#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 2.46 0.18 1.61 0.01 -1.26 -5.04 113.70 111.66 1x5x s SER 2 Ca 0.00 -1.31 0.00 0.00 1.31 0.00 0.00 55.95 55.95 1x5x s SER 2 Cb 0.00 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.12 1x5x s SER 2 CO 0.00 -0.52 0.00 -0.24 0.41 0.00 0.00 173.24 172.89 1x5x n SER 3 N -0.64 -1.59 -3.64 2.44 2.88 -1.26 -5.15 113.62 106.66 1x5x n SER 3 Ca -0.03 0.42 -0.07 0.00 -1.33 0.00 0.00 58.87 57.85 1x5x n SER 3 Cb 0.65 1.72 -0.07 0.00 -0.75 0.00 0.00 64.21 65.76 1x5x n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x5x s GLY 4 N -2.00 -0.02 0.05 0.46 0.00 -1.26 -5.17 107.32 99.38 1x5x s GLY 4 Ca 0.00 2.90 0.08 0.00 0.00 0.00 0.00 44.72 47.69 1x5x s GLY 4 CO 0.00 1.88 -0.19 -0.56 0.00 0.00 0.00 173.10 174.23 1x5x s SER 5 N 0.21 3.73 -0.32 1.64 0.01 -1.26 -5.10 113.70 112.61 1x5x s SER 5 Ca 0.04 -0.46 -0.02 0.00 1.31 0.00 0.00 55.95 56.82 1x5x s SER 5 Cb -0.05 -0.56 0.11 0.00 0.21 0.00 0.00 66.02 65.73 1x5x s SER 5 CO -0.09 0.25 0.13 -0.55 0.41 0.00 0.00 173.24 173.39 1x5x s SER 6 N -1.50 3.73 0.00 2.44 0.15 -1.26 -5.03 113.70 112.24 1x5x s SER 6 Ca 0.15 -1.66 0.00 0.00 0.70 0.00 0.00 55.95 55.14 1x5x s SER 6 Cb -0.10 -0.66 0.00 0.00 -1.71 0.00 0.00 66.02 63.55 1x5x s SER 6 CO 0.05 -0.40 0.00 0.61 1.20 0.00 0.00 173.24 174.70 1x5x n GLY 7 N 4.80 0.75 3.72 9.45 0.00 -1.26 -4.98 105.19 117.66 1x5x n GLY 7 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 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 1.30 4.46 1.13 1.61 0.04 -1.26 -4.78 135.00 137.51 1x5x s PRO 8 Ca 0.00 1.72 -0.16 0.00 0.04 0.00 0.00 61.00 62.60 1x5x s PRO 8 Cb 0.00 -3.35 0.25 0.00 0.04 0.00 0.00 34.50 31.43 1x5x s PRO 8 CO 0.00 -0.20 0.55 0.43 0.04 0.00 0.00 177.00 177.83 1x5x n SER 9 N 3.75 -3.42 -4.64 6.66 7.64 -1.26 -4.77 113.62 117.58 1x5x n SER 9 Ca 0.08 -0.56 -0.42 0.00 1.01 0.00 0.00 58.87 58.97 1x5x n SER 9 Cb 0.47 -0.82 -0.03 0.00 -1.01 0.00 0.00 64.21 62.82 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 -3.96 3.85 0.88 1.43 1.75 -1.26 -4.89 119.30 117.09 1x5x s MET 10 Ca 0.43 2.20 -0.12 0.00 -1.25 0.00 0.00 55.69 56.95 1x5x s MET 10 Cb -0.08 -4.15 0.12 0.00 2.84 0.00 0.00 34.83 33.56 1x5x s MET 10 CO 0.36 -1.26 1.13 -1.25 -0.65 0.00 0.00 175.02 173.35 1x5x s PRO 11 N 4.84 1.41 0.21 4.11 0.04 -1.26 -4.86 135.00 139.50 1x5x s PRO 11 Ca 0.85 0.38 -0.23 0.00 0.04 0.00 0.00 61.00 62.04 1x5x s PRO 11 Cb -0.35 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.25 1x5x s PRO 11 CO 0.35 -2.03 0.77 0.00 0.04 0.00 0.00 177.00 176.13 1x5x s ALA 12 N -3.25 3.41 0.46 8.56 0.00 -1.26 -4.71 121.76 124.97 1x5x s ALA 12 Ca 0.63 0.29 -0.22 0.00 0.00 0.00 0.00 51.96 52.65 1x5x s ALA 12 Cb -0.15 -2.92 -0.10 0.00 0.00 0.00 0.00 23.12 19.96 1x5x s ALA 12 CO 0.53 0.30 0.84 -1.13 0.00 0.00 0.00 175.76 176.30 1x5x n SER 13 N 1.08 0.43 -4.71 0.00 3.41 -1.26 -4.49 113.62 108.08 1x5x n SER 13 Ca -0.03 0.95 -0.42 0.00 -0.26 0.00 0.00 58.87 59.10 1x5x n SER 13 Cb 0.50 -1.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.14 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 -2.00 4.44 0.37 4.33 0.04 -1.26 -4.76 135.00 136.17 1x5x s PRO 14 Ca 0.65 1.72 -0.04 0.00 0.04 0.00 0.00 61.00 63.37 1x5x s PRO 14 Cb -0.54 -3.37 0.08 0.00 0.04 0.00 0.00 34.50 30.71 1x5x s PRO 14 CO 0.56 -0.24 0.51 1.33 0.04 0.00 0.00 177.00 179.19 1x5x n VAL 15 N 3.96 0.00 -3.50 -0.36 0.24 0.16 -4.76 118.33 114.07 1x5x n VAL 15 Ca 0.09 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.59 1x5x n VAL 15 Cb 0.47 -1.57 -0.13 0.00 -1.47 0.00 0.00 33.84 31.15 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 1.03 0.01 1.34 2.96 -1.26 -1.77 118.68 120.99 1x5x s LEU 16 Ca 0.30 -2.04 -0.26 0.00 -0.22 0.00 0.00 54.13 51.91 1x5x s LEU 16 Cb -0.01 -0.44 -0.15 0.00 0.50 0.00 0.00 46.19 46.09 1x5x s LEU 16 CO 0.21 -0.33 1.11 0.71 -1.32 0.00 0.00 176.35 176.73 1x5x h THR 17 N 5.32 0.12 -4.06 3.68 1.35 -1.61 -3.45 112.91 114.26 1x5x h THR 17 Ca 0.00 -0.35 -0.52 0.00 -0.55 0.00 0.00 66.41 64.99 1x5x h THR 17 Cb 0.98 0.17 -0.30 0.00 -1.73 0.00 0.00 68.15 67.26 1x5x h THR 17 CO 0.31 0.02 -0.82 -0.54 -0.25 0.00 0.00 175.52 174.24 1x5x s LYS 18 N -4.63 1.42 -0.23 4.72 1.02 -1.18 -5.06 119.74 115.79 1x5x s LYS 18 Ca -0.14 -0.54 -0.05 0.00 0.02 0.00 0.00 55.97 55.26 1x5x s LYS 18 Cb 0.02 -1.30 -0.01 0.00 -0.52 0.00 0.00 37.83 36.01 1x5x s LYS 18 CO 0.44 0.27 -0.02 0.00 -0.92 0.00 0.00 175.35 175.12 1x5x s ALA 19 N -0.13 2.89 0.46 5.17 0.00 -1.26 -1.08 121.76 127.80 1x5x s ALA 19 Ca 0.01 -1.19 0.05 0.00 0.00 0.00 0.00 51.96 50.83 1x5x s ALA 19 Cb -0.08 -1.80 0.02 0.00 0.00 0.00 0.00 23.12 21.25 1x5x s ALA 19 CO 0.01 -0.48 0.64 0.20 0.00 0.00 0.00 175.76 176.13 1x5x s GLY 20 N 1.50 1.84 0.01 0.00 0.00 0.10 -4.36 107.32 106.41 1x5x s GLY 20 Ca 0.06 -1.48 -0.21 0.00 0.00 0.00 0.00 44.72 43.09 1x5x s GLY 20 CO -0.02 -1.27 1.18 -2.22 0.00 0.00 0.00 173.10 170.78 1x5x h ILE 21 N 0.43 1.42 0.00 0.90 2.04 -1.92 -3.22 117.51 117.16 1x5x h ILE 21 Ca -0.42 -1.76 -0.01 0.00 1.00 0.00 0.00 64.86 63.68 1x5x h ILE 21 Cb 1.28 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 39.68 1x5x h ILE 21 CO 0.49 0.51 -0.25 0.35 0.00 0.00 0.00 178.15 179.25 1x5x n THR 22 N -4.39 1.84 -3.51 -0.27 -2.24 -1.26 -3.21 114.28 101.23 1x5x n THR 22 Ca -0.08 -2.48 -0.12 0.00 -2.27 0.00 0.00 64.05 59.10 1x5x n THR 22 Cb 0.52 -0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 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 -2.76 -0.42 -0.04 4.78 1.48 -1.25 -2.98 118.94 117.75 1x5x s TRP 23 Ca 0.33 0.24 -0.01 0.00 -1.06 0.00 0.00 56.10 55.60 1x5x s TRP 23 Cb 0.30 0.43 0.03 0.00 -1.16 0.00 0.00 33.47 33.07 1x5x s TRP 23 CO -0.02 -0.76 0.06 -0.51 -4.06 0.00 0.00 176.95 171.66 1x5x s LEU 24 N -2.59 0.84 -0.49 -4.66 1.43 -1.10 0.01 118.68 112.13 1x5x s LEU 24 Ca 0.00 0.11 -0.11 0.00 -1.03 0.00 0.00 54.13 53.11 1x5x s LEU 24 Cb -0.00 0.03 0.12 0.00 0.03 0.00 0.00 46.19 46.37 1x5x s LEU 24 CO -0.10 -0.15 0.39 -0.44 0.23 0.00 0.00 176.35 176.27 1x5x s SER 25 N 1.27 5.84 0.49 2.29 0.01 -0.24 -1.49 113.70 121.86 1x5x s SER 25 Ca -0.07 -1.87 0.02 0.00 1.31 0.00 0.00 55.95 55.34 1x5x s SER 25 Cb -0.13 -2.07 0.02 0.00 0.21 0.00 0.00 66.02 64.06 1x5x s SER 25 CO -0.04 -0.74 0.70 -0.76 0.41 0.00 0.00 173.24 172.81 1x5x s LEU 26 N 1.43 3.48 -0.17 2.44 1.43 -1.23 -1.62 118.68 124.44 1x5x s LEU 26 Ca 0.05 -0.00 -0.05 0.00 -1.03 0.00 0.00 54.13 53.10 1x5x s LEU 26 Cb -0.27 -2.91 0.09 0.00 0.03 0.00 0.00 46.19 43.13 1x5x s LEU 26 CO 0.00 -0.92 0.31 -1.10 0.23 0.00 0.00 176.35 174.87 1x5x s GLN 27 N -4.61 0.23 0.32 1.70 -1.52 -0.73 -3.99 119.66 111.06 1x5x s GLN 27 Ca 0.54 0.71 0.07 0.00 -1.95 0.00 0.00 55.36 54.72 1x5x s GLN 27 Cb -0.10 -0.18 -0.06 0.00 -0.22 0.00 0.00 33.01 32.44 1x5x s GLN 27 CO 0.37 -0.39 -0.04 1.67 -0.25 0.00 0.00 175.29 176.65 1x5x s TRP 28 N 2.47 2.17 0.22 0.91 -2.14 -1.08 0.39 118.94 121.89 1x5x s TRP 28 Ca 0.03 -0.67 0.04 0.00 2.66 0.00 0.00 56.10 58.16 1x5x s TRP 28 Cb -0.13 -1.32 -0.05 0.00 -3.10 0.00 0.00 33.47 28.87 1x5x s TRP 28 CO -0.11 0.36 -0.02 -1.54 -2.66 0.00 0.00 176.95 172.98 1x5x s SER 29 N -3.54 1.84 0.48 -2.66 1.04 -1.26 -4.71 113.70 104.90 1x5x s SER 29 Ca 0.32 -1.19 -0.04 0.00 0.48 0.00 0.00 55.95 55.52 1x5x s SER 29 Cb 0.05 0.00 -0.03 0.00 0.10 0.00 0.00 66.02 66.15 1x5x s SER 29 CO 0.15 -0.48 0.77 -1.59 0.98 0.00 0.00 173.24 173.06 1x5x s LYS 30 N -3.84 3.40 1.05 4.02 -2.85 -1.26 -4.02 119.74 116.25 1x5x s LYS 30 Ca 0.27 0.05 -0.17 0.00 -1.00 0.00 0.00 55.97 55.12 1x5x s LYS 30 Cb 0.05 -2.41 0.23 0.00 -2.06 0.00 0.00 37.83 33.64 1x5x s LYS 30 CO 0.08 -0.24 1.21 -1.25 0.10 0.00 0.00 175.35 175.24 1x5x s PRO 31 N -4.72 -0.04 0.24 1.78 0.04 -1.26 -4.90 135.00 126.14 1x5x s PRO 31 Ca 0.48 -0.16 -0.23 0.00 0.04 0.00 0.00 61.00 61.12 1x5x s PRO 31 Cb -0.10 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.61 1x5x s PRO 31 CO 0.43 -2.91 0.81 0.45 0.04 0.00 0.00 177.00 175.82 1x5x s SER 32 N -4.35 7.24 -0.43 6.66 0.15 -1.26 -4.41 113.70 117.29 1x5x s SER 32 Ca 0.71 1.61 -0.38 0.00 0.70 0.00 0.00 55.95 58.60 1x5x s SER 32 Cb -0.08 -2.49 0.06 0.00 -1.71 0.00 0.00 66.02 61.80 1x5x s SER 32 CO 0.54 0.05 0.64 0.61 1.20 0.00 0.00 173.24 176.28 1x5x n GLY 33 N 0.89 0.17 3.83 9.45 0.00 -1.26 -4.90 105.19 113.37 1x5x n GLY 33 Ca -0.02 1.11 -0.33 0.00 0.00 0.00 0.00 46.02 46.79 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 -1.40 4.35 -0.03 2.61 -4.23 -1.26 -5.00 115.64 110.67 1x5x s THR 34 Ca 0.37 1.29 -0.23 0.00 -1.18 0.00 0.00 61.69 61.94 1x5x s THR 34 Cb -0.04 -3.62 -0.22 0.00 1.34 0.00 0.00 72.50 69.96 1x5x s THR 34 CO 0.84 -0.48 1.08 1.55 -0.54 0.00 0.00 174.62 177.07 1x5x h PRO 35 N 1.35 0.24 -6.22 3.99 0.13 -1.90 -3.46 132.00 126.12 1x5x h PRO 35 Ca -0.48 -0.23 -0.50 0.00 -0.87 0.00 0.00 66.00 63.92 1x5x h PRO 35 Cb 1.19 0.06 0.25 0.00 0.13 0.00 0.00 31.00 32.62 1x5x h PRO 35 CO 0.61 0.93 -1.98 0.45 -0.23 0.00 0.00 178.00 177.78 1x5x n SER 36 N -4.46 -3.49 -3.88 1.44 2.88 -1.26 -4.81 113.62 100.04 1x5x n SER 36 Ca -0.09 0.05 -0.42 0.00 -1.33 0.00 0.00 58.87 57.07 1x5x n SER 36 Cb 0.52 -0.73 0.01 0.00 -0.75 0.00 0.00 64.21 63.26 1x5x n SER 36 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1x5x n ASP 37 N 1.92 6.38 -1.99 -3.46 2.03 -1.26 -4.90 116.55 115.27 1x5x n ASP 37 Ca -0.01 -3.37 0.00 0.00 0.52 0.00 0.00 54.79 51.94 1x5x n ASP 37 Cb 0.66 -1.31 0.00 0.00 -0.72 0.00 0.00 41.12 39.75 1x5x n ASP 37 CO 0.00 0.00 0.00 1.21 -1.92 0.00 0.00 177.20 176.49 1x5x n GLU 38 N 1.73 -5.54 -0.12 -0.67 0.00 -1.26 -5.03 120.64 109.75 1x5x n GLU 38 Ca 0.35 3.96 0.00 0.00 0.00 0.00 0.00 57.16 61.47 1x5x n GLU 38 Cb 0.32 -4.33 0.00 0.00 0.00 0.00 0.00 31.44 27.43 1x5x n GLU 38 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1x5x n GLY 39 N 1.05 0.23 3.14 8.31 0.00 -1.26 -5.13 105.19 111.53 1x5x n GLY 39 Ca 0.00 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 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 1.15 0.11 -0.61 1.01 -1.26 -4.98 121.20 116.61 1x5x s ILE 40 Ca 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 60.65 59.87 1x5x s ILE 40 Cb 0.00 -1.00 -0.04 0.00 0.01 0.00 0.00 42.46 41.43 1x5x s ILE 40 CO 0.00 0.16 -0.02 -0.94 0.00 0.00 0.00 174.94 174.14 1x5x s SER 41 N -0.78 4.85 -0.02 3.58 1.04 -1.24 -4.56 113.70 116.56 1x5x s SER 41 Ca 0.04 -0.26 0.01 0.00 0.48 0.00 0.00 55.95 56.22 1x5x s SER 41 Cb -0.07 -1.09 0.01 0.00 0.10 0.00 0.00 66.02 64.98 1x5x s SER 41 CO 0.00 0.16 -0.03 -0.31 0.98 0.00 0.00 173.24 174.05 1x5x s TYR 42 N -1.36 0.46 -0.27 5.02 1.51 -1.20 -1.77 117.35 119.74 1x5x s TYR 42 Ca 0.25 -0.08 -0.14 0.00 -1.01 0.00 0.00 57.07 56.09 1x5x s TYR 42 Cb -0.11 -0.41 -0.04 0.00 -0.11 0.00 0.00 41.96 41.29 1x5x s TYR 42 CO 0.17 -0.09 0.34 0.42 -1.11 0.00 0.00 175.55 175.29 1x5x s ILE 43 N 0.52 5.20 -0.48 2.71 1.01 0.45 -4.27 121.20 126.34 1x5x s ILE 43 Ca -0.06 0.51 -0.22 0.00 0.00 0.00 0.00 60.65 60.88 1x5x s ILE 43 Cb -0.09 -3.67 0.03 0.00 0.01 0.00 0.00 42.46 38.74 1x5x s ILE 43 CO -0.01 0.18 0.75 -0.22 0.00 0.00 0.00 174.94 175.64 1x5x s LEU 44 N 1.99 4.43 0.35 2.97 2.96 -1.25 -0.90 118.68 129.23 1x5x s LEU 44 Ca 0.14 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.69 1x5x s LEU 44 Cb -0.16 -2.77 -0.02 0.00 0.50 0.00 0.00 46.19 43.75 1x5x s LEU 44 CO 0.10 -0.94 0.52 -1.61 -1.32 0.00 0.00 176.35 173.10 1x5x s GLU 45 N 3.16 3.27 -0.22 1.98 2.02 -0.83 -2.67 118.70 125.42 1x5x s GLU 45 Ca 0.25 -0.63 -0.14 0.00 0.02 0.00 0.00 54.97 54.46 1x5x s GLU 45 Cb -0.14 -2.72 0.06 0.00 0.10 0.00 0.00 34.13 31.43 1x5x s GLU 45 CO 0.19 0.08 0.55 1.41 0.02 0.00 0.00 175.26 177.50 1x5x s MET 46 N -4.27 0.57 -0.07 1.61 -2.45 -1.13 -2.60 119.30 110.95 1x5x s MET 46 Ca 0.42 0.93 0.04 0.00 -1.25 0.00 0.00 55.69 55.84 1x5x s MET 46 Cb -0.10 0.13 -0.01 0.00 1.25 0.00 0.00 34.83 36.10 1x5x s MET 46 CO 0.34 -0.13 -0.21 -2.00 1.05 0.00 0.00 175.02 174.07 1x5x s GLU 47 N 1.17 2.74 0.00 4.11 2.12 -0.52 -3.24 118.70 125.08 1x5x s GLU 47 Ca -0.07 -0.82 0.00 0.00 0.36 0.00 0.00 54.97 54.44 1x5x s GLU 47 Cb -0.06 -2.30 0.00 0.00 0.26 0.00 0.00 34.13 32.03 1x5x s GLU 47 CO -0.11 0.38 0.00 0.39 -0.54 0.00 0.00 175.26 175.38 1x5x n GLU 48 N 2.98 -0.22 0.03 4.30 1.02 -1.26 -2.84 120.64 124.65 1x5x n GLU 48 Ca -0.18 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 56.95 1x5x n GLU 48 Cb 0.52 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.94 1x5x n GLU 48 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1x5x n GLU 49 N -1.09 0.05 -0.10 3.49 2.13 -1.26 -4.41 120.64 119.45 1x5x n GLU 49 Ca 0.00 0.02 -0.03 0.00 0.66 0.00 0.00 57.16 57.81 1x5x n GLU 49 Cb 0.00 -0.59 -0.02 0.00 0.27 0.00 0.00 31.44 31.10 1x5x n GLU 49 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 1x5x n THR 50 N -3.53 -0.17 -0.02 6.31 -2.24 -1.26 -4.20 114.28 109.17 1x5x n THR 50 Ca -0.02 1.60 -0.02 0.00 -2.27 0.00 0.00 64.05 63.35 1x5x n THR 50 Cb 0.11 -2.08 -0.01 0.00 -2.10 0.00 0.00 70.33 66.25 1x5x n THR 50 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1x5x n SER 51 N -3.51 0.41 0.00 3.42 3.41 -1.26 -5.03 113.62 111.06 1x5x n SER 51 Ca 0.00 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 1x5x n SER 51 Cb 0.06 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 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 1.60 1.97 2.23 5.00 0.00 -1.26 -4.80 105.19 109.93 1x5x n GLY 52 Ca -0.03 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.27 1x5x n GLY 52 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1x5x n TYR 53 N 0.00 -0.97 0.00 1.61 4.19 -1.26 -4.43 117.16 116.31 1x5x n TYR 53 Ca 0.00 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.21 1x5x n TYR 53 Cb 0.00 -2.65 0.00 0.00 0.49 0.00 0.00 39.34 37.18 1x5x n TYR 53 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 1x5x n GLY 54 N -0.56 -1.24 3.80 2.98 0.00 -1.26 -4.92 105.19 104.00 1x5x n GLY 54 Ca -0.14 -1.60 -0.36 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.42 3.65 0.07 1.61 0.08 -1.26 -4.69 117.98 116.02 1x5x s PHE 55 Ca 0.00 1.54 0.06 0.00 0.12 0.00 0.00 56.93 58.65 1x5x s PHE 55 Cb 0.00 -2.74 -0.03 0.00 -0.57 0.00 0.00 43.02 39.68 1x5x s PHE 55 CO 0.00 0.27 -0.16 0.15 -0.10 0.00 0.00 175.22 175.38 1x5x s LYS 56 N -2.06 0.95 0.18 0.44 -0.14 -1.20 -4.94 119.74 112.97 1x5x s LYS 56 Ca 0.46 -0.98 -0.30 0.00 -1.36 0.00 0.00 55.97 53.79 1x5x s LYS 56 Cb -0.17 -1.03 -0.08 0.00 -1.68 0.00 0.00 37.83 34.87 1x5x s LYS 56 CO 0.22 0.24 1.12 -1.25 -0.76 0.00 0.00 175.35 174.91 1x5x s PRO 57 N -1.66 4.57 -0.01 -1.68 0.04 -1.26 -2.85 135.00 132.15 1x5x s PRO 57 Ca 0.01 1.75 -0.00 0.00 0.04 0.00 0.00 61.00 62.80 1x5x s PRO 57 Cb -0.10 -3.27 -0.00 0.00 0.04 0.00 0.00 34.50 31.17 1x5x s PRO 57 CO 0.03 0.04 -0.01 1.63 0.04 0.00 0.00 177.00 178.73 1x5x n LYS 58 N 2.40 0.02 -4.20 4.56 5.02 -1.09 -5.02 118.16 119.85 1x5x n LYS 58 Ca 0.03 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.09 1x5x n LYS 58 Cb 0.46 -0.91 -0.07 0.00 -0.02 0.00 0.00 35.03 34.49 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 -2.01 2.66 -0.35 2.13 5.04 -1.22 -5.01 117.35 118.60 1x5x s TYR 59 Ca -0.01 -0.37 -0.06 0.00 -2.44 0.00 0.00 57.07 54.19 1x5x s TYR 59 Cb 0.00 -1.52 0.20 0.00 0.35 0.00 0.00 41.96 41.00 1x5x s TYR 59 CO 0.02 0.43 1.05 0.34 -1.34 0.00 0.00 175.55 176.04 1x5x s ASP 60 N -3.78 -0.40 0.30 4.32 -1.08 -1.26 -3.92 116.67 110.85 1x5x s ASP 60 Ca 0.36 -0.36 -0.02 0.00 -0.52 0.00 0.00 52.55 52.00 1x5x s ASP 60 Cb -0.03 0.52 0.01 0.00 -1.46 0.00 0.00 42.92 41.96 1x5x s ASP 60 CO 0.21 -0.03 0.43 0.61 0.52 0.00 0.00 175.17 176.91 1x5x n GLY 61 N 3.07 2.21 2.28 2.66 0.00 -1.26 -5.05 105.19 109.09 1x5x n GLY 61 Ca 0.10 -1.56 -0.33 0.00 0.00 0.00 0.00 46.02 44.23 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 -0.49 2.73 -4.37 1.61 0.28 -1.26 -3.20 120.64 115.94 1x5x n GLU 62 Ca 0.00 -3.35 -0.28 0.00 -0.16 0.00 0.00 57.16 53.37 1x5x n GLU 62 Cb 0.50 -2.27 -0.12 0.00 1.43 0.00 0.00 31.44 30.97 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 -1.96 3.58 -0.26 -1.84 1.01 -1.26 -4.86 116.67 111.07 1x5x s ASP 63 Ca 0.63 -0.72 0.04 0.00 0.71 0.00 0.00 52.55 53.21 1x5x s ASP 63 Cb 0.50 -0.36 0.47 0.00 1.01 0.00 0.00 42.92 44.54 1x5x s ASP 63 CO 0.00 0.16 1.53 0.18 0.21 0.00 0.00 175.17 177.25 1x5x n LEU 64 N 0.62 5.09 -3.49 1.23 4.77 -1.26 -4.64 117.00 119.32 1x5x n LEU 64 Ca -0.15 -2.66 -0.12 0.00 -0.03 0.00 0.00 56.01 53.05 1x5x n LEU 64 Cb 0.54 -0.70 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 1x5x n LEU 64 CO 0.27 0.76 0.56 0.00 -1.33 0.00 0.00 177.39 177.65 1x5x s ALA 65 N -2.16 -1.76 0.12 -1.18 0.00 -1.26 -2.63 121.76 112.89 1x5x s ALA 65 Ca 0.37 1.00 -0.21 0.00 0.00 0.00 0.00 51.96 53.13 1x5x s ALA 65 Cb 0.30 0.31 0.05 0.00 0.00 0.00 0.00 23.12 23.78 1x5x s ALA 65 CO 0.08 -0.59 0.51 -0.47 0.00 0.00 0.00 175.76 175.30 1x5x s TYR 66 N -2.60 -0.40 -0.49 0.00 5.04 -1.26 -5.04 117.35 112.60 1x5x s TYR 66 Ca -0.01 0.21 0.00 0.00 -2.44 0.00 0.00 57.07 54.84 1x5x s TYR 66 Cb -0.01 0.41 0.13 0.00 0.35 0.00 0.00 41.96 42.84 1x5x s TYR 66 CO -0.05 -0.75 0.26 0.99 -1.34 0.00 0.00 175.55 174.66 1x5x s THR 67 N -3.48 3.07 0.55 4.34 2.01 -1.26 -3.48 115.64 117.39 1x5x s THR 67 Ca 0.00 -2.69 -0.22 0.00 0.31 0.00 0.00 61.69 59.10 1x5x s THR 67 Cb 0.00 -3.10 -0.05 0.00 0.01 0.00 0.00 72.50 69.37 1x5x s THR 67 CO -0.10 -0.76 1.36 -0.69 -0.69 0.00 0.00 174.62 173.74 1x5x s VAL 68 N 0.39 2.07 0.23 3.82 1.01 -0.56 -4.84 120.40 122.52 1x5x s VAL 68 Ca 0.13 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.17 1x5x s VAL 68 Cb -0.22 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.09 1x5x s VAL 68 CO -0.04 -0.00 0.10 -0.54 0.00 0.00 0.00 175.10 174.62 1x5x s LYS 69 N -2.92 1.30 -0.56 2.72 1.02 -1.26 -2.70 119.74 117.34 1x5x s LYS 69 Ca 0.72 -1.69 -0.04 0.00 0.02 0.00 0.00 55.97 54.98 1x5x s LYS 69 Cb -0.40 -0.08 0.00 0.00 -0.52 0.00 0.00 37.83 36.83 1x5x s LYS 69 CO 0.47 -0.31 0.57 0.09 -0.92 0.00 0.00 175.35 175.26 1x5x n ASN 70 N -0.37 -7.00 -1.08 2.83 3.02 -1.16 -4.94 115.26 106.56 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 -4.71 0.00 0.00 -0.61 0.00 0.00 39.78 35.12 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 -1.30 0.00 -4.15 3.41 4.77 -1.23 -5.02 117.00 113.48 1x5x n LEU 71 Ca 0.03 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.82 1x5x n LEU 71 Cb 0.47 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.44 1x5x n LEU 71 CO 0.44 0.00 -0.46 -0.13 -1.33 0.00 0.00 177.39 175.92 1x5x s ARG 72 N -1.47 0.83 0.53 3.23 0.52 -1.26 -4.78 118.95 116.55 1x5x s ARG 72 Ca 0.00 -0.85 -0.20 0.00 -0.52 0.00 0.00 55.73 54.16 1x5x s ARG 72 Cb 0.00 -0.83 -0.06 0.00 0.52 0.00 0.00 34.95 34.58 1x5x s ARG 72 CO 0.00 0.19 1.12 -0.98 0.02 0.00 0.00 175.30 175.65 1x5x s ARG 73 N -1.46 3.45 -0.77 3.54 3.03 -1.20 -3.93 118.95 121.62 1x5x s ARG 73 Ca -0.01 1.60 -0.06 0.00 2.03 0.00 0.00 55.73 59.29 1x5x s ARG 73 Cb -0.09 -2.06 0.01 0.00 -1.03 0.00 0.00 34.95 31.78 1x5x s ARG 73 CO 0.02 -0.77 0.62 0.45 -1.13 0.00 0.00 175.30 174.49 1x5x n SER 74 N -1.18 -5.13 -3.74 -2.89 2.88 0.97 -4.98 113.62 99.55 1x5x n SER 74 Ca 0.11 -0.79 -0.13 0.00 -1.33 0.00 0.00 58.87 56.72 1x5x n SER 74 Cb 0.51 -1.91 -0.09 0.00 -0.75 0.00 0.00 64.21 61.97 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 -2.78 0.03 0.14 2.46 2.01 -1.25 -4.96 115.64 111.28 1x5x s THR 75 Ca 0.06 -0.21 -0.04 0.00 0.31 0.00 0.00 61.69 61.80 1x5x s THR 75 Cb -0.01 -0.58 -0.05 0.00 0.01 0.00 0.00 72.50 71.87 1x5x s THR 75 CO 0.88 -0.12 0.36 -1.59 -0.69 0.00 0.00 174.62 173.46 1x5x s LYS 76 N -0.54 3.59 -0.09 4.92 0.00 -1.26 -2.79 119.74 123.56 1x5x s LYS 76 Ca -0.07 -0.15 -0.20 0.00 0.00 0.00 0.00 55.97 55.55 1x5x s LYS 76 Cb -0.04 -2.87 0.05 0.00 0.00 0.00 0.00 37.83 34.97 1x5x s LYS 76 CO 0.03 0.48 0.48 0.71 0.00 0.00 0.00 175.35 177.05 1x5x s TYR 77 N -1.65 -0.45 -0.18 1.78 2.02 -1.15 -4.75 117.35 112.97 1x5x s TYR 77 Ca 0.40 0.90 -0.09 0.00 -0.37 0.00 0.00 57.07 57.91 1x5x s TYR 77 Cb -0.12 0.21 -0.05 0.00 -0.40 0.00 0.00 41.96 41.61 1x5x s TYR 77 CO 0.25 -0.40 0.12 0.15 -1.57 0.00 0.00 175.55 174.10 1x5x s LYS 78 N -0.70 4.01 0.17 -0.62 1.02 -1.13 -2.56 119.74 119.93 1x5x s LYS 78 Ca -0.08 -0.23 0.09 0.00 0.02 0.00 0.00 55.97 55.78 1x5x s LYS 78 Cb -0.03 -3.34 -0.04 0.00 -0.52 0.00 0.00 37.83 33.90 1x5x s LYS 78 CO 0.04 0.38 -0.20 -0.06 -0.92 0.00 0.00 175.35 174.60 1x5x s PHE 79 N 0.11 1.95 -0.19 3.18 0.08 0.13 -1.43 117.98 121.81 1x5x s PHE 79 Ca 0.09 -0.44 -0.10 0.00 0.12 0.00 0.00 56.93 56.60 1x5x s PHE 79 Cb -0.11 -0.97 0.06 0.00 -0.57 0.00 0.00 43.02 41.43 1x5x s PHE 79 CO -0.01 0.38 0.45 -1.59 -0.10 0.00 0.00 175.22 174.35 1x5x s LYS 80 N -2.77 0.43 -0.18 0.44 -2.85 -1.07 -0.07 119.74 113.66 1x5x s LYS 80 Ca 0.17 0.86 -0.23 0.00 -1.00 0.00 0.00 55.97 55.78 1x5x s LYS 80 Cb -0.06 0.02 -0.02 0.00 -2.06 0.00 0.00 37.83 35.71 1x5x s LYS 80 CO 0.08 -0.16 0.72 0.54 0.10 0.00 0.00 175.35 176.62 1x5x s VAL 81 N 1.51 4.96 -0.27 1.79 0.11 -1.26 -1.97 120.40 125.26 1x5x s VAL 81 Ca -0.09 1.38 -0.02 0.00 -2.93 0.00 0.00 61.98 60.32 1x5x s VAL 81 Cb -0.08 -4.03 0.04 0.00 -1.53 0.00 0.00 36.38 30.78 1x5x s VAL 81 CO -0.14 0.08 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.05 1x5x s ILE 82 N 1.99 2.96 -0.10 7.04 1.01 -0.08 -2.32 121.20 131.71 1x5x s ILE 82 Ca 0.33 -1.19 -0.20 0.00 0.00 0.00 0.00 60.65 59.60 1x5x s ILE 82 Cb -0.16 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 1x5x s ILE 82 CO 0.11 0.05 0.54 0.00 0.00 0.00 0.00 174.94 175.64 1x5x s ALA 83 N 1.29 3.44 0.06 9.38 0.00 -1.26 0.17 121.76 134.84 1x5x s ALA 83 Ca -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 51.96 51.83 1x5x s ALA 83 Cb -0.18 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.17 1x5x s ALA 83 CO -0.03 -0.02 -0.02 1.52 0.00 0.00 0.00 175.76 177.22 1x5x s TYR 84 N 0.63 0.57 0.14 0.00 -0.85 -0.73 -2.35 117.35 114.75 1x5x s TYR 84 Ca 0.29 -1.08 0.09 0.00 -0.52 0.00 0.00 57.07 55.85 1x5x s TYR 84 Cb -0.16 -0.41 -0.04 0.00 0.38 0.00 0.00 41.96 41.74 1x5x s TYR 84 CO 0.13 -0.38 -0.21 1.21 -1.52 0.00 0.00 175.55 174.77 1x5x s ASN 85 N -2.94 2.79 0.59 -0.18 2.47 0.53 -3.67 114.94 114.54 1x5x s ASN 85 Ca 0.09 -0.77 0.30 0.00 0.42 0.00 0.00 52.86 52.90 1x5x s ASN 85 Cb 0.08 -0.17 1.23 0.00 -1.45 0.00 0.00 41.25 40.94 1x5x s ASN 85 CO -0.09 0.05 1.57 -1.28 -3.72 0.00 0.00 177.10 173.64 1x5x h SER 86 N 3.70 0.00 0.02 -4.21 0.87 -1.98 0.95 113.55 112.90 1x5x h SER 86 Ca -0.46 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.02 1x5x h SER 86 Cb 1.19 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 63.16 1x5x h SER 86 CO 0.44 0.00 -0.35 -0.33 -0.53 0.00 0.00 176.83 176.05 1x5x h GLU 87 N 0.00 0.20 -2.02 2.24 5.08 -2.05 -3.49 114.58 114.54 1x5x h GLU 87 Ca 0.43 -0.24 0.28 0.00 -1.00 0.00 0.00 59.36 58.83 1x5x h GLU 87 Cb 2.34 0.08 -0.08 0.00 0.50 0.00 0.00 28.75 31.58 1x5x h GLU 87 CO -0.00 1.01 0.76 0.20 -1.00 0.00 0.00 179.01 179.97 1x5x s GLY 88 N -4.07 -0.18 0.31 -3.84 0.00 0.33 -5.18 107.32 94.69 1x5x s GLY 88 Ca -0.16 0.18 0.07 0.00 0.00 0.00 0.00 44.72 44.81 1x5x s GLY 88 CO 0.76 2.38 0.28 -1.59 0.00 0.00 0.00 173.10 174.93 1x5x s LYS 89 N -2.34 2.82 0.00 2.90 -2.85 -1.26 0.20 119.74 119.21 1x5x s LYS 89 Ca 0.21 -1.19 0.00 0.00 -1.00 0.00 0.00 55.97 53.98 1x5x s LYS 89 Cb 0.01 -2.53 0.00 0.00 -2.06 0.00 0.00 37.83 33.24 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 -1.34 1.54 -4.82 0.03 7.64 -0.99 -4.80 113.62 110.88 1x5x n SER 90 Ca -0.04 -0.51 -0.33 0.00 1.01 0.00 0.00 58.87 59.01 1x5x n SER 90 Cb 0.59 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.76 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 -0.24 6.44 0.76 6.43 4.22 -1.26 -4.84 114.94 126.45 1x5x s ASN 91 Ca 0.00 1.73 -0.11 0.00 -2.14 0.00 0.00 52.86 52.33 1x5x s ASN 91 Cb 0.00 -2.53 0.05 0.00 1.28 0.00 0.00 41.25 40.05 1x5x s ASN 91 CO 0.00 -0.71 1.08 -2.16 -2.04 0.00 0.00 177.10 173.27 1x5x s PRO 92 N -3.71 2.38 0.48 3.55 0.04 -1.26 -4.55 135.00 131.92 1x5x s PRO 92 Ca 0.62 0.75 0.01 0.00 0.04 0.00 0.00 61.00 62.42 1x5x s PRO 92 Cb -0.12 -1.94 0.09 0.00 0.04 0.00 0.00 34.50 32.57 1x5x s PRO 92 CO 0.26 -1.44 0.66 0.45 0.04 0.00 0.00 177.00 176.97 1x5x n SER 93 N -3.33 0.99 -4.72 6.66 2.88 -0.98 -4.94 113.62 110.19 1x5x n SER 93 Ca 0.07 -1.81 -0.42 0.00 -1.33 0.00 0.00 58.87 55.38 1x5x n SER 93 Cb 0.55 -0.41 -0.03 0.00 -0.75 0.00 0.00 64.21 63.57 1x5x n SER 93 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1x5x s GLU 94 N -4.16 4.17 -0.19 -1.46 0.41 -1.26 -4.74 118.70 111.48 1x5x s GLU 94 Ca 0.44 2.48 -0.29 0.00 -0.41 0.00 0.00 54.97 57.19 1x5x s GLU 94 Cb -0.03 -3.12 -0.02 0.00 -1.78 0.00 0.00 34.13 29.19 1x5x s GLU 94 CO 0.29 -0.68 1.35 0.08 -0.49 0.00 0.00 175.26 175.82 1x5x s VAL 95 N 1.17 4.11 0.41 2.63 1.01 -1.26 -4.67 120.40 123.79 1x5x s VAL 95 Ca 0.72 1.32 0.08 0.00 0.00 0.00 0.00 61.98 64.10 1x5x s VAL 95 Cb -0.47 -3.94 0.00 0.00 0.00 0.00 0.00 36.38 31.98 1x5x s VAL 95 CO 0.32 -0.21 0.52 0.68 0.00 0.00 0.00 175.10 176.41 1x5x s VAL 96 N 3.91 3.12 0.09 2.92 -7.23 0.90 -4.89 120.40 119.21 1x5x s VAL 96 Ca 0.59 -1.05 0.05 0.00 -1.81 0.00 0.00 61.98 59.75 1x5x s VAL 96 Cb -0.22 -3.06 -0.03 0.00 0.56 0.00 0.00 36.38 33.62 1x5x s VAL 96 CO 0.20 -0.03 -0.12 -0.70 -0.31 0.00 0.00 175.10 174.14 1x5x s GLU 97 N -4.29 0.83 0.33 4.82 2.12 -1.26 -0.70 118.70 120.56 1x5x s GLU 97 Ca 0.52 -1.05 -0.08 0.00 0.36 0.00 0.00 54.97 54.73 1x5x s GLU 97 Cb -0.09 -0.70 0.01 0.00 0.26 0.00 0.00 34.13 33.61 1x5x s GLU 97 CO 0.32 0.14 0.55 -0.06 -0.54 0.00 0.00 175.26 175.67 1x5x s PHE 98 N -1.79 0.69 0.03 5.30 0.08 -1.06 -5.00 117.98 116.23 1x5x s PHE 98 Ca 0.01 -1.06 0.01 0.00 0.12 0.00 0.00 56.93 56.01 1x5x s PHE 98 Cb -0.07 0.19 -0.02 0.00 -0.57 0.00 0.00 43.02 42.55 1x5x s PHE 98 CO 0.02 -1.21 -0.04 0.99 -0.10 0.00 0.00 175.22 174.87 1x5x s THR 99 N -3.08 0.24 0.35 0.64 2.01 -1.26 -2.94 115.64 111.60 1x5x s THR 99 Ca 0.25 -0.92 0.03 0.00 0.31 0.00 0.00 61.69 61.37 1x5x s THR 99 Cb -0.02 -0.36 -0.02 0.00 0.01 0.00 0.00 72.50 72.12 1x5x s THR 99 CO 0.16 -0.44 0.52 0.42 -0.69 0.00 0.00 174.62 174.59 1x5x s THR 100 N -1.36 4.49 1.03 -0.82 -4.23 -1.12 -4.84 115.64 108.79 1x5x s THR 100 Ca -0.13 -0.75 -0.15 0.00 -1.18 0.00 0.00 61.69 59.48 1x5x s THR 100 Cb -0.10 -3.61 0.09 0.00 1.34 0.00 0.00 72.50 70.22 1x5x s THR 100 CO -0.01 -0.32 0.31 0.00 -0.54 0.00 0.00 174.62 174.06 1x5x h PRO 102 N -1.86 0.37 0.00 0.00 0.13 -1.95 0.28 132.00 128.97 1x5x h PRO 102 Ca -0.49 -0.36 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 1x5x h PRO 102 Cb 1.32 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.54 1x5x h PRO 102 CO 0.37 1.02 0.00 -3.47 -0.23 0.00 0.00 178.00 175.69 1x5x n ASP 103 N -4.31 0.00 -4.97 1.44 2.03 -1.26 -4.12 116.55 105.36 1x5x n ASP 103 Ca -0.09 0.00 -0.20 0.00 0.52 0.00 0.00 54.79 55.01 1x5x n ASP 103 Cb 0.60 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.98 1x5x n ASP 103 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1x5x s SER 104 N 0.00 6.16 0.00 1.67 0.01 -1.26 -5.10 113.70 115.18 1x5x s SER 104 Ca 0.00 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.23 1x5x s SER 104 Cb 0.00 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.58 1x5x s SER 104 CO 0.00 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.09 1x5x n GLY 105 N -1.46 -1.26 0.15 3.44 0.00 -1.26 -5.03 105.19 99.77 1x5x n GLY 105 Ca -0.06 -0.93 -0.17 0.00 0.00 0.00 0.00 46.02 44.86 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 0.47 -6.48 1.61 0.13 -2.04 -3.44 132.00 122.25 1x5x h PRO 106 Ca 0.00 -0.45 -0.53 0.00 -0.87 0.00 0.00 66.00 64.15 1x5x h PRO 106 Cb 0.00 0.12 0.03 0.00 0.13 0.00 0.00 31.00 31.28 1x5x h PRO 106 CO 0.00 1.10 1.06 -1.54 -0.23 0.00 0.00 178.00 178.39 1x5x s SER 107 N -6.76 6.51 0.22 1.44 1.04 -1.26 -4.42 113.70 110.47 1x5x s SER 107 Ca -0.13 2.63 0.00 0.00 0.48 0.00 0.00 55.95 58.93 1x5x s SER 107 Cb 0.04 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.60 1x5x s SER 107 CO 0.83 -0.95 0.00 -1.20 0.98 0.00 0.00 173.24 172.90 1x5x n SER 108 N 5.71 -8.42 0.00 7.02 7.64 -1.26 -5.09 113.62 119.22 1x5x n SER 108 Ca 0.17 1.25 0.00 0.00 1.01 0.00 0.00 58.87 61.30 1x5x n SER 108 Cb 0.39 -4.67 0.00 0.00 -1.01 0.00 0.00 64.21 58.92 1x5x n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64