#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 6.18 -0.18 1.61 0.15 -1.26 -4.92 113.70 115.28 2dia s SER 2 Ca 0.00 -0.98 -0.20 0.00 0.70 0.00 0.00 55.95 55.47 2dia s SER 2 Cb 0.00 -2.22 -0.22 0.00 -1.71 0.00 0.00 66.02 61.87 2dia s SER 2 CO 0.00 -0.66 0.34 0.77 1.20 0.00 0.00 173.24 174.88 2dia h SER 3 N 8.79 0.10 -3.67 5.45 4.64 -2.09 -3.51 113.55 123.27 2dia h SER 3 Ca -0.27 -0.66 0.01 0.00 -0.47 0.00 0.00 61.79 60.40 2dia h SER 3 Cb 1.11 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2dia h SER 3 CO 0.86 1.50 -0.01 0.61 -0.87 0.00 0.00 176.83 178.91 2dia n GLY 4 N 1.56 -2.01 3.02 -0.77 0.00 -1.26 -4.77 105.19 100.95 2dia n GLY 4 Ca -0.29 -1.40 -0.31 0.00 0.00 0.00 0.00 46.02 44.02 2dia n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dia s SER 5 N -3.74 4.64 -0.13 1.61 0.01 -1.26 -4.94 113.70 109.89 2dia s SER 5 Ca 0.00 -1.94 -0.10 0.00 1.31 0.00 0.00 55.95 55.23 2dia s SER 5 Cb 0.00 -1.57 -0.06 0.00 0.21 0.00 0.00 66.02 64.60 2dia s SER 5 CO 0.00 -0.33 -0.22 -1.54 0.41 0.00 0.00 173.24 171.56 2dia n SER 6 N 4.33 1.39 -3.74 2.44 3.41 -1.26 -5.09 113.62 115.09 2dia n SER 6 Ca -0.01 0.23 -0.11 0.00 -0.26 0.00 0.00 58.87 58.73 2dia n SER 6 Cb 0.42 -0.54 -0.06 0.00 -0.26 0.00 0.00 64.21 63.77 2dia n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2dia s GLY 7 N -5.00 -0.12 0.79 5.00 0.00 -1.26 -5.17 107.32 101.57 2dia s GLY 7 Ca -0.21 -0.14 -0.11 0.00 0.00 0.00 0.00 44.72 44.26 2dia s GLY 7 CO 0.29 -0.37 1.09 2.56 0.00 0.00 0.00 173.10 176.67 2dia s PRO 8 N -3.21 2.11 0.29 2.90 0.04 -1.26 -4.62 135.00 131.24 2dia s PRO 8 Ca -0.00 1.12 -0.29 0.00 0.04 0.00 0.00 61.00 61.87 2dia s PRO 8 Cb 0.01 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.58 2dia s PRO 8 CO -0.08 -1.73 1.05 0.12 0.04 0.00 0.00 177.00 176.40 2dia s PHE 9 N -2.91 3.64 -0.30 0.56 2.19 -1.26 -3.92 117.98 115.98 2dia s PHE 9 Ca 0.61 1.75 -0.10 0.00 0.33 0.00 0.00 56.93 59.52 2dia s PHE 9 Cb -0.17 -3.18 0.16 0.00 -1.31 0.00 0.00 43.02 38.51 2dia s PHE 9 CO 0.56 -0.30 0.79 0.34 1.83 0.00 0.00 175.22 178.44 2dia s ASP 10 N -1.05 -0.94 0.45 6.13 2.15 -0.64 -4.93 116.67 117.83 2dia s ASP 10 Ca 0.45 1.08 0.24 0.00 0.43 0.00 0.00 52.55 54.75 2dia s ASP 10 Cb -0.29 1.99 1.02 0.00 -0.30 0.00 0.00 42.92 45.33 2dia s ASP 10 CO 0.37 -0.18 1.88 1.55 -0.17 0.00 0.00 175.17 178.61 2dia h PRO 11 N 7.84 0.00 0.00 4.34 0.13 -1.84 -2.72 132.00 139.75 2dia h PRO 11 Ca -0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.94 2dia h PRO 11 Cb 1.12 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.25 2dia h PRO 11 CO 0.10 0.23 -0.06 0.77 -0.23 0.00 0.00 178.00 178.81 2dia h SER 12 N 0.00 0.00 1.00 1.44 0.02 -1.95 -2.18 113.55 111.89 2dia h SER 12 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2dia h SER 12 Cb 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 2dia h SER 12 CO 0.03 0.06 0.00 0.29 -1.14 0.00 0.00 176.83 176.07 2dia n LYS 13 N -3.19 0.03 -2.78 3.45 4.76 -1.03 -4.78 118.16 114.61 2dia n LYS 13 Ca 0.00 0.05 -0.41 0.00 -2.87 0.00 0.00 58.31 55.08 2dia n LYS 13 Cb 0.33 -1.54 -0.03 0.00 -1.84 0.00 0.00 35.03 31.94 2dia n LYS 13 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2dia s VAL 14 N -3.01 4.87 -0.26 -0.18 1.01 -0.82 -4.52 120.40 117.48 2dia s VAL 14 Ca 0.13 1.93 -0.03 0.00 0.00 0.00 0.00 61.98 64.01 2dia s VAL 14 Cb 0.17 -4.26 0.02 0.00 0.00 0.00 0.00 36.38 32.31 2dia s VAL 14 CO 0.51 0.20 -0.01 -0.69 0.00 0.00 0.00 175.10 175.10 2dia s VAL 15 N 0.85 3.27 -0.07 2.92 1.01 -1.14 -4.79 120.40 122.45 2dia s VAL 15 Ca 0.48 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.64 2dia s VAL 15 Cb -0.21 -2.65 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 2dia s VAL 15 CO 0.26 0.18 -0.19 0.00 0.00 0.00 0.00 175.10 175.36 2dia s ALA 16 N 1.40 2.44 0.35 5.51 0.00 -1.26 -1.30 121.76 128.90 2dia s ALA 16 Ca 0.01 -0.99 -0.12 0.00 0.00 0.00 0.00 51.96 50.86 2dia s ALA 16 Cb -0.17 -0.89 0.03 0.00 0.00 0.00 0.00 23.12 22.10 2dia s ALA 16 CO -0.02 0.43 0.67 -1.54 0.00 0.00 0.00 175.76 175.31 2dia s SER 17 N -0.26 0.23 0.00 0.00 1.04 -1.03 -4.99 113.70 108.69 2dia s SER 17 Ca 0.00 -1.18 0.00 0.00 0.48 0.00 0.00 55.95 55.26 2dia s SER 17 Cb -0.13 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2dia s SER 17 CO 0.03 -1.51 0.00 0.61 0.98 0.00 0.00 173.24 173.34 2dia n GLY 18 N -0.52 3.16 0.17 7.32 0.00 -1.26 -1.68 105.19 112.37 2dia n GLY 18 Ca -0.05 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.19 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 0.03 -0.15 1.61 0.13 -1.90 -3.04 132.00 128.68 2dia h PRO 19 Ca 0.00 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 65.10 2dia h PRO 19 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2dia h PRO 19 CO 0.00 0.51 0.04 0.78 -0.23 0.00 0.00 178.00 179.09 2dia h GLY 20 N 1.44 0.22 0.62 1.56 0.00 -1.63 0.55 103.07 105.83 2dia h GLY 20 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2dia h GLY 20 CO 0.06 0.09 0.00 1.04 0.00 0.00 0.00 176.54 177.74 2dia n LEU 21 N -4.45 0.31 -0.04 3.11 4.77 -1.15 -3.63 117.00 115.92 2dia n LEU 21 Ca -0.01 -0.11 -0.06 0.00 -0.03 0.00 0.00 56.01 55.81 2dia n LEU 21 Cb 0.13 -0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.17 2dia n LEU 21 CO 0.35 0.06 -0.79 -0.62 -1.33 0.00 0.00 177.39 175.06 2dia n GLU 22 N -0.72 1.07 -3.67 3.23 1.02 -0.07 -4.85 120.64 116.66 2dia n GLU 22 Ca 0.21 0.04 -0.03 0.00 -0.02 0.00 0.00 57.16 57.36 2dia n GLU 22 Cb 0.15 -1.19 -0.01 0.00 -0.02 0.00 0.00 31.44 30.37 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 -2.19 -0.15 0.23 -0.32 -3.43 -0.01 -4.50 115.29 104.92 2dia s HIS 23 Ca -0.10 -0.06 -0.17 0.00 -0.80 0.00 0.00 55.06 53.93 2dia s HIS 23 Cb 0.03 0.59 0.02 0.00 -1.43 0.00 0.00 32.58 31.79 2dia s HIS 23 CO 0.25 -0.60 0.56 0.20 -2.00 0.00 0.00 174.74 173.15 2dia s GLY 24 N -2.82 0.10 -0.02 -1.38 0.00 -1.20 -4.01 107.32 97.99 2dia s GLY 24 Ca 0.11 -0.44 0.02 0.00 0.00 0.00 0.00 44.72 44.41 2dia s GLY 24 CO -0.02 -0.33 -0.08 1.25 0.00 0.00 0.00 173.10 173.93 2dia s LYS 25 N -3.93 0.83 -0.34 2.90 2.20 -1.26 -0.47 119.74 119.67 2dia s LYS 25 Ca 0.14 -0.26 -0.35 0.00 -0.36 0.00 0.00 55.97 55.14 2dia s LYS 25 Cb -0.02 -0.79 -0.11 0.00 -1.51 0.00 0.00 37.83 35.40 2dia s LYS 25 CO 0.03 0.09 2.19 0.28 -0.36 0.00 0.00 175.35 177.58 2dia n VAL 26 N 3.30 0.20 0.00 4.02 0.31 -0.46 0.31 118.33 126.01 2dia n VAL 26 Ca -0.18 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 2dia n VAL 26 Cb 0.55 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 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 6.50 2.61 2.45 2.92 0.00 0.16 -4.25 105.19 115.58 2dia n GLY 27 Ca 0.41 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.23 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 -0.57 -1.94 -3.96 1.61 -0.58 0.15 -4.85 120.64 110.50 2dia n GLU 28 Ca 0.00 -1.25 -0.29 0.00 -0.42 0.00 0.00 57.16 55.20 2dia n GLU 28 Cb 0.00 -1.05 -0.17 0.00 -0.57 0.00 0.00 31.44 29.66 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 -3.32 1.62 -0.57 0.62 0.00 -1.26 -4.00 121.76 114.85 2dia s ALA 29 Ca 0.49 -0.78 -0.28 0.00 0.00 0.00 0.00 51.96 51.39 2dia s ALA 29 Cb -0.04 -1.03 0.01 0.00 0.00 0.00 0.00 23.12 22.06 2dia s ALA 29 CO 0.36 -0.48 1.50 0.20 0.00 0.00 0.00 175.76 177.35 2dia s GLY 30 N 1.58 0.76 0.05 0.00 0.00 -0.08 -4.83 107.32 104.82 2dia s GLY 30 Ca 0.04 -0.68 -0.31 0.00 0.00 0.00 0.00 44.72 43.78 2dia s GLY 30 CO -0.09 2.93 1.55 1.08 0.00 0.00 0.00 173.10 178.57 2dia s LEU 31 N 6.61 4.35 -0.02 0.66 1.43 -1.26 -3.28 118.68 127.17 2dia s LEU 31 Ca 0.55 2.36 0.00 0.00 -1.03 0.00 0.00 54.13 56.02 2dia s LEU 31 Cb -0.12 -3.57 0.02 0.00 0.03 0.00 0.00 46.19 42.56 2dia s LEU 31 CO 0.24 -0.82 -0.00 -0.76 0.23 0.00 0.00 176.35 175.24 2dia s LEU 32 N 2.39 1.42 -0.10 1.79 1.43 0.04 -2.59 118.68 123.06 2dia s LEU 32 Ca 0.70 -0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2dia s LEU 32 Cb -0.37 -0.18 0.01 0.00 0.03 0.00 0.00 46.19 45.69 2dia s LEU 32 CO 0.30 -0.06 -0.15 -0.44 0.23 0.00 0.00 176.35 176.23 2dia s SER 33 N 0.69 2.36 -0.32 2.29 0.01 -0.68 -0.90 113.70 117.14 2dia s SER 33 Ca -0.07 -0.41 -0.03 0.00 1.31 0.00 0.00 55.95 56.75 2dia s SER 33 Cb -0.10 -1.05 0.05 0.00 0.21 0.00 0.00 66.02 65.13 2dia s SER 33 CO -0.01 0.01 0.04 -0.69 0.41 0.00 0.00 173.24 173.00 2dia s VAL 34 N 0.97 3.24 -0.29 3.43 1.01 -0.74 -2.46 120.40 125.56 2dia s VAL 34 Ca -0.07 -1.35 -0.20 0.00 0.00 0.00 0.00 61.98 60.36 2dia s VAL 34 Cb -0.15 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2dia s VAL 34 CO -0.01 -0.16 0.60 -1.81 0.00 0.00 0.00 175.10 173.72 2dia s ASP 35 N 1.34 6.49 -0.17 3.32 1.11 -0.42 -1.79 116.67 126.54 2dia s ASP 35 Ca -0.03 0.46 -0.07 0.00 0.18 0.00 0.00 52.55 53.09 2dia s ASP 35 Cb -0.20 -2.32 -0.04 0.00 1.07 0.00 0.00 42.92 41.43 2dia s ASP 35 CO -0.00 -0.42 0.07 0.00 1.18 0.00 0.00 175.17 176.00 2dia n SER 37 N 3.29 0.31 -0.07 0.00 2.88 -1.26 -4.83 113.62 113.94 2dia n SER 37 Ca -0.17 0.08 0.08 0.00 -1.33 0.00 0.00 58.87 57.53 2dia n SER 37 Cb 0.53 -0.06 0.11 0.00 -0.75 0.00 0.00 64.21 64.03 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 -2.88 1.71 0.03 -1.46 -0.58 -1.26 -4.68 120.64 111.53 2dia n GLU 38 Ca 0.00 -2.33 0.05 0.00 -0.42 0.00 0.00 57.16 54.46 2dia n GLU 38 Cb 0.00 -1.39 0.23 0.00 -0.57 0.00 0.00 31.44 29.71 2dia n GLU 38 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2dia n ALA 39 N -1.20 1.29 -0.59 0.62 0.00 -1.26 -4.33 120.51 115.04 2dia n ALA 39 Ca 0.12 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2dia n ALA 39 Cb 0.55 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.84 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 -0.83 0.06 0.39 0.00 0.00 -1.25 -1.63 105.19 101.93 2dia n GLY 40 Ca 0.01 -0.98 -0.03 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.26 0.00 1.61 -0.04 -1.26 -4.93 135.00 129.12 2dia n PRO 41 Ca 0.00 -0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 2dia n PRO 41 Cb 0.00 -0.18 0.00 0.00 -0.04 0.00 0.00 33.50 33.28 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 1.65 2.74 3.58 0.55 0.00 -1.26 -4.82 105.19 107.62 2dia n GLY 42 Ca 0.02 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.75 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 -2.97 2.98 0.01 4.61 0.00 -1.26 -4.80 121.76 120.33 2dia s ALA 43 Ca 0.00 -0.89 -0.20 0.00 0.00 0.00 0.00 51.96 50.87 2dia s ALA 43 Cb 0.00 -1.24 -0.06 0.00 0.00 0.00 0.00 23.12 21.82 2dia s ALA 43 CO 0.00 0.56 0.58 -1.17 0.00 0.00 0.00 175.76 175.72 2dia s LEU 44 N -0.75 4.44 -0.17 0.00 2.96 -1.26 -1.97 118.68 121.92 2dia s LEU 44 Ca 0.11 1.17 -0.07 0.00 -0.22 0.00 0.00 54.13 55.12 2dia s LEU 44 Cb -0.11 -2.90 0.07 0.00 0.50 0.00 0.00 46.19 43.75 2dia s LEU 44 CO 0.02 0.15 0.37 -0.83 -1.32 0.00 0.00 176.35 174.74 2dia s GLY 45 N -0.41 -0.29 0.22 7.98 0.00 -1.17 -5.04 107.32 108.61 2dia s GLY 45 Ca 0.30 1.37 0.09 0.00 0.00 0.00 0.00 44.72 46.48 2dia s GLY 45 CO 0.17 1.97 -0.01 -2.27 0.00 0.00 0.00 173.10 172.97 2dia s LEU 46 N 2.03 3.23 -0.21 0.66 2.96 -1.26 -1.75 118.68 124.34 2dia s LEU 46 Ca -0.05 -0.53 -0.04 0.00 -0.22 0.00 0.00 54.13 53.29 2dia s LEU 46 Cb -0.11 -1.82 0.10 0.00 0.50 0.00 0.00 46.19 44.86 2dia s LEU 46 CO -0.12 0.04 0.24 -0.70 -1.32 0.00 0.00 176.35 174.49 2dia s GLU 47 N -3.32 0.21 -0.32 1.98 2.12 0.79 -4.97 118.70 115.20 2dia s GLU 47 Ca 0.29 0.19 -0.15 0.00 0.36 0.00 0.00 54.97 55.67 2dia s GLU 47 Cb -0.08 -1.12 -0.02 0.00 0.26 0.00 0.00 34.13 33.17 2dia s GLU 47 CO 0.19 -0.68 0.35 0.00 -0.54 0.00 0.00 175.26 174.57 2dia s ALA 48 N 2.34 3.52 -0.05 6.30 0.00 -1.26 -1.29 121.76 131.31 2dia s ALA 48 Ca 0.08 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.97 2dia s ALA 48 Cb -0.16 -2.76 0.02 0.00 0.00 0.00 0.00 23.12 20.23 2dia s ALA 48 CO -0.14 -0.90 -0.07 0.08 0.00 0.00 0.00 175.76 174.72 2dia s VAL 49 N 2.01 0.75 0.84 0.00 1.01 -1.21 -0.30 120.40 123.50 2dia s VAL 49 Ca 0.12 -0.25 -0.11 0.00 0.00 0.00 0.00 61.98 61.74 2dia s VAL 49 Cb -0.16 -0.74 0.10 0.00 0.00 0.00 0.00 36.38 35.57 2dia s VAL 49 CO 0.11 0.27 1.09 -0.55 0.00 0.00 0.00 175.10 176.03 2dia s SER 50 N 0.86 3.95 0.21 3.32 0.15 -0.75 0.16 113.70 121.61 2dia s SER 50 Ca -0.12 1.59 -0.11 0.00 0.70 0.00 0.00 55.95 58.02 2dia s SER 50 Cb -0.15 -2.29 0.30 0.00 -1.71 0.00 0.00 66.02 62.17 2dia s SER 50 CO 0.01 -2.35 1.67 -2.24 1.20 0.00 0.00 173.24 171.52 2dia h ASP 51 N -1.35 -0.25 0.59 5.45 2.03 0.16 0.68 116.42 123.73 2dia h ASP 51 Ca -0.47 0.15 0.00 0.00 -0.73 0.00 0.00 57.03 55.98 2dia h ASP 51 Cb 1.26 0.26 0.00 0.00 -0.83 0.00 0.00 39.33 40.02 2dia h ASP 51 CO 0.54 -0.10 0.00 -1.28 -1.03 0.00 0.00 179.24 177.37 2dia h SER 52 N 0.13 0.00 -0.27 4.15 0.87 -1.92 -3.46 113.55 113.05 2dia h SER 52 Ca 0.32 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2dia h SER 52 Cb 0.52 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2dia h SER 52 CO -0.52 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.39 2dia n GLY 53 N -0.29 0.90 3.13 5.77 0.00 0.24 -5.10 105.19 109.84 2dia n GLY 53 Ca 0.01 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.07 2.62 -0.24 2.61 2.01 -1.23 -4.81 115.64 114.54 2dia s THR 54 Ca 0.00 -1.48 -0.29 0.00 0.31 0.00 0.00 61.69 60.23 2dia s THR 54 Cb 0.00 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.97 2dia s THR 54 CO 0.00 -0.06 1.76 -0.54 -0.69 0.00 0.00 174.62 175.09 2dia s LYS 55 N 1.19 3.60 0.45 4.92 1.02 -1.26 -1.80 119.74 127.86 2dia s LYS 55 Ca -0.07 1.68 -0.09 0.00 0.02 0.00 0.00 55.97 57.52 2dia s LYS 55 Cb -0.20 -4.13 -0.05 0.00 -0.52 0.00 0.00 37.83 32.93 2dia s LYS 55 CO -0.03 -1.53 0.79 0.00 -0.92 0.00 0.00 175.35 173.66 2dia s ALA 56 N 6.00 3.35 -0.27 5.17 0.00 0.58 -4.99 121.76 131.60 2dia s ALA 56 Ca 0.78 -0.29 -0.29 0.00 0.00 0.00 0.00 51.96 52.16 2dia s ALA 56 Cb -0.26 -2.70 -0.01 0.00 0.00 0.00 0.00 23.12 20.15 2dia s ALA 56 CO 0.32 -0.17 1.51 -2.00 0.00 0.00 0.00 175.76 175.43 2dia s GLU 57 N -4.23 3.79 -0.03 0.00 2.12 -1.22 -4.63 118.70 114.50 2dia s GLU 57 Ca 0.50 1.46 0.06 0.00 0.36 0.00 0.00 54.97 57.36 2dia s GLU 57 Cb -0.10 -3.99 -0.02 0.00 0.26 0.00 0.00 34.13 30.27 2dia s GLU 57 CO 0.37 -1.29 -0.20 0.08 -0.54 0.00 0.00 175.26 173.68 2dia s VAL 58 N 5.05 2.57 -0.02 3.70 1.01 -1.26 -1.23 120.40 130.22 2dia s VAL 58 Ca 0.66 -0.92 0.01 0.00 0.00 0.00 0.00 61.98 61.73 2dia s VAL 58 Cb -0.21 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.22 2dia s VAL 58 CO 0.28 0.58 -0.02 -0.55 0.00 0.00 0.00 175.10 175.39 2dia s SER 59 N -0.69 0.43 -0.15 3.32 0.15 -0.59 -4.99 113.70 111.18 2dia s SER 59 Ca 0.11 -0.05 0.01 0.00 0.70 0.00 0.00 55.95 56.72 2dia s SER 59 Cb -0.10 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.07 2dia s SER 59 CO -0.00 -0.02 -0.18 -0.63 1.20 0.00 0.00 173.24 173.60 2dia s ILE 60 N 0.44 2.39 -0.26 6.45 1.01 -1.26 -1.77 121.20 128.20 2dia s ILE 60 Ca -0.04 -0.87 -0.09 0.00 0.00 0.00 0.00 60.65 59.65 2dia s ILE 60 Cb -0.07 -1.99 -0.04 0.00 0.01 0.00 0.00 42.46 40.37 2dia s ILE 60 CO -0.01 0.53 0.11 -1.58 0.00 0.00 0.00 174.94 174.00 2dia s GLN 61 N 0.79 3.78 -0.08 2.79 0.74 -0.70 -4.95 119.66 122.03 2dia s GLN 61 Ca -0.07 -0.41 -0.24 0.00 0.05 0.00 0.00 55.36 54.69 2dia s GLN 61 Cb -0.16 -3.44 -0.03 0.00 1.10 0.00 0.00 33.01 30.48 2dia s GLN 61 CO -0.00 -0.16 0.74 -0.80 -0.55 0.00 0.00 175.29 174.52 2dia s ASN 62 N 1.60 7.01 0.18 6.67 -0.87 -1.26 -2.34 114.94 125.93 2dia s ASN 62 Ca 0.06 1.22 0.09 0.00 -1.57 0.00 0.00 52.86 52.66 2dia s ASN 62 Cb -0.15 -2.43 -0.04 0.00 -0.02 0.00 0.00 41.25 38.61 2dia s ASN 62 CO 0.06 -0.17 -0.09 0.20 -2.57 0.00 0.00 177.10 174.52 2dia s ASN 63 N 0.88 4.26 -0.39 -1.22 0.01 -1.22 -5.02 114.94 112.24 2dia s ASN 63 Ca 0.39 -0.57 0.01 0.00 -0.71 0.00 0.00 52.86 51.98 2dia s ASN 63 Cb -0.18 -0.72 0.44 0.00 0.41 0.00 0.00 41.25 41.20 2dia s ASN 63 CO 0.18 0.10 1.79 0.29 -1.51 0.00 0.00 177.10 177.96 2dia n LYS 64 N 0.04 2.03 -0.01 -0.60 5.02 -1.26 -4.10 118.16 119.28 2dia n LYS 64 Ca -0.11 -2.29 -0.01 0.00 -2.02 0.00 0.00 58.31 53.89 2dia n LYS 64 Cb 0.55 -1.90 -0.01 0.00 -0.02 0.00 0.00 35.03 33.66 2dia n LYS 64 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2dia n ASP 65 N -0.57 3.22 0.00 4.39 9.92 -1.26 -5.05 116.55 127.20 2dia n ASP 65 Ca 0.45 -0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.71 2dia n ASP 65 Cb 1.12 -0.02 0.00 0.00 -0.64 0.00 0.00 41.12 41.58 2dia n ASP 65 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dia n GLY 66 N 3.35 0.49 3.32 0.44 0.00 -1.26 -5.09 105.19 106.44 2dia n GLY 66 Ca -0.02 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.90 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 -0.51 0.05 -0.02 2.61 -4.23 -1.26 -1.97 115.64 110.31 2dia s THR 67 Ca 0.00 -1.58 0.02 0.00 -1.18 0.00 0.00 61.69 58.95 2dia s THR 67 Cb 0.00 -2.02 0.00 0.00 1.34 0.00 0.00 72.50 71.82 2dia s THR 67 CO 0.00 -0.25 -0.08 -0.31 -0.54 0.00 0.00 174.62 173.44 2dia s TYR 68 N -4.02 0.86 -0.59 3.99 1.51 -0.74 -3.39 117.35 114.97 2dia s TYR 68 Ca 0.22 -0.20 -0.11 0.00 -1.01 0.00 0.00 57.07 55.96 2dia s TYR 68 Cb 0.04 -0.62 0.15 0.00 -0.11 0.00 0.00 41.96 41.42 2dia s TYR 68 CO 0.03 -0.09 0.49 0.00 -1.11 0.00 0.00 175.55 174.88 2dia s ALA 69 N 0.17 3.64 -0.06 3.71 0.00 -0.99 -1.79 121.76 126.45 2dia s ALA 69 Ca -0.02 -2.79 -0.08 0.00 0.00 0.00 0.00 51.96 49.06 2dia s ALA 69 Cb -0.08 -3.08 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 2dia s ALA 69 CO 0.00 -2.04 0.22 0.08 0.00 0.00 0.00 175.76 174.02 2dia s VAL 70 N 1.01 5.37 -0.05 0.00 1.01 -0.08 -1.72 120.40 125.93 2dia s VAL 70 Ca 0.09 0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.30 2dia s VAL 70 Cb -0.23 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.66 2dia s VAL 70 CO -0.02 0.52 0.14 -0.89 0.00 0.00 0.00 175.10 174.85 2dia s THR 71 N -1.13 -0.00 -0.06 3.92 2.01 -0.73 -0.78 115.64 118.86 2dia s THR 71 Ca 0.21 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.25 2dia s THR 71 Cb -0.13 -0.20 0.01 0.00 0.01 0.00 0.00 72.50 72.19 2dia s THR 71 CO 0.10 0.01 -0.13 -0.72 -0.69 0.00 0.00 174.62 173.19 2dia s TYR 72 N 0.16 1.50 -0.45 4.92 -0.85 -1.21 -1.55 117.35 119.88 2dia s TYR 72 Ca -0.01 -0.54 -0.06 0.00 -0.52 0.00 0.00 57.07 55.94 2dia s TYR 72 Cb -0.02 -1.09 0.12 0.00 0.38 0.00 0.00 41.96 41.35 2dia s TYR 72 CO -0.00 -0.27 0.28 0.08 -1.52 0.00 0.00 175.55 174.12 2dia s VAL 73 N 0.59 3.72 0.14 -3.49 1.01 -0.37 -0.90 120.40 121.11 2dia s VAL 73 Ca -0.14 -1.97 -0.31 0.00 0.00 0.00 0.00 61.98 59.57 2dia s VAL 73 Cb -0.15 -3.50 -0.08 0.00 0.00 0.00 0.00 36.38 32.65 2dia s VAL 73 CO 0.04 -0.74 1.34 -2.16 0.00 0.00 0.00 175.10 173.58 2dia s PRO 74 N 1.19 4.36 0.09 2.72 0.04 -1.26 -3.42 135.00 138.73 2dia s PRO 74 Ca 0.07 2.04 0.18 0.00 0.04 0.00 0.00 61.00 63.34 2dia s PRO 74 Cb -0.24 -3.23 -0.11 0.00 0.04 0.00 0.00 34.50 30.96 2dia s PRO 74 CO -0.03 -0.35 0.86 1.28 0.04 0.00 0.00 177.00 178.80 2dia n LEU 75 N 3.41 0.82 -3.76 -3.56 4.77 -1.26 0.36 117.00 117.77 2dia n LEU 75 Ca 0.09 0.35 -0.16 0.00 -0.03 0.00 0.00 56.01 56.26 2dia n LEU 75 Cb 0.43 0.04 -0.16 0.00 -2.33 0.00 0.00 43.42 41.40 2dia n LEU 75 CO 0.58 0.06 -0.35 0.28 -1.33 0.00 0.00 177.39 176.62 2dia s THR 76 N -3.05 -0.01 1.05 -5.08 -1.32 -1.26 -4.78 115.64 101.19 2dia s THR 76 Ca -0.03 0.22 -0.12 0.00 -1.21 0.00 0.00 61.69 60.56 2dia s THR 76 Cb 0.09 -0.14 0.22 0.00 -1.51 0.00 0.00 72.50 71.16 2dia s THR 76 CO 0.81 0.12 1.08 0.00 -2.21 0.00 0.00 174.62 174.41 2dia s ALA 77 N 1.25 0.40 0.00 11.08 0.00 -1.26 -4.94 121.76 128.28 2dia s ALA 77 Ca -0.07 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.05 2dia s ALA 77 Cb -0.13 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.67 2dia s ALA 77 CO -0.03 -3.34 0.00 0.41 0.00 0.00 0.00 175.76 172.80 2dia n GLY 78 N 0.45 0.80 3.66 0.00 0.00 -0.82 -4.96 105.19 104.32 2dia n GLY 78 Ca 0.07 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.54 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 -1.01 4.20 0.18 1.61 -1.94 -1.26 -2.58 119.30 118.50 2dia s MET 79 Ca 0.00 1.93 0.06 0.00 -1.71 0.00 0.00 55.69 55.97 2dia s MET 79 Cb 0.00 -3.88 -0.04 0.00 2.01 0.00 0.00 34.83 32.92 2dia s MET 79 CO 0.00 -0.78 0.13 0.71 -0.01 0.00 0.00 175.02 175.06 2dia s TYR 80 N 3.79 3.10 -0.49 -0.03 2.02 -0.82 0.18 117.35 125.10 2dia s TYR 80 Ca 0.64 -0.04 0.03 0.00 -0.37 0.00 0.00 57.07 57.33 2dia s TYR 80 Cb -0.28 -1.48 0.13 0.00 -0.40 0.00 0.00 41.96 39.93 2dia s TYR 80 CO 0.22 0.52 0.25 0.99 -1.57 0.00 0.00 175.55 175.96 2dia s THR 81 N -1.80 2.21 -0.03 -0.71 2.01 0.12 -3.05 115.64 114.40 2dia s THR 81 Ca 0.31 -3.05 -0.30 0.00 0.31 0.00 0.00 61.69 58.96 2dia s THR 81 Cb -0.10 -2.54 -0.05 0.00 0.01 0.00 0.00 72.50 69.82 2dia s THR 81 CO 0.23 -0.82 1.32 -0.76 -0.69 0.00 0.00 174.62 173.90 2dia s LEU 82 N -0.05 4.30 -0.25 4.42 1.43 -1.02 -3.34 118.68 124.17 2dia s LEU 82 Ca 0.17 1.99 0.02 0.00 -1.03 0.00 0.00 54.13 55.28 2dia s LEU 82 Cb -0.25 -3.56 0.06 0.00 0.03 0.00 0.00 46.19 42.47 2dia s LEU 82 CO -0.00 -0.67 -0.09 -0.89 0.23 0.00 0.00 176.35 174.93 2dia s THR 83 N 2.37 1.96 -0.19 5.49 2.01 -0.41 -2.01 115.64 124.86 2dia s THR 83 Ca 0.61 -1.52 -0.00 0.00 0.31 0.00 0.00 61.69 61.08 2dia s THR 83 Cb -0.29 -2.13 0.01 0.00 0.01 0.00 0.00 72.50 70.10 2dia s THR 83 CO 0.24 -0.07 -0.16 -0.32 -0.69 0.00 0.00 174.62 173.62 2dia s MET 84 N 1.19 3.10 -0.16 4.92 0.00 -1.26 -0.15 119.30 126.95 2dia s MET 84 Ca -0.07 -0.78 0.00 0.00 0.00 0.00 0.00 55.69 54.85 2dia s MET 84 Cb -0.20 -2.67 0.03 0.00 0.00 0.00 0.00 34.83 31.99 2dia s MET 84 CO -0.06 -0.18 -0.14 0.15 0.00 0.00 0.00 175.02 174.80 2dia s LYS 85 N 1.27 2.32 -0.42 4.11 1.02 -0.72 -2.53 119.74 124.79 2dia s LYS 85 Ca 0.04 -0.63 -0.15 0.00 0.02 0.00 0.00 55.97 55.24 2dia s LYS 85 Cb -0.14 -2.20 0.03 0.00 -0.52 0.00 0.00 37.83 35.00 2dia s LYS 85 CO -0.09 -0.27 0.31 -0.47 -0.92 0.00 0.00 175.35 173.92 2dia s TYR 86 N 1.45 3.24 -0.85 3.18 6.14 0.79 -3.06 117.35 128.24 2dia s TYR 86 Ca 0.04 -0.66 0.00 0.00 0.64 0.00 0.00 57.07 57.09 2dia s TYR 86 Cb -0.13 -2.69 0.00 0.00 0.42 0.00 0.00 41.96 39.56 2dia s TYR 86 CO -0.11 -0.63 0.00 0.41 0.64 0.00 0.00 175.55 175.87 2dia n GLY 87 N 5.16 0.04 1.89 8.97 0.00 -0.83 -2.47 105.19 117.95 2dia n GLY 87 Ca -0.11 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.06 1.43 3.33 -0.02 0.00 -1.26 -4.94 105.19 102.66 2dia n GLY 88 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.37 3.34 0.73 1.61 2.02 -1.03 -5.05 118.70 119.95 2dia s GLU 89 Ca 0.00 -0.69 -0.16 0.00 0.02 0.00 0.00 54.97 54.15 2dia s GLU 89 Cb 0.00 -2.73 0.04 0.00 0.10 0.00 0.00 34.13 31.54 2dia s GLU 89 CO 0.00 0.06 1.24 -0.51 0.02 0.00 0.00 175.26 176.07 2dia s LEU 90 N 0.76 3.35 0.36 1.80 1.43 -1.26 -0.15 118.68 124.97 2dia s LEU 90 Ca -0.05 2.47 0.01 0.00 -1.03 0.00 0.00 54.13 55.53 2dia s LEU 90 Cb -0.15 -4.60 -0.03 0.00 0.03 0.00 0.00 46.19 41.44 2dia s LEU 90 CO 0.01 -2.32 0.57 0.68 0.23 0.00 0.00 176.35 175.52 2dia s VAL 91 N -1.82 4.86 -2.00 -1.59 -7.23 -1.05 -4.77 120.40 106.80 2dia s VAL 91 Ca 0.77 -0.50 0.10 0.00 -1.81 0.00 0.00 61.98 60.54 2dia s VAL 91 Cb -0.32 -3.77 0.28 0.00 0.56 0.00 0.00 36.38 33.12 2dia s VAL 91 CO 0.45 -0.50 1.03 -0.81 -0.31 0.00 0.00 175.10 174.96 2dia n PRO 92 N -1.83 0.49 0.00 4.82 -0.04 -1.26 -1.69 135.00 135.48 2dia n PRO 92 Ca -0.04 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.46 2dia n PRO 92 Cb 0.57 -1.32 0.02 0.00 -0.04 0.00 0.00 33.50 32.73 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 -0.82 0.00 -4.04 0.54 8.25 -1.26 -5.02 115.22 112.88 2dia n HIS 93 Ca 0.07 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.44 2dia n HIS 93 Cb 0.03 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.04 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 -0.55 0.47 0.64 4.41 0.40 -0.68 -3.96 117.98 118.71 2dia s PHE 94 Ca 0.07 -0.66 -0.16 0.00 -0.60 0.00 0.00 56.93 55.59 2dia s PHE 94 Cb 0.05 -0.31 -0.01 0.00 0.51 0.00 0.00 43.02 43.26 2dia s PHE 94 CO 0.08 -0.19 1.11 -1.25 0.70 0.00 0.00 175.22 175.67 2dia s PRO 95 N -2.15 2.88 -0.08 0.24 0.04 -1.26 -4.37 135.00 130.30 2dia s PRO 95 Ca -0.08 1.42 -0.00 0.00 0.04 0.00 0.00 61.00 62.38 2dia s PRO 95 Cb -0.05 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.55 2dia s PRO 95 CO -0.03 -1.19 -0.04 0.00 0.04 0.00 0.00 177.00 175.78 2dia s ALA 96 N -2.26 0.96 0.13 8.56 0.00 -0.85 -4.97 121.76 123.33 2dia s ALA 96 Ca 0.68 -0.29 -0.27 0.00 0.00 0.00 0.00 51.96 52.08 2dia s ALA 96 Cb -0.21 -0.74 -0.07 0.00 0.00 0.00 0.00 23.12 22.10 2dia s ALA 96 CO 0.39 -0.33 0.83 -0.98 0.00 0.00 0.00 175.76 175.68 2dia s ARG 97 N 1.61 4.62 -0.01 0.00 1.04 -1.26 -2.42 118.95 122.52 2dia s ARG 97 Ca 0.01 1.24 -0.00 0.00 -1.04 0.00 0.00 55.73 55.93 2dia s ARG 97 Cb -0.13 -3.31 0.01 0.00 -2.04 0.00 0.00 34.95 29.47 2dia s ARG 97 CO -0.05 0.42 0.02 0.08 -0.04 0.00 0.00 175.30 175.73 2dia s VAL 98 N -0.64 -0.01 -0.28 4.99 1.01 -1.17 -4.94 120.40 119.36 2dia s VAL 98 Ca 0.39 0.04 -0.18 0.00 0.00 0.00 0.00 61.98 62.23 2dia s VAL 98 Cb -0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 36.38 36.09 2dia s VAL 98 CO 0.27 0.02 0.53 -0.75 0.00 0.00 0.00 175.10 175.16 2dia s LYS 99 N 0.21 3.98 -0.18 2.72 2.20 -1.26 -1.95 119.74 125.46 2dia s LYS 99 Ca -0.02 0.24 -0.08 0.00 -0.36 0.00 0.00 55.97 55.75 2dia s LYS 99 Cb -0.02 -3.69 -0.04 0.00 -1.51 0.00 0.00 37.83 32.57 2dia s LYS 99 CO -0.01 -0.42 0.10 0.08 -0.36 0.00 0.00 175.35 174.74 2dia s VAL 100 N 2.36 5.12 0.41 4.02 1.01 -1.06 -3.25 120.40 129.00 2dia s VAL 100 Ca 0.21 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.26 2dia s VAL 100 Cb -0.15 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.89 2dia s VAL 100 CO 0.10 0.47 0.65 -1.61 0.00 0.00 0.00 175.10 174.71 2dia s GLU 101 N 0.20 3.44 0.66 2.72 2.02 0.38 -1.95 118.70 126.17 2dia s GLU 101 Ca 0.07 -0.17 -0.15 0.00 0.02 0.00 0.00 54.97 54.73 2dia s GLU 101 Cb -0.12 -2.55 0.00 0.00 0.10 0.00 0.00 34.13 31.57 2dia s GLU 101 CO -0.00 -0.03 1.11 -1.25 0.02 0.00 0.00 175.26 175.10 2dia s PRO 102 N -4.50 2.78 -0.32 0.39 0.04 -1.26 -1.35 135.00 130.77 2dia s PRO 102 Ca 0.44 1.38 -0.03 0.00 0.04 0.00 0.00 61.00 62.82 2dia s PRO 102 Cb -0.10 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.54 2dia s PRO 102 CO 0.39 -1.27 2.66 0.00 0.04 0.00 0.00 177.00 178.82 2dia n ALA 103 N -2.47 5.95 -1.69 8.56 0.00 -1.26 -4.63 120.51 124.98 2dia n ALA 103 Ca 0.10 -2.32 -0.44 0.00 0.00 0.00 0.00 53.44 50.78 2dia n ALA 103 Cb 0.52 -1.90 -0.03 0.00 0.00 0.00 0.00 19.45 18.03 2dia n ALA 103 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2dia n VAL 104 N 1.01 0.28 -3.00 0.00 0.24 -1.26 -1.54 118.33 114.05 2dia n VAL 104 Ca 0.40 -0.05 -0.18 0.00 -2.04 0.00 0.00 64.34 62.47 2dia n VAL 104 Cb 0.61 -1.97 -0.00 0.00 -1.47 0.00 0.00 33.84 31.01 2dia n VAL 104 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 2dia n ASP 105 N 5.14 -3.67 -4.67 -1.34 9.92 -1.26 -4.91 116.55 115.75 2dia n ASP 105 Ca 0.18 -0.14 -0.29 0.00 -0.53 0.00 0.00 54.79 54.00 2dia n ASP 105 Cb 0.35 -3.08 0.17 0.00 -0.64 0.00 0.00 41.12 37.92 2dia n ASP 105 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 2dia s THR 106 N -2.78 2.32 0.74 -3.53 -1.32 -0.59 -4.96 115.64 105.52 2dia s THR 106 Ca 0.24 0.10 -0.16 0.00 -1.21 0.00 0.00 61.69 60.67 2dia s THR 106 Cb -0.13 -2.52 -0.01 0.00 -1.51 0.00 0.00 72.50 68.33 2dia s THR 106 CO 0.30 -0.13 0.71 -0.24 -2.21 0.00 0.00 174.62 173.04 2dia n SER 107 N -4.15 -0.58 -4.80 8.08 2.88 -1.26 -5.02 113.62 108.78 2dia n SER 107 Ca 0.06 0.60 -0.23 0.00 -1.33 0.00 0.00 58.87 57.97 2dia n SER 107 Cb 0.56 -1.30 -0.05 0.00 -0.75 0.00 0.00 64.21 62.67 2dia n SER 107 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dia s SER 108 N -1.61 4.74 0.00 -3.46 0.15 -1.26 -5.05 113.70 107.21 2dia s SER 108 Ca 0.68 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 56.43 2dia s SER 108 Cb -0.33 -0.55 0.00 0.00 -1.71 0.00 0.00 66.02 63.42 2dia s SER 108 CO 0.56 -0.57 0.00 0.61 1.20 0.00 0.00 173.24 175.04 2dia n GLY 109 N -1.37 0.95 3.71 9.45 0.00 -1.26 -5.15 105.19 111.52 2dia n GLY 109 Ca 0.01 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 2dia n GLY 109 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dia s PRO 110 N 0.00 1.14 -0.20 1.61 0.04 -1.26 -5.08 135.00 131.25 2dia s PRO 110 Ca 0.00 0.78 -0.07 0.00 0.04 0.00 0.00 61.00 61.74 2dia s PRO 110 Cb 0.00 -1.80 0.09 0.00 0.04 0.00 0.00 34.50 32.83 2dia s PRO 110 CO 0.00 -2.31 0.44 -1.54 0.04 0.00 0.00 177.00 173.63 2dia s SER 111 N -3.43 -0.35 -0.52 6.66 1.04 -1.26 -5.10 113.70 110.74 2dia s SER 111 Ca 0.64 1.03 -0.26 0.00 0.48 0.00 0.00 55.95 57.84 2dia s SER 111 Cb -0.18 1.36 -0.06 0.00 0.10 0.00 0.00 66.02 67.25 2dia s SER 111 CO 0.57 -0.23 2.27 -0.94 0.98 0.00 0.00 173.24 175.90 2dia s SER 112 N 2.50 4.63 0.00 7.02 1.04 -1.26 -5.37 113.70 122.26 2dia s SER 112 Ca -0.03 0.88 0.00 0.00 0.48 0.00 0.00 55.95 57.28 2dia s SER 112 Cb -0.12 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.50 2dia s SER 112 CO -0.13 -2.77 0.00 0.61 0.98 0.00 0.00 173.24 171.92