#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 6.86 -0.17 1.61 0.01 -1.26 -4.90 113.70 115.85 2dia s SER 2 Ca 0.00 -2.49 -0.07 0.00 1.31 0.00 0.00 55.95 54.70 2dia s SER 2 Cb 0.00 -2.49 0.08 0.00 0.21 0.00 0.00 66.02 63.82 2dia s SER 2 CO 0.00 -1.03 0.37 -0.55 0.41 0.00 0.00 173.24 172.44 2dia s SER 3 N 3.70 -0.15 0.35 2.44 0.15 -1.26 -5.15 113.70 113.77 2dia s SER 3 Ca 0.46 0.85 -0.24 0.00 0.70 0.00 0.00 55.95 57.72 2dia s SER 3 Cb -0.00 1.03 -0.10 0.00 -1.71 0.00 0.00 66.02 65.24 2dia s SER 3 CO 0.01 -0.22 0.92 -0.83 1.20 0.00 0.00 173.24 174.31 2dia s GLY 4 N 2.28 2.65 0.11 9.45 0.00 -1.26 -5.06 107.32 115.48 2dia s GLY 4 Ca -0.03 0.44 -0.26 0.00 0.00 0.00 0.00 44.72 44.87 2dia s GLY 4 CO -0.11 0.81 0.88 -0.45 0.00 0.00 0.00 173.10 174.23 2dia s SER 5 N -1.81 -0.29 1.07 1.64 0.15 -1.26 -5.17 113.70 108.03 2dia s SER 5 Ca 0.53 -0.24 -0.17 0.00 0.70 0.00 0.00 55.95 56.78 2dia s SER 5 Cb -0.15 0.48 0.13 0.00 -1.71 0.00 0.00 66.02 64.77 2dia s SER 5 CO 0.20 -0.85 0.10 -1.54 1.20 0.00 0.00 173.24 172.35 2dia n SER 6 N -0.38 -2.80 -2.72 5.45 3.41 -1.26 -4.59 113.62 110.73 2dia n SER 6 Ca -0.08 -0.28 -0.01 0.00 -0.26 0.00 0.00 58.87 58.23 2dia n SER 6 Cb 0.61 -0.83 -0.01 0.00 -0.26 0.00 0.00 64.21 63.72 2dia n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dia n GLY 7 N 2.33 -4.32 3.71 5.00 0.00 -1.26 -4.99 105.19 105.67 2dia n GLY 7 Ca 0.04 0.75 -0.30 0.00 0.00 0.00 0.00 46.02 46.51 2dia n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dia s PRO 8 N -1.38 1.10 0.47 1.61 0.04 -1.26 -4.47 135.00 131.12 2dia s PRO 8 Ca -0.07 0.76 -0.23 0.00 0.04 0.00 0.00 61.00 61.51 2dia s PRO 8 Cb 0.00 -1.80 -0.07 0.00 0.04 0.00 0.00 34.50 32.68 2dia s PRO 8 CO 0.75 -2.33 1.24 0.12 0.04 0.00 0.00 177.00 176.81 2dia s PHE 9 N -2.94 2.71 -0.30 0.56 5.36 -1.26 -3.87 117.98 118.25 2dia s PHE 9 Ca 0.64 1.48 -0.12 0.00 -0.96 0.00 0.00 56.93 57.96 2dia s PHE 9 Cb -0.18 -3.53 0.17 0.00 -0.34 0.00 0.00 43.02 39.14 2dia s PHE 9 CO 0.57 -1.95 0.95 -0.51 -1.46 0.00 0.00 175.22 172.81 2dia s ASP 10 N -1.16 -0.66 0.26 6.13 1.01 -1.00 -4.89 116.67 116.35 2dia s ASP 10 Ca 0.65 0.67 0.03 0.00 0.71 0.00 0.00 52.55 54.60 2dia s ASP 10 Cb -0.33 1.66 0.33 0.00 1.01 0.00 0.00 42.92 45.58 2dia s ASP 10 CO 0.40 -0.13 1.63 1.55 0.21 0.00 0.00 175.17 178.84 2dia h PRO 11 N 7.74 0.36 0.00 8.23 0.13 -1.84 -2.88 132.00 143.74 2dia h PRO 11 Ca -0.16 -0.19 -0.01 0.00 -0.87 0.00 0.00 66.00 64.78 2dia h PRO 11 Cb 1.14 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 2dia h PRO 11 CO 0.05 0.74 -0.03 1.03 -0.23 0.00 0.00 178.00 179.56 2dia h SER 12 N 0.29 0.00 1.71 1.44 0.87 -1.95 -0.04 113.55 115.87 2dia h SER 12 Ca 0.02 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2dia h SER 12 Cb 0.91 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.87 2dia h SER 12 CO 0.08 0.03 -0.02 0.11 -0.53 0.00 0.00 176.83 176.49 2dia h LYS 13 N 0.00 0.00 -6.46 2.24 1.79 -1.85 -3.45 116.57 108.84 2dia h LYS 13 Ca -0.00 0.00 -0.54 0.00 -2.18 0.00 0.00 60.65 57.93 2dia h LYS 13 Cb 0.10 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2dia h LYS 13 CO 0.00 0.02 0.71 0.08 -1.08 0.00 0.00 179.45 179.18 2dia s VAL 14 N -3.33 3.70 -0.20 0.50 1.01 -0.03 -4.72 120.40 117.33 2dia s VAL 14 Ca 0.05 1.17 -0.02 0.00 0.00 0.00 0.00 61.98 63.18 2dia s VAL 14 Cb 0.06 -3.75 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2dia s VAL 14 CO 0.64 0.06 -0.08 -0.69 0.00 0.00 0.00 175.10 175.02 2dia s VAL 15 N 1.58 3.11 -0.14 2.92 1.01 -1.22 -4.61 120.40 123.05 2dia s VAL 15 Ca 0.62 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 62.01 2dia s VAL 15 Cb -0.32 -2.38 -0.00 0.00 0.00 0.00 0.00 36.38 33.67 2dia s VAL 15 CO 0.28 0.46 -0.16 0.00 0.00 0.00 0.00 175.10 175.68 2dia s ALA 16 N 1.23 2.47 0.29 5.51 0.00 -1.26 -1.85 121.76 128.16 2dia s ALA 16 Ca 0.03 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 50.98 2dia s ALA 16 Cb -0.14 -1.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.78 2dia s ALA 16 CO -0.03 0.05 0.30 -1.12 0.00 0.00 0.00 175.76 174.95 2dia s SER 17 N 0.69 0.96 0.00 0.00 0.01 -0.60 -4.96 113.70 109.80 2dia s SER 17 Ca -0.08 -1.54 0.00 0.00 1.31 0.00 0.00 55.95 55.65 2dia s SER 17 Cb -0.16 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2dia s SER 17 CO 0.02 -1.06 0.00 0.61 0.41 0.00 0.00 173.24 173.22 2dia n GLY 18 N -0.49 3.37 0.28 3.44 0.00 -1.26 -0.41 105.19 110.12 2dia n GLY 18 Ca 0.04 -1.77 0.18 0.00 0.00 0.00 0.00 46.02 44.46 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 -1.89 -2.90 132.00 128.95 2dia h PRO 19 Ca 0.00 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.03 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 0.00 -0.47 0.78 -0.23 0.00 0.00 178.00 178.08 2dia h GLY 20 N 1.96 0.00 1.06 1.56 0.00 -1.63 -1.12 103.07 104.89 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 0.00 0.00 -0.15 1.04 0.00 0.00 0.00 176.54 177.43 2dia n LEU 21 N -3.74 0.42 -0.09 3.11 4.77 -1.10 -3.79 117.00 116.59 2dia n LEU 21 Ca -0.01 0.07 -0.11 0.00 -0.03 0.00 0.00 56.01 55.93 2dia n LEU 21 Cb 0.53 -0.24 -0.11 0.00 -2.33 0.00 0.00 43.42 41.28 2dia n LEU 21 CO 0.39 0.08 -1.08 -0.62 -1.33 0.00 0.00 177.39 174.83 2dia n GLU 22 N -1.09 0.98 -3.65 3.23 1.02 -1.01 -4.84 120.64 115.27 2dia n GLU 22 Ca 0.12 0.05 -0.03 0.00 -0.02 0.00 0.00 57.16 57.29 2dia n GLU 22 Cb 0.30 -1.40 -0.01 0.00 -0.02 0.00 0.00 31.44 30.30 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 -2.39 -0.14 0.30 -0.32 -3.43 -0.45 -4.60 115.29 104.26 2dia s HIS 23 Ca -0.17 -0.04 -0.14 0.00 -0.80 0.00 0.00 55.06 53.91 2dia s HIS 23 Cb 0.06 0.58 0.01 0.00 -1.43 0.00 0.00 32.58 31.80 2dia s HIS 23 CO 0.55 -0.52 0.60 0.20 -2.00 0.00 0.00 174.74 173.57 2dia s GLY 24 N -2.78 0.50 -0.00 -1.38 0.00 -1.23 -4.00 107.32 98.44 2dia s GLY 24 Ca 0.11 -0.82 0.01 0.00 0.00 0.00 0.00 44.72 44.02 2dia s GLY 24 CO -0.03 -0.50 -0.02 1.25 0.00 0.00 0.00 173.10 173.81 2dia s LYS 25 N -3.51 0.17 -0.40 2.90 2.20 -1.26 -0.65 119.74 119.18 2dia s LYS 25 Ca 0.20 -0.08 -0.33 0.00 -0.36 0.00 0.00 55.97 55.39 2dia s LYS 25 Cb -0.03 -0.15 -0.11 0.00 -1.51 0.00 0.00 37.83 36.03 2dia s LYS 25 CO 0.11 0.04 2.26 0.28 -0.36 0.00 0.00 175.35 177.68 2dia n VAL 26 N 3.00 0.16 0.00 4.02 0.31 -0.70 0.08 118.33 125.20 2dia n VAL 26 Ca -0.13 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 2dia n VAL 26 Cb 0.59 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.69 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 6.38 2.42 2.48 2.92 0.00 0.26 -4.35 105.19 115.29 2dia n GLY 27 Ca 0.41 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.28 -2.89 -3.93 1.61 -0.58 0.11 -4.81 120.64 109.87 2dia n GLU 28 Ca 0.00 -1.22 -0.28 0.00 -0.42 0.00 0.00 57.16 55.24 2dia n GLU 28 Cb 0.00 -1.22 -0.16 0.00 -0.57 0.00 0.00 31.44 29.48 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 -2.81 1.58 -0.63 0.62 0.00 -1.26 -4.01 121.76 115.24 2dia s ALA 29 Ca 0.51 -0.83 -0.27 0.00 0.00 0.00 0.00 51.96 51.37 2dia s ALA 29 Cb -0.06 -1.08 -0.00 0.00 0.00 0.00 0.00 23.12 21.98 2dia s ALA 29 CO 0.40 -0.64 1.63 0.20 0.00 0.00 0.00 175.76 177.35 2dia s GLY 30 N 1.59 0.51 -0.08 0.00 0.00 -0.30 -4.83 107.32 104.21 2dia s GLY 30 Ca 0.02 -0.83 -0.30 0.00 0.00 0.00 0.00 44.72 43.61 2dia s GLY 30 CO -0.08 3.11 1.72 1.08 0.00 0.00 0.00 173.10 178.92 2dia s LEU 31 N 7.63 4.22 -0.01 0.66 1.43 -1.26 -3.45 118.68 127.90 2dia s LEU 31 Ca 0.56 2.17 0.05 0.00 -1.03 0.00 0.00 54.13 55.88 2dia s LEU 31 Cb -0.11 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.56 2dia s LEU 31 CO 0.20 -1.05 -0.16 -0.76 0.23 0.00 0.00 176.35 174.82 2dia s LEU 32 N 4.50 2.03 -0.07 1.79 1.43 0.41 -2.63 118.68 126.13 2dia s LEU 32 Ca 0.76 -0.28 0.03 0.00 -1.03 0.00 0.00 54.13 53.62 2dia s LEU 32 Cb -0.33 -0.80 0.01 0.00 0.03 0.00 0.00 46.19 45.09 2dia s LEU 32 CO 0.31 0.19 -0.16 -0.44 0.23 0.00 0.00 176.35 176.48 2dia s SER 33 N -0.36 2.19 -0.27 2.29 0.01 0.46 -1.60 113.70 116.41 2dia s SER 33 Ca 0.06 -0.37 0.03 0.00 1.31 0.00 0.00 55.95 56.97 2dia s SER 33 Cb -0.06 -0.89 0.07 0.00 0.21 0.00 0.00 66.02 65.34 2dia s SER 33 CO -0.01 0.10 -0.08 -0.69 0.41 0.00 0.00 173.24 172.98 2dia s VAL 34 N 0.41 2.12 -0.38 3.43 1.01 -0.71 -1.56 120.40 124.72 2dia s VAL 34 Ca -0.12 -1.72 -0.20 0.00 0.00 0.00 0.00 61.98 59.94 2dia s VAL 34 Cb -0.15 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.94 2dia s VAL 34 CO 0.04 -0.14 0.61 -0.62 0.00 0.00 0.00 175.10 174.99 2dia s ASP 35 N 1.10 6.37 -0.37 3.32 -1.08 -0.77 -2.04 116.67 123.20 2dia s ASP 35 Ca -0.05 -0.06 -0.12 0.00 -0.52 0.00 0.00 52.55 51.80 2dia s ASP 35 Cb -0.20 -2.31 0.02 0.00 -1.46 0.00 0.00 42.92 38.97 2dia s ASP 35 CO -0.06 -0.63 0.22 0.00 0.52 0.00 0.00 175.17 175.23 2dia n SER 37 N 5.04 0.96 -0.26 0.00 7.64 -1.26 -4.79 113.62 120.95 2dia n SER 37 Ca -0.12 0.15 0.06 0.00 1.01 0.00 0.00 58.87 59.96 2dia n SER 37 Cb 0.47 -0.35 0.11 0.00 -1.01 0.00 0.00 64.21 63.43 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 -3.57 2.38 0.00 1.43 -0.58 -1.26 -4.60 120.64 114.43 2dia n GLU 38 Ca -0.10 -2.16 0.12 0.00 -0.42 0.00 0.00 57.16 54.60 2dia n GLU 38 Cb 0.39 -1.34 0.66 0.00 -0.57 0.00 0.00 31.44 30.57 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 -0.67 2.31 -0.68 0.62 0.00 -1.26 -4.12 120.51 116.70 2dia n ALA 39 Ca 0.11 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2dia n ALA 39 Cb 0.51 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 0.68 0.90 0.33 0.00 0.00 -1.25 -2.38 105.19 103.47 2dia n GLY 40 Ca 0.14 -0.71 -0.03 0.00 0.00 0.00 0.00 46.02 45.42 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 -1.22 0.00 1.61 -0.04 -1.26 -4.91 135.00 129.18 2dia n PRO 41 Ca 0.00 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 2dia n PRO 41 Cb 0.00 -0.16 0.00 0.00 -0.04 0.00 0.00 33.50 33.30 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 1.76 3.00 3.84 0.55 0.00 -1.26 -4.75 105.19 108.32 2dia n GLY 42 Ca 0.01 -1.64 -0.36 0.00 0.00 0.00 0.00 46.02 44.03 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 -1.50 3.57 0.05 4.61 0.00 -1.26 -4.59 121.76 122.64 2dia s ALA 43 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 51.96 51.87 2dia s ALA 43 Cb 0.00 -2.56 -0.04 0.00 0.00 0.00 0.00 23.12 20.52 2dia s ALA 43 CO 0.00 0.44 0.16 -1.17 0.00 0.00 0.00 175.76 175.19 2dia s LEU 44 N -1.90 4.17 -0.28 0.00 2.96 -1.26 -0.96 118.68 121.40 2dia s LEU 44 Ca 0.38 0.19 -0.25 0.00 -0.22 0.00 0.00 54.13 54.23 2dia s LEU 44 Cb -0.15 -2.74 0.13 0.00 0.50 0.00 0.00 46.19 43.92 2dia s LEU 44 CO 0.19 0.19 1.07 -0.83 -1.32 0.00 0.00 176.35 175.65 2dia s GLY 45 N -2.36 -0.11 0.14 7.98 0.00 -1.12 -5.02 107.32 106.82 2dia s GLY 45 Ca 0.32 2.74 0.10 0.00 0.00 0.00 0.00 44.72 47.88 2dia s GLY 45 CO 0.24 1.83 -0.23 -2.27 0.00 0.00 0.00 173.10 172.67 2dia s LEU 46 N 0.19 2.36 -0.23 0.66 2.96 -1.26 -0.95 118.68 122.41 2dia s LEU 46 Ca 0.04 -0.77 -0.02 0.00 -0.22 0.00 0.00 54.13 53.15 2dia s LEU 46 Cb -0.05 -1.06 0.07 0.00 0.50 0.00 0.00 46.19 45.65 2dia s LEU 46 CO -0.07 0.10 0.04 -0.70 -1.32 0.00 0.00 176.35 174.41 2dia s GLU 47 N -2.26 0.79 -0.20 1.98 2.12 0.20 -4.96 118.70 116.36 2dia s GLU 47 Ca 0.14 -0.68 -0.20 0.00 0.36 0.00 0.00 54.97 54.59 2dia s GLU 47 Cb -0.09 -2.12 -0.03 0.00 0.26 0.00 0.00 34.13 32.15 2dia s GLU 47 CO 0.06 -0.74 0.60 0.00 -0.54 0.00 0.00 175.26 174.65 2dia s ALA 48 N 1.74 3.55 -0.07 6.30 0.00 -1.26 -2.53 121.76 129.48 2dia s ALA 48 Ca 0.01 -0.32 -0.03 0.00 0.00 0.00 0.00 51.96 51.62 2dia s ALA 48 Cb -0.17 -2.93 0.04 0.00 0.00 0.00 0.00 23.12 20.05 2dia s ALA 48 CO -0.13 -0.54 0.16 0.08 0.00 0.00 0.00 175.76 175.32 2dia s VAL 49 N 1.88 -0.04 0.51 0.00 1.01 -1.21 -2.18 120.40 120.36 2dia s VAL 49 Ca 0.27 0.15 -0.05 0.00 0.00 0.00 0.00 61.98 62.36 2dia s VAL 49 Cb -0.16 -0.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.96 2dia s VAL 49 CO 0.10 0.06 0.81 -0.55 0.00 0.00 0.00 175.10 175.52 2dia s SER 50 N 1.04 5.97 0.24 3.32 0.15 -1.07 -0.61 113.70 122.74 2dia s SER 50 Ca -0.08 0.76 -0.04 0.00 0.70 0.00 0.00 55.95 57.29 2dia s SER 50 Cb -0.10 -1.96 0.45 0.00 -1.71 0.00 0.00 66.02 62.70 2dia s SER 50 CO -0.05 -0.76 1.73 0.44 1.20 0.00 0.00 173.24 175.80 2dia h ASP 51 N 0.12 0.28 0.90 5.45 5.19 -1.84 0.48 116.42 126.99 2dia h ASP 51 Ca -0.46 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.05 2dia h ASP 51 Cb 1.23 0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.82 2dia h ASP 51 CO 0.61 0.11 0.00 -1.28 -3.12 0.00 0.00 179.24 175.55 2dia h SER 52 N 0.44 0.00 -0.47 6.45 0.87 -1.94 -3.46 113.55 115.44 2dia h SER 52 Ca 0.41 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.97 2dia h SER 52 Cb 0.62 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2dia h SER 52 CO -0.40 0.00 0.00 0.61 -0.53 0.00 0.00 176.83 176.51 2dia n GLY 53 N 0.12 0.83 3.01 5.77 0.00 0.17 -5.10 105.19 109.99 2dia n GLY 53 Ca 0.02 -0.72 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.16 1.89 -0.32 2.61 2.01 -1.24 -4.84 115.64 113.59 2dia s THR 54 Ca 0.00 -1.52 -0.29 0.00 0.31 0.00 0.00 61.69 60.19 2dia s THR 54 Cb 0.00 -2.10 -0.01 0.00 0.01 0.00 0.00 72.50 70.40 2dia s THR 54 CO 0.00 -0.12 1.54 -0.54 -0.69 0.00 0.00 174.62 174.81 2dia s LYS 55 N 1.21 3.63 0.18 4.92 1.02 -1.26 -2.60 119.74 126.85 2dia s LYS 55 Ca -0.06 1.30 -0.19 0.00 0.02 0.00 0.00 55.97 57.04 2dia s LYS 55 Cb -0.19 -4.04 -0.08 0.00 -0.52 0.00 0.00 37.83 32.99 2dia s LYS 55 CO -0.06 -1.49 0.68 0.00 -0.92 0.00 0.00 175.35 173.56 2dia s ALA 56 N 5.53 3.47 0.00 5.17 0.00 -0.93 -4.97 121.76 130.04 2dia s ALA 56 Ca 0.68 0.12 -0.30 0.00 0.00 0.00 0.00 51.96 52.45 2dia s ALA 56 Cb -0.19 -2.76 -0.08 0.00 0.00 0.00 0.00 23.12 20.09 2dia s ALA 56 CO 0.30 0.36 1.89 -2.00 0.00 0.00 0.00 175.76 176.31 2dia s GLU 57 N -1.74 4.12 -0.02 0.00 2.12 -1.25 -4.53 118.70 117.41 2dia s GLU 57 Ca 0.39 2.48 0.07 0.00 0.36 0.00 0.00 54.97 58.27 2dia s GLU 57 Cb -0.18 -4.12 -0.02 0.00 0.26 0.00 0.00 34.13 30.08 2dia s GLU 57 CO 0.21 -0.96 -0.23 0.08 -0.54 0.00 0.00 175.26 173.81 2dia s VAL 58 N 4.46 1.85 0.00 3.70 1.01 -1.26 -2.11 120.40 128.04 2dia s VAL 58 Ca 0.85 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2dia s VAL 58 Cb -0.40 -1.54 -0.00 0.00 0.00 0.00 0.00 36.38 34.44 2dia s VAL 58 CO 0.38 0.52 -0.03 -0.55 0.00 0.00 0.00 175.10 175.42 2dia s SER 59 N -0.55 0.35 -0.13 3.32 0.15 -1.11 -5.02 113.70 110.72 2dia s SER 59 Ca 0.09 -0.09 0.03 0.00 0.70 0.00 0.00 55.95 56.68 2dia s SER 59 Cb -0.09 -0.03 0.01 0.00 -1.71 0.00 0.00 66.02 64.20 2dia s SER 59 CO -0.01 0.01 -0.23 -0.63 1.20 0.00 0.00 173.24 173.59 2dia s ILE 60 N -0.17 2.06 -0.33 6.45 1.01 -1.26 -2.50 121.20 126.46 2dia s ILE 60 Ca 0.00 -0.99 -0.13 0.00 0.00 0.00 0.00 60.65 59.53 2dia s ILE 60 Cb -0.02 -1.80 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 2dia s ILE 60 CO -0.00 0.55 0.26 -1.58 0.00 0.00 0.00 174.94 174.17 2dia s GLN 61 N 0.66 3.56 -0.04 2.79 0.74 -1.01 -4.95 119.66 121.41 2dia s GLN 61 Ca -0.11 -0.55 -0.21 0.00 0.05 0.00 0.00 55.36 54.54 2dia s GLN 61 Cb -0.16 -3.79 -0.05 0.00 1.10 0.00 0.00 33.01 30.11 2dia s GLN 61 CO 0.02 -0.43 0.61 1.21 -0.55 0.00 0.00 175.29 176.15 2dia s ASN 62 N 1.73 6.94 0.12 6.67 3.84 -1.26 -2.71 114.94 130.26 2dia s ASN 62 Ca 0.07 1.13 0.08 0.00 0.21 0.00 0.00 52.86 54.35 2dia s ASN 62 Cb -0.17 -2.37 -0.04 0.00 -0.55 0.00 0.00 41.25 38.13 2dia s ASN 62 CO 0.11 0.03 -0.20 0.20 -2.79 0.00 0.00 177.10 174.44 2dia s ASN 63 N 0.18 2.58 -0.32 -4.21 0.01 -1.25 -5.03 114.94 106.90 2dia s ASN 63 Ca 0.32 -0.72 -0.02 0.00 -0.71 0.00 0.00 52.86 51.73 2dia s ASN 63 Cb -0.18 -0.14 0.12 0.00 0.41 0.00 0.00 41.25 41.46 2dia s ASN 63 CO 0.17 0.04 2.38 1.17 -1.51 0.00 0.00 177.10 179.35 2dia n LYS 64 N 0.92 1.97 0.00 -0.60 0.00 -1.26 -3.95 118.16 115.23 2dia n LYS 64 Ca -0.18 -1.69 0.00 0.00 0.00 0.00 0.00 58.31 56.44 2dia n LYS 64 Cb 0.54 -1.78 0.00 0.00 0.00 0.00 0.00 35.03 33.79 2dia n LYS 64 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2dia n ASP 65 N 0.74 1.41 0.00 3.14 -0.08 -1.26 -5.06 116.55 115.44 2dia n ASP 65 Ca 0.35 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.63 2dia n ASP 65 Cb 0.59 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.05 2dia n ASP 65 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2dia n GLY 66 N 2.78 0.43 3.41 0.27 0.00 -1.25 -5.11 105.19 105.71 2dia n GLY 66 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 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 -0.47 0.02 0.00 2.61 -4.23 -1.26 -2.54 115.64 109.77 2dia s THR 67 Ca 0.00 -1.57 0.00 0.00 -1.18 0.00 0.00 61.69 58.94 2dia s THR 67 Cb 0.00 -2.19 -0.00 0.00 1.34 0.00 0.00 72.50 71.65 2dia s THR 67 CO 0.00 -0.09 -0.01 -0.31 -0.54 0.00 0.00 174.62 173.68 2dia s TYR 68 N -4.04 0.07 -0.59 3.99 1.51 -0.87 -3.75 117.35 113.67 2dia s TYR 68 Ca 0.26 -0.05 -0.07 0.00 -1.01 0.00 0.00 57.07 56.20 2dia s TYR 68 Cb 0.03 -0.04 0.15 0.00 -0.11 0.00 0.00 41.96 41.98 2dia s TYR 68 CO 0.07 -0.01 0.45 0.00 -1.11 0.00 0.00 175.55 174.95 2dia s ALA 69 N -0.11 3.57 0.03 3.71 0.00 -1.10 -1.73 121.76 126.13 2dia s ALA 69 Ca -0.01 -2.94 -0.17 0.00 0.00 0.00 0.00 51.96 48.85 2dia s ALA 69 Cb -0.01 -2.87 -0.06 0.00 0.00 0.00 0.00 23.12 20.18 2dia s ALA 69 CO -0.00 -2.04 0.48 0.08 0.00 0.00 0.00 175.76 174.28 2dia s VAL 70 N 0.62 4.91 0.02 0.00 1.01 -0.63 -2.41 120.40 123.93 2dia s VAL 70 Ca 0.12 1.00 -0.04 0.00 0.00 0.00 0.00 61.98 63.06 2dia s VAL 70 Cb -0.21 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.37 2dia s VAL 70 CO -0.03 0.57 0.05 -0.89 0.00 0.00 0.00 175.10 174.79 2dia s THR 71 N -1.07 0.12 -0.04 3.92 2.01 -1.04 -0.45 115.64 119.09 2dia s THR 71 Ca 0.26 -0.95 -0.01 0.00 0.31 0.00 0.00 61.69 61.30 2dia s THR 71 Cb -0.18 -0.55 0.03 0.00 0.01 0.00 0.00 72.50 71.81 2dia s THR 71 CO 0.16 -0.52 0.08 -0.72 -0.69 0.00 0.00 174.62 172.92 2dia s TYR 72 N -1.89 -0.05 -0.45 4.92 -0.85 -1.22 -2.73 117.35 115.08 2dia s TYR 72 Ca -0.11 0.27 -0.06 0.00 -0.52 0.00 0.00 57.07 56.65 2dia s TYR 72 Cb -0.06 -0.18 0.12 0.00 0.38 0.00 0.00 41.96 42.22 2dia s TYR 72 CO -0.02 -0.12 0.28 0.08 -1.52 0.00 0.00 175.55 174.26 2dia s VAL 73 N 1.12 3.72 -0.07 -3.49 1.01 -0.90 -1.15 120.40 120.64 2dia s VAL 73 Ca -0.09 -2.01 -0.30 0.00 0.00 0.00 0.00 61.98 59.59 2dia s VAL 73 Cb -0.12 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 2dia s VAL 73 CO -0.04 -0.74 1.50 -2.16 0.00 0.00 0.00 175.10 173.66 2dia s PRO 74 N 1.15 4.21 0.22 2.72 0.04 -1.26 -3.74 135.00 138.34 2dia s PRO 74 Ca 0.08 2.01 0.11 0.00 0.04 0.00 0.00 61.00 63.24 2dia s PRO 74 Cb -0.24 -3.84 0.05 0.00 0.04 0.00 0.00 34.50 30.50 2dia s PRO 74 CO -0.03 -0.76 1.42 -0.07 0.04 0.00 0.00 177.00 177.61 2dia h LEU 75 N 9.71 0.00 -8.01 -3.56 3.38 -1.93 0.73 115.31 115.64 2dia h LEU 75 Ca -0.36 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.20 2dia h LEU 75 Cb 1.16 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.61 2dia h LEU 75 CO 0.95 0.73 -0.78 0.28 0.09 0.00 0.00 178.44 179.70 2dia s THR 76 N -3.00 0.76 0.64 0.22 -1.32 -1.26 -4.71 115.64 106.97 2dia s THR 76 Ca 0.02 -0.38 -0.16 0.00 -1.21 0.00 0.00 61.69 59.96 2dia s THR 76 Cb 0.10 -0.66 -0.01 0.00 -1.51 0.00 0.00 72.50 70.41 2dia s THR 76 CO 0.77 0.23 1.10 0.00 -2.21 0.00 0.00 174.62 174.52 2dia s ALA 77 N -0.01 2.54 0.00 11.08 0.00 -1.26 -4.86 121.76 129.25 2dia s ALA 77 Ca 0.00 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.51 2dia s ALA 77 Cb -0.06 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.75 2dia s ALA 77 CO 0.00 -1.14 0.00 0.41 0.00 0.00 0.00 175.76 175.03 2dia n GLY 78 N -0.54 0.98 3.63 0.00 0.00 -0.90 -5.00 105.19 103.36 2dia n GLY 78 Ca 0.10 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.82 3.86 0.16 1.61 -1.94 -1.26 -2.26 119.30 117.65 2dia s MET 79 Ca 0.00 1.20 0.03 0.00 -1.71 0.00 0.00 55.69 55.21 2dia s MET 79 Cb 0.00 -3.91 -0.03 0.00 2.01 0.00 0.00 34.83 32.90 2dia s MET 79 CO 0.00 -1.20 0.28 0.71 -0.01 0.00 0.00 175.02 174.81 2dia s TYR 80 N 4.56 3.47 -0.44 -0.03 2.02 -1.00 -2.38 117.35 123.55 2dia s TYR 80 Ca 0.57 0.10 0.04 0.00 -0.37 0.00 0.00 57.07 57.41 2dia s TYR 80 Cb -0.16 -1.65 0.12 0.00 -0.40 0.00 0.00 41.96 39.86 2dia s TYR 80 CO 0.25 0.51 0.18 0.99 -1.57 0.00 0.00 175.55 175.90 2dia s THR 81 N -1.76 2.25 -0.01 -0.71 2.01 0.22 -2.87 115.64 114.77 2dia s THR 81 Ca 0.34 -2.79 -0.30 0.00 0.31 0.00 0.00 61.69 59.25 2dia s THR 81 Cb -0.11 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 2dia s THR 81 CO 0.28 -0.73 1.18 -0.76 -0.69 0.00 0.00 174.62 173.90 2dia s LEU 82 N 0.30 4.32 -0.20 4.42 1.43 -0.45 -3.36 118.68 125.13 2dia s LEU 82 Ca 0.15 1.87 -0.02 0.00 -1.03 0.00 0.00 54.13 55.10 2dia s LEU 82 Cb -0.23 -3.57 0.06 0.00 0.03 0.00 0.00 46.19 42.48 2dia s LEU 82 CO -0.04 -0.51 0.02 -0.89 0.23 0.00 0.00 176.35 175.15 2dia s THR 83 N 1.69 0.70 -0.08 5.49 2.01 -1.05 -1.23 115.64 123.17 2dia s THR 83 Ca 0.57 -0.66 0.04 0.00 0.31 0.00 0.00 61.69 61.94 2dia s THR 83 Cb -0.26 -1.16 -0.01 0.00 0.01 0.00 0.00 72.50 71.08 2dia s THR 83 CO 0.25 -0.18 -0.21 -0.32 -0.69 0.00 0.00 174.62 173.47 2dia s MET 84 N 1.78 2.83 -0.13 4.92 0.00 -1.26 0.58 119.30 128.01 2dia s MET 84 Ca -0.02 -0.83 0.02 0.00 0.00 0.00 0.00 55.69 54.86 2dia s MET 84 Cb -0.17 -2.31 0.01 0.00 0.00 0.00 0.00 34.83 32.36 2dia s MET 84 CO -0.08 0.33 -0.18 0.15 0.00 0.00 0.00 175.02 175.25 2dia s LYS 85 N -0.01 2.54 -0.27 4.11 1.02 -0.12 -2.67 119.74 124.33 2dia s LYS 85 Ca -0.07 -0.67 -0.06 0.00 0.02 0.00 0.00 55.97 55.19 2dia s LYS 85 Cb -0.15 -2.15 -0.00 0.00 -0.52 0.00 0.00 37.83 35.01 2dia s LYS 85 CO 0.05 -0.09 0.05 -0.47 -0.92 0.00 0.00 175.35 173.97 2dia s TYR 86 N 1.04 3.10 -1.19 3.18 6.14 0.21 -2.81 117.35 127.02 2dia s TYR 86 Ca -0.04 -0.87 -0.01 0.00 0.64 0.00 0.00 57.07 56.79 2dia s TYR 86 Cb -0.15 -2.22 0.00 0.00 0.42 0.00 0.00 41.96 40.02 2dia s TYR 86 CO -0.04 -0.53 0.19 0.41 0.64 0.00 0.00 175.55 176.22 2dia n GLY 87 N 4.86 -0.21 2.44 8.97 0.00 -0.14 -1.95 105.19 119.17 2dia n GLY 87 Ca -0.16 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.14 0.75 3.12 -0.02 0.00 -1.26 -4.90 105.19 101.75 2dia n GLY 88 Ca -0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 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 1.76 0.70 1.61 2.02 -0.82 -5.09 118.70 118.85 2dia s GLU 89 Ca 0.00 -0.59 -0.16 0.00 0.02 0.00 0.00 54.97 54.24 2dia s GLU 89 Cb 0.00 -1.52 0.02 0.00 0.10 0.00 0.00 34.13 32.73 2dia s GLU 89 CO 0.00 0.22 1.25 -0.51 0.02 0.00 0.00 175.26 176.24 2dia s LEU 90 N 0.08 3.43 0.37 1.80 1.43 -1.26 0.65 118.68 125.19 2dia s LEU 90 Ca -0.05 2.48 -0.00 0.00 -1.03 0.00 0.00 54.13 55.53 2dia s LEU 90 Cb -0.12 -4.60 -0.03 0.00 0.03 0.00 0.00 46.19 41.47 2dia s LEU 90 CO 0.02 -2.17 0.59 0.68 0.23 0.00 0.00 176.35 175.71 2dia s VAL 91 N -1.72 5.00 -2.00 -1.59 -7.23 -1.09 -4.69 120.40 107.08 2dia s VAL 91 Ca 0.78 -0.37 0.10 0.00 -1.81 0.00 0.00 61.98 60.69 2dia s VAL 91 Cb -0.33 -3.84 0.29 0.00 0.56 0.00 0.00 36.38 33.07 2dia s VAL 91 CO 0.43 -0.59 1.05 -0.81 -0.31 0.00 0.00 175.10 174.87 2dia n PRO 92 N -1.88 0.49 -0.06 4.82 -0.04 -1.26 -1.85 135.00 135.22 2dia n PRO 92 Ca -0.04 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.47 2dia n PRO 92 Cb 0.56 -1.33 0.07 0.00 -0.04 0.00 0.00 33.50 32.77 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 -0.83 0.08 -3.67 0.54 8.25 -1.26 -5.03 115.22 113.31 2dia n HIS 93 Ca 0.08 -0.70 -0.14 0.00 -0.26 0.00 0.00 57.72 56.70 2dia n HIS 93 Cb 0.04 -0.10 -0.07 0.00 1.12 0.00 0.00 29.99 30.98 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 -1.76 -0.32 0.57 4.41 0.40 -0.77 -4.09 117.98 116.42 2dia s PHE 94 Ca 0.15 0.44 -0.18 0.00 -0.60 0.00 0.00 56.93 56.74 2dia s PHE 94 Cb 0.13 0.21 -0.04 0.00 0.51 0.00 0.00 43.02 43.82 2dia s PHE 94 CO 0.03 -0.51 1.12 -1.25 0.70 0.00 0.00 175.22 175.31 2dia s PRO 95 N -1.75 3.23 -0.02 0.24 0.04 -1.26 -4.37 135.00 131.10 2dia s PRO 95 Ca -0.10 1.56 0.01 0.00 0.04 0.00 0.00 61.00 62.51 2dia s PRO 95 Cb -0.02 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.53 2dia s PRO 95 CO 0.03 -0.94 -0.05 0.00 0.04 0.00 0.00 177.00 176.08 2dia s ALA 96 N -1.91 0.58 0.06 8.56 0.00 -0.36 -4.98 121.76 123.71 2dia s ALA 96 Ca 0.71 -0.14 -0.12 0.00 0.00 0.00 0.00 51.96 52.41 2dia s ALA 96 Cb -0.23 -0.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.55 2dia s ALA 96 CO 0.30 0.06 0.42 -0.98 0.00 0.00 0.00 175.76 175.56 2dia s ARG 97 N 0.41 3.85 -0.10 0.00 1.04 -1.26 -1.35 118.95 121.54 2dia s ARG 97 Ca -0.05 0.30 -0.05 0.00 -1.04 0.00 0.00 55.73 54.89 2dia s ARG 97 Cb -0.09 -3.08 0.05 0.00 -2.04 0.00 0.00 34.95 29.79 2dia s ARG 97 CO -0.00 0.60 0.24 0.08 -0.04 0.00 0.00 175.30 176.18 2dia s VAL 98 N -1.28 -0.06 -0.28 4.99 1.01 -1.14 -4.97 120.40 118.68 2dia s VAL 98 Ca 0.30 0.16 -0.28 0.00 0.00 0.00 0.00 61.98 62.16 2dia s VAL 98 Cb -0.15 -0.38 0.01 0.00 0.00 0.00 0.00 36.38 35.86 2dia s VAL 98 CO 0.16 0.06 1.00 -0.75 0.00 0.00 0.00 175.10 175.58 2dia s LYS 99 N 1.32 4.14 -0.20 2.72 2.20 -1.26 -2.36 119.74 126.29 2dia s LYS 99 Ca -0.09 1.11 -0.09 0.00 -0.36 0.00 0.00 55.97 56.55 2dia s LYS 99 Cb -0.11 -3.69 -0.04 0.00 -1.51 0.00 0.00 37.83 32.48 2dia s LYS 99 CO -0.08 -0.73 0.09 0.08 -0.36 0.00 0.00 175.35 174.35 2dia s VAL 100 N 3.31 5.02 0.36 4.02 1.01 -0.96 -3.52 120.40 129.65 2dia s VAL 100 Ca 0.42 0.05 -0.11 0.00 0.00 0.00 0.00 61.98 62.35 2dia s VAL 100 Cb -0.14 -3.29 -0.07 0.00 0.00 0.00 0.00 36.38 32.89 2dia s VAL 100 CO 0.11 0.43 0.72 -1.61 0.00 0.00 0.00 175.10 174.75 2dia s GLU 101 N 0.51 3.80 0.60 2.72 0.41 0.17 -2.12 118.70 124.79 2dia s GLU 101 Ca 0.05 0.43 -0.17 0.00 -0.41 0.00 0.00 54.97 54.87 2dia s GLU 101 Cb -0.12 -2.45 -0.03 0.00 -1.78 0.00 0.00 34.13 29.75 2dia s GLU 101 CO 0.00 0.05 1.12 -1.25 -0.49 0.00 0.00 175.26 174.70 2dia s PRO 102 N -3.58 3.09 -0.62 0.39 0.04 -1.26 -1.72 135.00 131.33 2dia s PRO 102 Ca 0.51 1.50 0.02 0.00 0.04 0.00 0.00 61.00 63.06 2dia s PRO 102 Cb -0.10 -1.98 0.40 0.00 0.04 0.00 0.00 34.50 32.85 2dia s PRO 102 CO 0.28 -1.04 1.59 0.00 0.04 0.00 0.00 177.00 177.87 2dia n ALA 103 N -1.85 5.80 -2.65 8.56 0.00 -1.26 -4.71 120.51 124.41 2dia n ALA 103 Ca 0.11 -4.11 -0.43 0.00 0.00 0.00 0.00 53.44 49.00 2dia n ALA 103 Cb 0.51 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.57 4.13 -3.73 0.00 0.24 -1.26 -4.86 118.33 112.28 2dia n VAL 104 Ca 0.48 -4.37 -0.29 0.00 -2.04 0.00 0.00 64.34 58.12 2dia n VAL 104 Cb 0.51 -2.43 -0.13 0.00 -1.47 0.00 0.00 33.84 30.32 2dia n VAL 104 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2dia s ASP 105 N 2.87 3.65 -0.25 -1.34 2.15 -1.26 -5.07 116.67 117.41 2dia s ASP 105 Ca 0.45 -2.97 -0.28 0.00 0.43 0.00 0.00 52.55 50.18 2dia s ASP 105 Cb 0.02 -1.13 0.17 0.00 -0.30 0.00 0.00 42.92 41.68 2dia s ASP 105 CO 0.02 -0.21 1.25 0.28 -0.17 0.00 0.00 175.17 176.33 2dia s THR 106 N -0.12 0.00 -0.15 1.71 -1.32 -1.26 -5.16 115.64 109.35 2dia s THR 106 Ca 0.21 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.71 2dia s THR 106 Cb -0.17 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 69.84 2dia s THR 106 CO -0.06 0.00 -0.21 -0.44 -2.21 0.00 0.00 174.62 171.70 2dia s SER 107 N -0.69 3.08 0.37 8.08 0.01 -1.26 -5.10 113.70 118.20 2dia s SER 107 Ca 0.05 -0.61 -0.26 0.00 1.31 0.00 0.00 55.95 56.44 2dia s SER 107 Cb -0.02 -1.43 -0.11 0.00 0.21 0.00 0.00 66.02 64.66 2dia s SER 107 CO -0.07 0.06 1.17 -0.24 0.41 0.00 0.00 173.24 174.57 2dia n SER 108 N 4.20 2.11 -3.63 2.44 2.88 -1.26 -4.97 113.62 115.39 2dia n SER 108 Ca -0.20 1.14 0.02 0.00 -1.33 0.00 0.00 58.87 58.50 2dia n SER 108 Cb 0.51 -1.43 -0.00 0.00 -0.75 0.00 0.00 64.21 62.54 2dia n SER 108 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2dia s GLY 109 N -0.51 -0.41 0.24 0.46 0.00 -1.26 -5.15 107.32 100.70 2dia s GLY 109 Ca 0.59 0.69 -0.30 0.00 0.00 0.00 0.00 44.72 45.70 2dia s GLY 109 CO 0.59 0.92 1.27 2.56 0.00 0.00 0.00 173.10 178.45 2dia s PRO 110 N -2.25 4.42 -0.05 2.90 0.04 -1.26 -5.04 135.00 133.77 2dia s PRO 110 Ca 0.17 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.31 2dia s PRO 110 Cb 0.05 -3.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.41 2dia s PRO 110 CO -0.04 -0.16 -0.22 -1.12 0.04 0.00 0.00 177.00 175.49 2dia s SER 111 N -0.06 3.32 -0.53 6.66 0.01 -1.26 -5.09 113.70 116.74 2dia s SER 111 Ca 0.53 -0.42 -0.18 0.00 1.31 0.00 0.00 55.95 57.19 2dia s SER 111 Cb -0.36 -0.71 0.09 0.00 0.21 0.00 0.00 66.02 65.25 2dia s SER 111 CO 0.42 0.29 0.57 -0.44 0.41 0.00 0.00 173.24 174.49 2dia s SER 112 N -0.41 6.19 0.00 2.44 0.01 -1.26 -5.36 113.70 115.30 2dia s SER 112 Ca 0.04 -1.34 0.00 0.00 1.31 0.00 0.00 55.95 55.96 2dia s SER 112 Cb -0.12 -2.25 0.00 0.00 0.21 0.00 0.00 66.02 63.86 2dia s SER 112 CO 0.01 -0.90 0.00 0.61 0.41 0.00 0.00 173.24 173.38