#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 6.30 -0.04 1.61 1.04 -1.26 -5.06 113.70 116.29 2dia s SER 2 Ca 0.00 0.96 -0.22 0.00 0.48 0.00 0.00 55.95 57.17 2dia s SER 2 Cb 0.00 -2.26 -0.04 0.00 0.10 0.00 0.00 66.02 63.82 2dia s SER 2 CO 0.00 -0.56 0.65 -0.94 0.98 0.00 0.00 173.24 173.38 2dia s SER 3 N -3.98 6.97 0.00 7.02 1.04 -1.26 -4.78 113.70 118.72 2dia s SER 3 Ca 0.48 1.17 0.00 0.00 0.48 0.00 0.00 55.95 58.08 2dia s SER 3 Cb -0.10 -2.39 0.00 0.00 0.10 0.00 0.00 66.02 63.63 2dia s SER 3 CO 0.43 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.23 2dia n GLY 4 N 2.88 -0.50 3.80 7.32 0.00 -1.26 -5.08 105.19 112.35 2dia n GLY 4 Ca -0.03 -0.76 -0.36 0.00 0.00 0.00 0.00 46.02 44.87 2dia n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dia s SER 5 N 0.00 6.21 -0.32 1.61 0.15 -1.26 -5.01 113.70 115.09 2dia s SER 5 Ca 0.00 0.34 0.14 0.00 0.70 0.00 0.00 55.95 57.13 2dia s SER 5 Cb 0.00 -2.04 0.47 0.00 -1.71 0.00 0.00 66.02 62.74 2dia s SER 5 CO 0.00 0.31 1.08 -1.20 1.20 0.00 0.00 173.24 174.63 2dia n SER 6 N 2.67 2.94 -4.85 5.45 7.64 -1.26 -5.09 113.62 121.12 2dia n SER 6 Ca -0.18 -2.95 -0.32 0.00 1.01 0.00 0.00 58.87 56.43 2dia n SER 6 Cb 0.54 -0.46 -0.04 0.00 -1.01 0.00 0.00 64.21 63.24 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 -3.52 2.13 0.68 0.23 0.00 -1.26 -5.05 107.32 100.53 2dia s GLY 7 Ca 0.37 0.12 -0.14 0.00 0.00 0.00 0.00 44.72 45.07 2dia s GLY 7 CO -0.03 0.37 1.11 2.56 0.00 0.00 0.00 173.10 177.11 2dia s PRO 8 N -3.75 2.69 0.24 2.90 0.04 -1.26 -4.73 135.00 131.14 2dia s PRO 8 Ca 0.57 1.35 -0.30 0.00 0.04 0.00 0.00 61.00 62.66 2dia s PRO 8 Cb -0.10 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.41 2dia s PRO 8 CO 0.26 -1.33 1.15 0.12 0.04 0.00 0.00 177.00 177.25 2dia s PHE 9 N -2.45 3.49 -0.30 0.56 2.19 -1.26 -4.30 117.98 115.91 2dia s PHE 9 Ca 0.66 1.58 -0.08 0.00 0.33 0.00 0.00 56.93 59.42 2dia s PHE 9 Cb -0.20 -3.36 0.17 0.00 -1.31 0.00 0.00 43.02 38.32 2dia s PHE 9 CO 0.44 -0.87 0.78 0.34 1.83 0.00 0.00 175.22 177.74 2dia s ASP 10 N -0.45 -1.00 0.30 6.13 2.15 0.23 -4.99 116.67 119.05 2dia s ASP 10 Ca 0.48 0.84 0.25 0.00 0.43 0.00 0.00 52.55 54.55 2dia s ASP 10 Cb -0.33 1.92 1.05 0.00 -0.30 0.00 0.00 42.92 45.27 2dia s ASP 10 CO 0.40 -0.19 1.76 1.55 -0.17 0.00 0.00 175.17 178.52 2dia h PRO 11 N 7.92 0.00 -0.37 4.34 0.13 -1.86 -2.97 132.00 139.20 2dia h PRO 11 Ca -0.19 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.86 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 0.12 0.00 -0.10 0.77 -0.23 0.00 0.00 178.00 178.56 2dia h SER 12 N 0.00 0.63 0.17 1.44 0.02 -1.94 -2.42 113.55 111.44 2dia h SER 12 Ca 0.00 -0.17 -0.02 0.00 -0.84 0.00 0.00 61.79 60.75 2dia h SER 12 Cb 0.38 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 2dia h SER 12 CO 0.00 0.77 -0.11 0.11 -1.14 0.00 0.00 176.83 176.45 2dia h LYS 13 N 0.59 0.00 -6.53 3.45 1.79 -1.89 -3.43 116.57 110.56 2dia h LYS 13 Ca 0.11 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.05 2dia h LYS 13 Cb 0.53 0.00 0.04 0.00 -1.58 0.00 0.00 32.23 31.21 2dia h LYS 13 CO 0.03 0.11 1.03 0.08 -1.08 0.00 0.00 179.45 179.63 2dia s VAL 14 N -4.60 2.61 -0.27 0.50 1.01 -0.91 -4.79 120.40 113.95 2dia s VAL 14 Ca -0.04 0.23 0.01 0.00 0.00 0.00 0.00 61.98 62.17 2dia s VAL 14 Cb 0.15 -3.14 0.05 0.00 0.00 0.00 0.00 36.38 33.44 2dia s VAL 14 CO 0.64 0.00 -0.07 -0.69 0.00 0.00 0.00 175.10 174.99 2dia s VAL 15 N 2.25 2.51 -0.09 2.92 1.01 -1.24 -4.69 120.40 123.07 2dia s VAL 15 Ca 0.76 -1.48 -0.00 0.00 0.00 0.00 0.00 61.98 61.26 2dia s VAL 15 Cb -0.44 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.47 2dia s VAL 15 CO 0.34 -0.02 -0.05 0.00 0.00 0.00 0.00 175.10 175.36 2dia s ALA 16 N 1.18 3.02 0.37 5.51 0.00 -1.26 -1.96 121.76 128.62 2dia s ALA 16 Ca -0.07 -0.87 -0.12 0.00 0.00 0.00 0.00 51.96 50.91 2dia s ALA 16 Cb -0.19 -1.32 0.04 0.00 0.00 0.00 0.00 23.12 21.64 2dia s ALA 16 CO -0.04 0.50 0.70 -1.12 0.00 0.00 0.00 175.76 175.80 2dia s SER 17 N -0.59 0.29 0.00 0.00 0.01 -1.06 -4.96 113.70 107.39 2dia s SER 17 Ca 0.09 -1.25 0.00 0.00 1.31 0.00 0.00 55.95 56.10 2dia s SER 17 Cb -0.12 0.80 0.00 0.00 0.21 0.00 0.00 66.02 66.91 2dia s SER 17 CO 0.02 -1.58 0.00 0.61 0.41 0.00 0.00 173.24 172.70 2dia n GLY 18 N -0.54 2.23 0.19 3.44 0.00 -1.26 -1.60 105.19 107.64 2dia n GLY 18 Ca -0.06 -1.98 -0.03 0.00 0.00 0.00 0.00 46.02 43.95 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 -0.65 1.61 0.13 -1.91 -3.09 132.00 128.35 2dia h PRO 19 Ca 0.00 -0.14 0.11 0.00 -0.87 0.00 0.00 66.00 65.10 2dia h PRO 19 Cb 0.00 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 2dia h PRO 19 CO 0.00 0.68 0.43 0.78 -0.23 0.00 0.00 178.00 179.66 2dia h GLY 20 N 1.28 0.66 0.47 1.56 0.00 -1.68 0.38 103.07 105.74 2dia h GLY 20 Ca 0.01 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.15 2dia h GLY 20 CO 0.07 0.11 0.00 1.04 0.00 0.00 0.00 176.54 177.76 2dia n LEU 21 N -4.48 0.40 -0.05 3.11 4.77 -1.17 -3.54 117.00 116.05 2dia n LEU 21 Ca 0.11 -0.15 -0.05 0.00 -0.03 0.00 0.00 56.01 55.89 2dia n LEU 21 Cb 0.39 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.41 2dia n LEU 21 CO 0.34 0.07 -0.81 -0.62 -1.33 0.00 0.00 177.39 175.04 2dia n GLU 22 N -0.63 1.86 -3.59 3.23 1.02 0.11 -4.87 120.64 117.77 2dia n GLU 22 Ca 0.20 0.02 -0.04 0.00 -0.02 0.00 0.00 57.16 57.31 2dia n GLU 22 Cb 0.16 -1.22 -0.02 0.00 -0.02 0.00 0.00 31.44 30.34 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 -2.21 -0.17 0.18 -0.32 -3.43 0.06 -4.70 115.29 104.70 2dia s HIS 23 Ca -0.08 0.06 -0.07 0.00 -0.80 0.00 0.00 55.06 54.18 2dia s HIS 23 Cb 0.03 0.54 -0.02 0.00 -1.43 0.00 0.00 32.58 31.70 2dia s HIS 23 CO 0.33 -0.35 0.26 0.20 -2.00 0.00 0.00 174.74 173.17 2dia s GLY 24 N -2.46 0.72 -0.05 -1.38 0.00 -1.23 -4.07 107.32 98.84 2dia s GLY 24 Ca 0.09 -1.11 -0.03 0.00 0.00 0.00 0.00 44.72 43.67 2dia s GLY 24 CO -0.05 -0.97 0.13 1.25 0.00 0.00 0.00 173.10 173.46 2dia s LYS 25 N -4.02 0.11 -0.30 2.90 2.20 -1.26 -0.27 119.74 119.11 2dia s LYS 25 Ca 0.23 0.26 -0.38 0.00 -0.36 0.00 0.00 55.97 55.72 2dia s LYS 25 Cb 0.04 -0.05 -0.14 0.00 -1.51 0.00 0.00 37.83 36.17 2dia s LYS 25 CO 0.04 -0.09 1.95 0.28 -0.36 0.00 0.00 175.35 177.17 2dia n VAL 26 N 3.59 0.28 0.00 4.02 0.31 -0.81 0.30 118.33 126.01 2dia n VAL 26 Ca -0.19 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 2dia n VAL 26 Cb 0.56 -1.42 0.00 0.00 -0.91 0.00 0.00 33.84 32.07 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 5.28 3.03 2.33 2.92 0.00 -0.26 -4.37 105.19 114.12 2dia n GLY 27 Ca 0.33 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.29 -2.36 -4.27 1.61 -0.58 0.15 -4.89 120.64 110.01 2dia n GLU 28 Ca 0.00 -1.17 -0.25 0.00 -0.42 0.00 0.00 57.16 55.32 2dia n GLU 28 Cb 0.00 -1.08 -0.17 0.00 -0.57 0.00 0.00 31.44 29.62 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 -3.05 1.21 -0.79 0.62 0.00 -1.26 -4.19 121.76 114.30 2dia s ALA 29 Ca 0.47 -0.42 -0.26 0.00 0.00 0.00 0.00 51.96 51.75 2dia s ALA 29 Cb -0.04 -0.68 0.03 0.00 0.00 0.00 0.00 23.12 22.42 2dia s ALA 29 CO 0.36 -0.11 1.40 0.20 0.00 0.00 0.00 175.76 177.62 2dia s GLY 30 N 1.10 0.86 -0.06 0.00 0.00 -0.39 -4.83 107.32 104.00 2dia s GLY 30 Ca -0.07 -1.48 -0.30 0.00 0.00 0.00 0.00 44.72 42.88 2dia s GLY 30 CO -0.01 2.77 1.73 1.08 0.00 0.00 0.00 173.10 178.67 2dia s LEU 31 N 6.11 4.27 -0.04 0.66 1.43 -1.26 -3.64 118.68 126.21 2dia s LEU 31 Ca 0.42 2.25 0.01 0.00 -1.03 0.00 0.00 54.13 55.78 2dia s LEU 31 Cb -0.07 -3.53 0.02 0.00 0.03 0.00 0.00 46.19 42.64 2dia s LEU 31 CO 0.10 -1.01 -0.04 -0.76 0.23 0.00 0.00 176.35 174.86 2dia s LEU 32 N 4.37 1.35 -0.15 1.79 1.43 -0.41 -2.96 118.68 124.10 2dia s LEU 32 Ca 0.77 -0.13 0.02 0.00 -1.03 0.00 0.00 54.13 53.76 2dia s LEU 32 Cb -0.34 -0.44 0.01 0.00 0.03 0.00 0.00 46.19 45.45 2dia s LEU 32 CO 0.32 -0.05 -0.20 -0.44 0.23 0.00 0.00 176.35 176.21 2dia s SER 33 N 0.87 3.24 -0.10 2.29 0.01 -0.63 -1.24 113.70 118.15 2dia s SER 33 Ca -0.12 -0.58 0.00 0.00 1.31 0.00 0.00 55.95 56.56 2dia s SER 33 Cb -0.14 -1.48 -0.02 0.00 0.21 0.00 0.00 66.02 64.59 2dia s SER 33 CO 0.00 0.07 -0.11 -0.69 0.41 0.00 0.00 173.24 172.92 2dia s VAL 34 N 0.91 3.26 -0.52 3.43 1.01 -0.57 -2.55 120.40 125.37 2dia s VAL 34 Ca -0.04 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.26 2dia s VAL 34 Cb -0.15 -2.35 0.13 0.00 0.00 0.00 0.00 36.38 34.01 2dia s VAL 34 CO -0.03 0.55 0.36 -0.62 0.00 0.00 0.00 175.10 175.36 2dia s ASP 35 N -0.08 5.56 -0.38 3.32 2.15 -0.83 -1.23 116.67 125.17 2dia s ASP 35 Ca -0.01 -2.23 -0.11 0.00 0.43 0.00 0.00 52.55 50.63 2dia s ASP 35 Cb -0.14 -1.94 0.03 0.00 -0.30 0.00 0.00 42.92 40.57 2dia s ASP 35 CO 0.03 -0.57 0.22 0.00 -0.17 0.00 0.00 175.17 174.69 2dia n SER 37 N 5.02 0.42 0.07 0.00 7.64 -1.26 -4.55 113.62 120.95 2dia n SER 37 Ca -0.12 0.24 0.12 0.00 1.01 0.00 0.00 58.87 60.12 2dia n SER 37 Cb 0.46 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.76 2dia n SER 37 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2dia h GLU 38 N 0.00 0.00 -0.96 1.43 4.39 -1.91 -3.36 114.58 114.16 2dia h GLU 38 Ca 0.00 0.00 0.31 0.00 0.34 0.00 0.00 59.36 60.01 2dia h GLU 38 Cb 0.00 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 28.49 2dia h GLU 38 CO 0.00 0.00 0.40 0.00 -1.16 0.00 0.00 179.01 178.25 2dia h ALA 39 N 2.36 1.71 0.00 3.43 0.00 -1.86 -3.43 119.26 121.46 2dia h ALA 39 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2dia h ALA 39 Cb 0.82 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2dia h ALA 39 CO 0.00 -0.62 0.00 0.41 0.00 0.00 0.00 179.25 179.04 2dia n GLY 40 N -1.33 -0.93 2.63 0.00 0.00 -1.26 0.76 105.19 105.05 2dia n GLY 40 Ca 0.29 -1.97 -0.22 0.00 0.00 0.00 0.00 46.02 44.11 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 -2.63 0.00 1.61 -0.04 -1.26 -4.96 135.00 127.71 2dia n PRO 41 Ca 0.00 -1.31 0.00 0.00 -0.04 0.00 0.00 63.50 62.15 2dia n PRO 41 Cb 0.00 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 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 -2.98 2.23 3.89 0.55 0.00 -1.26 -4.75 105.19 102.87 2dia n GLY 42 Ca 0.11 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.73 3.83 0.10 4.61 0.00 -1.26 -4.62 121.76 122.69 2dia s ALA 43 Ca 0.00 -0.59 -0.14 0.00 0.00 0.00 0.00 51.96 51.23 2dia s ALA 43 Cb 0.00 -2.08 -0.06 0.00 0.00 0.00 0.00 23.12 20.98 2dia s ALA 43 CO 0.00 0.68 0.50 -1.17 0.00 0.00 0.00 175.76 175.77 2dia s LEU 44 N -2.31 4.40 -0.03 0.00 2.96 -1.26 -0.88 118.68 121.55 2dia s LEU 44 Ca 0.36 1.04 -0.25 0.00 -0.22 0.00 0.00 54.13 55.06 2dia s LEU 44 Cb -0.13 -3.04 0.05 0.00 0.50 0.00 0.00 46.19 43.58 2dia s LEU 44 CO 0.22 0.18 0.55 -0.83 -1.32 0.00 0.00 176.35 175.16 2dia s GLY 45 N -1.51 -0.44 0.04 7.98 0.00 -1.02 -5.01 107.32 107.37 2dia s GLY 45 Ca 0.33 0.94 0.03 0.00 0.00 0.00 0.00 44.72 46.01 2dia s GLY 45 CO 0.18 0.63 -0.09 -2.27 0.00 0.00 0.00 173.10 171.54 2dia s LEU 46 N -1.33 2.24 -0.30 0.66 2.96 -1.26 -0.73 118.68 120.92 2dia s LEU 46 Ca -0.11 -0.53 -0.00 0.00 -0.22 0.00 0.00 54.13 53.27 2dia s LEU 46 Cb -0.02 -0.27 0.10 0.00 0.50 0.00 0.00 46.19 46.50 2dia s LEU 46 CO 0.07 -0.15 0.09 -0.70 -1.32 0.00 0.00 176.35 174.34 2dia s GLU 47 N -1.49 0.79 -0.10 1.98 2.12 0.19 -4.97 118.70 117.23 2dia s GLU 47 Ca -0.07 -1.10 -0.21 0.00 0.36 0.00 0.00 54.97 53.95 2dia s GLU 47 Cb -0.09 -2.10 -0.04 0.00 0.26 0.00 0.00 34.13 32.16 2dia s GLU 47 CO 0.01 -0.96 0.60 0.00 -0.54 0.00 0.00 175.26 174.37 2dia s ALA 48 N 1.57 3.41 -0.17 6.30 0.00 -1.26 -2.36 121.76 129.25 2dia s ALA 48 Ca 0.09 -0.03 -0.10 0.00 0.00 0.00 0.00 51.96 51.92 2dia s ALA 48 Cb -0.17 -2.83 0.06 0.00 0.00 0.00 0.00 23.12 20.17 2dia s ALA 48 CO -0.23 -0.10 0.41 0.08 0.00 0.00 0.00 175.76 175.92 2dia s VAL 49 N 0.83 -0.02 0.77 0.00 1.01 -1.22 -2.36 120.40 119.41 2dia s VAL 49 Ca 0.32 0.09 -0.12 0.00 0.00 0.00 0.00 61.98 62.27 2dia s VAL 49 Cb -0.16 -0.61 0.05 0.00 0.00 0.00 0.00 36.38 35.66 2dia s VAL 49 CO 0.14 0.03 1.14 -0.94 0.00 0.00 0.00 175.10 175.47 2dia s SER 50 N 1.30 4.85 0.41 3.32 1.04 -0.92 -0.76 113.70 122.94 2dia s SER 50 Ca -0.09 0.98 0.13 0.00 0.48 0.00 0.00 55.95 57.45 2dia s SER 50 Cb -0.08 -1.62 0.97 0.00 0.10 0.00 0.00 66.02 65.39 2dia s SER 50 CO -0.12 -1.71 1.93 -0.78 0.98 0.00 0.00 173.24 173.55 2dia h ASP 51 N -0.91 0.46 0.97 7.02 1.82 -1.78 0.39 116.42 124.39 2dia h ASP 51 Ca -0.46 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.20 2dia h ASP 51 Cb 1.29 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 41.23 2dia h ASP 51 CO 0.64 0.26 0.00 -0.24 -1.61 0.00 0.00 179.24 178.29 2dia n SER 52 N -4.49 0.57 -0.60 2.28 2.88 -1.26 -4.91 113.62 108.10 2dia n SER 52 Ca 0.13 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.27 2dia n SER 52 Cb 0.44 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 63.16 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 0.56 0.72 3.08 0.46 0.00 0.14 -5.09 105.19 105.05 2dia n GLY 53 Ca 0.04 -0.42 -0.32 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.23 1.89 -0.11 2.61 2.01 -1.25 -4.86 115.64 113.70 2dia s THR 54 Ca 0.00 -0.90 -0.30 0.00 0.31 0.00 0.00 61.69 60.80 2dia s THR 54 Cb 0.00 -1.76 -0.02 0.00 0.01 0.00 0.00 72.50 70.73 2dia s THR 54 CO 0.00 0.45 1.17 -0.54 -0.69 0.00 0.00 174.62 175.00 2dia s LYS 55 N 1.34 4.33 0.34 4.92 1.02 -1.26 -2.16 119.74 128.27 2dia s LYS 55 Ca 0.04 1.59 -0.03 0.00 0.02 0.00 0.00 55.97 57.59 2dia s LYS 55 Cb -0.14 -3.61 -0.04 0.00 -0.52 0.00 0.00 37.83 33.52 2dia s LYS 55 CO -0.11 -0.51 0.59 0.00 -0.92 0.00 0.00 175.35 174.40 2dia s ALA 56 N 2.59 3.61 -0.34 5.17 0.00 -0.99 -4.97 121.76 126.83 2dia s ALA 56 Ca 0.53 -0.68 -0.28 0.00 0.00 0.00 0.00 51.96 51.52 2dia s ALA 56 Cb -0.22 -2.28 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 2dia s ALA 56 CO 0.18 0.04 1.81 -2.00 0.00 0.00 0.00 175.76 175.79 2dia s GLU 57 N -4.05 3.29 0.01 0.00 2.12 -1.23 -4.71 118.70 114.12 2dia s GLU 57 Ca 0.43 1.40 0.06 0.00 0.36 0.00 0.00 54.97 57.23 2dia s GLU 57 Cb -0.10 -4.21 -0.03 0.00 0.26 0.00 0.00 34.13 30.05 2dia s GLU 57 CO 0.35 -1.91 -0.19 0.08 -0.54 0.00 0.00 175.26 173.05 2dia s VAL 58 N 7.05 2.71 -0.02 3.70 1.01 -1.26 -1.78 120.40 131.80 2dia s VAL 58 Ca 0.80 -1.05 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 2dia s VAL 58 Cb -0.22 -2.08 0.02 0.00 0.00 0.00 0.00 36.38 34.09 2dia s VAL 58 CO 0.33 0.45 0.24 -0.55 0.00 0.00 0.00 175.10 175.58 2dia s SER 59 N -1.09 -0.13 0.02 3.32 0.15 -0.98 -5.01 113.70 109.98 2dia s SER 59 Ca 0.13 0.06 0.06 0.00 0.70 0.00 0.00 55.95 56.90 2dia s SER 59 Cb -0.10 0.32 -0.02 0.00 -1.71 0.00 0.00 66.02 64.50 2dia s SER 59 CO 0.03 -0.36 -0.18 -0.63 1.20 0.00 0.00 173.24 173.29 2dia s ILE 60 N -1.11 1.46 -0.11 6.45 1.01 -1.26 -2.04 121.20 125.60 2dia s ILE 60 Ca -0.12 -0.99 -0.02 0.00 0.00 0.00 0.00 60.65 59.52 2dia s ILE 60 Cb -0.05 -1.26 0.04 0.00 0.01 0.00 0.00 42.46 41.20 2dia s ILE 60 CO 0.03 0.24 0.03 -1.58 0.00 0.00 0.00 174.94 173.66 2dia s GLN 61 N -0.87 0.48 0.70 2.79 0.74 -1.05 -4.94 119.66 117.51 2dia s GLN 61 Ca 0.06 -0.01 -0.11 0.00 0.05 0.00 0.00 55.36 55.36 2dia s GLN 61 Cb -0.08 -1.28 0.01 0.00 1.10 0.00 0.00 33.01 32.76 2dia s GLN 61 CO 0.01 -0.43 1.06 0.54 -0.55 0.00 0.00 175.29 175.92 2dia s ASN 62 N 1.99 5.37 0.19 6.67 2.20 -1.26 -0.24 114.94 129.85 2dia s ASN 62 Ca 0.03 1.61 -0.01 0.00 -0.94 0.00 0.00 52.86 53.55 2dia s ASN 62 Cb -0.14 -2.48 -0.04 0.00 -2.00 0.00 0.00 41.25 36.59 2dia s ASN 62 CO -0.06 -1.45 0.11 0.20 -2.94 0.00 0.00 177.10 172.96 2dia s ASN 63 N -3.80 0.33 0.44 3.54 0.01 -0.17 -4.89 114.94 110.39 2dia s ASN 63 Ca 0.58 -1.34 0.20 0.00 -0.71 0.00 0.00 52.86 51.59 2dia s ASN 63 Cb -0.14 0.33 1.01 0.00 0.41 0.00 0.00 41.25 42.86 2dia s ASN 63 CO 0.55 -0.79 1.91 0.11 -1.51 0.00 0.00 177.10 177.36 2dia h LYS 64 N 2.65 0.00 -1.78 -0.60 1.57 -1.98 -2.99 116.57 113.44 2dia h LYS 64 Ca -0.36 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.33 2dia h LYS 64 Cb 1.24 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.51 2dia h LYS 64 CO 0.55 0.26 0.12 -3.47 -0.57 0.00 0.00 179.45 176.34 2dia n ASP 65 N -3.75 5.45 -4.07 0.86 2.03 -1.26 -4.78 116.55 111.02 2dia n ASP 65 Ca -0.01 -2.57 -0.34 0.00 0.52 0.00 0.00 54.79 52.38 2dia n ASP 65 Cb 0.36 -1.06 -0.06 0.00 -0.72 0.00 0.00 41.12 39.64 2dia n ASP 65 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2dia n GLY 66 N 1.08 -0.39 3.50 0.27 0.00 -1.13 -4.79 105.19 103.73 2dia n GLY 66 Ca 0.09 0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.93 1.77 -0.03 2.61 -4.23 -1.25 -0.84 115.64 110.73 2dia s THR 67 Ca 0.67 -2.09 0.02 0.00 -1.18 0.00 0.00 61.69 59.11 2dia s THR 67 Cb -0.39 -2.69 0.01 0.00 1.34 0.00 0.00 72.50 70.77 2dia s THR 67 CO 0.82 -0.15 -0.06 -0.31 -0.54 0.00 0.00 174.62 174.38 2dia s TYR 68 N -2.91 0.75 -0.69 3.99 1.51 -0.37 -1.00 117.35 118.63 2dia s TYR 68 Ca 0.33 -0.19 -0.15 0.00 -1.01 0.00 0.00 57.07 56.04 2dia s TYR 68 Cb 0.06 -0.60 0.17 0.00 -0.11 0.00 0.00 41.96 41.48 2dia s TYR 68 CO 0.15 -0.13 0.66 0.00 -1.11 0.00 0.00 175.55 175.12 2dia s ALA 69 N 0.53 3.83 0.08 3.71 0.00 0.66 -1.52 121.76 129.05 2dia s ALA 69 Ca -0.07 -2.89 -0.14 0.00 0.00 0.00 0.00 51.96 48.86 2dia s ALA 69 Cb -0.11 -3.43 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 2dia s ALA 69 CO 0.00 -2.20 0.47 0.08 0.00 0.00 0.00 175.76 174.12 2dia s VAL 70 N 1.04 4.96 0.01 0.00 1.01 -0.37 -2.51 120.40 124.54 2dia s VAL 70 Ca 0.12 0.76 -0.08 0.00 0.00 0.00 0.00 61.98 62.78 2dia s VAL 70 Cb -0.19 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.47 2dia s VAL 70 CO -0.03 0.38 0.15 -0.89 0.00 0.00 0.00 175.10 174.71 2dia s THR 71 N -1.31 0.09 -0.04 3.92 2.01 -0.87 -1.29 115.64 118.16 2dia s THR 71 Ca 0.32 -0.78 -0.02 0.00 0.31 0.00 0.00 61.69 61.52 2dia s THR 71 Cb -0.16 -0.60 0.03 0.00 0.01 0.00 0.00 72.50 71.79 2dia s THR 71 CO 0.17 -0.43 0.10 -0.72 -0.69 0.00 0.00 174.62 173.05 2dia s TYR 72 N -1.78 -0.09 -0.40 4.92 -0.85 -1.24 -2.32 117.35 115.59 2dia s TYR 72 Ca -0.12 0.32 -0.04 0.00 -0.52 0.00 0.00 57.07 56.72 2dia s TYR 72 Cb -0.05 -0.12 0.10 0.00 0.38 0.00 0.00 41.96 42.27 2dia s TYR 72 CO -0.00 -0.12 0.20 0.08 -1.52 0.00 0.00 175.55 174.19 2dia s VAL 73 N 0.98 3.42 -0.06 -3.49 1.01 -0.74 -1.26 120.40 120.27 2dia s VAL 73 Ca -0.08 -1.91 -0.30 0.00 0.00 0.00 0.00 61.98 59.69 2dia s VAL 73 Cb -0.10 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 2dia s VAL 73 CO -0.04 -0.63 1.49 -2.16 0.00 0.00 0.00 175.10 173.76 2dia s PRO 74 N 1.20 4.22 0.07 2.72 0.04 -1.26 -3.50 135.00 138.49 2dia s PRO 74 Ca 0.06 2.01 0.07 0.00 0.04 0.00 0.00 61.00 63.19 2dia s PRO 74 Cb -0.23 -3.80 -0.22 0.00 0.04 0.00 0.00 34.50 30.29 2dia s PRO 74 CO -0.03 -0.73 1.08 -0.07 0.04 0.00 0.00 177.00 177.29 2dia h LEU 75 N 9.50 0.04 -8.15 -3.56 3.38 -1.93 -0.69 115.31 113.90 2dia h LEU 75 Ca -0.36 -0.05 -0.56 0.00 0.09 0.00 0.00 57.88 56.99 2dia h LEU 75 Cb 1.16 -0.01 -0.32 0.00 0.09 0.00 0.00 40.66 41.57 2dia h LEU 75 CO 0.94 1.04 -0.84 0.28 0.09 0.00 0.00 178.44 179.96 2dia s THR 76 N -2.67 1.42 0.85 0.22 -1.32 -1.26 -4.82 115.64 108.07 2dia s THR 76 Ca -0.01 -0.68 -0.10 0.00 -1.21 0.00 0.00 61.69 59.69 2dia s THR 76 Cb 0.09 -1.25 0.11 0.00 -1.51 0.00 0.00 72.50 69.94 2dia s THR 76 CO 0.83 0.42 1.12 0.00 -2.21 0.00 0.00 174.62 174.77 2dia s ALA 77 N 0.33 1.81 0.00 11.08 0.00 -1.26 -4.92 121.76 128.80 2dia s ALA 77 Ca -0.11 0.41 0.00 0.00 0.00 0.00 0.00 51.96 52.26 2dia s ALA 77 Cb -0.14 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.62 2dia s ALA 77 CO 0.04 -2.30 0.00 0.41 0.00 0.00 0.00 175.76 173.91 2dia n GLY 78 N -0.49 0.78 3.74 0.00 0.00 -0.94 -5.01 105.19 103.26 2dia n GLY 78 Ca 0.10 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.59 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 -1.00 4.49 0.17 1.61 -1.94 -1.26 -1.81 119.30 119.56 2dia s MET 79 Ca 0.00 1.85 0.11 0.00 -1.71 0.00 0.00 55.69 55.94 2dia s MET 79 Cb 0.00 -3.25 -0.04 0.00 2.01 0.00 0.00 34.83 33.54 2dia s MET 79 CO 0.00 -0.09 -0.24 0.71 -0.01 0.00 0.00 175.02 175.39 2dia s TYR 80 N 0.03 2.33 -0.42 -0.03 1.51 -1.03 -2.03 117.35 117.72 2dia s TYR 80 Ca 0.53 -0.35 0.04 0.00 -1.01 0.00 0.00 57.07 56.28 2dia s TYR 80 Cb -0.32 -1.19 0.11 0.00 -0.11 0.00 0.00 41.96 40.45 2dia s TYR 80 CO 0.36 0.45 0.15 0.99 -1.11 0.00 0.00 175.55 176.39 2dia s THR 81 N -1.48 2.36 0.08 -0.71 2.01 0.06 -2.66 115.64 115.30 2dia s THR 81 Ca 0.19 -2.76 -0.31 0.00 0.31 0.00 0.00 61.69 59.13 2dia s THR 81 Cb -0.09 -2.70 -0.06 0.00 0.01 0.00 0.00 72.50 69.67 2dia s THR 81 CO 0.09 -0.70 1.21 -0.76 -0.69 0.00 0.00 174.62 173.78 2dia s LEU 82 N 0.38 4.38 -0.27 4.42 1.43 -1.16 -3.41 118.68 124.45 2dia s LEU 82 Ca 0.14 2.05 -0.00 0.00 -1.03 0.00 0.00 54.13 55.29 2dia s LEU 82 Cb -0.22 -3.58 0.08 0.00 0.03 0.00 0.00 46.19 42.50 2dia s LEU 82 CO -0.05 -0.47 0.04 -0.89 0.23 0.00 0.00 176.35 175.21 2dia s THR 83 N 0.97 1.13 -0.15 5.49 2.01 -1.00 -2.07 115.64 122.03 2dia s THR 83 Ca 0.59 -1.31 -0.05 0.00 0.31 0.00 0.00 61.69 61.23 2dia s THR 83 Cb -0.30 -1.70 -0.03 0.00 0.01 0.00 0.00 72.50 70.47 2dia s THR 83 CO 0.30 -0.44 0.01 -0.32 -0.69 0.00 0.00 174.62 173.48 2dia s MET 84 N 1.52 3.59 -0.08 4.92 0.00 -1.26 0.56 119.30 128.55 2dia s MET 84 Ca 0.04 -0.42 -0.01 0.00 0.00 0.00 0.00 55.69 55.31 2dia s MET 84 Cb -0.18 -2.99 0.03 0.00 0.00 0.00 0.00 34.83 31.69 2dia s MET 84 CO -0.15 0.39 -0.04 0.15 0.00 0.00 0.00 175.02 175.37 2dia s LYS 85 N 0.00 1.03 -0.33 4.11 1.02 0.09 -2.96 119.74 122.70 2dia s LYS 85 Ca 0.03 -0.07 -0.12 0.00 0.02 0.00 0.00 55.97 55.84 2dia s LYS 85 Cb -0.13 -1.22 -0.01 0.00 -0.52 0.00 0.00 37.83 35.96 2dia s LYS 85 CO 0.02 -0.26 0.21 -0.47 -0.92 0.00 0.00 175.35 173.93 2dia s TYR 86 N 1.73 3.21 0.00 3.18 5.04 0.41 -2.44 117.35 128.48 2dia s TYR 86 Ca 0.03 -0.38 0.00 0.00 -2.44 0.00 0.00 57.07 54.28 2dia s TYR 86 Cb -0.13 -2.43 0.00 0.00 0.35 0.00 0.00 41.96 39.75 2dia s TYR 86 CO -0.06 -0.41 0.00 0.41 -1.34 0.00 0.00 175.55 174.15 2dia n GLY 87 N 5.06 0.82 0.00 8.97 0.00 -0.06 -2.07 105.19 117.91 2dia n GLY 87 Ca -0.13 0.00 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 -2.00 1.23 3.21 -0.02 0.00 -1.26 -4.85 105.19 101.49 2dia n GLY 88 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 1.68 0.60 1.61 0.41 -0.88 -5.06 118.70 117.00 2dia s GLU 89 Ca 0.00 -0.72 -0.20 0.00 -0.41 0.00 0.00 54.97 53.65 2dia s GLU 89 Cb 0.00 -1.60 -0.03 0.00 -1.78 0.00 0.00 34.13 30.72 2dia s GLU 89 CO 0.00 0.42 1.32 -0.51 -0.49 0.00 0.00 175.26 176.00 2dia s LEU 90 N -0.43 3.69 0.33 1.80 1.43 -1.26 -0.44 118.68 123.80 2dia s LEU 90 Ca 0.07 2.69 0.03 0.00 -1.03 0.00 0.00 54.13 55.89 2dia s LEU 90 Cb -0.08 -4.47 -0.02 0.00 0.03 0.00 0.00 46.19 41.65 2dia s LEU 90 CO -0.00 -1.83 0.50 0.68 0.23 0.00 0.00 176.35 175.93 2dia s VAL 91 N -1.35 4.65 -2.00 -1.59 -7.23 -1.16 -4.79 120.40 106.93 2dia s VAL 91 Ca 0.78 -0.76 0.09 0.00 -1.81 0.00 0.00 61.98 60.28 2dia s VAL 91 Cb -0.39 -3.66 0.25 0.00 0.56 0.00 0.00 36.38 33.14 2dia s VAL 91 CO 0.43 -0.34 0.98 -0.81 -0.31 0.00 0.00 175.10 175.04 2dia n PRO 92 N -1.70 0.49 -0.15 4.82 -0.04 -1.26 -1.99 135.00 135.17 2dia n PRO 92 Ca -0.03 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.51 2dia n PRO 92 Cb 0.57 -1.28 0.13 0.00 -0.04 0.00 0.00 33.50 32.87 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 -0.78 0.00 -3.55 0.54 8.25 -1.26 -5.04 115.22 113.38 2dia n HIS 93 Ca 0.07 -0.91 -0.15 0.00 -0.26 0.00 0.00 57.72 56.46 2dia n HIS 93 Cb 0.03 -0.14 -0.05 0.00 1.12 0.00 0.00 29.99 30.94 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 -2.57 -0.53 0.67 4.41 0.40 -0.84 -4.26 117.98 115.26 2dia s PHE 94 Ca 0.29 0.74 -0.14 0.00 -0.60 0.00 0.00 56.93 57.21 2dia s PHE 94 Cb 0.25 0.38 0.01 0.00 0.51 0.00 0.00 43.02 44.17 2dia s PHE 94 CO 0.02 -0.63 1.11 -1.25 0.70 0.00 0.00 175.22 175.17 2dia s PRO 95 N -1.94 2.73 -0.20 0.24 0.04 -1.26 -4.42 135.00 130.20 2dia s PRO 95 Ca -0.08 1.36 -0.03 0.00 0.04 0.00 0.00 61.00 62.30 2dia s PRO 95 Cb -0.01 -1.94 0.06 0.00 0.04 0.00 0.00 34.50 32.65 2dia s PRO 95 CO 0.03 -1.30 0.04 0.00 0.04 0.00 0.00 177.00 175.81 2dia s ALA 96 N -2.41 1.02 0.36 8.56 0.00 -0.88 -4.97 121.76 123.44 2dia s ALA 96 Ca 0.66 -0.77 -0.27 0.00 0.00 0.00 0.00 51.96 51.59 2dia s ALA 96 Cb -0.20 -1.21 -0.09 0.00 0.00 0.00 0.00 23.12 21.61 2dia s ALA 96 CO 0.43 -1.23 1.14 -0.98 0.00 0.00 0.00 175.76 175.13 2dia s ARG 97 N 1.85 4.28 -0.13 0.00 1.04 -1.26 -2.97 118.95 121.77 2dia s ARG 97 Ca 0.00 1.81 -0.05 0.00 -1.04 0.00 0.00 55.73 56.45 2dia s ARG 97 Cb -0.17 -2.85 0.06 0.00 -2.04 0.00 0.00 34.95 29.96 2dia s ARG 97 CO -0.10 -0.11 0.27 0.08 -0.04 0.00 0.00 175.30 175.39 2dia s VAL 98 N -1.35 -0.41 -0.31 4.99 1.01 -1.09 -4.92 120.40 118.31 2dia s VAL 98 Ca 0.52 0.27 -0.29 0.00 0.00 0.00 0.00 61.98 62.49 2dia s VAL 98 Cb -0.31 -0.45 0.00 0.00 0.00 0.00 0.00 36.38 35.63 2dia s VAL 98 CO 0.39 0.11 1.29 -0.75 0.00 0.00 0.00 175.10 176.14 2dia s LYS 99 N 2.39 3.90 -0.09 2.72 2.20 -1.26 -2.47 119.74 127.13 2dia s LYS 99 Ca 0.01 1.19 -0.15 0.00 -0.36 0.00 0.00 55.97 56.65 2dia s LYS 99 Cb -0.12 -3.88 -0.05 0.00 -1.51 0.00 0.00 37.83 32.27 2dia s LYS 99 CO -0.09 -1.14 0.38 0.08 -0.36 0.00 0.00 175.35 174.23 2dia s VAL 100 N 4.39 5.18 0.25 4.02 1.01 -0.75 -3.55 120.40 130.95 2dia s VAL 100 Ca 0.55 0.76 0.01 0.00 0.00 0.00 0.00 61.98 63.31 2dia s VAL 100 Cb -0.16 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 2dia s VAL 100 CO 0.23 0.45 0.43 -1.61 0.00 0.00 0.00 175.10 174.61 2dia s GLU 101 N -0.12 3.50 0.59 2.72 0.41 0.63 -2.22 118.70 124.20 2dia s GLU 101 Ca 0.22 -0.42 -0.18 0.00 -0.41 0.00 0.00 54.97 54.19 2dia s GLU 101 Cb -0.15 -2.79 -0.03 0.00 -1.78 0.00 0.00 34.13 29.37 2dia s GLU 101 CO 0.09 0.33 1.12 -1.25 -0.49 0.00 0.00 175.26 175.06 2dia s PRO 102 N -3.75 3.12 -0.33 0.39 0.04 -1.26 -1.93 135.00 131.28 2dia s PRO 102 Ca 0.38 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.94 2dia s PRO 102 Cb -0.10 -1.98 0.29 0.00 0.04 0.00 0.00 34.50 32.75 2dia s PRO 102 CO 0.31 -1.02 1.84 0.00 0.04 0.00 0.00 177.00 178.18 2dia n ALA 103 N -1.78 4.93 -2.13 8.56 0.00 -1.26 -4.72 120.51 124.11 2dia n ALA 103 Ca 0.11 -1.82 -0.43 0.00 0.00 0.00 0.00 53.44 51.30 2dia n ALA 103 Cb 0.51 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.57 2dia n ALA 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2dia s VAL 104 N -2.39 3.70 0.02 0.00 -7.23 -1.26 -4.99 120.40 108.24 2dia s VAL 104 Ca 0.35 0.77 -0.10 0.00 -1.81 0.00 0.00 61.98 61.18 2dia s VAL 104 Cb 0.28 -3.76 -0.05 0.00 0.56 0.00 0.00 36.38 33.40 2dia s VAL 104 CO 0.02 -0.36 0.35 -1.81 -0.31 0.00 0.00 175.10 172.98 2dia s ASP 105 N 4.46 6.64 -0.14 4.85 1.11 -1.26 -5.02 116.67 127.31 2dia s ASP 105 Ca 0.71 0.76 -0.12 0.00 0.18 0.00 0.00 52.55 54.08 2dia s ASP 105 Cb -0.23 -2.17 -0.06 0.00 1.07 0.00 0.00 42.92 41.53 2dia s ASP 105 CO 0.30 0.27 -0.26 0.41 1.18 0.00 0.00 175.17 177.06 2dia n THR 106 N 1.37 1.34 -2.53 -1.27 -1.04 -1.26 -4.80 114.28 106.09 2dia n THR 106 Ca -0.12 0.05 -0.42 0.00 -2.04 0.00 0.00 64.05 61.53 2dia n THR 106 Cb 0.53 -2.04 -0.01 0.00 -1.82 0.00 0.00 70.33 66.99 2dia n THR 106 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2dia s SER 107 N -6.22 6.65 -0.11 8.00 0.15 -1.26 -4.74 113.70 116.16 2dia s SER 107 Ca -0.24 -2.25 -0.12 0.00 0.70 0.00 0.00 55.95 54.04 2dia s SER 107 Cb 0.06 -2.58 -0.10 0.00 -1.71 0.00 0.00 66.02 61.68 2dia s SER 107 CO 0.33 -1.37 0.33 0.28 1.20 0.00 0.00 173.24 174.01 2dia h SER 108 N 8.04 -0.02 -3.77 5.45 0.02 -2.04 -3.51 113.55 117.73 2dia h SER 108 Ca 0.40 -0.37 0.22 0.00 -0.84 0.00 0.00 61.79 61.20 2dia h SER 108 Cb 0.89 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.32 2dia h SER 108 CO 1.44 0.66 -0.79 0.61 -1.14 0.00 0.00 176.83 177.61 2dia n GLY 109 N 1.64 -3.08 3.69 -3.77 0.00 -1.26 -4.80 105.19 97.60 2dia n GLY 109 Ca -0.04 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.36 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 -3.78 4.27 0.13 1.61 0.04 -1.26 -4.97 135.00 131.04 2dia s PRO 110 Ca 0.00 2.02 -0.31 0.00 0.04 0.00 0.00 61.00 62.75 2dia s PRO 110 Cb 0.00 -3.58 -0.09 0.00 0.04 0.00 0.00 34.50 30.87 2dia s PRO 110 CO 0.00 -0.60 1.49 0.45 0.04 0.00 0.00 177.00 178.38 2dia s SER 111 N 1.97 6.70 -0.40 6.66 0.15 -1.26 -4.93 113.70 122.59 2dia s SER 111 Ca 0.65 2.47 0.05 0.00 0.70 0.00 0.00 55.95 59.82 2dia s SER 111 Cb -0.33 -2.59 0.45 0.00 -1.71 0.00 0.00 66.02 61.84 2dia s SER 111 CO 0.27 -0.75 1.34 -1.54 1.20 0.00 0.00 173.24 173.77 2dia n SER 112 N 4.09 5.43 0.00 5.45 3.41 -1.26 -5.33 113.62 125.42 2dia n SER 112 Ca 0.13 -3.75 0.00 0.00 -0.26 0.00 0.00 58.87 54.98 2dia n SER 112 Cb 0.40 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.86 2dia n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49