#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 7.38 -0.42 1.61 0.15 -1.26 -5.02 113.70 116.14 1x5x s SER 2 Ca 0.00 2.08 0.02 0.00 0.70 0.00 0.00 55.95 58.75 1x5x s SER 2 Cb 0.00 -2.61 0.12 0.00 -1.71 0.00 0.00 66.02 61.82 1x5x s SER 2 CO 0.00 -0.10 0.18 -0.94 1.20 0.00 0.00 173.24 173.58 1x5x s SER 3 N -0.55 4.10 0.00 5.45 1.04 -1.26 -5.03 113.70 117.45 1x5x s SER 3 Ca 0.46 -2.46 0.00 0.00 0.48 0.00 0.00 55.95 54.43 1x5x s SER 3 Cb -0.29 -1.27 0.00 0.00 0.10 0.00 0.00 66.02 64.56 1x5x s SER 3 CO 0.35 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.88 1x5x n GLY 4 N 3.81 4.23 3.36 7.32 0.00 -1.26 -5.17 105.19 117.48 1x5x n GLY 4 Ca 0.05 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.38 0.29 1.61 1.04 -1.26 -5.18 113.70 109.83 1x5x s SER 5 Ca 0.00 0.11 0.07 0.00 0.48 0.00 0.00 55.95 56.61 1x5x s SER 5 Cb 0.00 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.55 1x5x s SER 5 CO 0.00 -0.69 0.24 -0.94 0.98 0.00 0.00 173.24 172.83 1x5x s SER 6 N -1.96 5.37 0.00 7.02 1.04 -1.26 -5.11 113.70 118.81 1x5x s SER 6 Ca -0.06 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 55.99 1x5x s SER 6 Cb -0.01 -1.17 0.00 0.00 0.10 0.00 0.00 66.02 64.94 1x5x s SER 6 CO -0.02 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1x5x n GLY 7 N -1.26 3.66 3.77 7.32 0.00 -1.26 -4.82 105.19 112.60 1x5x n GLY 7 Ca -0.05 -0.97 -0.38 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.40 4.39 0.00 1.61 0.04 -1.26 -5.04 135.00 132.35 1x5x s PRO 8 Ca 0.00 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1x5x s PRO 8 Cb 0.00 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.69 1x5x s PRO 8 CO 0.00 0.04 0.00 0.43 0.04 0.00 0.00 177.00 177.51 1x5x n SER 9 N 0.53 -1.66 -4.67 6.66 7.64 -1.26 -4.69 113.62 116.17 1x5x n SER 9 Ca 0.02 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.47 1x5x n SER 9 Cb 0.47 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.65 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 -2.49 4.30 0.93 1.43 1.75 -1.26 -4.84 119.30 119.11 1x5x s MET 10 Ca 0.00 1.55 -0.13 0.00 -1.25 0.00 0.00 55.69 55.87 1x5x s MET 10 Cb 0.00 -3.65 0.15 0.00 2.84 0.00 0.00 34.83 34.17 1x5x s MET 10 CO 0.00 -0.57 1.14 -1.25 -0.65 0.00 0.00 175.02 173.70 1x5x s PRO 11 N 2.89 1.01 0.07 4.11 0.04 -1.26 -4.80 135.00 137.06 1x5x s PRO 11 Ca 0.51 0.24 -0.23 0.00 0.04 0.00 0.00 61.00 61.56 1x5x s PRO 11 Cb -0.20 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.44 1x5x s PRO 11 CO 0.15 -2.27 0.71 0.00 0.04 0.00 0.00 177.00 175.63 1x5x s ALA 12 N -3.30 3.44 0.39 8.56 0.00 -1.26 -4.65 121.76 124.95 1x5x s ALA 12 Ca 0.65 0.22 -0.24 0.00 0.00 0.00 0.00 51.96 52.59 1x5x s ALA 12 Cb -0.14 -2.89 -0.13 0.00 0.00 0.00 0.00 23.12 19.96 1x5x s ALA 12 CO 0.53 0.19 0.66 -1.13 0.00 0.00 0.00 175.76 176.01 1x5x n SER 13 N 2.31 -0.38 -4.69 0.00 3.41 -1.26 -4.49 113.62 108.50 1x5x n SER 13 Ca -0.05 0.97 -0.42 0.00 -0.26 0.00 0.00 58.87 59.10 1x5x n SER 13 Cb 0.50 -1.15 -0.03 0.00 -0.26 0.00 0.00 64.21 63.27 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 4.37 0.25 4.33 0.04 -1.26 -4.82 135.00 136.31 1x5x s PRO 14 Ca 0.63 1.71 -0.04 0.00 0.04 0.00 0.00 61.00 63.34 1x5x s PRO 14 Cb -0.63 -3.51 0.06 0.00 0.04 0.00 0.00 34.50 30.46 1x5x s PRO 14 CO 0.58 -0.40 0.34 1.33 0.04 0.00 0.00 177.00 178.89 1x5x n VAL 15 N 4.45 0.00 -3.58 -0.36 0.24 0.76 -4.79 118.33 115.04 1x5x n VAL 15 Ca 0.10 -0.30 -0.29 0.00 -2.04 0.00 0.00 64.34 61.82 1x5x n VAL 15 Cb 0.46 -1.74 -0.12 0.00 -1.47 0.00 0.00 33.84 30.97 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 1.96 0.05 1.34 2.96 -1.26 -2.39 118.68 121.34 1x5x s LEU 16 Ca 0.20 -2.57 -0.35 0.00 -0.22 0.00 0.00 54.13 51.19 1x5x s LEU 16 Cb -0.01 -0.74 -0.20 0.00 0.50 0.00 0.00 46.19 45.75 1x5x s LEU 16 CO 0.14 -0.26 1.48 0.71 -1.32 0.00 0.00 176.35 177.10 1x5x h THR 17 N 5.05 0.04 -3.96 3.68 1.35 -1.57 -3.44 112.91 114.05 1x5x h THR 17 Ca 0.06 -0.06 -0.57 0.00 -0.55 0.00 0.00 66.41 65.28 1x5x h THR 17 Cb 0.93 0.04 -0.31 0.00 -1.73 0.00 0.00 68.15 67.08 1x5x h THR 17 CO 0.39 0.00 -0.84 -0.54 -0.25 0.00 0.00 175.52 174.28 1x5x s LYS 18 N -5.72 1.81 -0.22 4.72 1.02 -1.15 -5.04 119.74 115.15 1x5x s LYS 18 Ca -0.19 -0.64 -0.01 0.00 0.02 0.00 0.00 55.97 55.15 1x5x s LYS 18 Cb 0.02 -1.59 0.01 0.00 -0.52 0.00 0.00 37.83 35.76 1x5x s LYS 18 CO 0.57 0.27 -0.10 0.00 -0.92 0.00 0.00 175.35 175.17 1x5x s ALA 19 N -0.03 2.62 0.06 5.17 0.00 -1.26 -0.53 121.76 127.78 1x5x s ALA 19 Ca -0.02 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.63 1x5x s ALA 19 Cb -0.11 -1.54 0.00 0.00 0.00 0.00 0.00 23.12 21.47 1x5x s ALA 19 CO 0.02 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.63 1x5x n GLY 20 N 4.69 1.75 0.13 0.00 0.00 -0.12 -4.46 105.19 107.19 1x5x n GLY 20 Ca -0.18 -2.07 -0.22 0.00 0.00 0.00 0.00 46.02 43.54 1x5x n GLY 20 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1x5x n ILE 21 N -0.69 1.63 -1.22 -0.61 5.41 -1.26 0.95 119.36 123.57 1x5x n ILE 21 Ca 0.00 -0.45 0.09 0.00 1.00 0.00 0.00 62.75 63.38 1x5x n ILE 21 Cb 0.00 -1.76 0.13 0.00 -0.71 0.00 0.00 39.64 37.30 1x5x n ILE 21 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1x5x n THR 22 N -3.76 1.74 -3.65 1.39 -2.24 -1.26 -3.28 114.28 103.21 1x5x n THR 22 Ca -0.38 -2.16 -0.13 0.00 -2.27 0.00 0.00 64.05 59.12 1x5x n THR 22 Cb 0.93 -0.16 -0.06 0.00 -2.10 0.00 0.00 70.33 68.94 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 -2.63 -0.27 -0.05 4.78 1.48 -1.26 -2.27 118.94 118.71 1x5x s TRP 23 Ca 0.30 0.21 -0.02 0.00 -1.06 0.00 0.00 56.10 55.52 1x5x s TRP 23 Cb 0.27 0.24 0.03 0.00 -1.16 0.00 0.00 33.47 32.85 1x5x s TRP 23 CO 0.01 -0.60 0.08 -0.51 -4.06 0.00 0.00 176.95 171.88 1x5x s LEU 24 N -2.10 0.11 -0.59 -4.66 1.43 -0.97 -0.94 118.68 110.95 1x5x s LEU 24 Ca -0.04 0.09 -0.20 0.00 -1.03 0.00 0.00 54.13 52.96 1x5x s LEU 24 Cb -0.00 -0.07 0.09 0.00 0.03 0.00 0.00 46.19 46.24 1x5x s LEU 24 CO -0.04 -0.25 0.74 -0.44 0.23 0.00 0.00 176.35 176.59 1x5x s SER 25 N 2.19 6.19 0.14 2.29 0.01 0.31 -0.94 113.70 123.89 1x5x s SER 25 Ca 0.05 -1.31 0.03 0.00 1.31 0.00 0.00 55.95 56.02 1x5x s SER 25 Cb -0.12 -2.32 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 1x5x s SER 25 CO -0.04 -1.14 0.26 -0.76 0.41 0.00 0.00 173.24 171.96 1x5x s LEU 26 N 2.90 4.27 -0.03 2.44 1.43 -1.02 -1.42 118.68 127.26 1x5x s LEU 26 Ca 0.14 0.14 0.01 0.00 -1.03 0.00 0.00 54.13 53.38 1x5x s LEU 26 Cb -0.22 -2.85 0.02 0.00 0.03 0.00 0.00 46.19 43.17 1x5x s LEU 26 CO 0.07 0.07 -0.00 -1.58 0.23 0.00 0.00 176.35 175.14 1x5x s GLN 27 N -3.13 0.30 0.20 1.70 0.74 -1.01 -2.68 119.66 115.79 1x5x s GLN 27 Ca 0.34 0.05 0.03 0.00 0.05 0.00 0.00 55.36 55.83 1x5x s GLN 27 Cb -0.11 -0.45 -0.05 0.00 1.10 0.00 0.00 33.01 33.50 1x5x s GLN 27 CO 0.28 -0.10 -0.03 1.67 -0.55 0.00 0.00 175.29 176.55 1x5x s TRP 28 N 0.86 1.42 0.46 1.67 -2.14 -1.18 -0.17 118.94 119.86 1x5x s TRP 28 Ca -0.09 -0.90 0.03 0.00 2.66 0.00 0.00 56.10 57.80 1x5x s TRP 28 Cb -0.12 -0.80 -0.02 0.00 -3.10 0.00 0.00 33.47 29.43 1x5x s TRP 28 CO -0.01 -0.04 0.07 -1.54 -2.66 0.00 0.00 176.95 172.77 1x5x s SER 29 N -3.25 3.42 0.73 -2.66 1.04 -1.26 -4.55 113.70 107.17 1x5x s SER 29 Ca 0.25 -1.67 -0.11 0.00 0.48 0.00 0.00 55.95 54.90 1x5x s SER 29 Cb 0.05 0.52 0.04 0.00 0.10 0.00 0.00 66.02 66.73 1x5x s SER 29 CO 0.06 -0.90 1.10 -1.59 0.98 0.00 0.00 173.24 172.88 1x5x s LYS 30 N -3.78 2.50 -0.74 4.02 -2.85 -1.26 -4.35 119.74 113.28 1x5x s LYS 30 Ca 0.15 0.22 -0.06 0.00 -1.00 0.00 0.00 55.97 55.28 1x5x s LYS 30 Cb 0.02 -2.04 -0.12 0.00 -2.06 0.00 0.00 37.83 33.63 1x5x s LYS 30 CO 0.09 -1.21 2.62 -0.35 0.10 0.00 0.00 175.35 176.61 1x5x n PRO 31 N -3.06 2.27 -2.79 1.78 -0.04 -1.26 -4.65 135.00 127.26 1x5x n PRO 31 Ca 0.07 -1.37 -0.03 0.00 -0.04 0.00 0.00 63.50 62.13 1x5x n PRO 31 Cb 0.59 -2.31 -0.03 0.00 -0.04 0.00 0.00 33.50 31.71 1x5x n PRO 31 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5x n SER 32 N 3.42 -3.30 -2.91 3.54 2.88 -1.26 -4.44 113.62 111.56 1x5x n SER 32 Ca 0.49 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 59.23 1x5x n SER 32 Cb 0.38 -3.93 0.00 0.00 -0.75 0.00 0.00 64.21 59.91 1x5x n SER 32 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5x n GLY 33 N 1.94 0.00 3.47 0.46 0.00 -1.26 -4.83 105.19 104.97 1x5x n GLY 33 Ca -0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 1x5x n GLY 33 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1x5x n THR 34 N 1.44 0.00 -0.65 2.61 -2.24 -1.26 -5.00 114.28 109.18 1x5x n THR 34 Ca 0.00 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1x5x n THR 34 Cb 0.37 -0.72 0.00 0.00 -2.10 0.00 0.00 70.33 67.87 1x5x n THR 34 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1x5x n PRO 35 N -2.45 -0.29 -1.55 -0.78 -0.04 -1.26 -4.96 135.00 123.67 1x5x n PRO 35 Ca 0.08 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.14 1x5x n PRO 35 Cb 0.54 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.03 1x5x n PRO 35 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x5x n SER 36 N -2.58 0.19 -1.71 3.54 7.64 -1.26 -4.47 113.62 114.97 1x5x n SER 36 Ca 0.00 0.87 0.00 0.00 1.01 0.00 0.00 58.87 60.75 1x5x n SER 36 Cb 0.00 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 61.92 1x5x n SER 36 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1x5x n ASP 37 N 0.26 -6.64 -2.87 6.43 2.03 -1.26 -5.06 116.55 109.43 1x5x n ASP 37 Ca 0.11 1.05 -0.06 0.00 0.52 0.00 0.00 54.79 56.42 1x5x n ASP 37 Cb 0.44 -3.63 0.02 0.00 -0.72 0.00 0.00 41.12 37.23 1x5x n ASP 37 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1x5x n GLU 38 N 1.18 0.88 0.00 -0.67 4.71 -1.26 -4.82 120.64 120.65 1x5x n GLU 38 Ca 0.00 -0.93 0.00 0.00 -0.01 0.00 0.00 57.16 56.22 1x5x n GLU 38 Cb 0.00 -0.07 0.00 0.00 -1.01 0.00 0.00 31.44 30.36 1x5x n GLU 38 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1x5x n GLY 39 N 2.89 1.43 3.77 0.62 0.00 -1.26 -5.07 105.19 107.57 1x5x n GLY 39 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 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 2.88 0.26 -0.61 1.01 -1.26 -4.85 121.20 116.63 1x5x s ILE 40 Ca 0.00 0.71 0.11 0.00 0.00 0.00 0.00 60.65 61.47 1x5x s ILE 40 Cb 0.00 -3.39 -0.05 0.00 0.01 0.00 0.00 42.46 39.04 1x5x s ILE 40 CO 0.00 0.04 -0.13 -0.44 0.00 0.00 0.00 174.94 174.41 1x5x s SER 41 N -1.11 3.95 -0.05 3.58 0.01 -0.85 -4.74 113.70 114.49 1x5x s SER 41 Ca 0.61 -0.85 0.02 0.00 1.31 0.00 0.00 55.95 57.04 1x5x s SER 41 Cb -0.33 -0.51 0.01 0.00 0.21 0.00 0.00 66.02 65.40 1x5x s SER 41 CO 0.41 0.04 -0.10 -0.31 0.41 0.00 0.00 173.24 173.68 1x5x s TYR 42 N -2.31 1.21 -0.16 2.43 1.51 -1.02 -0.75 117.35 118.26 1x5x s TYR 42 Ca 0.29 -0.39 -0.08 0.00 -1.01 0.00 0.00 57.07 55.88 1x5x s TYR 42 Cb -0.06 -0.90 -0.04 0.00 -0.11 0.00 0.00 41.96 40.85 1x5x s TYR 42 CO 0.16 -0.21 0.13 0.42 -1.11 0.00 0.00 175.55 174.94 1x5x s ILE 43 N 0.54 5.39 -0.40 2.71 1.01 0.32 -3.98 121.20 126.80 1x5x s ILE 43 Ca -0.10 0.17 -0.11 0.00 0.00 0.00 0.00 60.65 60.61 1x5x s ILE 43 Cb -0.13 -3.40 0.05 0.00 0.01 0.00 0.00 42.46 38.98 1x5x s ILE 43 CO 0.02 0.53 0.24 -0.22 0.00 0.00 0.00 174.94 175.51 1x5x s LEU 44 N -0.31 4.95 0.36 2.97 2.96 -1.24 -0.54 118.68 127.83 1x5x s LEU 44 Ca 0.11 -1.18 0.04 0.00 -0.22 0.00 0.00 54.13 52.89 1x5x s LEU 44 Cb -0.12 -2.03 -0.01 0.00 0.50 0.00 0.00 46.19 44.53 1x5x s LEU 44 CO 0.01 -0.46 0.53 -1.61 -1.32 0.00 0.00 176.35 173.50 1x5x s GLU 45 N 1.53 3.14 -0.22 1.98 2.02 -1.06 -0.80 118.70 125.29 1x5x s GLU 45 Ca 0.02 -0.80 -0.16 0.00 0.02 0.00 0.00 54.97 54.05 1x5x s GLU 45 Cb -0.21 -2.74 0.06 0.00 0.10 0.00 0.00 34.13 31.35 1x5x s GLU 45 CO 0.05 -0.01 0.56 1.41 0.02 0.00 0.00 175.26 177.29 1x5x s MET 46 N -4.29 0.61 0.12 1.61 -2.45 -0.96 -3.03 119.30 110.90 1x5x s MET 46 Ca 0.45 0.88 -0.01 0.00 -1.25 0.00 0.00 55.69 55.76 1x5x s MET 46 Cb -0.10 0.20 -0.04 0.00 1.25 0.00 0.00 34.83 36.14 1x5x s MET 46 CO 0.33 -0.11 0.04 -2.00 1.05 0.00 0.00 175.02 174.33 1x5x s GLU 47 N 0.86 0.88 0.00 4.11 -6.30 -1.19 -3.02 118.70 114.04 1x5x s GLU 47 Ca -0.05 -1.40 0.00 0.00 -2.50 0.00 0.00 54.97 51.02 1x5x s GLU 47 Cb -0.05 0.24 0.00 0.00 0.00 0.00 0.00 34.13 34.32 1x5x s GLU 47 CO -0.07 -0.24 0.00 -1.91 0.02 0.00 0.00 175.26 173.06 1x5x n GLU 48 N -0.06 1.66 -0.11 4.30 2.13 -1.26 -1.44 120.64 125.86 1x5x n GLU 48 Ca -0.07 0.00 -0.14 0.00 0.66 0.00 0.00 57.16 57.61 1x5x n GLU 48 Cb 0.63 0.00 0.13 0.00 0.27 0.00 0.00 31.44 32.48 1x5x n GLU 48 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1x5x n GLU 49 N 0.00 -3.21 -1.64 5.31 2.13 -1.26 -4.80 120.64 117.16 1x5x n GLU 49 Ca 0.00 -0.66 -0.50 0.00 0.66 0.00 0.00 57.16 56.66 1x5x n GLU 49 Cb 0.00 -0.87 -0.05 0.00 0.27 0.00 0.00 31.44 30.78 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 -4.28 0.08 0.04 6.31 5.66 -1.26 -4.72 114.28 116.11 1x5x n THR 50 Ca 0.06 -0.01 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1x5x n THR 50 Cb 0.27 -1.24 0.00 0.00 -1.55 0.00 0.00 70.33 67.81 1x5x n THR 50 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1x5x n SER 51 N 3.50 -0.54 0.00 1.09 3.41 -1.26 -5.12 113.62 114.70 1x5x n SER 51 Ca 0.19 0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1x5x n SER 51 Cb 0.23 0.77 0.00 0.00 -0.26 0.00 0.00 64.21 64.95 1x5x n SER 51 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5x n GLY 52 N -0.34 0.71 1.10 5.00 0.00 -1.26 -5.08 105.19 105.32 1x5x n GLY 52 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 -3.18 0.00 1.61 4.01 -1.26 -5.18 117.16 113.16 1x5x n TYR 53 Ca 0.00 0.68 0.00 0.00 -0.16 0.00 0.00 57.90 58.42 1x5x n TYR 53 Cb 0.00 1.93 0.00 0.00 -0.31 0.00 0.00 39.34 40.96 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 -1.25 2.03 3.68 2.72 0.00 -1.26 -4.98 105.19 106.13 1x5x n GLY 54 Ca 0.00 -2.00 -0.45 0.00 0.00 0.00 0.00 46.02 43.57 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 1.07 2.43 -4.25 1.61 3.72 -1.26 -4.89 117.46 115.88 1x5x n PHE 55 Ca 0.00 0.11 -0.30 0.00 -0.05 0.00 0.00 57.45 57.21 1x5x n PHE 55 Cb 0.00 -2.62 -0.10 0.00 -0.94 0.00 0.00 39.48 35.82 1x5x n PHE 55 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1x5x s LYS 56 N 1.77 2.15 0.11 -1.08 -0.14 -1.17 -4.88 119.74 116.50 1x5x s LYS 56 Ca 0.81 -1.01 -0.30 0.00 -1.36 0.00 0.00 55.97 54.11 1x5x s LYS 56 Cb -0.62 -2.31 -0.06 0.00 -1.68 0.00 0.00 37.83 33.16 1x5x s LYS 56 CO 0.39 0.51 1.14 -1.25 -0.76 0.00 0.00 175.35 175.39 1x5x s PRO 57 N -2.15 4.51 -0.09 -1.68 0.04 -1.26 -2.27 135.00 132.09 1x5x s PRO 57 Ca 0.21 1.73 0.04 0.00 0.04 0.00 0.00 61.00 63.03 1x5x s PRO 57 Cb -0.11 -3.32 -0.09 0.00 0.04 0.00 0.00 34.50 31.02 1x5x s PRO 57 CO 0.13 -0.10 -0.03 1.63 0.04 0.00 0.00 177.00 178.67 1x5x n LYS 58 N 3.20 1.51 -4.45 4.56 5.02 0.02 -4.99 118.16 123.03 1x5x n LYS 58 Ca 0.06 0.03 -0.22 0.00 -2.02 0.00 0.00 58.31 56.15 1x5x n LYS 58 Cb 0.46 -1.22 -0.10 0.00 -0.02 0.00 0.00 35.03 34.16 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 -2.21 2.05 -0.43 2.13 5.04 -1.16 -4.99 117.35 117.77 1x5x s TYR 59 Ca -0.09 -0.60 0.02 0.00 -2.44 0.00 0.00 57.07 53.95 1x5x s TYR 59 Cb 0.03 -1.12 0.20 0.00 0.35 0.00 0.00 41.96 41.42 1x5x s TYR 59 CO 0.30 0.40 0.86 0.34 -1.34 0.00 0.00 175.55 176.10 1x5x s ASP 60 N -3.47 -1.01 0.22 4.32 2.15 -1.26 -3.70 116.67 113.92 1x5x s ASP 60 Ca 0.29 -1.05 -0.02 0.00 0.43 0.00 0.00 52.55 52.20 1x5x s ASP 60 Cb 0.02 1.32 0.01 0.00 -0.30 0.00 0.00 42.92 43.97 1x5x s ASP 60 CO 0.13 -0.05 0.33 0.61 -0.17 0.00 0.00 175.17 176.01 1x5x n GLY 61 N 3.10 2.36 2.26 2.66 0.00 -1.26 -5.06 105.19 109.26 1x5x n GLY 61 Ca 0.14 -1.48 -0.29 0.00 0.00 0.00 0.00 46.02 44.39 1x5x n GLY 61 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1x5x n GLU 62 N -0.36 3.22 -4.23 1.61 0.28 -1.26 -2.43 120.64 117.47 1x5x n GLU 62 Ca -0.00 -3.88 -0.26 0.00 -0.16 0.00 0.00 57.16 52.86 1x5x n GLU 62 Cb 0.36 -2.28 -0.08 0.00 1.43 0.00 0.00 31.44 30.88 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 -2.79 4.66 -0.42 -1.84 1.11 -1.26 -4.98 116.67 111.15 1x5x s ASP 63 Ca 0.55 -0.44 0.05 0.00 0.18 0.00 0.00 52.55 52.89 1x5x s ASP 63 Cb 0.44 -0.95 0.65 0.00 1.07 0.00 0.00 42.92 44.14 1x5x s ASP 63 CO -0.05 0.09 1.85 0.18 1.18 0.00 0.00 175.17 178.41 1x5x n LEU 64 N -0.13 6.33 -3.63 1.23 4.77 -1.26 -4.74 117.00 119.57 1x5x n LEU 64 Ca -0.10 -3.60 -0.08 0.00 -0.03 0.00 0.00 56.01 52.21 1x5x n LEU 64 Cb 0.55 -0.80 -0.06 0.00 -2.33 0.00 0.00 43.42 40.78 1x5x n LEU 64 CO 0.38 1.06 0.87 0.00 -1.33 0.00 0.00 177.39 178.37 1x5x s ALA 65 N -3.26 -2.03 0.11 -1.18 0.00 -1.26 -3.08 121.76 111.05 1x5x s ALA 65 Ca 0.55 1.76 -0.16 0.00 0.00 0.00 0.00 51.96 54.12 1x5x s ALA 65 Cb 0.47 -1.33 0.03 0.00 0.00 0.00 0.00 23.12 22.28 1x5x s ALA 65 CO 0.10 -0.23 0.38 -0.47 0.00 0.00 0.00 175.76 175.54 1x5x s TYR 66 N -0.25 -0.18 -0.28 0.00 5.04 -1.09 -5.05 117.35 115.52 1x5x s TYR 66 Ca 0.03 -0.09 0.02 0.00 -2.44 0.00 0.00 57.07 54.59 1x5x s TYR 66 Cb -0.04 0.22 0.08 0.00 0.35 0.00 0.00 41.96 42.57 1x5x s TYR 66 CO -0.06 -0.66 -0.03 0.99 -1.34 0.00 0.00 175.55 174.45 1x5x s THR 67 N -3.56 1.92 0.57 4.34 2.01 -1.26 -2.43 115.64 117.23 1x5x s THR 67 Ca 0.02 -1.73 -0.18 0.00 0.31 0.00 0.00 61.69 60.10 1x5x s THR 67 Cb 0.02 -2.22 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 1x5x s THR 67 CO -0.10 -0.28 1.12 -0.69 -0.69 0.00 0.00 174.62 173.98 1x5x s VAL 68 N 1.16 3.20 0.21 3.82 1.01 -0.11 -4.86 120.40 124.83 1x5x s VAL 68 Ca -0.00 0.70 -0.03 0.00 0.00 0.00 0.00 61.98 62.65 1x5x s VAL 68 Cb -0.19 -3.26 -0.03 0.00 0.00 0.00 0.00 36.38 32.90 1x5x s VAL 68 CO -0.08 -0.21 0.20 -0.54 0.00 0.00 0.00 175.10 174.47 1x5x s LYS 69 N -3.47 1.27 -0.74 2.72 1.02 -1.26 -2.29 119.74 116.99 1x5x s LYS 69 Ca 0.71 -1.56 -0.04 0.00 0.02 0.00 0.00 55.97 55.10 1x5x s LYS 69 Cb -0.23 0.31 -0.05 0.00 -0.52 0.00 0.00 37.83 37.34 1x5x s LYS 69 CO 0.30 -0.44 0.65 -1.71 -0.92 0.00 0.00 175.35 173.23 1x5x n ASN 70 N -0.30 -5.38 -1.61 2.83 2.85 -0.96 -4.93 115.26 107.77 1x5x n ASN 70 Ca 0.01 -0.49 0.00 0.00 -0.11 0.00 0.00 54.58 53.99 1x5x n ASN 70 Cb 0.65 -3.89 0.00 0.00 1.24 0.00 0.00 39.78 37.78 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 -2.69 0.00 -4.24 1.20 4.77 -1.04 -5.03 117.00 109.98 1x5x n LEU 71 Ca -0.05 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.72 1x5x n LEU 71 Cb 0.58 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.55 1x5x n LEU 71 CO 0.42 0.00 -0.49 -0.13 -1.33 0.00 0.00 177.39 175.87 1x5x s ARG 72 N -1.42 0.99 0.29 3.23 0.52 -1.26 -4.73 118.95 116.57 1x5x s ARG 72 Ca 0.00 -1.09 -0.29 0.00 -0.52 0.00 0.00 55.73 53.83 1x5x s ARG 72 Cb 0.00 -1.12 -0.10 0.00 0.52 0.00 0.00 34.95 34.26 1x5x s ARG 72 CO 0.00 0.25 1.13 -0.98 0.02 0.00 0.00 175.30 175.72 1x5x s ARG 73 N -1.92 4.59 -0.51 3.54 3.03 -1.20 -4.09 118.95 122.39 1x5x s ARG 73 Ca 0.03 1.86 -0.23 0.00 2.03 0.00 0.00 55.73 59.42 1x5x s ARG 73 Cb -0.10 -3.16 0.03 0.00 -1.03 0.00 0.00 34.95 30.70 1x5x s ARG 73 CO 0.03 0.15 0.64 0.45 -1.13 0.00 0.00 175.30 175.44 1x5x n SER 74 N 1.11 -6.55 -3.78 -2.89 2.88 -1.23 -5.00 113.62 98.15 1x5x n SER 74 Ca -0.01 0.01 -0.11 0.00 -1.33 0.00 0.00 58.87 57.44 1x5x n SER 74 Cb 0.44 -3.39 -0.07 0.00 -0.75 0.00 0.00 64.21 60.45 1x5x n SER 74 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1x5x s THR 75 N -2.21 0.10 -0.28 2.46 2.01 -1.26 -4.98 115.64 111.49 1x5x s THR 75 Ca 0.26 -0.82 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 1x5x s THR 75 Cb -0.04 -1.06 0.01 0.00 0.01 0.00 0.00 72.50 71.41 1x5x s THR 75 CO 0.83 -0.45 0.04 -1.59 -0.69 0.00 0.00 174.62 172.76 1x5x s LYS 76 N -3.03 3.11 0.08 4.92 -2.85 -1.26 -3.14 119.74 117.57 1x5x s LYS 76 Ca -0.02 -0.83 0.09 0.00 -1.00 0.00 0.00 55.97 54.21 1x5x s LYS 76 Cb 0.01 -3.27 -0.03 0.00 -2.06 0.00 0.00 37.83 32.48 1x5x s LYS 76 CO -0.06 -0.39 -0.23 0.71 0.10 0.00 0.00 175.35 175.48 1x5x s TYR 77 N 1.47 1.95 0.25 1.78 2.02 -1.06 -4.81 117.35 118.96 1x5x s TYR 77 Ca 0.03 -0.40 0.05 0.00 -0.37 0.00 0.00 57.07 56.38 1x5x s TYR 77 Cb -0.17 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.26 1x5x s TYR 77 CO 0.01 0.18 0.38 0.21 -1.57 0.00 0.00 175.55 174.76 1x5x s LYS 78 N -1.62 3.41 -0.21 -0.62 2.20 -0.52 -2.36 119.74 120.02 1x5x s LYS 78 Ca 0.09 -0.76 -0.25 0.00 -0.36 0.00 0.00 55.97 54.69 1x5x s LYS 78 Cb -0.10 -2.87 0.07 0.00 -1.51 0.00 0.00 37.83 33.42 1x5x s LYS 78 CO 0.03 0.38 0.67 -0.06 -0.36 0.00 0.00 175.35 176.01 1x5x s PHE 79 N -2.02 -0.72 -0.11 4.03 0.40 -0.88 -3.15 117.98 115.54 1x5x s PHE 79 Ca 0.35 1.66 -0.05 0.00 -0.60 0.00 0.00 56.93 58.29 1x5x s PHE 79 Cb -0.09 0.28 0.05 0.00 0.51 0.00 0.00 43.02 43.77 1x5x s PHE 79 CO 0.30 -0.40 0.24 -1.59 0.70 0.00 0.00 175.22 174.47 1x5x s LYS 80 N 0.05 0.18 -0.03 0.44 -2.85 -1.17 -0.71 119.74 115.65 1x5x s LYS 80 Ca -0.02 0.57 -0.27 0.00 -1.00 0.00 0.00 55.97 55.25 1x5x s LYS 80 Cb -0.04 -0.11 -0.03 0.00 -2.06 0.00 0.00 37.83 35.59 1x5x s LYS 80 CO 0.03 -0.19 0.85 0.54 0.10 0.00 0.00 175.35 176.67 1x5x s VAL 81 N 1.54 4.95 -0.22 1.79 0.11 -1.26 -2.55 120.40 124.76 1x5x s VAL 81 Ca -0.07 1.77 0.02 0.00 -2.93 0.00 0.00 61.98 60.78 1x5x s VAL 81 Cb -0.11 -4.19 0.04 0.00 -1.53 0.00 0.00 36.38 30.59 1x5x s VAL 81 CO -0.08 0.21 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.12 1x5x s ILE 82 N 0.89 2.04 -0.31 7.04 1.01 0.30 -1.92 121.20 130.25 1x5x s ILE 82 Ca 0.45 -1.28 -0.20 0.00 0.00 0.00 0.00 60.65 59.62 1x5x s ILE 82 Cb -0.20 -2.03 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 1x5x s ILE 82 CO 0.23 0.21 0.64 0.00 0.00 0.00 0.00 174.94 176.02 1x5x s ALA 83 N 1.22 3.53 0.24 9.38 0.00 -1.26 0.12 121.76 134.99 1x5x s ALA 83 Ca -0.03 -0.64 0.07 0.00 0.00 0.00 0.00 51.96 51.36 1x5x s ALA 83 Cb -0.17 -3.11 -0.05 0.00 0.00 0.00 0.00 23.12 19.79 1x5x s ALA 83 CO -0.08 -1.09 -0.10 1.52 0.00 0.00 0.00 175.76 176.01 1x5x s TYR 84 N 2.63 1.81 0.12 0.00 -0.85 0.07 -2.74 117.35 118.38 1x5x s TYR 84 Ca 0.25 -0.65 0.09 0.00 -0.52 0.00 0.00 57.07 56.24 1x5x s TYR 84 Cb -0.15 -0.94 -0.04 0.00 0.38 0.00 0.00 41.96 41.21 1x5x s TYR 84 CO 0.12 0.30 -0.22 -0.80 -1.52 0.00 0.00 175.55 173.43 1x5x s ASN 85 N -3.37 2.77 0.59 -0.18 0.01 0.58 -2.01 114.94 113.32 1x5x s ASN 85 Ca 0.26 -0.73 0.35 0.00 -0.71 0.00 0.00 52.86 52.04 1x5x s ASN 85 Cb 0.02 -0.16 1.30 0.00 0.41 0.00 0.00 41.25 42.81 1x5x s ASN 85 CO 0.09 0.08 1.50 -1.28 -1.51 0.00 0.00 177.10 175.98 1x5x h SER 86 N 3.91 0.00 -0.03 -1.22 0.87 -1.98 1.42 113.55 116.51 1x5x h SER 86 Ca -0.47 0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.04 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 -0.17 -0.33 -0.53 0.00 0.00 176.83 176.21 1x5x h GLU 87 N 0.00 0.17 0.00 2.24 5.08 -1.97 -3.49 114.58 116.61 1x5x h GLU 87 Ca 0.61 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 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 0.81 0.00 0.41 -1.00 0.00 0.00 179.01 179.22 1x5x n GLY 88 N 0.75 2.24 3.20 -3.84 0.00 0.49 -5.14 105.19 102.89 1x5x n GLY 88 Ca -0.09 -0.56 -0.14 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 0.93 0.00 1.61 -2.85 -1.26 0.22 119.74 119.81 1x5x s LYS 89 Ca 0.00 -1.27 0.00 0.00 -1.00 0.00 0.00 55.97 53.70 1x5x s LYS 89 Cb 0.00 -0.56 0.00 0.00 -2.06 0.00 0.00 37.83 35.21 1x5x s LYS 89 CO 0.00 0.08 0.00 0.43 0.10 0.00 0.00 175.35 175.96 1x5x n SER 90 N 0.27 0.85 -4.82 0.03 7.64 -1.11 -4.93 113.62 111.56 1x5x n SER 90 Ca -0.14 -0.49 -0.33 0.00 1.01 0.00 0.00 58.87 58.92 1x5x n SER 90 Cb 0.59 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.75 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 -0.57 6.54 0.81 6.43 -0.87 -1.26 -4.85 114.94 121.17 1x5x s ASN 91 Ca 0.00 1.73 -0.12 0.00 -1.57 0.00 0.00 52.86 52.91 1x5x s ASN 91 Cb 0.00 -2.54 0.08 0.00 -0.02 0.00 0.00 41.25 38.77 1x5x s ASN 91 CO 0.00 -0.64 1.10 -2.16 -2.57 0.00 0.00 177.10 172.83 1x5x s PRO 92 N -3.57 1.97 0.67 -0.60 0.04 -1.26 -4.53 135.00 127.72 1x5x s PRO 92 Ca 0.63 0.60 0.00 0.00 0.04 0.00 0.00 61.00 62.26 1x5x s PRO 92 Cb -0.12 -1.91 0.10 0.00 0.04 0.00 0.00 34.50 32.61 1x5x s PRO 92 CO 0.23 -1.69 0.93 0.45 0.04 0.00 0.00 177.00 176.96 1x5x s SER 93 N -3.92 4.60 -0.07 6.66 0.15 -0.81 -4.87 113.70 115.45 1x5x s SER 93 Ca 0.61 -0.29 -0.30 0.00 0.70 0.00 0.00 55.95 56.68 1x5x s SER 93 Cb -0.14 -0.22 -0.08 0.00 -1.71 0.00 0.00 66.02 63.87 1x5x s SER 93 CO 0.54 -1.67 2.07 -0.62 1.20 0.00 0.00 173.24 174.76 1x5x n GLU 94 N -2.70 2.47 -1.69 5.44 -0.58 -1.26 -4.72 120.64 117.60 1x5x n GLU 94 Ca 0.13 0.84 -0.44 0.00 -0.42 0.00 0.00 57.16 57.27 1x5x n GLU 94 Cb 0.60 -3.07 -0.03 0.00 -0.57 0.00 0.00 31.44 28.37 1x5x n GLU 94 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1x5x n VAL 95 N 6.39 0.31 -4.05 2.62 0.31 -1.26 -4.63 118.33 118.02 1x5x n VAL 95 Ca 0.24 -0.08 -0.24 0.00 -0.01 0.00 0.00 64.34 64.26 1x5x n VAL 95 Cb 0.42 -1.71 -0.07 0.00 -0.91 0.00 0.00 33.84 31.57 1x5x n VAL 95 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1x5x s VAL 96 N 0.68 2.58 -0.02 2.52 -7.23 0.11 -4.96 120.40 114.08 1x5x s VAL 96 Ca 0.74 -1.66 0.02 0.00 -1.81 0.00 0.00 61.98 59.27 1x5x s VAL 96 Cb -0.60 -2.98 0.00 0.00 0.56 0.00 0.00 36.38 33.36 1x5x s VAL 96 CO 0.40 -0.06 -0.07 -0.70 -0.31 0.00 0.00 175.10 174.36 1x5x s GLU 97 N -3.91 0.73 0.22 4.82 2.12 -1.26 -2.08 118.70 119.34 1x5x s GLU 97 Ca 0.41 -0.22 0.00 0.00 0.36 0.00 0.00 54.97 55.52 1x5x s GLU 97 Cb 0.01 -0.71 -0.04 0.00 0.26 0.00 0.00 34.13 33.65 1x5x s GLU 97 CO 0.23 0.08 0.15 -0.06 -0.54 0.00 0.00 175.26 175.12 1x5x s PHE 98 N 0.22 1.27 0.02 5.30 0.08 -0.99 -5.04 117.98 118.84 1x5x s PHE 98 Ca -0.03 -1.41 0.01 0.00 0.12 0.00 0.00 56.93 55.62 1x5x s PHE 98 Cb -0.07 -0.60 -0.02 0.00 -0.57 0.00 0.00 43.02 41.75 1x5x s PHE 98 CO 0.00 -0.66 -0.04 0.99 -0.10 0.00 0.00 175.22 175.41 1x5x s THR 99 N -4.03 0.23 0.98 0.64 2.01 -1.26 -2.55 115.64 111.67 1x5x s THR 99 Ca 0.39 -0.85 -0.16 0.00 0.31 0.00 0.00 61.69 61.38 1x5x s THR 99 Cb 0.06 -0.34 0.22 0.00 0.01 0.00 0.00 72.50 72.45 1x5x s THR 99 CO 0.14 -0.40 1.34 0.42 -0.69 0.00 0.00 174.62 175.43 1x5x s THR 100 N -1.26 2.00 0.39 -0.82 -4.23 -1.19 -4.83 115.64 105.70 1x5x s THR 100 Ca -0.12 -0.03 0.07 0.00 -1.18 0.00 0.00 61.69 60.44 1x5x s THR 100 Cb -0.09 -2.98 -0.00 0.00 1.34 0.00 0.00 72.50 70.77 1x5x s THR 100 CO -0.00 0.00 0.50 0.00 -0.54 0.00 0.00 174.62 174.58 1x5x s PRO 102 N -4.25 4.34 0.14 0.00 0.04 -1.26 -3.57 135.00 130.44 1x5x s PRO 102 Ca 0.50 1.70 -0.24 0.00 0.04 0.00 0.00 61.00 63.01 1x5x s PRO 102 Cb -0.09 -3.57 0.00 0.00 0.04 0.00 0.00 34.50 30.88 1x5x s PRO 102 CO 0.31 -0.48 1.63 0.38 0.04 0.00 0.00 177.00 178.88 1x5x h ASP 103 N 7.54 -0.83 -3.72 6.66 2.03 -1.94 -3.43 116.42 122.73 1x5x h ASP 103 Ca -0.34 0.14 -0.51 0.00 -0.73 0.00 0.00 57.03 55.58 1x5x h ASP 103 Cb 1.16 0.37 -0.19 0.00 -0.83 0.00 0.00 39.33 39.85 1x5x h ASP 103 CO 0.89 -0.31 -0.79 -0.44 -1.03 0.00 0.00 179.24 177.57 1x5x s SER 104 N -4.99 2.57 0.00 4.15 0.01 -1.26 -5.08 113.70 109.11 1x5x s SER 104 Ca -0.15 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.29 1x5x s SER 104 Cb 0.11 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.20 1x5x s SER 104 CO 0.67 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.90 1x5x n GLY 105 N 0.46 0.08 0.10 3.44 0.00 -1.26 -4.99 105.19 103.02 1x5x n GLY 105 Ca -0.15 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.77 1x5x n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5x h PRO 106 N 0.00 -0.12 -4.96 1.61 0.13 -2.00 -3.50 132.00 123.16 1x5x h PRO 106 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1x5x h PRO 106 Cb 0.00 0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.14 1x5x h PRO 106 CO 0.00 0.39 -1.02 0.45 -0.23 0.00 0.00 178.00 177.59 1x5x n SER 107 N -4.83 -6.47 -2.62 1.44 2.88 -1.26 -4.74 113.62 98.02 1x5x n SER 107 Ca -0.07 1.33 -0.04 0.00 -1.33 0.00 0.00 58.87 58.75 1x5x n SER 107 Cb 0.28 -5.03 -0.04 0.00 -0.75 0.00 0.00 64.21 58.67 1x5x n SER 107 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1x5x n SER 108 N 0.80 -2.21 0.00 -3.46 2.88 -1.26 -5.26 113.62 105.12 1x5x n SER 108 Ca -0.06 1.37 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 1x5x n SER 108 Cb 0.10 -5.28 0.00 0.00 -0.75 0.00 0.00 64.21 58.28 1x5x n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42