#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dia n SER 2 N 0.00 -0.53 -3.92 1.61 7.64 -1.26 -4.95 113.62 112.21 2dia n SER 2 Ca 0.00 -1.08 -0.10 0.00 1.01 0.00 0.00 58.87 58.69 2dia n SER 2 Cb 0.00 -2.60 -0.11 0.00 -1.01 0.00 0.00 64.21 60.49 2dia n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dia s SER 3 N -4.17 0.11 0.00 6.43 1.04 -1.26 -5.12 113.70 110.74 2dia s SER 3 Ca 0.15 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2dia s SER 3 Cb -0.08 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.17 2dia s SER 3 CO 0.93 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 175.51 2dia n GLY 4 N 1.92 2.11 3.47 7.32 0.00 -1.26 -5.12 105.19 113.64 2dia n GLY 4 Ca -0.21 -0.06 -0.45 0.00 0.00 0.00 0.00 46.02 45.30 2dia n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dia n SER 5 N 0.00 -0.35 -4.75 1.61 7.64 -1.26 -4.88 113.62 111.63 2dia n SER 5 Ca 0.00 1.10 -0.36 0.00 1.01 0.00 0.00 58.87 60.62 2dia n SER 5 Cb 0.00 -1.09 0.04 0.00 -1.01 0.00 0.00 64.21 62.14 2dia n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2dia s SER 6 N -0.83 5.16 -0.48 6.43 0.15 -1.26 -5.02 113.70 117.85 2dia s SER 6 Ca 0.62 2.37 0.06 0.00 0.70 0.00 0.00 55.95 59.70 2dia s SER 6 Cb -0.78 -2.60 0.19 0.00 -1.71 0.00 0.00 66.02 61.12 2dia s SER 6 CO 0.58 -1.61 0.73 -0.83 1.20 0.00 0.00 173.24 173.31 2dia s GLY 7 N -1.64 -1.30 0.81 9.45 0.00 -1.26 -5.15 107.32 108.23 2dia s GLY 7 Ca 0.77 -0.17 -0.11 0.00 0.00 0.00 0.00 44.72 45.21 2dia s GLY 7 CO 0.34 3.70 1.09 2.56 0.00 0.00 0.00 173.10 180.79 2dia s PRO 8 N 1.16 1.95 0.28 2.90 0.04 -1.26 -4.54 135.00 135.53 2dia s PRO 8 Ca 0.26 1.07 -0.28 0.00 0.04 0.00 0.00 61.00 62.08 2dia s PRO 8 Cb -0.00 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 2dia s PRO 8 CO -0.06 -1.83 0.96 0.12 0.04 0.00 0.00 177.00 176.23 2dia s PHE 9 N -2.91 3.82 -0.30 0.56 2.19 -1.26 -3.43 117.98 116.65 2dia s PHE 9 Ca 0.62 1.84 -0.12 0.00 0.33 0.00 0.00 56.93 59.61 2dia s PHE 9 Cb -0.17 -2.99 0.16 0.00 -1.31 0.00 0.00 43.02 38.70 2dia s PHE 9 CO 0.56 0.24 0.85 0.34 1.83 0.00 0.00 175.22 179.04 2dia s ASP 10 N -1.32 -0.83 0.29 6.13 2.15 -0.48 -4.89 116.67 117.71 2dia s ASP 10 Ca 0.45 0.98 0.07 0.00 0.43 0.00 0.00 52.55 54.48 2dia s ASP 10 Cb -0.24 1.88 0.43 0.00 -0.30 0.00 0.00 42.92 44.69 2dia s ASP 10 CO 0.30 -0.16 1.67 1.55 -0.17 0.00 0.00 175.17 178.36 2dia h PRO 11 N 7.76 0.19 0.00 4.34 0.13 -1.83 -2.91 132.00 139.69 2dia h PRO 11 Ca -0.17 -0.10 -0.02 0.00 -0.87 0.00 0.00 66.00 64.84 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 0.09 0.62 -0.11 1.03 -0.23 0.00 0.00 178.00 179.40 2dia h SER 12 N 0.16 0.00 1.02 1.44 0.87 -1.94 -0.97 113.55 114.12 2dia h SER 12 Ca 0.01 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2dia h SER 12 Cb 0.89 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.85 2dia h SER 12 CO 0.07 0.11 0.00 0.11 -0.53 0.00 0.00 176.83 176.59 2dia h LYS 13 N 0.00 0.00 -6.81 2.24 1.79 -1.87 -3.44 116.57 108.48 2dia h LYS 13 Ca -0.00 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.96 2dia h LYS 13 Cb 0.26 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 30.93 2dia h LYS 13 CO 0.01 0.00 0.52 0.08 -1.08 0.00 0.00 179.45 178.99 2dia s VAL 14 N -3.51 3.32 -0.14 0.50 1.01 -0.37 -4.37 120.40 116.84 2dia s VAL 14 Ca 0.03 1.30 0.03 0.00 0.00 0.00 0.00 61.98 63.33 2dia s VAL 14 Cb 0.09 -3.83 0.01 0.00 0.00 0.00 0.00 36.38 32.65 2dia s VAL 14 CO 0.51 0.30 -0.22 -0.69 0.00 0.00 0.00 175.10 175.00 2dia s VAL 15 N -1.04 2.09 -0.12 2.92 1.01 -0.95 -4.72 120.40 119.59 2dia s VAL 15 Ca 0.46 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.50 2dia s VAL 15 Cb -0.34 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.21 2dia s VAL 15 CO 0.43 0.55 -0.21 0.00 0.00 0.00 0.00 175.10 175.87 2dia s ALA 16 N 0.75 2.27 0.22 5.51 0.00 -1.26 -0.58 121.76 128.67 2dia s ALA 16 Ca -0.08 -1.02 -0.10 0.00 0.00 0.00 0.00 51.96 50.75 2dia s ALA 16 Cb -0.16 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 21.99 2dia s ALA 16 CO -0.00 0.12 0.38 -1.12 0.00 0.00 0.00 175.76 175.13 2dia s SER 17 N 0.59 -0.03 0.00 0.00 0.01 -1.02 -4.99 113.70 108.25 2dia s SER 17 Ca -0.12 -0.99 0.00 0.00 1.31 0.00 0.00 55.95 56.15 2dia s SER 17 Cb -0.17 0.52 0.00 0.00 0.21 0.00 0.00 66.02 66.58 2dia s SER 17 CO 0.03 -1.03 0.00 0.61 0.41 0.00 0.00 173.24 173.26 2dia n GLY 18 N -0.33 3.15 0.17 3.44 0.00 -1.26 -1.35 105.19 109.01 2dia n GLY 18 Ca -0.02 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.22 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 0.04 -0.44 1.61 0.13 -1.92 -3.07 132.00 128.35 2dia h PRO 19 Ca 0.00 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 2dia h PRO 19 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2dia h PRO 19 CO 0.00 0.52 0.29 0.78 -0.23 0.00 0.00 178.00 179.36 2dia h GLY 20 N 1.42 0.62 1.44 1.56 0.00 -1.67 0.69 103.07 107.14 2dia h GLY 20 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.09 2dia h GLY 20 CO 0.06 0.23 -0.01 1.04 0.00 0.00 0.00 176.54 177.86 2dia n LEU 21 N -4.47 0.05 -0.11 3.11 4.77 -1.16 -3.56 117.00 115.64 2dia n LEU 21 Ca 0.04 0.23 -0.14 0.00 -0.03 0.00 0.00 56.01 56.10 2dia n LEU 21 Cb 0.06 -0.24 -0.11 0.00 -2.33 0.00 0.00 43.42 40.80 2dia n LEU 21 CO 0.35 0.01 -1.19 -0.62 -1.33 0.00 0.00 177.39 174.61 2dia n GLU 22 N -1.22 0.68 -3.83 3.23 1.02 -0.01 -4.86 120.64 115.64 2dia n GLU 22 Ca 0.15 0.10 -0.07 0.00 -0.02 0.00 0.00 57.16 57.33 2dia n GLU 22 Cb 0.23 -1.44 -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 -1.01 1.18 0.00 0.00 177.13 177.30 2dia s HIS 23 N -2.44 -0.10 0.12 -0.32 3.76 0.03 -4.68 115.29 111.66 2dia s HIS 23 Ca -0.26 -0.37 -0.17 0.00 -0.15 0.00 0.00 55.06 54.11 2dia s HIS 23 Cb 0.07 0.73 0.04 0.00 1.11 0.00 0.00 32.58 34.52 2dia s HIS 23 CO 0.55 -1.23 0.41 0.20 -0.85 0.00 0.00 174.74 173.82 2dia s GLY 24 N -2.98 -0.30 -0.01 -2.22 0.00 -1.22 -4.11 107.32 96.48 2dia s GLY 24 Ca 0.13 0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.87 2dia s GLY 24 CO 0.07 -0.24 -0.00 1.25 0.00 0.00 0.00 173.10 174.18 2dia s LYS 25 N -3.66 0.16 -0.23 2.90 2.20 -1.26 -0.96 119.74 118.88 2dia s LYS 25 Ca 0.02 0.03 -0.36 0.00 -0.36 0.00 0.00 55.97 55.30 2dia s LYS 25 Cb 0.01 -0.27 -0.13 0.00 -1.51 0.00 0.00 37.83 35.94 2dia s LYS 25 CO -0.11 -0.06 1.94 0.28 -0.36 0.00 0.00 175.35 177.04 2dia n VAL 26 N 3.61 0.37 0.00 4.02 0.31 -0.89 0.04 118.33 125.78 2dia n VAL 26 Ca -0.20 -0.14 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2dia n VAL 26 Cb 0.55 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.87 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 5.01 3.12 2.43 2.92 0.00 0.77 -4.47 105.19 114.96 2dia n GLY 27 Ca 0.30 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.66 -2.24 -4.04 1.61 -0.58 0.11 -4.86 120.64 109.97 2dia n GLU 28 Ca 0.00 -1.23 -0.27 0.00 -0.42 0.00 0.00 57.16 55.24 2dia n GLU 28 Cb 0.00 -1.09 -0.17 0.00 -0.57 0.00 0.00 31.44 29.61 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 -3.15 1.46 -0.75 0.62 0.00 -1.26 -4.07 121.76 114.61 2dia s ALA 29 Ca 0.49 -0.62 -0.26 0.00 0.00 0.00 0.00 51.96 51.57 2dia s ALA 29 Cb -0.04 -0.90 0.01 0.00 0.00 0.00 0.00 23.12 22.19 2dia s ALA 29 CO 0.37 -0.33 1.56 0.20 0.00 0.00 0.00 175.76 177.56 2dia s GLY 30 N 1.50 0.64 -0.13 0.00 0.00 -0.17 -4.84 107.32 104.31 2dia s GLY 30 Ca 0.02 -1.27 -0.29 0.00 0.00 0.00 0.00 44.72 43.18 2dia s GLY 30 CO -0.07 2.99 1.82 1.08 0.00 0.00 0.00 173.10 178.92 2dia s LEU 31 N 7.15 4.00 -0.05 0.66 1.43 -1.26 -3.50 118.68 127.11 2dia s LEU 31 Ca 0.50 2.01 0.03 0.00 -1.03 0.00 0.00 54.13 55.64 2dia s LEU 31 Cb -0.08 -3.53 0.00 0.00 0.03 0.00 0.00 46.19 42.61 2dia s LEU 31 CO 0.12 -1.29 -0.13 -0.76 0.23 0.00 0.00 176.35 174.51 2dia s LEU 32 N 5.44 1.78 -0.13 1.79 1.43 0.32 -2.74 118.68 126.58 2dia s LEU 32 Ca 0.81 -0.30 0.01 0.00 -1.03 0.00 0.00 54.13 53.63 2dia s LEU 32 Cb -0.32 -0.82 0.02 0.00 0.03 0.00 0.00 46.19 45.10 2dia s LEU 32 CO 0.33 0.09 -0.17 -0.44 0.23 0.00 0.00 176.35 176.39 2dia s SER 33 N 0.31 2.72 -0.16 2.29 0.01 -0.45 -1.22 113.70 117.20 2dia s SER 33 Ca -0.08 -0.50 -0.06 0.00 1.31 0.00 0.00 55.95 56.61 2dia s SER 33 Cb -0.13 -1.23 -0.04 0.00 0.21 0.00 0.00 66.02 64.84 2dia s SER 33 CO 0.02 0.00 0.05 -0.69 0.41 0.00 0.00 173.24 173.04 2dia s VAL 34 N 1.14 4.71 -0.33 3.43 1.01 -0.76 -2.45 120.40 127.15 2dia s VAL 34 Ca -0.02 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 61.90 2dia s VAL 34 Cb -0.14 -3.09 0.08 0.00 0.00 0.00 0.00 36.38 33.23 2dia s VAL 34 CO -0.06 0.50 0.04 -0.62 0.00 0.00 0.00 175.10 174.97 2dia s ASP 35 N 0.04 4.85 -0.32 3.32 2.15 0.25 -2.14 116.67 124.81 2dia s ASP 35 Ca 0.05 -1.76 -0.13 0.00 0.43 0.00 0.00 52.55 51.14 2dia s ASP 35 Cb -0.12 -1.68 -0.03 0.00 -0.30 0.00 0.00 42.92 40.79 2dia s ASP 35 CO 0.01 -0.35 0.27 0.00 -0.17 0.00 0.00 175.17 174.93 2dia n SER 37 N 5.18 1.45 -0.11 0.00 7.64 -1.26 -4.77 113.62 121.75 2dia n SER 37 Ca -0.12 0.24 0.09 0.00 1.01 0.00 0.00 58.87 60.10 2dia n SER 37 Cb 0.50 -0.64 0.14 0.00 -1.01 0.00 0.00 64.21 63.21 2dia n SER 37 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dia n GLU 38 N -3.95 1.45 0.05 1.43 -0.58 -1.26 -4.68 120.64 113.10 2dia n GLU 38 Ca -0.10 -2.54 0.06 0.00 -0.42 0.00 0.00 57.16 54.16 2dia n GLU 38 Cb 0.36 -1.49 0.29 0.00 -0.57 0.00 0.00 31.44 30.02 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 -1.34 1.32 -0.83 0.62 0.00 -1.26 -4.02 120.51 115.00 2dia n ALA 39 Ca 0.15 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2dia n ALA 39 Cb 0.63 -1.20 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 -0.75 0.71 0.00 0.00 0.00 -1.22 -1.38 105.19 102.55 2dia n GLY 40 Ca 0.01 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 0.06 0.00 1.61 -0.04 -1.26 -4.92 135.00 130.45 2dia n PRO 41 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2dia n PRO 41 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 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 2.43 2.45 3.88 0.55 0.00 -1.26 -4.79 105.19 108.44 2dia n GLY 42 Ca 0.00 -1.76 -0.37 0.00 0.00 0.00 0.00 46.02 43.89 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 -2.13 3.86 0.09 4.61 0.00 -1.26 -4.69 121.76 122.24 2dia s ALA 43 Ca 0.00 -0.59 -0.09 0.00 0.00 0.00 0.00 51.96 51.28 2dia s ALA 43 Cb 0.00 -2.02 -0.06 0.00 0.00 0.00 0.00 23.12 21.04 2dia s ALA 43 CO 0.00 0.62 0.39 -1.17 0.00 0.00 0.00 175.76 175.60 2dia s LEU 44 N -1.17 4.33 -0.28 0.00 2.96 -1.26 -1.11 118.68 122.16 2dia s LEU 44 Ca 0.18 0.75 -0.21 0.00 -0.22 0.00 0.00 54.13 54.64 2dia s LEU 44 Cb -0.13 -3.04 0.08 0.00 0.50 0.00 0.00 46.19 43.61 2dia s LEU 44 CO 0.07 0.15 0.74 -0.83 -1.32 0.00 0.00 176.35 175.17 2dia s GLY 45 N -1.87 -0.53 0.17 7.98 0.00 -1.06 -5.02 107.32 106.99 2dia s GLY 45 Ca 0.34 2.29 0.11 0.00 0.00 0.00 0.00 44.72 47.46 2dia s GLY 45 CO 0.19 2.07 -0.23 -2.27 0.00 0.00 0.00 173.10 172.85 2dia s LEU 46 N 0.93 2.47 -0.16 0.66 2.96 -1.26 -0.69 118.68 123.58 2dia s LEU 46 Ca -0.04 -0.79 -0.04 0.00 -0.22 0.00 0.00 54.13 53.04 2dia s LEU 46 Cb -0.05 -1.25 0.06 0.00 0.50 0.00 0.00 46.19 45.44 2dia s LEU 46 CO -0.09 0.14 0.08 -0.70 -1.32 0.00 0.00 176.35 174.46 2dia s GLU 47 N -2.47 0.12 -0.22 1.98 2.12 0.28 -4.96 118.70 115.55 2dia s GLU 47 Ca 0.19 -0.07 -0.12 0.00 0.36 0.00 0.00 54.97 55.33 2dia s GLU 47 Cb -0.09 -1.72 -0.05 0.00 0.26 0.00 0.00 34.13 32.54 2dia s GLU 47 CO 0.09 -0.63 0.21 0.00 -0.54 0.00 0.00 175.26 174.40 2dia s ALA 48 N 2.11 3.61 -0.03 6.30 0.00 -1.26 -1.78 121.76 130.70 2dia s ALA 48 Ca 0.02 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 2dia s ALA 48 Cb -0.16 -2.37 0.02 0.00 0.00 0.00 0.00 23.12 20.62 2dia s ALA 48 CO -0.08 -0.15 0.07 0.08 0.00 0.00 0.00 175.76 175.68 2dia s VAL 49 N 0.97 -0.04 0.64 0.00 1.01 -1.21 -2.14 120.40 119.63 2dia s VAL 49 Ca 0.11 0.13 -0.11 0.00 0.00 0.00 0.00 61.98 62.10 2dia s VAL 49 Cb -0.13 -0.12 -0.03 0.00 0.00 0.00 0.00 36.38 36.10 2dia s VAL 49 CO 0.04 0.05 1.04 -0.55 0.00 0.00 0.00 175.10 175.68 2dia s SER 50 N 0.72 6.04 0.26 3.32 0.15 -0.51 -0.18 113.70 123.49 2dia s SER 50 Ca -0.06 1.47 -0.04 0.00 0.70 0.00 0.00 55.95 58.02 2dia s SER 50 Cb -0.08 -2.48 0.51 0.00 -1.71 0.00 0.00 66.02 62.26 2dia s SER 50 CO -0.03 -1.00 1.64 -2.24 1.20 0.00 0.00 173.24 172.82 2dia h ASP 51 N -0.39 -0.22 0.64 5.45 2.03 -1.25 0.77 116.42 123.47 2dia h ASP 51 Ca -0.44 0.19 -0.06 0.00 -0.73 0.00 0.00 57.03 55.99 2dia h ASP 51 Cb 1.19 0.31 -0.01 0.00 -0.83 0.00 0.00 39.33 39.99 2dia h ASP 51 CO 0.61 -0.16 -0.26 -1.28 -1.03 0.00 0.00 179.24 177.12 2dia h SER 52 N 0.15 0.00 0.00 4.15 0.87 -1.92 -3.47 113.55 113.33 2dia h SER 52 Ca 0.45 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.01 2dia h SER 52 Cb 0.82 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 2dia h SER 52 CO -0.65 0.26 0.00 0.61 -0.53 0.00 0.00 176.83 176.53 2dia n GLY 53 N -0.17 0.73 3.32 5.77 0.00 0.27 -5.12 105.19 109.99 2dia n GLY 53 Ca -0.01 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.54 3.64 -0.46 2.61 2.01 -1.23 -4.79 115.64 116.88 2dia s THR 54 Ca 0.00 -0.67 -0.29 0.00 0.31 0.00 0.00 61.69 61.04 2dia s THR 54 Cb 0.00 -2.80 0.02 0.00 0.01 0.00 0.00 72.50 69.73 2dia s THR 54 CO 0.00 0.21 1.23 -0.54 -0.69 0.00 0.00 174.62 174.83 2dia s LYS 55 N 1.47 3.67 0.83 4.92 1.02 -1.26 -1.42 119.74 128.96 2dia s LYS 55 Ca 0.03 0.69 -0.13 0.00 0.02 0.00 0.00 55.97 56.58 2dia s LYS 55 Cb -0.16 -3.95 0.10 0.00 -0.52 0.00 0.00 37.83 33.29 2dia s LYS 55 CO -0.00 -1.45 1.20 0.00 -0.92 0.00 0.00 175.35 174.17 2dia s ALA 56 N 4.81 2.59 -0.37 5.17 0.00 -0.91 -4.97 121.76 128.08 2dia s ALA 56 Ca 0.53 -0.72 -0.26 0.00 0.00 0.00 0.00 51.96 51.50 2dia s ALA 56 Cb -0.09 -2.94 0.02 0.00 0.00 0.00 0.00 23.12 20.11 2dia s ALA 56 CO 0.32 -1.78 0.95 -2.00 0.00 0.00 0.00 175.76 173.25 2dia s GLU 57 N -5.62 3.85 0.01 0.00 2.12 -1.18 -4.76 118.70 113.13 2dia s GLU 57 Ca 0.64 0.62 0.06 0.00 0.36 0.00 0.00 54.97 56.64 2dia s GLU 57 Cb -0.10 -3.80 -0.03 0.00 0.26 0.00 0.00 34.13 30.45 2dia s GLU 57 CO 0.50 -0.97 -0.16 0.08 -0.54 0.00 0.00 175.26 174.16 2dia s VAL 58 N 3.55 2.95 -0.10 3.70 1.01 -1.26 -1.30 120.40 128.95 2dia s VAL 58 Ca 0.39 -1.03 -0.05 0.00 0.00 0.00 0.00 61.98 61.30 2dia s VAL 58 Cb -0.12 -2.23 0.05 0.00 0.00 0.00 0.00 36.38 34.08 2dia s VAL 58 CO 0.19 0.41 0.22 -0.55 0.00 0.00 0.00 175.10 175.37 2dia s SER 59 N -1.26 -0.14 -0.12 3.32 0.15 -1.02 -5.00 113.70 109.63 2dia s SER 59 Ca 0.14 0.48 -0.01 0.00 0.70 0.00 0.00 55.95 57.26 2dia s SER 59 Cb -0.11 0.38 -0.02 0.00 -1.71 0.00 0.00 66.02 64.57 2dia s SER 59 CO 0.04 -0.17 -0.10 -0.63 1.20 0.00 0.00 173.24 173.58 2dia s ILE 60 N 1.39 3.38 0.13 6.45 1.01 -1.26 -2.44 121.20 129.85 2dia s ILE 60 Ca -0.08 -0.56 0.07 0.00 0.00 0.00 0.00 60.65 60.08 2dia s ILE 60 Cb -0.11 -2.42 -0.04 0.00 0.01 0.00 0.00 42.46 39.90 2dia s ILE 60 CO -0.08 0.53 -0.16 -1.58 0.00 0.00 0.00 174.94 173.65 2dia s GLN 61 N 0.10 1.08 0.18 2.79 2.00 -0.91 -4.94 119.66 119.96 2dia s GLN 61 Ca -0.04 -1.24 0.03 0.00 -2.00 0.00 0.00 55.36 52.11 2dia s GLN 61 Cb -0.14 -1.06 -0.03 0.00 0.80 0.00 0.00 33.01 32.57 2dia s GLN 61 CO 0.04 0.22 0.31 -0.80 -0.50 0.00 0.00 175.29 174.56 2dia s ASN 62 N -2.37 6.33 0.12 6.67 -0.87 -1.26 -0.26 114.94 123.30 2dia s ASN 62 Ca 0.09 0.13 0.04 0.00 -1.57 0.00 0.00 52.86 51.55 2dia s ASN 62 Cb -0.06 -1.89 -0.04 0.00 -0.02 0.00 0.00 41.25 39.24 2dia s ASN 62 CO 0.04 0.01 -0.09 0.20 -2.57 0.00 0.00 177.10 174.68 2dia s ASN 63 N -3.51 1.56 0.44 -1.22 0.01 -0.68 -4.87 114.94 106.66 2dia s ASN 63 Ca 0.34 -0.98 0.31 0.00 -0.71 0.00 0.00 52.86 51.82 2dia s ASN 63 Cb -0.10 0.02 1.39 0.00 0.41 0.00 0.00 41.25 42.97 2dia s ASN 63 CO 0.29 -0.35 1.91 0.50 -1.51 0.00 0.00 177.10 177.94 2dia h LYS 64 N 2.97 0.00 -0.01 -0.60 3.11 -2.00 -1.31 116.57 118.74 2dia h LYS 64 Ca -0.36 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.48 2dia h LYS 64 Cb 1.18 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.41 2dia h LYS 64 CO 0.62 0.00 -0.05 -0.25 -2.81 0.00 0.00 179.45 176.96 2dia n ASP 65 N -2.69 0.66 0.00 4.20 8.00 -1.26 -4.89 116.55 120.57 2dia n ASP 65 Ca 0.00 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.52 2dia n ASP 65 Cb 0.20 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 2dia n ASP 65 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dia n GLY 66 N 1.17 0.75 3.95 0.44 0.00 -0.49 -4.97 105.19 106.04 2dia n GLY 66 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.72 4.27 -0.12 2.61 -4.23 -1.26 -4.32 115.64 109.87 2dia s THR 67 Ca 0.00 -0.43 0.02 0.00 -1.18 0.00 0.00 61.69 60.10 2dia s THR 67 Cb 0.00 -3.58 -0.00 0.00 1.34 0.00 0.00 72.50 70.26 2dia s THR 67 CO 0.00 -0.42 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.15 2dia s TYR 68 N -2.53 2.66 -0.79 3.99 1.51 -0.91 -1.69 117.35 119.59 2dia s TYR 68 Ca 0.47 -1.02 -0.19 0.00 -1.01 0.00 0.00 57.07 55.31 2dia s TYR 68 Cb -0.10 -1.78 0.12 0.00 -0.11 0.00 0.00 41.96 40.09 2dia s TYR 68 CO 0.38 -0.42 0.97 0.00 -1.11 0.00 0.00 175.55 175.37 2dia s ALA 69 N 0.49 3.38 -0.09 3.71 0.00 0.64 -1.83 121.76 128.05 2dia s ALA 69 Ca -0.14 -2.48 -0.12 0.00 0.00 0.00 0.00 51.96 49.23 2dia s ALA 69 Cb -0.17 -3.85 -0.05 0.00 0.00 0.00 0.00 23.12 19.05 2dia s ALA 69 CO 0.05 -2.74 0.28 0.08 0.00 0.00 0.00 175.76 173.43 2dia s VAL 70 N 2.80 5.28 0.04 0.00 1.01 -0.36 -2.14 120.40 127.02 2dia s VAL 70 Ca 0.24 0.52 -0.04 0.00 0.00 0.00 0.00 61.98 62.71 2dia s VAL 70 Cb -0.12 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.67 2dia s VAL 70 CO -0.01 0.55 0.05 -0.89 0.00 0.00 0.00 175.10 174.79 2dia s THR 71 N -0.68 0.15 -0.09 3.92 2.01 -1.02 -0.52 115.64 119.40 2dia s THR 71 Ca 0.18 -1.20 -0.05 0.00 0.31 0.00 0.00 61.69 60.94 2dia s THR 71 Cb -0.14 -0.90 0.04 0.00 0.01 0.00 0.00 72.50 71.51 2dia s THR 71 CO 0.07 -0.66 0.21 -0.72 -0.69 0.00 0.00 174.62 172.83 2dia s TYR 72 N -2.67 -0.27 -0.43 4.92 -0.85 -1.23 -2.42 117.35 114.40 2dia s TYR 72 Ca -0.05 0.67 -0.06 0.00 -0.52 0.00 0.00 57.07 57.12 2dia s TYR 72 Cb -0.01 0.01 0.11 0.00 0.38 0.00 0.00 41.96 42.45 2dia s TYR 72 CO -0.05 -0.20 0.26 0.08 -1.52 0.00 0.00 175.55 174.12 2dia s VAL 73 N 1.16 3.71 -0.02 -3.49 1.01 -0.42 -1.00 120.40 121.35 2dia s VAL 73 Ca -0.09 -1.90 -0.30 0.00 0.00 0.00 0.00 61.98 59.69 2dia s VAL 73 Cb -0.10 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.75 2dia s VAL 73 CO -0.07 -0.71 1.47 -2.16 0.00 0.00 0.00 175.10 173.63 2dia s PRO 74 N 1.25 4.25 -0.02 2.72 0.04 -1.26 -3.11 135.00 138.87 2dia s PRO 74 Ca 0.07 2.02 -0.16 0.00 0.04 0.00 0.00 61.00 62.96 2dia s PRO 74 Cb -0.24 -3.69 -0.33 0.00 0.04 0.00 0.00 34.50 30.28 2dia s PRO 74 CO -0.02 -0.67 0.84 -0.07 0.04 0.00 0.00 177.00 177.12 2dia h LEU 75 N 8.96 0.66 -8.47 -3.56 3.38 -1.93 0.22 115.31 114.56 2dia h LEU 75 Ca -0.37 -0.92 -0.67 0.00 0.09 0.00 0.00 57.88 56.01 2dia h LEU 75 Cb 1.17 -0.21 -0.30 0.00 0.09 0.00 0.00 40.66 41.41 2dia h LEU 75 CO 0.92 1.66 -0.81 0.28 0.09 0.00 0.00 178.44 180.58 2dia s THR 76 N -2.54 2.63 0.60 0.22 -1.32 -1.26 -4.69 115.64 109.28 2dia s THR 76 Ca -0.13 -0.81 -0.19 0.00 -1.21 0.00 0.00 61.69 59.35 2dia s THR 76 Cb 0.04 -2.08 -0.03 0.00 -1.51 0.00 0.00 72.50 68.92 2dia s THR 76 CO 0.88 0.53 1.24 0.00 -2.21 0.00 0.00 174.62 175.07 2dia s ALA 77 N 0.44 2.52 0.00 11.08 0.00 -1.26 -4.92 121.76 129.62 2dia s ALA 77 Ca -0.13 1.09 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2dia s ALA 77 Cb -0.16 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2dia s ALA 77 CO 0.06 -1.29 0.00 0.41 0.00 0.00 0.00 175.76 174.93 2dia n GLY 78 N 0.64 0.42 3.62 0.00 0.00 -1.04 -5.00 105.19 103.82 2dia n GLY 78 Ca 0.14 -1.77 -0.43 0.00 0.00 0.00 0.00 46.02 43.96 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 -1.85 3.79 0.21 1.61 -1.94 -1.26 -2.27 119.30 117.59 2dia s MET 79 Ca 0.00 1.08 -0.00 0.00 -1.71 0.00 0.00 55.69 55.05 2dia s MET 79 Cb 0.00 -3.92 -0.04 0.00 2.01 0.00 0.00 34.83 32.88 2dia s MET 79 CO 0.00 -1.28 0.40 0.71 -0.01 0.00 0.00 175.02 174.84 2dia s TYR 80 N 4.69 3.48 -0.46 -0.03 1.51 -1.09 -0.65 117.35 124.80 2dia s TYR 80 Ca 0.57 0.33 0.04 0.00 -1.01 0.00 0.00 57.07 56.99 2dia s TYR 80 Cb -0.15 -1.85 0.12 0.00 -0.11 0.00 0.00 41.96 39.98 2dia s TYR 80 CO 0.27 0.36 0.20 0.99 -1.11 0.00 0.00 175.55 176.26 2dia s THR 81 N -1.90 2.34 0.02 -0.71 2.01 0.75 -2.96 115.64 115.19 2dia s THR 81 Ca 0.38 -2.94 -0.30 0.00 0.31 0.00 0.00 61.69 59.14 2dia s THR 81 Cb -0.11 -2.66 -0.05 0.00 0.01 0.00 0.00 72.50 69.69 2dia s THR 81 CO 0.29 -0.75 1.23 -0.76 -0.69 0.00 0.00 174.62 173.94 2dia s LEU 82 N 0.14 4.34 -0.14 4.42 1.43 -0.45 -3.36 118.68 125.05 2dia s LEU 82 Ca 0.15 1.98 -0.02 0.00 -1.03 0.00 0.00 54.13 55.21 2dia s LEU 82 Cb -0.24 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.46 2dia s LEU 82 CO -0.03 -0.53 0.01 -0.89 0.23 0.00 0.00 176.35 175.14 2dia s THR 83 N 1.53 0.56 -0.09 5.49 2.01 -0.74 -1.08 115.64 123.32 2dia s THR 83 Ca 0.59 -0.31 0.04 0.00 0.31 0.00 0.00 61.69 62.31 2dia s THR 83 Cb -0.29 -0.89 0.00 0.00 0.01 0.00 0.00 72.50 71.34 2dia s THR 83 CO 0.27 0.02 -0.20 -0.32 -0.69 0.00 0.00 174.62 173.69 2dia s MET 84 N 1.87 2.59 -0.15 4.92 0.00 -1.26 0.99 119.30 128.27 2dia s MET 84 Ca 0.02 -0.74 0.02 0.00 0.00 0.00 0.00 55.69 54.99 2dia s MET 84 Cb -0.15 -2.01 0.02 0.00 0.00 0.00 0.00 34.83 32.69 2dia s MET 84 CO -0.07 0.15 -0.19 0.15 0.00 0.00 0.00 175.02 175.06 2dia s LYS 85 N 0.40 2.75 -0.40 4.11 1.02 0.13 -2.63 119.74 125.12 2dia s LYS 85 Ca -0.17 -0.75 -0.10 0.00 0.02 0.00 0.00 55.97 54.97 2dia s LYS 85 Cb -0.17 -2.32 0.05 0.00 -0.52 0.00 0.00 37.83 34.88 2dia s LYS 85 CO 0.07 -0.11 0.24 -0.47 -0.92 0.00 0.00 175.35 174.17 2dia s TYR 86 N 1.07 3.28 -0.70 3.18 6.14 0.61 -2.57 117.35 128.36 2dia s TYR 86 Ca -0.02 -1.22 0.00 0.00 0.64 0.00 0.00 57.07 56.47 2dia s TYR 86 Cb -0.14 -2.73 0.00 0.00 0.42 0.00 0.00 41.96 39.51 2dia s TYR 86 CO -0.06 -0.75 0.00 0.41 0.64 0.00 0.00 175.55 175.79 2dia n GLY 87 N 4.98 0.12 2.12 8.97 0.00 -0.27 -2.65 105.19 118.47 2dia n GLY 87 Ca -0.11 -0.56 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.09 1.07 3.25 -0.02 0.00 -1.26 -4.91 105.19 102.23 2dia n GLY 88 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.29 3.14 0.67 1.61 2.02 -1.08 -5.07 118.70 119.70 2dia s GLU 89 Ca 0.00 -0.82 -0.17 0.00 0.02 0.00 0.00 54.97 54.00 2dia s GLU 89 Cb 0.00 -2.44 -0.00 0.00 0.10 0.00 0.00 34.13 31.79 2dia s GLU 89 CO 0.00 0.13 1.21 1.28 0.02 0.00 0.00 175.26 177.89 2dia n LEU 90 N 3.70 5.30 -4.93 1.80 4.77 -1.26 -0.29 117.00 126.09 2dia n LEU 90 Ca -0.19 0.78 -0.25 0.00 -0.03 0.00 0.00 56.01 56.32 2dia n LEU 90 Cb 0.52 -1.51 -0.01 0.00 -2.33 0.00 0.00 43.42 40.09 2dia n LEU 90 CO 0.28 -1.31 0.25 0.68 -1.33 0.00 0.00 177.39 175.96 2dia s VAL 91 N -1.54 4.98 -2.00 4.08 -7.23 -1.08 -4.71 120.40 112.90 2dia s VAL 91 Ca 0.80 -0.31 0.09 0.00 -1.81 0.00 0.00 61.98 60.75 2dia s VAL 91 Cb -0.37 -3.84 0.27 0.00 0.56 0.00 0.00 36.38 33.00 2dia s VAL 91 CO 0.43 -0.61 1.01 -0.81 -0.31 0.00 0.00 175.10 174.81 2dia n PRO 92 N -1.92 0.49 -0.07 4.82 -0.04 -1.26 -1.82 135.00 135.20 2dia n PRO 92 Ca -0.03 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.46 2dia n PRO 92 Cb 0.56 -1.30 0.07 0.00 -0.04 0.00 0.00 33.50 32.78 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 -0.80 0.12 -3.70 0.54 8.25 -1.26 -5.02 115.22 113.35 2dia n HIS 93 Ca 0.07 -0.62 -0.13 0.00 -0.26 0.00 0.00 57.72 56.77 2dia n HIS 93 Cb 0.03 -0.08 -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 -1.48 -0.26 0.54 4.41 0.40 -0.76 -4.05 117.98 116.78 2dia s PHE 94 Ca 0.12 0.32 -0.20 0.00 -0.60 0.00 0.00 56.93 56.58 2dia s PHE 94 Cb 0.09 0.18 -0.06 0.00 0.51 0.00 0.00 43.02 43.74 2dia s PHE 94 CO 0.04 -0.49 1.13 -1.25 0.70 0.00 0.00 175.22 175.34 2dia s PRO 95 N -1.86 3.38 -0.05 0.24 0.04 -1.26 -4.39 135.00 131.10 2dia s PRO 95 Ca -0.09 1.62 0.02 0.00 0.04 0.00 0.00 61.00 62.59 2dia s PRO 95 Cb -0.02 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.50 2dia s PRO 95 CO 0.02 -0.83 -0.10 0.00 0.04 0.00 0.00 177.00 176.13 2dia s ALA 96 N -1.76 1.09 -0.08 8.56 0.00 -0.24 -4.97 121.76 124.36 2dia s ALA 96 Ca 0.72 -0.34 -0.15 0.00 0.00 0.00 0.00 51.96 52.19 2dia s ALA 96 Cb -0.24 -0.49 -0.05 0.00 0.00 0.00 0.00 23.12 22.34 2dia s ALA 96 CO 0.27 0.11 0.37 -0.98 0.00 0.00 0.00 175.76 175.53 2dia s ARG 97 N 0.58 4.08 -0.05 0.00 1.04 -1.26 -1.34 118.95 122.00 2dia s ARG 97 Ca -0.11 0.29 -0.01 0.00 -1.04 0.00 0.00 55.73 54.86 2dia s ARG 97 Cb -0.14 -3.33 0.03 0.00 -2.04 0.00 0.00 34.95 29.47 2dia s ARG 97 CO 0.02 0.45 0.02 0.08 -0.04 0.00 0.00 175.30 175.83 2dia s VAL 98 N -0.25 0.16 -0.24 4.99 1.01 -1.15 -4.99 120.40 119.92 2dia s VAL 98 Ca 0.22 0.20 -0.29 0.00 0.00 0.00 0.00 61.98 62.10 2dia s VAL 98 Cb -0.15 -0.32 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 2dia s VAL 98 CO 0.09 0.19 1.29 -0.75 0.00 0.00 0.00 175.10 175.92 2dia s LYS 99 N 1.65 4.05 -0.15 2.72 2.20 -1.26 -2.67 119.74 126.28 2dia s LYS 99 Ca -0.01 1.43 -0.07 0.00 -0.36 0.00 0.00 55.97 56.96 2dia s LYS 99 Cb -0.13 -3.83 -0.04 0.00 -1.51 0.00 0.00 37.83 32.32 2dia s LYS 99 CO -0.03 -0.94 0.09 0.08 -0.36 0.00 0.00 175.35 174.19 2dia s VAL 100 N 4.00 5.05 0.22 4.02 1.01 -0.96 -3.42 120.40 130.31 2dia s VAL 100 Ca 0.56 0.05 -0.01 0.00 0.00 0.00 0.00 61.98 62.58 2dia s VAL 100 Cb -0.19 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2dia s VAL 100 CO 0.19 0.53 0.41 -1.61 0.00 0.00 0.00 175.10 174.62 2dia s GLU 101 N -0.27 3.52 0.71 2.72 2.02 -0.14 -2.51 118.70 124.76 2dia s GLU 101 Ca 0.09 -0.34 -0.13 0.00 0.02 0.00 0.00 54.97 54.61 2dia s GLU 101 Cb -0.12 -2.82 0.02 0.00 0.10 0.00 0.00 34.13 31.31 2dia s GLU 101 CO 0.01 0.38 1.10 -1.25 0.02 0.00 0.00 175.26 175.52 2dia s PRO 102 N -3.41 2.57 -0.10 0.39 0.04 -1.26 -2.10 135.00 131.13 2dia s PRO 102 Ca 0.39 1.30 -0.04 0.00 0.04 0.00 0.00 61.00 62.68 2dia s PRO 102 Cb -0.11 -1.93 -0.15 0.00 0.04 0.00 0.00 34.50 32.36 2dia s PRO 102 CO 0.29 -1.41 3.15 0.00 0.04 0.00 0.00 177.00 179.07 2dia n ALA 103 N -2.88 5.97 0.56 8.56 0.00 -1.26 -4.47 120.51 126.99 2dia n ALA 103 Ca 0.10 -1.76 0.06 0.00 0.00 0.00 0.00 53.44 51.84 2dia n ALA 103 Cb 0.52 -2.04 0.31 0.00 0.00 0.00 0.00 19.45 18.25 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 1.95 0.82 -0.06 0.00 0.24 -1.26 -2.89 118.33 117.13 2dia n VAL 104 Ca 0.37 0.21 -0.13 0.00 -2.04 0.00 0.00 64.34 62.75 2dia n VAL 104 Cb 0.77 -0.98 -0.12 0.00 -1.47 0.00 0.00 33.84 32.04 2dia n VAL 104 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 2dia h ASP 105 N 0.00 -0.00 -3.18 -1.34 3.32 -2.01 -3.45 116.42 109.76 2dia h ASP 105 Ca 0.00 -0.89 -0.60 0.00 0.02 0.00 0.00 57.03 55.55 2dia h ASP 105 Cb 0.17 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.62 2dia h ASP 105 CO 0.00 0.93 -0.34 -0.89 -1.72 0.00 0.00 179.24 177.23 2dia s THR 106 N -2.26 5.30 -0.65 0.35 2.01 -1.14 -4.99 115.64 114.25 2dia s THR 106 Ca -0.17 0.53 0.00 0.00 0.31 0.00 0.00 61.69 62.35 2dia s THR 106 Cb -0.03 -3.61 0.41 0.00 0.01 0.00 0.00 72.50 69.29 2dia s THR 106 CO 0.63 0.44 1.82 -0.24 -0.69 0.00 0.00 174.62 176.58 2dia n SER 107 N 3.16 6.94 -4.79 3.53 2.88 -1.26 -4.93 113.62 119.15 2dia n SER 107 Ca -0.13 -3.79 -0.36 0.00 -1.33 0.00 0.00 58.87 53.26 2dia n SER 107 Cb 0.52 -0.87 -0.05 0.00 -0.75 0.00 0.00 64.21 63.06 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 -2.00 6.93 0.00 -3.46 0.15 -1.26 -4.78 113.70 109.27 2dia s SER 108 Ca 0.57 1.91 0.00 0.00 0.70 0.00 0.00 55.95 59.12 2dia s SER 108 Cb 0.46 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 62.20 2dia s SER 108 CO -0.16 -0.37 0.00 0.61 1.20 0.00 0.00 173.24 174.52 2dia n GLY 109 N 0.17 -1.56 0.25 9.45 0.00 -1.26 -4.96 105.19 107.27 2dia n GLY 109 Ca 0.05 0.56 0.16 0.00 0.00 0.00 0.00 46.02 46.80 2dia n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dia h PRO 110 N 0.00 0.00 -4.91 1.61 0.13 -2.06 -3.41 132.00 123.37 2dia h PRO 110 Ca 0.00 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.46 2dia h PRO 110 Cb 0.00 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 30.83 2dia h PRO 110 CO 0.00 0.00 -0.72 -1.54 -0.23 0.00 0.00 178.00 175.51 2dia s SER 111 N -5.34 4.45 -0.26 1.44 1.04 -1.26 -5.09 113.70 108.67 2dia s SER 111 Ca 0.02 -0.73 -0.10 0.00 0.48 0.00 0.00 55.95 55.62 2dia s SER 111 Cb 0.09 -1.72 -0.04 0.00 0.10 0.00 0.00 66.02 64.45 2dia s SER 111 CO 0.50 -0.11 0.14 -0.44 0.98 0.00 0.00 173.24 174.31 2dia s SER 112 N 1.39 5.71 0.00 7.02 0.01 -1.26 -4.99 113.70 121.57 2dia s SER 112 Ca 0.02 -0.06 0.00 0.00 1.31 0.00 0.00 55.95 57.22 2dia s SER 112 Cb -0.16 -2.04 0.00 0.00 0.21 0.00 0.00 66.02 64.02 2dia s SER 112 CO -0.03 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.20