#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1eav n PRO 4 N 0.00 1.99 -0.09 1.61 -0.02 -1.26 -4.97 135.00 132.26 1eav n PRO 4 Ca 0.00 0.71 -0.16 0.00 -2.02 0.00 0.00 63.50 62.03 1eav n PRO 4 Cb 0.00 -2.37 -0.10 0.00 -0.02 0.00 0.00 33.50 31.01 1eav n PRO 4 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1eav h GLU 5 N 4.31 0.00 -5.16 -0.52 4.81 -1.90 -3.44 114.58 112.68 1eav h GLU 5 Ca -0.45 0.00 -0.65 0.00 -0.13 0.00 0.00 59.36 58.13 1eav h GLU 5 Cb 1.28 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.50 1eav h GLU 5 CO 0.76 0.81 -0.11 0.71 -0.73 0.00 0.00 179.01 180.46 1eav s TYR 6 N -2.27 3.19 -0.23 0.92 4.12 -0.80 -5.01 117.35 117.26 1eav s TYR 6 Ca -0.23 0.12 -0.26 0.00 0.02 0.00 0.00 57.07 56.71 1eav s TYR 6 Cb 0.03 -2.87 0.00 0.00 -1.52 0.00 0.00 41.96 37.60 1eav s TYR 6 CO 0.53 -0.52 0.92 0.15 0.02 0.00 0.00 175.55 176.65 1eav s LYS 7 N 2.30 4.23 -0.06 -0.62 1.02 -1.26 -1.55 119.74 123.80 1eav s LYS 7 Ca 0.17 1.12 0.03 0.00 0.02 0.00 0.00 55.97 57.31 1eav s LYS 7 Cb -0.16 -3.64 -0.03 0.00 -0.52 0.00 0.00 37.83 33.49 1eav s LYS 7 CO 0.13 -0.54 -0.14 0.08 -0.92 0.00 0.00 175.35 173.96 1eav s VAL 8 N 2.92 3.12 0.02 3.17 1.01 -0.01 -1.19 120.40 129.43 1eav s VAL 8 Ca 0.39 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.70 1eav s VAL 8 Cb -0.15 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 1eav s VAL 8 CO 0.07 0.59 -0.09 0.00 0.00 0.00 0.00 175.10 175.67 1eav s ALA 9 N -0.65 0.70 -0.12 5.51 0.00 0.37 -1.13 121.76 126.44 1eav s ALA 9 Ca 0.10 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.50 1eav s ALA 9 Cb -0.11 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.94 1eav s ALA 9 CO 0.01 0.10 -0.16 0.42 0.00 0.00 0.00 175.76 176.13 1eav s ILE 10 N -0.73 1.60 -0.24 0.00 1.01 -0.67 -0.93 121.20 121.23 1eav s ILE 10 Ca -0.02 -0.70 -0.05 0.00 0.00 0.00 0.00 60.65 59.88 1eav s ILE 10 Cb -0.06 -1.46 -0.01 0.00 0.01 0.00 0.00 42.46 40.94 1eav s ILE 10 CO 0.00 0.46 0.01 -0.22 0.00 0.00 0.00 174.94 175.20 1eav s LEU 11 N 1.01 3.23 -0.15 2.97 2.96 -0.67 -1.56 118.68 126.47 1eav s LEU 11 Ca -0.05 -0.41 -0.12 0.00 -0.22 0.00 0.00 54.13 53.32 1eav s LEU 11 Cb -0.15 -1.81 -0.05 0.00 0.50 0.00 0.00 46.19 44.68 1eav s LEU 11 CO -0.03 -0.06 0.24 -0.89 -1.32 0.00 0.00 176.35 174.30 1eav s THR 12 N 1.52 5.33 -0.23 3.68 2.01 0.12 -1.22 115.64 126.85 1eav s THR 12 Ca 0.05 0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.48 1eav s THR 12 Cb -0.15 -3.57 0.02 0.00 0.01 0.00 0.00 72.50 68.81 1eav s THR 12 CO -0.00 0.45 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.62 1eav s VAL 13 N 0.10 2.92 -0.30 3.82 1.01 0.17 -1.79 120.40 126.33 1eav s VAL 13 Ca 0.15 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 61.08 1eav s VAL 13 Cb -0.13 -2.42 0.17 0.00 0.00 0.00 0.00 36.38 34.01 1eav s VAL 13 CO 0.03 0.29 1.19 -0.55 0.00 0.00 0.00 175.10 176.06 1eav s SER 14 N 1.36 -0.17 0.32 3.32 0.15 0.09 -4.32 113.70 114.45 1eav s SER 14 Ca 0.02 0.10 0.11 0.00 0.70 0.00 0.00 55.95 56.88 1eav s SER 14 Cb -0.16 1.14 0.95 0.00 -1.71 0.00 0.00 66.02 66.25 1eav s SER 14 CO -0.05 -0.03 1.68 0.44 1.20 0.00 0.00 173.24 176.48 1eav h ASP 15 N 7.97 0.48 -0.24 5.45 3.32 -1.86 -0.56 116.42 130.97 1eav h ASP 15 Ca -0.11 0.17 -0.16 0.00 0.02 0.00 0.00 57.03 56.96 1eav h ASP 15 Cb 1.18 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1eav h ASP 15 CO -0.20 -0.06 -0.46 0.74 -1.72 0.00 0.00 179.24 177.54 1eav h THR 16 N 0.39 1.30 -0.39 0.35 2.02 -1.95 -2.91 112.91 111.72 1eav h THR 16 Ca 0.67 -1.67 -0.15 0.00 0.77 0.00 0.00 66.41 66.03 1eav h THR 16 Cb 1.42 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 69.58 1eav h THR 16 CO -0.57 0.53 -0.35 0.58 0.37 0.00 0.00 175.52 176.08 1eav h VAL 17 N 0.46 1.27 0.00 3.16 2.07 -1.36 -2.22 116.25 119.64 1eav h VAL 17 Ca 0.01 -1.52 -0.03 0.00 0.82 0.00 0.00 66.70 65.98 1eav h VAL 17 Cb 1.07 1.37 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1eav h VAL 17 CO 0.10 0.51 -0.14 -1.28 0.02 0.00 0.00 177.57 176.78 1eav h SER 18 N 0.74 0.00 0.18 0.57 0.87 -1.36 -1.72 113.55 112.83 1eav h SER 18 Ca 0.07 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1eav h SER 18 Cb 0.94 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.90 1eav h SER 18 CO 0.09 0.14 -0.23 0.00 -0.53 0.00 0.00 176.83 176.30 1eav n ALA 19 N -2.21 3.02 -0.85 6.23 0.00 -1.10 -4.92 120.51 120.68 1eav n ALA 19 Ca -0.01 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1eav n ALA 19 Cb 0.33 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1eav n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1eav n GLY 20 N 1.32 0.52 0.17 0.00 0.00 -0.65 -4.97 105.19 101.58 1eav n GLY 20 Ca 0.13 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 45.79 1eav n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1eav n ALA 21 N 0.56 3.37 -3.76 4.61 0.00 -0.84 -4.93 120.51 119.52 1eav n ALA 21 Ca 0.00 -0.42 -0.03 0.00 0.00 0.00 0.00 53.44 52.99 1eav n ALA 21 Cb 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.36 1eav n ALA 21 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1eav s GLY 22 N -2.69 -0.19 0.33 0.00 0.00 -1.20 -5.00 107.32 98.57 1eav s GLY 22 Ca 0.19 0.10 0.03 0.00 0.00 0.00 0.00 44.72 45.03 1eav s GLY 22 CO 0.60 0.34 0.45 -1.55 0.00 0.00 0.00 173.10 172.95 1eav n PRO 23 N -0.51 0.60 -3.86 2.90 -0.04 -1.26 -4.49 135.00 128.34 1eav n PRO 23 Ca -0.06 -1.55 -0.36 0.00 -0.04 0.00 0.00 63.50 61.50 1eav n PRO 23 Cb 0.61 -0.20 -0.13 0.00 -0.04 0.00 0.00 33.50 33.73 1eav n PRO 23 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1eav s ASP 24 N -2.95 4.88 -0.01 3.54 3.68 -1.26 -4.84 116.67 119.71 1eav s ASP 24 Ca 0.33 -1.02 0.21 0.00 2.13 0.00 0.00 52.55 54.21 1eav s ASP 24 Cb -0.02 -1.77 -0.23 0.00 -1.45 0.00 0.00 42.92 39.44 1eav s ASP 24 CO 0.21 -0.22 0.79 0.54 0.13 0.00 0.00 175.17 176.61 1eav n ARG 25 N 4.73 0.22 -0.07 4.34 1.74 -1.26 -4.51 116.66 121.85 1eav n ARG 25 Ca -0.14 -0.06 -0.19 0.00 -0.77 0.00 0.00 57.85 56.69 1eav n ARG 25 Cb 0.46 -1.51 -0.13 0.00 -1.02 0.00 0.00 32.46 30.25 1eav n ARG 25 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1eav n SER 26 N -1.77 1.89 -0.33 0.55 3.41 -1.26 -3.89 113.62 112.21 1eav n SER 26 Ca 0.01 0.03 -0.06 0.00 -0.26 0.00 0.00 58.87 58.60 1eav n SER 26 Cb 0.41 -0.50 -0.02 0.00 -0.26 0.00 0.00 64.21 63.84 1eav n SER 26 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1eav h GLY 27 N 1.81 -0.33 2.00 5.00 0.00 -1.92 0.36 103.07 109.99 1eav h GLY 27 Ca -0.50 0.60 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 1eav h GLY 27 CO -0.00 -0.13 -0.10 -0.56 0.00 0.00 0.00 176.54 175.75 1eav h PRO 28 N -0.08 0.00 -0.06 4.80 0.13 -1.80 0.44 132.00 135.43 1eav h PRO 28 Ca 0.24 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 65.13 1eav h PRO 28 Cb 0.54 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.69 1eav h PRO 28 CO -0.87 0.10 -0.90 0.00 -0.23 0.00 0.00 178.00 176.11 1eav h ARG 29 N 0.00 0.70 -0.84 0.86 2.47 -1.10 -2.52 114.38 113.95 1eav h ARG 29 Ca -0.00 -0.68 0.00 0.00 -1.26 0.00 0.00 59.98 58.04 1eav h ARG 29 Cb 0.59 0.18 -0.04 0.00 -1.65 0.00 0.00 29.97 29.05 1eav h ARG 29 CO 0.01 1.28 0.53 0.00 0.56 0.00 0.00 179.97 182.35 1eav h ALA 30 N 0.44 1.35 -0.35 0.04 0.00 -0.57 0.11 119.26 120.29 1eav h ALA 30 Ca -0.10 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1eav h ALA 30 Cb 1.55 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1eav h ALA 30 CO 0.18 0.58 0.05 0.28 0.00 0.00 0.00 179.25 180.34 1eav h VAL 31 N 1.16 0.80 0.00 0.00 2.07 -0.77 -1.73 116.25 117.78 1eav h VAL 31 Ca 0.31 -0.06 -0.12 0.00 0.82 0.00 0.00 66.70 67.65 1eav h VAL 31 Cb -0.09 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1eav h VAL 31 CO -0.06 0.03 -0.57 0.77 0.02 0.00 0.00 177.57 177.76 1eav h SER 32 N 0.16 0.00 -0.18 0.57 4.64 -0.64 -2.21 113.55 115.90 1eav h SER 32 Ca 0.17 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1eav h SER 32 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1eav h SER 32 CO -0.23 0.56 0.11 0.58 -0.87 0.00 0.00 176.83 176.98 1eav h VAL 33 N 0.00 1.07 0.11 0.95 2.07 -0.42 0.24 116.25 120.28 1eav h VAL 33 Ca -0.01 -0.17 0.02 0.00 0.82 0.00 0.00 66.70 67.36 1eav h VAL 33 Cb 1.43 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 32.03 1eav h VAL 33 CO 0.07 0.07 -0.28 0.58 0.02 0.00 0.00 177.57 178.04 1eav h VAL 34 N 0.22 0.40 -0.26 2.57 2.07 -1.03 -1.16 116.25 119.04 1eav h VAL 34 Ca 0.06 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.62 1eav h VAL 34 Cb 0.02 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.15 1eav h VAL 34 CO -0.01 0.00 0.03 0.44 0.02 0.00 0.00 177.57 178.05 1eav h ASP 35 N -0.49 -0.03 0.09 0.57 3.45 -1.23 0.49 116.42 119.27 1eav h ASP 35 Ca 0.03 0.05 0.00 0.00 0.43 0.00 0.00 57.03 57.54 1eav h ASP 35 Cb 0.52 0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.36 1eav h ASP 35 CO -0.16 0.02 0.00 -0.24 -1.57 0.00 0.00 179.24 177.28 1eav n SER 36 N -5.11 0.00 -0.26 6.45 2.88 0.82 -1.96 113.62 116.43 1eav n SER 36 Ca -0.01 0.35 0.03 0.00 -1.33 0.00 0.00 58.87 57.91 1eav n SER 36 Cb 0.12 -0.38 0.05 0.00 -0.75 0.00 0.00 64.21 63.25 1eav n SER 36 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1eav n SER 37 N -1.38 1.99 -0.28 -3.46 7.64 0.17 -4.74 113.62 113.55 1eav n SER 37 Ca 0.01 -1.65 0.09 0.00 1.01 0.00 0.00 58.87 58.34 1eav n SER 37 Cb 0.03 -0.06 0.22 0.00 -1.01 0.00 0.00 64.21 63.40 1eav n SER 37 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1eav h SER 38 N 1.00 -0.19 0.53 6.43 0.87 -0.66 0.42 113.55 121.94 1eav h SER 38 Ca 0.00 0.20 -0.03 0.00 -1.23 0.00 0.00 61.79 60.73 1eav h SER 38 Cb 0.43 0.31 0.01 0.00 -0.44 0.00 0.00 62.40 62.71 1eav h SER 38 CO 0.00 -0.17 -0.25 -0.08 -0.53 0.00 0.00 176.83 175.80 1eav h GLU 39 N 0.15 -0.68 -0.04 2.24 4.81 -1.85 1.99 114.58 121.20 1eav h GLU 39 Ca 0.48 0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.77 1eav h GLU 39 Cb 0.92 0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 1eav h GLU 39 CO -0.67 -0.45 0.11 0.87 -0.73 0.00 0.00 179.01 178.13 1eav h LYS 40 N -0.73 0.00 -0.01 1.92 1.57 -1.78 0.75 116.57 118.29 1eav h LYS 40 Ca -0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1eav h LYS 40 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 1eav h LYS 40 CO 0.12 0.00 -0.03 1.28 -0.57 0.00 0.00 179.45 180.25 1eav n LEU 41 N -3.31 0.88 0.00 2.94 4.77 0.14 -4.66 117.00 117.76 1eav n LEU 41 Ca -0.02 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 1eav n LEU 41 Cb 0.18 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1eav n LEU 41 CO 0.21 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1eav n GLY 42 N 1.15 0.76 1.09 -0.72 0.00 0.26 -4.59 105.19 103.13 1eav n GLY 42 Ca 0.19 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1eav n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eav n GLY 43 N -2.43 -2.14 3.20 -0.02 0.00 0.67 -4.78 105.19 99.70 1eav n GLY 43 Ca 0.00 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.40 1eav n GLY 43 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1eav s ALA 44 N 0.00 -0.38 0.02 4.61 0.00 -1.23 -1.91 121.76 122.87 1eav s ALA 44 Ca 0.00 -0.35 -0.18 0.00 0.00 0.00 0.00 51.96 51.43 1eav s ALA 44 Cb 0.00 0.37 0.03 0.00 0.00 0.00 0.00 23.12 23.53 1eav s ALA 44 CO 0.00 -0.43 0.40 0.21 0.00 0.00 0.00 175.76 175.94 1eav s LYS 45 N -3.07 0.86 -0.27 0.00 2.20 -0.60 -4.60 119.74 114.26 1eav s LYS 45 Ca -0.01 -0.29 -0.17 0.00 -0.36 0.00 0.00 55.97 55.14 1eav s LYS 45 Cb 0.01 0.39 -0.03 0.00 -1.51 0.00 0.00 37.83 36.69 1eav s LYS 45 CO -0.07 -0.28 0.47 0.08 -0.36 0.00 0.00 175.35 175.19 1eav s VAL 46 N -2.11 5.10 -0.53 4.02 1.01 -1.26 -0.83 120.40 125.80 1eav s VAL 46 Ca -0.08 0.74 0.12 0.00 0.00 0.00 0.00 61.98 62.77 1eav s VAL 46 Cb -0.02 -3.79 -0.14 0.00 0.00 0.00 0.00 36.38 32.43 1eav s VAL 46 CO 0.00 0.09 0.50 1.33 0.00 0.00 0.00 175.10 177.02 1eav n VAL 47 N 5.16 0.00 -3.51 2.92 0.24 -0.28 -4.94 118.33 117.92 1eav n VAL 47 Ca -0.06 -0.22 -0.16 0.00 -2.04 0.00 0.00 64.34 61.86 1eav n VAL 47 Cb 0.50 0.94 -0.05 0.00 -1.47 0.00 0.00 33.84 33.76 1eav n VAL 47 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1eav s ALA 48 N -2.21 -1.66 0.08 2.33 0.00 -1.23 -5.06 121.76 114.01 1eav s ALA 48 Ca 0.04 1.05 -0.07 0.00 0.00 0.00 0.00 51.96 52.98 1eav s ALA 48 Cb 0.09 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.42 1eav s ALA 48 CO 0.50 -0.46 0.14 0.95 0.00 0.00 0.00 175.76 176.90 1eav s THR 49 N -1.82 0.16 0.25 0.00 -4.23 -1.26 -1.67 115.64 107.07 1eav s THR 49 Ca -0.08 -1.33 -0.16 0.00 -1.18 0.00 0.00 61.69 58.94 1eav s THR 49 Cb -0.00 -1.38 0.01 0.00 1.34 0.00 0.00 72.50 72.46 1eav s THR 49 CO 0.04 -0.73 0.56 0.00 -0.54 0.00 0.00 174.62 173.95 1eav s ALA 50 N -3.88 -0.61 0.01 3.99 0.00 -0.60 -4.95 121.76 115.72 1eav s ALA 50 Ca 0.05 -0.64 0.05 0.00 0.00 0.00 0.00 51.96 51.42 1eav s ALA 50 Cb 0.06 0.98 -0.02 0.00 0.00 0.00 0.00 23.12 24.14 1eav s ALA 50 CO -0.11 -0.91 -0.15 0.08 0.00 0.00 0.00 175.76 174.68 1eav s VAL 51 N -3.97 1.17 0.05 0.00 1.01 -1.26 0.13 120.40 117.52 1eav s VAL 51 Ca 0.18 -0.77 -0.03 0.00 0.00 0.00 0.00 61.98 61.36 1eav s VAL 51 Cb -0.02 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.33 1eav s VAL 51 CO 0.07 0.22 0.03 0.68 0.00 0.00 0.00 175.10 176.11 1eav s VAL 52 N -0.52 0.19 0.79 2.92 -7.23 -0.74 -4.94 120.40 110.87 1eav s VAL 52 Ca 0.05 -1.52 -0.13 0.00 -1.81 0.00 0.00 61.98 58.56 1eav s VAL 52 Cb -0.06 -1.32 0.19 0.00 0.56 0.00 0.00 36.38 35.75 1eav s VAL 52 CO 0.00 -0.84 0.90 -0.81 -0.31 0.00 0.00 175.10 174.04 1eav n PRO 53 N 0.26 -1.63 -2.49 4.82 -0.04 -1.26 -0.73 135.00 133.93 1eav n PRO 53 Ca -0.16 -1.41 -0.43 0.00 -0.04 0.00 0.00 63.50 61.47 1eav n PRO 53 Cb 0.61 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.98 1eav n PRO 53 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1eav n ASP 54 N -3.94 4.82 -3.67 3.54 8.00 -1.26 -4.45 116.55 119.59 1eav n ASP 54 Ca 0.12 -2.92 -0.08 0.00 0.71 0.00 0.00 54.79 52.61 1eav n ASP 54 Cb 0.43 -1.71 -0.09 0.00 -0.02 0.00 0.00 41.12 39.72 1eav n ASP 54 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1eav s GLU 55 N 3.74 0.43 0.21 -1.24 2.02 -1.26 -4.91 118.70 117.68 1eav s GLU 55 Ca 0.52 1.00 -0.10 0.00 0.02 0.00 0.00 54.97 56.41 1eav s GLU 55 Cb 0.05 0.21 0.22 0.00 0.10 0.00 0.00 34.13 34.71 1eav s GLU 55 CO 0.05 -0.19 1.81 -0.39 0.02 0.00 0.00 175.26 176.56 1eav h VAL 56 N 5.73 1.00 -0.42 2.63 -1.51 -1.89 -1.14 116.25 120.64 1eav h VAL 56 Ca -0.27 -0.24 0.05 0.00 -1.23 0.00 0.00 66.70 65.02 1eav h VAL 56 Cb 1.16 0.23 -0.05 0.00 -2.13 0.00 0.00 31.29 30.49 1eav h VAL 56 CO 0.20 0.13 0.14 -0.33 -1.23 0.00 0.00 177.57 176.47 1eav h GLU 57 N 0.71 0.29 -0.55 5.19 4.39 -1.97 0.82 114.58 123.45 1eav h GLU 57 Ca 0.29 -0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.93 1eav h GLU 57 Cb 0.15 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.71 1eav h GLU 57 CO -0.16 0.19 0.16 0.00 -1.16 0.00 0.00 179.01 178.03 1eav h ARG 58 N 0.29 0.83 0.00 2.33 2.47 -1.59 0.13 114.38 118.84 1eav h ARG 58 Ca 0.20 -0.16 -0.23 0.00 -1.26 0.00 0.00 59.98 58.53 1eav h ARG 58 Cb 0.20 -0.13 0.02 0.00 -1.65 0.00 0.00 29.97 28.40 1eav h ARG 58 CO -0.21 0.73 -0.90 0.82 0.56 0.00 0.00 179.97 180.96 1eav h ILE 59 N 0.80 1.33 -0.12 2.04 2.04 -0.40 -3.19 117.51 120.01 1eav h ILE 59 Ca 0.18 -2.19 0.04 0.00 1.00 0.00 0.00 64.86 63.89 1eav h ILE 59 Cb 0.26 2.45 -0.05 0.00 -0.74 0.00 0.00 36.82 38.73 1eav h ILE 59 CO -0.01 0.67 -0.23 0.11 0.00 0.00 0.00 178.15 178.69 1eav h LYS 60 N 0.23 -0.29 -0.36 2.37 1.57 0.12 -1.34 116.57 118.87 1eav h LYS 60 Ca -0.11 0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1eav h LYS 60 Cb 1.58 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.90 1eav h LYS 60 CO 0.18 -0.19 0.07 -0.44 -0.57 0.00 0.00 179.45 178.49 1eav h ASP 61 N -0.30 -0.00 -0.74 0.86 3.32 -1.02 0.39 116.42 118.93 1eav h ASP 61 Ca 0.10 0.06 -0.05 0.00 0.02 0.00 0.00 57.03 57.16 1eav h ASP 61 Cb 0.44 0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 1eav h ASP 61 CO -0.29 0.04 0.26 0.40 -1.72 0.00 0.00 179.24 177.92 1eav h ILE 62 N 0.19 1.26 -0.89 0.35 1.08 -1.51 0.29 117.51 118.27 1eav h ILE 62 Ca 0.17 -0.86 0.03 0.00 -0.39 0.00 0.00 64.86 63.81 1eav h ILE 62 Cb 0.20 0.43 -0.05 0.00 -3.07 0.00 0.00 36.82 34.33 1eav h ILE 62 CO -0.23 0.34 0.59 -0.07 -0.69 0.00 0.00 178.15 178.09 1eav h LEU 63 N 1.08 0.98 -0.13 1.44 3.38 0.76 -0.81 115.31 122.02 1eav h LEU 63 Ca 0.24 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 1eav h LEU 63 Cb 0.27 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 1eav h LEU 63 CO -0.01 0.68 -0.11 1.56 0.09 0.00 0.00 178.44 180.65 1eav h GLN 64 N 1.14 0.30 -0.35 1.13 4.20 0.16 -2.39 115.11 119.29 1eav h GLN 64 Ca 0.35 -0.15 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 1eav h GLN 64 Cb -0.02 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 1eav h GLN 64 CO -0.10 0.69 0.06 -0.22 -0.67 0.00 0.00 178.83 178.59 1eav h LYS 65 N -0.08 0.58 0.00 1.46 3.64 -0.00 0.28 116.57 122.45 1eav h LYS 65 Ca 0.02 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 1eav h LYS 65 Cb 0.63 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.38 1eav h LYS 65 CO 0.03 0.65 -0.04 -1.49 -2.27 0.00 0.00 179.45 176.33 1eav h TRP 66 N 0.42 0.00 0.02 1.91 6.55 -1.16 -1.47 115.95 122.22 1eav h TRP 66 Ca 0.11 0.00 -0.14 0.00 0.95 0.00 0.00 58.89 59.81 1eav h TRP 66 Cb 0.35 0.00 -0.02 0.00 -0.86 0.00 0.00 29.16 28.63 1eav h TRP 66 CO 0.02 0.04 -0.75 0.77 -1.05 0.00 0.00 178.44 177.48 1eav h SER 67 N 0.00 0.06 1.22 -3.49 0.02 -1.06 -2.45 113.55 107.84 1eav h SER 67 Ca -0.00 -0.76 -0.03 0.00 -0.84 0.00 0.00 61.79 60.15 1eav h SER 67 Cb 0.84 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.35 1eav h SER 67 CO 0.01 1.30 -0.80 0.44 -1.14 0.00 0.00 176.83 176.64 1eav h ASP 68 N -0.90 0.00 0.00 3.07 3.32 -0.41 -3.26 116.42 118.24 1eav h ASP 68 Ca -0.20 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.75 1eav h ASP 68 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1eav h ASP 68 CO -0.08 0.12 -1.13 0.52 -1.72 0.00 0.00 179.24 176.95 1eav n VAL 69 N -2.85 0.71 0.70 -1.35 0.31 -0.60 -4.71 118.33 110.55 1eav n VAL 69 Ca -0.00 0.01 0.13 0.00 -0.01 0.00 0.00 64.34 64.47 1eav n VAL 69 Cb 0.60 -1.67 0.45 0.00 -0.91 0.00 0.00 33.84 32.31 1eav n VAL 69 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1eav n ASP 70 N -3.50 0.64 -1.54 4.52 8.00 -0.92 -5.04 116.55 118.70 1eav n ASP 70 Ca -0.13 0.56 0.00 0.00 0.71 0.00 0.00 54.79 55.93 1eav n ASP 70 Cb 0.48 -0.73 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 1eav n ASP 70 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1eav n GLU 71 N -2.10 -3.03 0.00 -1.24 1.02 -0.92 -4.99 120.64 109.37 1eav n GLU 71 Ca 0.06 2.24 0.00 0.00 -0.02 0.00 0.00 57.16 59.44 1eav n GLU 71 Cb 0.41 -2.71 0.00 0.00 -0.02 0.00 0.00 31.44 29.12 1eav n GLU 71 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1eav n ASP 73 N -0.46 2.21 -3.66 1.62 8.00 -0.34 -4.95 116.55 118.97 1eav n ASP 73 Ca 0.00 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.39 1eav n ASP 73 Cb 0.00 0.38 -0.11 0.00 -0.02 0.00 0.00 41.12 41.37 1eav n ASP 73 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1eav s LEU 74 N -1.59 -0.43 -0.19 0.64 2.96 -0.86 -1.90 118.68 117.31 1eav s LEU 74 Ca 0.00 0.79 0.01 0.00 -0.22 0.00 0.00 54.13 54.71 1eav s LEU 74 Cb 0.00 1.03 0.02 0.00 0.50 0.00 0.00 46.19 47.74 1eav s LEU 74 CO 0.00 -0.23 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.00 1eav s ILE 75 N 2.43 2.23 -0.21 6.68 1.01 -0.52 -0.48 121.20 132.35 1eav s ILE 75 Ca -0.01 -0.96 -0.09 0.00 0.00 0.00 0.00 60.65 59.60 1eav s ILE 75 Cb -0.12 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.32 1eav s ILE 75 CO -0.11 0.47 0.11 -0.76 0.00 0.00 0.00 174.94 174.65 1eav s LEU 76 N 1.30 3.95 0.28 2.97 1.43 -0.11 -1.92 118.68 126.57 1eav s LEU 76 Ca 0.04 0.10 0.05 0.00 -1.03 0.00 0.00 54.13 53.28 1eav s LEU 76 Cb -0.14 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.03 1eav s LEU 76 CO -0.11 0.13 0.41 0.42 0.23 0.00 0.00 176.35 177.43 1eav s THR 77 N 0.67 4.98 -0.04 5.49 -4.23 -0.96 -1.67 115.64 119.88 1eav s THR 77 Ca 0.06 -0.92 -0.00 0.00 -1.18 0.00 0.00 61.69 59.64 1eav s THR 77 Cb -0.13 -3.76 0.03 0.00 1.34 0.00 0.00 72.50 69.98 1eav s THR 77 CO 0.01 -0.32 0.02 -0.76 -0.54 0.00 0.00 174.62 173.03 1eav s LEU 78 N -4.07 0.81 0.00 4.79 1.43 -0.35 -4.65 118.68 116.64 1eav s LEU 78 Ca 0.37 -0.00 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 1eav s LEU 78 Cb -0.09 -0.22 0.00 0.00 0.03 0.00 0.00 46.19 45.90 1eav s LEU 78 CO 0.30 -0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.34 1eav n GLY 79 N 4.59 -0.64 2.19 -3.19 0.00 -1.26 0.46 105.19 107.34 1eav n GLY 79 Ca -0.18 -1.69 -0.09 0.00 0.00 0.00 0.00 46.02 44.06 1eav n GLY 79 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1eav n GLY 80 N -0.66 0.17 0.73 -0.02 0.00 -1.26 -4.68 105.19 99.47 1eav n GLY 80 Ca 0.00 -0.52 0.07 0.00 0.00 0.00 0.00 46.02 45.57 1eav n GLY 80 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1eav n THR 81 N -3.81 0.54 -0.94 2.61 -2.24 -1.26 -0.99 114.28 108.18 1eav n THR 81 Ca -0.11 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 60.91 1eav n THR 81 Cb 0.54 0.88 0.00 0.00 -2.10 0.00 0.00 70.33 69.64 1eav n THR 81 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1eav n GLY 82 N 0.85 1.08 0.05 3.38 0.00 -1.26 -0.67 105.19 108.61 1eav n GLY 82 Ca 0.12 -1.82 0.11 0.00 0.00 0.00 0.00 46.02 44.44 1eav n GLY 82 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1eav n PHE 83 N 0.00 0.37 -1.50 1.61 3.01 -1.26 -4.76 117.46 114.93 1eav n PHE 83 Ca 0.00 0.11 -0.43 0.00 1.01 0.00 0.00 57.45 58.13 1eav n PHE 83 Cb 0.00 -0.68 -0.01 0.00 -0.01 0.00 0.00 39.48 38.79 1eav n PHE 83 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1eav n THR 84 N -2.42 1.92 0.25 4.37 -1.04 -1.26 -4.86 114.28 111.24 1eav n THR 84 Ca -0.02 -0.50 0.10 0.00 -2.04 0.00 0.00 64.05 61.58 1eav n THR 84 Cb 0.56 -0.64 0.66 0.00 -1.82 0.00 0.00 70.33 69.10 1eav n THR 84 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 1eav h PRO 85 N 1.25 0.00 0.00 -2.82 0.11 -2.03 -1.68 132.00 126.83 1eav h PRO 85 Ca -0.38 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.66 1eav h PRO 85 Cb 1.38 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.48 1eav h PRO 85 CO 0.55 0.12 -0.32 0.00 -0.21 0.00 0.00 178.00 178.15 1eav h ARG 86 N 0.00 0.00 -6.09 1.05 2.47 -1.95 -3.43 114.38 106.43 1eav h ARG 86 Ca -0.00 0.00 -0.58 0.00 -1.26 0.00 0.00 59.98 58.13 1eav h ARG 86 Cb 0.27 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.58 1eav h ARG 86 CO 0.02 0.32 1.42 -0.51 0.56 0.00 0.00 179.97 181.78 1eav s ASP 87 N -6.33 5.62 -0.04 7.04 1.01 -0.63 -4.71 116.67 118.62 1eav s ASP 87 Ca 0.04 1.74 0.13 0.00 0.71 0.00 0.00 52.55 55.17 1eav s ASP 87 Cb 0.08 -2.52 0.24 0.00 1.01 0.00 0.00 42.92 41.73 1eav s ASP 87 CO 0.70 -1.85 1.11 1.33 0.21 0.00 0.00 175.17 176.66 1eav n VAL 88 N 7.57 0.54 -0.06 -1.27 0.24 -1.02 -4.80 118.33 119.53 1eav n VAL 88 Ca 0.27 -1.06 -0.13 0.00 -2.04 0.00 0.00 64.34 61.39 1eav n VAL 88 Cb 0.45 0.48 -0.06 0.00 -1.47 0.00 0.00 33.84 33.24 1eav n VAL 88 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1eav h THR 89 N 5.29 1.33 -0.68 3.34 2.02 -1.34 -1.98 112.91 120.89 1eav h THR 89 Ca -0.08 -1.26 -0.04 0.00 0.77 0.00 0.00 66.41 65.80 1eav h THR 89 Cb 1.47 1.78 -0.03 0.00 -1.74 0.00 0.00 68.15 69.62 1eav h THR 89 CO 0.03 0.38 0.26 -0.65 0.37 0.00 0.00 175.52 175.91 1eav h PRO 90 N 0.05 1.02 -0.97 6.66 0.11 -1.84 0.26 132.00 137.30 1eav h PRO 90 Ca 0.03 -0.19 0.03 0.00 0.11 0.00 0.00 66.00 65.98 1eav h PRO 90 Cb 0.65 -0.16 -0.06 0.00 0.11 0.00 0.00 31.00 31.55 1eav h PRO 90 CO 0.04 0.86 0.63 0.93 -0.21 0.00 0.00 178.00 180.25 1eav h GLU 91 N 0.97 1.19 -0.17 1.05 3.07 -1.85 0.30 114.58 119.14 1eav h GLU 91 Ca 0.22 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.88 1eav h GLU 91 Cb 0.23 -0.27 0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1eav h GLU 91 CO -0.02 0.79 -0.42 0.00 -1.40 0.00 0.00 179.01 177.96 1eav h ALA 92 N 1.43 0.28 -0.74 3.43 0.00 -0.25 -2.66 119.26 120.75 1eav h ALA 92 Ca 0.38 -0.46 0.07 0.00 0.00 0.00 0.00 54.91 54.90 1eav h ALA 92 Cb -0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1eav h ALA 92 CO -0.11 0.40 0.41 1.15 0.00 0.00 0.00 179.25 181.09 1eav h THR 93 N 0.24 0.94 -0.14 0.00 2.02 0.24 -2.69 112.91 113.52 1eav h THR 93 Ca -0.01 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 66.95 1eav h THR 93 Cb 1.03 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.58 1eav h THR 93 CO 0.09 0.13 0.09 0.11 0.37 0.00 0.00 175.52 176.32 1eav h LYS 94 N 0.73 0.08 0.00 6.66 1.57 -0.07 -1.53 116.57 124.01 1eav h LYS 94 Ca 0.34 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1eav h LYS 94 Cb 0.26 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1eav h LYS 94 CO -0.21 0.06 0.00 1.63 -0.57 0.00 0.00 179.45 180.35 1eav n LYS 95 N -4.51 0.17 -0.00 3.15 5.02 -1.02 -3.92 118.16 117.06 1eav n LYS 95 Ca -0.00 0.13 0.02 0.00 -2.02 0.00 0.00 58.31 56.44 1eav n LYS 95 Cb 0.15 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 1eav n LYS 95 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1eav n VAL 96 N -1.37 0.00 -2.17 -0.18 0.24 -0.60 -5.02 118.33 109.23 1eav n VAL 96 Ca 0.07 -0.26 -0.29 0.00 -2.04 0.00 0.00 64.34 61.83 1eav n VAL 96 Cb 0.18 0.73 0.03 0.00 -1.47 0.00 0.00 33.84 33.31 1eav n VAL 96 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1eav s ILE 97 N -1.76 3.89 -0.01 1.34 -4.36 -1.06 -4.76 121.20 114.47 1eav s ILE 97 Ca 0.00 0.31 0.02 0.00 -0.26 0.00 0.00 60.65 60.73 1eav s ILE 97 Cb 0.03 -3.57 -0.03 0.00 1.25 0.00 0.00 42.46 40.14 1eav s ILE 97 CO 0.15 -0.66 0.03 -0.62 0.24 0.00 0.00 174.94 174.08 1eav n GLU 98 N -2.72 2.04 -3.65 0.37 1.02 0.65 -4.98 120.64 113.37 1eav n GLU 98 Ca 0.05 -0.01 -0.18 0.00 -0.02 0.00 0.00 57.16 57.00 1eav n GLU 98 Cb 0.57 -1.06 -0.16 0.00 -0.02 0.00 0.00 31.44 30.77 1eav n GLU 98 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1eav s ARG 99 N -2.10 0.02 0.64 3.49 0.52 -0.90 -4.97 118.95 115.64 1eav s ARG 99 Ca -0.01 0.47 -0.13 0.00 -0.52 0.00 0.00 55.73 55.54 1eav s ARG 99 Cb 0.01 -0.46 -0.02 0.00 0.52 0.00 0.00 34.95 35.00 1eav s ARG 99 CO 0.09 -0.35 1.05 -1.21 0.02 0.00 0.00 175.30 174.90 1eav s GLU 100 N 2.26 3.25 -0.48 3.54 2.02 -1.26 -0.98 118.70 127.05 1eav s GLU 100 Ca 0.04 0.98 0.07 0.00 0.02 0.00 0.00 54.97 56.08 1eav s GLU 100 Cb -0.12 -2.03 0.25 0.00 0.10 0.00 0.00 34.13 32.32 1eav s GLU 100 CO -0.06 -0.85 0.59 0.25 0.02 0.00 0.00 175.26 175.22 1eav n THR 101 N -2.62 0.37 0.32 3.63 -2.24 -1.23 -4.82 114.28 107.68 1eav n THR 101 Ca 0.07 -4.42 0.20 0.00 -2.27 0.00 0.00 64.05 57.63 1eav n THR 101 Cb 0.53 -2.00 1.07 0.00 -2.10 0.00 0.00 70.33 67.83 1eav n THR 101 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1eav h PRO 102 N 4.14 0.00 -0.54 -0.78 0.13 -1.95 -0.52 132.00 132.48 1eav h PRO 102 Ca 0.12 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.19 1eav h PRO 102 Cb 0.80 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 1eav h PRO 102 CO 0.59 0.01 0.08 0.78 -0.23 0.00 0.00 178.00 179.24 1eav h GLY 103 N 0.27 0.92 1.08 1.56 0.00 -1.99 0.30 103.07 105.21 1eav h GLY 103 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 47.33 46.65 1eav h GLY 103 CO 0.00 0.53 -0.14 1.41 0.00 0.00 0.00 176.54 178.34 1eav h LEU 104 N 0.81 1.00 -1.21 3.11 3.38 -1.53 0.18 115.31 121.05 1eav h LEU 104 Ca 0.17 -0.37 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 1eav h LEU 104 Cb 0.37 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1eav h LEU 104 CO 0.01 1.14 -0.19 -0.07 0.09 0.00 0.00 178.44 179.42 1eav h LEU 105 N 0.85 0.31 -0.19 1.67 3.38 -1.41 -2.30 115.31 117.61 1eav h LEU 105 Ca 0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1eav h LEU 105 Cb 0.71 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1eav h LEU 105 CO 0.05 0.51 0.07 0.15 0.09 0.00 0.00 178.44 179.32 1eav h PHE 106 N 0.29 0.29 -0.39 1.13 3.57 0.59 -3.40 116.94 119.02 1eav h PHE 106 Ca 0.05 -0.02 -0.28 0.00 3.53 0.00 0.00 57.97 61.25 1eav h PHE 106 Cb 0.50 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.12 1eav h PHE 106 CO 0.01 0.34 0.91 0.28 -2.23 0.00 0.00 178.31 177.62 1eav n VAL 107 N -4.84 1.59 0.00 1.41 0.31 -0.04 -4.65 118.33 112.11 1eav n VAL 107 Ca -0.04 -1.66 0.00 0.00 -0.01 0.00 0.00 64.34 62.63 1eav n VAL 107 Cb 0.12 -2.14 0.00 0.00 -0.91 0.00 0.00 33.84 30.91 1eav n VAL 107 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 1eav n GLN 110 N 8.23 0.00 -0.35 5.55 7.27 -1.26 -4.56 117.38 132.25 1eav n GLN 110 Ca 0.44 0.00 0.06 0.00 0.07 0.00 0.00 57.00 57.57 1eav n GLN 110 Cb 0.47 0.00 0.22 0.00 2.41 0.00 0.00 30.24 33.34 1eav n GLN 110 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1eav h GLU 111 N 0.00 0.97 -0.04 3.69 4.39 -1.97 -1.56 114.58 120.06 1eav h GLU 111 Ca 0.00 -0.06 -0.17 0.00 0.34 0.00 0.00 59.36 59.47 1eav h GLU 111 Cb 0.00 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.42 1eav h GLU 111 CO 0.00 0.64 -0.74 0.66 -1.16 0.00 0.00 179.01 178.41 1eav h SER 112 N 1.00 0.29 -0.27 1.42 4.64 -1.94 -0.87 113.55 117.81 1eav h SER 112 Ca 0.48 -0.20 0.08 0.00 -0.47 0.00 0.00 61.79 61.68 1eav h SER 112 Cb 0.43 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1eav h SER 112 CO -0.25 0.93 0.28 -0.07 -0.87 0.00 0.00 176.83 176.84 1eav h LEU 113 N 0.16 0.00 0.00 5.97 3.38 -1.44 0.30 115.31 123.68 1eav h LEU 113 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1eav h LEU 113 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1eav h LEU 113 CO 0.12 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.94 1eav n LYS 114 N -3.85 0.00 -0.12 1.13 5.02 -0.33 -3.06 118.16 116.94 1eav n LYS 114 Ca 0.04 0.12 -0.17 0.00 -2.02 0.00 0.00 58.31 56.27 1eav n LYS 114 Cb 0.42 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.82 1eav n LYS 114 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1eav n ILE 115 N -1.50 1.44 -3.56 -0.18 5.41 0.98 -5.01 119.36 116.95 1eav n ILE 115 Ca 0.05 -0.57 -0.13 0.00 1.00 0.00 0.00 62.75 63.10 1eav n ILE 115 Cb 0.26 -1.33 -0.06 0.00 -0.71 0.00 0.00 39.64 37.80 1eav n ILE 115 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1eav s THR 116 N -2.50 0.00 0.40 1.39 -1.32 -0.69 -5.02 115.64 107.90 1eav s THR 116 Ca -0.32 0.00 0.35 0.00 -1.21 0.00 0.00 61.69 60.51 1eav s THR 116 Cb 0.09 -1.00 0.38 0.00 -1.51 0.00 0.00 72.50 70.45 1eav s THR 116 CO 0.60 0.00 2.14 -0.65 -2.21 0.00 0.00 174.62 174.50 1eav h PRO 117 N 2.80 0.00 0.00 7.08 0.11 -1.85 -2.23 132.00 137.91 1eav h PRO 117 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 1eav h PRO 117 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1eav h PRO 117 CO 0.32 0.04 0.00 1.19 -0.21 0.00 0.00 178.00 179.35 1eav n PHE 118 N -3.28 0.00 -0.01 0.65 3.01 -1.26 -4.54 117.46 112.03 1eav n PHE 118 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1eav n PHE 118 Cb 0.20 -0.34 0.00 0.00 -0.01 0.00 0.00 39.48 39.33 1eav n PHE 118 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1eav n ALA 119 N -1.34 0.96 0.00 4.37 0.00 -0.84 -4.37 120.51 119.30 1eav n ALA 119 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1eav n ALA 119 Cb 0.12 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.31 1eav n ALA 119 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1eav n LEU 121 N 3.73 0.00 -4.75 0.00 4.77 -1.26 -4.92 117.00 114.57 1eav n LEU 121 Ca 0.00 0.00 -0.40 0.00 -0.03 0.00 0.00 56.01 55.58 1eav n LEU 121 Cb 0.00 -0.10 -0.04 0.00 -2.33 0.00 0.00 43.42 40.94 1eav n LEU 121 CO 0.34 0.00 0.79 -0.55 -1.33 0.00 0.00 177.39 176.64 1eav s SER 122 N 0.00 7.28 -0.32 -1.43 0.15 -1.26 -4.41 113.70 113.71 1eav s SER 122 Ca 0.00 2.21 0.07 0.00 0.70 0.00 0.00 55.95 58.93 1eav s SER 122 Cb 0.00 -2.62 0.48 0.00 -1.71 0.00 0.00 66.02 62.17 1eav s SER 122 CO 0.00 -0.15 1.43 0.54 1.20 0.00 0.00 173.24 176.26 1eav n ARG 123 N 1.53 2.29 -1.66 5.44 1.74 0.15 -5.01 116.66 121.14 1eav n ARG 123 Ca -0.00 -3.44 -0.41 0.00 -0.77 0.00 0.00 57.85 53.23 1eav n ARG 123 Cb 0.45 -1.95 0.02 0.00 -1.02 0.00 0.00 32.46 29.96 1eav n ARG 123 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1eav n SER 124 N -1.01 1.83 -4.77 0.55 7.64 -1.26 -4.70 113.62 111.90 1eav n SER 124 Ca 0.37 1.04 -0.26 0.00 1.01 0.00 0.00 58.87 61.03 1eav n SER 124 Cb 0.95 -1.43 -0.06 0.00 -1.01 0.00 0.00 64.21 62.66 1eav n SER 124 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1eav s ALA 125 N -1.27 3.80 -0.08 -0.43 0.00 -1.26 -4.99 121.76 117.53 1eav s ALA 125 Ca 0.64 -1.70 -0.30 0.00 0.00 0.00 0.00 51.96 50.60 1eav s ALA 125 Cb -0.52 -0.36 0.10 0.00 0.00 0.00 0.00 23.12 22.35 1eav s ALA 125 CO 0.56 -0.20 0.85 0.00 0.00 0.00 0.00 175.76 176.98 1eav s ALA 126 N -2.68 -1.84 0.00 0.00 0.00 -1.26 -1.52 121.76 114.45 1eav s ALA 126 Ca 0.34 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.65 1eav s ALA 126 Cb 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.93 1eav s ALA 126 CO 0.19 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 175.95 1eav n GLY 127 N 0.58 -1.71 3.69 0.00 0.00 -0.19 -3.52 105.19 104.03 1eav n GLY 127 Ca -0.13 -1.10 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 1eav n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1eav s ILE 128 N -2.17 4.41 -0.09 -0.61 1.01 -0.15 0.03 121.20 123.62 1eav s ILE 128 Ca 0.00 -0.21 -0.00 0.00 0.00 0.00 0.00 60.65 60.44 1eav s ILE 128 Cb 0.00 -2.87 0.02 0.00 0.01 0.00 0.00 42.46 39.63 1eav s ILE 128 CO 0.00 0.59 -0.05 -0.60 0.00 0.00 0.00 174.94 174.88 1eav s ARG 129 N -0.77 1.22 7.00 2.79 3.52 -0.22 -0.25 118.95 132.25 1eav s ARG 129 Ca 0.12 -0.15 0.00 0.00 -0.13 0.00 0.00 55.73 55.57 1eav s ARG 129 Cb -0.12 -1.35 0.00 0.00 -1.56 0.00 0.00 34.95 31.92 1eav s ARG 129 CO 0.02 -0.25 0.00 0.41 -0.81 0.00 0.00 175.30 174.67 1eav n GLY 130 N 4.88 2.81 0.52 8.12 0.00 -1.26 -0.53 105.19 119.74 1eav n GLY 130 Ca -0.12 0.25 0.07 0.00 0.00 0.00 0.00 46.02 46.21 1eav n GLY 130 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1eav n SER 131 N 10.44 1.80 -4.42 1.61 3.41 -1.26 -4.99 113.62 120.21 1eav n SER 131 Ca 0.00 -3.68 -0.35 0.00 -0.26 0.00 0.00 58.87 54.58 1eav n SER 131 Cb 0.00 -0.50 -0.13 0.00 -0.26 0.00 0.00 64.21 63.32 1eav n SER 131 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1eav s THR 132 N -3.05 3.85 -0.16 6.66 2.01 0.31 -4.69 115.64 120.57 1eav s THR 132 Ca 0.36 -0.34 -0.22 0.00 0.31 0.00 0.00 61.69 61.80 1eav s THR 132 Cb 0.35 -2.75 -0.03 0.00 0.01 0.00 0.00 72.50 70.08 1eav s THR 132 CO -0.05 0.42 0.70 -0.22 -0.69 0.00 0.00 174.62 174.77 1eav s LEU 133 N 1.16 4.19 -0.11 4.42 2.96 -0.80 -1.05 118.68 129.46 1eav s LEU 133 Ca 0.03 1.00 0.03 0.00 -0.22 0.00 0.00 54.13 54.97 1eav s LEU 133 Cb -0.14 -3.02 -0.00 0.00 0.50 0.00 0.00 46.19 43.52 1eav s LEU 133 CO 0.01 -0.26 -0.21 -0.63 -1.32 0.00 0.00 176.35 173.94 1eav s ILE 134 N 1.69 2.33 -0.10 6.68 1.01 0.11 -1.43 121.20 131.49 1eav s ILE 134 Ca 0.33 -0.92 -0.00 0.00 0.00 0.00 0.00 60.65 60.06 1eav s ILE 134 Cb -0.16 -1.92 0.02 0.00 0.01 0.00 0.00 42.46 40.41 1eav s ILE 134 CO 0.13 0.55 -0.07 -0.63 0.00 0.00 0.00 174.94 174.92 1eav s ILE 135 N 0.40 0.90 0.94 2.92 1.01 -0.81 -1.02 121.20 125.55 1eav s ILE 135 Ca -0.15 -0.23 -0.15 0.00 0.00 0.00 0.00 60.65 60.11 1eav s ILE 135 Cb -0.17 -0.94 0.19 0.00 0.01 0.00 0.00 42.46 41.55 1eav s ILE 135 CO 0.07 0.34 1.31 0.20 0.00 0.00 0.00 174.94 176.86 1eav s ASN 136 N 1.63 3.27 0.10 3.58 0.01 -0.58 -2.25 114.94 120.70 1eav s ASN 136 Ca 0.03 0.32 0.03 0.00 -0.71 0.00 0.00 52.86 52.52 1eav s ASN 136 Cb -0.13 -0.41 -0.04 0.00 0.41 0.00 0.00 41.25 41.08 1eav s ASN 136 CO -0.06 -2.64 0.14 -2.84 -1.51 0.00 0.00 177.10 170.18 1eav s PRO 138 N -5.85 3.06 0.58 -0.60 0.02 -1.26 -4.72 135.00 126.23 1eav s PRO 138 Ca 0.73 -0.66 0.28 0.00 0.02 0.00 0.00 61.00 61.37 1eav s PRO 138 Cb -0.05 -2.81 1.59 0.00 0.02 0.00 0.00 34.50 33.26 1eav s PRO 138 CO 0.53 0.56 2.06 0.78 -0.33 0.00 0.00 177.00 180.59 1eav h GLY 139 N 2.99 0.00 -3.69 0.52 0.00 -1.87 -3.38 103.07 97.64 1eav h GLY 139 Ca -0.47 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 46.32 1eav h GLY 139 CO 0.68 0.00 0.69 0.70 0.00 0.00 0.00 176.54 178.61 1eav n ASN 140 N -3.86 3.34 -0.00 0.19 3.02 -1.26 -4.63 115.26 112.05 1eav n ASN 140 Ca 0.03 1.16 0.11 0.00 -0.03 0.00 0.00 54.58 55.85 1eav n ASN 140 Cb 0.40 -1.59 0.54 0.00 -0.61 0.00 0.00 39.78 38.52 1eav n ASN 140 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1eav h PRO 141 N 2.48 0.30 0.00 3.52 0.11 -1.88 -2.47 132.00 134.07 1eav h PRO 141 Ca -0.50 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.51 1eav h PRO 141 Cb 1.26 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 1eav h PRO 141 CO 0.62 0.20 -0.90 -0.91 -0.21 0.00 0.00 178.00 176.79 1eav h ASN 142 N 0.31 0.00 -0.66 -2.05 2.35 -1.96 -3.35 115.58 110.22 1eav h ASN 142 Ca 0.21 0.00 0.14 0.00 -0.55 0.00 0.00 56.30 56.10 1eav h ASN 142 Cb 0.43 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.69 1eav h ASN 142 CO -0.05 0.31 -0.04 0.00 -1.65 0.00 0.00 177.43 176.00 1eav h ALA 143 N 1.69 0.60 -0.41 -0.83 0.00 -1.77 0.14 119.26 118.68 1eav h ALA 143 Ca -0.06 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1eav h ALA 143 Cb 1.29 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1eav h ALA 143 CO 0.03 -0.41 0.04 0.28 0.00 0.00 0.00 179.25 179.19 1eav h VAL 144 N 0.08 1.21 -0.44 0.00 2.07 -1.69 0.13 116.25 117.60 1eav h VAL 144 Ca 0.34 -0.80 -0.08 0.00 0.82 0.00 0.00 66.70 66.98 1eav h VAL 144 Cb 0.56 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1eav h VAL 144 CO -0.60 0.28 -0.05 0.00 0.02 0.00 0.00 177.57 177.22 1eav h ALA 145 N 1.44 0.60 -0.08 1.67 0.00 -0.93 -3.20 119.26 118.76 1eav h ALA 145 Ca 0.13 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.56 1eav h ALA 145 Cb 0.32 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.96 1eav h ALA 145 CO 0.01 0.45 -0.67 0.93 0.00 0.00 0.00 179.25 179.96 1eav h GLU 146 N 0.65 0.59 -0.22 0.00 5.08 -0.85 -2.30 114.58 117.53 1eav h GLU 146 Ca 0.12 -0.53 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1eav h GLU 146 Cb 0.57 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1eav h GLU 146 CO 0.03 1.15 0.00 0.00 -1.00 0.00 0.00 179.01 179.20 1eav n GLU 149 N 0.50 0.00 0.13 0.00 2.13 -0.87 -2.17 120.64 120.36 1eav n GLU 149 Ca 0.00 0.00 -0.00 0.00 0.66 0.00 0.00 57.16 57.82 1eav n GLU 149 Cb 0.00 0.00 0.09 0.00 0.27 0.00 0.00 31.44 31.80 1eav n GLU 149 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1eav h ALA 150 N 0.00 0.73 0.00 4.31 0.00 -1.71 -3.32 119.26 119.26 1eav h ALA 150 Ca 0.00 -0.58 -0.28 0.00 0.00 0.00 0.00 54.91 54.04 1eav h ALA 150 Cb 0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 1eav h ALA 150 CO 0.00 0.80 -1.84 1.28 0.00 0.00 0.00 179.25 179.49 1eav n LEU 151 N -3.47 0.62 -0.29 0.00 4.77 -0.92 -4.57 117.00 113.13 1eav n LEU 151 Ca 0.00 0.29 0.23 0.00 -0.03 0.00 0.00 56.01 56.50 1eav n LEU 151 Cb 0.71 0.24 0.54 0.00 -2.33 0.00 0.00 43.42 42.57 1eav n LEU 151 CO 0.42 0.37 1.23 0.25 -1.33 0.00 0.00 177.39 178.32 1eav h LEU 152 N 0.00 0.38 -2.13 2.23 5.85 -1.85 0.18 115.31 119.97 1eav h LEU 152 Ca -0.33 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1eav h LEU 152 Cb 1.98 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 43.00 1eav h LEU 152 CO 0.06 0.10 0.00 -0.65 -0.34 0.00 0.00 178.44 177.61 1eav h PRO 153 N 0.35 0.00 0.00 5.25 0.11 -1.80 -3.30 132.00 132.61 1eav h PRO 153 Ca 0.54 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.65 1eav h PRO 153 Cb 1.47 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.58 1eav h PRO 153 CO -0.22 0.00 -0.20 0.00 -0.21 0.00 0.00 178.00 177.37 1eav n ALA 154 N -1.95 0.83 0.31 -0.75 0.00 0.58 -4.77 120.51 114.76 1eav n ALA 154 Ca -0.02 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.60 1eav n ALA 154 Cb 0.09 0.00 1.00 0.00 0.00 0.00 0.00 19.45 20.55 1eav n ALA 154 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1eav h LEU 155 N 0.00 0.00 0.59 0.00 5.85 -1.45 0.30 115.31 120.60 1eav h LEU 155 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 1eav h LEU 155 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 1eav h LEU 155 CO 0.00 0.01 -0.28 0.50 -0.34 0.00 0.00 178.44 178.33 1eav h LYS 156 N 0.00 -0.77 -0.88 1.25 3.64 -1.81 -0.21 116.57 117.78 1eav h LYS 156 Ca -0.00 0.05 0.13 0.00 -1.27 0.00 0.00 60.65 59.56 1eav h LYS 156 Cb 0.05 0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 1eav h LYS 156 CO 0.00 -0.47 0.57 1.25 -2.27 0.00 0.00 179.45 178.53 1eav h HIS 157 N -1.14 0.86 -0.22 1.91 2.76 -1.65 -1.22 115.15 116.44 1eav h HIS 157 Ca -0.08 0.02 0.02 0.00 -2.20 0.00 0.00 60.37 58.13 1eav h HIS 157 Cb 0.65 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 29.31 1eav h HIS 157 CO 0.00 0.34 0.09 0.00 -1.30 0.00 0.00 177.93 177.07 1eav h ALA 158 N 1.59 0.26 -0.13 5.26 0.00 -0.14 -0.62 119.26 125.48 1eav h ALA 158 Ca 0.43 0.01 -0.17 0.00 0.00 0.00 0.00 54.91 55.19 1eav h ALA 158 Cb 0.61 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1eav h ALA 158 CO -0.20 -0.32 -0.63 -0.07 0.00 0.00 0.00 179.25 178.04 1eav h LEU 159 N 0.21 0.51 -0.49 0.00 3.38 -0.02 -3.12 115.31 115.78 1eav h LEU 159 Ca 0.09 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1eav h LEU 159 Cb 0.04 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1eav h LEU 159 CO -0.08 1.01 0.29 0.50 0.09 0.00 0.00 178.44 180.25 1eav h LYS 160 N 0.33 0.56 -0.65 1.13 3.64 -0.88 -2.87 116.57 117.83 1eav h LYS 160 Ca -0.01 -0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.38 1eav h LYS 160 Cb 1.17 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 32.83 1eav h LYS 160 CO 0.11 0.37 0.43 1.96 -2.27 0.00 0.00 179.45 180.05 1eav h GLN 161 N 0.58 0.70 0.00 1.90 4.20 -1.06 -3.51 115.11 117.91 1eav h GLN 161 Ca 0.20 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1eav h GLN 161 Cb 0.03 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.65 1eav h GLN 161 CO -0.09 0.46 0.00 -0.89 -0.67 0.00 0.00 178.83 177.64