#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5x s SER 2 N 0.00 -0.55 -0.71 1.61 0.15 -1.26 -5.11 113.70 107.84 1x5x s SER 2 Ca 0.00 0.11 -0.06 0.00 0.70 0.00 0.00 55.95 56.70 1x5x s SER 2 Cb 0.00 0.57 0.18 0.00 -1.71 0.00 0.00 66.02 65.06 1x5x s SER 2 CO 0.00 -0.88 0.56 -0.55 1.20 0.00 0.00 173.24 173.57 1x5x s SER 3 N -2.42 5.76 0.00 5.45 0.15 -1.26 -4.87 113.70 116.51 1x5x s SER 3 Ca -0.01 -2.85 0.00 0.00 0.70 0.00 0.00 55.95 53.79 1x5x s SER 3 Cb -0.01 -1.97 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 1x5x s SER 3 CO -0.08 -0.43 0.00 0.61 1.20 0.00 0.00 173.24 174.54 1x5x n GLY 4 N 3.58 -0.45 3.08 9.45 0.00 -1.26 -5.13 105.19 114.46 1x5x n GLY 4 Ca 0.10 0.10 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 1x5x n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5x s SER 5 N -4.00 0.13 -0.30 1.61 0.01 -1.26 -5.13 113.70 104.76 1x5x s SER 5 Ca 0.00 -0.38 -0.16 0.00 1.31 0.00 0.00 55.95 56.72 1x5x s SER 5 Cb 0.00 0.18 0.18 0.00 0.21 0.00 0.00 66.02 66.59 1x5x s SER 5 CO 0.00 -0.39 1.17 -0.44 0.41 0.00 0.00 173.24 173.99 1x5x s SER 6 N -1.61 -0.12 0.00 2.44 0.01 -1.26 -5.10 113.70 108.06 1x5x s SER 6 Ca -0.12 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.16 1x5x s SER 6 Cb -0.06 1.08 0.00 0.00 0.21 0.00 0.00 66.02 67.24 1x5x s SER 6 CO -0.01 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.23 1x5x n GLY 7 N 5.12 4.03 3.80 3.44 0.00 -1.26 -4.50 105.19 115.83 1x5x n GLY 7 Ca 0.07 -1.08 -0.34 0.00 0.00 0.00 0.00 46.02 44.68 1x5x n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5x s PRO 8 N -2.83 3.67 1.11 1.61 0.04 -1.26 -4.96 135.00 132.38 1x5x s PRO 8 Ca 0.00 1.30 -0.19 0.00 0.04 0.00 0.00 61.00 62.15 1x5x s PRO 8 Cb 0.00 -2.08 0.28 0.00 0.04 0.00 0.00 34.50 32.74 1x5x s PRO 8 CO 0.00 -0.53 0.87 -1.13 0.04 0.00 0.00 177.00 176.25 1x5x n SER 9 N -1.29 -2.54 -4.66 6.66 3.41 -1.26 -4.59 113.62 109.35 1x5x n SER 9 Ca 0.09 -0.97 -0.42 0.00 -0.26 0.00 0.00 58.87 57.31 1x5x n SER 9 Cb 0.53 -0.85 -0.03 0.00 -0.26 0.00 0.00 64.21 63.60 1x5x n SER 9 CO 0.00 0.00 0.00 -0.32 -0.16 0.00 0.00 175.04 174.56 1x5x s MET 10 N -5.00 4.12 0.06 4.33 1.75 -1.26 -4.82 119.30 118.48 1x5x s MET 10 Ca 0.59 2.44 -0.01 0.00 -1.25 0.00 0.00 55.69 57.46 1x5x s MET 10 Cb -0.07 -4.11 0.01 0.00 2.84 0.00 0.00 34.83 33.50 1x5x s MET 10 CO 0.47 -0.96 0.07 -0.35 -0.65 0.00 0.00 175.02 173.59 1x5x n PRO 11 N 7.44 -0.59 -4.00 4.11 -0.04 -1.26 -4.49 135.00 136.17 1x5x n PRO 11 Ca 0.19 -0.10 -0.36 0.00 -0.04 0.00 0.00 63.50 63.19 1x5x n PRO 11 Cb 0.42 -0.08 -0.07 0.00 -0.04 0.00 0.00 33.50 33.72 1x5x n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x5x s ALA 12 N -3.50 3.67 0.39 0.55 0.00 -1.26 -4.80 121.76 116.80 1x5x s ALA 12 Ca 0.04 -0.70 -0.24 0.00 0.00 0.00 0.00 51.96 51.07 1x5x s ALA 12 Cb -0.00 -1.86 -0.13 0.00 0.00 0.00 0.00 23.12 21.13 1x5x s ALA 12 CO 0.03 0.53 0.67 -1.13 0.00 0.00 0.00 175.76 175.85 1x5x n SER 13 N 2.32 -0.33 -4.74 0.00 3.41 -1.26 -4.40 113.62 108.62 1x5x n SER 13 Ca -0.19 0.98 -0.41 0.00 -0.26 0.00 0.00 58.87 58.99 1x5x n SER 13 Cb 0.54 -1.16 -0.04 0.00 -0.26 0.00 0.00 64.21 63.29 1x5x n SER 13 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 1x5x s PRO 14 N -1.60 4.56 0.60 4.33 0.04 -1.26 -4.73 135.00 136.94 1x5x s PRO 14 Ca 0.63 1.75 -0.03 0.00 0.04 0.00 0.00 61.00 63.39 1x5x s PRO 14 Cb -0.63 -3.28 0.12 0.00 0.04 0.00 0.00 34.50 30.76 1x5x s PRO 14 CO 0.58 0.02 0.82 1.33 0.04 0.00 0.00 177.00 179.80 1x5x n VAL 15 N 2.49 0.00 -3.53 -0.36 0.24 0.17 -4.80 118.33 112.54 1x5x n VAL 15 Ca 0.03 -1.13 -0.29 0.00 -2.04 0.00 0.00 64.34 60.91 1x5x n VAL 15 Cb 0.46 -1.12 -0.12 0.00 -1.47 0.00 0.00 33.84 31.59 1x5x n VAL 15 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1x5x s LEU 16 N 0.00 1.72 0.10 1.34 2.96 -1.26 -1.40 118.68 122.14 1x5x s LEU 16 Ca 0.53 -2.63 -0.32 0.00 -0.22 0.00 0.00 54.13 51.49 1x5x s LEU 16 Cb -0.03 -0.63 -0.13 0.00 0.50 0.00 0.00 46.19 45.90 1x5x s LEU 16 CO 0.35 -0.25 1.60 0.71 -1.32 0.00 0.00 176.35 177.45 1x5x h THR 17 N 4.93 0.23 -3.86 3.68 1.35 -1.45 -3.43 112.91 114.37 1x5x h THR 17 Ca 0.11 0.00 -0.38 0.00 -0.55 0.00 0.00 66.41 65.58 1x5x h THR 17 Cb 0.93 0.23 -0.30 0.00 -1.73 0.00 0.00 68.15 67.28 1x5x h THR 17 CO 0.37 0.00 -0.77 -0.54 -0.25 0.00 0.00 175.52 174.33 1x5x s LYS 18 N -5.98 0.71 -0.27 4.72 1.02 -1.18 -5.05 119.74 113.72 1x5x s LYS 18 Ca -0.17 -0.24 -0.04 0.00 0.02 0.00 0.00 55.97 55.54 1x5x s LYS 18 Cb 0.06 -0.69 0.02 0.00 -0.52 0.00 0.00 37.83 36.69 1x5x s LYS 18 CO 0.63 0.11 0.00 0.00 -0.92 0.00 0.00 175.35 175.17 1x5x s ALA 19 N 0.09 2.87 0.43 5.17 0.00 -1.26 -0.47 121.76 128.58 1x5x s ALA 19 Ca -0.01 -1.45 0.01 0.00 0.00 0.00 0.00 51.96 50.51 1x5x s ALA 19 Cb -0.06 -1.89 0.05 0.00 0.00 0.00 0.00 23.12 21.21 1x5x s ALA 19 CO -0.00 -0.85 0.33 0.41 0.00 0.00 0.00 175.76 175.64 1x5x n GLY 20 N 4.76 1.02 0.13 0.00 0.00 0.62 -4.12 105.19 107.60 1x5x n GLY 20 Ca -0.16 -2.03 -0.22 0.00 0.00 0.00 0.00 46.02 43.62 1x5x n GLY 20 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1x5x h ILE 21 N -0.34 0.92 0.00 -0.61 2.04 -1.91 0.50 117.51 118.11 1x5x h ILE 21 Ca -0.11 -2.36 -0.01 0.00 1.00 0.00 0.00 64.86 63.39 1x5x h ILE 21 Cb 0.42 2.60 -0.01 0.00 -0.74 0.00 0.00 36.82 39.09 1x5x h ILE 21 CO 0.12 0.70 -0.24 0.35 0.00 0.00 0.00 178.15 179.09 1x5x n THR 22 N -3.88 1.88 -3.48 -0.27 -2.24 -1.26 -3.12 114.28 101.91 1x5x n THR 22 Ca -0.28 -2.50 -0.14 0.00 -2.27 0.00 0.00 64.05 58.86 1x5x n THR 22 Cb 0.91 -0.17 -0.04 0.00 -2.10 0.00 0.00 70.33 68.93 1x5x n THR 22 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1x5x s TRP 23 N -2.81 -0.55 -0.11 4.78 1.48 -1.26 -2.41 118.94 118.06 1x5x s TRP 23 Ca 0.33 0.60 -0.04 0.00 -1.06 0.00 0.00 56.10 55.94 1x5x s TRP 23 Cb 0.30 0.47 0.05 0.00 -1.16 0.00 0.00 33.47 33.13 1x5x s TRP 23 CO -0.01 -0.73 0.12 -0.51 -4.06 0.00 0.00 176.95 171.75 1x5x s LEU 24 N -2.11 0.10 -0.63 -4.66 1.43 -0.76 -0.27 118.68 111.77 1x5x s LEU 24 Ca -0.04 -0.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.74 1x5x s LEU 24 Cb -0.01 0.03 0.06 0.00 0.03 0.00 0.00 46.19 46.30 1x5x s LEU 24 CO -0.04 -0.29 0.98 -0.44 0.23 0.00 0.00 176.35 176.80 1x5x s SER 25 N 2.22 6.22 0.39 2.29 0.01 0.38 -1.58 113.70 123.63 1x5x s SER 25 Ca 0.04 -0.73 0.01 0.00 1.31 0.00 0.00 55.95 56.58 1x5x s SER 25 Cb -0.14 -2.44 -0.02 0.00 0.21 0.00 0.00 66.02 63.64 1x5x s SER 25 CO -0.07 -1.41 0.59 -0.76 0.41 0.00 0.00 173.24 172.00 1x5x s LEU 26 N 4.18 3.85 -0.23 2.44 1.43 -1.01 -1.17 118.68 128.16 1x5x s LEU 26 Ca 0.26 0.29 -0.03 0.00 -1.03 0.00 0.00 54.13 53.62 1x5x s LEU 26 Cb -0.15 -3.17 0.12 0.00 0.03 0.00 0.00 46.19 43.03 1x5x s LEU 26 CO 0.13 -0.49 0.36 -1.58 0.23 0.00 0.00 176.35 175.01 1x5x s GLN 27 N -4.40 0.32 0.33 1.70 0.74 -0.49 -3.26 119.66 114.60 1x5x s GLN 27 Ca 0.44 0.55 0.09 0.00 0.05 0.00 0.00 55.36 56.49 1x5x s GLN 27 Cb -0.10 -0.48 -0.05 0.00 1.10 0.00 0.00 33.01 33.49 1x5x s GLN 27 CO 0.36 -0.59 0.02 1.67 -0.55 0.00 0.00 175.29 176.20 1x5x s TRP 28 N 2.52 2.58 0.30 1.67 -2.14 -0.96 0.43 118.94 123.35 1x5x s TRP 28 Ca 0.10 -0.39 0.07 0.00 2.66 0.00 0.00 56.10 58.54 1x5x s TRP 28 Cb -0.15 -1.45 -0.06 0.00 -3.10 0.00 0.00 33.47 28.71 1x5x s TRP 28 CO -0.15 0.48 -0.05 -1.12 -2.66 0.00 0.00 176.95 173.46 1x5x s SER 29 N -3.72 2.94 0.98 -2.66 0.01 -1.26 -4.56 113.70 105.42 1x5x s SER 29 Ca 0.35 -1.22 -0.11 0.00 1.31 0.00 0.00 55.95 56.27 1x5x s SER 29 Cb -0.02 -0.20 0.18 0.00 0.21 0.00 0.00 66.02 66.19 1x5x s SER 29 CO 0.20 -0.35 1.09 -1.59 0.41 0.00 0.00 173.24 173.00 1x5x s LYS 30 N -3.72 0.57 0.74 12.44 -2.85 -1.26 -4.04 119.74 121.62 1x5x s LYS 30 Ca 0.31 1.07 -0.11 0.00 -1.00 0.00 0.00 55.97 56.24 1x5x s LYS 30 Cb 0.04 -1.71 0.04 0.00 -2.06 0.00 0.00 37.83 34.14 1x5x s LYS 30 CO 0.13 -2.78 1.08 -1.25 0.10 0.00 0.00 175.35 172.63 1x5x s PRO 31 N -4.70 2.55 0.05 1.78 0.04 -1.26 -4.50 135.00 128.95 1x5x s PRO 31 Ca 0.66 0.81 -0.31 0.00 0.04 0.00 0.00 61.00 62.20 1x5x s PRO 31 Cb -0.21 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.29 1x5x s PRO 31 CO 0.59 -1.34 1.56 -1.12 0.04 0.00 0.00 177.00 176.74 1x5x s SER 32 N -3.84 6.69 -0.29 6.66 0.01 -1.26 -3.90 113.70 117.76 1x5x s SER 32 Ca 0.59 2.36 -0.20 0.00 1.31 0.00 0.00 55.95 60.02 1x5x s SER 32 Cb -0.14 -2.56 0.03 0.00 0.21 0.00 0.00 66.02 63.55 1x5x s SER 32 CO 0.55 -0.83 0.38 0.61 0.41 0.00 0.00 173.24 174.36 1x5x n GLY 33 N 3.87 -0.55 3.69 3.44 0.00 -1.26 -4.88 105.19 109.49 1x5x n GLY 33 Ca 0.15 0.75 -0.32 0.00 0.00 0.00 0.00 46.02 46.59 1x5x n GLY 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x5x s THR 34 N -1.50 2.06 -0.72 2.61 -4.23 -1.25 -4.81 115.64 107.80 1x5x s THR 34 Ca 0.21 0.02 -0.06 0.00 -1.18 0.00 0.00 61.69 60.68 1x5x s THR 34 Cb -0.03 -2.27 -0.12 0.00 1.34 0.00 0.00 72.50 71.42 1x5x s THR 34 CO 0.58 -0.02 2.63 -0.81 -0.54 0.00 0.00 174.62 176.46 1x5x n PRO 35 N -3.69 2.26 -3.26 3.99 -0.04 -1.26 -4.70 135.00 128.30 1x5x n PRO 35 Ca 0.13 -1.35 -0.19 0.00 -0.04 0.00 0.00 63.50 62.04 1x5x n PRO 35 Cb 0.51 -2.30 0.02 0.00 -0.04 0.00 0.00 33.50 31.69 1x5x n PRO 35 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5x n SER 36 N 3.39 -5.80 0.00 3.54 2.88 -1.26 -4.97 113.62 111.41 1x5x n SER 36 Ca 0.48 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.13 1x5x n SER 36 Cb 0.39 -1.52 0.00 0.00 -0.75 0.00 0.00 64.21 62.32 1x5x n SER 36 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1x5x n ASP 37 N 0.59 0.00 -4.89 -3.46 8.00 -1.26 -5.17 116.55 110.35 1x5x n ASP 37 Ca -0.04 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 1x5x n ASP 37 Cb 0.57 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.70 1x5x n ASP 37 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1x5x s GLU 38 N 0.00 3.12 0.00 -1.24 0.41 -1.26 -4.41 118.70 115.32 1x5x s GLU 38 Ca 0.00 0.38 0.00 0.00 -0.41 0.00 0.00 54.97 54.94 1x5x s GLU 38 Cb 0.00 -2.14 0.00 0.00 -1.78 0.00 0.00 34.13 30.21 1x5x s GLU 38 CO 0.00 -0.75 0.00 0.41 -0.49 0.00 0.00 175.26 174.43 1x5x n GLY 39 N -2.76 0.97 3.73 -1.39 0.00 -1.26 -5.07 105.19 99.41 1x5x n GLY 39 Ca 0.05 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1x5x n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5x s ILE 40 N -2.00 2.08 0.30 -0.61 1.01 -1.26 -4.96 121.20 115.75 1x5x s ILE 40 Ca 0.00 0.05 0.10 0.00 0.00 0.00 0.00 60.65 60.80 1x5x s ILE 40 Cb 0.00 -2.92 -0.05 0.00 0.01 0.00 0.00 42.46 39.50 1x5x s ILE 40 CO 0.00 -0.01 -0.09 -0.44 0.00 0.00 0.00 174.94 174.40 1x5x s SER 41 N -1.54 4.00 -0.05 3.58 0.01 -1.21 -4.69 113.70 113.80 1x5x s SER 41 Ca 0.81 -0.94 -0.02 0.00 1.31 0.00 0.00 55.95 57.11 1x5x s SER 41 Cb -0.36 -0.50 0.04 0.00 0.21 0.00 0.00 66.02 65.41 1x5x s SER 41 CO 0.41 -0.06 0.10 -0.31 0.41 0.00 0.00 173.24 173.79 1x5x s TYR 42 N -2.47 -0.08 -0.27 2.43 1.51 -1.14 -2.58 117.35 114.74 1x5x s TYR 42 Ca 0.32 0.37 -0.11 0.00 -1.01 0.00 0.00 57.07 56.64 1x5x s TYR 42 Cb -0.03 -0.19 -0.05 0.00 -0.11 0.00 0.00 41.96 41.57 1x5x s TYR 42 CO 0.17 -0.16 0.19 0.42 -1.11 0.00 0.00 175.55 175.07 1x5x s ILE 43 N 1.39 5.31 -0.36 2.71 1.01 -0.01 -4.12 121.20 127.13 1x5x s ILE 43 Ca -0.06 0.20 -0.22 0.00 0.00 0.00 0.00 60.65 60.56 1x5x s ILE 43 Cb -0.12 -3.53 0.01 0.00 0.01 0.00 0.00 42.46 38.82 1x5x s ILE 43 CO -0.05 0.27 0.72 -0.22 0.00 0.00 0.00 174.94 175.66 1x5x s LEU 44 N 1.62 4.18 0.20 2.97 2.96 -1.23 -2.23 118.68 127.16 1x5x s LEU 44 Ca 0.08 0.29 0.07 0.00 -0.22 0.00 0.00 54.13 54.34 1x5x s LEU 44 Cb -0.15 -2.93 -0.04 0.00 0.50 0.00 0.00 46.19 43.57 1x5x s LEU 44 CO 0.10 -0.67 0.10 -1.61 -1.32 0.00 0.00 176.35 172.95 1x5x s GLU 45 N 2.93 2.70 -0.18 1.98 8.01 -1.04 -2.02 118.70 131.08 1x5x s GLU 45 Ca 0.29 -1.05 -0.09 0.00 0.01 0.00 0.00 54.97 54.12 1x5x s GLU 45 Cb -0.14 -2.49 0.07 0.00 -4.31 0.00 0.00 34.13 27.26 1x5x s GLU 45 CO 0.16 0.44 0.43 1.41 0.01 0.00 0.00 175.26 177.70 1x5x s MET 46 N -3.33 0.39 -0.02 1.61 1.75 -1.18 -2.40 119.30 116.12 1x5x s MET 46 Ca 0.31 0.86 0.06 0.00 -1.25 0.00 0.00 55.69 55.67 1x5x s MET 46 Cb -0.09 0.06 -0.01 0.00 2.84 0.00 0.00 34.83 37.63 1x5x s MET 46 CO 0.22 -0.18 -0.20 -2.00 -0.65 0.00 0.00 175.02 172.22 1x5x s GLU 47 N 1.67 1.71 0.00 4.11 -6.30 -0.88 -3.94 118.70 115.07 1x5x s GLU 47 Ca -0.08 -0.70 0.00 0.00 -2.50 0.00 0.00 54.97 51.69 1x5x s GLU 47 Cb -0.09 -1.59 0.00 0.00 0.00 0.00 0.00 34.13 32.45 1x5x s GLU 47 CO -0.13 0.38 0.00 -1.91 0.02 0.00 0.00 175.26 173.62 1x5x n GLU 48 N 2.74 0.00 -0.16 4.30 4.07 -1.26 -2.99 120.64 127.34 1x5x n GLU 48 Ca -0.16 0.00 -0.19 0.00 -0.06 0.00 0.00 57.16 56.75 1x5x n GLU 48 Cb 0.53 0.00 0.18 0.00 -0.06 0.00 0.00 31.44 32.09 1x5x n GLU 48 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 1x5x n GLU 49 N -0.50 -3.79 -2.07 5.31 2.13 -1.26 -4.87 120.64 115.60 1x5x n GLU 49 Ca 0.00 -0.92 -0.38 0.00 0.66 0.00 0.00 57.16 56.52 1x5x n GLU 49 Cb 0.00 -1.19 0.01 0.00 0.27 0.00 0.00 31.44 30.53 1x5x n GLU 49 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1x5x n THR 50 N -4.76 4.64 -3.08 6.31 5.66 -1.26 -4.98 114.28 116.81 1x5x n THR 50 Ca 0.09 -4.55 -0.33 0.00 -3.05 0.00 0.00 64.05 56.20 1x5x n THR 50 Cb 0.38 -1.57 -0.06 0.00 -1.55 0.00 0.00 70.33 67.52 1x5x n THR 50 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1x5x s SER 51 N -0.58 6.83 -0.68 1.09 1.04 -1.26 -5.00 113.70 115.15 1x5x s SER 51 Ca 0.50 1.36 0.01 0.00 0.48 0.00 0.00 55.95 58.31 1x5x s SER 51 Cb 0.30 -2.41 0.38 0.00 0.10 0.00 0.00 66.02 64.39 1x5x s SER 51 CO -0.23 -0.21 1.58 0.61 0.98 0.00 0.00 173.24 175.97 1x5x n GLY 52 N -0.30 5.77 1.14 7.32 0.00 -1.26 -4.50 105.19 113.36 1x5x n GLY 52 Ca 0.04 -2.62 0.00 0.00 0.00 0.00 0.00 46.02 43.43 1x5x n GLY 52 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1x5x n TYR 53 N -0.46 -0.85 0.00 1.61 4.01 -1.26 -5.17 117.16 115.04 1x5x n TYR 53 Ca 0.46 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.20 1x5x n TYR 53 Cb 0.42 0.29 0.00 0.00 -0.31 0.00 0.00 39.34 39.73 1x5x n TYR 53 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x5x n GLY 54 N -0.29 0.45 3.73 2.72 0.00 -1.26 -5.07 105.19 105.46 1x5x n GLY 54 Ca 0.00 -1.24 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 1x5x n GLY 54 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x5x s PHE 55 N -1.71 3.74 0.06 1.61 0.08 -1.26 -4.83 117.98 115.67 1x5x s PHE 55 Ca 0.00 1.63 0.06 0.00 0.12 0.00 0.00 56.93 58.74 1x5x s PHE 55 Cb 0.00 -2.97 -0.04 0.00 -0.57 0.00 0.00 43.02 39.45 1x5x s PHE 55 CO 0.00 0.18 -0.10 0.15 -0.10 0.00 0.00 175.22 175.36 1x5x s LYS 56 N 0.21 2.28 0.30 0.44 -0.14 -1.25 -4.95 119.74 116.62 1x5x s LYS 56 Ca 0.44 -0.91 -0.29 0.00 -1.36 0.00 0.00 55.97 53.85 1x5x s LYS 56 Cb -0.22 -2.36 -0.09 0.00 -1.68 0.00 0.00 37.83 33.48 1x5x s LYS 56 CO 0.26 0.54 1.07 -1.25 -0.76 0.00 0.00 175.35 175.22 1x5x s PRO 57 N -1.85 4.58 0.00 -1.68 0.04 -1.26 -3.10 135.00 131.72 1x5x s PRO 57 Ca 0.19 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.96 1x5x s PRO 57 Cb -0.11 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.34 1x5x s PRO 57 CO 0.11 0.18 0.00 1.63 0.04 0.00 0.00 177.00 178.96 1x5x n LYS 58 N 1.00 0.00 -4.31 4.56 5.02 -0.86 -5.00 118.16 118.57 1x5x n LYS 58 Ca -0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 1x5x n LYS 58 Cb 0.46 -0.79 -0.10 0.00 -0.02 0.00 0.00 35.03 34.58 1x5x n LYS 58 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1x5x s TYR 59 N -1.96 2.58 -0.46 2.13 5.04 -1.19 -5.01 117.35 118.48 1x5x s TYR 59 Ca 0.00 -0.24 0.06 0.00 -2.44 0.00 0.00 57.07 54.45 1x5x s TYR 59 Cb 0.00 -1.27 0.18 0.00 0.35 0.00 0.00 41.96 41.22 1x5x s TYR 59 CO 0.00 0.50 0.62 0.16 -1.34 0.00 0.00 175.55 175.49 1x5x s ASP 60 N -2.76 -0.85 0.27 4.32 -4.77 -1.26 -3.52 116.67 108.10 1x5x s ASP 60 Ca 0.24 -1.60 -0.11 0.00 -3.30 0.00 0.00 52.55 47.78 1x5x s ASP 60 Cb -0.09 1.50 -0.00 0.00 -1.09 0.00 0.00 42.92 43.24 1x5x s ASP 60 CO 0.14 -0.12 0.48 -0.83 0.70 0.00 0.00 175.17 175.54 1x5x s GLY 61 N 1.12 0.73 -0.49 2.12 0.00 -1.26 -5.04 107.32 104.51 1x5x s GLY 61 Ca 0.25 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.95 1x5x s GLY 61 CO -0.07 -0.71 1.93 -1.84 0.00 0.00 0.00 173.10 172.41 1x5x n GLU 62 N -0.42 2.26 -4.06 2.90 0.28 -1.26 -2.88 120.64 117.47 1x5x n GLU 62 Ca -0.01 -2.64 -0.24 0.00 -0.16 0.00 0.00 57.16 54.11 1x5x n GLU 62 Cb 0.62 -2.03 -0.04 0.00 1.43 0.00 0.00 31.44 31.41 1x5x n GLU 62 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1x5x s ASP 63 N -1.07 5.74 -0.35 -1.84 1.11 -1.26 -4.92 116.67 114.07 1x5x s ASP 63 Ca 0.51 -0.10 0.08 0.00 0.18 0.00 0.00 52.55 53.22 1x5x s ASP 63 Cb 0.41 -1.55 0.64 0.00 1.07 0.00 0.00 42.92 43.50 1x5x s ASP 63 CO 0.03 0.01 1.74 0.18 1.18 0.00 0.00 175.17 178.31 1x5x n LEU 64 N -0.78 5.71 -3.64 1.23 4.77 -1.26 -4.63 117.00 118.40 1x5x n LEU 64 Ca -0.08 -3.50 -0.05 0.00 -0.03 0.00 0.00 56.01 52.36 1x5x n LEU 64 Cb 0.56 -0.74 -0.07 0.00 -2.33 0.00 0.00 43.42 40.84 1x5x n LEU 64 CO 0.44 1.00 1.03 0.00 -1.33 0.00 0.00 177.39 178.54 1x5x s ALA 65 N -3.17 -2.14 0.03 -1.18 0.00 -1.26 -2.25 121.76 111.79 1x5x s ALA 65 Ca 0.52 1.74 -0.08 0.00 0.00 0.00 0.00 51.96 54.15 1x5x s ALA 65 Cb 0.44 -1.62 -0.00 0.00 0.00 0.00 0.00 23.12 21.94 1x5x s ALA 65 CO 0.09 -0.16 0.15 -0.47 0.00 0.00 0.00 175.76 175.37 1x5x s TYR 66 N -0.06 0.10 -0.63 0.00 5.04 -1.20 -5.04 117.35 115.56 1x5x s TYR 66 Ca 0.06 -0.31 -0.10 0.00 -2.44 0.00 0.00 57.07 54.28 1x5x s TYR 66 Cb -0.04 -0.07 0.16 0.00 0.35 0.00 0.00 41.96 42.36 1x5x s TYR 66 CO -0.12 -0.37 0.52 0.99 -1.34 0.00 0.00 175.55 175.23 1x5x s THR 67 N -2.25 4.70 0.44 4.34 2.01 -1.26 -2.41 115.64 121.20 1x5x s THR 67 Ca -0.08 -2.20 -0.26 0.00 0.31 0.00 0.00 61.69 59.46 1x5x s THR 67 Cb -0.03 -4.00 -0.08 0.00 0.01 0.00 0.00 72.50 68.39 1x5x s THR 67 CO -0.03 -0.89 1.39 -0.69 -0.69 0.00 0.00 174.62 173.72 1x5x s VAL 68 N 0.72 2.22 0.22 3.82 1.01 -0.61 -4.84 120.40 122.94 1x5x s VAL 68 Ca 0.11 0.20 0.01 0.00 0.00 0.00 0.00 61.98 62.31 1x5x s VAL 68 Cb -0.20 -3.12 -0.05 0.00 0.00 0.00 0.00 36.38 33.01 1x5x s VAL 68 CO -0.03 0.03 0.05 -0.54 0.00 0.00 0.00 175.10 174.61 1x5x s LYS 69 N -2.39 1.27 -0.46 2.72 1.02 -1.26 -1.84 119.74 118.81 1x5x s LYS 69 Ca 0.60 -1.65 -0.02 0.00 0.02 0.00 0.00 55.97 54.92 1x5x s LYS 69 Cb -0.42 -0.25 -0.02 0.00 -0.52 0.00 0.00 37.83 36.62 1x5x s LYS 69 CO 0.54 -0.22 0.41 -1.71 -0.92 0.00 0.00 175.35 173.45 1x5x n ASN 70 N -0.36 -4.63 -3.23 2.83 2.85 -1.01 -4.94 115.26 106.78 1x5x n ASN 70 Ca -0.03 -0.21 -0.17 0.00 -0.11 0.00 0.00 54.58 54.06 1x5x n ASN 70 Cb 0.65 -3.03 -0.04 0.00 1.24 0.00 0.00 39.78 38.60 1x5x n ASN 70 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1x5x n LEU 71 N -1.91 0.00 -4.40 1.20 4.77 -1.19 -5.01 117.00 110.46 1x5x n LEU 71 Ca -0.02 -1.87 -0.29 0.00 -0.03 0.00 0.00 56.01 53.80 1x5x n LEU 71 Cb 0.53 0.42 -0.13 0.00 -2.33 0.00 0.00 43.42 41.91 1x5x n LEU 71 CO 0.28 -0.28 -0.55 -0.13 -1.33 0.00 0.00 177.39 175.39 1x5x s ARG 72 N -3.00 1.62 0.47 3.23 0.52 -1.25 -4.66 118.95 115.89 1x5x s ARG 72 Ca 0.06 -1.23 -0.22 0.00 -0.52 0.00 0.00 55.73 53.82 1x5x s ARG 72 Cb 0.00 -1.98 -0.07 0.00 0.52 0.00 0.00 34.95 33.42 1x5x s ARG 72 CO 0.04 0.48 1.15 -0.98 0.02 0.00 0.00 175.30 176.01 1x5x s ARG 73 N -1.81 3.69 -0.90 3.54 1.70 -1.18 -3.79 118.95 120.19 1x5x s ARG 73 Ca 0.14 1.72 -0.08 0.00 -0.47 0.00 0.00 55.73 57.04 1x5x s ARG 73 Cb -0.10 -2.32 0.01 0.00 -0.57 0.00 0.00 34.95 31.97 1x5x s ARG 73 CO 0.06 -0.59 0.61 -1.13 -1.08 0.00 0.00 175.30 173.16 1x5x n SER 74 N -0.65 -4.54 -4.05 -2.89 3.41 -0.99 -4.96 113.62 98.96 1x5x n SER 74 Ca 0.08 -1.05 -0.10 0.00 -0.26 0.00 0.00 58.87 57.55 1x5x n SER 74 Cb 0.49 -1.56 -0.08 0.00 -0.26 0.00 0.00 64.21 62.79 1x5x n SER 74 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1x5x s THR 75 N -3.11 0.09 0.05 6.66 2.01 -1.25 -4.94 115.64 115.15 1x5x s THR 75 Ca 0.11 -1.64 0.08 0.00 0.31 0.00 0.00 61.69 60.55 1x5x s THR 75 Cb -0.06 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.50 1x5x s THR 75 CO 0.90 -0.40 -0.20 -1.59 -0.69 0.00 0.00 174.62 172.64 1x5x s LYS 76 N -4.00 1.98 -0.03 4.92 0.00 -1.26 -1.88 119.74 119.46 1x5x s LYS 76 Ca 0.20 -1.03 -0.10 0.00 0.00 0.00 0.00 55.97 55.03 1x5x s LYS 76 Cb 0.05 -2.14 0.02 0.00 0.00 0.00 0.00 37.83 35.76 1x5x s LYS 76 CO 0.00 0.53 0.24 0.71 0.00 0.00 0.00 175.35 176.83 1x5x s TYR 77 N -0.92 -0.14 -0.06 1.78 2.02 -1.03 -5.01 117.35 113.98 1x5x s TYR 77 Ca 0.14 0.27 -0.07 0.00 -0.37 0.00 0.00 57.07 57.05 1x5x s TYR 77 Cb -0.10 0.05 -0.04 0.00 -0.40 0.00 0.00 41.96 41.46 1x5x s TYR 77 CO 0.05 -0.27 0.20 0.15 -1.57 0.00 0.00 175.55 174.10 1x5x s LYS 78 N -0.88 3.51 0.02 -0.62 1.02 -1.16 -2.77 119.74 118.86 1x5x s LYS 78 Ca -0.10 -0.11 -0.01 0.00 0.02 0.00 0.00 55.97 55.77 1x5x s LYS 78 Cb -0.05 -3.15 -0.02 0.00 -0.52 0.00 0.00 37.83 34.09 1x5x s LYS 78 CO 0.02 0.72 -0.01 -0.06 -0.92 0.00 0.00 175.35 175.10 1x5x s PHE 79 N -1.15 0.22 -0.10 3.18 0.08 -0.47 -2.08 117.98 117.66 1x5x s PHE 79 Ca 0.21 -0.46 -0.05 0.00 0.12 0.00 0.00 56.93 56.75 1x5x s PHE 79 Cb -0.13 -0.16 0.05 0.00 -0.57 0.00 0.00 43.02 42.20 1x5x s PHE 79 CO 0.10 -0.19 0.24 -1.59 -0.10 0.00 0.00 175.22 173.69 1x5x s LYS 80 N -1.36 0.21 -0.09 0.44 -2.85 -1.01 -0.48 119.74 114.59 1x5x s LYS 80 Ca -0.15 0.52 -0.20 0.00 -1.00 0.00 0.00 55.97 55.14 1x5x s LYS 80 Cb -0.09 -0.11 -0.04 0.00 -2.06 0.00 0.00 37.83 35.52 1x5x s LYS 80 CO -0.01 -0.16 0.56 0.54 0.10 0.00 0.00 175.35 176.39 1x5x s VAL 81 N 1.22 5.13 -0.19 1.79 0.11 -1.26 -2.49 120.40 124.70 1x5x s VAL 81 Ca -0.09 1.14 0.01 0.00 -2.93 0.00 0.00 61.98 60.11 1x5x s VAL 81 Cb -0.10 -3.90 0.03 0.00 -1.53 0.00 0.00 36.38 30.88 1x5x s VAL 81 CO -0.08 0.31 -0.18 -0.63 -3.33 0.00 0.00 175.10 171.19 1x5x s ILE 82 N 0.64 2.01 -0.33 7.04 1.01 -0.94 -1.85 121.20 128.77 1x5x s ILE 82 Ca 0.30 -1.00 -0.19 0.00 0.00 0.00 0.00 60.65 59.77 1x5x s ILE 82 Cb -0.16 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.44 1x5x s ILE 82 CO 0.13 0.45 0.57 0.00 0.00 0.00 0.00 174.94 176.09 1x5x s ALA 83 N 1.29 3.50 0.27 9.38 0.00 -1.26 -0.83 121.76 134.11 1x5x s ALA 83 Ca 0.03 -0.83 0.09 0.00 0.00 0.00 0.00 51.96 51.25 1x5x s ALA 83 Cb -0.14 -3.05 -0.05 0.00 0.00 0.00 0.00 23.12 19.88 1x5x s ALA 83 CO -0.12 -1.14 -0.13 1.52 0.00 0.00 0.00 175.76 175.90 1x5x s TYR 84 N 2.50 2.06 0.12 0.00 -0.85 -1.07 -2.71 117.35 117.40 1x5x s TYR 84 Ca 0.22 -0.53 0.09 0.00 -0.52 0.00 0.00 57.07 56.33 1x5x s TYR 84 Cb -0.15 -1.04 -0.04 0.00 0.38 0.00 0.00 41.96 41.11 1x5x s TYR 84 CO 0.13 0.47 -0.22 1.21 -1.52 0.00 0.00 175.55 175.62 1x5x s ASN 85 N -3.46 2.76 0.59 -0.18 2.47 0.55 -3.30 114.94 114.38 1x5x s ASN 85 Ca 0.28 -0.72 0.34 0.00 0.42 0.00 0.00 52.86 53.18 1x5x s ASN 85 Cb 0.00 -0.16 1.26 0.00 -1.45 0.00 0.00 41.25 40.89 1x5x s ASN 85 CO 0.12 0.08 1.50 -1.28 -3.72 0.00 0.00 177.10 173.80 1x5x h SER 86 N 3.93 0.00 -0.03 -4.21 0.87 -1.99 1.34 113.55 113.45 1x5x h SER 86 Ca -0.47 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.03 1x5x h SER 86 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1x5x h SER 86 CO 0.41 0.00 -0.20 -0.33 -0.53 0.00 0.00 176.83 176.18 1x5x h GLU 87 N 0.00 0.18 0.00 2.24 5.08 -1.94 -3.49 114.58 116.65 1x5x h GLU 87 Ca 0.56 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.76 1x5x h GLU 87 Cb 2.81 0.04 0.00 0.00 0.50 0.00 0.00 28.75 32.09 1x5x h GLU 87 CO -0.01 0.84 0.00 0.41 -1.00 0.00 0.00 179.01 179.26 1x5x n GLY 88 N 0.81 2.25 3.21 -3.84 0.00 0.46 -4.77 105.19 103.31 1x5x n GLY 88 Ca -0.09 -0.56 -0.17 0.00 0.00 0.00 0.00 46.02 45.20 1x5x n GLY 88 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x5x s LYS 89 N 1.42 0.93 0.00 1.61 -2.85 -1.26 0.21 119.74 119.80 1x5x s LYS 89 Ca 0.00 -1.14 0.00 0.00 -1.00 0.00 0.00 55.97 53.83 1x5x s LYS 89 Cb 0.00 -0.81 0.00 0.00 -2.06 0.00 0.00 37.83 34.96 1x5x s LYS 89 CO 0.00 0.16 0.00 0.43 0.10 0.00 0.00 175.35 176.04 1x5x n SER 90 N 0.74 0.43 -4.84 0.03 7.64 -1.10 -4.88 113.62 111.65 1x5x n SER 90 Ca -0.17 -0.27 -0.32 0.00 1.01 0.00 0.00 58.87 59.11 1x5x n SER 90 Cb 0.56 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.72 1x5x n SER 90 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1x5x s ASN 91 N -0.68 6.72 0.68 6.43 4.22 -1.26 -4.86 114.94 126.18 1x5x s ASN 91 Ca 0.00 1.53 -0.11 0.00 -2.14 0.00 0.00 52.86 52.13 1x5x s ASN 91 Cb 0.00 -2.48 0.00 0.00 1.28 0.00 0.00 41.25 40.05 1x5x s ASN 91 CO 0.00 -0.46 1.06 -2.16 -2.04 0.00 0.00 177.10 173.49 1x5x s PRO 92 N -3.69 3.00 0.69 3.55 0.04 -1.26 -4.49 135.00 132.84 1x5x s PRO 92 Ca 0.58 0.98 0.03 0.00 0.04 0.00 0.00 61.00 62.64 1x5x s PRO 92 Cb -0.10 -2.00 0.13 0.00 0.04 0.00 0.00 34.50 32.58 1x5x s PRO 92 CO 0.25 -1.05 0.94 0.45 0.04 0.00 0.00 177.00 177.63 1x5x n SER 93 N -2.98 1.58 -4.71 6.66 2.88 -0.77 -4.92 113.62 111.35 1x5x n SER 93 Ca 0.08 -2.26 -0.42 0.00 -1.33 0.00 0.00 58.87 54.93 1x5x n SER 93 Cb 0.53 -0.58 -0.03 0.00 -0.75 0.00 0.00 64.21 63.38 1x5x n SER 93 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1x5x n GLU 94 N -2.68 2.77 -2.59 -1.46 1.02 -1.26 -4.66 120.64 111.78 1x5x n GLU 94 Ca 0.17 1.00 -0.43 0.00 -0.02 0.00 0.00 57.16 57.88 1x5x n GLU 94 Cb 0.59 -2.85 -0.02 0.00 -0.02 0.00 0.00 31.44 29.14 1x5x n GLU 94 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1x5x s VAL 95 N 1.42 4.56 0.29 2.62 1.01 -1.26 -4.64 120.40 124.41 1x5x s VAL 95 Ca 0.76 1.87 0.06 0.00 0.00 0.00 0.00 61.98 64.67 1x5x s VAL 95 Cb -0.51 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 31.65 1x5x s VAL 95 CO 0.33 -0.10 0.39 0.68 0.00 0.00 0.00 175.10 176.40 1x5x s VAL 96 N 2.84 4.50 0.04 2.92 -7.23 0.36 -4.89 120.40 118.94 1x5x s VAL 96 Ca 0.49 -1.07 0.07 0.00 -1.81 0.00 0.00 61.98 59.66 1x5x s VAL 96 Cb -0.19 -3.56 -0.02 0.00 0.56 0.00 0.00 36.38 33.18 1x5x s VAL 96 CO 0.13 -0.24 -0.19 -0.70 -0.31 0.00 0.00 175.10 173.79 1x5x s GLU 97 N -4.05 1.32 0.23 4.82 2.12 -1.26 -1.37 118.70 120.50 1x5x s GLU 97 Ca 0.39 -0.88 -0.06 0.00 0.36 0.00 0.00 54.97 54.79 1x5x s GLU 97 Cb -0.09 -1.39 -0.02 0.00 0.26 0.00 0.00 34.13 32.89 1x5x s GLU 97 CO 0.29 0.36 0.29 -0.06 -0.54 0.00 0.00 175.26 175.60 1x5x s PHE 98 N -0.77 0.85 0.03 5.30 0.08 -1.11 -5.02 117.98 117.34 1x5x s PHE 98 Ca 0.06 -1.12 0.03 0.00 0.12 0.00 0.00 56.93 56.02 1x5x s PHE 98 Cb -0.08 -0.24 -0.02 0.00 -0.57 0.00 0.00 43.02 42.11 1x5x s PHE 98 CO 0.01 -0.82 -0.09 0.99 -0.10 0.00 0.00 175.22 175.22 1x5x s THR 99 N -4.02 0.67 1.02 0.64 2.01 -1.26 -2.48 115.64 112.22 1x5x s THR 99 Ca 0.32 -0.88 -0.17 0.00 0.31 0.00 0.00 61.69 61.27 1x5x s THR 99 Cb 0.03 -0.67 0.24 0.00 0.01 0.00 0.00 72.50 72.12 1x5x s THR 99 CO 0.12 -0.17 1.29 0.35 -0.69 0.00 0.00 174.62 175.51 1x5x n THR 100 N 1.89 0.00 -2.64 -0.82 -2.24 -0.79 -4.80 114.28 104.88 1x5x n THR 100 Ca -0.19 -0.89 -0.22 0.00 -2.27 0.00 0.00 64.05 60.47 1x5x n THR 100 Cb 0.55 -1.47 0.03 0.00 -2.10 0.00 0.00 70.33 67.35 1x5x n THR 100 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1x5x s PRO 102 N -4.79 3.59 0.20 0.00 0.04 -1.26 -2.35 135.00 130.43 1x5x s PRO 102 Ca 0.56 1.26 0.08 0.00 0.04 0.00 0.00 61.00 62.93 1x5x s PRO 102 Cb -0.10 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.32 1x5x s PRO 102 CO 0.39 -0.60 -0.14 0.34 0.04 0.00 0.00 177.00 177.04 1x5x s ASP 103 N -2.44 2.54 0.47 6.66 2.15 -1.26 -4.90 116.67 119.88 1x5x s ASP 103 Ca 0.65 -1.03 0.00 0.00 0.43 0.00 0.00 52.55 52.60 1x5x s ASP 103 Cb -0.16 -0.13 0.00 0.00 -0.30 0.00 0.00 42.92 42.33 1x5x s ASP 103 CO 0.29 -0.19 0.00 -0.24 -0.17 0.00 0.00 175.17 174.86 1x5x n SER 104 N -0.38 -7.62 -1.18 -0.34 2.88 -1.26 -5.03 113.62 100.70 1x5x n SER 104 Ca -0.08 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.61 1x5x n SER 104 Cb 0.60 -4.10 0.00 0.00 -0.75 0.00 0.00 64.21 59.97 1x5x n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5x n GLY 105 N -1.07 -2.26 3.76 0.46 0.00 -1.26 -5.03 105.19 99.79 1x5x n GLY 105 Ca 0.00 -0.36 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 1x5x n GLY 105 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5x s PRO 106 N -0.02 4.55 -0.13 1.61 0.04 -1.26 -4.55 135.00 135.24 1x5x s PRO 106 Ca 0.00 1.71 -0.09 0.00 0.04 0.00 0.00 61.00 62.66 1x5x s PRO 106 Cb 0.00 -3.05 0.04 0.00 0.04 0.00 0.00 34.50 31.53 1x5x s PRO 106 CO 0.00 0.16 0.18 0.43 0.04 0.00 0.00 177.00 177.81 1x5x n SER 107 N 0.93 -2.26 -3.70 6.66 7.64 -1.26 -5.06 113.62 116.57 1x5x n SER 107 Ca 0.00 1.34 -0.15 0.00 1.01 0.00 0.00 58.87 61.07 1x5x n SER 107 Cb 0.46 -4.89 -0.15 0.00 -1.01 0.00 0.00 64.21 58.62 1x5x n SER 107 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x5x s SER 108 N -0.59 0.31 0.00 6.43 0.01 -1.26 -5.25 113.70 113.34 1x5x s SER 108 Ca -0.21 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.41 1x5x s SER 108 Cb 0.01 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.54 1x5x s SER 108 CO 0.57 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.63