#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkn s VAL 3 N 0.00 3.43 -0.07 -3.33 1.01 -1.26 -0.65 120.40 119.52 2dkn s VAL 3 Ca 0.00 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.52 2dkn s VAL 3 Cb 0.00 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.83 2dkn s VAL 3 CO 0.00 0.42 -0.09 -0.63 0.00 0.00 0.00 175.10 174.79 2dkn s ILE 4 N 1.49 0.99 0.00 2.22 1.01 0.04 -1.39 121.20 125.55 2dkn s ILE 4 Ca 0.06 -0.36 -0.16 0.00 0.00 0.00 0.00 60.65 60.19 2dkn s ILE 4 Cb -0.14 -0.94 -0.06 0.00 0.01 0.00 0.00 42.46 41.33 2dkn s ILE 4 CO -0.03 0.33 0.46 0.00 0.00 0.00 0.00 174.94 175.70 2dkn s ALA 5 N 0.98 3.64 -0.15 9.38 0.00 -0.37 -0.81 121.76 134.43 2dkn s ALA 5 Ca -0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 51.96 51.71 2dkn s ALA 5 Cb -0.15 -2.48 0.04 0.00 0.00 0.00 0.00 23.12 20.53 2dkn s ALA 5 CO 0.00 0.40 -0.01 0.42 0.00 0.00 0.00 175.76 176.57 2dkn s ILE 6 N -0.86 0.73 0.33 0.00 1.01 -0.24 -0.47 121.20 121.71 2dkn s ILE 6 Ca 0.25 -0.43 -0.23 0.00 0.00 0.00 0.00 60.65 60.24 2dkn s ILE 6 Cb -0.17 -1.02 -0.10 0.00 0.01 0.00 0.00 42.46 41.18 2dkn s ILE 6 CO 0.14 0.04 0.89 0.42 0.00 0.00 0.00 174.94 176.44 2dkn s THR 7 N 1.79 4.35 -0.38 2.92 -4.23 -0.04 -1.25 115.64 118.80 2dkn s THR 7 Ca 0.01 1.58 0.00 0.00 -1.18 0.00 0.00 61.69 62.10 2dkn s THR 7 Cb -0.15 -3.85 0.00 0.00 1.34 0.00 0.00 72.50 69.84 2dkn s THR 7 CO -0.07 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 2dkn n GLY 8 N 0.22 0.28 0.02 3.99 0.00 0.99 -2.27 105.19 108.43 2dkn n GLY 8 Ca 0.03 -0.74 0.09 0.00 0.00 0.00 0.00 46.02 45.40 2dkn n GLY 8 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dkn n SER 9 N 1.21 0.13 -0.03 1.61 3.41 -1.18 -3.60 113.62 115.17 2dkn n SER 9 Ca -0.05 0.53 0.13 0.00 -0.26 0.00 0.00 58.87 59.22 2dkn n SER 9 Cb 0.47 -0.56 0.42 0.00 -0.26 0.00 0.00 64.21 64.28 2dkn n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dkn n ALA 10 N -1.55 3.05 -3.10 7.33 0.00 -1.26 -3.07 120.51 121.91 2dkn n ALA 10 Ca 0.04 -0.26 -0.09 0.00 0.00 0.00 0.00 53.44 53.12 2dkn n ALA 10 Cb 0.22 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.36 2dkn n ALA 10 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2dkn s SER 11 N -2.91 -0.13 0.65 0.00 0.15 -1.24 -4.85 113.70 105.37 2dkn s SER 11 Ca 0.15 -0.68 0.00 0.00 0.70 0.00 0.00 55.95 56.12 2dkn s SER 11 Cb 0.18 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 65.03 2dkn s SER 11 CO 0.61 -1.02 0.00 0.61 1.20 0.00 0.00 173.24 174.64 2dkn n GLY 12 N -0.31 2.90 0.24 9.45 0.00 -1.26 -1.64 105.19 114.57 2dkn n GLY 12 Ca -0.08 -0.01 -0.07 0.00 0.00 0.00 0.00 46.02 45.86 2dkn n GLY 12 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2dkn h ILE 13 N 0.00 1.17 -0.78 -0.61 2.04 -1.88 -1.60 117.51 115.85 2dkn h ILE 13 Ca 0.00 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.42 2dkn h ILE 13 Cb 0.00 0.43 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 2dkn h ILE 13 CO 0.00 0.18 0.34 1.23 0.00 0.00 0.00 178.15 179.90 2dkn h GLY 14 N 0.75 1.23 1.03 5.37 0.00 -1.60 -0.44 103.07 109.41 2dkn h GLY 14 Ca 0.20 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 2dkn h GLY 14 CO -0.04 0.61 0.11 0.00 0.00 0.00 0.00 176.54 177.22 2dkn h ALA 15 N 1.18 0.78 -0.65 3.60 0.00 -1.11 0.16 119.26 123.22 2dkn h ALA 15 Ca 0.26 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2dkn h ALA 15 Cb 0.17 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2dkn h ALA 15 CO -0.03 0.52 0.15 0.00 0.00 0.00 0.00 179.25 179.90 2dkn h ALA 16 N 1.02 0.85 -0.32 0.00 0.00 -0.86 -2.09 119.26 117.86 2dkn h ALA 16 Ca 0.18 -0.24 -0.15 0.00 0.00 0.00 0.00 54.91 54.70 2dkn h ALA 16 Cb 0.40 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2dkn h ALA 16 CO 0.01 0.57 -0.40 1.25 0.00 0.00 0.00 179.25 180.69 2dkn h LEU 17 N 0.96 0.90 -0.53 0.00 5.85 -0.91 -0.63 115.31 120.95 2dkn h LEU 17 Ca 0.20 -0.49 0.06 0.00 0.84 0.00 0.00 57.88 58.49 2dkn h LEU 17 Cb 0.37 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 41.09 2dkn h LEU 17 CO 0.00 1.21 0.24 0.50 -0.34 0.00 0.00 178.44 180.06 2dkn h LYS 18 N 0.61 0.44 -0.04 1.25 3.64 -0.80 -0.15 116.57 121.53 2dkn h LYS 18 Ca 0.04 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2dkn h LYS 18 Cb 0.99 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.71 2dkn h LYS 18 CO 0.09 0.29 0.01 1.49 -2.27 0.00 0.00 179.45 179.07 2dkn h GLU 19 N 0.46 0.07 -0.18 1.90 4.81 -1.24 -1.57 114.58 118.82 2dkn h GLU 19 Ca 0.24 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.51 2dkn h GLU 19 Cb 0.20 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 29.51 2dkn h GLU 19 CO -0.20 0.30 -0.25 1.25 -0.73 0.00 0.00 179.01 179.38 2dkn h LEU 20 N -0.17 -0.77 -0.84 1.64 6.46 -0.80 -1.69 115.31 119.13 2dkn h LEU 20 Ca 0.01 0.13 -0.07 0.00 -0.12 0.00 0.00 57.88 57.83 2dkn h LEU 20 Cb 0.26 0.35 -0.02 0.00 -0.73 0.00 0.00 40.66 40.52 2dkn h LEU 20 CO 0.00 -0.29 0.09 -0.07 -0.62 0.00 0.00 178.44 177.55 2dkn h LEU 21 N -0.28 0.91 -0.32 2.25 3.38 -1.02 -2.41 115.31 117.81 2dkn h LEU 21 Ca 0.12 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 2dkn h LEU 21 Cb 0.46 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2dkn h LEU 21 CO -0.35 0.91 0.10 0.00 0.09 0.00 0.00 178.44 179.20 2dkn h ALA 22 N 1.19 0.42 -0.01 1.53 0.00 -1.05 -1.35 119.26 119.99 2dkn h ALA 22 Ca 0.18 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 2dkn h ALA 22 Cb 0.40 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 2dkn h ALA 22 CO 0.01 0.06 -0.14 0.00 0.00 0.00 0.00 179.25 179.18 2dkn h ARG 23 N 0.36 0.01 -0.00 0.00 3.08 -1.21 -0.62 114.38 116.00 2dkn h ARG 23 Ca 0.10 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2dkn h ARG 23 Cb 0.25 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2dkn h ARG 23 CO -0.00 0.15 -0.00 0.00 -1.07 0.00 0.00 179.97 179.05 2dkn n ALA 24 N -2.51 2.67 0.00 0.04 0.00 -0.92 -4.91 120.51 114.88 2dkn n ALA 24 Ca -0.02 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2dkn n ALA 24 Cb 0.21 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.19 2dkn n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dkn n GLY 25 N 1.03 0.70 3.88 0.00 0.00 -0.24 -5.04 105.19 105.52 2dkn n GLY 25 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 2dkn n GLY 25 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dkn s HIS 26 N -2.00 3.53 -0.25 1.61 3.76 -0.54 -4.67 115.29 116.73 2dkn s HIS 26 Ca 0.00 1.14 -0.19 0.00 -0.15 0.00 0.00 55.06 55.86 2dkn s HIS 26 Cb 0.00 -2.55 -0.03 0.00 1.11 0.00 0.00 32.58 31.11 2dkn s HIS 26 CO 0.00 -0.36 0.55 0.99 -0.85 0.00 0.00 174.74 175.07 2dkn s THR 27 N -2.73 5.05 -0.17 1.30 2.01 0.17 -4.30 115.64 116.97 2dkn s THR 27 Ca 0.53 0.96 -0.05 0.00 0.31 0.00 0.00 61.69 63.44 2dkn s THR 27 Cb -0.10 -3.86 -0.03 0.00 0.01 0.00 0.00 72.50 68.52 2dkn s THR 27 CO 0.41 0.08 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.71 2dkn s VAL 28 N 2.31 4.09 -0.36 3.82 1.01 -1.26 -0.78 120.40 129.24 2dkn s VAL 28 Ca 0.23 -0.28 -0.09 0.00 0.00 0.00 0.00 61.98 61.84 2dkn s VAL 28 Cb -0.16 -2.81 0.03 0.00 0.00 0.00 0.00 36.38 33.44 2dkn s VAL 28 CO 0.09 0.48 0.16 -0.63 0.00 0.00 0.00 175.10 175.20 2dkn s ILE 29 N 0.44 4.22 -0.03 2.22 1.01 0.01 -4.96 121.20 124.12 2dkn s ILE 29 Ca -0.02 -0.96 -0.15 0.00 0.00 0.00 0.00 60.65 59.52 2dkn s ILE 29 Cb -0.14 -3.36 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 2dkn s ILE 29 CO 0.02 -0.20 0.40 -0.83 0.00 0.00 0.00 174.94 174.34 2dkn s GLY 30 N 1.49 2.45 -0.09 6.18 0.00 -1.26 -1.07 107.32 115.01 2dkn s GLY 30 Ca 0.01 -0.24 0.02 0.00 0.00 0.00 0.00 44.72 44.51 2dkn s GLY 30 CO 0.05 0.22 -0.15 -0.42 0.00 0.00 0.00 173.10 172.80 2dkn s ILE 31 N -0.79 1.44 0.38 0.90 1.09 -0.38 -1.05 121.20 122.79 2dkn s ILE 31 Ca 0.23 -0.62 -0.13 0.00 -1.10 0.00 0.00 60.65 59.03 2dkn s ILE 31 Cb -0.16 -1.30 0.05 0.00 -1.06 0.00 0.00 42.46 39.98 2dkn s ILE 31 CO 0.12 0.43 0.73 -0.62 -0.10 0.00 0.00 174.94 175.50 2dkn s ASP 32 N 0.84 0.22 0.38 3.58 2.15 -0.65 -0.01 116.67 123.17 2dkn s ASP 32 Ca -0.10 -1.25 0.07 0.00 0.43 0.00 0.00 52.55 51.70 2dkn s ASP 32 Cb -0.15 0.83 0.74 0.00 -0.30 0.00 0.00 42.92 44.03 2dkn s ASP 32 CO 0.01 -1.64 1.94 0.03 -0.17 0.00 0.00 175.17 175.35 2dkn h ARG 33 N 2.02 0.43 -2.78 4.34 3.08 -1.86 -0.42 114.38 119.19 2dkn h ARG 33 Ca -0.32 -0.07 0.07 0.00 0.07 0.00 0.00 59.98 59.73 2dkn h ARG 33 Cb 1.25 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 31.20 2dkn h ARG 33 CO 0.41 0.43 0.37 0.20 -1.07 0.00 0.00 179.97 180.32 2dkn s GLY 34 N -3.87 0.12 -1.33 0.04 0.00 -1.26 -4.25 107.32 96.76 2dkn s GLY 34 Ca -0.07 -0.42 -0.01 0.00 0.00 0.00 0.00 44.72 44.22 2dkn s GLY 34 CO 0.74 0.44 0.69 -1.06 0.00 0.00 0.00 173.10 173.91 2dkn n GLN 35 N -0.55 -4.81 -3.75 2.90 6.02 -1.26 -4.77 117.38 111.16 2dkn n GLN 35 Ca -0.06 0.60 -0.10 0.00 -0.01 0.00 0.00 57.00 57.43 2dkn n GLN 35 Cb 0.60 -5.14 -0.05 0.00 1.02 0.00 0.00 30.24 26.67 2dkn n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2dkn s ALA 36 N -3.67 -0.71 0.25 -1.58 0.00 -1.26 -4.57 121.76 110.21 2dkn s ALA 36 Ca 0.05 -0.31 -0.04 0.00 0.00 0.00 0.00 51.96 51.66 2dkn s ALA 36 Cb -0.02 0.77 0.46 0.00 0.00 0.00 0.00 23.12 24.33 2dkn s ALA 36 CO 0.82 -0.70 1.74 -0.44 0.00 0.00 0.00 175.76 177.19 2dkn h ASP 37 N 2.36 0.35 -3.11 0.00 3.45 -1.90 -3.39 116.42 114.19 2dkn h ASP 37 Ca -0.32 0.10 -0.62 0.00 0.43 0.00 0.00 57.03 56.62 2dkn h ASP 37 Cb 1.25 0.06 -0.36 0.00 -0.56 0.00 0.00 39.33 39.72 2dkn h ASP 37 CO 0.44 0.14 -0.84 -0.63 -1.57 0.00 0.00 179.24 176.79 2dkn s ILE 38 N -6.01 1.72 -0.30 0.35 1.01 -0.21 -5.00 121.20 112.76 2dkn s ILE 38 Ca -0.12 -0.74 -0.09 0.00 0.00 0.00 0.00 60.65 59.70 2dkn s ILE 38 Cb 0.21 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 41.06 2dkn s ILE 38 CO 0.77 0.48 0.15 -1.61 0.00 0.00 0.00 174.94 174.72 2dkn s GLU 39 N 1.43 3.42 -0.10 2.79 2.02 -1.26 -1.64 118.70 125.36 2dkn s GLU 39 Ca 0.05 -0.66 -0.22 0.00 0.02 0.00 0.00 54.97 54.16 2dkn s GLU 39 Cb -0.13 -3.54 0.05 0.00 0.10 0.00 0.00 34.13 30.61 2dkn s GLU 39 CO -0.11 -0.37 0.53 0.00 0.02 0.00 0.00 175.26 175.33 2dkn s ALA 40 N 1.63 -1.35 -0.57 5.21 0.00 -0.17 -4.94 121.76 121.57 2dkn s ALA 40 Ca 0.05 1.14 -0.19 0.00 0.00 0.00 0.00 51.96 52.96 2dkn s ALA 40 Cb -0.17 -0.32 0.10 0.00 0.00 0.00 0.00 23.12 22.74 2dkn s ALA 40 CO 0.06 -0.30 0.67 0.34 0.00 0.00 0.00 175.76 176.53 2dkn s ASP 41 N -0.68 6.19 0.00 0.00 3.68 -1.26 -3.70 116.67 120.90 2dkn s ASP 41 Ca -0.08 -1.38 0.13 0.00 2.13 0.00 0.00 52.55 53.36 2dkn s ASP 41 Cb -0.03 -2.29 0.78 0.00 -1.45 0.00 0.00 42.92 39.93 2dkn s ASP 41 CO 0.05 -1.05 1.36 0.18 0.13 0.00 0.00 175.17 175.84 2dkn n LEU 42 N 6.21 0.00 -0.44 -1.34 4.77 -1.26 -3.09 117.00 121.85 2dkn n LEU 42 Ca -0.09 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.03 2dkn n LEU 42 Cb 0.43 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 42.04 2dkn n LEU 42 CO 0.57 0.00 0.85 -1.54 -1.33 0.00 0.00 177.39 175.95 2dkn n SER 43 N -0.75 1.39 -4.21 -1.43 3.41 -1.26 -3.67 113.62 107.10 2dkn n SER 43 Ca 0.10 -1.41 -0.17 0.00 -0.26 0.00 0.00 58.87 57.13 2dkn n SER 43 Cb 0.05 0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 63.90 2dkn n SER 43 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2dkn s THR 44 N -2.06 1.17 0.30 6.66 -4.23 -1.18 -4.73 115.64 111.58 2dkn s THR 44 Ca 0.37 -1.59 0.02 0.00 -1.18 0.00 0.00 61.69 59.30 2dkn s THR 44 Cb 0.21 -1.37 0.29 0.00 1.34 0.00 0.00 72.50 72.97 2dkn s THR 44 CO 0.36 -0.41 1.87 -0.65 -0.54 0.00 0.00 174.62 175.25 2dkn h PRO 45 N 3.72 0.96 -0.32 3.99 0.11 -1.90 -1.14 132.00 137.42 2dkn h PRO 45 Ca -0.39 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 2dkn h PRO 45 Cb 1.19 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 2dkn h PRO 45 CO 0.49 0.63 0.18 0.78 -0.21 0.00 0.00 178.00 179.87 2dkn h GLY 46 N 0.99 0.46 1.03 -0.55 0.00 -1.96 -0.98 103.07 102.05 2dkn h GLY 46 Ca 0.45 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.54 2dkn h GLY 46 CO -0.21 0.19 0.32 -1.33 0.00 0.00 0.00 176.54 175.51 2dkn h GLY 47 N 0.40 1.19 1.02 4.60 0.00 -1.51 -2.03 103.07 106.75 2dkn h GLY 47 Ca 0.11 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 2dkn h GLY 47 CO -0.02 0.60 0.35 3.21 0.00 0.00 0.00 176.54 180.68 2dkn h ARG 48 N 1.07 1.10 -0.38 4.80 3.08 -0.98 -1.33 114.38 121.73 2dkn h ARG 48 Ca 0.25 -0.17 0.01 0.00 0.07 0.00 0.00 59.98 60.14 2dkn h ARG 48 Cb 0.19 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 2dkn h ARG 48 CO -0.02 0.86 0.24 1.49 -1.07 0.00 0.00 179.97 181.47 2dkn h GLU 49 N 1.07 0.48 -0.02 0.04 4.81 -0.92 0.24 114.58 120.29 2dkn h GLU 49 Ca 0.26 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 59.48 2dkn h GLU 49 Cb 0.13 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.39 2dkn h GLU 49 CO -0.03 0.32 -0.08 1.15 -0.73 0.00 0.00 179.01 179.63 2dkn h THR 50 N 0.49 0.78 -0.21 0.32 2.02 -1.16 -1.44 112.91 113.72 2dkn h THR 50 Ca 0.14 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.37 2dkn h THR 50 Cb -0.04 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.11 2dkn h THR 50 CO -0.04 0.00 -0.06 0.00 0.37 0.00 0.00 175.52 175.79 2dkn h ALA 51 N 0.86 0.13 0.05 6.16 0.00 -0.81 -0.34 119.26 125.31 2dkn h ALA 51 Ca 0.04 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2dkn h ALA 51 Cb 0.19 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2dkn h ALA 51 CO -0.10 -0.48 -0.06 0.28 0.00 0.00 0.00 179.25 178.89 2dkn h VAL 52 N -0.01 0.87 -0.76 0.00 2.07 -0.80 0.77 116.25 118.38 2dkn h VAL 52 Ca 0.10 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.65 2dkn h VAL 52 Cb 0.17 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 2dkn h VAL 52 CO -0.22 0.00 0.49 0.00 0.02 0.00 0.00 177.57 177.86 2dkn h ALA 53 N 0.83 1.00 -0.51 1.67 0.00 -1.09 -0.43 119.26 120.74 2dkn h ALA 53 Ca 0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2dkn h ALA 53 Cb 0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2dkn h ALA 53 CO -0.03 0.30 0.02 0.00 0.00 0.00 0.00 179.25 179.54 2dkn h ALA 54 N 1.32 0.68 -0.14 0.00 0.00 -0.78 -1.24 119.26 119.10 2dkn h ALA 54 Ca 0.30 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 2dkn h ALA 54 Cb -0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2dkn h ALA 54 CO -0.11 0.48 0.08 0.28 0.00 0.00 0.00 179.25 179.98 2dkn h VAL 55 N 0.75 1.08 -0.74 0.00 2.07 -0.46 -1.36 116.25 117.58 2dkn h VAL 55 Ca 0.15 -0.20 0.07 0.00 0.82 0.00 0.00 66.70 67.54 2dkn h VAL 55 Cb 0.50 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 2dkn h VAL 55 CO 0.02 0.07 0.42 -0.07 0.02 0.00 0.00 177.57 178.03 2dkn h LEU 56 N 0.15 0.61 -0.25 2.57 3.38 -0.90 -0.98 115.31 119.88 2dkn h LEU 56 Ca 0.05 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2dkn h LEU 56 Cb 0.04 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2dkn h LEU 56 CO -0.01 0.38 0.14 -0.78 0.09 0.00 0.00 178.44 178.26 2dkn h ASP 57 N 0.74 0.31 0.35 -0.43 3.58 -1.07 -0.15 116.42 119.74 2dkn h ASP 57 Ca 0.34 -0.07 -0.07 0.00 0.42 0.00 0.00 57.03 57.65 2dkn h ASP 57 Cb 0.26 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 2dkn h ASP 57 CO -0.21 0.29 -0.35 0.03 -2.88 0.00 0.00 179.24 176.12 2dkn h ARG 58 N 0.30 0.00 -0.29 0.28 3.08 -0.39 -2.97 114.38 114.39 2dkn h ARG 58 Ca 0.09 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2dkn h ARG 58 Cb 0.04 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.09 2dkn h ARG 58 CO -0.02 0.35 0.00 0.00 -1.07 0.00 0.00 179.97 179.24 2dkn n GLY 60 N 1.20 -0.37 2.35 0.00 0.00 -0.45 -2.54 105.19 105.37 2dkn n GLY 60 Ca 0.16 -0.11 -0.04 0.00 0.00 0.00 0.00 46.02 46.03 2dkn n GLY 60 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dkn n GLY 61 N -1.09 0.64 2.87 -0.02 0.00 -0.20 -5.00 105.19 102.39 2dkn n GLY 61 Ca -0.19 -0.29 -0.26 0.00 0.00 0.00 0.00 46.02 45.28 2dkn n GLY 61 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dkn s VAL 62 N -1.92 0.90 -0.06 1.61 1.01 -1.05 -4.30 120.40 116.59 2dkn s VAL 62 Ca 0.00 -0.29 0.03 0.00 0.00 0.00 0.00 61.98 61.73 2dkn s VAL 62 Cb 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 36.38 35.39 2dkn s VAL 62 CO 0.00 0.28 -0.16 -0.22 0.00 0.00 0.00 175.10 175.00 2dkn s LEU 63 N 1.75 1.82 0.08 3.92 0.20 -0.68 -4.78 118.68 120.99 2dkn s LEU 63 Ca 0.04 -0.35 0.22 0.00 0.69 0.00 0.00 54.13 54.73 2dkn s LEU 63 Cb -0.13 -0.95 -0.11 0.00 -0.43 0.00 0.00 46.19 44.57 2dkn s LEU 63 CO -0.08 0.10 0.84 0.47 -0.29 0.00 0.00 176.35 177.39 2dkn n ASP 64 N 3.48 0.50 -3.68 3.68 10.43 -0.49 -3.59 116.55 126.89 2dkn n ASP 64 Ca -0.20 0.05 -0.14 0.00 2.57 0.00 0.00 54.79 57.07 2dkn n ASP 64 Cb 0.52 1.09 -0.08 0.00 1.84 0.00 0.00 41.12 44.49 2dkn n ASP 64 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 2dkn s GLY 65 N -4.21 -0.36 -0.02 0.44 0.00 -0.93 -2.14 107.32 100.10 2dkn s GLY 65 Ca -0.02 1.13 -0.00 0.00 0.00 0.00 0.00 44.72 45.83 2dkn s GLY 65 CO 0.84 0.89 0.03 -2.27 0.00 0.00 0.00 173.10 172.59 2dkn s LEU 66 N -0.44 1.04 -0.18 0.66 2.96 -1.01 -1.24 118.68 120.47 2dkn s LEU 66 Ca -0.06 0.04 0.01 0.00 -0.22 0.00 0.00 54.13 53.90 2dkn s LEU 66 Cb -0.03 -0.07 0.03 0.00 0.50 0.00 0.00 46.19 46.62 2dkn s LEU 66 CO 0.04 -0.13 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.12 2dkn s VAL 67 N 1.12 1.63 -0.80 1.68 1.01 0.38 -0.84 120.40 124.57 2dkn s VAL 67 Ca -0.09 -0.85 -0.17 0.00 0.00 0.00 0.00 61.98 60.87 2dkn s VAL 67 Cb -0.13 -1.62 0.15 0.00 0.00 0.00 0.00 36.38 34.78 2dkn s VAL 67 CO -0.03 0.30 0.90 0.00 0.00 0.00 0.00 175.10 176.28 2dkn n ALA 70 N -1.67 1.57 -3.64 0.00 0.00 -0.96 -4.75 120.51 111.05 2dkn n ALA 70 Ca -0.01 0.42 -0.05 0.00 0.00 0.00 0.00 53.44 53.81 2dkn n ALA 70 Cb 0.21 -2.36 -0.02 0.00 0.00 0.00 0.00 19.45 17.28 2dkn n ALA 70 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2dkn s GLY 71 N 0.73 -0.34 0.13 0.00 0.00 -1.26 -4.73 107.32 101.85 2dkn s GLY 71 Ca 0.74 0.59 0.06 0.00 0.00 0.00 0.00 44.72 46.11 2dkn s GLY 71 CO 0.41 0.16 -0.15 -1.34 0.00 0.00 0.00 173.10 172.19 2dkn s VAL 72 N -3.07 1.42 0.00 1.40 -7.23 -1.26 -5.05 120.40 106.60 2dkn s VAL 72 Ca 0.10 -1.76 0.00 0.00 -1.81 0.00 0.00 61.98 58.51 2dkn s VAL 72 Cb -0.00 -1.60 0.00 0.00 0.56 0.00 0.00 36.38 35.34 2dkn s VAL 72 CO -0.03 -0.41 0.00 0.61 -0.31 0.00 0.00 175.10 174.97 2dkn n GLY 73 N 0.47 5.34 0.16 2.32 0.00 -1.26 -4.95 105.19 107.28 2dkn n GLY 73 Ca -0.15 -2.03 0.12 0.00 0.00 0.00 0.00 46.02 43.96 2dkn n GLY 73 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2dkn h VAL 74 N 0.00 0.00 -0.39 1.61 -1.51 -1.94 -1.38 116.25 112.65 2dkn h VAL 74 Ca 0.00 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 65.36 2dkn h VAL 74 Cb 0.00 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 29.88 2dkn h VAL 74 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 177.57 176.69 2dkn n THR 75 N -2.30 0.53 -0.65 7.19 -2.24 -1.26 -4.78 114.28 110.76 2dkn n THR 75 Ca -0.00 -0.52 -0.31 0.00 -2.27 0.00 0.00 64.05 60.95 2dkn n THR 75 Cb 0.12 0.25 0.18 0.00 -2.10 0.00 0.00 70.33 68.78 2dkn n THR 75 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dkn s ALA 76 N -1.49 1.16 0.23 6.98 0.00 -0.52 -4.91 121.76 123.21 2dkn s ALA 76 Ca 0.26 0.51 -0.07 0.00 0.00 0.00 0.00 51.96 52.66 2dkn s ALA 76 Cb 0.14 -3.43 0.39 0.00 0.00 0.00 0.00 23.12 20.21 2dkn s ALA 76 CO 0.18 -2.96 1.71 0.00 0.00 0.00 0.00 175.76 174.69 2dkn h ALA 77 N -2.01 0.88 -2.73 0.00 0.00 -1.92 -3.45 119.26 110.03 2dkn h ALA 77 Ca -0.46 0.13 0.11 0.00 0.00 0.00 0.00 54.91 54.70 2dkn h ALA 77 Cb 1.28 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 2dkn h ALA 77 CO 0.42 -0.28 0.35 0.54 0.00 0.00 0.00 179.25 180.28 2dkn s ASN 78 N -5.30 -0.20 0.35 0.00 4.22 -1.26 -5.04 114.94 107.70 2dkn s ASN 78 Ca -0.13 -0.58 0.04 0.00 -2.14 0.00 0.00 52.86 50.05 2dkn s ASN 78 Cb 0.19 0.64 0.63 0.00 1.28 0.00 0.00 41.25 43.99 2dkn s ASN 78 CO 0.75 -1.19 1.93 0.28 -2.04 0.00 0.00 177.10 176.83 2dkn h SER 79 N 2.00 0.57 -0.90 3.54 0.02 -1.88 -2.59 113.55 114.32 2dkn h SER 79 Ca -0.22 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.65 2dkn h SER 79 Cb 1.24 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.59 2dkn h SER 79 CO 0.26 0.54 0.55 1.23 -1.14 0.00 0.00 176.83 178.26 2dkn h GLY 80 N 0.80 1.30 1.08 -3.77 0.00 -1.86 -2.60 103.07 98.02 2dkn h GLY 80 Ca 0.15 -0.53 -0.12 0.00 0.00 0.00 0.00 47.33 46.83 2dkn h GLY 80 CO -0.01 0.52 -0.16 -2.00 0.00 0.00 0.00 176.54 174.89 2dkn h LEU 81 N 1.24 0.99 -0.33 3.11 5.85 -1.86 -1.21 115.31 123.08 2dkn h LEU 81 Ca 0.32 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.72 2dkn h LEU 81 Cb -0.06 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.65 2dkn h LEU 81 CO -0.06 1.14 0.03 0.58 -0.34 0.00 0.00 178.44 179.78 2dkn h VAL 82 N 0.83 0.79 -0.47 1.05 2.07 -1.34 -0.96 116.25 118.21 2dkn h VAL 82 Ca 0.12 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.53 2dkn h VAL 82 Cb 0.73 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.13 2dkn h VAL 82 CO 0.06 0.02 0.06 0.58 0.02 0.00 0.00 177.57 178.31 2dkn h VAL 83 N 0.13 1.25 -0.81 2.57 2.07 -1.31 0.15 116.25 120.30 2dkn h VAL 83 Ca 0.16 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 2dkn h VAL 83 Cb 0.20 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 2dkn h VAL 83 CO -0.24 0.33 0.48 0.00 0.02 0.00 0.00 177.57 178.16 2dkn h ALA 84 N 0.95 1.04 0.00 1.67 0.00 -0.72 -1.73 119.26 120.46 2dkn h ALA 84 Ca 0.14 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 2dkn h ALA 84 Cb 0.41 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 2dkn h ALA 84 CO 0.01 0.51 -0.52 0.28 0.00 0.00 0.00 179.25 179.54 2dkn h VAL 85 N 1.12 0.97 -0.06 0.00 2.07 -1.13 0.31 116.25 119.53 2dkn h VAL 85 Ca 0.29 -1.90 -0.10 0.00 0.82 0.00 0.00 66.70 65.80 2dkn h VAL 85 Cb -0.02 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.74 2dkn h VAL 85 CO -0.05 0.33 -0.44 0.78 0.02 0.00 0.00 177.57 178.21 2dkn h ASN 86 N -1.00 0.15 0.00 0.57 4.21 -0.73 -2.51 115.58 116.26 2dkn h ASN 86 Ca -0.12 -0.06 0.00 0.00 1.21 0.00 0.00 56.30 57.32 2dkn h ASN 86 Cb 0.89 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 38.05 2dkn h ASN 86 CO -0.07 0.57 -0.64 0.00 -1.29 0.00 0.00 177.43 176.00 2dkn n TYR 87 N -4.01 0.09 0.12 1.19 9.36 -0.67 -4.52 117.16 118.72 2dkn n TYR 87 Ca -0.02 0.04 -0.02 0.00 3.32 0.00 0.00 57.90 61.22 2dkn n TYR 87 Cb 0.48 -0.38 0.10 0.00 -0.63 0.00 0.00 39.34 38.91 2dkn n TYR 87 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2dkn h PHE 88 N -0.69 0.00 0.00 2.98 0.04 -1.36 0.44 116.94 118.35 2dkn h PHE 88 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2dkn h PHE 88 Cb 0.64 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.78 2dkn h PHE 88 CO -0.27 0.70 -0.09 0.78 -0.60 0.00 0.00 178.31 178.82 2dkn h GLY 89 N 2.20 0.00 0.00 -1.45 0.00 -0.46 -1.39 103.07 101.97 2dkn h GLY 89 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.26 2dkn h GLY 89 CO 0.09 0.00 -0.42 -2.08 0.00 0.00 0.00 176.54 174.13 2dkn h VAL 90 N 0.00 0.76 -0.74 4.60 2.07 -1.48 -3.34 116.25 118.11 2dkn h VAL 90 Ca -0.00 -1.69 -0.04 0.00 0.82 0.00 0.00 66.70 65.79 2dkn h VAL 90 Cb 0.24 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 2dkn h VAL 90 CO 0.01 0.26 0.31 0.77 0.02 0.00 0.00 177.57 178.93 2dkn h SER 91 N -1.00 1.01 0.34 0.57 4.64 -0.86 -0.65 113.55 117.60 2dkn h SER 91 Ca -0.09 -0.14 -0.11 0.00 -0.47 0.00 0.00 61.79 60.98 2dkn h SER 91 Cb 0.73 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.54 2dkn h SER 91 CO -0.05 0.89 -0.45 0.00 -0.87 0.00 0.00 176.83 176.34 2dkn h ALA 92 N 1.26 1.13 -0.14 5.18 0.00 -1.47 0.56 119.26 125.78 2dkn h ALA 92 Ca 0.25 -0.43 -0.20 0.00 0.00 0.00 0.00 54.91 54.53 2dkn h ALA 92 Cb 0.19 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.91 2dkn h ALA 92 CO -0.02 0.60 -0.69 -0.07 0.00 0.00 0.00 179.25 179.07 2dkn h LEU 93 N 0.12 0.84 -0.20 0.00 4.07 -1.50 -0.96 115.31 117.67 2dkn h LEU 93 Ca 0.01 -0.63 0.03 0.00 0.08 0.00 0.00 57.88 57.36 2dkn h LEU 93 Cb 0.85 -0.25 -0.03 0.00 1.08 0.00 0.00 40.66 42.31 2dkn h LEU 93 CO 0.07 1.34 0.04 -0.07 -1.08 0.00 0.00 178.44 178.73 2dkn h LEU 94 N 0.40 0.00 -0.01 1.67 3.38 -0.90 -1.54 115.31 118.32 2dkn h LEU 94 Ca -0.05 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2dkn h LEU 94 Cb 1.33 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.09 2dkn h LEU 94 CO 0.14 0.03 -0.12 0.44 0.09 0.00 0.00 178.44 179.02 2dkn h ASP 95 N 0.11 -0.35 0.73 -0.43 3.32 -0.84 -1.10 116.42 117.87 2dkn h ASP 95 Ca 0.09 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 2dkn h ASP 95 Cb 0.09 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2dkn h ASP 95 CO -0.12 -0.17 -0.35 1.23 -1.72 0.00 0.00 179.24 178.11 2dkn h GLY 96 N -0.20 0.00 -1.23 2.75 0.00 -1.07 -3.24 103.07 100.08 2dkn h GLY 96 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 2dkn h GLY 96 CO -0.12 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.46 2dkn n LEU 97 N -3.61 2.37 -0.25 3.11 4.77 -0.59 -4.60 117.00 118.20 2dkn n LEU 97 Ca -0.01 -1.19 0.02 0.00 -0.03 0.00 0.00 56.01 54.80 2dkn n LEU 97 Cb 0.47 -0.06 0.14 0.00 -2.33 0.00 0.00 43.42 41.64 2dkn n LEU 97 CO 0.36 0.47 1.07 0.00 -1.33 0.00 0.00 177.39 177.97 2dkn h ALA 98 N 2.72 1.00 -0.24 -1.18 0.00 -1.23 -0.30 119.26 120.04 2dkn h ALA 98 Ca 0.00 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2dkn h ALA 98 Cb 0.63 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 2dkn h ALA 98 CO 0.00 -0.04 -0.08 1.49 0.00 0.00 0.00 179.25 180.62 2dkn h GLU 99 N 0.62 0.48 -0.69 0.00 4.81 -1.82 -0.41 114.58 117.58 2dkn h GLU 99 Ca 0.36 -0.20 0.05 0.00 -0.13 0.00 0.00 59.36 59.44 2dkn h GLU 99 Cb 0.37 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.68 2dkn h GLU 99 CO -0.27 0.73 0.40 0.00 -0.73 0.00 0.00 179.01 179.14 2dkn h ALA 100 N 0.74 0.91 -0.78 2.92 0.00 -1.66 -2.14 119.26 119.25 2dkn h ALA 100 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2dkn h ALA 100 Cb 0.56 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2dkn h ALA 100 CO 0.03 0.12 0.43 -0.07 0.00 0.00 0.00 179.25 179.76 2dkn h LEU 101 N 0.76 0.97 -2.63 0.00 3.38 -0.86 -1.67 115.31 115.26 2dkn h LEU 101 Ca 0.29 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 2dkn h LEU 101 Cb 0.12 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 2dkn h LEU 101 CO -0.15 0.79 -0.01 0.77 0.09 0.00 0.00 178.44 179.93 2dkn h SER 102 N 1.08 0.00 0.39 -0.43 4.64 -0.42 -1.44 113.55 117.38 2dkn h SER 102 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2dkn h SER 102 Cb 0.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.12 2dkn h SER 102 CO -0.05 0.01 -0.56 0.54 -0.87 0.00 0.00 176.83 175.90 2dkn n ARG 103 N -3.54 0.08 -1.20 4.77 1.74 -0.90 -4.92 116.66 112.69 2dkn n ARG 103 Ca -0.03 -0.05 -0.19 0.00 -0.77 0.00 0.00 57.85 56.81 2dkn n ARG 103 Cb 0.09 -1.50 0.14 0.00 -1.02 0.00 0.00 32.46 30.17 2dkn n ARG 103 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dkn n GLY 104 N 1.49 -1.50 3.44 -0.13 0.00 -0.54 -4.83 105.19 103.11 2dkn n GLY 104 Ca 0.06 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.04 2dkn n GLY 104 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dkn s GLN 105 N -4.89 3.64 -1.37 1.61 -1.52 -1.26 -4.45 119.66 111.41 2dkn s GLN 105 Ca 0.50 -0.49 -0.03 0.00 -1.95 0.00 0.00 55.36 53.39 2dkn s GLN 105 Cb -0.02 -3.31 -0.00 0.00 -0.22 0.00 0.00 33.01 29.46 2dkn s GLN 105 CO 0.35 -0.19 0.46 1.04 -0.25 0.00 0.00 175.29 176.70 2dkn n GLN 106 N 4.92 -3.05 -2.27 2.91 6.02 -1.26 -4.88 117.38 119.78 2dkn n GLN 106 Ca -0.16 0.40 -0.33 0.00 -0.01 0.00 0.00 57.00 56.90 2dkn n GLN 106 Cb 0.51 -4.45 -0.01 0.00 1.02 0.00 0.00 30.24 27.31 2dkn n GLN 106 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2dkn s PRO 107 N -6.51 3.53 0.03 -1.09 0.04 -1.26 -4.92 135.00 124.82 2dkn s PRO 107 Ca 0.06 1.28 -0.23 0.00 0.04 0.00 0.00 61.00 62.14 2dkn s PRO 107 Cb -0.02 -2.06 0.05 0.00 0.04 0.00 0.00 34.50 32.51 2dkn s PRO 107 CO 0.89 -0.64 0.53 0.00 0.04 0.00 0.00 177.00 177.82 2dkn s ALA 108 N -2.24 -1.36 0.06 8.56 0.00 -0.91 -2.40 121.76 123.47 2dkn s ALA 108 Ca 0.65 0.70 0.04 0.00 0.00 0.00 0.00 51.96 53.35 2dkn s ALA 108 Cb -0.16 0.30 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 2dkn s ALA 108 CO 0.29 -0.47 -0.12 0.00 0.00 0.00 0.00 175.76 175.47 2dkn s ALA 109 N -2.16 0.98 -0.04 0.00 0.00 0.36 -2.40 121.76 118.50 2dkn s ALA 109 Ca -0.07 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 50.96 2dkn s ALA 109 Cb -0.01 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 23.08 2dkn s ALA 109 CO 0.01 0.09 -0.06 0.08 0.00 0.00 0.00 175.76 175.87 2dkn s VAL 110 N -1.42 0.62 -0.17 0.00 1.01 -0.02 -2.06 120.40 118.37 2dkn s VAL 110 Ca -0.04 -0.22 -0.09 0.00 0.00 0.00 0.00 61.98 61.63 2dkn s VAL 110 Cb -0.09 -0.60 -0.05 0.00 0.00 0.00 0.00 36.38 35.64 2dkn s VAL 110 CO 0.01 0.22 0.13 -0.63 0.00 0.00 0.00 175.10 174.84 2dkn s ILE 111 N 0.57 5.45 -0.56 2.22 1.01 -0.48 -0.96 121.20 128.45 2dkn s ILE 111 Ca -0.08 0.20 -0.22 0.00 0.00 0.00 0.00 60.65 60.54 2dkn s ILE 111 Cb -0.12 -3.45 0.05 0.00 0.01 0.00 0.00 42.46 38.96 2dkn s ILE 111 CO 0.01 0.51 0.86 -0.69 0.00 0.00 0.00 174.94 175.62 2dkn s VAL 112 N -0.16 4.51 0.00 2.92 1.01 -0.63 -1.03 120.40 127.03 2dkn s VAL 112 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2dkn s VAL 112 Cb -0.11 -4.50 0.00 0.00 0.00 0.00 0.00 36.38 31.77 2dkn s VAL 112 CO 0.00 -1.09 0.00 0.61 0.00 0.00 0.00 175.10 174.63 2dkn n GLY 113 N 5.17 0.88 3.64 4.51 0.00 0.11 -4.89 105.19 114.60 2dkn n GLY 113 Ca -0.01 -0.38 -0.04 0.00 0.00 0.00 0.00 46.02 45.59 2dkn n GLY 113 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dkn s SER 114 N -1.00 -0.10 0.66 1.61 0.15 -1.26 -4.50 113.70 109.25 2dkn s SER 114 Ca 0.00 0.15 0.43 0.00 0.70 0.00 0.00 55.95 57.23 2dkn s SER 114 Cb 0.00 0.13 2.34 0.00 -1.71 0.00 0.00 66.02 66.78 2dkn s SER 114 CO 0.00 -0.07 2.35 -0.29 1.20 0.00 0.00 173.24 176.42 2dkn h ILE 115 N 2.49 0.04 -0.01 6.45 2.10 -1.52 -0.94 117.51 126.12 2dkn h ILE 115 Ca -0.16 -0.04 0.00 0.00 1.08 0.00 0.00 64.86 65.75 2dkn h ILE 115 Cb 1.19 1.03 -0.00 0.00 -1.09 0.00 0.00 36.82 37.95 2dkn h ILE 115 CO 0.21 0.00 0.02 0.00 -1.08 0.00 0.00 178.15 177.31 2dkn h ALA 116 N 2.00 1.43 -0.12 0.18 0.00 -1.94 -0.74 119.26 120.06 2dkn h ALA 116 Ca -0.00 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.95 2dkn h ALA 116 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2dkn h ALA 116 CO 0.00 -0.03 0.21 0.00 0.00 0.00 0.00 179.25 179.44 2dkn h ALA 117 N 1.97 1.57 -0.16 0.00 0.00 -1.37 -1.89 119.26 119.38 2dkn h ALA 117 Ca 0.01 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dkn h ALA 117 Cb 0.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2dkn h ALA 117 CO -0.00 -0.28 0.00 0.25 0.00 0.00 0.00 179.25 179.22 2dkn n THR 118 N -3.45 0.20 -1.64 0.00 -2.24 -0.28 -4.53 114.28 102.33 2dkn n THR 118 Ca 0.00 -0.50 -0.46 0.00 -2.27 0.00 0.00 64.05 60.82 2dkn n THR 118 Cb 0.31 0.95 -0.03 0.00 -2.10 0.00 0.00 70.33 69.46 2dkn n THR 118 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2dkn n GLN 119 N 0.99 1.75 -1.72 -0.78 7.27 -0.71 -4.86 117.38 119.33 2dkn n GLN 119 Ca 0.17 0.63 -0.43 0.00 0.07 0.00 0.00 57.00 57.44 2dkn n GLN 119 Cb 0.51 -2.25 -0.02 0.00 2.41 0.00 0.00 30.24 30.89 2dkn n GLN 119 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 2dkn n PRO 120 N 2.17 2.45 -0.10 3.69 -0.02 -1.26 -1.92 135.00 140.01 2dkn n PRO 120 Ca 0.14 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.49 2dkn n PRO 120 Cb 0.28 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.17 2dkn n PRO 120 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2dkn n GLY 121 N 1.94 1.92 0.36 -1.23 0.00 -1.26 -4.91 105.19 102.01 2dkn n GLY 121 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.13 2dkn n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkn h ALA 122 N 0.00 1.51 0.00 4.61 0.00 -1.72 -1.97 119.26 121.69 2dkn h ALA 122 Ca 0.00 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2dkn h ALA 122 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2dkn h ALA 122 CO 0.00 0.41 -0.20 0.00 0.00 0.00 0.00 179.25 179.46 2dkn h ALA 123 N 1.53 1.51 -0.25 0.00 0.00 -1.88 -2.77 119.26 117.40 2dkn h ALA 123 Ca 0.32 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2dkn h ALA 123 Cb 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2dkn h ALA 123 CO -0.09 0.26 0.00 -0.85 0.00 0.00 0.00 179.25 178.56 2dkn n GLU 124 N -4.07 2.27 -1.82 0.00 0.00 -0.75 -4.88 120.64 111.39 2dkn n GLU 124 Ca -0.02 -1.90 -0.42 0.00 0.00 0.00 0.00 57.16 54.82 2dkn n GLU 124 Cb 0.28 -1.48 -0.03 0.00 0.00 0.00 0.00 31.44 30.21 2dkn n GLU 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2dkn s LEU 125 N -1.63 4.37 0.35 -1.84 1.43 -1.05 -4.90 118.68 115.42 2dkn s LEU 125 Ca 0.35 2.72 0.10 0.00 -1.03 0.00 0.00 54.13 56.27 2dkn s LEU 125 Cb 0.21 -3.59 0.85 0.00 0.03 0.00 0.00 46.19 43.69 2dkn s LEU 125 CO 0.30 -0.92 1.84 -0.65 0.23 0.00 0.00 176.35 177.15 2dkn h PRO 126 N 7.26 0.64 -0.07 1.29 0.11 -1.91 -1.33 132.00 137.99 2dkn h PRO 126 Ca -0.43 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 65.66 2dkn h PRO 126 Cb 1.20 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2dkn h PRO 126 CO 0.94 0.43 0.05 0.00 -0.21 0.00 0.00 178.00 179.20 2dkn h MET 127 N 0.66 0.00 -0.47 1.05 -0.00 -1.89 -1.97 114.93 112.31 2dkn h MET 127 Ca 0.49 0.00 0.01 0.00 -0.00 0.00 0.00 59.70 60.20 2dkn h MET 127 Cb 0.87 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.45 2dkn h MET 127 CO -0.25 0.00 0.31 0.28 -0.00 0.00 0.00 176.91 177.25 2dkn h VAL 128 N 0.00 1.10 -0.91 -0.10 2.07 -1.55 -0.47 116.25 116.39 2dkn h VAL 128 Ca 0.03 -0.21 0.01 0.00 0.82 0.00 0.00 66.70 67.35 2dkn h VAL 128 Cb 0.13 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 2dkn h VAL 128 CO -0.00 0.11 0.59 -0.33 0.02 0.00 0.00 177.57 177.96 2dkn h GLU 129 N 0.62 1.20 -0.55 1.57 5.08 -1.46 -1.00 114.58 120.03 2dkn h GLU 129 Ca 0.18 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 2dkn h GLU 129 Cb -0.05 -0.27 -0.02 0.00 0.50 0.00 0.00 28.75 28.92 2dkn h GLU 129 CO -0.05 0.81 -0.10 0.00 -1.00 0.00 0.00 179.01 178.67 2dkn h ALA 130 N 1.32 0.76 0.03 3.43 0.00 -1.39 -0.81 119.26 122.59 2dkn h ALA 130 Ca 0.33 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2dkn h ALA 130 Cb -0.12 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 2dkn h ALA 130 CO -0.07 0.67 -0.08 0.52 0.00 0.00 0.00 179.25 180.29 2dkn h MET 131 N 0.92 -0.15 0.00 0.00 2.86 -0.76 -1.28 114.93 116.53 2dkn h MET 131 Ca 0.14 0.01 -0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2dkn h MET 131 Cb 0.67 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 2dkn h MET 131 CO 0.05 -0.10 -0.26 -0.07 1.06 0.00 0.00 176.91 177.59 2dkn h LEU 132 N -0.15 0.00 -0.20 1.22 3.38 -0.99 0.29 115.31 118.86 2dkn h LEU 132 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2dkn h LEU 132 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2dkn h LEU 132 CO -0.06 0.26 0.00 0.00 0.09 0.00 0.00 178.44 178.72 2dkn n ALA 133 N -2.35 2.02 -1.00 1.53 0.00 -0.33 -4.92 120.51 115.45 2dkn n ALA 133 Ca -0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 53.44 53.41 2dkn n ALA 133 Cb 0.35 -1.41 -0.00 0.00 0.00 0.00 0.00 19.45 18.39 2dkn n ALA 133 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dkn n GLY 134 N 0.77 0.46 3.44 0.00 0.00 0.09 -4.98 105.19 104.97 2dkn n GLY 134 Ca 0.05 -0.38 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 2dkn n GLY 134 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dkn s ASP 135 N -2.35 6.73 0.15 1.61 -1.08 -0.55 -4.88 116.67 116.30 2dkn s ASP 135 Ca 0.00 -2.28 -0.12 0.00 -0.52 0.00 0.00 52.55 49.62 2dkn s ASP 135 Cb 0.00 -2.39 0.03 0.00 -1.46 0.00 0.00 42.92 39.10 2dkn s ASP 135 CO 0.00 -0.96 1.63 -0.08 0.52 0.00 0.00 175.17 176.28 2dkn h GLU 136 N 8.42 0.86 -0.74 4.34 4.81 -1.94 -0.56 114.58 129.79 2dkn h GLU 136 Ca 0.19 -0.24 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 2dkn h GLU 136 Cb 0.99 -0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.24 2dkn h GLU 136 CO 1.11 0.86 0.44 0.00 -0.73 0.00 0.00 179.01 180.69 2dkn h ALA 137 N 0.97 0.94 -0.49 2.92 0.00 -1.97 -0.58 119.26 121.06 2dkn h ALA 137 Ca 0.15 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 2dkn h ALA 137 Cb 0.43 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2dkn h ALA 137 CO 0.01 0.42 -0.07 -0.09 0.00 0.00 0.00 179.25 179.52 2dkn h ARG 138 N 1.01 0.91 -0.53 0.00 9.65 -1.88 -1.56 114.38 121.98 2dkn h ARG 138 Ca 0.26 -0.33 -0.02 0.00 -1.10 0.00 0.00 59.98 58.79 2dkn h ARG 138 Cb -0.02 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 2dkn h ARG 138 CO -0.05 0.98 0.24 0.00 2.80 0.00 0.00 179.97 183.94 2dkn h ALA 139 N 0.90 0.69 -0.48 2.80 0.00 -0.75 -0.54 119.26 121.89 2dkn h ALA 139 Ca 0.13 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2dkn h ALA 139 Cb 0.61 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.17 2dkn h ALA 139 CO 0.04 0.27 0.14 0.82 0.00 0.00 0.00 179.25 180.51 2dkn h ILE 140 N 0.72 1.23 -0.07 0.00 2.04 -1.03 0.58 117.51 120.98 2dkn h ILE 140 Ca 0.18 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.26 2dkn h ILE 140 Cb 0.15 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2dkn h ILE 140 CO -0.02 0.28 0.03 -0.08 0.00 0.00 0.00 178.15 178.36 2dkn h GLU 141 N 0.64 0.07 -0.88 2.37 4.81 -1.06 -0.49 114.58 120.03 2dkn h GLU 141 Ca 0.15 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2dkn h GLU 141 Cb 0.29 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 2dkn h GLU 141 CO -0.00 0.04 0.56 -0.07 -0.73 0.00 0.00 179.01 178.81 2dkn h LEU 142 N 0.07 1.04 -0.41 1.64 3.38 -0.96 -0.60 115.31 119.47 2dkn h LEU 142 Ca 0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2dkn h LEU 142 Cb 0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 2dkn h LEU 142 CO -0.02 0.78 0.26 0.00 0.09 0.00 0.00 178.44 179.54 2dkn h ALA 143 N 1.30 0.52 -0.43 1.53 0.00 -0.59 0.94 119.26 122.54 2dkn h ALA 143 Ca 0.32 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2dkn h ALA 143 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2dkn h ALA 143 CO -0.06 0.00 0.23 0.93 0.00 0.00 0.00 179.25 180.35 2dkn h GLU 144 N 0.54 0.60 -0.16 0.00 4.39 -0.71 -2.65 114.58 116.59 2dkn h GLU 144 Ca 0.15 -0.07 -0.06 0.00 0.34 0.00 0.00 59.36 59.72 2dkn h GLU 144 Cb -0.02 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.50 2dkn h GLU 144 CO -0.03 0.48 -0.15 1.96 -1.16 0.00 0.00 179.01 180.11 2dkn h GLN 145 N 0.56 0.27 -0.06 2.33 4.20 -0.86 -2.32 115.11 119.21 2dkn h GLN 145 Ca 0.15 -0.07 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 2dkn h GLN 145 Cb 0.06 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.79 2dkn h GLN 145 CO -0.02 0.43 -0.25 0.37 -0.67 0.00 0.00 178.83 178.68 2dkn h GLN 146 N 0.25 0.11 0.00 1.46 5.75 -0.48 -3.47 115.11 118.73 2dkn h GLN 146 Ca 0.05 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2dkn h GLN 146 Cb 0.43 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.97 2dkn h GLN 146 CO 0.03 0.36 0.00 0.41 -2.65 0.00 0.00 178.83 176.98 2dkn n GLY 147 N -0.69 1.42 2.79 2.39 0.00 -0.88 -5.04 105.19 105.18 2dkn n GLY 147 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 2dkn n GLY 147 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dkn s GLN 148 N -0.35 0.19 0.45 1.61 -0.21 -1.26 -5.03 119.66 115.07 2dkn s GLN 148 Ca 0.00 0.13 0.11 0.00 0.02 0.00 0.00 55.36 55.61 2dkn s GLN 148 Cb 0.00 -0.44 1.01 0.00 1.00 0.00 0.00 33.01 34.59 2dkn s GLN 148 CO 0.00 -0.16 2.09 1.79 -2.12 0.00 0.00 175.29 176.89 2dkn h THR 149 N 6.27 1.06 0.00 -0.19 1.35 -1.94 -1.38 112.91 118.08 2dkn h THR 149 Ca -0.41 -0.12 -0.04 0.00 -0.55 0.00 0.00 66.41 65.30 2dkn h THR 149 Cb 1.13 0.68 -0.01 0.00 -1.73 0.00 0.00 68.15 68.22 2dkn h THR 149 CO 0.45 0.06 -0.18 1.12 -0.25 0.00 0.00 175.52 176.72 2dkn h HIS 150 N 0.35 0.00 0.02 4.73 2.07 -1.94 0.29 115.15 120.67 2dkn h HIS 150 Ca 0.10 0.00 -0.26 0.00 -2.85 0.00 0.00 60.37 57.37 2dkn h HIS 150 Cb -0.02 0.00 0.01 0.00 2.57 0.00 0.00 27.41 29.98 2dkn h HIS 150 CO -0.00 0.18 -1.04 -0.07 -3.07 0.00 0.00 177.93 173.93 2dkn h LEU 151 N 0.00 0.73 -0.91 6.12 3.38 -1.69 -1.37 115.31 121.58 2dkn h LEU 151 Ca -0.00 -0.61 -0.08 0.00 0.09 0.00 0.00 57.88 57.28 2dkn h LEU 151 Cb 0.32 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2dkn h LEU 151 CO 0.02 1.41 -0.11 0.00 0.09 0.00 0.00 178.44 179.86 2dkn h ALA 152 N 0.53 1.08 0.32 1.53 0.00 -1.07 0.13 119.26 121.79 2dkn h ALA 152 Ca -0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 2dkn h ALA 152 Cb 1.69 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.32 2dkn h ALA 152 CO 0.19 0.57 -0.15 -0.92 0.00 0.00 0.00 179.25 178.94 2dkn h TYR 153 N 0.63 -0.40 -0.68 0.00 3.20 -0.35 0.02 116.97 119.39 2dkn h TYR 153 Ca 0.11 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 2dkn h TYR 153 Cb 0.55 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.92 2dkn h TYR 153 CO 0.02 -0.13 0.40 0.00 -1.64 0.00 0.00 178.16 176.81 2dkn h ALA 154 N 0.00 0.87 -0.41 1.82 0.00 -1.24 -1.34 119.26 118.97 2dkn h ALA 154 Ca -0.04 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2dkn h ALA 154 Cb 0.44 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2dkn h ALA 154 CO 0.07 0.36 0.17 0.78 0.00 0.00 0.00 179.25 180.63 2dkn h GLY 155 N 0.93 0.64 1.37 0.00 0.00 -0.72 0.62 103.07 105.92 2dkn h GLY 155 Ca 0.24 -0.34 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 2dkn h GLY 155 CO -0.04 0.32 -0.42 1.48 0.00 0.00 0.00 176.54 177.88 2dkn h SER 156 N 0.51 0.73 -0.18 0.19 4.64 -0.80 -0.16 113.55 118.48 2dkn h SER 156 Ca 0.14 -0.34 -0.20 0.00 -0.47 0.00 0.00 61.79 60.92 2dkn h SER 156 Cb 0.17 -0.21 0.00 0.00 -0.31 0.00 0.00 62.40 62.06 2dkn h SER 156 CO -0.01 1.06 -0.65 0.11 -0.87 0.00 0.00 176.83 176.46 2dkn h LYS 157 N 0.56 0.80 0.36 4.77 1.79 -1.08 -1.05 116.57 122.72 2dkn h LYS 157 Ca 0.04 -0.57 -0.01 0.00 -2.18 0.00 0.00 60.65 57.93 2dkn h LYS 157 Cb 0.96 0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 31.69 2dkn h LYS 157 CO 0.09 1.19 -0.25 -0.92 -1.08 0.00 0.00 179.45 178.49 2dkn h TYR 158 N 0.59 -0.64 -0.49 -1.35 3.20 -0.73 -2.12 116.97 115.43 2dkn h TYR 158 Ca -0.02 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.89 2dkn h TYR 158 Cb 1.27 0.24 -0.04 0.00 1.54 0.00 0.00 36.73 39.73 2dkn h TYR 158 CO 0.08 -0.37 0.25 0.00 -1.64 0.00 0.00 178.16 176.47 2dkn h ALA 159 N -0.00 0.62 -0.00 1.82 0.00 -0.94 -1.26 119.26 119.50 2dkn h ALA 159 Ca -0.03 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2dkn h ALA 159 Cb 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2dkn h ALA 159 CO 0.02 -0.09 -0.51 -0.24 0.00 0.00 0.00 179.25 178.42 2dkn h VAL 160 N 0.49 1.37 -0.23 0.00 3.04 -1.17 0.36 116.25 120.12 2dkn h VAL 160 Ca 0.21 -1.75 -0.05 0.00 -1.01 0.00 0.00 66.70 64.10 2dkn h VAL 160 Cb 0.11 1.94 -0.01 0.00 -2.01 0.00 0.00 31.29 31.33 2dkn h VAL 160 CO -0.14 0.50 -0.06 0.74 -1.01 0.00 0.00 177.57 177.60 2dkn h THR 161 N 0.01 1.28 -0.88 3.17 2.02 -0.92 -2.62 112.91 114.97 2dkn h THR 161 Ca -0.00 -1.06 0.06 0.00 0.77 0.00 0.00 66.41 66.18 2dkn h THR 161 Cb 0.90 1.51 -0.06 0.00 -1.74 0.00 0.00 68.15 68.76 2dkn h THR 161 CO 0.07 0.33 0.55 0.00 0.37 0.00 0.00 175.52 176.83 2dkn h LEU 163 N 1.00 -0.12 -0.60 0.00 5.85 -0.83 0.43 115.31 121.04 2dkn h LEU 163 Ca 0.38 0.06 0.06 0.00 0.84 0.00 0.00 57.88 59.22 2dkn h LEU 163 Cb 0.16 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 2dkn h LEU 163 CO -0.17 -0.03 0.31 0.00 -0.34 0.00 0.00 178.44 178.21 2dkn h ALA 164 N 1.22 0.79 -0.17 1.25 0.00 -1.17 -1.93 119.26 119.25 2dkn h ALA 164 Ca 0.12 0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 2dkn h ALA 164 Cb 0.16 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2dkn h ALA 164 CO -0.21 -0.03 -0.71 0.00 0.00 0.00 0.00 179.25 178.30 2dkn h ARG 165 N 0.59 0.74 -0.49 0.00 3.08 -1.14 -3.18 114.38 113.98 2dkn h ARG 165 Ca 0.27 -0.56 -0.04 0.00 0.07 0.00 0.00 59.98 59.72 2dkn h ARG 165 Cb 0.18 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 2dkn h ARG 165 CO -0.18 1.18 0.16 -0.09 -1.07 0.00 0.00 179.97 179.97 2dkn h ARG 166 N 0.52 0.72 -0.66 0.04 2.43 0.17 -2.84 114.38 114.77 2dkn h ARG 166 Ca -0.03 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 2dkn h ARG 166 Cb 1.32 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 2dkn h ARG 166 CO 0.14 0.62 0.00 0.09 -1.51 0.00 0.00 179.97 179.32 2dkn n ASN 167 N -4.32 4.26 -0.32 -3.80 5.03 -0.75 -4.55 115.26 110.80 2dkn n ASN 167 Ca 0.04 -2.55 0.05 0.00 0.87 0.00 0.00 54.58 52.99 2dkn n ASN 167 Cb 0.18 -0.58 0.21 0.00 -1.02 0.00 0.00 39.78 38.57 2dkn n ASN 167 CO 0.00 0.00 0.00 1.62 -1.83 0.00 0.00 177.26 177.05 2dkn h VAL 168 N 3.10 0.87 -0.15 2.41 3.04 -1.48 -1.91 116.25 122.13 2dkn h VAL 168 Ca 0.00 -0.28 -0.16 0.00 -1.01 0.00 0.00 66.70 65.25 2dkn h VAL 168 Cb 1.44 -0.03 0.01 0.00 -2.01 0.00 0.00 31.29 30.69 2dkn h VAL 168 CO 0.29 0.15 -0.53 0.58 -1.01 0.00 0.00 177.57 177.06 2dkn h VAL 169 N 0.82 1.33 -0.51 1.51 2.07 -1.86 -1.66 116.25 117.97 2dkn h VAL 169 Ca 0.45 -1.79 0.05 0.00 0.82 0.00 0.00 66.70 66.23 2dkn h VAL 169 Cb 0.48 2.03 -0.05 0.00 -1.52 0.00 0.00 31.29 32.23 2dkn h VAL 169 CO -0.28 0.55 0.24 0.44 0.02 0.00 0.00 177.57 178.54 2dkn h ASP 170 N 0.28 0.33 -0.57 0.57 3.45 -1.79 0.06 116.42 118.76 2dkn h ASP 170 Ca -0.02 0.04 -0.05 0.00 0.43 0.00 0.00 57.03 57.42 2dkn h ASP 170 Cb 1.15 -0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.88 2dkn h ASP 170 CO 0.11 0.22 0.16 -0.50 -1.57 0.00 0.00 179.24 177.67 2dkn h TRP 171 N 0.47 0.93 -0.92 4.55 4.06 -1.35 -2.27 115.95 121.41 2dkn h TRP 171 Ca 0.23 -0.10 0.05 0.00 2.06 0.00 0.00 58.89 61.13 2dkn h TRP 171 Cb 0.17 -0.27 -0.06 0.00 -1.00 0.00 0.00 29.16 28.01 2dkn h TRP 171 CO -0.12 0.79 0.60 0.00 -3.56 0.00 0.00 178.44 176.15 2dkn h ALA 172 N 1.04 1.44 0.00 1.49 0.00 -0.89 -1.50 119.26 120.84 2dkn h ALA 172 Ca 0.18 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 2dkn h ALA 172 Cb 0.30 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2dkn h ALA 172 CO -0.00 0.45 -0.31 0.78 0.00 0.00 0.00 179.25 180.17 2dkn h GLY 173 N 1.12 0.00 1.54 0.00 0.00 -0.47 -0.60 103.07 104.66 2dkn h GLY 173 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 2dkn h GLY 173 CO -0.13 0.00 -0.07 0.54 0.00 0.00 0.00 176.54 176.88 2dkn n ARG 174 N -3.90 0.28 -1.46 4.80 1.74 -0.86 -4.93 116.66 112.33 2dkn n ARG 174 Ca -0.02 -0.05 -0.02 0.00 -0.77 0.00 0.00 57.85 57.00 2dkn n ARG 174 Cb 0.38 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.32 2dkn n ARG 174 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2dkn n GLY 175 N 1.39 0.43 3.17 -0.13 0.00 -0.23 -4.51 105.19 105.30 2dkn n GLY 175 Ca 0.11 -0.92 -0.32 0.00 0.00 0.00 0.00 46.02 44.89 2dkn n GLY 175 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dkn s VAL 176 N -2.08 1.95 0.42 1.61 1.01 -0.62 -4.39 120.40 118.30 2dkn s VAL 176 Ca 0.00 -0.93 -0.20 0.00 0.00 0.00 0.00 61.98 60.85 2dkn s VAL 176 Cb 0.00 -1.72 -0.10 0.00 0.00 0.00 0.00 36.38 34.56 2dkn s VAL 176 CO 0.00 0.53 0.92 -0.13 0.00 0.00 0.00 175.10 176.42 2dkn s ARG 177 N 0.68 4.17 -0.06 2.72 0.52 -1.01 -3.86 118.95 122.11 2dkn s ARG 177 Ca -0.11 1.03 -0.03 0.00 -0.52 0.00 0.00 55.73 56.10 2dkn s ARG 177 Cb -0.16 -2.22 0.04 0.00 0.52 0.00 0.00 34.95 33.13 2dkn s ARG 177 CO 0.02 -0.02 0.12 -1.17 0.02 0.00 0.00 175.30 174.27 2dkn s LEU 178 N -3.23 0.21 0.22 2.53 2.96 -1.26 -0.49 118.68 119.63 2dkn s LEU 178 Ca 0.60 0.24 0.02 0.00 -0.22 0.00 0.00 54.13 54.77 2dkn s LEU 178 Cb -0.09 0.15 -0.05 0.00 0.50 0.00 0.00 46.19 46.70 2dkn s LEU 178 CO 0.15 -0.22 0.03 0.20 -1.32 0.00 0.00 176.35 175.20 2dkn s ASN 179 N 1.97 1.35 -0.04 3.68 0.01 -0.87 -0.27 114.94 120.76 2dkn s ASN 179 Ca 0.00 -1.26 0.06 0.00 -0.71 0.00 0.00 52.86 50.96 2dkn s ASN 179 Cb -0.12 0.11 -0.01 0.00 0.41 0.00 0.00 41.25 41.64 2dkn s ASN 179 CO -0.05 -0.61 -0.24 -0.69 -1.51 0.00 0.00 177.10 174.00 2dkn s VAL 180 N -3.64 1.90 -0.16 1.60 1.01 -0.16 -1.39 120.40 119.57 2dkn s VAL 180 Ca 0.30 -1.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 2dkn s VAL 180 Cb 0.07 -1.60 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 2dkn s VAL 180 CO 0.08 0.53 0.05 -0.69 0.00 0.00 0.00 175.10 175.08 2dkn s VAL 181 N -0.28 4.72 -0.50 2.92 1.01 -0.20 -0.31 120.40 127.77 2dkn s VAL 181 Ca 0.01 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 61.94 2dkn s VAL 181 Cb -0.12 -3.10 0.13 0.00 0.00 0.00 0.00 36.38 33.29 2dkn s VAL 181 CO 0.02 0.49 0.26 0.00 0.00 0.00 0.00 175.10 175.87 2dkn s ALA 182 N 0.10 3.29 0.54 5.51 0.00 0.09 0.05 121.76 131.35 2dkn s ALA 182 Ca 0.05 -3.07 -0.18 0.00 0.00 0.00 0.00 51.96 48.75 2dkn s ALA 182 Cb -0.12 -2.28 -0.06 0.00 0.00 0.00 0.00 23.12 20.66 2dkn s ALA 182 CO 0.01 -1.96 1.07 -2.14 0.00 0.00 0.00 175.76 172.74 2dkn s PRO 183 N 0.12 3.48 0.00 0.00 0.02 -1.26 -1.34 135.00 136.01 2dkn s PRO 183 Ca 0.15 1.39 0.00 0.00 0.02 0.00 0.00 61.00 62.56 2dkn s PRO 183 Cb -0.23 -2.04 0.00 0.00 0.02 0.00 0.00 34.50 32.25 2dkn s PRO 183 CO -0.03 -0.71 0.00 0.41 -0.33 0.00 0.00 177.00 176.35 2dkn n GLY 184 N -0.35 1.56 3.73 0.52 0.00 -1.03 -1.62 105.19 108.01 2dkn n GLY 184 Ca 0.10 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 2dkn n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkn s ALA 185 N -3.29 3.87 0.01 4.61 0.00 -1.26 -4.92 121.76 120.78 2dkn s ALA 185 Ca 0.00 1.55 0.01 0.00 0.00 0.00 0.00 51.96 53.52 2dkn s ALA 185 Cb 0.00 -3.67 -0.01 0.00 0.00 0.00 0.00 23.12 19.44 2dkn s ALA 185 CO 0.00 -0.92 -0.03 0.08 0.00 0.00 0.00 175.76 174.89 2dkn s VAL 186 N 0.88 0.23 -1.05 0.00 1.01 -1.26 -1.18 120.40 119.03 2dkn s VAL 186 Ca 0.71 -0.36 -0.07 0.00 0.00 0.00 0.00 61.98 62.27 2dkn s VAL 186 Cb -0.48 -0.25 0.27 0.00 0.00 0.00 0.00 36.38 35.91 2dkn s VAL 186 CO 0.36 -0.08 1.04 -0.62 0.00 0.00 0.00 175.10 175.80 2dkn n GLU 187 N 2.60 3.34 -3.52 2.72 -0.58 -0.71 -4.32 120.64 120.17 2dkn n GLU 187 Ca -0.15 -4.47 -0.22 0.00 -0.42 0.00 0.00 57.16 51.89 2dkn n GLU 187 Cb 0.58 -2.51 -0.00 0.00 -0.57 0.00 0.00 31.44 28.94 2dkn n GLU 187 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2dkn n THR 188 N 2.47 0.00 0.11 2.62 -2.24 -1.26 -4.44 114.28 111.53 2dkn n THR 188 Ca 0.24 -1.86 0.16 0.00 -2.27 0.00 0.00 64.05 60.31 2dkn n THR 188 Cb 0.38 -0.07 0.69 0.00 -2.10 0.00 0.00 70.33 69.23 2dkn n THR 188 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2dkn h PRO 189 N 0.00 0.00 -0.02 -0.78 0.11 -1.99 -1.05 132.00 128.27 2dkn h PRO 189 Ca -0.30 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.81 2dkn h PRO 189 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2dkn h PRO 189 CO 0.47 0.00 0.00 1.25 -0.21 0.00 0.00 178.00 179.51 2dkn h LEU 190 N 0.00 0.03 -0.68 2.35 6.46 -1.97 -1.56 115.31 119.93 2dkn h LEU 190 Ca 0.15 -0.24 -0.02 0.00 -0.12 0.00 0.00 57.88 57.65 2dkn h LEU 190 Cb 0.62 -0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.52 2dkn h LEU 190 CO -0.00 0.26 0.35 0.25 -0.62 0.00 0.00 178.44 178.68 2dkn h LEU 191 N -0.21 0.88 -1.23 2.25 5.85 -1.59 -2.38 115.31 118.89 2dkn h LEU 191 Ca 0.01 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2dkn h LEU 191 Cb 0.24 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 2dkn h LEU 191 CO 0.00 0.74 0.46 1.56 -0.34 0.00 0.00 178.44 180.86 2dkn h GLN 192 N 0.95 0.98 -0.57 1.25 1.08 -1.08 0.06 115.11 117.78 2dkn h GLN 192 Ca 0.24 -0.07 -0.05 0.00 -1.45 0.00 0.00 58.65 57.32 2dkn h GLN 192 Cb 0.08 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.27 2dkn h GLN 192 CO -0.03 0.67 0.17 0.00 -0.95 0.00 0.00 178.83 178.69 2dkn h ALA 193 N 1.50 0.74 -0.52 3.87 0.00 -1.06 -2.43 119.26 121.36 2dkn h ALA 193 Ca 0.27 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2dkn h ALA 193 Cb -0.07 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2dkn h ALA 193 CO -0.05 0.41 0.13 0.77 0.00 0.00 0.00 179.25 180.51 2dkn h SER 194 N 0.80 0.79 -0.17 0.00 0.02 -0.89 -2.31 113.55 111.79 2dkn h SER 194 Ca 0.18 -0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 2dkn h SER 194 Cb 0.29 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.61 2dkn h SER 194 CO -0.01 0.82 0.09 0.11 -1.14 0.00 0.00 176.83 176.71 2dkn h LYS 195 N 0.73 0.27 -0.01 3.45 1.57 -0.78 -2.42 116.57 119.38 2dkn h LYS 195 Ca 0.16 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 2dkn h LYS 195 Cb 0.33 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.58 2dkn h LYS 195 CO 0.00 0.21 -0.50 0.00 -0.57 0.00 0.00 179.45 178.59 2dkn n ALA 196 N -2.50 3.61 -2.14 3.86 0.00 -0.94 -4.48 120.51 117.93 2dkn n ALA 196 Ca -0.00 -0.53 -0.42 0.00 0.00 0.00 0.00 53.44 52.49 2dkn n ALA 196 Cb 0.10 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2dkn n ALA 196 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dkn s ASP 197 N -2.63 6.88 0.17 0.00 2.15 -0.88 -4.89 116.67 117.47 2dkn s ASP 197 Ca 0.18 2.32 -0.19 0.00 0.43 0.00 0.00 52.55 55.29 2dkn s ASP 197 Cb 0.18 -2.59 0.10 0.00 -0.30 0.00 0.00 42.92 40.30 2dkn s ASP 197 CO 0.62 -0.59 1.64 -0.65 -0.17 0.00 0.00 175.17 176.02 2dkn h PRO 198 N 6.29 -0.11 -0.05 4.34 0.11 -1.92 0.12 132.00 140.78 2dkn h PRO 198 Ca -0.43 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.66 2dkn h PRO 198 Cb 1.21 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 2dkn h PRO 198 CO 0.83 -0.07 -0.08 -0.09 -0.21 0.00 0.00 178.00 178.37 2dkn h ARG 199 N -0.12 0.14 -0.02 1.05 9.65 -1.95 -3.38 114.38 119.75 2dkn h ARG 199 Ca 0.19 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2dkn h ARG 199 Cb 0.42 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.00 2dkn h ARG 199 CO -0.47 0.64 -0.19 0.66 2.80 0.00 0.00 179.97 183.41 2dkn n TYR 200 N -4.70 0.00 -0.14 2.20 4.02 -1.20 -4.66 117.16 112.68 2dkn n TYR 200 Ca -0.08 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.75 2dkn n TYR 200 Cb 0.33 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.67 2dkn n TYR 200 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2dkn h GLY 201 N 3.75 0.60 0.92 2.72 0.00 -0.67 0.16 103.07 110.56 2dkn h GLY 201 Ca 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 2dkn h GLY 201 CO 0.00 0.15 0.12 -2.09 0.00 0.00 0.00 176.54 174.72 2dkn h GLU 202 N 0.49 0.39 -0.60 4.80 4.22 -1.83 0.31 114.58 122.36 2dkn h GLU 202 Ca 0.17 -0.06 0.10 0.00 0.08 0.00 0.00 59.36 59.65 2dkn h GLU 202 Cb 0.03 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.14 2dkn h GLU 202 CO -0.09 0.39 0.20 1.03 -2.18 0.00 0.00 179.01 178.35 2dkn h SER 203 N 0.29 0.16 0.05 1.04 0.87 -1.79 0.20 113.55 114.37 2dkn h SER 203 Ca 0.09 0.09 -0.12 0.00 -1.23 0.00 0.00 61.79 60.62 2dkn h SER 203 Cb 0.14 0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 2dkn h SER 203 CO -0.01 0.09 -0.38 0.74 -0.53 0.00 0.00 176.83 176.75 2dkn h THR 204 N 0.36 1.30 -0.00 2.23 2.02 -0.22 -3.15 112.91 115.44 2dkn h THR 204 Ca 0.31 -1.49 0.00 0.00 0.77 0.00 0.00 66.41 65.99 2dkn h THR 204 Cb 0.40 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.37 2dkn h THR 204 CO -0.33 0.46 -0.66 0.54 0.37 0.00 0.00 175.52 175.90 2dkn n ARG 205 N -4.05 0.17 -0.20 6.66 1.74 0.06 -4.60 116.66 116.43 2dkn n ARG 205 Ca -0.01 -0.12 -0.01 0.00 -0.77 0.00 0.00 57.85 56.94 2dkn n ARG 205 Cb 0.48 -1.50 0.10 0.00 -1.02 0.00 0.00 32.46 30.53 2dkn n ARG 205 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2dkn h ARG 206 N 0.29 0.45 -4.26 5.56 2.43 -0.58 -3.43 114.38 114.84 2dkn h ARG 206 Ca 0.00 -0.03 -0.32 0.00 -0.81 0.00 0.00 59.98 58.82 2dkn h ARG 206 Cb 0.52 -0.10 -0.29 0.00 -0.42 0.00 0.00 29.97 29.68 2dkn h ARG 206 CO 0.00 0.30 -0.75 -0.06 -1.51 0.00 0.00 179.97 177.95 2dkn s PHE 207 N -6.09 0.45 0.15 2.20 2.99 -1.26 -5.12 117.98 111.30 2dkn s PHE 207 Ca -0.13 -0.09 0.04 0.00 0.00 0.00 0.00 56.93 56.76 2dkn s PHE 207 Cb 0.17 -0.30 -0.04 0.00 0.00 0.00 0.00 43.02 42.85 2dkn s PHE 207 CO 0.75 -0.02 0.16 0.08 -0.00 0.00 0.00 175.22 176.19 2dkn s VAL 208 N -0.06 4.68 0.73 -0.44 1.01 -1.26 -5.08 120.40 119.97 2dkn s VAL 208 Ca 0.01 -0.94 -0.13 0.00 0.00 0.00 0.00 61.98 60.92 2dkn s VAL 208 Cb -0.03 -3.37 0.04 0.00 0.00 0.00 0.00 36.38 33.02 2dkn s VAL 208 CO -0.00 -0.07 1.12 0.00 0.00 0.00 0.00 175.10 176.16 2dkn s ALA 209 N -1.69 2.25 0.38 5.51 0.00 -1.26 -4.88 121.76 122.07 2dkn s ALA 209 Ca 0.31 0.52 0.20 0.00 0.00 0.00 0.00 51.96 52.99 2dkn s ALA 209 Cb -0.11 -3.34 1.17 0.00 0.00 0.00 0.00 23.12 20.84 2dkn s ALA 209 CO 0.24 -1.67 1.69 -1.35 0.00 0.00 0.00 175.76 174.67 2dkn h PRO 210 N -0.56 0.29 0.00 0.00 0.11 -1.80 0.16 132.00 130.20 2dkn h PRO 210 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2dkn h PRO 210 Cb 1.25 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2dkn h PRO 210 CO 0.51 0.19 0.00 1.28 -0.21 0.00 0.00 178.00 179.78 2dkn n LEU 211 N -4.81 0.02 0.00 2.35 4.32 -0.59 -4.88 117.00 113.41 2dkn n LEU 211 Ca 0.31 0.51 0.00 0.00 -0.02 0.00 0.00 56.01 56.80 2dkn n LEU 211 Cb 1.05 -0.50 0.00 0.00 -1.62 0.00 0.00 43.42 42.35 2dkn n LEU 211 CO 0.18 -0.36 0.00 0.61 -1.22 0.00 0.00 177.39 176.60 2dkn n GLY 212 N -0.59 0.48 3.73 -0.72 0.00 0.55 -4.99 105.19 103.65 2dkn n GLY 212 Ca 0.02 -0.67 -0.07 0.00 0.00 0.00 0.00 46.02 45.30 2dkn n GLY 212 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2dkn s ARG 213 N -1.26 1.46 0.66 1.61 1.70 -1.26 -4.97 118.95 116.90 2dkn s ARG 213 Ca 0.00 -0.76 -0.08 0.00 -0.47 0.00 0.00 55.73 54.42 2dkn s ARG 213 Cb 0.00 0.53 0.03 0.00 -0.57 0.00 0.00 34.95 34.94 2dkn s ARG 213 CO 0.00 -0.66 0.99 0.20 -1.08 0.00 0.00 175.30 174.75 2dkn s GLY 214 N -2.86 1.63 0.53 3.88 0.00 -1.26 -4.58 107.32 104.66 2dkn s GLY 214 Ca 0.09 -0.67 -0.18 0.00 0.00 0.00 0.00 44.72 43.97 2dkn s GLY 214 CO 0.01 -0.32 1.03 -0.45 0.00 0.00 0.00 173.10 173.37 2dkn s SER 215 N -4.38 6.19 0.23 1.64 0.15 -0.33 -4.89 113.70 112.31 2dkn s SER 215 Ca 0.57 1.80 -0.15 0.00 0.70 0.00 0.00 55.95 58.87 2dkn s SER 215 Cb -0.11 -2.54 -0.08 0.00 -1.71 0.00 0.00 66.02 61.59 2dkn s SER 215 CO 0.47 -0.89 0.64 -1.61 1.20 0.00 0.00 173.24 173.06 2dkn s GLU 216 N -3.75 4.01 0.39 5.44 0.41 -1.26 -1.73 118.70 122.20 2dkn s GLU 216 Ca 0.64 0.58 0.13 0.00 -0.41 0.00 0.00 54.97 55.91 2dkn s GLU 216 Cb -0.15 -2.71 0.95 0.00 -1.78 0.00 0.00 34.13 30.44 2dkn s GLU 216 CO 0.29 0.33 1.88 -1.35 -0.49 0.00 0.00 175.26 175.92 2dkn h PRO 217 N 2.92 0.53 -0.04 0.39 0.11 -1.91 -0.25 132.00 133.75 2dkn h PRO 217 Ca -0.48 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 2dkn h PRO 217 Cb 1.18 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2dkn h PRO 217 CO 0.66 0.35 -0.01 -0.09 -0.21 0.00 0.00 178.00 178.70 2dkn h ARG 218 N 0.54 0.05 -0.40 1.05 9.65 -1.91 -0.97 114.38 122.40 2dkn h ARG 218 Ca 0.43 -0.00 -0.12 0.00 -1.10 0.00 0.00 59.98 59.18 2dkn h ARG 218 Cb 0.85 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 29.41 2dkn h ARG 218 CO -0.17 0.07 -0.24 0.93 2.80 0.00 0.00 179.97 183.36 2dkn h GLU 219 N 0.05 0.81 -0.35 0.20 5.08 -1.42 -0.33 114.58 118.62 2dkn h GLU 219 Ca 0.01 -0.34 -0.12 0.00 -1.00 0.00 0.00 59.36 57.91 2dkn h GLU 219 Cb 0.06 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2dkn h GLU 219 CO 0.00 0.96 -0.26 0.28 -1.00 0.00 0.00 179.01 179.00 2dkn h VAL 220 N 0.70 1.29 -0.90 3.13 2.07 -1.42 -3.00 116.25 118.11 2dkn h VAL 220 Ca 0.09 -1.42 0.08 0.00 0.82 0.00 0.00 66.70 66.27 2dkn h VAL 220 Cb 0.77 1.41 -0.06 0.00 -1.52 0.00 0.00 31.29 31.89 2dkn h VAL 220 CO 0.06 0.47 0.58 0.00 0.02 0.00 0.00 177.57 178.70 2dkn h ALA 221 N 0.76 1.56 -0.58 1.67 0.00 -0.84 -1.54 119.26 120.30 2dkn h ALA 221 Ca 0.07 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 2dkn h ALA 221 Cb 0.83 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 2dkn h ALA 221 CO 0.07 0.28 0.08 0.93 0.00 0.00 0.00 179.25 180.61 2dkn h GLU 222 N 0.97 0.97 -0.68 0.00 4.39 -0.98 0.11 114.58 119.35 2dkn h GLU 222 Ca 0.40 -0.27 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 2dkn h GLU 222 Cb 0.29 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.80 2dkn h GLU 222 CO -0.16 0.93 0.33 0.00 -1.16 0.00 0.00 179.01 178.94 2dkn h ALA 223 N 1.00 0.88 -0.38 3.43 0.00 -1.27 -1.44 119.26 121.49 2dkn h ALA 223 Ca 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2dkn h ALA 223 Cb 0.44 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2dkn h ALA 223 CO 0.01 0.44 0.17 0.82 0.00 0.00 0.00 179.25 180.69 2dkn h ILE 224 N 0.95 1.18 -0.88 0.00 2.04 -0.86 -2.13 117.51 117.81 2dkn h ILE 224 Ca 0.23 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 2dkn h ILE 224 Cb 0.12 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 2dkn h ILE 224 CO -0.03 0.19 0.50 0.00 0.00 0.00 0.00 178.15 178.82 2dkn h ALA 225 N 1.01 1.22 -0.13 1.87 0.00 -0.64 -0.58 119.26 122.00 2dkn h ALA 225 Ca 0.13 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2dkn h ALA 225 Cb 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2dkn h ALA 225 CO -0.01 0.64 0.04 0.35 0.00 0.00 0.00 179.25 180.27 2dkn h PHE 226 N 1.23 0.06 0.00 0.00 3.04 -1.08 -2.38 116.94 117.82 2dkn h PHE 226 Ca 0.31 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.23 2dkn h PHE 226 Cb 0.00 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 38.49 2dkn h PHE 226 CO 0.01 0.03 -0.21 -0.07 -2.02 0.00 0.00 178.31 176.05 2dkn h LEU 227 N 0.10 0.00 -0.85 0.59 3.38 -0.76 -2.38 115.31 115.38 2dkn h LEU 227 Ca 0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.91 2dkn h LEU 227 Cb 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2dkn h LEU 227 CO -0.07 0.21 -0.57 -0.07 0.09 0.00 0.00 178.44 178.03 2dkn h LEU 228 N 0.00 0.00-10.63 1.67 4.07 -0.81 -3.45 115.31 106.16 2dkn h LEU 228 Ca -0.00 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.50 2dkn h LEU 228 Cb 0.49 0.00 0.08 0.00 1.08 0.00 0.00 40.66 42.31 2dkn h LEU 228 CO 0.03 0.57 0.15 -0.83 -1.08 0.00 0.00 178.44 177.27 2dkn s GLY 229 N -4.44 1.76 0.22 0.83 0.00 -0.90 -4.56 107.32 100.23 2dkn s GLY 229 Ca -0.01 -1.33 0.23 0.00 0.00 0.00 0.00 44.72 43.61 2dkn s GLY 229 CO 0.75 -0.86 1.71 -1.55 0.00 0.00 0.00 173.10 173.16 2dkn n PRO 230 N -2.85 0.19 0.00 2.90 -0.04 -1.26 -1.89 135.00 132.04 2dkn n PRO 230 Ca 0.11 0.35 0.15 0.00 -0.04 0.00 0.00 63.50 64.07 2dkn n PRO 230 Cb 0.60 -1.81 0.83 0.00 -0.04 0.00 0.00 33.50 33.08 2dkn n PRO 230 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2dkn n GLN 231 N -2.15 0.70 -0.79 0.54 3.00 -1.26 -2.94 117.38 114.48 2dkn n GLN 231 Ca 0.03 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.99 2dkn n GLN 231 Cb 0.27 -1.50 0.20 0.00 0.00 0.00 0.00 30.24 29.21 2dkn n GLN 231 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2dkn n ALA 232 N -1.14 4.24 0.32 -1.58 0.00 -0.79 -4.85 120.51 116.71 2dkn n ALA 232 Ca 0.19 -3.09 0.20 0.00 0.00 0.00 0.00 53.44 50.74 2dkn n ALA 232 Cb 0.17 -0.74 1.07 0.00 0.00 0.00 0.00 19.45 19.95 2dkn n ALA 232 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dkn h SER 233 N 1.04 0.00 -0.27 0.00 4.64 -1.69 -1.06 113.55 116.21 2dkn h SER 233 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 2dkn h SER 233 Cb 1.65 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.74 2dkn h SER 233 CO 0.38 0.01 0.00 0.33 -0.87 0.00 0.00 176.83 176.68 2dkn n PHE 234 N -3.21 0.49 -3.50 4.77 -0.00 -1.26 -4.95 117.46 109.81 2dkn n PHE 234 Ca -0.02 -0.60 -0.40 0.00 -0.00 0.00 0.00 57.45 56.42 2dkn n PHE 234 Cb 0.12 -0.10 -0.10 0.00 -0.00 0.00 0.00 39.48 39.40 2dkn n PHE 234 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.76 177.18 2dkn s ILE 235 N -1.48 5.25 -0.16 -2.13 1.01 -0.40 -5.05 121.20 118.23 2dkn s ILE 235 Ca 0.25 -0.03 -0.13 0.00 0.00 0.00 0.00 60.65 60.74 2dkn s ILE 235 Cb 0.16 -3.71 0.05 0.00 0.01 0.00 0.00 42.46 38.96 2dkn s ILE 235 CO 0.12 0.02 0.41 -2.28 0.00 0.00 0.00 174.94 173.21 2dkn s HIS 236 N 1.83 -0.50 0.00 3.97 2.46 -1.26 -4.70 115.29 117.10 2dkn s HIS 236 Ca 0.08 1.16 0.00 0.00 0.47 0.00 0.00 55.06 56.77 2dkn s HIS 236 Cb -0.17 0.19 0.00 0.00 -0.13 0.00 0.00 32.58 32.47 2dkn s HIS 236 CO 0.11 -0.26 0.00 0.41 -2.47 0.00 0.00 174.74 172.53 2dkn n GLY 237 N 3.33 0.22 3.85 1.59 0.00 0.63 -4.98 105.19 109.84 2dkn n GLY 237 Ca -0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.54 2dkn n GLY 237 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkn s SER 238 N -2.02 6.67 -0.28 1.61 0.01 -1.26 -4.74 113.70 113.69 2dkn s SER 238 Ca 0.00 1.37 -0.04 0.00 1.31 0.00 0.00 55.95 58.59 2dkn s SER 238 Cb 0.00 -2.42 0.02 0.00 0.21 0.00 0.00 66.02 63.83 2dkn s SER 238 CO 0.00 -0.40 0.02 -0.69 0.41 0.00 0.00 173.24 172.58 2dkn s VAL 239 N -2.33 3.42 -0.40 3.43 1.01 -1.26 -0.99 120.40 123.29 2dkn s VAL 239 Ca 0.56 -0.93 -0.14 0.00 0.00 0.00 0.00 61.98 61.47 2dkn s VAL 239 Cb -0.10 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.52 2dkn s VAL 239 CO 0.25 0.09 0.28 -0.22 0.00 0.00 0.00 175.10 175.50 2dkn s LEU 240 N 1.40 5.02 0.18 3.92 0.20 0.58 -4.95 118.68 125.03 2dkn s LEU 240 Ca 0.01 -0.93 -0.30 0.00 0.69 0.00 0.00 54.13 53.60 2dkn s LEU 240 Cb -0.17 -2.13 -0.08 0.00 -0.43 0.00 0.00 46.19 43.38 2dkn s LEU 240 CO -0.01 -0.44 1.09 -0.36 -0.29 0.00 0.00 176.35 176.35 2dkn s PHE 241 N 1.65 3.61 -0.49 5.38 0.08 -1.26 -0.73 117.98 126.22 2dkn s PHE 241 Ca 0.04 1.62 0.06 0.00 0.12 0.00 0.00 56.93 58.78 2dkn s PHE 241 Cb -0.19 -3.26 0.22 0.00 -0.57 0.00 0.00 43.02 39.22 2dkn s PHE 241 CO 0.09 -0.53 0.52 0.28 -0.10 0.00 0.00 175.22 175.48 2dkn n VAL 242 N 2.34 0.18 -1.54 -0.44 0.31 -0.45 -4.89 118.33 113.84 2dkn n VAL 242 Ca 0.02 -4.26 0.01 0.00 -0.01 0.00 0.00 64.34 60.11 2dkn n VAL 242 Cb 0.46 -1.95 0.01 0.00 -0.91 0.00 0.00 33.84 31.46 2dkn n VAL 242 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2dkn n ASP 243 N 1.71 0.32 -1.59 4.52 5.75 -1.26 -2.45 116.55 123.55 2dkn n ASP 243 Ca 0.25 -1.83 -0.19 0.00 -0.01 0.00 0.00 54.79 53.01 2dkn n ASP 243 Cb 0.47 -0.16 -0.07 0.00 -1.03 0.00 0.00 41.12 40.32 2dkn n ASP 243 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2dkn n GLY 244 N -0.16 1.57 0.16 6.12 0.00 -1.26 -2.33 105.19 109.28 2dkn n GLY 244 Ca 0.02 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2dkn n GLY 244 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dkn n GLY 245 N -0.64 0.56 0.13 -0.02 0.00 -1.26 -1.55 105.19 102.40 2dkn n GLY 245 Ca -0.20 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 2dkn n GLY 245 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2dkn h MET 246 N 4.82 0.33 -0.47 1.61 1.85 -1.84 -0.51 114.93 120.72 2dkn h MET 246 Ca 0.00 -0.04 -0.12 0.00 -0.61 0.00 0.00 59.70 58.93 2dkn h MET 246 Cb 0.00 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 31.95 2dkn h MET 246 CO 0.00 0.32 -0.17 0.22 -0.40 0.00 0.00 176.91 176.88 2dkn h ASP 247 N 0.26 0.92 -0.50 1.39 3.58 -1.95 -0.93 116.42 119.19 2dkn h ASP 247 Ca 0.08 -0.32 -0.02 0.00 0.42 0.00 0.00 57.03 57.19 2dkn h ASP 247 Cb 0.09 -0.25 -0.03 0.00 1.72 0.00 0.00 39.33 40.86 2dkn h ASP 247 CO -0.01 1.08 0.24 0.00 -2.88 0.00 0.00 179.24 177.67 2dkn h ALA 248 N 0.99 1.42 -0.41 -0.78 0.00 -1.79 0.14 119.26 118.84 2dkn h ALA 248 Ca 0.12 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2dkn h ALA 248 Cb 0.72 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2dkn h ALA 248 CO 0.06 0.45 -0.11 1.25 0.00 0.00 0.00 179.25 180.89 2dkn h LEU 249 N 0.76 0.82 0.00 0.00 5.85 -0.64 -3.04 115.31 119.06 2dkn h LEU 249 Ca 0.19 -0.37 -0.02 0.00 0.84 0.00 0.00 57.88 58.52 2dkn h LEU 249 Cb 0.10 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 2dkn h LEU 249 CO -0.02 1.00 -1.08 0.23 -0.34 0.00 0.00 178.44 178.22 2dkn n MET 250 N -4.30 0.61 -3.15 1.25 2.81 -0.39 -4.43 117.12 109.52 2dkn n MET 250 Ca -0.01 0.12 -0.20 0.00 -1.81 0.00 0.00 57.70 55.80 2dkn n MET 250 Cb 0.38 -1.81 -0.04 0.00 -0.71 0.00 0.00 33.22 31.04 2dkn n MET 250 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2dkn n ARG 251 N -2.68 0.86 0.25 0.03 1.74 0.47 -5.00 116.66 112.32 2dkn n ARG 251 Ca -0.01 -3.17 0.08 0.00 -0.77 0.00 0.00 57.85 53.98 2dkn n ARG 251 Cb 0.58 -1.46 0.62 0.00 -1.02 0.00 0.00 32.46 31.18 2dkn n ARG 251 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dkn h ALA 252 N 3.46 1.97 -0.58 7.54 0.00 -1.70 -2.52 119.26 127.43 2dkn h ALA 252 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2dkn h ALA 252 Cb 0.94 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.72 2dkn h ALA 252 CO 0.46 0.02 0.00 1.63 0.00 0.00 0.00 179.25 181.36 2dkn n LYS 253 N -4.53 2.69 -3.57 0.00 5.02 -1.26 -4.91 118.16 111.60 2dkn n LYS 253 Ca -0.03 -2.43 -0.39 0.00 -2.02 0.00 0.00 58.31 53.44 2dkn n LYS 253 Cb 0.10 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 33.52 2dkn n LYS 253 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2dkn s THR 254 N -1.05 5.24 0.00 -0.18 2.01 -0.95 -5.27 115.64 115.44 2dkn s THR 254 Ca 0.40 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 62.39 2dkn s THR 254 Cb 0.21 -3.58 0.00 0.00 0.01 0.00 0.00 72.50 69.14 2dkn s THR 254 CO 0.28 0.14 0.00 2.22 -0.69 0.00 0.00 174.62 176.58