#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 6.00 -0.93 1.61 1.04 -1.26 -5.00 113.70 115.17 2dia s SER 2 Ca 0.00 -1.98 -0.06 0.00 0.48 0.00 0.00 55.95 54.39 2dia s SER 2 Cb 0.00 -2.11 0.23 0.00 0.10 0.00 0.00 66.02 64.24 2dia s SER 2 CO 0.00 -0.74 0.85 -0.44 0.98 0.00 0.00 173.24 173.89 2dia s SER 3 N 2.95 6.45 -0.01 7.02 0.01 -1.26 -5.04 113.70 123.82 2dia s SER 3 Ca 0.06 -3.45 0.06 0.00 1.31 0.00 0.00 55.95 53.93 2dia s SER 3 Cb -0.26 -2.04 -0.03 0.00 0.21 0.00 0.00 66.02 63.90 2dia s SER 3 CO -0.00 -0.29 -0.18 -0.83 0.41 0.00 0.00 173.24 172.35 2dia s GLY 4 N 0.74 1.49 0.01 3.44 0.00 -1.26 -5.13 107.32 106.62 2dia s GLY 4 Ca 0.26 -1.08 -0.04 0.00 0.00 0.00 0.00 44.72 43.86 2dia s GLY 4 CO -0.09 -0.91 0.07 -1.35 0.00 0.00 0.00 173.10 170.81 2dia s SER 5 N -0.96 0.12 -0.56 1.64 1.04 -1.26 -5.11 113.70 108.61 2dia s SER 5 Ca 0.12 -0.35 -0.28 0.00 0.48 0.00 0.00 55.95 55.92 2dia s SER 5 Cb -0.10 0.16 0.03 0.00 0.10 0.00 0.00 66.02 66.21 2dia s SER 5 CO 0.02 -0.35 1.18 -0.94 0.98 0.00 0.00 173.24 174.13 2dia s SER 6 N -1.48 6.48 0.32 7.02 1.04 -1.26 -5.01 113.70 120.81 2dia s SER 6 Ca -0.15 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.45 2dia s SER 6 Cb -0.08 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.49 2dia s SER 6 CO 0.00 -1.44 0.00 0.61 0.98 0.00 0.00 173.24 173.39 2dia n GLY 7 N 5.03 -1.54 3.77 7.32 0.00 -1.26 -4.98 105.19 113.52 2dia n GLY 7 Ca 0.09 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.96 3.30 0.48 1.61 0.04 -1.26 -4.53 135.00 133.67 2dia s PRO 8 Ca 0.00 1.59 -0.21 0.00 0.04 0.00 0.00 61.00 62.42 2dia s PRO 8 Cb 0.00 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.46 2dia s PRO 8 CO 0.00 -0.89 1.05 0.12 0.04 0.00 0.00 177.00 177.32 2dia s PHE 9 N -1.83 3.01 -0.30 0.56 2.19 -1.26 -3.21 117.98 117.14 2dia s PHE 9 Ca 0.72 1.58 -0.16 0.00 0.33 0.00 0.00 56.93 59.41 2dia s PHE 9 Cb -0.24 -3.10 0.17 0.00 -1.31 0.00 0.00 43.02 38.55 2dia s PHE 9 CO 0.28 -0.87 1.06 -0.51 1.83 0.00 0.00 175.22 177.02 2dia s ASP 10 N -1.89 -0.45 0.46 6.13 1.01 -0.89 -4.86 116.67 116.19 2dia s ASP 10 Ca 0.66 0.58 0.25 0.00 0.71 0.00 0.00 52.55 54.76 2dia s ASP 10 Cb -0.18 1.50 1.07 0.00 1.01 0.00 0.00 42.92 46.32 2dia s ASP 10 CO 0.22 -0.09 1.89 1.55 0.21 0.00 0.00 175.17 178.95 2dia h PRO 11 N 7.44 0.00 -0.09 8.23 0.13 -1.84 -2.91 132.00 142.95 2dia h PRO 11 Ca -0.15 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.87 2dia h PRO 11 Cb 1.12 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 2dia h PRO 11 CO 0.06 0.20 -0.44 0.77 -0.23 0.00 0.00 178.00 178.36 2dia h SER 12 N 0.00 0.23 0.45 1.44 0.02 -1.95 -2.63 113.55 111.11 2dia h SER 12 Ca -0.00 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.83 2dia h SER 12 Cb 0.64 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.11 2dia h SER 12 CO 0.03 0.64 -0.09 0.11 -1.14 0.00 0.00 176.83 176.38 2dia h LYS 13 N 0.18 0.00 -6.52 3.45 1.79 -1.84 -3.43 116.57 110.20 2dia h LYS 13 Ca 0.01 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.95 2dia h LYS 13 Cb 0.84 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 31.51 2dia h LYS 13 CO 0.07 0.09 0.68 0.08 -1.08 0.00 0.00 179.45 179.28 2dia s VAL 14 N -4.07 3.54 -0.25 0.50 1.01 -0.99 -4.02 120.40 116.12 2dia s VAL 14 Ca -0.02 1.10 0.00 0.00 0.00 0.00 0.00 61.98 63.06 2dia s VAL 14 Cb 0.12 -3.70 0.04 0.00 0.00 0.00 0.00 36.38 32.83 2dia s VAL 14 CO 0.55 0.08 -0.09 -0.69 0.00 0.00 0.00 175.10 174.95 2dia s VAL 15 N 1.16 2.57 -0.12 2.92 1.01 -0.73 -4.68 120.40 122.53 2dia s VAL 15 Ca 0.63 -1.22 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 2dia s VAL 15 Cb -0.34 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 2dia s VAL 15 CO 0.30 0.15 -0.08 0.00 0.00 0.00 0.00 175.10 175.47 2dia s ALA 16 N 1.25 2.85 0.32 5.51 0.00 -1.26 0.18 121.76 130.62 2dia s ALA 16 Ca -0.02 -0.87 -0.07 0.00 0.00 0.00 0.00 51.96 51.00 2dia s ALA 16 Cb -0.17 -1.34 0.03 0.00 0.00 0.00 0.00 23.12 21.64 2dia s ALA 16 CO -0.06 0.33 0.55 -1.13 0.00 0.00 0.00 175.76 175.45 2dia n SER 17 N 3.16 -1.58 0.00 0.00 3.41 -0.72 -4.92 113.62 112.97 2dia n SER 17 Ca -0.18 -2.52 0.00 0.00 -0.26 0.00 0.00 58.87 55.91 2dia n SER 17 Cb 0.53 2.76 0.00 0.00 -0.26 0.00 0.00 64.21 67.24 2dia n SER 17 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dia n GLY 18 N -0.48 2.48 0.19 5.00 0.00 -1.26 -0.98 105.19 110.13 2dia n GLY 18 Ca -0.03 -1.97 -0.03 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.49 1.61 0.13 -1.91 -3.07 132.00 128.53 2dia h PRO 19 Ca 0.00 -0.14 0.09 0.00 -0.87 0.00 0.00 66.00 65.08 2dia h PRO 19 Cb 0.00 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.11 2dia h PRO 19 CO 0.00 0.67 0.34 0.78 -0.23 0.00 0.00 178.00 179.56 2dia h GLY 20 N 1.28 0.38 1.25 1.56 0.00 -1.62 0.31 103.07 106.23 2dia h GLY 20 Ca 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2dia h GLY 20 CO 0.07 0.07 -0.05 1.04 0.00 0.00 0.00 176.54 177.68 2dia n LEU 21 N -4.46 0.20 -0.10 3.11 4.77 -1.16 -3.58 117.00 115.77 2dia n LEU 21 Ca 0.08 0.15 -0.13 0.00 -0.03 0.00 0.00 56.01 56.08 2dia n LEU 21 Cb 0.36 -0.22 -0.12 0.00 -2.33 0.00 0.00 43.42 41.11 2dia n LEU 21 CO 0.35 0.04 -1.17 -0.62 -1.33 0.00 0.00 177.39 174.66 2dia n GLU 22 N -1.13 0.81 -3.61 3.23 1.02 0.94 -4.84 120.64 117.06 2dia n GLU 22 Ca 0.15 0.07 -0.03 0.00 -0.02 0.00 0.00 57.16 57.33 2dia n GLU 22 Cb 0.25 -1.45 -0.01 0.00 -0.02 0.00 0.00 31.44 30.20 2dia n GLU 22 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 2dia s HIS 23 N -2.44 -0.15 0.21 -0.32 -3.43 -0.19 -4.69 115.29 104.29 2dia s HIS 23 Ca -0.21 0.02 -0.11 0.00 -0.80 0.00 0.00 55.06 53.95 2dia s HIS 23 Cb 0.07 0.55 -0.00 0.00 -1.43 0.00 0.00 32.58 31.77 2dia s HIS 23 CO 0.61 -0.41 0.40 0.20 -2.00 0.00 0.00 174.74 173.54 2dia s GLY 24 N -2.62 0.50 -0.01 -1.38 0.00 -1.21 -4.12 107.32 98.48 2dia s GLY 24 Ca 0.10 -0.85 -0.01 0.00 0.00 0.00 0.00 44.72 43.96 2dia s GLY 24 CO -0.04 -0.70 0.03 1.25 0.00 0.00 0.00 173.10 173.64 2dia s LYS 25 N -3.99 0.10 -0.20 2.90 2.20 -1.26 -1.22 119.74 118.27 2dia s LYS 25 Ca 0.20 -0.06 -0.35 0.00 -0.36 0.00 0.00 55.97 55.41 2dia s LYS 25 Cb 0.01 0.04 -0.12 0.00 -1.51 0.00 0.00 37.83 36.25 2dia s LYS 25 CO 0.05 -0.02 1.98 0.28 -0.36 0.00 0.00 175.35 177.28 2dia n VAL 26 N 2.79 0.42 0.00 4.02 0.31 -0.84 -0.27 118.33 124.78 2dia n VAL 26 Ca -0.14 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.02 2dia n VAL 26 Cb 0.59 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 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 5.06 3.12 3.66 2.92 0.00 -0.17 -4.43 105.19 115.36 2dia n GLY 27 Ca 0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 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 -0.30 -0.72 -0.15 1.61 0.41 0.63 -4.87 118.70 115.31 2dia s GLU 28 Ca 0.00 -0.06 0.02 0.00 -0.41 0.00 0.00 54.97 54.52 2dia s GLU 28 Cb 0.00 -1.65 0.01 0.00 -1.78 0.00 0.00 34.13 30.71 2dia s GLU 28 CO 0.00 -3.38 -0.20 0.00 -0.49 0.00 0.00 175.26 171.18 2dia s ALA 29 N -3.14 2.18 -0.78 5.21 0.00 -1.26 -4.08 121.76 119.88 2dia s ALA 29 Ca 0.71 -1.07 -0.26 0.00 0.00 0.00 0.00 51.96 51.33 2dia s ALA 29 Cb -0.10 -1.03 0.03 0.00 0.00 0.00 0.00 23.12 22.02 2dia s ALA 29 CO 0.56 -0.14 1.38 0.20 0.00 0.00 0.00 175.76 177.75 2dia s GLY 30 N 0.99 0.87 -0.05 0.00 0.00 -0.46 -4.85 107.32 103.83 2dia s GLY 30 Ca -0.03 -1.46 -0.30 0.00 0.00 0.00 0.00 44.72 42.93 2dia s GLY 30 CO -0.05 2.74 1.72 1.08 0.00 0.00 0.00 173.10 178.59 2dia s LEU 31 N 6.00 4.31 -0.05 0.66 1.43 -1.26 -3.53 118.68 126.24 2dia s LEU 31 Ca 0.41 2.28 0.01 0.00 -1.03 0.00 0.00 54.13 55.80 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 0.11 -0.99 -0.07 -0.76 0.23 0.00 0.00 176.35 174.88 2dia s LEU 32 N 4.25 1.47 -0.14 1.79 1.43 -0.01 -2.37 118.68 125.10 2dia s LEU 32 Ca 0.77 -0.17 0.02 0.00 -1.03 0.00 0.00 54.13 53.72 2dia s LEU 32 Cb -0.35 -0.54 0.01 0.00 0.03 0.00 0.00 46.19 45.34 2dia s LEU 32 CO 0.32 -0.02 -0.21 -0.55 0.23 0.00 0.00 176.35 176.12 2dia s SER 33 N 0.76 3.21 -0.35 2.29 0.15 -0.15 -1.08 113.70 118.53 2dia s SER 33 Ca -0.11 -0.57 -0.06 0.00 0.70 0.00 0.00 55.95 55.90 2dia s SER 33 Cb -0.14 -1.46 0.05 0.00 -1.71 0.00 0.00 66.02 62.76 2dia s SER 33 CO 0.01 0.09 0.12 -0.69 1.20 0.00 0.00 173.24 173.97 2dia s VAL 34 N 0.76 3.68 -0.44 4.45 1.01 -0.78 -1.75 120.40 127.33 2dia s VAL 34 Ca -0.08 -1.27 -0.18 0.00 0.00 0.00 0.00 61.98 60.45 2dia s VAL 34 Cb -0.16 -3.14 0.03 0.00 0.00 0.00 0.00 36.38 33.11 2dia s VAL 34 CO -0.00 -0.25 0.48 -0.62 0.00 0.00 0.00 175.10 174.71 2dia s ASP 35 N 1.50 6.21 -0.21 3.32 -1.08 0.13 -2.28 116.67 124.25 2dia s ASP 35 Ca -0.01 -0.73 -0.12 0.00 -0.52 0.00 0.00 52.55 51.17 2dia s ASP 35 Cb -0.20 -2.24 -0.05 0.00 -1.46 0.00 0.00 42.92 38.97 2dia s ASP 35 CO 0.02 -0.65 0.23 0.00 0.52 0.00 0.00 175.17 175.29 2dia n SER 37 N 4.11 0.44 -0.48 0.00 7.64 -1.26 -4.83 113.62 119.24 2dia n SER 37 Ca -0.13 0.07 0.07 0.00 1.01 0.00 0.00 58.87 59.88 2dia n SER 37 Cb 0.52 -0.36 0.18 0.00 -1.01 0.00 0.00 64.21 63.54 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 -2.93 1.63 0.00 1.43 -0.58 -1.26 -4.67 120.64 114.26 2dia n GLU 38 Ca -0.02 -2.94 0.10 0.00 -0.42 0.00 0.00 57.16 53.88 2dia n GLU 38 Cb 0.08 -1.62 0.56 0.00 -0.57 0.00 0.00 31.44 29.89 2dia n GLU 38 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2dia n ALA 39 N -1.19 2.18 -0.68 0.62 0.00 -1.26 -4.16 120.51 116.02 2dia n ALA 39 Ca 0.20 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2dia n ALA 39 Cb 0.73 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.87 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 0.25 0.88 0.00 0.00 0.00 -1.20 -2.10 105.19 103.02 2dia n GLY 40 Ca 0.13 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.39 0.00 1.61 -0.04 -1.26 -4.89 135.00 130.02 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 2.71 3.73 0.55 0.00 -1.26 -4.79 105.19 108.57 2dia n GLY 42 Ca 0.00 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.73 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 -2.94 3.42 0.10 4.61 0.00 -1.26 -4.76 121.76 120.92 2dia s ALA 43 Ca 0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.09 2dia s ALA 43 Cb 0.00 -1.52 -0.05 0.00 0.00 0.00 0.00 23.12 21.55 2dia s ALA 43 CO 0.00 0.63 0.30 -1.17 0.00 0.00 0.00 175.76 175.52 2dia s LEU 44 N -1.26 4.31 -0.08 0.00 2.96 -1.26 -0.77 118.68 122.57 2dia s LEU 44 Ca 0.17 0.47 -0.30 0.00 -0.22 0.00 0.00 54.13 54.24 2dia s LEU 44 Cb -0.12 -3.11 0.08 0.00 0.50 0.00 0.00 46.19 43.54 2dia s LEU 44 CO 0.07 0.12 0.73 -0.83 -1.32 0.00 0.00 176.35 175.12 2dia s GLY 45 N -2.39 -0.53 0.04 7.98 0.00 -0.67 -5.01 107.32 106.74 2dia s GLY 45 Ca 0.37 1.49 0.02 0.00 0.00 0.00 0.00 44.72 46.61 2dia s GLY 45 CO 0.25 1.03 -0.08 -2.27 0.00 0.00 0.00 173.10 172.04 2dia s LEU 46 N -1.06 2.23 -0.17 0.66 2.96 -1.26 -0.54 118.68 121.51 2dia s LEU 46 Ca -0.09 -0.50 -0.02 0.00 -0.22 0.00 0.00 54.13 53.30 2dia s LEU 46 Cb -0.00 -0.19 0.05 0.00 0.50 0.00 0.00 46.19 46.54 2dia s LEU 46 CO 0.08 -0.17 0.02 -0.70 -1.32 0.00 0.00 176.35 174.26 2dia s GLU 47 N -1.42 0.75 -0.20 1.98 2.56 0.14 -4.97 118.70 117.54 2dia s GLU 47 Ca -0.08 -0.36 -0.14 0.00 0.00 0.00 0.00 54.97 54.40 2dia s GLU 47 Cb -0.09 -1.92 -0.04 0.00 2.00 0.00 0.00 34.13 34.08 2dia s GLU 47 CO 0.00 -0.56 0.29 0.00 -0.56 0.00 0.00 175.26 174.44 2dia s ALA 48 N 1.84 3.59 -0.08 6.30 0.00 -1.26 -1.73 121.76 130.41 2dia s ALA 48 Ca 0.00 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.30 2dia s ALA 48 Cb -0.16 -2.47 0.04 0.00 0.00 0.00 0.00 23.12 20.53 2dia s ALA 48 CO -0.07 -0.16 0.18 0.08 0.00 0.00 0.00 175.76 175.79 2dia s VAL 49 N 1.01 -0.11 0.45 0.00 1.01 -1.22 -2.49 120.40 119.06 2dia s VAL 49 Ca 0.15 0.21 -0.08 0.00 0.00 0.00 0.00 61.98 62.25 2dia s VAL 49 Cb -0.14 -0.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 2dia s VAL 49 CO 0.06 0.09 0.80 -0.55 0.00 0.00 0.00 175.10 175.49 2dia s SER 50 N 1.49 6.39 0.55 3.32 0.15 -0.76 -0.43 113.70 124.41 2dia s SER 50 Ca -0.06 1.07 0.39 0.00 0.70 0.00 0.00 55.95 58.04 2dia s SER 50 Cb -0.11 -2.30 1.58 0.00 -1.71 0.00 0.00 66.02 63.48 2dia s SER 50 CO -0.07 -0.51 1.77 -0.78 1.20 0.00 0.00 173.24 174.85 2dia h ASP 51 N 0.71 0.00 -0.49 5.45 1.82 -1.57 1.17 116.42 123.52 2dia h ASP 51 Ca -0.47 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 55.97 2dia h ASP 51 Cb 1.19 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 41.08 2dia h ASP 51 CO 0.63 0.00 0.26 -1.20 -1.61 0.00 0.00 179.24 177.32 2dia n SER 52 N -4.13 3.48 -3.63 2.28 7.64 -1.26 -4.89 113.62 113.11 2dia n SER 52 Ca 0.28 -2.78 -0.26 0.00 1.01 0.00 0.00 58.87 57.12 2dia n SER 52 Cb 1.37 -0.66 0.04 0.00 -1.01 0.00 0.00 64.21 63.95 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 -0.20 -0.81 3.19 0.23 0.00 0.40 -4.97 105.19 103.03 2dia n GLY 53 Ca 0.28 0.38 -0.35 0.00 0.00 0.00 0.00 46.02 46.34 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 -3.54 2.92 -0.36 2.61 2.01 -1.19 -4.85 115.64 113.24 2dia s THR 54 Ca 0.34 -1.17 -0.29 0.00 0.31 0.00 0.00 61.69 60.88 2dia s THR 54 Cb -0.10 -2.56 0.02 0.00 0.01 0.00 0.00 72.50 69.86 2dia s THR 54 CO 0.83 0.08 1.16 -0.54 -0.69 0.00 0.00 174.62 175.46 2dia s LYS 55 N 1.30 3.93 0.27 4.92 1.02 -1.26 -1.84 119.74 128.08 2dia s LYS 55 Ca -0.02 0.98 -0.12 0.00 0.02 0.00 0.00 55.97 56.83 2dia s LYS 55 Cb -0.18 -3.82 -0.08 0.00 -0.52 0.00 0.00 37.83 33.23 2dia s LYS 55 CO -0.03 -1.10 0.63 0.00 -0.92 0.00 0.00 175.35 173.93 2dia s ALA 56 N 4.09 3.46 -0.01 5.17 0.00 -1.04 -4.95 121.76 128.48 2dia s ALA 56 Ca 0.49 -0.15 -0.30 0.00 0.00 0.00 0.00 51.96 52.01 2dia s ALA 56 Cb -0.12 -2.58 -0.06 0.00 0.00 0.00 0.00 23.12 20.36 2dia s ALA 56 CO 0.22 0.42 1.56 -2.00 0.00 0.00 0.00 175.76 175.96 2dia s GLU 57 N -2.92 4.22 0.04 0.00 2.12 -1.24 -4.62 118.70 116.30 2dia s GLU 57 Ca 0.50 2.14 0.06 0.00 0.36 0.00 0.00 54.97 58.03 2dia s GLU 57 Cb -0.11 -3.75 -0.02 0.00 0.26 0.00 0.00 34.13 30.51 2dia s GLU 57 CO 0.20 -0.73 -0.17 0.08 -0.54 0.00 0.00 175.26 174.10 2dia s VAL 58 N 3.16 1.35 0.01 3.70 1.01 -1.26 -1.61 120.40 126.75 2dia s VAL 58 Ca 0.70 -1.09 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 2dia s VAL 58 Cb -0.34 -1.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 2dia s VAL 58 CO 0.29 0.09 0.02 -0.55 0.00 0.00 0.00 175.10 174.94 2dia s SER 59 N -1.17 0.16 -0.10 3.32 0.15 -0.98 -5.01 113.70 110.07 2dia s SER 59 Ca 0.04 -0.37 0.02 0.00 0.70 0.00 0.00 55.95 56.35 2dia s SER 59 Cb -0.08 0.12 0.01 0.00 -1.71 0.00 0.00 66.02 64.36 2dia s SER 59 CO 0.02 -0.29 -0.17 -0.63 1.20 0.00 0.00 173.24 173.36 2dia s ILE 60 N -1.30 1.59 0.02 6.45 1.01 -1.26 -2.59 121.20 125.12 2dia s ILE 60 Ca -0.14 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 59.85 2dia s ILE 60 Cb -0.08 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 40.95 2dia s ILE 60 CO -0.00 0.46 -0.19 -1.58 0.00 0.00 0.00 174.94 173.63 2dia s GLN 61 N 0.73 1.35 0.35 2.79 0.74 -1.10 -4.96 119.66 119.56 2dia s GLN 61 Ca -0.12 -0.80 -0.02 0.00 0.05 0.00 0.00 55.36 54.47 2dia s GLN 61 Cb -0.16 -1.39 -0.04 0.00 1.10 0.00 0.00 33.01 32.52 2dia s GLN 61 CO 0.02 0.36 0.58 1.21 -0.55 0.00 0.00 175.29 176.92 2dia s ASN 62 N -0.88 6.33 0.09 6.67 3.84 -1.26 -0.06 114.94 129.67 2dia s ASN 62 Ca 0.06 0.59 0.03 0.00 0.21 0.00 0.00 52.86 53.76 2dia s ASN 62 Cb -0.08 -2.09 -0.03 0.00 -0.55 0.00 0.00 41.25 38.49 2dia s ASN 62 CO 0.01 -0.30 -0.10 0.20 -2.79 0.00 0.00 177.10 174.12 2dia s ASN 63 N -3.78 1.35 0.12 -4.21 0.01 -0.59 -4.87 114.94 102.98 2dia s ASN 63 Ca 0.42 -0.78 0.14 0.00 -0.71 0.00 0.00 52.86 51.93 2dia s ASN 63 Cb -0.10 0.02 0.63 0.00 0.41 0.00 0.00 41.25 42.20 2dia s ASN 63 CO 0.35 -0.26 1.42 1.17 -1.51 0.00 0.00 177.10 178.28 2dia n LYS 64 N 0.69 0.07 -0.07 -0.60 4.81 -1.26 -1.03 118.16 120.77 2dia n LYS 64 Ca -0.17 0.45 0.11 0.00 -0.87 0.00 0.00 58.31 57.82 2dia n LYS 64 Cb 0.57 -1.68 0.39 0.00 0.02 0.00 0.00 35.03 34.34 2dia n LYS 64 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 2dia n ASP 65 N -1.82 1.61 -0.12 3.14 2.03 -1.26 -4.90 116.55 115.24 2dia n ASP 65 Ca 0.01 -1.68 -0.02 0.00 0.52 0.00 0.00 54.79 53.62 2dia n ASP 65 Cb 0.10 -0.09 -0.01 0.00 -0.72 0.00 0.00 41.12 40.40 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 1.13 0.52 3.91 0.27 0.00 -0.20 -4.96 105.19 105.86 2dia n GLY 66 Ca 0.16 -0.61 -0.22 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.01 2.23 -0.05 2.61 -4.23 -1.25 -4.17 115.64 108.76 2dia s THR 67 Ca 0.00 -1.34 0.03 0.00 -1.18 0.00 0.00 61.69 59.20 2dia s THR 67 Cb 0.00 -2.56 0.01 0.00 1.34 0.00 0.00 72.50 71.28 2dia s THR 67 CO 0.00 0.00 -0.12 -0.31 -0.54 0.00 0.00 174.62 173.65 2dia s TYR 68 N -2.61 1.31 -0.71 3.99 1.51 -0.97 -1.54 117.35 118.34 2dia s TYR 68 Ca 0.45 -0.41 -0.16 0.00 -1.01 0.00 0.00 57.07 55.95 2dia s TYR 68 Cb -0.03 -0.94 0.17 0.00 -0.11 0.00 0.00 41.96 41.05 2dia s TYR 68 CO 0.27 -0.19 0.70 0.00 -1.11 0.00 0.00 175.55 175.23 2dia s ALA 69 N 0.38 3.80 -0.13 3.71 0.00 0.91 -1.87 121.76 128.56 2dia s ALA 69 Ca -0.08 -2.88 -0.16 0.00 0.00 0.00 0.00 51.96 48.85 2dia s ALA 69 Cb -0.12 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.47 2dia s ALA 69 CO 0.02 -2.26 0.38 0.08 0.00 0.00 0.00 175.76 173.99 2dia s VAL 70 N 1.17 5.23 0.05 0.00 1.01 -0.24 -2.71 120.40 124.92 2dia s VAL 70 Ca 0.13 0.75 0.03 0.00 0.00 0.00 0.00 61.98 62.89 2dia s VAL 70 Cb -0.18 -3.72 -0.03 0.00 0.00 0.00 0.00 36.38 32.45 2dia s VAL 70 CO -0.03 0.38 -0.10 -0.89 0.00 0.00 0.00 175.10 174.45 2dia s THR 71 N 0.41 0.75 -0.03 3.92 2.01 -1.07 -0.83 115.64 120.80 2dia s THR 71 Ca 0.21 -1.16 -0.01 0.00 0.31 0.00 0.00 61.69 61.04 2dia s THR 71 Cb -0.14 -0.78 0.03 0.00 0.01 0.00 0.00 72.50 71.62 2dia s THR 71 CO 0.07 -0.32 0.06 -0.72 -0.69 0.00 0.00 174.62 173.02 2dia s TYR 72 N -1.34 -0.02 -0.43 4.92 -0.85 -1.23 -2.32 117.35 116.07 2dia s TYR 72 Ca -0.07 0.23 -0.06 0.00 -0.52 0.00 0.00 57.07 56.65 2dia s TYR 72 Cb -0.10 -0.20 0.11 0.00 0.38 0.00 0.00 41.96 42.15 2dia s TYR 72 CO 0.01 -0.11 0.26 0.08 -1.52 0.00 0.00 175.55 174.27 2dia s VAL 73 N 1.13 3.78 -0.24 -3.49 1.01 -0.64 -1.35 120.40 120.61 2dia s VAL 73 Ca -0.09 -1.84 -0.29 0.00 0.00 0.00 0.00 61.98 59.77 2dia s VAL 73 Cb -0.13 -3.50 -0.02 0.00 0.00 0.00 0.00 36.38 32.73 2dia s VAL 73 CO -0.04 -0.68 1.62 -2.16 0.00 0.00 0.00 175.10 173.84 2dia s PRO 74 N 1.27 3.75 0.23 2.72 0.04 -1.26 -3.60 135.00 138.15 2dia s PRO 74 Ca 0.06 1.61 0.02 0.00 0.04 0.00 0.00 61.00 62.74 2dia s PRO 74 Cb -0.24 -4.05 0.23 0.00 0.04 0.00 0.00 34.50 30.48 2dia s PRO 74 CO -0.02 -1.35 1.55 -0.07 0.04 0.00 0.00 177.00 177.15 2dia h LEU 75 N 11.88 0.37 -8.20 -3.56 3.38 -1.92 -0.42 115.31 116.84 2dia h LEU 75 Ca -0.33 -0.20 -0.48 0.00 0.09 0.00 0.00 57.88 56.95 2dia h LEU 75 Cb 1.15 -0.11 -0.29 0.00 0.09 0.00 0.00 40.66 41.50 2dia h LEU 75 CO 1.01 0.87 -0.81 0.28 0.09 0.00 0.00 178.44 179.87 2dia s THR 76 N -3.86 1.10 0.75 0.22 -1.32 -1.26 -4.73 115.64 106.53 2dia s THR 76 Ca -0.05 -0.59 -0.12 0.00 -1.21 0.00 0.00 61.69 59.71 2dia s THR 76 Cb 0.12 -0.92 0.05 0.00 -1.51 0.00 0.00 72.50 70.23 2dia s THR 76 CO 0.81 0.31 1.11 0.00 -2.21 0.00 0.00 174.62 174.64 2dia s ALA 77 N -0.31 2.24 0.00 11.08 0.00 -1.26 -4.90 121.76 128.61 2dia s ALA 77 Ca 0.05 0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.44 2dia s ALA 77 Cb -0.06 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.74 2dia s ALA 77 CO -0.00 -1.72 0.00 0.41 0.00 0.00 0.00 175.76 174.45 2dia n GLY 78 N -0.73 2.09 3.68 0.00 0.00 -1.07 -5.02 105.19 104.14 2dia n GLY 78 Ca 0.10 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.80 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 -1.51 4.21 0.14 1.61 -1.94 -1.26 -3.13 119.30 117.42 2dia s MET 79 Ca 0.00 2.18 0.05 0.00 -1.71 0.00 0.00 55.69 56.22 2dia s MET 79 Cb 0.00 -3.76 -0.04 0.00 2.01 0.00 0.00 34.83 33.04 2dia s MET 79 CO 0.00 -0.75 0.06 0.71 -0.01 0.00 0.00 175.02 175.03 2dia s TYR 80 N 3.18 3.03 -0.45 -0.03 1.51 -1.00 -1.32 117.35 122.27 2dia s TYR 80 Ca 0.71 -0.04 0.04 0.00 -1.01 0.00 0.00 57.07 56.77 2dia s TYR 80 Cb -0.35 -1.50 0.12 0.00 -0.11 0.00 0.00 41.96 40.12 2dia s TYR 80 CO 0.30 0.51 0.18 0.99 -1.11 0.00 0.00 175.55 176.42 2dia s THR 81 N -1.58 2.38 0.06 -0.71 2.01 0.43 -2.72 115.64 115.51 2dia s THR 81 Ca 0.28 -2.91 -0.31 0.00 0.31 0.00 0.00 61.69 59.07 2dia s THR 81 Cb -0.11 -2.69 -0.06 0.00 0.01 0.00 0.00 72.50 69.65 2dia s THR 81 CO 0.21 -0.73 1.33 -0.76 -0.69 0.00 0.00 174.62 173.97 2dia s LEU 82 N 0.19 4.35 -0.28 4.42 1.43 -1.09 -3.37 118.68 124.34 2dia s LEU 82 Ca 0.15 2.16 0.01 0.00 -1.03 0.00 0.00 54.13 55.42 2dia s LEU 82 Cb -0.23 -3.58 0.08 0.00 0.03 0.00 0.00 46.19 42.49 2dia s LEU 82 CO -0.03 -0.61 0.03 -0.89 0.23 0.00 0.00 176.35 175.07 2dia s THR 83 N 1.46 1.39 -0.02 5.49 2.01 -0.71 -1.90 115.64 123.36 2dia s THR 83 Ca 0.62 -1.48 -0.00 0.00 0.31 0.00 0.00 61.69 61.14 2dia s THR 83 Cb -0.33 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 2dia s THR 83 CO 0.29 -0.42 0.05 -0.32 -0.69 0.00 0.00 174.62 173.53 2dia s MET 84 N 1.40 2.99 -0.08 4.92 0.00 -1.26 0.24 119.30 127.51 2dia s MET 84 Ca 0.04 -0.49 -0.03 0.00 0.00 0.00 0.00 55.69 55.20 2dia s MET 84 Cb -0.18 -2.81 0.04 0.00 0.00 0.00 0.00 34.83 31.88 2dia s MET 84 CO -0.13 0.66 0.16 0.15 0.00 0.00 0.00 175.02 175.85 2dia s LYS 85 N -1.52 0.08 -0.27 4.11 1.02 0.30 -3.51 119.74 119.96 2dia s LYS 85 Ca 0.20 0.46 -0.02 0.00 0.02 0.00 0.00 55.97 56.63 2dia s LYS 85 Cb -0.12 -0.20 0.03 0.00 -0.52 0.00 0.00 37.83 37.02 2dia s LYS 85 CO 0.11 -0.22 -0.03 -0.47 -0.92 0.00 0.00 175.35 173.81 2dia s TYR 86 N 1.62 3.12 -1.16 3.18 5.04 0.26 -1.67 117.35 127.75 2dia s TYR 86 Ca -0.04 -1.58 0.00 0.00 -2.44 0.00 0.00 57.07 53.01 2dia s TYR 86 Cb -0.12 -2.09 0.00 0.00 0.35 0.00 0.00 41.96 40.10 2dia s TYR 86 CO -0.06 -0.73 0.00 0.41 -1.34 0.00 0.00 175.55 173.83 2dia n GLY 87 N 4.68 1.08 1.14 8.97 0.00 0.05 -2.21 105.19 118.91 2dia n GLY 87 Ca -0.15 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.54 0.75 3.12 -0.02 0.00 -1.26 -4.91 105.19 101.33 2dia n GLY 88 Ca -0.11 0.00 -0.27 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 -0.49 1.98 0.65 1.61 2.02 -0.94 -5.10 118.70 118.44 2dia s GLU 89 Ca 0.00 -0.60 -0.18 0.00 0.02 0.00 0.00 54.97 54.22 2dia s GLU 89 Cb 0.00 -1.64 -0.01 0.00 0.10 0.00 0.00 34.13 32.58 2dia s GLU 89 CO 0.00 0.17 1.18 1.28 0.02 0.00 0.00 175.26 177.90 2dia n LEU 90 N 3.42 5.19 -4.96 1.80 4.77 -1.26 -0.57 117.00 125.38 2dia n LEU 90 Ca -0.20 0.79 -0.22 0.00 -0.03 0.00 0.00 56.01 56.36 2dia n LEU 90 Cb 0.53 -1.50 -0.02 0.00 -2.33 0.00 0.00 43.42 40.10 2dia n LEU 90 CO 0.26 -1.34 0.04 0.68 -1.33 0.00 0.00 177.39 175.69 2dia s VAL 91 N -1.49 5.05 -2.00 4.08 -7.23 -1.23 -4.73 120.40 112.85 2dia s VAL 91 Ca 0.80 -0.83 0.10 0.00 -1.81 0.00 0.00 61.98 60.24 2dia s VAL 91 Cb -0.38 -3.80 0.28 0.00 0.56 0.00 0.00 36.38 33.04 2dia s VAL 91 CO 0.43 -0.37 1.04 -0.81 -0.31 0.00 0.00 175.10 175.07 2dia n PRO 92 N -1.56 0.49 -0.07 4.82 -0.04 -1.26 -1.98 135.00 135.40 2dia n PRO 92 Ca -0.07 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.49 2dia n PRO 92 Cb 0.57 -1.32 0.13 0.00 -0.04 0.00 0.00 33.50 32.84 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 -0.82 0.00 -3.50 0.54 8.25 -1.26 -5.03 115.22 113.40 2dia n HIS 93 Ca 0.07 -0.97 -0.16 0.00 -0.26 0.00 0.00 57.72 56.40 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 -2.78 -0.62 0.65 4.41 0.40 -0.84 -4.27 117.98 114.93 2dia s PHE 94 Ca 0.30 0.92 -0.15 0.00 -0.60 0.00 0.00 56.93 57.40 2dia s PHE 94 Cb 0.27 0.44 -0.00 0.00 0.51 0.00 0.00 43.02 44.23 2dia s PHE 94 CO 0.03 -0.67 1.11 -1.25 0.70 0.00 0.00 175.22 175.14 2dia s PRO 95 N -1.83 2.83 -0.13 0.24 0.04 -1.26 -4.38 135.00 130.51 2dia s PRO 95 Ca -0.08 1.40 -0.02 0.00 0.04 0.00 0.00 61.00 62.34 2dia s PRO 95 Cb -0.00 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.63 2dia s PRO 95 CO 0.04 -1.23 0.02 0.00 0.04 0.00 0.00 177.00 175.88 2dia s ALA 96 N -2.31 0.81 0.28 8.56 0.00 -0.80 -4.98 121.76 123.33 2dia s ALA 96 Ca 0.67 -0.38 -0.29 0.00 0.00 0.00 0.00 51.96 51.97 2dia s ALA 96 Cb -0.21 -0.95 -0.09 0.00 0.00 0.00 0.00 23.12 21.87 2dia s ALA 96 CO 0.41 -0.81 1.02 -0.98 0.00 0.00 0.00 175.76 175.40 2dia s ARG 97 N 1.94 4.66 -0.09 0.00 1.04 -1.26 -2.67 118.95 122.56 2dia s ARG 97 Ca 0.02 1.62 -0.04 0.00 -1.04 0.00 0.00 55.73 56.29 2dia s ARG 97 Cb -0.15 -3.11 0.05 0.00 -2.04 0.00 0.00 34.95 29.70 2dia s ARG 97 CO -0.07 0.29 0.21 0.08 -0.04 0.00 0.00 175.30 175.77 2dia s VAL 98 N -1.27 -0.13 -0.15 4.99 1.01 -1.10 -4.96 120.40 118.79 2dia s VAL 98 Ca 0.45 0.21 -0.28 0.00 0.00 0.00 0.00 61.98 62.36 2dia s VAL 98 Cb -0.28 -0.33 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 2dia s VAL 98 CO 0.35 0.09 0.95 -0.75 0.00 0.00 0.00 175.10 175.73 2dia s LYS 99 N 1.54 4.35 -0.14 2.72 2.20 -1.26 -2.38 119.74 126.78 2dia s LYS 99 Ca -0.06 1.25 -0.03 0.00 -0.36 0.00 0.00 55.97 56.76 2dia s LYS 99 Cb -0.11 -3.57 -0.03 0.00 -1.51 0.00 0.00 37.83 32.61 2dia s LYS 99 CO -0.07 -0.37 -0.02 0.08 -0.36 0.00 0.00 175.35 174.61 2dia s VAL 100 N 2.24 4.06 0.39 4.02 1.01 -1.18 -3.33 120.40 127.59 2dia s VAL 100 Ca 0.44 -0.31 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 2dia s VAL 100 Cb -0.17 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 2dia s VAL 100 CO 0.14 0.52 0.62 -1.61 0.00 0.00 0.00 175.10 174.77 2dia s GLU 101 N 0.06 3.51 0.79 2.72 0.41 -0.36 -2.59 118.70 123.24 2dia s GLU 101 Ca 0.01 -0.14 -0.11 0.00 -0.41 0.00 0.00 54.97 54.32 2dia s GLU 101 Cb -0.13 -2.57 0.06 0.00 -1.78 0.00 0.00 34.13 29.71 2dia s GLU 101 CO 0.02 0.04 1.09 -1.25 -0.49 0.00 0.00 175.26 174.68 2dia s PRO 102 N -4.40 2.15 -0.51 0.39 0.04 -1.26 -1.98 135.00 129.43 2dia s PRO 102 Ca 0.43 1.13 -0.01 0.00 0.04 0.00 0.00 61.00 62.59 2dia s PRO 102 Cb -0.10 -1.89 0.38 0.00 0.04 0.00 0.00 34.50 32.94 2dia s PRO 102 CO 0.38 -1.71 1.99 0.00 0.04 0.00 0.00 177.00 177.71 2dia n ALA 103 N -3.56 5.76 -2.70 8.56 0.00 -1.26 -4.64 120.51 122.67 2dia n ALA 103 Ca 0.09 -2.73 -0.41 0.00 0.00 0.00 0.00 53.44 50.39 2dia n ALA 103 Cb 0.53 -1.59 -0.04 0.00 0.00 0.00 0.00 19.45 18.35 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 -3.71 4.91 -0.13 0.00 1.01 -1.26 -5.05 120.40 116.18 2dia s VAL 104 Ca 0.51 1.73 -0.00 0.00 0.00 0.00 0.00 61.98 64.22 2dia s VAL 104 Cb 0.41 -4.18 -0.02 0.00 0.00 0.00 0.00 36.38 32.59 2dia s VAL 104 CO 0.00 0.12 -0.12 -1.81 0.00 0.00 0.00 175.10 173.29 2dia s ASP 105 N 1.01 4.08 0.04 3.32 1.01 -1.26 -5.03 116.67 119.84 2dia s ASP 105 Ca 0.43 -0.30 -0.24 0.00 0.71 0.00 0.00 52.55 53.14 2dia s ASP 105 Cb -0.18 -1.60 -0.17 0.00 1.01 0.00 0.00 42.92 41.98 2dia s ASP 105 CO 0.19 0.17 1.54 0.74 0.21 0.00 0.00 175.17 178.02 2dia h THR 106 N 5.34 1.17 -3.41 -1.27 2.02 -2.04 -3.43 112.91 111.29 2dia h THR 106 Ca -0.27 -0.49 -0.54 0.00 0.77 0.00 0.00 66.41 65.88 2dia h THR 106 Cb 1.21 1.49 -0.03 0.00 -1.74 0.00 0.00 68.15 69.07 2dia h THR 106 CO 0.56 0.13 -0.06 -0.94 0.37 0.00 0.00 175.52 175.58 2dia s SER 107 N -5.41 6.79 0.38 4.18 1.04 -1.26 -5.09 113.70 114.33 2dia s SER 107 Ca -0.14 1.09 0.08 0.00 0.48 0.00 0.00 55.95 57.45 2dia s SER 107 Cb 0.04 -2.29 -0.03 0.00 0.10 0.00 0.00 66.02 63.85 2dia s SER 107 CO 0.67 0.02 0.33 -0.44 0.98 0.00 0.00 173.24 174.80 2dia s SER 108 N -1.93 5.08 0.00 7.02 0.01 -1.26 -5.13 113.70 117.49 2dia s SER 108 Ca 0.42 -0.68 0.00 0.00 1.31 0.00 0.00 55.95 57.01 2dia s SER 108 Cb -0.14 -0.71 0.00 0.00 0.21 0.00 0.00 66.02 65.38 2dia s SER 108 CO 0.20 -0.53 0.00 0.61 0.41 0.00 0.00 173.24 173.93 2dia n GLY 109 N -1.45 3.52 3.58 3.44 0.00 -1.26 -5.11 105.19 107.91 2dia n GLY 109 Ca 0.01 -0.87 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 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 1.11 3.17 -0.22 1.61 0.04 -1.26 -4.98 135.00 134.48 2dia s PRO 110 Ca 0.00 1.10 -0.19 0.00 0.04 0.00 0.00 61.00 61.95 2dia s PRO 110 Cb 0.00 -4.22 -0.03 0.00 0.04 0.00 0.00 34.50 30.29 2dia s PRO 110 CO 0.00 -2.06 0.55 0.45 0.04 0.00 0.00 177.00 175.98 2dia s SER 111 N 6.30 6.55 0.25 6.66 0.15 -1.26 -4.96 113.70 127.39 2dia s SER 111 Ca 0.73 0.66 -0.04 0.00 0.70 0.00 0.00 55.95 58.01 2dia s SER 111 Cb -0.18 -2.30 0.50 0.00 -1.71 0.00 0.00 66.02 62.32 2dia s SER 111 CO 0.30 -0.24 1.70 0.77 1.20 0.00 0.00 173.24 176.96 2dia h SER 112 N 7.66 0.12 0.00 5.45 4.64 -2.09 -3.57 113.55 125.75 2dia h SER 112 Ca -0.31 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 2dia h SER 112 Cb 1.14 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2dia h SER 112 CO 0.74 -0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.31