEU 41 Ca -0.47 0.07 0.17 0.00 0.84 0.00 0.00 57.88 58.50 1guo h LEU 41 Cb 1.20 0.03 -0.11 0.00 0.37 0.00 0.00 40.66 42.15 1guo h LEU 41 CO 0.64 0.18 0.23 0.44 -0.34 0.00 0.00 178.44 179.59 1guo h ASP 42 N 0.49 0.08 -0.66 1.25 3.32 -1.92 0.14 116.42 119.12 1guo h ASP 42 Ca 0.34 0.15 -0.06 0.00 0.02 0.00 0.00 57.03 57.48 1guo h ASP 42 Cb 0.40 0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 1guo h ASP 42 CO -0.30 -0.03 0.20 0.28 -1.72 0.00 0.00 179.24 177.66 1guo h SER 43 N 0.30 0.97 0.28 6.45 0.02 -1.70 -2.05 113.55 117.81 1guo h SER 43 Ca 0.45 -0.21 -0.02 0.00 -0.84 0.00 0.00 61.79 61.17 1guo h SER 43 Cb 0.79 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.08 1guo h SER 43 CO -0.52 0.92 -0.10 0.58 -1.14 0.00 0.00 176.83 176.57 1guo h VAL 44 N 0.96 0.60 0.11 2.27 2.07 -0.29 -0.92 116.25 121.05 1guo h VAL 44 Ca 0.21 -0.43 -0.29 0.00 0.82 0.00 0.00 66.70 67.00 1guo h VAL 44 Cb 0.31 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 1guo h VAL 44 CO -0.00 0.10 -1.44 -0.33 0.02 0.00 0.00 177.57 175.92 1guo h GLU 45 N 0.00 0.23 0.03 1.57 4.39 -0.99 -3.16 114.58 116.64 1guo h GLU 45 Ca -0.00 -0.40 -0.26 0.00 0.34 0.00 0.00 59.36 59.04 1guo h GLU 45 Cb 0.27 0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 29.03 1guo h GLU 45 CO 0.01 1.11 -1.35 0.93 -1.16 0.00 0.00 179.01 178.55 1guo h GLU 46 N 0.06 0.06 0.00 2.33 5.08 -0.79 -3.34 114.58 117.98 1guo h GLU 46 Ca -0.21 -0.10 -0.12 0.00 -1.00 0.00 0.00 59.36 57.94 1guo h GLU 46 Cb 1.99 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 31.26 1guo h GLU 46 CO 0.17 0.87 -0.55 -0.07 -1.00 0.00 0.00 179.01 178.42 1guo h LEU 47 N 0.02 0.00 0.00 1.33 3.38 -1.38 -3.47 115.31 115.18 1guo h LEU 47 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1guo h LEU 47 Cb 1.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.66 1guo h LEU 47 CO 0.12 0.55 0.00 0.61 0.09 0.00 0.00 178.44 179.81 1guo n GLY 48 N 1.17 1.70 3.73 0.83 0.00 -1.25 -5.07 105.19 106.30 1guo n GLY 48 Ca 0.02 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1guo n GLY 48 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1guo s VAL 49 N -2.00 2.26 0.20 1.61 1.01 -1.19 -5.00 120.40 117.28 1guo s VAL 49 Ca 0.00 0.19 -0.20 0.00 0.00 0.00 0.00 61.98 61.97 1guo s VAL 49 Cb 0.00 -3.12 0.04 0.00 0.00 0.00 0.00 36.38 33.30 1guo s VAL 49 CO 0.00 0.02 0.60 -0.54 0.00 0.00 0.00 175.10 175.18 1guo s LYS 50 N 0.75 1.44 0.55 2.72 1.02 -1.26 -4.95 119.74 120.01 1guo s LYS 50 Ca 0.70 -0.76 -0.21 0.00 0.02 0.00 0.00 55.97 55.73 1guo s LYS 50 Cb -0.47 0.57 -0.05 0.00 -0.52 0.00 0.00 37.83 37.36 1guo s LYS 50 CO 0.35 -0.63 1.28 -2.00 -0.92 0.00 0.00 175.35 173.43 1guo s GLU 51 N -3.84 3.16 0.00 1.68 2.12 -1.26 -2.71 118.70 117.86 1guo s GLU 51 Ca 0.07 2.04 0.00 0.00 0.36 0.00 0.00 54.97 57.44 1guo s GLU 51 Cb -0.02 -2.17 0.00 0.00 0.26 0.00 0.00 34.13 32.19 1guo s GLU 51 CO -0.04 -1.11 0.00 0.41 -0.54 0.00 0.00 175.26 173.98 1guo n GLY 52 N 0.65 3.21 3.77 -1.50 0.00 0.72 -4.94 105.19 107.10 1guo n GLY 52 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 1guo n GLY 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1guo s ALA 53 N -1.87 2.85 -0.22 4.61 0.00 -1.10 -4.63 121.76 121.40 1guo s ALA 53 Ca 0.00 0.94 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 1guo s ALA 53 Cb 0.00 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.68 1guo s ALA 53 CO 0.00 -0.79 0.12 -1.21 0.00 0.00 0.00 175.76 173.89 1guo s GLU 54 N -2.92 4.05 0.26 0.00 2.02 -1.26 -0.10 118.70 120.75 1guo s GLU 54 Ca 0.68 -0.29 -0.04 0.00 0.02 0.00 0.00 54.97 55.34 1guo s GLU 54 Cb -0.28 -3.42 -0.02 0.00 0.10 0.00 0.00 34.13 30.51 1guo s GLU 54 CO 0.33 0.15 0.33 -0.51 0.02 0.00 0.00 175.26 175.59 1guo s LEU 55 N 0.76 0.93 -0.08 1.80 1.43 -0.05 -4.98 118.68 118.49 1guo s LEU 55 Ca 0.06 -1.31 0.05 0.00 -1.03 0.00 0.00 54.13 51.90 1guo s LEU 55 Cb -0.13 1.06 -0.01 0.00 0.03 0.00 0.00 46.19 47.15 1guo s LEU 55 CO 0.02 -1.06 -0.23 -0.89 0.23 0.00 0.00 176.35 174.42 1guo s THR 56 N -3.79 2.18 -0.04 5.49 2.01 -1.26 0.15 115.64 120.38 1guo s THR 56 Ca 0.32 -1.00 -0.22 0.00 0.31 0.00 0.00 61.69 61.10 1guo s THR 56 Cb 0.03 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 1guo s THR 56 CO 0.15 0.56 0.67 0.00 -0.69 0.00 0.00 174.62 175.30 1guo s ALA 57 N 0.07 3.39 -0.06 7.40 0.00 0.26 -4.86 121.76 127.96 1guo s ALA 57 Ca -0.10 0.11 0.05 0.00 0.00 0.00 0.00 51.96 52.02 1guo s ALA 57 Cb -0.16 -2.88 -0.01 0.00 0.00 0.00 0.00 23.12 20.07 1guo s ALA 57 CO 0.06 0.00 -0.23 0.08 0.00 0.00 0.00 175.76 175.67 1guo s VAL 58 N 0.39 1.90 -0.06 0.00 1.01 -1.25 0.33 120.40 122.72 1guo s VAL 58 Ca 0.35 -0.98 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1guo s VAL 58 Cb -0.18 -1.62 0.04 0.00 0.00 0.00 0.00 36.38 34.62 1guo s VAL 58 CO 0.18 0.53 0.13 -0.69 0.00 0.00 0.00 175.10 175.25 1guo s VAL 59 N -0.05 -0.06 0.16 2.92 1.01 0.15 -4.99 120.40 119.55 1guo s VAL 59 Ca -0.06 0.20 -0.31 0.00 0.00 0.00 0.00 61.98 61.82 1guo s VAL 59 Cb -0.14 -0.22 -0.08 0.00 0.00 0.00 0.00 36.38 35.94 1guo s VAL 59 CO 0.04 0.08 1.35 -0.75 0.00 0.00 0.00 175.10 175.82 1guo s LYS 60 N 1.24 4.35 0.27 2.72 2.20 -1.26 -2.41 119.74 126.85 1guo s LYS 60 Ca -0.08 2.07 -0.03 0.00 -0.36 0.00 0.00 55.97 57.57 1guo s LYS 60 Cb -0.12 -3.22 0.57 0.00 -1.51 0.00 0.00 37.83 33.56 1guo s LYS 60 CO -0.06 -0.35 1.62 0.77 -0.36 0.00 0.00 175.35 176.98 1guo h SER 61 N 6.03 -0.30 0.14 1.43 0.02 -1.94 0.51 113.55 119.44 1guo h SER 61 Ca -0.44 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1guo h SER 61 Cb 1.21 0.36 0.00 0.00 0.14 0.00 0.00 62.40 64.11 1guo h SER 61 CO 0.82 -0.21 0.00 0.35 -1.14 0.00 0.00 176.83 176.64 1guo n THR 62 N -5.35 0.39 1.01 -2.27 -2.24 -1.26 -1.49 114.28 103.07 1guo n THR 62 Ca 0.18 0.10 0.11 0.00 -2.27 0.00 0.00 64.05 62.16 1guo n THR 62 Cb 0.58 -0.89 -0.02 0.00 -2.10 0.00 0.00 70.33 67.91 1guo n THR 62 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1guo n ASP 63 N -1.17 1.69 -4.62 3.42 8.00 0.17 -4.92 116.55 119.12 1guo n ASP 63 Ca 0.08 -1.33 -0.39 0.00 0.71 0.00 0.00 54.79 53.85 1guo n ASP 63 Cb 0.08 0.60 -0.08 0.00 -0.02 0.00 0.00 41.12 41.70 1guo n ASP 63 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1guo s VAL 64 N -2.63 5.15 0.42 2.53 1.01 -0.56 -5.04 120.40 121.29 1guo s VAL 64 Ca 0.16 0.67 0.05 0.00 0.00 0.00 0.00 61.98 62.85 1guo s VAL 64 Cb 0.18 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.83 1guo s VAL 64 CO 0.65 0.16 0.59 -0.04 0.00 0.00 0.00 175.10 176.46 1guo s MET 65 N 1.99 2.92 -0.06 2.72 -1.94 -1.26 -5.06 119.30 118.61 1guo s MET 65 Ca 0.17 -0.93 0.03 0.00 -1.71 0.00 0.00 55.69 53.25 1guo s MET 65 Cb -0.16 -2.69 0.01 0.00 2.01 0.00 0.00 34.83 34.00 1guo s MET 65 CO 0.09 -0.24 -0.15 0.42 -0.01 0.00 0.00 175.02 175.14 1guo s ILE 66 N -2.40 1.32 -0.20 2.53 -1.09 -1.26 -5.12 121.20 114.98 1guo s ILE 66 Ca 0.51 -0.61 -0.02 0.00 -2.23 0.00 0.00 60.65 58.29 1guo s ILE 66 Cb -0.10 -1.17 -0.00 0.00 -1.58 0.00 0.00 42.46 39.61 1guo s ILE 66 CO 0.34 0.39 -0.09 -0.22 -1.23 0.00 0.00 174.94 174.13 1guo s LEU 67 N 0.42 2.68 0.00 2.97 2.96 -1.26 -5.35 118.68 121.10 1guo s LEU 67 Ca -0.12 -0.45 0.18 0.00 -0.22 0.00 0.00 54.13 53.53 1guo s LEU 67 Cb -0.14 -1.66 0.15 0.00 0.50 0.00 0.00 46.19 45.03 1guo s LEU 67 CO 0.04 0.01 1.09 0.00 -1.32 0.00 0.00 176.35 176.16