#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 6.14 0.51 1.61 0.01 -1.26 -4.68 113.70 116.03 1x5x s SER 2 Ca 0.00 3.00 0.00 0.00 1.31 0.00 0.00 55.95 60.26 1x5x s SER 2 Cb 0.00 -2.66 0.00 0.00 0.21 0.00 0.00 66.02 63.57 1x5x s SER 2 CO 0.00 -1.00 0.00 -0.24 0.41 0.00 0.00 173.24 172.41 1x5x n SER 3 N 0.18 -6.95 0.00 2.44 2.88 -1.26 -5.08 113.62 105.83 1x5x n SER 3 Ca 0.03 1.47 0.00 0.00 -1.33 0.00 0.00 58.87 59.04 1x5x n SER 3 Cb 0.40 -4.14 0.00 0.00 -0.75 0.00 0.00 64.21 59.73 1x5x n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5x n GLY 4 N -2.92 3.10 3.56 0.46 0.00 -1.26 -4.93 105.19 103.20 1x5x n GLY 4 Ca -0.03 -1.99 -0.17 0.00 0.00 0.00 0.00 46.02 43.84 1x5x n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5x s SER 5 N 0.00 4.12 -0.95 1.61 1.04 -1.26 -4.84 113.70 113.42 1x5x s SER 5 Ca 0.00 -0.34 -0.24 0.00 0.48 0.00 0.00 55.95 55.85 1x5x s SER 5 Cb 0.00 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.53 1x5x s SER 5 CO 0.00 -3.76 1.86 -0.94 0.98 0.00 0.00 173.24 171.38 1x5x s SER 6 N 9.74 5.39 0.00 7.02 1.04 -1.26 -4.71 113.70 130.91 1x5x s SER 6 Ca 0.85 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1x5x s SER 6 Cb -0.10 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.46 1x5x s SER 6 CO 0.08 -2.54 0.00 0.61 0.98 0.00 0.00 173.24 172.37 1x5x n GLY 7 N 6.75 4.62 3.81 7.32 0.00 -1.26 -4.89 105.19 121.53 1x5x n GLY 7 Ca 0.40 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.79 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 -3.73 3.43 1.22 1.61 0.04 -1.26 -5.02 135.00 131.29 1x5x s PRO 8 Ca 0.00 1.19 -0.21 0.00 0.04 0.00 0.00 61.00 62.03 1x5x s PRO 8 Cb 0.00 -2.05 0.31 0.00 0.04 0.00 0.00 34.50 32.80 1x5x s PRO 8 CO 0.00 -0.72 1.05 0.43 0.04 0.00 0.00 177.00 177.80 1x5x n SER 9 N -1.88 -2.25 -4.67 6.66 7.64 -1.26 -4.75 113.62 113.10 1x5x n SER 9 Ca 0.09 -1.13 -0.42 0.00 1.01 0.00 0.00 58.87 58.41 1x5x n SER 9 Cb 0.53 -0.98 -0.03 0.00 -1.01 0.00 0.00 64.21 62.72 1x5x n SER 9 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1x5x s MET 10 N -5.39 4.20 0.96 1.43 1.75 -1.26 -4.69 119.30 116.29 1x5x s MET 10 Ca 0.69 2.22 -0.14 0.00 -1.25 0.00 0.00 55.69 57.21 1x5x s MET 10 Cb -0.07 -3.81 0.17 0.00 2.84 0.00 0.00 34.83 33.96 1x5x s MET 10 CO 0.53 -0.78 1.16 -1.25 -0.65 0.00 0.00 175.02 174.04 1x5x s PRO 11 N 3.37 0.76 0.06 4.11 0.04 -1.26 -4.11 135.00 137.97 1x5x s PRO 11 Ca 0.73 0.14 -0.23 0.00 0.04 0.00 0.00 61.00 61.68 1x5x s PRO 11 Cb -0.36 -1.81 -0.06 0.00 0.04 0.00 0.00 34.50 32.32 1x5x s PRO 11 CO 0.30 -2.43 0.70 0.00 0.04 0.00 0.00 177.00 175.62 1x5x s ALA 12 N -3.33 3.44 0.37 8.56 0.00 -1.22 -4.68 121.76 124.90 1x5x s ALA 12 Ca 0.66 0.21 -0.24 0.00 0.00 0.00 0.00 51.96 52.58 1x5x s ALA 12 Cb -0.13 -2.88 -0.13 0.00 0.00 0.00 0.00 23.12 19.98 1x5x s ALA 12 CO 0.54 0.18 0.69 0.43 0.00 0.00 0.00 175.76 177.59 1x5x n SER 13 N 2.39 -0.25 -4.71 0.00 7.64 -1.26 -4.20 113.62 113.23 1x5x n SER 13 Ca -0.05 1.00 -0.42 0.00 1.01 0.00 0.00 58.87 60.41 1x5x n SER 13 Cb 0.50 -1.16 -0.03 0.00 -1.01 0.00 0.00 64.21 62.51 1x5x n SER 13 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1x5x s PRO 14 N -1.55 4.45 0.37 1.43 0.04 -1.26 -4.73 135.00 133.74 1x5x s PRO 14 Ca 0.62 1.72 -0.02 0.00 0.04 0.00 0.00 61.00 63.37 1x5x s PRO 14 Cb -0.66 -3.36 0.08 0.00 0.04 0.00 0.00 34.50 30.60 1x5x s PRO 14 CO 0.58 -0.22 0.51 1.33 0.04 0.00 0.00 177.00 179.23 1x5x n VAL 15 N 3.90 0.00 -3.60 -0.36 0.24 0.27 -4.78 118.33 114.00 1x5x n VAL 15 Ca 0.08 -0.67 -0.29 0.00 -2.04 0.00 0.00 64.34 61.42 1x5x n VAL 15 Cb 0.47 -1.30 -0.12 0.00 -1.47 0.00 0.00 33.84 31.42 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 2.05 0.08 1.34 2.96 -1.26 -1.48 118.68 122.37 1x5x s LEU 16 Ca 0.32 -2.57 -0.35 0.00 -0.22 0.00 0.00 54.13 51.31 1x5x s LEU 16 Cb -0.02 -0.78 -0.17 0.00 0.50 0.00 0.00 46.19 45.72 1x5x s LEU 16 CO 0.22 -0.26 1.54 0.71 -1.32 0.00 0.00 176.35 177.23 1x5x h THR 17 N 5.07 0.00 -3.46 3.68 1.35 -1.39 -3.43 112.91 114.73 1x5x h THR 17 Ca 0.05 0.00 -0.40 0.00 -0.55 0.00 0.00 66.41 65.51 1x5x h THR 17 Cb 0.93 0.00 -0.34 0.00 -1.73 0.00 0.00 68.15 67.01 1x5x h THR 17 CO 0.40 0.00 -0.77 -0.75 -0.25 0.00 0.00 175.52 174.16 1x5x s LYS 18 N -5.76 0.73 -0.29 4.72 2.20 -1.19 -5.05 119.74 115.10 1x5x s LYS 18 Ca -0.18 -0.07 -0.09 0.00 -0.36 0.00 0.00 55.97 55.28 1x5x s LYS 18 Cb 0.04 -0.77 -0.02 0.00 -1.51 0.00 0.00 37.83 35.56 1x5x s LYS 18 CO 0.58 -0.09 0.12 0.00 -0.36 0.00 0.00 175.35 175.60 1x5x s ALA 19 N 0.95 3.26 0.20 3.13 0.00 -1.26 -1.05 121.76 126.98 1x5x s ALA 19 Ca -0.11 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.59 1x5x s ALA 19 Cb -0.14 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.70 1x5x s ALA 19 CO -0.00 -0.72 0.00 0.41 0.00 0.00 0.00 175.76 175.45 1x5x n GLY 20 N 4.97 1.31 0.13 0.00 0.00 0.13 -4.49 105.19 107.24 1x5x n GLY 20 Ca -0.15 -2.04 -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 -0.20 0.76 -0.03 -0.61 2.04 -1.91 -1.61 117.51 115.95 1x5x h ILE 21 Ca 0.00 -2.31 -0.05 0.00 1.00 0.00 0.00 64.86 63.50 1x5x h ILE 21 Cb 0.00 2.46 -0.08 0.00 -0.74 0.00 0.00 36.82 38.46 1x5x h ILE 21 CO 0.00 0.71 -0.60 0.35 0.00 0.00 0.00 178.15 178.62 1x5x n THR 22 N -3.80 1.89 -3.51 -0.27 -2.24 -1.26 -3.16 114.28 101.92 1x5x n THR 22 Ca -0.31 -2.95 -0.12 0.00 -2.27 0.00 0.00 64.05 58.40 1x5x n THR 22 Cb 0.93 -0.08 -0.04 0.00 -2.10 0.00 0.00 70.33 69.04 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 -2.78 -0.46 -0.11 4.78 1.48 -1.26 -2.97 118.94 117.62 1x5x s TRP 23 Ca 0.38 0.56 -0.04 0.00 -1.06 0.00 0.00 56.10 55.94 1x5x s TRP 23 Cb 0.37 0.49 0.05 0.00 -1.16 0.00 0.00 33.47 33.22 1x5x s TRP 23 CO -0.08 -0.55 0.11 -0.51 -4.06 0.00 0.00 176.95 171.86 1x5x s LEU 24 N -1.85 0.13 -0.64 -4.66 1.43 -0.78 -0.69 118.68 111.61 1x5x s LEU 24 Ca -0.01 -0.14 -0.22 0.00 -1.03 0.00 0.00 54.13 52.73 1x5x s LEU 24 Cb -0.01 -0.02 0.08 0.00 0.03 0.00 0.00 46.19 46.27 1x5x s LEU 24 CO -0.02 -0.29 0.90 -0.44 0.23 0.00 0.00 176.35 176.73 1x5x s SER 25 N 2.21 6.18 0.39 2.29 0.01 -0.22 -0.93 113.70 123.62 1x5x s SER 25 Ca 0.04 -1.10 0.00 0.00 1.31 0.00 0.00 55.95 56.20 1x5x s SER 25 Cb -0.14 -2.39 -0.02 0.00 0.21 0.00 0.00 66.02 63.68 1x5x s SER 25 CO -0.07 -1.36 0.60 -0.76 0.41 0.00 0.00 173.24 172.06 1x5x s LEU 26 N 3.73 3.87 -0.12 2.44 1.43 -1.07 -1.03 118.68 127.93 1x5x s LEU 26 Ca 0.20 0.41 -0.04 0.00 -1.03 0.00 0.00 54.13 53.66 1x5x s LEU 26 Cb -0.19 -3.28 0.06 0.00 0.03 0.00 0.00 46.19 42.82 1x5x s LEU 26 CO 0.09 -0.44 0.21 -1.58 0.23 0.00 0.00 176.35 174.85 1x5x s GLN 27 N -4.41 0.10 0.22 1.70 -0.44 -0.55 -3.33 119.66 112.95 1x5x s GLN 27 Ca 0.43 0.55 0.09 0.00 -2.50 0.00 0.00 55.36 53.93 1x5x s GLN 27 Cb -0.10 -0.40 -0.05 0.00 -1.64 0.00 0.00 33.01 30.83 1x5x s GLN 27 CO 0.37 -0.37 -0.16 1.67 0.50 0.00 0.00 175.29 177.29 1x5x s TRP 28 N 2.34 1.89 0.30 1.67 -2.14 -1.17 0.97 118.94 122.82 1x5x s TRP 28 Ca 0.03 -0.49 0.06 0.00 2.66 0.00 0.00 56.10 58.36 1x5x s TRP 28 Cb -0.13 -0.86 -0.06 0.00 -3.10 0.00 0.00 33.47 29.32 1x5x s TRP 28 CO -0.08 0.46 -0.03 -1.12 -2.66 0.00 0.00 176.95 173.52 1x5x s SER 29 N -3.32 2.83 0.96 -2.66 0.01 -1.26 -4.57 113.70 105.70 1x5x s SER 29 Ca 0.24 -1.24 -0.11 0.00 1.31 0.00 0.00 55.95 56.15 1x5x s SER 29 Cb -0.02 -0.18 0.17 0.00 0.21 0.00 0.00 66.02 66.19 1x5x s SER 29 CO 0.09 -0.39 1.10 -1.59 0.41 0.00 0.00 173.24 172.86 1x5x s LYS 30 N -3.75 0.69 0.54 12.44 -2.85 -1.26 -3.41 119.74 122.13 1x5x s LYS 30 Ca 0.31 1.21 -0.18 0.00 -1.00 0.00 0.00 55.97 56.32 1x5x s LYS 30 Cb 0.05 -1.71 -0.06 0.00 -2.06 0.00 0.00 37.83 34.05 1x5x s LYS 30 CO 0.13 -2.75 1.04 -1.25 0.10 0.00 0.00 175.35 172.63 1x5x s PRO 31 N -4.67 3.59 0.28 1.78 0.04 -1.26 -4.26 135.00 130.49 1x5x s PRO 31 Ca 0.66 1.25 -0.30 0.00 0.04 0.00 0.00 61.00 62.65 1x5x s PRO 31 Cb -0.22 -2.07 -0.12 0.00 0.04 0.00 0.00 34.50 32.13 1x5x s PRO 31 CO 0.59 -0.59 1.63 -1.13 0.04 0.00 0.00 177.00 177.54 1x5x n SER 32 N -1.51 3.91 -3.21 6.66 3.41 -1.26 -3.75 113.62 117.87 1x5x n SER 32 Ca 0.09 1.13 -0.14 0.00 -0.26 0.00 0.00 58.87 59.69 1x5x n SER 32 Cb 0.53 -1.59 0.01 0.00 -0.26 0.00 0.00 64.21 62.90 1x5x n SER 32 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5x n GLY 33 N 2.53 -0.59 3.49 5.00 0.00 -1.26 -4.81 105.19 109.55 1x5x n GLY 33 Ca 0.10 0.56 -0.24 0.00 0.00 0.00 0.00 46.02 46.45 1x5x n GLY 33 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1x5x s THR 34 N -1.38 2.06 0.00 2.61 -1.32 -1.25 -4.79 115.64 111.57 1x5x s THR 34 Ca 0.15 -2.20 0.00 0.00 -1.21 0.00 0.00 61.69 58.43 1x5x s THR 34 Cb -0.02 -2.52 0.00 0.00 -1.51 0.00 0.00 72.50 68.45 1x5x s THR 34 CO 0.46 -0.27 0.18 -0.81 -2.21 0.00 0.00 174.62 171.97 1x5x n PRO 35 N -0.69 0.00 -2.07 7.08 -0.04 -1.26 -4.70 135.00 133.32 1x5x n PRO 35 Ca -0.05 0.23 -0.43 0.00 -0.04 0.00 0.00 63.50 63.20 1x5x n PRO 35 Cb 0.63 -0.85 -0.03 0.00 -0.04 0.00 0.00 33.50 33.21 1x5x n PRO 35 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5x s SER 36 N -1.93 6.13 0.00 3.54 0.15 -1.26 -4.90 113.70 115.44 1x5x s SER 36 Ca 0.00 1.39 -0.15 0.00 0.70 0.00 0.00 55.95 57.89 1x5x s SER 36 Cb 0.00 -2.53 -0.08 0.00 -1.71 0.00 0.00 66.02 61.70 1x5x s SER 36 CO 0.00 -1.51 0.85 0.44 1.20 0.00 0.00 173.24 174.23 1x5x h ASP 37 N 11.83 -0.45 -3.44 5.45 5.19 -2.03 -3.42 116.42 129.56 1x5x h ASP 37 Ca -0.33 0.02 -0.67 0.00 -0.62 0.00 0.00 57.03 55.42 1x5x h ASP 37 Cb 1.16 0.12 -0.34 0.00 0.18 0.00 0.00 39.33 40.44 1x5x h ASP 37 CO 1.02 -0.21 -0.79 -1.61 -3.12 0.00 0.00 179.24 174.53 1x5x s GLU 38 N -3.55 2.77 0.00 3.56 2.02 -1.26 -4.61 118.70 117.63 1x5x s GLU 38 Ca -0.08 -1.00 0.00 0.00 0.02 0.00 0.00 54.97 53.91 1x5x s GLU 38 Cb 0.01 -2.83 0.00 0.00 0.10 0.00 0.00 34.13 31.41 1x5x s GLU 38 CO 0.23 -0.37 0.00 0.41 0.02 0.00 0.00 175.26 175.55 1x5x n GLY 39 N 4.60 0.49 3.74 -1.39 0.00 -1.26 -5.14 105.19 106.23 1x5x n GLY 39 Ca -0.17 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 2.40 0.14 -0.61 1.01 -1.26 -4.91 121.20 117.97 1x5x s ILE 40 Ca 0.00 0.25 0.11 0.00 0.00 0.00 0.00 60.65 61.01 1x5x s ILE 40 Cb 0.00 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 1x5x s ILE 40 CO 0.00 -0.06 -0.26 -0.44 0.00 0.00 0.00 174.94 174.18 1x5x s SER 41 N -1.56 3.36 -0.03 3.58 0.01 -1.25 -4.56 113.70 113.26 1x5x s SER 41 Ca 0.79 -0.77 0.01 0.00 1.31 0.00 0.00 55.95 57.29 1x5x s SER 41 Cb -0.33 -0.23 0.01 0.00 0.21 0.00 0.00 66.02 65.68 1x5x s SER 41 CO 0.36 0.17 -0.05 -0.31 0.41 0.00 0.00 173.24 173.82 1x5x s TYR 42 N -1.21 0.65 -0.27 2.43 1.51 -1.11 -2.33 117.35 117.02 1x5x s TYR 42 Ca 0.16 -0.15 -0.11 0.00 -1.01 0.00 0.00 57.07 55.95 1x5x s TYR 42 Cb -0.10 -0.53 -0.05 0.00 -0.11 0.00 0.00 41.96 41.18 1x5x s TYR 42 CO 0.07 -0.11 0.20 0.42 -1.11 0.00 0.00 175.55 175.01 1x5x s ILE 43 N 0.51 5.31 -0.61 2.71 1.01 -0.65 -4.08 121.20 125.40 1x5x s ILE 43 Ca -0.06 0.21 -0.23 0.00 0.00 0.00 0.00 60.65 60.57 1x5x s ILE 43 Cb -0.10 -3.54 0.06 0.00 0.01 0.00 0.00 42.46 38.89 1x5x s ILE 43 CO -0.00 0.27 0.91 -0.22 0.00 0.00 0.00 174.94 175.90 1x5x s LEU 44 N 1.60 4.38 0.33 2.97 2.96 -1.17 -2.84 118.68 126.91 1x5x s LEU 44 Ca 0.08 -0.79 0.01 0.00 -0.22 0.00 0.00 54.13 53.21 1x5x s LEU 44 Cb -0.15 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 43.96 1x5x s LEU 44 CO 0.09 -1.31 0.52 -1.61 -1.32 0.00 0.00 176.35 172.72 1x5x s GLU 45 N 3.84 3.46 -0.28 1.98 8.01 -1.10 -2.37 118.70 132.24 1x5x s GLU 45 Ca 0.24 -0.43 -0.19 0.00 0.01 0.00 0.00 54.97 54.60 1x5x s GLU 45 Cb -0.16 -2.70 0.10 0.00 -4.31 0.00 0.00 34.13 27.05 1x5x s GLU 45 CO 0.13 0.19 0.80 1.41 0.01 0.00 0.00 175.26 177.80 1x5x s MET 46 N -4.26 0.65 0.05 1.61 1.75 -0.88 -2.60 119.30 115.61 1x5x s MET 46 Ca 0.39 0.98 -0.06 0.00 -1.25 0.00 0.00 55.69 55.75 1x5x s MET 46 Cb -0.09 0.20 -0.01 0.00 2.84 0.00 0.00 34.83 37.77 1x5x s MET 46 CO 0.35 -0.11 0.10 -1.21 -0.65 0.00 0.00 175.02 173.50 1x5x s GLU 47 N 1.10 0.64 0.05 4.11 0.41 -1.25 -3.42 118.70 120.34 1x5x s GLU 47 Ca -0.06 -0.84 0.05 0.00 -0.41 0.00 0.00 54.97 53.72 1x5x s GLU 47 Cb -0.05 0.25 -0.04 0.00 -1.78 0.00 0.00 34.13 32.52 1x5x s GLU 47 CO -0.12 -0.17 -0.09 -1.21 -0.49 0.00 0.00 175.26 173.18 1x5x s GLU 48 N -2.98 2.31 0.19 1.61 0.41 -1.26 -3.14 118.70 115.84 1x5x s GLU 48 Ca -0.02 -0.88 0.00 0.00 -0.41 0.00 0.00 54.97 53.66 1x5x s GLU 48 Cb 0.01 -2.38 0.00 0.00 -1.78 0.00 0.00 34.13 29.98 1x5x s GLU 48 CO -0.06 0.55 0.00 -1.91 -0.49 0.00 0.00 175.26 173.35 1x5x n GLU 49 N 1.18 -1.27 0.00 1.61 4.07 -1.26 -4.98 120.64 120.00 1x5x n GLU 49 Ca -0.14 0.93 0.00 0.00 -0.06 0.00 0.00 57.16 57.88 1x5x n GLU 49 Cb 0.52 -1.52 0.00 0.00 -0.06 0.00 0.00 31.44 30.39 1x5x n GLU 49 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1x5x n THR 50 N -3.08 0.00 -0.02 6.31 -2.24 -1.26 -4.49 114.28 109.49 1x5x n THR 50 Ca -0.01 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1x5x n THR 50 Cb 0.27 0.00 -0.00 0.00 -2.10 0.00 0.00 70.33 68.50 1x5x n THR 50 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 1x5x h SER 51 N 0.00 0.00 0.00 3.42 0.87 -1.99 -3.49 113.55 112.37 1x5x h SER 51 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1x5x h SER 51 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1x5x h SER 51 CO 0.00 0.21 0.00 0.61 -0.53 0.00 0.00 176.83 177.12 1x5x n GLY 52 N 1.90 -1.79 0.63 5.77 0.00 -1.26 -5.01 105.19 105.43 1x5x n GLY 52 Ca -0.00 0.65 0.09 0.00 0.00 0.00 0.00 46.02 46.76 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 0.00 0.00 -0.31 1.61 4.01 -1.26 -4.29 117.16 116.92 1x5x n TYR 53 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1x5x n TYR 53 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 1.08 0.59 3.00 2.72 0.00 -1.26 -5.06 105.19 106.26 1x5x n GLY 54 Ca 0.10 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.57 1x5x n GLY 54 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x5x n PHE 55 N -0.24 1.26 -3.74 1.61 3.01 -1.26 -4.89 117.46 113.20 1x5x n PHE 55 Ca 0.00 0.83 -0.32 0.00 1.01 0.00 0.00 57.45 58.97 1x5x n PHE 55 Cb 0.25 -1.93 -0.05 0.00 -0.01 0.00 0.00 39.48 37.75 1x5x n PHE 55 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1x5x s LYS 56 N 3.78 3.57 0.62 -1.08 -0.14 -1.22 -4.83 119.74 120.45 1x5x s LYS 56 Ca 0.96 -0.17 -0.14 0.00 -1.36 0.00 0.00 55.97 55.26 1x5x s LYS 56 Cb -1.28 -2.93 -0.02 0.00 -1.68 0.00 0.00 37.83 31.91 1x5x s LYS 56 CO 0.64 0.53 1.05 -1.25 -0.76 0.00 0.00 175.35 175.56 1x5x s PRO 57 N -2.48 3.24 0.08 -1.68 0.04 -1.26 -2.07 135.00 130.87 1x5x s PRO 57 Ca 0.37 1.09 0.00 0.00 0.04 0.00 0.00 61.00 62.51 1x5x s PRO 57 Cb -0.13 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1x5x s PRO 57 CO 0.24 -0.86 0.00 1.63 0.04 0.00 0.00 177.00 178.05 1x5x n LYS 58 N -2.38 0.00 -4.24 4.56 5.02 -1.00 -4.92 118.16 115.21 1x5x n LYS 58 Ca 0.08 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.06 1x5x n LYS 58 Cb 0.53 -0.06 -0.09 0.00 -0.02 0.00 0.00 35.03 35.39 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 -2.00 2.91 -0.47 2.13 5.04 -1.22 -4.99 117.35 118.76 1x5x s TYR 59 Ca 0.00 -0.05 0.06 0.00 -2.44 0.00 0.00 57.07 54.63 1x5x s TYR 59 Cb 0.00 -1.54 0.18 0.00 0.35 0.00 0.00 41.96 40.95 1x5x s TYR 59 CO 0.00 0.44 0.55 -0.40 -1.34 0.00 0.00 175.55 174.80 1x5x n ASP 60 N 0.89 -2.03 -4.06 4.32 5.75 -1.26 -3.06 116.55 117.11 1x5x n ASP 60 Ca -0.13 -2.67 -0.11 0.00 -0.01 0.00 0.00 54.79 51.87 1x5x n ASP 60 Cb 0.52 0.65 -0.08 0.00 -1.03 0.00 0.00 41.12 41.19 1x5x n ASP 60 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1x5x s GLY 61 N 0.42 1.16 -0.62 6.12 0.00 -1.26 -5.05 107.32 108.10 1x5x s GLY 61 Ca 0.31 -1.42 -0.02 0.00 0.00 0.00 0.00 44.72 43.59 1x5x s GLY 61 CO -0.12 -1.12 2.07 -1.84 0.00 0.00 0.00 173.10 172.09 1x5x n GLU 62 N -0.33 2.52 -4.26 2.90 0.28 -1.26 -2.76 120.64 117.72 1x5x n GLU 62 Ca 0.01 -2.95 -0.29 0.00 -0.16 0.00 0.00 57.16 53.76 1x5x n GLU 62 Cb 0.64 -2.15 -0.10 0.00 1.43 0.00 0.00 31.44 31.26 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 -1.25 4.21 -0.33 -1.84 1.01 -1.26 -4.84 116.67 112.36 1x5x s ASP 63 Ca 0.57 -0.48 0.06 0.00 0.71 0.00 0.00 52.55 53.41 1x5x s ASP 63 Cb 0.44 -0.72 0.63 0.00 1.01 0.00 0.00 42.92 44.28 1x5x s ASP 63 CO -0.07 0.16 1.73 0.18 0.21 0.00 0.00 175.17 177.38 1x5x n LEU 64 N 0.61 5.89 -3.62 1.23 4.77 -1.26 -4.69 117.00 119.93 1x5x n LEU 64 Ca -0.14 -3.09 -0.10 0.00 -0.03 0.00 0.00 56.01 52.65 1x5x n LEU 64 Cb 0.53 -0.75 -0.06 0.00 -2.33 0.00 0.00 43.42 40.80 1x5x n LEU 64 CO 0.32 0.84 0.71 0.00 -1.33 0.00 0.00 177.39 177.94 1x5x s ALA 65 N -2.76 -1.94 0.09 -1.18 0.00 -1.26 -3.02 121.76 111.69 1x5x s ALA 65 Ca 0.49 1.78 -0.15 0.00 0.00 0.00 0.00 51.96 54.08 1x5x s ALA 65 Cb 0.40 -1.15 0.03 0.00 0.00 0.00 0.00 23.12 22.39 1x5x s ALA 65 CO 0.11 -0.27 0.34 -0.47 0.00 0.00 0.00 175.76 175.48 1x5x s TYR 66 N -0.19 -0.13 -0.40 0.00 5.04 -1.21 -5.07 117.35 115.40 1x5x s TYR 66 Ca 0.01 -0.12 0.00 0.00 -2.44 0.00 0.00 57.07 54.52 1x5x s TYR 66 Cb -0.04 0.16 0.11 0.00 0.35 0.00 0.00 41.96 42.54 1x5x s TYR 66 CO -0.03 -0.61 0.16 0.99 -1.34 0.00 0.00 175.55 174.72 1x5x s THR 67 N -3.31 2.89 0.45 4.34 2.01 -1.26 -2.59 115.64 118.17 1x5x s THR 67 Ca 0.00 -2.25 -0.25 0.00 0.31 0.00 0.00 61.69 59.50 1x5x s THR 67 Cb 0.01 -3.03 -0.08 0.00 0.01 0.00 0.00 72.50 69.41 1x5x s THR 67 CO -0.08 -0.67 1.37 -0.69 -0.69 0.00 0.00 174.62 173.86 1x5x s VAL 68 N 0.95 2.26 0.26 3.82 1.01 -0.11 -4.83 120.40 123.76 1x5x s VAL 68 Ca 0.10 0.22 0.01 0.00 0.00 0.00 0.00 61.98 62.32 1x5x s VAL 68 Cb -0.21 -3.13 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1x5x s VAL 68 CO -0.05 0.03 0.11 -0.54 0.00 0.00 0.00 175.10 174.64 1x5x s LYS 69 N -2.47 1.43 -0.66 2.72 1.02 -1.26 -1.87 119.74 118.65 1x5x s LYS 69 Ca 0.62 -1.78 -0.04 0.00 0.02 0.00 0.00 55.97 54.78 1x5x s LYS 69 Cb -0.41 -0.18 0.00 0.00 -0.52 0.00 0.00 37.83 36.73 1x5x s LYS 69 CO 0.52 -0.34 0.67 0.09 -0.92 0.00 0.00 175.35 175.38 1x5x n ASN 70 N -0.54 -7.82 -1.30 2.83 3.02 -1.16 -4.92 115.26 105.38 1x5x n ASN 70 Ca 0.00 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 1x5x n ASN 70 Cb 0.66 -5.32 0.00 0.00 -0.61 0.00 0.00 39.78 34.51 1x5x n ASN 70 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1x5x n LEU 71 N -1.40 0.00 -4.21 3.41 4.77 -1.24 -5.01 117.00 113.31 1x5x n LEU 71 Ca 0.03 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.77 1x5x n LEU 71 Cb 0.49 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.44 1x5x n LEU 71 CO 0.51 0.00 -0.50 -0.13 -1.33 0.00 0.00 177.39 175.94 1x5x s ARG 72 N -1.70 1.28 0.55 3.23 3.00 -1.26 -4.78 118.95 119.27 1x5x s ARG 72 Ca 0.00 -0.85 -0.20 0.00 0.00 0.00 0.00 55.73 54.69 1x5x s ARG 72 Cb 0.00 -1.34 -0.05 0.00 0.00 0.00 0.00 34.95 33.56 1x5x s ARG 72 CO 0.00 0.34 1.17 -0.98 0.00 0.00 0.00 175.30 175.84 1x5x s ARG 73 N -1.05 3.25 -0.51 3.54 3.03 -1.19 -3.99 118.95 122.02 1x5x s ARG 73 Ca 0.06 1.74 -0.32 0.00 2.03 0.00 0.00 55.73 59.23 1x5x s ARG 73 Cb -0.08 -2.03 0.05 0.00 -1.03 0.00 0.00 34.95 31.86 1x5x s ARG 73 CO 0.01 -0.96 0.65 0.43 -1.13 0.00 0.00 175.30 174.30 1x5x n SER 74 N -1.31 -5.25 -3.97 -2.89 7.64 -0.93 -4.93 113.62 101.98 1x5x n SER 74 Ca 0.12 -0.31 -0.10 0.00 1.01 0.00 0.00 58.87 59.59 1x5x n SER 74 Cb 0.50 -1.56 -0.07 0.00 -1.01 0.00 0.00 64.21 62.07 1x5x n SER 74 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x5x s THR 75 N -1.71 0.05 -0.20 0.44 2.01 -1.26 -4.95 115.64 110.03 1x5x s THR 75 Ca 0.31 -1.40 0.01 0.00 0.31 0.00 0.00 61.69 60.93 1x5x s THR 75 Cb -0.03 -1.91 0.04 0.00 0.01 0.00 0.00 72.50 70.60 1x5x s THR 75 CO 0.87 -0.23 -0.15 -1.59 -0.69 0.00 0.00 174.62 172.83 1x5x s LYS 76 N -3.98 2.52 0.07 4.92 -2.85 -1.26 -3.01 119.74 116.15 1x5x s LYS 76 Ca 0.19 -0.93 0.07 0.00 -1.00 0.00 0.00 55.97 54.30 1x5x s LYS 76 Cb 0.03 -2.57 -0.03 0.00 -2.06 0.00 0.00 37.83 33.20 1x5x s LYS 76 CO 0.02 -0.35 -0.20 0.71 0.10 0.00 0.00 175.35 175.63 1x5x s TYR 77 N 1.29 1.74 0.46 1.78 2.02 -1.00 -4.91 117.35 118.72 1x5x s TYR 77 Ca 0.00 -0.39 0.02 0.00 -0.37 0.00 0.00 57.07 56.33 1x5x s TYR 77 Cb -0.15 -1.00 0.01 0.00 -0.40 0.00 0.00 41.96 40.41 1x5x s TYR 77 CO -0.10 0.13 0.66 0.21 -1.57 0.00 0.00 175.55 174.89 1x5x s LYS 78 N -1.49 2.90 -0.09 -0.62 2.20 -1.19 -2.50 119.74 118.95 1x5x s LYS 78 Ca 0.06 -0.72 -0.31 0.00 -0.36 0.00 0.00 55.97 54.64 1x5x s LYS 78 Cb -0.09 -2.60 0.09 0.00 -1.51 0.00 0.00 37.83 33.72 1x5x s LYS 78 CO 0.03 -0.35 0.79 -0.06 -0.36 0.00 0.00 175.35 175.39 1x5x s PHE 79 N -2.54 -0.56 -0.20 4.03 0.08 -0.57 -3.81 117.98 114.41 1x5x s PHE 79 Ca 0.51 0.97 -0.12 0.00 0.12 0.00 0.00 56.93 58.41 1x5x s PHE 79 Cb -0.10 0.42 0.06 0.00 -0.57 0.00 0.00 43.02 42.83 1x5x s PHE 79 CO 0.37 -0.52 0.49 -1.59 -0.10 0.00 0.00 175.22 173.87 1x5x s LYS 80 N -1.15 0.50 -0.08 0.44 -2.85 -1.07 -0.79 119.74 114.74 1x5x s LYS 80 Ca -0.08 0.87 -0.19 0.00 -1.00 0.00 0.00 55.97 55.57 1x5x s LYS 80 Cb -0.00 0.07 -0.04 0.00 -2.06 0.00 0.00 37.83 35.80 1x5x s LYS 80 CO 0.07 -0.14 0.54 0.54 0.10 0.00 0.00 175.35 176.46 1x5x s VAL 81 N 1.23 5.10 -0.15 1.79 0.11 -1.26 -2.70 120.40 124.52 1x5x s VAL 81 Ca -0.08 1.09 0.01 0.00 -2.93 0.00 0.00 61.98 60.07 1x5x s VAL 81 Cb -0.07 -3.87 0.02 0.00 -1.53 0.00 0.00 36.38 30.93 1x5x s VAL 81 CO -0.12 0.34 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.21 1x5x s ILE 82 N 0.42 1.70 -0.35 7.04 1.01 -1.13 -1.75 121.20 128.14 1x5x s ILE 82 Ca 0.29 -0.72 -0.19 0.00 0.00 0.00 0.00 60.65 60.03 1x5x s ILE 82 Cb -0.16 -1.57 -0.00 0.00 0.01 0.00 0.00 42.46 40.74 1x5x s ILE 82 CO 0.13 0.48 0.56 0.00 0.00 0.00 0.00 174.94 176.11 1x5x s ALA 83 N 1.39 3.47 0.25 9.38 0.00 -1.26 -1.64 121.76 133.35 1x5x s ALA 83 Ca 0.04 -0.97 0.10 0.00 0.00 0.00 0.00 51.96 51.13 1x5x s ALA 83 Cb -0.13 -3.08 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1x5x s ALA 83 CO -0.10 -1.28 -0.16 1.52 0.00 0.00 0.00 175.76 175.74 1x5x s TYR 84 N 2.51 2.04 0.14 0.00 -0.85 -0.99 -2.78 117.35 117.42 1x5x s TYR 84 Ca 0.21 -0.47 0.09 0.00 -0.52 0.00 0.00 57.07 56.38 1x5x s TYR 84 Cb -0.15 -0.94 -0.04 0.00 0.38 0.00 0.00 41.96 41.20 1x5x s TYR 84 CO 0.14 0.53 -0.21 -0.80 -1.52 0.00 0.00 175.55 173.69 1x5x s ASN 85 N -3.43 2.80 0.58 -0.18 0.01 0.58 -3.75 114.94 111.55 1x5x s ASN 85 Ca 0.27 -0.79 0.36 0.00 -0.71 0.00 0.00 52.86 52.00 1x5x s ASN 85 Cb -0.02 -0.17 1.35 0.00 0.41 0.00 0.00 41.25 42.81 1x5x s ASN 85 CO 0.12 0.04 1.53 0.28 -1.51 0.00 0.00 177.10 177.55 1x5x h SER 86 N 3.60 0.00 -0.06 -1.22 0.02 -1.99 1.43 113.55 115.34 1x5x h SER 86 Ca -0.45 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.44 1x5x h SER 86 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1x5x h SER 86 CO 0.45 0.00 -0.19 -0.33 -1.14 0.00 0.00 176.83 175.62 1x5x h GLU 87 N 0.00 0.24 0.00 3.45 5.08 -1.98 -3.49 114.58 117.87 1x5x h GLU 87 Ca 0.63 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.81 1x5x h GLU 87 Cb 2.95 0.03 0.00 0.00 0.50 0.00 0.00 28.75 32.23 1x5x h GLU 87 CO -0.01 0.80 0.00 0.41 -1.00 0.00 0.00 179.01 179.21 1x5x n GLY 88 N 0.60 1.78 3.27 -3.84 0.00 0.49 -5.16 105.19 102.32 1x5x n GLY 88 Ca -0.08 -0.52 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 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 1.43 1.09 0.00 1.61 -2.85 -1.26 0.22 119.74 119.98 1x5x s LYS 89 Ca 0.00 -1.30 0.00 0.00 -1.00 0.00 0.00 55.97 53.67 1x5x s LYS 89 Cb 0.00 -1.00 0.00 0.00 -2.06 0.00 0.00 37.83 34.77 1x5x s LYS 89 CO 0.00 0.19 0.00 0.43 0.10 0.00 0.00 175.35 176.07 1x5x n SER 90 N 0.42 0.71 -4.80 0.03 7.64 -1.12 -4.94 113.62 111.56 1x5x n SER 90 Ca -0.14 -0.43 -0.34 0.00 1.01 0.00 0.00 58.87 58.96 1x5x n SER 90 Cb 0.57 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.73 1x5x n SER 90 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1x5x s ASN 91 N -0.60 6.47 0.76 6.43 0.01 -1.26 -4.85 114.94 121.90 1x5x s ASN 91 Ca 0.00 1.88 -0.11 0.00 -0.71 0.00 0.00 52.86 53.92 1x5x s ASN 91 Cb 0.00 -2.56 0.05 0.00 0.41 0.00 0.00 41.25 39.15 1x5x s ASN 91 CO 0.00 -0.69 1.08 -2.16 -1.51 0.00 0.00 177.10 173.82 1x5x s PRO 92 N -3.21 2.40 0.61 -0.60 0.04 -1.26 -4.51 135.00 128.47 1x5x s PRO 92 Ca 0.66 0.76 0.04 0.00 0.04 0.00 0.00 61.00 62.50 1x5x s PRO 92 Cb -0.15 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.53 1x5x s PRO 92 CO 0.19 -1.43 0.85 0.45 0.04 0.00 0.00 177.00 177.09 1x5x s SER 93 N -3.86 4.88 0.21 6.66 0.15 -0.71 -4.90 113.70 116.12 1x5x s SER 93 Ca 0.60 -0.48 -0.32 0.00 0.70 0.00 0.00 55.95 56.45 1x5x s SER 93 Cb -0.14 -0.11 -0.14 0.00 -1.71 0.00 0.00 66.02 63.91 1x5x s SER 93 CO 0.54 -1.46 1.43 -0.62 1.20 0.00 0.00 173.24 174.33 1x5x n GLU 94 N -2.46 1.95 -2.69 5.44 1.02 -1.26 -4.66 120.64 117.98 1x5x n GLU 94 Ca 0.13 0.70 -0.42 0.00 -0.02 0.00 0.00 57.16 57.55 1x5x n GLU 94 Cb 0.61 -2.37 -0.03 0.00 -0.02 0.00 0.00 31.44 29.63 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 0.20 4.78 0.32 2.62 1.01 -1.26 -4.62 120.40 123.45 1x5x s VAL 95 Ca 0.72 2.03 0.08 0.00 0.00 0.00 0.00 61.98 64.81 1x5x s VAL 95 Cb -0.69 -4.31 -0.04 0.00 0.00 0.00 0.00 36.38 31.35 1x5x s VAL 95 CO 0.47 0.00 0.19 0.68 0.00 0.00 0.00 175.10 176.43 1x5x s VAL 96 N 2.04 3.40 0.04 2.92 -7.23 0.03 -4.94 120.40 116.66 1x5x s VAL 96 Ca 0.48 -1.57 0.05 0.00 -1.81 0.00 0.00 61.98 59.12 1x5x s VAL 96 Cb -0.18 -3.08 -0.02 0.00 0.56 0.00 0.00 36.38 33.65 1x5x s VAL 96 CO 0.17 -0.22 -0.14 -0.70 -0.31 0.00 0.00 175.10 173.91 1x5x s GLU 97 N -3.88 0.90 0.22 4.82 -6.30 -1.26 -1.51 118.70 111.69 1x5x s GLU 97 Ca 0.38 -0.77 -0.09 0.00 -2.50 0.00 0.00 54.97 51.99 1x5x s GLU 97 Cb -0.05 -0.91 -0.01 0.00 0.00 0.00 0.00 34.13 33.17 1x5x s GLU 97 CO 0.24 0.22 0.36 -0.06 0.02 0.00 0.00 175.26 176.04 1x5x s PHE 98 N -0.89 0.53 0.24 5.30 0.08 -1.04 -5.04 117.98 117.16 1x5x s PHE 98 Ca 0.01 -0.86 0.03 0.00 0.12 0.00 0.00 56.93 56.23 1x5x s PHE 98 Cb -0.08 -0.02 -0.05 0.00 -0.57 0.00 0.00 43.02 42.29 1x5x s PHE 98 CO 0.01 -0.85 0.02 0.99 -0.10 0.00 0.00 175.22 175.29 1x5x s THR 99 N -4.03 0.93 0.50 0.64 2.01 -1.26 -2.39 115.64 112.04 1x5x s THR 99 Ca 0.24 -2.02 0.06 0.00 0.31 0.00 0.00 61.69 60.28 1x5x s THR 99 Cb 0.02 -2.41 0.01 0.00 0.01 0.00 0.00 72.50 70.13 1x5x s THR 99 CO 0.07 -0.26 0.31 0.42 -0.69 0.00 0.00 174.62 174.47 1x5x s THR 100 N -3.49 1.83 0.47 -0.82 -4.23 -1.16 -4.75 115.64 103.48 1x5x s THR 100 Ca 0.30 -1.58 0.02 0.00 -1.18 0.00 0.00 61.69 59.25 1x5x s THR 100 Cb 0.06 -2.41 0.01 0.00 1.34 0.00 0.00 72.50 71.51 1x5x s THR 100 CO 0.10 0.00 0.68 0.00 -0.54 0.00 0.00 174.62 174.86 1x5x s PRO 102 N -4.58 4.37 -0.62 0.00 0.04 -1.26 -2.20 135.00 130.76 1x5x s PRO 102 Ca 0.52 1.63 -0.23 0.00 0.04 0.00 0.00 61.00 62.96 1x5x s PRO 102 Cb -0.10 -2.83 0.06 0.00 0.04 0.00 0.00 34.50 31.67 1x5x s PRO 102 CO 0.37 0.02 0.93 0.34 0.04 0.00 0.00 177.00 178.70 1x5x s ASP 103 N -1.27 6.22 -0.29 6.66 2.15 -1.26 -4.91 116.67 123.97 1x5x s ASP 103 Ca 0.52 -0.81 -0.20 0.00 0.43 0.00 0.00 52.55 52.50 1x5x s ASP 103 Cb -0.26 -2.41 0.17 0.00 -0.30 0.00 0.00 42.92 40.11 1x5x s ASP 103 CO 0.33 -1.34 1.17 -0.94 -0.17 0.00 0.00 175.17 174.22 1x5x s SER 104 N 3.37 -0.27 0.00 -0.34 1.04 -1.26 -5.09 113.70 111.15 1x5x s SER 104 Ca 0.24 0.46 0.00 0.00 0.48 0.00 0.00 55.95 57.13 1x5x s SER 104 Cb -0.16 0.86 0.00 0.00 0.10 0.00 0.00 66.02 66.82 1x5x s SER 104 CO 0.13 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1x5x n GLY 105 N 2.80 -2.54 3.74 7.32 0.00 -1.26 -5.01 105.19 110.24 1x5x n GLY 105 Ca -0.15 -0.29 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 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 -0.03 4.60 0.46 1.61 0.04 -1.26 -4.83 135.00 135.60 1x5x s PRO 106 Ca 0.00 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.79 1x5x s PRO 106 Cb 0.00 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.29 1x5x s PRO 106 CO 0.00 0.11 0.00 0.43 0.04 0.00 0.00 177.00 177.58 1x5x n SER 107 N 2.05 -8.34 -3.63 6.66 7.64 -1.26 -5.00 113.62 111.74 1x5x n SER 107 Ca 0.02 0.96 -0.11 0.00 1.01 0.00 0.00 58.87 60.75 1x5x n SER 107 Cb 0.46 -4.47 -0.07 0.00 -1.01 0.00 0.00 64.21 59.11 1x5x n SER 107 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1x5x s SER 108 N -7.14 -0.82 0.00 6.43 0.15 -1.26 -5.19 113.70 105.87 1x5x s SER 108 Ca 0.00 1.47 0.09 0.00 0.70 0.00 0.00 55.95 58.22 1x5x s SER 108 Cb 0.00 1.44 0.07 0.00 -1.71 0.00 0.00 66.02 65.82 1x5x s SER 108 CO 0.00 -0.25 0.80 0.61 1.20 0.00 0.00 173.24 175.60