#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 -0.26 -0.10 1.61 0.01 -1.26 -5.09 113.70 108.62 2dia s SER 2 Ca 0.00 -0.01 -0.03 0.00 1.31 0.00 0.00 55.95 57.21 2dia s SER 2 Cb 0.00 0.41 -0.03 0.00 0.21 0.00 0.00 66.02 66.61 2dia s SER 2 CO 0.00 -0.64 0.11 -1.28 0.41 0.00 0.00 173.24 171.84 2dia h SER 3 N 3.10 -0.03 0.00 2.44 0.87 -2.11 -3.50 113.55 114.32 2dia h SER 3 Ca -0.31 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 2dia h SER 3 Cb 1.20 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 2dia h SER 3 CO 0.44 0.50 0.00 0.61 -0.53 0.00 0.00 176.83 177.85 2dia n GLY 4 N 1.67 0.61 3.68 5.77 0.00 -1.26 -4.98 105.19 110.68 2dia n GLY 4 Ca -0.01 -1.74 -0.60 0.00 0.00 0.00 0.00 46.02 43.67 2dia n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2dia n SER 5 N 0.00 1.98 -0.12 1.61 2.88 -1.26 -4.85 113.62 113.85 2dia n SER 5 Ca 0.00 1.04 -0.26 0.00 -1.33 0.00 0.00 58.87 58.33 2dia n SER 5 Cb 0.00 -1.07 -0.11 0.00 -0.75 0.00 0.00 64.21 62.29 2dia n SER 5 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dia n SER 6 N 5.44 1.91 0.00 -3.46 7.64 -1.26 -5.11 113.62 118.78 2dia n SER 6 Ca 0.30 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.56 2dia n SER 6 Cb 0.08 -0.89 0.00 0.00 -1.01 0.00 0.00 64.21 62.39 2dia n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dia n GLY 7 N 1.34 -1.67 3.68 0.23 0.00 -1.26 -5.10 105.19 102.41 2dia n GLY 7 Ca -0.43 -1.09 -0.29 0.00 0.00 0.00 0.00 46.02 44.21 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 -1.64 0.41 0.06 1.61 0.04 -1.26 -4.68 135.00 129.53 2dia s PRO 8 Ca 0.00 0.52 -0.26 0.00 0.04 0.00 0.00 61.00 61.30 2dia s PRO 8 Cb 0.00 -1.73 -0.06 0.00 0.04 0.00 0.00 34.50 32.75 2dia s PRO 8 CO 0.00 -2.75 0.79 0.12 0.04 0.00 0.00 177.00 175.21 2dia s PHE 9 N -2.96 3.75 -0.27 0.56 5.36 -1.26 -3.60 117.98 119.55 2dia s PHE 9 Ca 0.65 1.52 -0.03 0.00 -0.96 0.00 0.00 56.93 58.11 2dia s PHE 9 Cb -0.19 -2.85 0.16 0.00 -0.34 0.00 0.00 43.02 39.80 2dia s PHE 9 CO 0.58 0.27 0.52 -0.51 -1.46 0.00 0.00 175.22 174.62 2dia s ASP 10 N -0.07 -0.78 0.54 6.13 1.01 -0.57 -4.94 116.67 118.00 2dia s ASP 10 Ca 0.40 0.78 0.33 0.00 0.71 0.00 0.00 52.55 54.76 2dia s ASP 10 Cb -0.21 1.80 1.36 0.00 1.01 0.00 0.00 42.92 46.88 2dia s ASP 10 CO 0.24 -0.26 1.98 1.55 0.21 0.00 0.00 175.17 178.89 2dia h PRO 11 N 8.07 0.00 -0.20 8.23 0.13 -1.84 -2.93 132.00 143.47 2dia h PRO 11 Ca -0.21 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.81 2dia h PRO 11 Cb 1.15 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.26 2dia h PRO 11 CO 0.23 0.03 -0.36 0.77 -0.23 0.00 0.00 178.00 178.45 2dia h SER 12 N 0.00 0.45 0.30 1.44 0.02 -1.95 -2.33 113.55 111.48 2dia h SER 12 Ca -0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2dia h SER 12 Cb 0.52 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2dia h SER 12 CO 0.00 0.77 0.00 0.29 -1.14 0.00 0.00 176.83 176.76 2dia n LYS 13 N -4.06 0.06 -2.87 3.45 4.76 -1.10 -4.65 118.16 113.75 2dia n LYS 13 Ca -0.01 0.27 -0.41 0.00 -2.87 0.00 0.00 58.31 55.28 2dia n LYS 13 Cb 0.47 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.12 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 -2.83 4.91 -0.10 -0.18 1.01 -0.88 -4.55 120.40 117.77 2dia s VAL 14 Ca 0.07 1.72 0.01 0.00 0.00 0.00 0.00 61.98 63.78 2dia s VAL 14 Cb 0.07 -4.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 2dia s VAL 14 CO 0.18 0.10 -0.14 -0.69 0.00 0.00 0.00 175.10 174.55 2dia s VAL 15 N 1.62 3.02 -0.03 2.92 1.01 -1.19 -4.71 120.40 123.05 2dia s VAL 15 Ca 0.42 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.72 2dia s VAL 15 Cb -0.18 -2.23 0.01 0.00 0.00 0.00 0.00 36.38 33.98 2dia s VAL 15 CO 0.17 0.55 -0.07 0.00 0.00 0.00 0.00 175.10 175.75 2dia s ALA 16 N -0.04 0.69 0.28 5.51 0.00 -1.26 -0.94 121.76 126.00 2dia s ALA 16 Ca -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 51.96 51.70 2dia s ALA 16 Cb -0.14 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.69 2dia s ALA 16 CO 0.04 0.09 0.40 0.43 0.00 0.00 0.00 175.76 176.72 2dia n SER 17 N 3.44 -1.12 0.00 0.00 7.64 -1.07 -4.99 113.62 117.52 2dia n SER 17 Ca -0.19 -2.52 0.00 0.00 1.01 0.00 0.00 58.87 57.17 2dia n SER 17 Cb 0.54 2.08 0.00 0.00 -1.01 0.00 0.00 64.21 65.82 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 -0.46 2.81 0.19 0.23 0.00 -1.26 -1.99 105.19 104.71 2dia n GLY 18 Ca 0.00 -1.95 -0.03 0.00 0.00 0.00 0.00 46.02 44.05 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 0.26 -0.33 1.61 0.13 -1.90 -3.05 132.00 128.71 2dia h PRO 19 Ca 0.00 -0.14 0.08 0.00 -0.87 0.00 0.00 66.00 65.07 2dia h PRO 19 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.12 2dia h PRO 19 CO 0.00 0.67 0.23 0.78 -0.23 0.00 0.00 178.00 179.46 2dia h GLY 20 N 1.28 0.12 1.11 1.56 0.00 -1.64 0.34 103.07 105.84 2dia h GLY 20 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2dia h GLY 20 CO 0.07 0.03 -0.05 1.04 0.00 0.00 0.00 176.54 177.63 2dia n LEU 21 N -4.46 0.26 -0.06 3.11 4.77 -1.15 -3.67 117.00 115.80 2dia n LEU 21 Ca 0.05 0.09 -0.07 0.00 -0.03 0.00 0.00 56.01 56.04 2dia n LEU 21 Cb 0.34 -0.18 -0.08 0.00 -2.33 0.00 0.00 43.42 41.17 2dia n LEU 21 CO 0.35 0.05 -0.90 -0.62 -1.33 0.00 0.00 177.39 174.94 2dia n GLU 22 N -1.04 1.38 -3.64 3.23 1.02 0.88 -4.87 120.64 117.61 2dia n GLU 22 Ca 0.16 0.03 -0.03 0.00 -0.02 0.00 0.00 57.16 57.31 2dia n GLU 22 Cb 0.24 -1.28 -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 -2.27 -0.14 0.30 -0.32 -3.43 0.59 -4.57 115.29 105.46 2dia s HIS 23 Ca -0.11 -0.02 -0.10 0.00 -0.80 0.00 0.00 55.06 54.02 2dia s HIS 23 Cb 0.04 0.57 0.01 0.00 -1.43 0.00 0.00 32.58 31.76 2dia s HIS 23 CO 0.39 -0.48 0.52 0.20 -2.00 0.00 0.00 174.74 173.37 2dia s GLY 24 N -2.74 0.83 -0.01 -1.38 0.00 -1.10 -3.87 107.32 99.06 2dia s GLY 24 Ca 0.11 -1.07 -0.01 0.00 0.00 0.00 0.00 44.72 43.75 2dia s GLY 24 CO -0.03 -0.70 0.03 1.25 0.00 0.00 0.00 173.10 173.64 2dia s LYS 25 N -3.47 0.03 -0.24 2.90 2.20 -1.26 -0.57 119.74 119.32 2dia s LYS 25 Ca 0.24 0.05 -0.32 0.00 -0.36 0.00 0.00 55.97 55.58 2dia s LYS 25 Cb -0.01 -0.01 -0.09 0.00 -1.51 0.00 0.00 37.83 36.21 2dia s LYS 25 CO 0.13 -0.02 2.14 0.28 -0.36 0.00 0.00 175.35 177.52 2dia n VAL 26 N 3.16 0.33 0.00 4.02 0.31 -0.79 -0.09 118.33 125.27 2dia n VAL 26 Ca -0.13 -0.30 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 2dia n VAL 26 Cb 0.59 -2.04 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 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 5.80 3.40 2.72 2.92 0.00 0.98 -4.40 105.19 116.62 2dia n GLY 27 Ca 0.33 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.14 2dia n GLY 27 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dia n GLU 28 N -1.91 -1.38 -4.12 1.61 -0.58 0.87 -4.88 120.64 110.24 2dia n GLU 28 Ca 0.00 -1.43 -0.29 0.00 -0.42 0.00 0.00 57.16 55.03 2dia n GLU 28 Cb 0.00 -1.04 -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 -3.71 1.66 -0.63 0.62 0.00 -1.26 -4.05 121.76 114.39 2dia s ALA 29 Ca 0.54 -0.75 -0.28 0.00 0.00 0.00 0.00 51.96 51.47 2dia s ALA 29 Cb -0.02 -0.94 0.02 0.00 0.00 0.00 0.00 23.12 22.17 2dia s ALA 29 CO 0.39 -0.29 1.34 0.20 0.00 0.00 0.00 175.76 177.39 2dia s GLY 30 N 1.38 0.91 0.02 0.00 0.00 -0.19 -4.85 107.32 104.59 2dia s GLY 30 Ca 0.01 -0.94 -0.30 0.00 0.00 0.00 0.00 44.72 43.49 2dia s GLY 30 CO -0.07 2.71 1.54 1.08 0.00 0.00 0.00 173.10 178.36 2dia s LEU 31 N 5.84 4.33 -0.02 0.66 1.43 -1.26 -3.45 118.68 126.21 2dia s LEU 31 Ca 0.45 2.28 0.00 0.00 -1.03 0.00 0.00 54.13 55.83 2dia s LEU 31 Cb -0.09 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.60 2dia s LEU 31 CO 0.22 -0.82 0.02 -0.76 0.23 0.00 0.00 176.35 175.24 2dia s LEU 32 N 2.78 1.12 -0.15 1.79 1.43 -0.50 -2.97 118.68 122.16 2dia s LEU 32 Ca 0.69 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.84 2dia s LEU 32 Cb -0.35 -0.09 0.01 0.00 0.03 0.00 0.00 46.19 45.79 2dia s LEU 32 CO 0.29 -0.12 -0.21 -0.44 0.23 0.00 0.00 176.35 176.10 2dia s SER 33 N 1.04 3.18 -0.35 2.29 0.01 -0.84 -1.44 113.70 117.58 2dia s SER 33 Ca -0.09 -0.60 -0.09 0.00 1.31 0.00 0.00 55.95 56.48 2dia s SER 33 Cb -0.13 -1.47 0.03 0.00 0.21 0.00 0.00 66.02 64.66 2dia s SER 33 CO -0.03 0.06 0.15 -0.69 0.41 0.00 0.00 173.24 173.14 2dia s VAL 34 N 0.96 4.18 -0.50 3.43 1.01 -0.92 -2.61 120.40 125.96 2dia s VAL 34 Ca -0.03 -0.93 -0.22 0.00 0.00 0.00 0.00 61.98 60.79 2dia s VAL 34 Cb -0.15 -3.32 0.04 0.00 0.00 0.00 0.00 36.38 32.95 2dia s VAL 34 CO -0.05 -0.16 0.77 -0.62 0.00 0.00 0.00 175.10 175.04 2dia s ASP 35 N 1.49 6.32 -0.18 3.32 -1.08 -0.12 -2.13 116.67 124.29 2dia s ASP 35 Ca 0.01 -0.46 -0.09 0.00 -0.52 0.00 0.00 52.55 51.49 2dia s ASP 35 Cb -0.19 -2.37 -0.05 0.00 -1.46 0.00 0.00 42.92 38.86 2dia s ASP 35 CO 0.05 -1.00 0.12 0.00 0.52 0.00 0.00 175.17 174.86 2dia n SER 37 N 3.10 0.00 -1.06 0.00 7.64 -1.26 -4.76 113.62 117.28 2dia n SER 37 Ca -0.17 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.79 2dia n SER 37 Cb 0.53 0.00 0.27 0.00 -1.01 0.00 0.00 64.21 64.00 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 -1.80 3.28 0.00 1.43 1.02 -1.26 -4.55 120.64 118.75 2dia n GLU 38 Ca 0.00 -2.76 0.02 0.00 -0.02 0.00 0.00 57.16 54.40 2dia n GLU 38 Cb 0.00 -1.81 0.08 0.00 -0.02 0.00 0.00 31.44 29.69 2dia n GLU 38 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2dia n ALA 39 N -0.01 1.23 -0.55 0.62 0.00 -1.26 -4.40 120.51 116.13 2dia n ALA 39 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.64 2dia n ALA 39 Cb 0.86 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 19.25 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 -1.07 -0.13 0.00 0.00 0.00 -1.24 -1.51 105.19 101.24 2dia n GLY 40 Ca 0.01 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.36 0.00 1.61 -0.04 -1.26 -4.92 135.00 130.03 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 2.44 1.73 3.54 0.55 0.00 -1.26 -4.78 105.19 107.41 2dia n GLY 42 Ca 0.00 -1.95 -0.28 0.00 0.00 0.00 0.00 46.02 43.80 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 -2.48 2.84 -0.05 4.61 0.00 -1.26 -4.77 121.76 120.65 2dia s ALA 43 Ca 0.00 -1.44 -0.07 0.00 0.00 0.00 0.00 51.96 50.45 2dia s ALA 43 Cb 0.00 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2dia s ALA 43 CO 0.00 0.51 0.22 -1.17 0.00 0.00 0.00 175.76 175.32 2dia s LEU 44 N -2.59 4.39 -0.20 0.00 2.96 -1.26 -0.78 118.68 121.19 2dia s LEU 44 Ca 0.22 0.55 -0.15 0.00 -0.22 0.00 0.00 54.13 54.53 2dia s LEU 44 Cb -0.09 -2.40 0.06 0.00 0.50 0.00 0.00 46.19 44.25 2dia s LEU 44 CO 0.13 0.33 0.52 -0.83 -1.32 0.00 0.00 176.35 175.18 2dia s GLY 45 N -1.37 -0.42 0.12 7.98 0.00 -0.98 -5.02 107.32 107.63 2dia s GLY 45 Ca 0.22 1.68 0.09 0.00 0.00 0.00 0.00 44.72 46.72 2dia s GLY 45 CO 0.11 1.64 -0.23 -2.27 0.00 0.00 0.00 173.10 172.35 2dia s LEU 46 N 0.95 2.33 -0.20 0.66 2.96 -1.26 -0.56 118.68 123.55 2dia s LEU 46 Ca -0.05 -0.74 -0.04 0.00 -0.22 0.00 0.00 54.13 53.07 2dia s LEU 46 Cb -0.06 -1.02 0.07 0.00 0.50 0.00 0.00 46.19 45.68 2dia s LEU 46 CO -0.08 0.10 0.09 -0.70 -1.32 0.00 0.00 176.35 174.44 2dia s GLU 47 N -2.10 0.18 -0.35 1.98 2.12 0.42 -4.95 118.70 115.99 2dia s GLU 47 Ca 0.11 -0.24 -0.19 0.00 0.36 0.00 0.00 54.97 55.00 2dia s GLU 47 Cb -0.09 -1.72 -0.00 0.00 0.26 0.00 0.00 34.13 32.57 2dia s GLU 47 CO 0.06 -0.75 0.58 0.00 -0.54 0.00 0.00 175.26 174.60 2dia s ALA 48 N 2.08 3.47 -0.07 6.30 0.00 -1.26 -2.09 121.76 130.19 2dia s ALA 48 Ca 0.03 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.09 2dia s ALA 48 Cb -0.16 -3.10 0.02 0.00 0.00 0.00 0.00 23.12 19.88 2dia s ALA 48 CO -0.15 -1.27 -0.07 0.08 0.00 0.00 0.00 175.76 174.35 2dia s VAL 49 N 2.55 0.81 0.63 0.00 1.01 -1.23 -0.66 120.40 123.51 2dia s VAL 49 Ca 0.22 -0.25 -0.10 0.00 0.00 0.00 0.00 61.98 61.85 2dia s VAL 49 Cb -0.15 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 2dia s VAL 49 CO 0.14 0.30 1.02 -0.55 0.00 0.00 0.00 175.10 176.00 2dia s SER 50 N 1.05 5.95 0.49 3.32 0.15 -1.08 -0.97 113.70 122.62 2dia s SER 50 Ca -0.08 1.24 0.27 0.00 0.70 0.00 0.00 55.95 58.07 2dia s SER 50 Cb -0.14 -2.23 1.46 0.00 -1.71 0.00 0.00 66.02 63.39 2dia s SER 50 CO -0.01 -1.00 1.80 -0.78 1.20 0.00 0.00 173.24 174.45 2dia h ASP 51 N -0.36 0.00 -0.70 5.45 1.82 -1.71 0.32 116.42 121.25 2dia h ASP 51 Ca -0.45 0.00 -0.16 0.00 -0.39 0.00 0.00 57.03 56.04 2dia h ASP 51 Cb 1.22 0.00 -0.09 0.00 0.68 0.00 0.00 39.33 41.13 2dia h ASP 51 CO 0.62 0.00 0.20 -1.20 -1.61 0.00 0.00 179.24 177.25 2dia n SER 52 N -2.56 5.12 -3.51 2.28 7.64 -1.26 -4.93 113.62 116.40 2dia n SER 52 Ca -0.02 -3.13 -0.21 0.00 1.01 0.00 0.00 58.87 56.53 2dia n SER 52 Cb 0.21 -0.73 0.06 0.00 -1.01 0.00 0.00 64.21 62.73 2dia n SER 52 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dia n GLY 53 N 0.09 -0.71 3.07 0.23 0.00 0.11 -4.98 105.19 103.00 2dia n GLY 53 Ca 0.37 0.33 -0.33 0.00 0.00 0.00 0.00 46.02 46.39 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 -3.49 2.70 -0.24 2.61 2.01 -1.24 -4.88 115.64 113.12 2dia s THR 54 Ca 0.24 -2.13 -0.29 0.00 0.31 0.00 0.00 61.69 59.81 2dia s THR 54 Cb -0.05 -2.88 -0.03 0.00 0.01 0.00 0.00 72.50 69.55 2dia s THR 54 CO 0.78 -0.57 1.73 -0.54 -0.69 0.00 0.00 174.62 175.34 2dia s LYS 55 N 1.03 3.64 0.65 4.92 1.02 -1.26 -2.62 119.74 127.12 2dia s LYS 55 Ca 0.08 1.68 -0.09 0.00 0.02 0.00 0.00 55.97 57.65 2dia s LYS 55 Cb -0.21 -4.11 0.01 0.00 -0.52 0.00 0.00 37.83 33.00 2dia s LYS 55 CO -0.06 -1.49 1.02 0.00 -0.92 0.00 0.00 175.35 173.90 2dia s ALA 56 N 5.85 3.06 -0.34 5.17 0.00 0.17 -4.98 121.76 130.68 2dia s ALA 56 Ca 0.77 -0.44 -0.27 0.00 0.00 0.00 0.00 51.96 52.02 2dia s ALA 56 Cb -0.26 -2.88 0.01 0.00 0.00 0.00 0.00 23.12 20.00 2dia s ALA 56 CO 0.32 -0.96 0.97 -2.00 0.00 0.00 0.00 175.76 174.09 2dia s GLU 57 N -5.20 3.94 0.05 0.00 2.12 -1.23 -4.67 118.70 113.70 2dia s GLU 57 Ca 0.56 0.78 0.08 0.00 0.36 0.00 0.00 54.97 56.75 2dia s GLU 57 Cb -0.11 -3.77 -0.03 0.00 0.26 0.00 0.00 34.13 30.48 2dia s GLU 57 CO 0.50 -0.91 -0.22 0.08 -0.54 0.00 0.00 175.26 174.17 2dia s VAL 58 N 3.51 2.51 0.01 3.70 1.01 -1.26 -1.75 120.40 128.13 2dia s VAL 58 Ca 0.41 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2dia s VAL 58 Cb -0.12 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 2dia s VAL 58 CO 0.17 0.34 -0.01 -0.55 0.00 0.00 0.00 175.10 175.05 2dia s SER 59 N -1.38 0.11 -0.11 3.32 0.15 -0.90 -5.01 113.70 109.88 2dia s SER 59 Ca 0.13 -0.19 0.03 0.00 0.70 0.00 0.00 55.95 56.62 2dia s SER 59 Cb -0.10 0.04 0.01 0.00 -1.71 0.00 0.00 66.02 64.25 2dia s SER 59 CO 0.04 -0.11 -0.19 -0.63 1.20 0.00 0.00 173.24 173.54 2dia s ILE 60 N -0.56 1.79 -0.12 6.45 1.01 -1.26 -2.49 121.20 126.02 2dia s ILE 60 Ca -0.06 -0.83 0.01 0.00 0.00 0.00 0.00 60.65 59.77 2dia s ILE 60 Cb -0.04 -1.59 -0.01 0.00 0.01 0.00 0.00 42.46 40.83 2dia s ILE 60 CO -0.00 0.50 -0.14 -1.58 0.00 0.00 0.00 174.94 173.71 2dia s GLN 61 N 0.73 3.25 0.51 2.79 0.74 -0.93 -4.95 119.66 121.80 2dia s GLN 61 Ca -0.11 -0.71 -0.17 0.00 0.05 0.00 0.00 55.36 54.42 2dia s GLN 61 Cb -0.16 -2.57 -0.08 0.00 1.10 0.00 0.00 33.01 31.30 2dia s GLN 61 CO 0.02 0.26 0.99 -0.80 -0.55 0.00 0.00 175.29 175.21 2dia s ASN 62 N 0.22 6.56 -0.08 6.67 -0.87 -1.26 -1.36 114.94 124.81 2dia s ASN 62 Ca -0.09 1.63 -0.04 0.00 -1.57 0.00 0.00 52.86 52.79 2dia s ASN 62 Cb -0.15 -2.52 0.04 0.00 -0.02 0.00 0.00 41.25 38.60 2dia s ASN 62 CO 0.05 -0.63 0.19 0.20 -2.57 0.00 0.00 177.10 174.34 2dia s ASN 63 N -2.88 -0.15 0.17 -1.22 0.01 -0.95 -4.88 114.94 105.03 2dia s ASN 63 Ca 0.60 0.39 0.13 0.00 -0.71 0.00 0.00 52.86 53.27 2dia s ASN 63 Cb -0.11 0.28 0.68 0.00 0.41 0.00 0.00 41.25 42.51 2dia s ASN 63 CO 0.29 -0.16 1.40 1.17 -1.51 0.00 0.00 177.10 178.30 2dia n LYS 64 N 4.24 0.08 -0.16 -0.60 4.81 -1.26 -1.37 118.16 123.91 2dia n LYS 64 Ca -0.26 0.54 0.02 0.00 -0.87 0.00 0.00 58.31 57.74 2dia n LYS 64 Cb 0.52 -1.75 0.08 0.00 0.02 0.00 0.00 35.03 33.90 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 -1.92 1.67 -2.37 3.14 8.00 -1.26 -4.84 116.55 118.96 2dia n ASP 65 Ca -0.00 -2.14 -0.18 0.00 0.71 0.00 0.00 54.79 53.17 2dia n ASP 65 Cb 0.05 -0.42 0.02 0.00 -0.02 0.00 0.00 41.12 40.74 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 0.30 -0.33 3.30 0.44 0.00 -0.47 -4.91 105.19 103.52 2dia n GLY 66 Ca 0.06 -0.06 -0.16 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.01 0.95 -0.05 2.61 -4.23 -1.21 -1.74 115.64 108.96 2dia s THR 67 Ca 0.17 -2.02 0.02 0.00 -1.18 0.00 0.00 61.69 58.68 2dia s THR 67 Cb -0.08 -2.26 0.02 0.00 1.34 0.00 0.00 72.50 71.52 2dia s THR 67 CO 0.21 -0.38 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.51 2dia s TYR 68 N -3.47 1.16 -0.71 3.99 1.51 -0.91 -2.24 117.35 116.67 2dia s TYR 68 Ca 0.27 -0.39 -0.18 0.00 -1.01 0.00 0.00 57.07 55.76 2dia s TYR 68 Cb 0.06 -0.89 0.13 0.00 -0.11 0.00 0.00 41.96 41.14 2dia s TYR 68 CO 0.07 -0.23 0.82 0.00 -1.11 0.00 0.00 175.55 175.11 2dia s ALA 69 N 0.71 3.51 -0.06 3.71 0.00 -0.46 -2.16 121.76 127.01 2dia s ALA 69 Ca -0.13 -2.53 -0.11 0.00 0.00 0.00 0.00 51.96 49.18 2dia s ALA 69 Cb -0.15 -3.66 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 2dia s ALA 69 CO 0.02 -2.50 0.29 0.08 0.00 0.00 0.00 175.76 173.65 2dia s VAL 70 N 2.29 5.24 -0.04 0.00 1.01 -0.52 -2.18 120.40 126.20 2dia s VAL 70 Ca 0.18 0.57 -0.07 0.00 0.00 0.00 0.00 61.98 62.66 2dia s VAL 70 Cb -0.17 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.64 2dia s VAL 70 CO 0.00 0.59 0.17 -0.89 0.00 0.00 0.00 175.10 174.97 2dia s THR 71 N -1.00 0.04 -0.04 3.92 2.01 -1.04 -1.41 115.64 118.12 2dia s THR 71 Ca 0.20 -0.29 0.01 0.00 0.31 0.00 0.00 61.69 61.92 2dia s THR 71 Cb -0.15 -0.35 0.02 0.00 0.01 0.00 0.00 72.50 72.03 2dia s THR 71 CO 0.09 -0.16 -0.04 -0.72 -0.69 0.00 0.00 174.62 173.10 2dia s TYR 72 N -0.55 0.65 -0.42 4.92 -0.85 -1.22 -2.13 117.35 117.75 2dia s TYR 72 Ca -0.06 -0.16 -0.04 0.00 -0.52 0.00 0.00 57.07 56.29 2dia s TYR 72 Cb -0.04 -0.58 0.11 0.00 0.38 0.00 0.00 41.96 41.83 2dia s TYR 72 CO 0.01 -0.15 0.22 0.08 -1.52 0.00 0.00 175.55 174.19 2dia s VAL 73 N 0.78 3.44 -0.12 -3.49 1.01 -0.72 -1.02 120.40 120.28 2dia s VAL 73 Ca -0.10 -2.00 -0.29 0.00 0.00 0.00 0.00 61.98 59.59 2dia s VAL 73 Cb -0.13 -3.33 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 2dia s VAL 73 CO -0.00 -0.69 1.54 -2.16 0.00 0.00 0.00 175.10 173.78 2dia s PRO 74 N 1.18 4.13 0.18 2.72 0.04 -1.26 -3.55 135.00 138.44 2dia s PRO 74 Ca 0.08 1.95 0.01 0.00 0.04 0.00 0.00 61.00 63.08 2dia s PRO 74 Cb -0.23 -3.93 0.07 0.00 0.04 0.00 0.00 34.50 30.45 2dia s PRO 74 CO -0.04 -0.89 1.43 -0.07 0.04 0.00 0.00 177.00 177.48 2dia h LEU 75 N 10.35 0.34 -8.90 -3.56 3.38 -1.94 0.28 115.31 115.25 2dia h LEU 75 Ca -0.35 -0.24 -0.53 0.00 0.09 0.00 0.00 57.88 56.86 2dia h LEU 75 Cb 1.15 -0.10 -0.17 0.00 0.09 0.00 0.00 40.66 41.63 2dia h LEU 75 CO 0.97 0.98 -0.77 0.28 0.09 0.00 0.00 178.44 179.99 2dia s THR 76 N -3.46 1.93 0.19 0.22 -1.32 -1.26 -4.68 115.64 107.26 2dia s THR 76 Ca -0.04 -2.04 -0.15 0.00 -1.21 0.00 0.00 61.69 58.25 2dia s THR 76 Cb 0.11 -1.96 -0.07 0.00 -1.51 0.00 0.00 72.50 69.06 2dia s THR 76 CO 0.83 -0.36 0.61 0.00 -2.21 0.00 0.00 174.62 173.49 2dia s ALA 77 N -2.24 3.51 0.00 11.08 0.00 -1.26 -4.77 121.76 128.09 2dia s ALA 77 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 51.96 52.09 2dia s ALA 77 Cb -0.05 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.46 2dia s ALA 77 CO 0.08 0.42 0.00 0.41 0.00 0.00 0.00 175.76 176.67 2dia n GLY 78 N 0.59 0.48 3.69 0.00 0.00 -1.07 -5.01 105.19 103.87 2dia n GLY 78 Ca -0.03 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.82 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 -1.33 4.22 0.20 1.61 -1.94 -1.26 -3.07 119.30 117.73 2dia s MET 79 Ca 0.00 2.22 0.07 0.00 -1.71 0.00 0.00 55.69 56.27 2dia s MET 79 Cb 0.00 -3.58 -0.04 0.00 2.01 0.00 0.00 34.83 33.22 2dia s MET 79 CO 0.00 -0.68 0.04 0.71 -0.01 0.00 0.00 175.02 175.07 2dia s TYR 80 N 2.53 2.88 -0.49 -0.03 1.51 -0.52 -1.74 117.35 121.50 2dia s TYR 80 Ca 0.71 -0.14 0.03 0.00 -1.01 0.00 0.00 57.07 56.66 2dia s TYR 80 Cb -0.37 -1.36 0.13 0.00 -0.11 0.00 0.00 41.96 40.25 2dia s TYR 80 CO 0.30 0.54 0.25 0.99 -1.11 0.00 0.00 175.55 176.52 2dia s THR 81 N -1.88 2.12 0.06 -0.71 2.01 -0.14 -2.38 115.64 114.72 2dia s THR 81 Ca 0.29 -3.03 -0.31 0.00 0.31 0.00 0.00 61.69 58.96 2dia s THR 81 Cb -0.09 -2.48 -0.07 0.00 0.01 0.00 0.00 72.50 69.87 2dia s THR 81 CO 0.20 -0.84 1.48 -0.76 -0.69 0.00 0.00 174.62 174.01 2dia s LEU 82 N -0.05 4.35 -0.30 4.42 1.43 -1.09 -3.52 118.68 123.92 2dia s LEU 82 Ca 0.17 2.30 0.02 0.00 -1.03 0.00 0.00 54.13 55.60 2dia s LEU 82 Cb -0.25 -3.57 0.09 0.00 0.03 0.00 0.00 46.19 42.49 2dia s LEU 82 CO 0.00 -0.75 0.03 -0.89 0.23 0.00 0.00 176.35 174.97 2dia s THR 83 N 2.02 1.77 -0.21 5.49 2.01 -0.89 -1.96 115.64 123.87 2dia s THR 83 Ca 0.67 -1.82 -0.05 0.00 0.31 0.00 0.00 61.69 60.80 2dia s THR 83 Cb -0.36 -2.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.91 2dia s THR 83 CO 0.29 -0.47 0.01 -0.32 -0.69 0.00 0.00 174.62 173.44 2dia s MET 84 N 1.20 3.60 -0.16 4.92 0.00 -1.26 -0.44 119.30 127.16 2dia s MET 84 Ca 0.05 -0.52 0.00 0.00 0.00 0.00 0.00 55.69 55.23 2dia s MET 84 Cb -0.19 -3.11 0.03 0.00 0.00 0.00 0.00 34.83 31.56 2dia s MET 84 CO -0.12 -0.03 -0.12 0.15 0.00 0.00 0.00 175.02 174.90 2dia s LYS 85 N 1.13 2.14 -0.27 4.11 1.02 0.27 -2.86 119.74 125.29 2dia s LYS 85 Ca 0.03 -0.60 -0.08 0.00 0.02 0.00 0.00 55.97 55.34 2dia s LYS 85 Cb -0.14 -2.13 -0.02 0.00 -0.52 0.00 0.00 37.83 35.01 2dia s LYS 85 CO 0.02 -0.29 0.09 -0.47 -0.92 0.00 0.00 175.35 173.77 2dia s TYR 86 N 1.49 3.11 -1.27 3.18 6.14 0.24 -2.32 117.35 127.92 2dia s TYR 86 Ca 0.03 -0.51 -0.02 0.00 0.64 0.00 0.00 57.07 57.21 2dia s TYR 86 Cb -0.14 -2.26 0.00 0.00 0.42 0.00 0.00 41.96 39.98 2dia s TYR 86 CO -0.10 -0.40 0.32 0.41 0.64 0.00 0.00 175.55 176.42 2dia n GLY 87 N 4.93 -0.27 2.43 8.97 0.00 0.04 -1.77 105.19 119.52 2dia n GLY 87 Ca -0.15 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.25 0.61 3.19 -0.02 0.00 -1.26 -4.92 105.19 101.53 2dia n GLY 88 Ca -0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.15 1.54 0.54 1.61 2.02 -0.73 -5.09 118.70 118.44 2dia s GLU 89 Ca 0.00 -0.68 -0.20 0.00 0.02 0.00 0.00 54.97 54.12 2dia s GLU 89 Cb 0.00 -1.49 -0.06 0.00 0.10 0.00 0.00 34.13 32.69 2dia s GLU 89 CO 0.00 0.40 1.15 -0.51 0.02 0.00 0.00 175.26 176.33 2dia s LEU 90 N -0.43 3.78 0.36 1.80 1.43 -1.26 0.83 118.68 125.18 2dia s LEU 90 Ca 0.07 2.24 0.01 0.00 -1.03 0.00 0.00 54.13 55.42 2dia s LEU 90 Cb -0.07 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.59 2dia s LEU 90 CO -0.01 -1.23 0.57 0.68 0.23 0.00 0.00 176.35 176.59 2dia s VAL 91 N -1.70 4.91 -2.00 -1.59 -7.23 -1.14 -4.77 120.40 106.88 2dia s VAL 91 Ca 0.72 -0.48 0.10 0.00 -1.81 0.00 0.00 61.98 60.52 2dia s VAL 91 Cb -0.26 -3.79 0.29 0.00 0.56 0.00 0.00 36.38 33.18 2dia s VAL 91 CO 0.29 -0.52 1.04 -0.81 -0.31 0.00 0.00 175.10 174.80 2dia n PRO 92 N -1.83 0.49 -0.08 4.82 -0.04 -1.26 -1.96 135.00 135.14 2dia n PRO 92 Ca -0.04 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.51 2dia n PRO 92 Cb 0.56 -1.33 0.13 0.00 -0.04 0.00 0.00 33.50 32.82 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 0.04 -3.55 0.54 8.25 -1.26 -5.03 115.22 113.38 2dia n HIS 93 Ca 0.08 -0.92 -0.15 0.00 -0.26 0.00 0.00 57.72 56.46 2dia n HIS 93 Cb 0.03 -0.14 -0.06 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 -2.61 -0.51 0.66 4.41 0.40 -0.83 -4.25 117.98 115.25 2dia s PHE 94 Ca 0.28 0.72 -0.15 0.00 -0.60 0.00 0.00 56.93 57.18 2dia s PHE 94 Cb 0.24 0.37 0.00 0.00 0.51 0.00 0.00 43.02 44.14 2dia s PHE 94 CO 0.03 -0.63 1.11 -1.25 0.70 0.00 0.00 175.22 175.18 2dia s PRO 95 N -1.93 2.78 -0.16 0.24 0.04 -1.26 -4.42 135.00 130.29 2dia s PRO 95 Ca -0.08 1.38 -0.03 0.00 0.04 0.00 0.00 61.00 62.31 2dia s PRO 95 Cb -0.01 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.64 2dia s PRO 95 CO 0.03 -1.27 0.05 0.00 0.04 0.00 0.00 177.00 175.85 2dia s ALA 96 N -2.36 0.71 0.27 8.56 0.00 -0.83 -4.97 121.76 123.13 2dia s ALA 96 Ca 0.67 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.90 2dia s ALA 96 Cb -0.20 -1.04 -0.09 0.00 0.00 0.00 0.00 23.12 21.79 2dia s ALA 96 CO 0.42 -1.04 1.10 -0.98 0.00 0.00 0.00 175.76 175.26 2dia s ARG 97 N 1.99 4.64 0.01 0.00 1.04 -1.26 -2.67 118.95 122.70 2dia s ARG 97 Ca 0.01 1.79 -0.00 0.00 -1.04 0.00 0.00 55.73 56.49 2dia s ARG 97 Cb -0.16 -3.20 -0.01 0.00 -2.04 0.00 0.00 34.95 29.54 2dia s ARG 97 CO -0.08 0.20 -0.01 0.08 -0.04 0.00 0.00 175.30 175.45 2dia s VAL 98 N -1.04 0.05 -0.26 4.99 1.01 -1.00 -4.97 120.40 119.18 2dia s VAL 98 Ca 0.45 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.89 2dia s VAL 98 Cb -0.32 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.91 2dia s VAL 98 CO 0.40 -0.21 0.39 -0.75 0.00 0.00 0.00 175.10 174.92 2dia s LYS 99 N -0.62 4.05 -0.27 2.72 2.20 -1.26 -1.43 119.74 125.12 2dia s LYS 99 Ca -0.07 0.09 -0.09 0.00 -0.36 0.00 0.00 55.97 55.55 2dia s LYS 99 Cb -0.04 -3.63 -0.03 0.00 -1.51 0.00 0.00 37.83 32.62 2dia s LYS 99 CO -0.00 -0.24 0.11 0.08 -0.36 0.00 0.00 175.35 174.94 2dia s VAL 100 N 1.94 4.56 0.45 4.02 1.01 -1.17 -2.70 120.40 128.51 2dia s VAL 100 Ca 0.16 -0.19 -0.21 0.00 0.00 0.00 0.00 61.98 61.74 2dia s VAL 100 Cb -0.16 -3.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.94 2dia s VAL 100 CO 0.09 0.25 1.01 -1.61 0.00 0.00 0.00 175.10 174.84 2dia s GLU 101 N 1.64 4.01 0.50 2.72 2.02 0.26 -2.60 118.70 127.25 2dia s GLU 101 Ca 0.06 1.30 -0.21 0.00 0.02 0.00 0.00 54.97 56.14 2dia s GLU 101 Cb -0.16 -2.20 -0.07 0.00 0.10 0.00 0.00 34.13 31.81 2dia s GLU 101 CO 0.06 -0.24 1.15 -1.25 0.02 0.00 0.00 175.26 174.99 2dia s PRO 102 N -3.09 3.56 -0.68 0.39 0.04 -1.26 -1.88 135.00 132.09 2dia s PRO 102 Ca 0.64 1.70 -0.02 0.00 0.04 0.00 0.00 61.00 63.35 2dia s PRO 102 Cb -0.15 -2.21 0.36 0.00 0.04 0.00 0.00 34.50 32.55 2dia s PRO 102 CO 0.19 -0.69 2.09 0.00 0.04 0.00 0.00 177.00 178.62 2dia n ALA 103 N -0.88 6.30 -1.80 8.56 0.00 -1.26 -4.61 120.51 126.81 2dia n ALA 103 Ca 0.09 -3.48 -0.38 0.00 0.00 0.00 0.00 53.44 49.67 2dia n ALA 103 Cb 0.49 -1.84 0.04 0.00 0.00 0.00 0.00 19.45 18.14 2dia n ALA 103 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dia n VAL 104 N -0.53 3.58 -3.92 0.00 0.31 -1.26 -4.83 118.33 111.67 2dia n VAL 104 Ca 0.56 -4.00 -0.32 0.00 -0.01 0.00 0.00 64.34 60.58 2dia n VAL 104 Cb 0.50 -1.25 -0.02 0.00 -0.91 0.00 0.00 33.84 32.16 2dia n VAL 104 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2dia n ASP 105 N -0.49 -3.42 -3.94 4.52 8.00 -1.26 -4.90 116.55 115.06 2dia n ASP 105 Ca 0.55 -0.78 -0.30 0.00 0.71 0.00 0.00 54.79 54.97 2dia n ASP 105 Cb 0.31 -2.81 -0.12 0.00 -0.02 0.00 0.00 41.12 38.48 2dia n ASP 105 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2dia s THR 106 N -3.14 2.92 -0.28 -3.53 -1.32 -1.26 -5.04 115.64 103.99 2dia s THR 106 Ca 0.63 -3.85 -0.19 0.00 -1.21 0.00 0.00 61.69 57.07 2dia s THR 106 Cb -0.34 -2.94 0.08 0.00 -1.51 0.00 0.00 72.50 67.78 2dia s THR 106 CO 0.77 -0.93 0.70 -0.55 -2.21 0.00 0.00 174.62 172.41 2dia s SER 107 N -0.86 -0.87 0.06 8.08 0.15 -1.26 -4.93 113.70 114.07 2dia s SER 107 Ca 0.22 1.49 0.03 0.00 0.70 0.00 0.00 55.95 58.39 2dia s SER 107 Cb -0.13 1.42 -0.03 0.00 -1.71 0.00 0.00 66.02 65.57 2dia s SER 107 CO -0.10 -0.24 -0.10 -0.44 1.20 0.00 0.00 173.24 173.56 2dia s SER 108 N 1.16 1.19 0.00 5.45 0.01 -1.26 -5.03 113.70 115.23 2dia s SER 108 Ca -0.06 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.56 2dia s SER 108 Cb -0.05 0.01 0.00 0.00 0.21 0.00 0.00 66.02 66.19 2dia s SER 108 CO -0.12 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 173.94 2dia n GLY 109 N 1.16 -1.89 0.00 3.44 0.00 -1.26 -4.88 105.19 101.76 2dia n GLY 109 Ca -0.21 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.38 2dia n GLY 109 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dia n PRO 110 N 0.21 0.49 -1.60 1.61 -0.04 -1.26 -4.85 135.00 129.57 2dia n PRO 110 Ca 0.00 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.03 2dia n PRO 110 Cb 0.00 -1.35 0.00 0.00 -0.04 0.00 0.00 33.50 32.11 2dia n PRO 110 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2dia n SER 111 N -0.85 1.21 -0.12 3.54 7.64 -1.26 -4.94 113.62 118.84 2dia n SER 111 Ca 0.08 1.09 -0.26 0.00 1.01 0.00 0.00 58.87 60.79 2dia n SER 111 Cb 0.04 -1.32 -0.09 0.00 -1.01 0.00 0.00 64.21 61.83 2dia n SER 111 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dia n SER 112 N 0.84 1.73 0.00 6.43 2.88 -1.26 -5.20 113.62 119.05 2dia n SER 112 Ca 0.09 0.29 0.00 0.00 -1.33 0.00 0.00 58.87 57.92 2dia n SER 112 Cb 0.36 -0.71 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 2dia n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42