#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dia s SER 2 N 0.00 6.63 0.14 1.61 0.01 -1.26 -4.94 113.70 115.89 2dia s SER 2 Ca 0.00 -2.33 -0.24 0.00 1.31 0.00 0.00 55.95 54.69 2dia s SER 2 Cb 0.00 -2.26 -0.02 0.00 0.21 0.00 0.00 66.02 63.94 2dia s SER 2 CO 0.00 -0.77 1.27 -1.54 0.41 0.00 0.00 173.24 172.61 2dia n SER 3 N 4.94 -0.83 -4.95 2.44 3.41 -1.26 -4.46 113.62 112.91 2dia n SER 3 Ca 0.12 1.46 -0.24 0.00 -0.26 0.00 0.00 58.87 59.95 2dia n SER 3 Cb 0.46 -0.21 0.05 0.00 -0.26 0.00 0.00 64.21 64.25 2dia n SER 3 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dia s GLY 4 N -2.72 1.73 0.25 5.00 0.00 -1.26 -5.11 107.32 105.20 2dia s GLY 4 Ca -0.10 -1.06 0.10 0.00 0.00 0.00 0.00 44.72 43.66 2dia s GLY 4 CO 0.52 -0.73 -0.09 -0.56 0.00 0.00 0.00 173.10 172.24 2dia s SER 5 N -4.44 4.15 -0.23 1.64 0.01 -1.26 -5.06 113.70 108.50 2dia s SER 5 Ca 0.58 -0.76 -0.10 0.00 1.31 0.00 0.00 55.95 56.98 2dia s SER 5 Cb -0.11 -0.63 -0.17 0.00 0.21 0.00 0.00 66.02 65.33 2dia s SER 5 CO 0.42 0.04 -0.09 -1.20 0.41 0.00 0.00 173.24 172.81 2dia n SER 6 N -0.56 1.97 -4.80 2.44 7.64 -1.26 -4.99 113.62 114.06 2dia n SER 6 Ca -0.07 0.19 -0.24 0.00 1.01 0.00 0.00 58.87 59.76 2dia n SER 6 Cb 0.58 -0.74 -0.05 0.00 -1.01 0.00 0.00 64.21 63.00 2dia n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dia s GLY 7 N -5.70 1.58 0.84 0.23 0.00 -1.26 -5.11 107.32 97.91 2dia s GLY 7 Ca -0.33 -1.31 -0.11 0.00 0.00 0.00 0.00 44.72 42.97 2dia s GLY 7 CO 0.59 -1.33 1.09 2.56 0.00 0.00 0.00 173.10 176.01 2dia s PRO 8 N -3.42 1.68 0.35 2.90 0.04 -1.26 -4.51 135.00 130.78 2dia s PRO 8 Ca 0.32 0.96 -0.25 0.00 0.04 0.00 0.00 61.00 62.07 2dia s PRO 8 Cb -0.09 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.50 2dia s PRO 8 CO 0.24 -1.99 0.94 0.12 0.04 0.00 0.00 177.00 176.35 2dia s PHE 9 N -2.92 3.59 -0.30 0.56 2.19 -1.26 -3.02 117.98 116.81 2dia s PHE 9 Ca 0.62 1.73 -0.13 0.00 0.33 0.00 0.00 56.93 59.49 2dia s PHE 9 Cb -0.18 -2.90 0.16 0.00 -1.31 0.00 0.00 43.02 38.80 2dia s PHE 9 CO 0.57 0.13 0.91 -0.51 1.83 0.00 0.00 175.22 178.14 2dia s ASP 10 N -1.77 -0.72 0.44 6.13 1.01 -0.46 -4.86 116.67 116.44 2dia s ASP 10 Ca 0.53 0.84 0.23 0.00 0.71 0.00 0.00 52.55 54.86 2dia s ASP 10 Cb -0.16 1.76 0.99 0.00 1.01 0.00 0.00 42.92 46.52 2dia s ASP 10 CO 0.21 -0.14 1.87 1.55 0.21 0.00 0.00 175.17 178.87 2dia h PRO 11 N 7.70 0.00 0.00 8.23 0.13 -1.83 -2.80 132.00 143.42 2dia h PRO 11 Ca -0.16 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.90 2dia h PRO 11 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 2dia h PRO 11 CO 0.07 0.24 -0.30 0.77 -0.23 0.00 0.00 178.00 178.55 2dia h SER 12 N 0.00 0.00 1.16 1.44 0.02 -1.95 -2.52 113.55 111.71 2dia h SER 12 Ca -0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2dia h SER 12 Cb 0.67 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 2dia h SER 12 CO 0.03 0.30 -0.02 0.11 -1.14 0.00 0.00 176.83 176.12 2dia h LYS 13 N 0.00 0.00 -6.84 3.45 1.79 -1.84 -3.45 116.57 109.69 2dia h LYS 13 Ca -0.00 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 57.95 2dia h LYS 13 Cb 0.73 0.00 0.05 0.00 -1.58 0.00 0.00 32.23 31.43 2dia h LYS 13 CO 0.04 0.02 0.58 0.08 -1.08 0.00 0.00 179.45 179.09 2dia s VAL 14 N -3.60 3.02 -0.15 0.50 1.01 -0.95 -4.22 120.40 116.02 2dia s VAL 14 Ca 0.02 1.01 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2dia s VAL 14 Cb 0.08 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.84 2dia s VAL 14 CO 0.57 0.23 -0.14 -0.69 0.00 0.00 0.00 175.10 175.07 2dia s VAL 15 N -1.03 1.58 -0.05 2.92 1.01 -0.80 -4.82 120.40 119.21 2dia s VAL 15 Ca 0.48 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.88 2dia s VAL 15 Cb -0.37 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.52 2dia s VAL 15 CO 0.48 0.46 -0.25 0.00 0.00 0.00 0.00 175.10 175.79 2dia s ALA 16 N 1.45 2.10 0.37 5.51 0.00 -1.26 -0.07 121.76 129.85 2dia s ALA 16 Ca 0.04 -1.03 -0.10 0.00 0.00 0.00 0.00 51.96 50.87 2dia s ALA 16 Cb -0.13 -0.63 0.03 0.00 0.00 0.00 0.00 23.12 22.40 2dia s ALA 16 CO -0.10 0.43 0.66 -1.12 0.00 0.00 0.00 175.76 175.63 2dia s SER 17 N -0.25 0.39 0.00 0.00 0.01 -0.97 -5.00 113.70 107.87 2dia s SER 17 Ca -0.00 -1.28 0.00 0.00 1.31 0.00 0.00 55.95 55.97 2dia s SER 17 Cb -0.13 0.77 0.00 0.00 0.21 0.00 0.00 66.02 66.88 2dia s SER 17 CO 0.02 -1.52 0.00 0.61 0.41 0.00 0.00 173.24 172.76 2dia n GLY 18 N -0.55 2.97 0.18 3.44 0.00 -1.26 -1.51 105.19 108.46 2dia n GLY 18 Ca -0.04 -1.91 0.03 0.00 0.00 0.00 0.00 46.02 44.09 2dia n GLY 18 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dia h PRO 19 N 0.00 0.00 0.00 1.61 0.13 -1.91 -2.97 132.00 128.86 2dia h PRO 19 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2dia h PRO 19 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2dia h PRO 19 CO 0.00 0.41 -0.00 0.78 -0.23 0.00 0.00 178.00 178.96 2dia h GLY 20 N 1.53 0.00 1.02 1.56 0.00 -1.67 0.10 103.07 105.62 2dia h GLY 20 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2dia h GLY 20 CO 0.05 0.00 -0.35 1.04 0.00 0.00 0.00 176.54 177.28 2dia n LEU 21 N -3.96 0.50 -0.11 3.11 4.77 -1.12 -3.97 117.00 116.22 2dia n LEU 21 Ca -0.03 0.04 -0.16 0.00 -0.03 0.00 0.00 56.01 55.82 2dia n LEU 21 Cb 0.09 -0.26 -0.13 0.00 -2.33 0.00 0.00 43.42 40.78 2dia n LEU 21 CO 0.29 0.11 -1.25 -0.62 -1.33 0.00 0.00 177.39 174.58 2dia n GLU 22 N -1.32 0.67 -3.69 3.23 1.02 0.18 -4.83 120.64 115.90 2dia n GLU 22 Ca 0.08 0.12 -0.04 0.00 -0.02 0.00 0.00 57.16 57.30 2dia n GLU 22 Cb 0.33 -1.54 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 2dia n GLU 22 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 2dia s HIS 23 N -2.52 -0.16 0.27 -0.32 -3.43 -0.15 -4.67 115.29 104.31 2dia s HIS 23 Ca -0.28 -0.09 -0.07 0.00 -0.80 0.00 0.00 55.06 53.83 2dia s HIS 23 Cb 0.08 0.61 -0.01 0.00 -1.43 0.00 0.00 32.58 31.83 2dia s HIS 23 CO 0.67 -0.70 0.40 0.20 -2.00 0.00 0.00 174.74 173.31 2dia s GLY 24 N -2.85 1.06 -0.08 -1.38 0.00 -1.12 -4.10 107.32 98.85 2dia s GLY 24 Ca 0.11 -1.27 -0.06 0.00 0.00 0.00 0.00 44.72 43.50 2dia s GLY 24 CO -0.01 -0.92 0.21 1.25 0.00 0.00 0.00 173.10 173.63 2dia s LYS 25 N -3.72 0.20 -0.27 2.90 2.20 -1.26 -1.86 119.74 117.93 2dia s LYS 25 Ca 0.29 0.37 -0.34 0.00 -0.36 0.00 0.00 55.97 55.93 2dia s LYS 25 Cb 0.01 -0.00 -0.10 0.00 -1.51 0.00 0.00 37.83 36.22 2dia s LYS 25 CO 0.14 -0.09 2.12 0.28 -0.36 0.00 0.00 175.35 177.44 2dia n VAL 26 N 3.55 0.29 0.00 4.02 0.31 -0.71 0.08 118.33 125.87 2dia n VAL 26 Ca -0.19 -0.27 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 2dia n VAL 26 Cb 0.56 -1.85 0.00 0.00 -0.91 0.00 0.00 33.84 31.63 2dia n VAL 26 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dia n GLY 27 N 5.91 3.21 2.73 2.92 0.00 0.32 -4.34 105.19 115.94 2dia n GLY 27 Ca 0.35 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.15 2dia n GLY 27 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dia n GLU 28 N -1.32 -1.62 -4.11 1.61 -0.58 0.11 -4.90 120.64 109.84 2dia n GLU 28 Ca 0.00 -1.42 -0.28 0.00 -0.42 0.00 0.00 57.16 55.04 2dia n GLU 28 Cb 0.00 -1.09 -0.17 0.00 -0.57 0.00 0.00 31.44 29.62 2dia n GLU 28 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2dia s ALA 29 N -3.58 1.62 -0.75 0.62 0.00 -1.26 -4.15 121.76 114.25 2dia s ALA 29 Ca 0.54 -0.72 -0.26 0.00 0.00 0.00 0.00 51.96 51.52 2dia s ALA 29 Cb -0.03 -0.93 0.02 0.00 0.00 0.00 0.00 23.12 22.17 2dia s ALA 29 CO 0.39 -0.30 1.49 0.20 0.00 0.00 0.00 175.76 177.54 2dia s GLY 30 N 1.40 0.71 -0.14 0.00 0.00 -0.73 -4.86 107.32 103.71 2dia s GLY 30 Ca 0.01 -1.31 -0.29 0.00 0.00 0.00 0.00 44.72 43.13 2dia s GLY 30 CO -0.07 2.90 1.89 1.08 0.00 0.00 0.00 173.10 178.90 2dia s LEU 31 N 6.74 3.93 -0.04 0.66 1.43 -1.26 -3.65 118.68 126.49 2dia s LEU 31 Ca 0.47 2.01 0.03 0.00 -1.03 0.00 0.00 54.13 55.61 2dia s LEU 31 Cb -0.08 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.62 2dia s LEU 31 CO 0.12 -1.40 -0.13 -0.76 0.23 0.00 0.00 176.35 174.41 2dia s LEU 32 N 5.88 1.82 -0.14 1.79 1.43 0.13 -2.78 118.68 126.81 2dia s LEU 32 Ca 0.85 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.69 2dia s LEU 32 Cb -0.33 -0.77 0.02 0.00 0.03 0.00 0.00 46.19 45.14 2dia s LEU 32 CO 0.34 0.10 -0.17 -0.55 0.23 0.00 0.00 176.35 176.31 2dia s SER 33 N 0.18 2.77 -0.38 2.29 0.15 -0.57 -1.02 113.70 117.12 2dia s SER 33 Ca -0.05 -0.52 -0.09 0.00 0.70 0.00 0.00 55.95 55.99 2dia s SER 33 Cb -0.11 -1.25 0.05 0.00 -1.71 0.00 0.00 66.02 63.00 2dia s SER 33 CO 0.02 -0.01 0.20 -0.69 1.20 0.00 0.00 173.24 173.96 2dia s VAL 34 N 1.22 4.19 -0.37 4.45 1.01 -0.40 -2.30 120.40 128.19 2dia s VAL 34 Ca 0.00 -1.16 -0.14 0.00 0.00 0.00 0.00 61.98 60.68 2dia s VAL 34 Cb -0.14 -3.44 -0.00 0.00 0.00 0.00 0.00 36.38 32.80 2dia s VAL 34 CO -0.07 -0.33 0.27 -0.62 0.00 0.00 0.00 175.10 174.34 2dia s ASP 35 N 1.72 6.08 0.01 3.32 -1.08 0.89 -1.73 116.67 125.89 2dia s ASP 35 Ca 0.01 -0.65 -0.07 0.00 -0.52 0.00 0.00 52.55 51.33 2dia s ASP 35 Cb -0.21 -2.15 -0.05 0.00 -1.46 0.00 0.00 42.92 39.06 2dia s ASP 35 CO 0.04 -0.33 0.27 0.00 0.52 0.00 0.00 175.17 175.67 2dia n SER 37 N 1.14 0.05 -0.35 0.00 2.88 -1.26 -4.91 113.62 111.18 2dia n SER 37 Ca -0.11 0.01 0.08 0.00 -1.33 0.00 0.00 58.87 57.52 2dia n SER 37 Cb 0.53 -0.01 0.16 0.00 -0.75 0.00 0.00 64.21 64.13 2dia n SER 37 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dia n GLU 38 N -2.56 1.30 0.00 -1.46 1.02 -1.26 -4.70 120.64 112.97 2dia n GLU 38 Ca 0.00 -2.77 0.07 0.00 -0.02 0.00 0.00 57.16 54.44 2dia n GLU 38 Cb 0.00 -1.45 0.40 0.00 -0.02 0.00 0.00 31.44 30.37 2dia n GLU 38 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dia n ALA 39 N -1.18 1.91 -0.99 0.62 0.00 -1.26 -4.09 120.51 115.52 2dia n ALA 39 Ca 0.16 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2dia n ALA 39 Cb 0.68 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.89 2dia n ALA 39 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dia n GLY 40 N -0.05 0.98 0.05 0.00 0.00 -1.17 -1.36 105.19 103.64 2dia n GLY 40 Ca 0.08 -0.75 -0.00 0.00 0.00 0.00 0.00 46.02 45.35 2dia n GLY 40 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dia n PRO 41 N 0.00 -1.05 0.00 1.61 -0.04 -1.26 -4.90 135.00 129.36 2dia n PRO 41 Ca 0.00 -0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 2dia n PRO 41 Cb 0.00 -0.02 0.00 0.00 -0.04 0.00 0.00 33.50 33.44 2dia n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dia n GLY 42 N 2.34 1.50 3.17 0.55 0.00 -1.26 -4.78 105.19 106.70 2dia n GLY 42 Ca 0.00 -2.21 -0.28 0.00 0.00 0.00 0.00 46.02 43.53 2dia n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dia s ALA 43 N -1.46 1.74 -0.02 4.61 0.00 -1.26 -4.82 121.76 120.55 2dia s ALA 43 Ca 0.00 -0.79 -0.17 0.00 0.00 0.00 0.00 51.96 51.00 2dia s ALA 43 Cb 0.00 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.47 2dia s ALA 43 CO 0.00 0.30 0.48 -1.17 0.00 0.00 0.00 175.76 175.37 2dia s LEU 44 N 0.09 4.41 -0.13 0.00 2.96 -1.26 -1.65 118.68 123.10 2dia s LEU 44 Ca -0.07 1.00 -0.11 0.00 -0.22 0.00 0.00 54.13 54.73 2dia s LEU 44 Cb -0.13 -2.72 0.04 0.00 0.50 0.00 0.00 46.19 43.87 2dia s LEU 44 CO 0.04 0.18 0.34 -0.83 -1.32 0.00 0.00 176.35 174.76 2dia s GLY 45 N -0.42 -0.26 0.15 7.98 0.00 -0.95 -5.03 107.32 108.79 2dia s GLY 45 Ca 0.26 1.02 0.10 0.00 0.00 0.00 0.00 44.72 46.11 2dia s GLY 45 CO 0.14 0.94 -0.24 -2.27 0.00 0.00 0.00 173.10 171.67 2dia s LEU 46 N 0.36 2.37 -0.14 0.66 2.96 -1.26 -1.02 118.68 122.60 2dia s LEU 46 Ca -0.01 -0.79 -0.04 0.00 -0.22 0.00 0.00 54.13 53.06 2dia s LEU 46 Cb -0.03 -1.11 0.05 0.00 0.50 0.00 0.00 46.19 45.60 2dia s LEU 46 CO -0.01 0.12 0.07 -0.70 -1.32 0.00 0.00 176.35 174.51 2dia s GLU 47 N -2.33 0.14 -0.15 1.98 2.12 0.93 -4.98 118.70 116.42 2dia s GLU 47 Ca 0.15 -0.02 -0.15 0.00 0.36 0.00 0.00 54.97 55.31 2dia s GLU 47 Cb -0.09 -1.54 -0.04 0.00 0.26 0.00 0.00 34.13 32.71 2dia s GLU 47 CO 0.07 -0.57 0.36 0.00 -0.54 0.00 0.00 175.26 174.57 2dia s ALA 48 N 2.10 3.55 -0.11 6.30 0.00 -1.26 -2.18 121.76 130.15 2dia s ALA 48 Ca 0.02 -0.36 -0.06 0.00 0.00 0.00 0.00 51.96 51.57 2dia s ALA 48 Cb -0.15 -2.48 0.05 0.00 0.00 0.00 0.00 23.12 20.54 2dia s ALA 48 CO -0.07 0.06 0.26 0.08 0.00 0.00 0.00 175.76 176.09 2dia s VAL 49 N 0.52 -0.05 0.47 0.00 1.01 -1.24 -2.72 120.40 118.39 2dia s VAL 49 Ca 0.20 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.25 2dia s VAL 49 Cb -0.14 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.79 2dia s VAL 49 CO 0.06 0.06 0.81 -0.55 0.00 0.00 0.00 175.10 175.48 2dia s SER 50 N 1.31 6.36 0.55 3.32 0.15 -0.45 -0.14 113.70 124.80 2dia s SER 50 Ca -0.09 1.06 0.33 0.00 0.70 0.00 0.00 55.95 57.95 2dia s SER 50 Cb -0.10 -2.30 1.49 0.00 -1.71 0.00 0.00 66.02 63.39 2dia s SER 50 CO -0.09 -0.54 1.85 -2.24 1.20 0.00 0.00 173.24 173.42 2dia h ASP 51 N 0.56 0.00 -0.58 5.45 2.03 -1.58 0.72 116.42 123.01 2dia h ASP 51 Ca -0.47 0.00 -0.25 0.00 -0.73 0.00 0.00 57.03 55.58 2dia h ASP 51 Cb 1.20 0.00 -0.15 0.00 -0.83 0.00 0.00 39.33 39.55 2dia h ASP 51 CO 0.62 0.00 0.32 -1.54 -1.03 0.00 0.00 179.24 177.61 2dia n SER 52 N -4.12 3.65 -3.48 4.15 3.41 -1.26 -4.89 113.62 111.08 2dia n SER 52 Ca 0.19 -2.94 -0.22 0.00 -0.26 0.00 0.00 58.87 55.65 2dia n SER 52 Cb 1.02 -0.70 0.06 0.00 -0.26 0.00 0.00 64.21 64.33 2dia n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dia n GLY 53 N -0.32 -0.92 3.14 5.00 0.00 0.25 -4.99 105.19 107.36 2dia n GLY 53 Ca 0.34 0.44 -0.34 0.00 0.00 0.00 0.00 46.02 46.46 2dia n GLY 53 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dia s THR 54 N -3.46 2.67 -0.26 2.61 2.01 -1.20 -4.84 115.64 113.16 2dia s THR 54 Ca 0.36 -1.40 -0.29 0.00 0.31 0.00 0.00 61.69 60.68 2dia s THR 54 Cb -0.08 -2.50 0.01 0.00 0.01 0.00 0.00 72.50 69.94 2dia s THR 54 CO 0.79 -0.01 1.05 -0.54 -0.69 0.00 0.00 174.62 175.22 2dia s LYS 55 N 1.21 4.19 0.62 4.92 3.01 -1.26 -1.33 119.74 131.10 2dia s LYS 55 Ca -0.05 1.25 -0.02 0.00 -1.01 0.00 0.00 55.97 56.13 2dia s LYS 55 Cb -0.19 -3.68 0.05 0.00 -1.01 0.00 0.00 37.83 33.00 2dia s LYS 55 CO -0.03 -0.73 0.89 0.00 0.51 0.00 0.00 175.35 175.98 2dia s ALA 56 N 3.37 3.56 -0.35 5.17 0.00 -1.10 -4.95 121.76 127.47 2dia s ALA 56 Ca 0.44 -1.15 -0.24 0.00 0.00 0.00 0.00 51.96 51.01 2dia s ALA 56 Cb -0.14 -2.31 0.01 0.00 0.00 0.00 0.00 23.12 20.68 2dia s ALA 56 CO 0.10 -1.01 0.82 -2.00 0.00 0.00 0.00 175.76 173.66 2dia s GLU 57 N -4.99 3.84 0.05 0.00 2.12 -1.22 -4.73 118.70 113.77 2dia s GLU 57 Ca 0.59 0.46 0.07 0.00 0.36 0.00 0.00 54.97 56.45 2dia s GLU 57 Cb -0.10 -3.78 -0.03 0.00 0.26 0.00 0.00 34.13 30.47 2dia s GLU 57 CO 0.41 -0.82 -0.15 0.08 -0.54 0.00 0.00 175.26 174.24 2dia s VAL 58 N 3.14 2.99 -0.10 3.70 1.01 -1.26 -1.67 120.40 128.21 2dia s VAL 58 Ca 0.33 -1.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.09 2dia s VAL 58 Cb -0.13 -2.29 0.04 0.00 0.00 0.00 0.00 36.38 34.00 2dia s VAL 58 CO 0.16 0.30 0.24 -0.55 0.00 0.00 0.00 175.10 175.25 2dia s SER 59 N -1.58 -0.26 -0.16 3.32 0.15 -0.94 -5.00 113.70 109.24 2dia s SER 59 Ca 0.16 0.50 -0.01 0.00 0.70 0.00 0.00 55.95 57.31 2dia s SER 59 Cb -0.11 0.42 -0.01 0.00 -1.71 0.00 0.00 66.02 64.62 2dia s SER 59 CO 0.07 -0.14 -0.12 -0.63 1.20 0.00 0.00 173.24 173.62 2dia s ILE 60 N 0.94 2.99 -0.15 6.45 1.01 -1.26 -2.27 121.20 128.91 2dia s ILE 60 Ca -0.07 -0.66 -0.09 0.00 0.00 0.00 0.00 60.65 59.83 2dia s ILE 60 Cb -0.08 -2.28 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 2dia s ILE 60 CO -0.06 0.50 0.17 -1.58 0.00 0.00 0.00 174.94 173.97 2dia s GLN 61 N 0.75 3.83 -0.23 2.79 2.00 -0.92 -4.94 119.66 122.93 2dia s GLN 61 Ca -0.05 -0.11 -0.09 0.00 -2.00 0.00 0.00 55.36 53.11 2dia s GLN 61 Cb -0.15 -3.30 -0.04 0.00 0.80 0.00 0.00 33.01 30.31 2dia s GLN 61 CO 0.01 0.54 0.13 -0.80 -0.50 0.00 0.00 175.29 174.67 2dia s ASN 62 N -0.37 5.83 0.09 6.67 -0.87 -1.26 -2.62 114.94 122.40 2dia s ASN 62 Ca 0.13 0.04 0.08 0.00 -1.57 0.00 0.00 52.86 51.54 2dia s ASN 62 Cb -0.12 -2.04 -0.04 0.00 -0.02 0.00 0.00 41.25 39.03 2dia s ASN 62 CO 0.02 0.06 -0.16 0.20 -2.57 0.00 0.00 177.10 174.65 2dia s ASN 63 N 1.08 3.97 -0.18 -1.22 0.01 -1.22 -5.02 114.94 112.35 2dia s ASN 63 Ca 0.06 -0.49 -0.01 0.00 -0.71 0.00 0.00 52.86 51.71 2dia s ASN 63 Cb -0.14 -0.62 0.08 0.00 0.41 0.00 0.00 41.25 40.98 2dia s ASN 63 CO 0.04 0.20 2.20 0.29 -1.51 0.00 0.00 177.10 178.32 2dia n LYS 64 N 0.98 1.56 0.00 -0.60 4.01 -1.26 -3.71 118.16 119.14 2dia n LYS 64 Ca -0.15 -0.99 0.00 0.00 -0.51 0.00 0.00 58.31 56.66 2dia n LYS 64 Cb 0.52 -1.45 0.00 0.00 -0.51 0.00 0.00 35.03 33.59 2dia n LYS 64 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2dia n ASP 65 N 0.99 2.39 0.00 4.39 2.03 -1.26 -5.05 116.55 120.04 2dia n ASP 65 Ca 0.21 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.52 2dia n ASP 65 Cb 0.57 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 2dia n ASP 65 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dia n GLY 66 N 2.80 0.83 3.18 0.27 0.00 -1.24 -5.11 105.19 105.92 2dia n GLY 66 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 2dia n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dia s THR 67 N -0.83 0.04 -0.02 2.61 -4.23 -1.26 -2.91 115.64 109.03 2dia s THR 67 Ca 0.00 -1.96 0.01 0.00 -1.18 0.00 0.00 61.69 58.56 2dia s THR 67 Cb 0.00 -2.30 0.02 0.00 1.34 0.00 0.00 72.50 71.55 2dia s THR 67 CO 0.00 -0.20 -0.02 -0.31 -0.54 0.00 0.00 174.62 173.55 2dia s TYR 68 N -4.11 0.33 -0.67 3.99 1.51 -0.70 -3.43 117.35 114.26 2dia s TYR 68 Ca 0.32 -0.03 -0.16 0.00 -1.01 0.00 0.00 57.07 56.19 2dia s TYR 68 Cb 0.07 -0.34 0.16 0.00 -0.11 0.00 0.00 41.96 41.74 2dia s TYR 68 CO 0.08 -0.08 0.66 0.00 -1.11 0.00 0.00 175.55 175.09 2dia s ALA 69 N 0.58 3.77 0.02 3.71 0.00 -1.08 -1.28 121.76 127.48 2dia s ALA 69 Ca -0.06 -2.80 -0.13 0.00 0.00 0.00 0.00 51.96 48.96 2dia s ALA 69 Cb -0.09 -3.44 -0.06 0.00 0.00 0.00 0.00 23.12 19.54 2dia s ALA 69 CO -0.01 -2.21 0.40 0.08 0.00 0.00 0.00 175.76 174.02 2dia s VAL 70 N 1.26 5.05 -0.00 0.00 1.01 -0.19 -2.17 120.40 125.37 2dia s VAL 70 Ca 0.11 0.74 -0.07 0.00 0.00 0.00 0.00 61.98 62.76 2dia s VAL 70 Cb -0.21 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2dia s VAL 70 CO -0.02 0.51 0.14 -0.89 0.00 0.00 0.00 175.10 174.84 2dia s THR 71 N -1.16 0.08 -0.03 3.92 2.01 -0.96 -0.69 115.64 118.81 2dia s THR 71 Ca 0.26 -0.66 -0.00 0.00 0.31 0.00 0.00 61.69 61.60 2dia s THR 71 Cb -0.16 -0.42 0.03 0.00 0.01 0.00 0.00 72.50 71.96 2dia s THR 71 CO 0.14 -0.36 0.02 -0.72 -0.69 0.00 0.00 174.62 173.02 2dia s TYR 72 N -1.31 0.17 -0.48 4.92 -0.85 -1.24 -2.21 117.35 116.35 2dia s TYR 72 Ca -0.14 0.09 -0.08 0.00 -0.52 0.00 0.00 57.07 56.43 2dia s TYR 72 Cb -0.07 -0.37 0.12 0.00 0.38 0.00 0.00 41.96 42.02 2dia s TYR 72 CO 0.01 -0.14 0.34 0.08 -1.52 0.00 0.00 175.55 174.33 2dia s VAL 73 N 1.31 4.07 -0.07 -3.49 1.01 -0.67 -1.77 120.40 120.79 2dia s VAL 73 Ca -0.06 -1.94 -0.30 0.00 0.00 0.00 0.00 61.98 59.69 2dia s VAL 73 Cb -0.13 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2dia s VAL 73 CO -0.03 -0.78 1.51 -2.16 0.00 0.00 0.00 175.10 173.64 2dia s PRO 74 N 1.19 4.21 -0.01 2.72 0.04 -1.26 -3.43 135.00 138.47 2dia s PRO 74 Ca 0.07 2.02 -0.21 0.00 0.04 0.00 0.00 61.00 62.92 2dia s PRO 74 Cb -0.25 -3.84 -0.22 0.00 0.04 0.00 0.00 34.50 30.24 2dia s PRO 74 CO -0.02 -0.76 1.12 -0.07 0.04 0.00 0.00 177.00 177.31 2dia h LEU 75 N 9.69 0.40 -9.18 -3.56 3.38 -1.92 0.92 115.31 115.04 2dia h LEU 75 Ca -0.36 -0.72 -0.67 0.00 0.09 0.00 0.00 57.88 56.22 2dia h LEU 75 Cb 1.16 -0.12 -0.17 0.00 0.09 0.00 0.00 40.66 41.62 2dia h LEU 75 CO 0.95 1.06 -0.76 0.28 0.09 0.00 0.00 178.44 180.06 2dia s THR 76 N -3.37 3.22 0.43 0.22 -1.32 -1.26 -4.64 115.64 108.92 2dia s THR 76 Ca -0.14 -1.25 -0.22 0.00 -1.21 0.00 0.00 61.69 58.87 2dia s THR 76 Cb 0.03 -2.47 -0.09 0.00 -1.51 0.00 0.00 72.50 68.45 2dia s THR 76 CO 0.78 0.17 1.01 0.00 -2.21 0.00 0.00 174.62 174.37 2dia s ALA 77 N -1.14 3.01 0.00 11.08 0.00 -1.26 -4.84 121.76 128.60 2dia s ALA 77 Ca 0.19 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.72 2dia s ALA 77 Cb -0.11 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.79 2dia s ALA 77 CO 0.11 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.17 2dia n GLY 78 N -0.14 2.17 3.69 0.00 0.00 -1.04 -5.01 105.19 104.86 2dia n GLY 78 Ca 0.07 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 2dia n GLY 78 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dia s MET 79 N -1.74 4.23 0.21 1.61 -1.94 -1.26 -2.83 119.30 117.58 2dia s MET 79 Ca 0.00 2.23 0.07 0.00 -1.71 0.00 0.00 55.69 56.28 2dia s MET 79 Cb 0.00 -3.53 -0.04 0.00 2.01 0.00 0.00 34.83 33.27 2dia s MET 79 CO 0.00 -0.66 0.08 0.71 -0.01 0.00 0.00 175.02 175.14 2dia s TYR 80 N 2.34 2.95 -0.52 -0.03 1.51 -0.94 -1.39 117.35 121.28 2dia s TYR 80 Ca 0.70 -0.12 0.04 0.00 -1.01 0.00 0.00 57.07 56.68 2dia s TYR 80 Cb -0.38 -1.37 0.13 0.00 -0.11 0.00 0.00 41.96 40.23 2dia s TYR 80 CO 0.31 0.54 0.26 0.99 -1.11 0.00 0.00 175.55 176.54 2dia s THR 81 N -1.97 2.66 -0.01 -0.71 2.01 0.80 -2.36 115.64 116.06 2dia s THR 81 Ca 0.30 -3.25 -0.30 0.00 0.31 0.00 0.00 61.69 58.75 2dia s THR 81 Cb -0.08 -2.84 -0.06 0.00 0.01 0.00 0.00 72.50 69.53 2dia s THR 81 CO 0.22 -0.79 1.52 -0.76 -0.69 0.00 0.00 174.62 174.11 2dia s LEU 82 N -0.22 4.32 -0.21 4.42 1.43 -0.82 -3.68 118.68 123.92 2dia s LEU 82 Ca 0.17 2.21 0.01 0.00 -1.03 0.00 0.00 54.13 55.48 2dia s LEU 82 Cb -0.25 -3.55 0.05 0.00 0.03 0.00 0.00 46.19 42.46 2dia s LEU 82 CO -0.01 -0.82 -0.09 -0.89 0.23 0.00 0.00 176.35 174.78 2dia s THR 83 N 2.96 1.67 -0.12 5.49 2.01 -0.93 -0.92 115.64 125.80 2dia s THR 83 Ca 0.68 -1.13 0.02 0.00 0.31 0.00 0.00 61.69 61.57 2dia s THR 83 Cb -0.33 -1.79 -0.00 0.00 0.01 0.00 0.00 72.50 70.38 2dia s THR 83 CO 0.28 0.08 -0.19 -0.32 -0.69 0.00 0.00 174.62 173.78 2dia s MET 84 N 1.37 3.17 -0.12 4.92 0.00 -1.26 -0.05 119.30 127.33 2dia s MET 84 Ca -0.03 -0.80 -0.00 0.00 0.00 0.00 0.00 55.69 54.86 2dia s MET 84 Cb -0.17 -2.46 0.02 0.00 0.00 0.00 0.00 34.83 32.22 2dia s MET 84 CO -0.07 0.14 -0.09 0.15 0.00 0.00 0.00 175.02 175.14 2dia s LYS 85 N 0.47 1.74 -0.24 4.11 1.02 -0.19 -2.84 119.74 123.82 2dia s LYS 85 Ca -0.13 -0.34 -0.07 0.00 0.02 0.00 0.00 55.97 55.45 2dia s LYS 85 Cb -0.17 -1.72 -0.03 0.00 -0.52 0.00 0.00 37.83 35.40 2dia s LYS 85 CO 0.05 -0.25 0.05 -0.47 -0.92 0.00 0.00 175.35 173.81 2dia s TYR 86 N 1.62 3.07 -1.60 3.18 6.14 0.42 -2.24 117.35 127.94 2dia s TYR 86 Ca 0.04 -0.48 -0.00 0.00 0.64 0.00 0.00 57.07 57.27 2dia s TYR 86 Cb -0.13 -2.20 0.00 0.00 0.42 0.00 0.00 41.96 40.06 2dia s TYR 86 CO -0.09 -0.36 0.03 0.41 0.64 0.00 0.00 175.55 176.19 2dia n GLY 87 N 4.79 -0.41 2.45 8.97 0.00 -0.66 -1.27 105.19 119.06 2dia n GLY 87 Ca -0.17 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.77 2dia n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dia n GLY 88 N -1.04 0.76 3.15 -0.02 0.00 -1.26 -4.91 105.19 101.87 2dia n GLY 88 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 2dia n GLY 88 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dia s GLU 89 N -0.03 2.60 0.60 1.61 2.02 -0.40 -5.09 118.70 120.02 2dia s GLU 89 Ca 0.00 -0.72 -0.19 0.00 0.02 0.00 0.00 54.97 54.07 2dia s GLU 89 Cb 0.00 -2.03 -0.03 0.00 0.10 0.00 0.00 34.13 32.17 2dia s GLU 89 CO 0.00 0.10 1.24 1.28 0.02 0.00 0.00 175.26 177.90 2dia n LEU 90 N 3.71 5.28 -4.94 1.80 4.77 -1.26 -0.44 117.00 125.92 2dia n LEU 90 Ca -0.20 0.88 -0.24 0.00 -0.03 0.00 0.00 56.01 56.42 2dia n LEU 90 Cb 0.52 -1.52 -0.01 0.00 -2.33 0.00 0.00 43.42 40.08 2dia n LEU 90 CO 0.27 -1.06 0.18 0.68 -1.33 0.00 0.00 177.39 176.12 2dia s VAL 91 N -1.38 5.06 -2.00 4.08 -7.23 -1.13 -4.77 120.40 113.03 2dia s VAL 91 Ca 0.77 -0.47 0.11 0.00 -1.81 0.00 0.00 61.98 60.59 2dia s VAL 91 Cb -0.40 -3.85 0.31 0.00 0.56 0.00 0.00 36.38 33.00 2dia s VAL 91 CO 0.45 -0.55 1.08 -0.81 -0.31 0.00 0.00 175.10 174.96 2dia n PRO 92 N -1.80 0.49 -0.09 4.82 -0.04 -1.26 -1.83 135.00 135.29 2dia n PRO 92 Ca -0.05 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.45 2dia n PRO 92 Cb 0.56 -1.35 0.08 0.00 -0.04 0.00 0.00 33.50 32.76 2dia n PRO 92 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2dia n HIS 93 N -0.85 0.18 -3.67 0.54 8.25 -1.26 -5.02 115.22 113.39 2dia n HIS 93 Ca 0.08 -0.63 -0.14 0.00 -0.26 0.00 0.00 57.72 56.77 2dia n HIS 93 Cb 0.04 -0.09 -0.07 0.00 1.12 0.00 0.00 29.99 30.99 2dia n HIS 93 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2dia s PHE 94 N -1.54 -0.30 0.63 4.41 0.40 -0.76 -4.15 117.98 116.66 2dia s PHE 94 Ca 0.15 0.38 -0.16 0.00 -0.60 0.00 0.00 56.93 56.70 2dia s PHE 94 Cb 0.11 0.21 -0.01 0.00 0.51 0.00 0.00 43.02 43.84 2dia s PHE 94 CO 0.05 -0.52 1.11 -1.25 0.70 0.00 0.00 175.22 175.31 2dia s PRO 95 N -1.91 2.94 -0.11 0.24 0.04 -1.26 -4.38 135.00 130.56 2dia s PRO 95 Ca -0.09 1.44 -0.02 0.00 0.04 0.00 0.00 61.00 62.37 2dia s PRO 95 Cb -0.02 -1.96 0.04 0.00 0.04 0.00 0.00 34.50 32.59 2dia s PRO 95 CO 0.02 -1.15 0.02 0.00 0.04 0.00 0.00 177.00 175.94 2dia s ALA 96 N -2.20 0.72 0.23 8.56 0.00 -0.10 -4.97 121.76 124.00 2dia s ALA 96 Ca 0.68 -0.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.07 2dia s ALA 96 Cb -0.21 -0.89 -0.09 0.00 0.00 0.00 0.00 23.12 21.94 2dia s ALA 96 CO 0.38 -0.73 1.00 1.03 0.00 0.00 0.00 175.76 177.44 2dia s ARG 97 N 1.97 4.76 -0.08 0.00 1.81 -1.26 -1.94 118.95 124.21 2dia s ARG 97 Ca 0.03 1.59 -0.03 0.00 -1.72 0.00 0.00 55.73 55.60 2dia s ARG 97 Cb -0.14 -3.27 0.05 0.00 -0.45 0.00 0.00 34.95 31.14 2dia s ARG 97 CO -0.06 0.37 0.16 0.08 -0.68 0.00 0.00 175.30 175.17 2dia s VAL 98 N -0.97 -0.24 0.21 3.52 1.01 -0.99 -4.98 120.40 117.96 2dia s VAL 98 Ca 0.43 0.33 -0.30 0.00 0.00 0.00 0.00 61.98 62.44 2dia s VAL 98 Cb -0.28 -0.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.73 2dia s VAL 98 CO 0.34 0.14 1.20 -0.75 0.00 0.00 0.00 175.10 176.03 2dia s LYS 99 N 2.14 4.50 -0.08 2.72 2.20 -1.26 -2.20 119.74 127.75 2dia s LYS 99 Ca 0.01 1.89 0.04 0.00 -0.36 0.00 0.00 55.97 57.56 2dia s LYS 99 Cb -0.12 -3.22 -0.01 0.00 -1.51 0.00 0.00 37.83 32.97 2dia s LYS 99 CO -0.06 -0.06 -0.22 0.08 -0.36 0.00 0.00 175.35 174.73 2dia s VAL 100 N -0.26 2.32 0.25 4.02 1.01 -1.13 -2.79 120.40 123.82 2dia s VAL 100 Ca 0.52 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.52 2dia s VAL 100 Cb -0.33 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.12 2dia s VAL 100 CO 0.38 0.56 0.47 -1.61 0.00 0.00 0.00 175.10 174.90 2dia s GLU 101 N -0.03 3.55 0.70 2.72 2.02 -0.78 -2.50 118.70 124.39 2dia s GLU 101 Ca -0.07 -0.23 -0.13 0.00 0.02 0.00 0.00 54.97 54.57 2dia s GLU 101 Cb -0.15 -2.75 0.02 0.00 0.10 0.00 0.00 34.13 31.35 2dia s GLU 101 CO 0.05 0.31 1.10 -1.25 0.02 0.00 0.00 175.26 175.49 2dia s PRO 102 N -3.53 2.58 -0.58 0.39 0.04 -1.26 -1.74 135.00 130.91 2dia s PRO 102 Ca 0.40 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2dia s PRO 102 Cb -0.11 -1.93 0.54 0.00 0.04 0.00 0.00 34.50 33.04 2dia s PRO 102 CO 0.30 -1.41 1.99 0.00 0.04 0.00 0.00 177.00 177.92 2dia n ALA 103 N -2.86 6.03 -2.73 8.56 0.00 -1.26 -4.71 120.51 123.54 2dia n ALA 103 Ca 0.10 -3.22 -0.43 0.00 0.00 0.00 0.00 53.44 49.89 2dia n ALA 103 Cb 0.52 -1.64 -0.00 0.00 0.00 0.00 0.00 19.45 18.33 2dia n ALA 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2dia s VAL 104 N -4.17 4.49 -0.05 0.00 -7.23 -1.26 -4.97 120.40 107.21 2dia s VAL 104 Ca 0.61 -2.17 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 2dia s VAL 104 Cb 0.49 -5.07 -0.03 0.00 0.56 0.00 0.00 36.38 32.33 2dia s VAL 104 CO 0.04 -1.86 -0.04 1.51 -0.31 0.00 0.00 175.10 174.45 2dia s ASP 105 N 3.68 4.90 -0.51 4.85 1.47 -1.26 -5.08 116.67 124.73 2dia s ASP 105 Ca 0.49 0.02 -0.24 0.00 1.18 0.00 0.00 52.55 54.00 2dia s ASP 105 Cb 0.01 -1.28 0.04 0.00 -0.34 0.00 0.00 42.92 41.35 2dia s ASP 105 CO 0.04 0.34 0.89 0.42 0.68 0.00 0.00 175.17 177.55 2dia s THR 106 N -0.90 4.48 -0.12 2.11 -4.23 -1.26 -5.00 115.64 110.72 2dia s THR 106 Ca 0.14 0.36 -0.18 0.00 -1.18 0.00 0.00 61.69 60.83 2dia s THR 106 Cb -0.11 -4.46 0.04 0.00 1.34 0.00 0.00 72.50 69.31 2dia s THR 106 CO 0.04 -0.97 0.47 -0.44 -0.54 0.00 0.00 174.62 173.18 2dia s SER 107 N 2.58 -0.45 -0.96 3.99 0.01 -1.26 -5.09 113.70 112.52 2dia s SER 107 Ca 0.31 0.73 -0.24 0.00 1.31 0.00 0.00 55.95 58.06 2dia s SER 107 Cb -0.12 0.77 -0.02 0.00 0.21 0.00 0.00 66.02 66.85 2dia s SER 107 CO 0.21 -0.29 1.80 -0.55 0.41 0.00 0.00 173.24 174.82 2dia s SER 108 N -0.31 5.55 0.00 2.44 0.15 -1.26 -4.73 113.70 115.54 2dia s SER 108 Ca -0.05 -0.99 0.00 0.00 0.70 0.00 0.00 55.95 55.62 2dia s SER 108 Cb -0.03 -2.56 0.00 0.00 -1.71 0.00 0.00 66.02 61.71 2dia s SER 108 CO 0.03 -2.39 0.00 0.61 1.20 0.00 0.00 173.24 172.69 2dia n GLY 109 N 6.77 0.50 0.00 9.45 0.00 -1.26 -4.84 105.19 115.81 2dia n GLY 109 Ca 0.39 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.48 2dia n GLY 109 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dia n PRO 110 N 0.00 0.01 -1.55 1.61 -0.04 -1.26 -4.69 135.00 129.07 2dia n PRO 110 Ca 0.00 0.25 -0.34 0.00 -0.04 0.00 0.00 63.50 63.38 2dia n PRO 110 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2dia n PRO 110 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dia s SER 111 N -2.99 4.35 0.73 3.54 0.15 -1.26 -4.93 113.70 113.30 2dia s SER 111 Ca 0.07 0.98 -0.01 0.00 0.70 0.00 0.00 55.95 57.69 2dia s SER 111 Cb 0.09 -2.51 0.13 0.00 -1.71 0.00 0.00 66.02 62.03 2dia s SER 111 CO 0.26 -3.01 1.01 -0.94 1.20 0.00 0.00 173.24 171.75 2dia s SER 112 N 12.14 4.29 0.00 5.45 1.04 -1.26 -5.08 113.70 130.28 2dia s SER 112 Ca 0.97 -0.40 0.00 0.00 0.48 0.00 0.00 55.95 57.01 2dia s SER 112 Cb -0.17 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.00 2dia s SER 112 CO 0.24 -1.91 0.15 0.61 0.98 0.00 0.00 173.24 173.32