#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 1.41 -4.64 1.61 2.88 -1.26 -4.94 113.62 108.68 2dia n SER 2 Ca 0.00 0.24 -0.43 0.00 -1.33 0.00 0.00 58.87 57.36 2dia n SER 2 Cb 0.00 -0.58 -0.03 0.00 -0.75 0.00 0.00 64.21 62.85 2dia n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dia s SER 3 N -6.65 6.37 0.19 -3.46 1.04 -1.26 -4.94 113.70 104.98 2dia s SER 3 Ca -0.26 2.04 -0.30 0.00 0.48 0.00 0.00 55.95 57.90 2dia s SER 3 Cb 0.10 -2.53 -0.09 0.00 0.10 0.00 0.00 66.02 63.59 2dia s SER 3 CO 0.34 -1.20 1.40 -0.83 0.98 0.00 0.00 173.24 173.92 2dia s GLY 4 N 4.50 2.21 0.59 7.32 0.00 -1.26 -4.99 107.32 115.69 2dia s GLY 4 Ca 0.79 1.21 -0.17 0.00 0.00 0.00 0.00 44.72 46.54 2dia s GLY 4 CO 0.32 2.26 1.10 -0.45 0.00 0.00 0.00 173.10 176.33 2dia s SER 5 N 0.60 5.57 -0.17 1.64 0.15 -1.26 -5.01 113.70 115.22 2dia s SER 5 Ca 0.61 2.01 -0.15 0.00 0.70 0.00 0.00 55.95 59.11 2dia s SER 5 Cb -0.39 -2.56 -0.05 0.00 -1.71 0.00 0.00 66.02 61.31 2dia s SER 5 CO 0.37 -1.32 -0.28 -1.20 1.20 0.00 0.00 173.24 172.02 2dia n SER 6 N -1.84 1.89 -4.77 5.45 7.64 -1.26 -4.96 113.62 115.77 2dia n SER 6 Ca 0.10 0.45 -0.39 0.00 1.01 0.00 0.00 58.87 60.04 2dia n SER 6 Cb 0.52 -0.79 -0.04 0.00 -1.01 0.00 0.00 64.21 62.89 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 -4.67 2.93 0.65 0.23 0.00 -1.26 -5.02 107.32 100.18 2dia s GLY 7 Ca -0.24 0.84 -0.15 0.00 0.00 0.00 0.00 44.72 45.17 2dia s GLY 7 CO 0.35 1.37 1.11 2.56 0.00 0.00 0.00 173.10 178.50 2dia s PRO 8 N -1.91 2.84 0.38 2.90 0.04 -1.26 -4.54 135.00 133.45 2dia s PRO 8 Ca 0.51 1.41 -0.25 0.00 0.04 0.00 0.00 61.00 62.71 2dia s PRO 8 Cb -0.28 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 2dia s PRO 8 CO 0.36 -1.22 1.06 0.12 0.04 0.00 0.00 177.00 177.37 2dia s PHE 9 N -2.29 3.29 -0.30 0.56 5.36 -1.26 -3.57 117.98 119.77 2dia s PHE 9 Ca 0.67 1.65 -0.13 0.00 -0.96 0.00 0.00 56.93 58.16 2dia s PHE 9 Cb -0.21 -3.16 0.17 0.00 -0.34 0.00 0.00 43.02 39.48 2dia s PHE 9 CO 0.40 -0.67 1.00 -0.51 -1.46 0.00 0.00 175.22 173.98 2dia s ASP 10 N -1.45 -0.57 0.34 6.13 1.01 -0.65 -4.90 116.67 116.58 2dia s ASP 10 Ca 0.56 0.51 0.13 0.00 0.71 0.00 0.00 52.55 54.46 2dia s ASP 10 Cb -0.24 1.54 0.60 0.00 1.01 0.00 0.00 42.92 45.84 2dia s ASP 10 CO 0.30 -0.11 1.74 1.55 0.21 0.00 0.00 175.17 178.86 2dia h PRO 11 N 7.78 0.00 -0.33 8.23 0.13 -1.85 -3.00 132.00 142.96 2dia h PRO 11 Ca -0.15 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.94 2dia h PRO 11 Cb 1.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2dia h PRO 11 CO 0.01 0.46 0.03 0.77 -0.23 0.00 0.00 178.00 179.04 2dia h SER 12 N 0.00 0.46 0.63 1.44 0.02 -1.95 -1.41 113.55 112.74 2dia h SER 12 Ca -0.00 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 2dia h SER 12 Cb 0.84 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.26 2dia h SER 12 CO 0.06 0.50 0.00 0.11 -1.14 0.00 0.00 176.83 176.36 2dia h LYS 13 N 0.48 0.00 -6.87 3.45 1.79 -1.88 -3.44 116.57 110.10 2dia h LYS 13 Ca 0.11 0.00 -0.52 0.00 -2.18 0.00 0.00 60.65 58.06 2dia h LYS 13 Cb 0.27 0.00 0.06 0.00 -1.58 0.00 0.00 32.23 30.98 2dia h LYS 13 CO 0.00 0.00 0.63 0.08 -1.08 0.00 0.00 179.45 179.08 2dia s VAL 14 N -3.82 2.77 -0.11 0.50 1.01 -0.53 -4.51 120.40 115.70 2dia s VAL 14 Ca -0.01 0.77 0.03 0.00 0.00 0.00 0.00 61.98 62.77 2dia s VAL 14 Cb 0.10 -3.49 0.01 0.00 0.00 0.00 0.00 36.38 33.00 2dia s VAL 14 CO 0.48 0.18 -0.21 -0.69 0.00 0.00 0.00 175.10 174.87 2dia s VAL 15 N -1.11 1.86 -0.06 2.92 1.01 -0.95 -4.80 120.40 119.27 2dia s VAL 15 Ca 0.49 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.62 2dia s VAL 15 Cb -0.39 -1.64 0.00 0.00 0.00 0.00 0.00 36.38 34.35 2dia s VAL 15 CO 0.52 0.51 -0.16 0.00 0.00 0.00 0.00 175.10 175.97 2dia s ALA 16 N 0.63 1.47 0.37 5.51 0.00 -1.26 -0.66 121.76 127.82 2dia s ALA 16 Ca -0.13 -0.61 -0.08 0.00 0.00 0.00 0.00 51.96 51.14 2dia s ALA 16 Cb -0.16 -0.55 0.03 0.00 0.00 0.00 0.00 23.12 22.44 2dia s ALA 16 CO 0.03 0.22 0.63 0.43 0.00 0.00 0.00 175.76 177.07 2dia n SER 17 N 3.41 -1.80 0.00 0.00 7.64 -0.89 -4.99 113.62 116.99 2dia n SER 17 Ca -0.20 -2.75 0.00 0.00 1.01 0.00 0.00 58.87 56.93 2dia n SER 17 Cb 0.53 3.15 0.00 0.00 -1.01 0.00 0.00 64.21 66.87 2dia n SER 17 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dia n GLY 18 N -0.56 3.00 0.17 0.23 0.00 -1.26 -1.36 105.19 105.42 2dia n GLY 18 Ca -0.04 -1.90 0.02 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.57 1.61 0.13 -1.92 -3.08 132.00 128.17 2dia h PRO 19 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.15 2dia h PRO 19 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 2dia h PRO 19 CO 0.00 0.46 0.38 0.78 -0.23 0.00 0.00 178.00 179.38 2dia h GLY 20 N 1.50 0.79 2.00 1.56 0.00 -1.64 0.46 103.07 107.75 2dia h GLY 20 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 47.33 47.04 2dia h GLY 20 CO 0.06 0.27 0.00 1.04 0.00 0.00 0.00 176.54 177.91 2dia n LEU 21 N -4.46 0.15 -0.09 3.11 4.77 -1.16 -3.22 117.00 116.10 2dia n LEU 21 Ca 0.06 0.52 -0.12 0.00 -0.03 0.00 0.00 56.01 56.44 2dia n LEU 21 Cb 0.08 -0.48 -0.15 0.00 -2.33 0.00 0.00 43.42 40.54 2dia n LEU 21 CO 0.35 -0.12 -1.09 -0.62 -1.33 0.00 0.00 177.39 174.59 2dia n GLU 22 N -1.65 0.68 -3.66 3.23 1.02 -0.05 -4.84 120.64 115.38 2dia n GLU 22 Ca 0.06 0.08 -0.00 0.00 -0.02 0.00 0.00 57.16 57.28 2dia n GLU 22 Cb 0.30 -1.57 -0.01 0.00 -0.02 0.00 0.00 31.44 30.14 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 -0.08 0.13 -0.32 -3.43 -0.05 -4.74 115.29 104.29 2dia s HIS 23 Ca -0.15 -0.09 -0.13 0.00 -0.80 0.00 0.00 55.06 53.89 2dia s HIS 23 Cb 0.07 0.58 0.02 0.00 -1.43 0.00 0.00 32.58 31.81 2dia s HIS 23 CO 0.78 -0.46 0.34 0.20 -2.00 0.00 0.00 174.74 173.60 2dia s GLY 24 N -2.93 -0.02 -0.01 -1.38 0.00 -1.20 -3.98 107.32 97.79 2dia s GLY 24 Ca 0.13 -0.36 0.02 0.00 0.00 0.00 0.00 44.72 44.50 2dia s GLY 24 CO -0.02 -0.52 -0.05 1.25 0.00 0.00 0.00 173.10 173.76 2dia s LYS 25 N -3.86 0.44 -0.11 2.90 2.20 -1.26 -1.53 119.74 118.51 2dia s LYS 25 Ca 0.07 -0.18 -0.34 0.00 -0.36 0.00 0.00 55.97 55.15 2dia s LYS 25 Cb 0.02 -0.42 -0.11 0.00 -1.51 0.00 0.00 37.83 35.81 2dia s LYS 25 CO -0.08 0.11 1.92 0.28 -0.36 0.00 0.00 175.35 177.21 2dia n VAL 26 N 2.99 0.56 0.00 4.02 0.31 -0.94 -0.66 118.33 124.60 2dia n VAL 26 Ca -0.13 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 2dia n VAL 26 Cb 0.58 -1.90 0.00 0.00 -0.91 0.00 0.00 33.84 31.61 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 4.60 2.94 3.48 2.92 0.00 -1.12 -4.46 105.19 113.55 2dia n GLY 27 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.96 2dia n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dia s GLU 28 N -0.09 -2.05 -0.21 1.61 0.41 0.16 -4.89 118.70 113.63 2dia s GLU 28 Ca 0.00 -0.08 0.02 0.00 -0.41 0.00 0.00 54.97 54.49 2dia s GLU 28 Cb 0.00 -1.50 0.04 0.00 -1.78 0.00 0.00 34.13 30.89 2dia s GLU 28 CO 0.00 -4.26 -0.13 0.00 -0.49 0.00 0.00 175.26 170.39 2dia s ALA 29 N -2.76 2.26 -0.69 5.21 0.00 -1.26 -4.26 121.76 120.26 2dia s ALA 29 Ca 0.71 -1.39 -0.26 0.00 0.00 0.00 0.00 51.96 51.02 2dia s ALA 29 Cb -0.09 -1.35 -0.03 0.00 0.00 0.00 0.00 23.12 21.65 2dia s ALA 29 CO 0.56 -0.83 1.86 0.20 0.00 0.00 0.00 175.76 177.56 2dia s GLY 30 N 1.28 0.22 -0.03 0.00 0.00 -0.43 -4.84 107.32 103.51 2dia s GLY 30 Ca -0.02 -0.90 -0.30 0.00 0.00 0.00 0.00 44.72 43.50 2dia s GLY 30 CO -0.08 3.41 1.72 1.08 0.00 0.00 0.00 173.10 179.23 2dia s LEU 31 N 9.20 4.35 -0.04 0.66 1.43 -1.26 -3.51 118.68 129.51 2dia s LEU 31 Ca 0.67 2.33 0.03 0.00 -1.03 0.00 0.00 54.13 56.12 2dia s LEU 31 Cb -0.11 -3.53 0.01 0.00 0.03 0.00 0.00 46.19 42.58 2dia s LEU 31 CO 0.15 -0.95 -0.10 -0.76 0.23 0.00 0.00 176.35 174.92 2dia s LEU 32 N 4.12 1.74 -0.09 1.79 1.43 -0.19 -2.70 118.68 124.78 2dia s LEU 32 Ca 0.77 -0.22 0.04 0.00 -1.03 0.00 0.00 54.13 53.69 2dia s LEU 32 Cb -0.35 -0.63 -0.00 0.00 0.03 0.00 0.00 46.19 45.23 2dia s LEU 32 CO 0.32 0.06 -0.24 -0.55 0.23 0.00 0.00 176.35 176.17 2dia s SER 33 N 0.32 3.05 -0.23 2.29 0.15 -0.46 -1.71 113.70 117.10 2dia s SER 33 Ca -0.06 -0.54 -0.01 0.00 0.70 0.00 0.00 55.95 56.04 2dia s SER 33 Cb -0.11 -1.27 0.03 0.00 -1.71 0.00 0.00 66.02 62.96 2dia s SER 33 CO 0.01 0.18 -0.09 -0.69 1.20 0.00 0.00 173.24 173.85 2dia s VAL 34 N 0.24 2.68 -0.41 4.45 1.01 -1.08 -2.09 120.40 125.19 2dia s VAL 34 Ca -0.15 -1.03 -0.11 0.00 0.00 0.00 0.00 61.98 60.69 2dia s VAL 34 Cb -0.17 -2.33 0.05 0.00 0.00 0.00 0.00 36.38 33.93 2dia s VAL 34 CO 0.08 0.26 0.26 -0.62 0.00 0.00 0.00 175.10 175.08 2dia s ASP 35 N 1.31 5.79 -0.27 3.32 -1.08 0.17 -2.20 116.67 123.71 2dia s ASP 35 Ca 0.01 -1.22 -0.09 0.00 -0.52 0.00 0.00 52.55 50.73 2dia s ASP 35 Cb -0.16 -2.04 -0.04 0.00 -1.46 0.00 0.00 42.92 39.22 2dia s ASP 35 CO -0.06 -0.48 0.14 0.00 0.52 0.00 0.00 175.17 175.29 2dia n SER 37 N 5.00 0.59 -0.57 0.00 7.64 -1.26 -4.80 113.62 120.21 2dia n SER 37 Ca -0.15 0.09 0.09 0.00 1.01 0.00 0.00 58.87 59.91 2dia n SER 37 Cb 0.52 -0.41 0.21 0.00 -1.01 0.00 0.00 64.21 63.51 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 -3.07 2.33 0.15 1.43 -0.58 -1.26 -4.63 120.64 115.01 2dia n GLU 38 Ca -0.03 -2.70 0.11 0.00 -0.42 0.00 0.00 57.16 54.12 2dia n GLU 38 Cb 0.12 -1.69 0.54 0.00 -0.57 0.00 0.00 31.44 29.84 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 -0.81 1.21 -0.81 0.62 0.00 -1.26 -4.11 120.51 115.34 2dia n ALA 39 Ca 0.19 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.79 2dia n ALA 39 Cb 0.77 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.90 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 -0.96 0.65 2.32 0.00 0.00 -1.23 -1.63 105.19 104.33 2dia n GLY 40 Ca -0.00 -0.80 -0.20 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 -2.44 0.00 1.61 -0.04 -1.26 -4.93 135.00 127.94 2dia n PRO 41 Ca 0.00 -1.16 0.00 0.00 -0.04 0.00 0.00 63.50 62.30 2dia n PRO 41 Cb 0.00 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.37 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 2.67 3.37 0.55 0.00 -1.26 -4.76 105.19 103.42 2dia n GLY 42 Ca 0.10 -2.04 -0.32 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 -2.50 2.49 0.23 4.61 0.00 -1.26 -4.77 121.76 120.57 2dia s ALA 43 Ca 0.00 -0.96 -0.11 0.00 0.00 0.00 0.00 51.96 50.89 2dia s ALA 43 Cb 0.00 -0.98 -0.07 0.00 0.00 0.00 0.00 23.12 22.07 2dia s ALA 43 CO 0.00 0.39 0.57 -1.17 0.00 0.00 0.00 175.76 175.55 2dia s LEU 44 N -0.12 4.17 -0.27 0.00 2.96 -1.26 -2.02 118.68 122.15 2dia s LEU 44 Ca -0.03 0.97 -0.25 0.00 -0.22 0.00 0.00 54.13 54.60 2dia s LEU 44 Cb -0.14 -3.69 0.08 0.00 0.50 0.00 0.00 46.19 42.94 2dia s LEU 44 CO 0.04 -0.07 0.80 -0.83 -1.32 0.00 0.00 176.35 174.97 2dia s GLY 45 N -2.30 -0.44 0.04 7.98 0.00 -1.06 -5.01 107.32 106.52 2dia s GLY 45 Ca 0.47 2.18 0.06 0.00 0.00 0.00 0.00 44.72 47.43 2dia s GLY 45 CO 0.21 1.74 -0.17 -2.27 0.00 0.00 0.00 173.10 172.61 2dia s LEU 46 N 0.28 2.17 -0.19 0.66 2.96 -1.26 -0.90 118.68 122.40 2dia s LEU 46 Ca 0.01 -0.48 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 2dia s LEU 46 Cb -0.05 -0.76 0.05 0.00 0.50 0.00 0.00 46.19 45.94 2dia s LEU 46 CO -0.01 0.09 -0.02 -0.70 -1.32 0.00 0.00 176.35 174.39 2dia s GLU 47 N -1.14 1.19 -0.24 1.98 2.56 -0.12 -4.96 118.70 117.98 2dia s GLU 47 Ca 0.04 -0.58 -0.15 0.00 0.00 0.00 0.00 54.97 54.27 2dia s GLU 47 Cb -0.08 -2.15 -0.04 0.00 2.00 0.00 0.00 34.13 33.86 2dia s GLU 47 CO 0.01 -0.54 0.38 0.00 -0.56 0.00 0.00 175.26 174.56 2dia s ALA 48 N 1.66 3.57 -0.05 6.30 0.00 -1.26 -2.30 121.76 129.67 2dia s ALA 48 Ca -0.01 -0.70 -0.02 0.00 0.00 0.00 0.00 51.96 51.23 2dia s ALA 48 Cb -0.17 -2.67 0.04 0.00 0.00 0.00 0.00 23.12 20.31 2dia s ALA 48 CO -0.07 -0.50 0.09 0.08 0.00 0.00 0.00 175.76 175.35 2dia s VAL 49 N 1.75 -0.15 0.67 0.00 1.01 -1.23 -2.16 120.40 120.29 2dia s VAL 49 Ca 0.17 0.38 -0.11 0.00 0.00 0.00 0.00 61.98 62.41 2dia s VAL 49 Cb -0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 36.38 36.03 2dia s VAL 49 CO 0.09 0.16 1.05 -0.55 0.00 0.00 0.00 175.10 175.85 2dia s SER 50 N 2.06 5.61 0.34 3.32 0.15 -0.90 -0.97 113.70 123.32 2dia s SER 50 Ca 0.02 1.60 0.14 0.00 0.70 0.00 0.00 55.95 58.41 2dia s SER 50 Cb -0.12 -2.49 1.04 0.00 -1.71 0.00 0.00 66.02 62.73 2dia s SER 50 CO -0.04 -1.28 1.70 0.44 1.20 0.00 0.00 173.24 175.25 2dia h ASP 51 N -0.48 0.55 -0.27 5.45 5.19 -1.66 0.81 116.42 126.01 2dia h ASP 51 Ca -0.44 0.16 -0.14 0.00 -0.62 0.00 0.00 57.03 55.98 2dia h ASP 51 Cb 1.21 0.09 -0.08 0.00 0.18 0.00 0.00 39.33 40.72 2dia h ASP 51 CO 0.58 -0.03 0.18 -0.24 -3.12 0.00 0.00 179.24 176.61 2dia n SER 52 N -4.93 3.45 -3.77 6.45 2.88 -1.26 -4.84 113.62 111.59 2dia n SER 52 Ca 0.30 -2.46 -0.29 0.00 -1.33 0.00 0.00 58.87 55.08 2dia n SER 52 Cb 0.91 -0.64 0.02 0.00 -0.75 0.00 0.00 64.21 63.76 2dia n SER 52 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dia n GLY 53 N 0.13 -0.71 3.24 0.46 0.00 0.28 -4.95 105.19 103.64 2dia n GLY 53 Ca 0.16 0.34 -0.38 0.00 0.00 0.00 0.00 46.02 46.14 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 -3.63 3.75 0.06 2.61 2.01 -1.19 -4.84 115.64 114.41 2dia s THR 54 Ca 0.30 -1.37 -0.31 0.00 0.31 0.00 0.00 61.69 60.63 2dia s THR 54 Cb -0.11 -3.24 -0.08 0.00 0.01 0.00 0.00 72.50 69.08 2dia s THR 54 CO 0.87 -0.34 1.61 -0.54 -0.69 0.00 0.00 174.62 175.53 2dia s LYS 55 N 1.35 4.21 0.02 4.92 1.02 -1.26 -2.11 119.74 127.89 2dia s LYS 55 Ca 0.01 2.27 -0.00 0.00 0.02 0.00 0.00 55.97 58.26 2dia s LYS 55 Cb -0.21 -3.58 -0.04 0.00 -0.52 0.00 0.00 37.83 33.48 2dia s LYS 55 CO 0.01 -0.70 0.13 0.00 -0.92 0.00 0.00 175.35 173.87 2dia s ALA 56 N 2.56 3.75 -0.26 5.17 0.00 -0.92 -4.84 121.76 127.22 2dia s ALA 56 Ca 0.72 -0.86 -0.28 0.00 0.00 0.00 0.00 51.96 51.53 2dia s ALA 56 Cb -0.38 -1.67 -0.03 0.00 0.00 0.00 0.00 23.12 21.03 2dia s ALA 56 CO 0.31 0.74 1.91 -2.00 0.00 0.00 0.00 175.76 176.72 2dia s GLU 57 N -2.03 3.37 0.00 0.00 2.12 -1.23 -4.64 118.70 116.29 2dia s GLU 57 Ca 0.27 1.69 0.08 0.00 0.36 0.00 0.00 54.97 57.37 2dia s GLU 57 Cb -0.12 -4.23 -0.02 0.00 0.26 0.00 0.00 34.13 30.02 2dia s GLU 57 CO 0.19 -1.82 -0.24 0.08 -0.54 0.00 0.00 175.26 172.93 2dia s VAL 58 N 6.98 2.22 -0.03 3.70 1.01 -1.26 -2.04 120.40 130.99 2dia s VAL 58 Ca 0.85 -1.16 -0.13 0.00 0.00 0.00 0.00 61.98 61.54 2dia s VAL 58 Cb -0.27 -1.82 0.02 0.00 0.00 0.00 0.00 36.38 34.31 2dia s VAL 58 CO 0.34 0.50 0.28 -0.55 0.00 0.00 0.00 175.10 175.67 2dia s SER 59 N -0.87 -0.17 -0.07 3.32 0.15 -1.10 -5.02 113.70 109.94 2dia s SER 59 Ca 0.11 0.11 0.04 0.00 0.70 0.00 0.00 55.95 56.91 2dia s SER 59 Cb -0.10 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 2dia s SER 59 CO 0.00 -0.39 -0.20 -0.63 1.20 0.00 0.00 173.24 173.22 2dia s ILE 60 N -1.13 1.74 -0.21 6.45 1.01 -1.26 -2.58 121.20 125.22 2dia s ILE 60 Ca -0.12 -0.85 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 2dia s ILE 60 Cb -0.05 -1.51 0.01 0.00 0.01 0.00 0.00 42.46 40.92 2dia s ILE 60 CO 0.03 0.49 -0.12 -1.58 0.00 0.00 0.00 174.94 173.76 2dia s GLN 61 N 0.27 3.11 0.41 2.79 2.00 -1.06 -4.95 119.66 122.24 2dia s GLN 61 Ca -0.13 -0.77 -0.23 0.00 -2.00 0.00 0.00 55.36 52.23 2dia s GLN 61 Cb -0.16 -2.80 -0.10 0.00 0.80 0.00 0.00 33.01 30.76 2dia s GLN 61 CO 0.06 -0.23 1.00 -0.80 -0.50 0.00 0.00 175.29 174.82 2dia s ASN 62 N 1.37 6.81 0.03 6.67 -0.87 -1.26 -1.51 114.94 126.17 2dia s ASN 62 Ca 0.05 1.89 0.01 0.00 -1.57 0.00 0.00 52.86 53.24 2dia s ASN 62 Cb -0.14 -2.57 -0.02 0.00 -0.02 0.00 0.00 41.25 38.50 2dia s ASN 62 CO -0.08 -0.45 -0.06 0.20 -2.57 0.00 0.00 177.10 174.14 2dia s ASN 63 N -1.83 0.60 0.29 -1.22 0.01 -0.98 -4.96 114.94 106.85 2dia s ASN 63 Ca 0.60 -0.49 0.23 0.00 -0.71 0.00 0.00 52.86 52.49 2dia s ASN 63 Cb -0.17 0.05 1.06 0.00 0.41 0.00 0.00 41.25 42.60 2dia s ASN 63 CO 0.21 -0.22 1.71 1.17 -1.51 0.00 0.00 177.10 178.46 2dia n LYS 64 N 1.63 0.19 -0.60 -0.60 4.81 -1.26 -2.99 118.16 119.33 2dia n LYS 64 Ca -0.22 0.50 -0.05 0.00 -0.87 0.00 0.00 58.31 57.66 2dia n LYS 64 Cb 0.55 -1.91 0.01 0.00 0.02 0.00 0.00 35.03 33.70 2dia n LYS 64 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 2dia n ASP 65 N -2.27 5.54 -3.15 3.14 8.00 -1.26 -4.78 116.55 121.77 2dia n ASP 65 Ca 0.01 -2.60 -0.15 0.00 0.71 0.00 0.00 54.79 52.76 2dia n ASP 65 Cb 0.17 -1.07 -0.03 0.00 -0.02 0.00 0.00 41.12 40.18 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 1.06 -0.44 3.37 0.44 0.00 -1.16 -4.85 105.19 103.61 2dia n GLY 66 Ca 0.10 0.02 -0.20 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.37 0.44 0.05 2.61 -4.23 -1.25 -3.00 115.64 107.90 2dia s THR 67 Ca 0.30 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.81 2dia s THR 67 Cb -0.17 -2.51 -0.04 0.00 1.34 0.00 0.00 72.50 71.12 2dia s THR 67 CO 0.37 0.00 -0.04 -0.31 -0.54 0.00 0.00 174.62 174.10 2dia s TYR 68 N -3.52 0.54 -0.45 3.99 1.51 -0.93 -2.32 117.35 116.17 2dia s TYR 68 Ca 0.34 -0.89 0.04 0.00 -1.01 0.00 0.00 57.07 55.54 2dia s TYR 68 Cb 0.05 -0.37 0.12 0.00 -0.11 0.00 0.00 41.96 41.65 2dia s TYR 68 CO 0.17 -0.28 0.19 0.00 -1.11 0.00 0.00 175.55 174.52 2dia s ALA 69 N -3.19 2.95 0.05 3.71 0.00 -0.57 -2.65 121.76 122.07 2dia s ALA 69 Ca 0.02 -2.90 -0.13 0.00 0.00 0.00 0.00 51.96 48.95 2dia s ALA 69 Cb 0.03 -2.04 -0.06 0.00 0.00 0.00 0.00 23.12 21.04 2dia s ALA 69 CO -0.07 -1.91 0.42 0.08 0.00 0.00 0.00 175.76 174.28 2dia s VAL 70 N 0.22 5.03 0.00 0.00 1.01 -0.69 -2.55 120.40 123.43 2dia s VAL 70 Ca 0.15 0.67 -0.07 0.00 0.00 0.00 0.00 61.98 62.73 2dia s VAL 70 Cb -0.23 -3.69 0.00 0.00 0.00 0.00 0.00 36.38 32.46 2dia s VAL 70 CO -0.04 0.41 0.13 -0.89 0.00 0.00 0.00 175.10 174.71 2dia s THR 71 N -1.27 0.08 -0.02 3.92 2.01 -1.07 -1.02 115.64 118.29 2dia s THR 71 Ca 0.30 -0.69 -0.00 0.00 0.31 0.00 0.00 61.69 61.60 2dia s THR 71 Cb -0.15 -0.42 0.02 0.00 0.01 0.00 0.00 72.50 71.95 2dia s THR 71 CO 0.16 -0.38 0.03 -0.72 -0.69 0.00 0.00 174.62 173.02 2dia s TYR 72 N -1.37 -0.01 -0.39 4.92 -0.85 -1.23 -2.71 117.35 115.71 2dia s TYR 72 Ca -0.15 0.11 -0.04 0.00 -0.52 0.00 0.00 57.07 56.47 2dia s TYR 72 Cb -0.08 -0.10 0.10 0.00 0.38 0.00 0.00 41.96 42.26 2dia s TYR 72 CO 0.01 -0.05 0.18 0.08 -1.52 0.00 0.00 175.55 174.25 2dia s VAL 73 N 0.53 3.40 -0.87 -3.49 1.01 -0.86 -1.32 120.40 118.80 2dia s VAL 73 Ca -0.04 -1.84 -0.25 0.00 0.00 0.00 0.00 61.98 59.85 2dia s VAL 73 Cb -0.06 -3.23 -0.04 0.00 0.00 0.00 0.00 36.38 33.04 2dia s VAL 73 CO -0.02 -0.57 1.94 -2.16 0.00 0.00 0.00 175.10 174.29 2dia s PRO 74 N 1.21 2.56 0.38 2.72 0.04 -1.26 -3.52 135.00 137.13 2dia s PRO 74 Ca 0.05 -0.20 0.16 0.00 0.04 0.00 0.00 61.00 61.05 2dia s PRO 74 Cb -0.22 -5.00 1.05 0.00 0.04 0.00 0.00 34.50 30.37 2dia s PRO 74 CO -0.03 -3.31 1.77 -0.07 0.04 0.00 0.00 177.00 175.40 2dia h LEU 75 N 17.73 0.50 -8.78 -3.56 3.38 -1.93 -2.96 115.31 119.69 2dia h LEU 75 Ca 0.06 0.09 -0.55 0.00 0.09 0.00 0.00 57.88 57.57 2dia h LEU 75 Cb 1.02 0.01 -0.20 0.00 0.09 0.00 0.00 40.66 41.58 2dia h LEU 75 CO 1.21 0.11 -0.81 0.28 0.09 0.00 0.00 178.44 179.32 2dia s THR 76 N -5.55 1.83 0.50 0.22 -1.32 -1.26 -4.70 115.64 105.36 2dia s THR 76 Ca -0.09 -1.75 -0.18 0.00 -1.21 0.00 0.00 61.69 58.45 2dia s THR 76 Cb 0.25 -1.74 -0.08 0.00 -1.51 0.00 0.00 72.50 69.42 2dia s THR 76 CO 0.80 -0.17 1.00 0.00 -2.21 0.00 0.00 174.62 174.03 2dia s ALA 77 N -1.59 2.96 0.00 11.08 0.00 -1.26 -4.84 121.76 128.11 2dia s ALA 77 Ca 0.12 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.45 2dia s ALA 77 Cb -0.08 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 19.86 2dia s ALA 77 CO 0.06 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2dia n GLY 78 N -0.92 2.66 3.66 0.00 0.00 -1.11 -5.01 105.19 104.48 2dia n GLY 78 Ca 0.08 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.85 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 -1.77 4.19 0.13 1.61 -1.94 -1.26 -2.97 119.30 117.29 2dia s MET 79 Ca 0.00 2.12 0.01 0.00 -1.71 0.00 0.00 55.69 56.11 2dia s MET 79 Cb 0.00 -3.93 -0.04 0.00 2.01 0.00 0.00 34.83 32.88 2dia s MET 79 CO 0.00 -0.81 0.28 0.71 -0.01 0.00 0.00 175.02 175.19 2dia s TYR 80 N 3.85 3.49 -0.51 -0.03 1.51 -0.88 -1.67 117.35 123.11 2dia s TYR 80 Ca 0.71 0.19 -0.00 0.00 -1.01 0.00 0.00 57.07 56.95 2dia s TYR 80 Cb -0.32 -1.72 0.13 0.00 -0.11 0.00 0.00 41.96 39.94 2dia s TYR 80 CO 0.28 0.51 0.29 0.99 -1.11 0.00 0.00 175.55 176.51 2dia s THR 81 N -1.70 3.17 -0.06 -0.71 2.01 -0.14 -2.96 115.64 115.25 2dia s THR 81 Ca 0.35 -2.74 -0.30 0.00 0.31 0.00 0.00 61.69 59.31 2dia s THR 81 Cb -0.12 -3.15 -0.03 0.00 0.01 0.00 0.00 72.50 69.21 2dia s THR 81 CO 0.28 -0.78 1.24 -0.76 -0.69 0.00 0.00 174.62 173.91 2dia s LEU 82 N 0.31 4.27 -0.32 4.42 1.43 -0.95 -3.49 118.68 124.35 2dia s LEU 82 Ca 0.14 1.84 0.02 0.00 -1.03 0.00 0.00 54.13 55.11 2dia s LEU 82 Cb -0.22 -3.56 0.10 0.00 0.03 0.00 0.00 46.19 42.54 2dia s LEU 82 CO -0.03 -0.63 0.05 -0.89 0.23 0.00 0.00 176.35 175.08 2dia s THR 83 N 2.40 1.80 -0.24 5.49 2.01 -0.97 -2.05 115.64 124.09 2dia s THR 83 Ca 0.57 -1.97 -0.07 0.00 0.31 0.00 0.00 61.69 60.53 2dia s THR 83 Cb -0.25 -2.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 2dia s THR 83 CO 0.22 -0.58 0.05 -0.32 -0.69 0.00 0.00 174.62 173.30 2dia s MET 84 N 1.15 3.63 -0.18 4.92 0.00 -1.26 -0.94 119.30 126.63 2dia s MET 84 Ca 0.09 -0.49 0.01 0.00 0.00 0.00 0.00 55.69 55.30 2dia s MET 84 Cb -0.18 -3.25 0.02 0.00 0.00 0.00 0.00 34.83 31.42 2dia s MET 84 CO -0.13 -0.14 -0.17 0.15 0.00 0.00 0.00 175.02 174.73 2dia s LYS 85 N 1.45 2.69 -0.19 4.11 1.02 -0.08 -2.82 119.74 125.92 2dia s LYS 85 Ca 0.05 -0.80 -0.06 0.00 0.02 0.00 0.00 55.97 55.19 2dia s LYS 85 Cb -0.15 -2.46 -0.03 0.00 -0.52 0.00 0.00 37.83 34.67 2dia s LYS 85 CO 0.02 -0.26 0.03 -0.47 -0.92 0.00 0.00 175.35 173.76 2dia s TYR 86 N 1.34 3.15 -1.44 3.18 6.14 0.10 -2.58 117.35 127.24 2dia s TYR 86 Ca 0.04 -0.14 -0.02 0.00 0.64 0.00 0.00 57.07 57.59 2dia s TYR 86 Cb -0.14 -2.07 0.01 0.00 0.42 0.00 0.00 41.96 40.18 2dia s TYR 86 CO -0.12 -0.01 0.16 0.41 0.64 0.00 0.00 175.55 176.64 2dia n GLY 87 N 3.81 -0.50 2.37 8.97 0.00 -0.86 -0.14 105.19 118.84 2dia n GLY 87 Ca -0.17 0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.89 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 -1.05 0.63 3.09 -0.02 0.00 -1.26 -4.91 105.19 101.67 2dia n GLY 88 Ca -0.16 0.00 -0.26 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 -0.07 1.92 0.66 1.61 2.02 0.80 -5.09 118.70 120.54 2dia s GLU 89 Ca 0.00 -0.55 -0.18 0.00 0.02 0.00 0.00 54.97 54.27 2dia s GLU 89 Cb 0.00 -1.58 -0.00 0.00 0.10 0.00 0.00 34.13 32.65 2dia s GLU 89 CO 0.00 0.13 1.28 -0.51 0.02 0.00 0.00 175.26 176.18 2dia s LEU 90 N 0.39 3.53 0.33 1.80 1.43 -1.26 0.03 118.68 124.93 2dia s LEU 90 Ca -0.11 2.60 0.02 0.00 -1.03 0.00 0.00 54.13 55.60 2dia s LEU 90 Cb -0.14 -4.62 -0.03 0.00 0.03 0.00 0.00 46.19 41.43 2dia s LEU 90 CO 0.04 -2.07 0.52 0.68 0.23 0.00 0.00 176.35 175.75 2dia s VAL 91 N -1.47 4.98 -2.00 -1.59 -7.23 -1.13 -4.77 120.40 107.19 2dia s VAL 91 Ca 0.82 -0.61 0.08 0.00 -1.81 0.00 0.00 61.98 60.47 2dia s VAL 91 Cb -0.37 -3.80 0.24 0.00 0.56 0.00 0.00 36.38 33.01 2dia s VAL 91 CO 0.41 -0.47 0.95 -0.81 -0.31 0.00 0.00 175.10 174.87 2dia n PRO 92 N -1.73 0.49 -0.07 4.82 -0.04 -1.26 -1.95 135.00 135.26 2dia n PRO 92 Ca -0.05 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.49 2dia n PRO 92 Cb 0.57 -1.27 0.12 0.00 -0.04 0.00 0.00 33.50 32.88 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 -0.77 0.03 -3.52 0.54 8.25 -1.26 -5.03 115.22 113.46 2dia n HIS 93 Ca 0.06 -0.91 -0.16 0.00 -0.26 0.00 0.00 57.72 56.45 2dia n HIS 93 Cb 0.03 -0.14 -0.05 0.00 1.12 0.00 0.00 29.99 30.95 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 -2.56 -0.56 0.68 4.41 0.40 -0.82 -4.28 117.98 115.24 2dia s PHE 94 Ca 0.27 0.79 -0.14 0.00 -0.60 0.00 0.00 56.93 57.25 2dia s PHE 94 Cb 0.24 0.41 0.01 0.00 0.51 0.00 0.00 43.02 44.18 2dia s PHE 94 CO 0.03 -0.65 1.11 -1.25 0.70 0.00 0.00 175.22 175.15 2dia s PRO 95 N -1.97 2.71 -0.05 0.24 0.04 -1.26 -4.42 135.00 130.30 2dia s PRO 95 Ca -0.08 1.36 0.01 0.00 0.04 0.00 0.00 61.00 62.33 2dia s PRO 95 Cb -0.01 -1.94 0.02 0.00 0.04 0.00 0.00 34.50 32.61 2dia s PRO 95 CO 0.03 -1.31 -0.05 0.00 0.04 0.00 0.00 177.00 175.71 2dia s ALA 96 N -2.42 0.71 -0.11 8.56 0.00 -0.87 -4.98 121.76 122.65 2dia s ALA 96 Ca 0.66 -0.08 -0.19 0.00 0.00 0.00 0.00 51.96 52.35 2dia s ALA 96 Cb -0.20 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 2dia s ALA 96 CO 0.44 -0.03 0.50 1.03 0.00 0.00 0.00 175.76 177.69 2dia s ARG 97 N 0.96 4.34 -0.06 0.00 3.00 -1.26 -2.25 118.95 123.67 2dia s ARG 97 Ca -0.10 0.50 0.00 0.00 0.00 0.00 0.00 55.73 56.13 2dia s ARG 97 Cb -0.14 -3.43 0.02 0.00 0.00 0.00 0.00 34.95 31.40 2dia s ARG 97 CO -0.00 0.17 -0.04 0.08 0.00 0.00 0.00 175.30 175.51 2dia s VAL 98 N 0.56 0.61 -0.14 3.52 1.01 -1.16 -5.00 120.40 119.81 2dia s VAL 98 Ca 0.27 -0.11 -0.29 0.00 0.00 0.00 0.00 61.98 61.84 2dia s VAL 98 Cb -0.16 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.56 2dia s VAL 98 CO 0.11 0.26 1.05 -0.75 0.00 0.00 0.00 175.10 175.77 2dia s LYS 99 N 1.25 4.36 -0.12 2.72 2.20 -1.26 -2.08 119.74 126.80 2dia s LYS 99 Ca -0.06 1.43 -0.03 0.00 -0.36 0.00 0.00 55.97 56.95 2dia s LYS 99 Cb -0.14 -3.58 -0.03 0.00 -1.51 0.00 0.00 37.83 32.57 2dia s LYS 99 CO -0.02 -0.43 0.00 0.08 -0.36 0.00 0.00 175.35 174.62 2dia s VAL 100 N 2.42 4.29 0.23 4.02 1.01 -1.16 -3.24 120.40 127.97 2dia s VAL 100 Ca 0.48 -0.24 0.01 0.00 0.00 0.00 0.00 61.98 62.23 2dia s VAL 100 Cb -0.18 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 2dia s VAL 100 CO 0.15 0.55 0.41 -1.61 0.00 0.00 0.00 175.10 174.59 2dia s GLU 101 N -0.29 3.49 0.53 2.72 0.41 -0.58 -2.74 118.70 122.24 2dia s GLU 101 Ca 0.06 -0.43 -0.20 0.00 -0.41 0.00 0.00 54.97 53.99 2dia s GLU 101 Cb -0.12 -2.82 -0.06 0.00 -1.78 0.00 0.00 34.13 29.34 2dia s GLU 101 CO 0.02 0.37 1.14 -1.25 -0.49 0.00 0.00 175.26 175.04 2dia s PRO 102 N -3.62 3.43 -0.52 0.39 0.04 -1.26 -2.22 135.00 131.24 2dia s PRO 102 Ca 0.38 1.64 0.02 0.00 0.04 0.00 0.00 61.00 63.07 2dia s PRO 102 Cb -0.10 -2.08 0.46 0.00 0.04 0.00 0.00 34.50 32.82 2dia s PRO 102 CO 0.30 -0.79 1.71 0.00 0.04 0.00 0.00 177.00 178.26 2dia n ALA 103 N -1.15 5.81 -2.56 8.56 0.00 -1.26 -4.77 120.51 125.14 2dia n ALA 103 Ca 0.11 -3.58 -0.43 0.00 0.00 0.00 0.00 53.44 49.54 2dia n ALA 103 Cb 0.50 -1.22 -0.02 0.00 0.00 0.00 0.00 19.45 18.72 2dia n ALA 103 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2dia s VAL 104 N -4.70 4.51 -0.01 0.00 1.01 -1.26 -5.02 120.40 114.94 2dia s VAL 104 Ca 0.59 1.82 -0.06 0.00 0.00 0.00 0.00 61.98 64.33 2dia s VAL 104 Cb 0.47 -4.17 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2dia s VAL 104 CO 0.01 -0.13 0.12 1.51 0.00 0.00 0.00 175.10 176.61 2dia s ASP 105 N 1.50 0.02 -0.18 3.32 1.47 -1.26 -5.15 116.67 116.38 2dia s ASP 105 Ca 0.49 -0.15 -0.02 0.00 1.18 0.00 0.00 52.55 54.05 2dia s ASP 105 Cb -0.18 0.21 -0.01 0.00 -0.34 0.00 0.00 42.92 42.60 2dia s ASP 105 CO 0.11 -0.31 -0.09 -0.89 0.68 0.00 0.00 175.17 174.67 2dia s THR 106 N -1.16 3.17 0.01 2.11 2.01 -1.26 -4.99 115.64 115.53 2dia s THR 106 Ca -0.12 -0.58 -0.04 0.00 0.31 0.00 0.00 61.69 61.26 2dia s THR 106 Cb -0.07 -2.39 -0.01 0.00 0.01 0.00 0.00 72.50 70.04 2dia s THR 106 CO 0.01 0.47 -0.07 -1.20 -0.69 0.00 0.00 174.62 173.14 2dia n SER 107 N 4.30 0.95 -0.15 3.53 7.64 -1.26 -4.78 113.62 123.86 2dia n SER 107 Ca -0.18 0.14 -0.04 0.00 1.01 0.00 0.00 58.87 59.79 2dia n SER 107 Cb 0.51 -0.36 0.02 0.00 -1.01 0.00 0.00 64.21 63.38 2dia n SER 107 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2dia h SER 108 N -0.20 -0.62 -3.61 6.43 4.64 -2.09 -3.48 113.55 114.61 2dia h SER 108 Ca 0.00 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2dia h SER 108 Cb 0.20 0.36 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2dia h SER 108 CO 0.00 -0.21 0.00 0.61 -0.87 0.00 0.00 176.83 176.36 2dia n GLY 109 N -1.38 3.10 3.58 -0.77 0.00 -1.26 -4.99 105.19 103.47 2dia n GLY 109 Ca 0.04 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 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 -4.28 3.07 -0.12 1.61 0.04 -1.26 -4.99 135.00 129.08 2dia s PRO 110 Ca 0.00 1.01 -0.08 0.00 0.04 0.00 0.00 61.00 61.98 2dia s PRO 110 Cb 0.00 -4.25 -0.04 0.00 0.04 0.00 0.00 34.50 30.24 2dia s PRO 110 CO 0.00 -2.19 0.16 -1.54 0.04 0.00 0.00 177.00 173.47 2dia s SER 111 N 6.63 6.41 -1.35 6.66 1.04 -1.26 -4.44 113.70 127.39 2dia s SER 111 Ca 0.72 0.49 -0.14 0.00 0.48 0.00 0.00 55.95 57.50 2dia s SER 111 Cb -0.17 -2.09 0.14 0.00 0.10 0.00 0.00 66.02 64.00 2dia s SER 111 CO 0.28 0.38 0.35 -1.54 0.98 0.00 0.00 173.24 173.69 2dia n SER 112 N 2.10 -0.91 -0.34 7.02 3.41 -1.26 -5.31 113.62 118.32 2dia n SER 112 Ca -0.19 -0.93 0.15 0.00 -0.26 0.00 0.00 58.87 57.63 2dia n SER 112 Cb 0.55 -1.19 0.64 0.00 -0.26 0.00 0.00 64.21 63.95 2dia n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49