#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1daf s LYS 2 N 0.00 4.50 -0.02 1.43 1.02 -0.75 -4.98 119.74 120.93 1daf s LYS 2 Ca 0.00 1.95 0.01 0.00 0.02 0.00 0.00 55.97 57.95 1daf s LYS 2 Cb 0.00 -3.18 0.01 0.00 -0.52 0.00 0.00 37.83 34.14 1daf s LYS 2 CO 0.00 -0.04 -0.04 1.03 -0.92 0.00 0.00 175.35 175.39 1daf s ARG 3 N -0.92 0.47 0.01 1.68 0.52 -1.26 -1.43 118.95 118.02 1daf s ARG 3 Ca 0.50 -0.10 0.01 0.00 -0.52 0.00 0.00 55.73 55.62 1daf s ARG 3 Cb -0.34 -0.50 -0.01 0.00 0.52 0.00 0.00 34.95 34.61 1daf s ARG 3 CO 0.42 0.01 -0.04 0.71 0.02 0.00 0.00 175.30 176.41 1daf s TYR 4 N 0.37 0.38 -0.14 -0.53 2.02 -0.67 -4.39 117.35 114.39 1daf s TYR 4 Ca -0.04 -0.28 -0.05 0.00 -0.37 0.00 0.00 57.07 56.33 1daf s TYR 4 Cb -0.07 -0.24 -0.04 0.00 -0.40 0.00 0.00 41.96 41.21 1daf s TYR 4 CO -0.00 -0.07 0.04 0.12 -1.57 0.00 0.00 175.55 174.07 1daf s PHE 5 N -0.72 3.23 -0.20 2.71 5.36 0.08 -0.60 117.98 127.84 1daf s PHE 5 Ca -0.06 0.11 -0.05 0.00 -0.96 0.00 0.00 56.93 55.97 1daf s PHE 5 Cb -0.05 -1.95 -0.02 0.00 -0.34 0.00 0.00 43.02 40.65 1daf s PHE 5 CO -0.00 0.29 0.00 0.08 -1.46 0.00 0.00 175.22 174.14 1daf s VAL 6 N -0.20 3.96 0.46 3.12 1.01 0.95 -0.75 120.40 128.94 1daf s VAL 6 Ca 0.07 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 61.78 1daf s VAL 6 Cb -0.12 -2.80 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 1daf s VAL 6 CO 0.02 0.42 0.06 0.28 0.00 0.00 0.00 175.10 175.88 1daf s THR 7 N 1.05 1.72 0.17 3.92 -1.32 -0.41 -2.23 115.64 118.53 1daf s THR 7 Ca 0.02 -1.92 0.03 0.00 -1.21 0.00 0.00 61.69 58.61 1daf s THR 7 Cb -0.14 -2.64 -0.05 0.00 -1.51 0.00 0.00 72.50 68.16 1daf s THR 7 CO 0.02 0.00 -0.04 -0.83 -2.21 0.00 0.00 174.62 171.55 1daf s GLY 8 N -3.84 1.18 0.19 6.08 0.00 -1.26 -0.55 107.32 109.12 1daf s GLY 8 Ca 0.25 -1.56 0.21 0.00 0.00 0.00 0.00 44.72 43.62 1daf s GLY 8 CO 0.13 -1.57 1.65 -1.30 0.00 0.00 0.00 173.10 172.01 1daf n THR 9 N -0.24 0.87 -3.79 0.90 -2.24 -0.82 -4.28 114.28 104.68 1daf n THR 9 Ca -0.08 0.23 -0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1daf n THR 9 Cb 0.62 -1.11 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 1daf n THR 9 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1daf s ASP 10 N -3.91 -0.05 0.62 3.42 2.15 -1.26 -4.92 116.67 112.72 1daf s ASP 10 Ca 0.05 -0.34 -0.16 0.00 0.43 0.00 0.00 52.55 52.53 1daf s ASP 10 Cb 0.09 0.31 -0.02 0.00 -0.30 0.00 0.00 42.92 43.00 1daf s ASP 10 CO 0.36 -0.59 1.11 0.28 -0.17 0.00 0.00 175.17 176.16 1daf s THR 11 N -2.44 3.31 -1.41 1.71 -1.32 -1.26 -4.09 115.64 110.13 1daf s THR 11 Ca 0.19 0.65 -0.06 0.00 -1.21 0.00 0.00 61.69 61.26 1daf s THR 11 Cb 0.01 -3.18 0.04 0.00 -1.51 0.00 0.00 72.50 67.85 1daf s THR 11 CO 0.00 -0.33 0.79 -0.62 -2.21 0.00 0.00 174.62 172.25 1daf n GLU 12 N -2.12 -5.01 0.00 7.08 4.71 -1.26 -4.91 120.64 119.13 1daf n GLU 12 Ca 0.10 0.59 0.06 0.00 -0.01 0.00 0.00 57.16 57.91 1daf n GLU 12 Cb 0.52 -5.25 0.04 0.00 -1.01 0.00 0.00 31.44 25.74 1daf n GLU 12 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 177.13 178.55 1daf n VAL 13 N -4.46 0.00 -0.01 2.62 0.24 -1.26 -5.00 118.33 110.46 1daf n VAL 13 Ca -0.16 -0.47 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1daf n VAL 13 Cb 0.61 1.24 0.00 0.00 -1.47 0.00 0.00 33.84 34.23 1daf n VAL 13 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1daf n GLY 14 N 0.80 1.11 0.32 7.63 0.00 -1.26 -4.20 105.19 109.58 1daf n GLY 14 Ca 0.07 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.14 1daf n GLY 14 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1daf h LYS 15 N 0.00 0.70 -0.32 1.61 1.57 -1.92 0.36 116.57 118.58 1daf h LYS 15 Ca 0.00 -0.04 -0.15 0.00 -1.87 0.00 0.00 60.65 58.58 1daf h LYS 15 Cb 0.00 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.15 1daf h LYS 15 CO 0.00 0.47 -0.40 1.15 -0.57 0.00 0.00 179.45 180.10 1daf h THR 16 N 0.73 1.28 -0.44 -0.16 2.02 -1.97 -1.01 112.91 113.35 1daf h THR 16 Ca 0.46 -1.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.03 1daf h THR 16 Cb 0.57 1.53 -0.02 0.00 -1.74 0.00 0.00 68.15 68.49 1daf h THR 16 CO -0.32 0.52 0.15 0.58 0.37 0.00 0.00 175.52 176.82 1daf h VAL 17 N 0.62 1.22 -0.34 3.16 2.07 -1.81 -1.72 116.25 119.44 1daf h VAL 17 Ca 0.04 -0.70 -0.09 0.00 0.82 0.00 0.00 66.70 66.77 1daf h VAL 17 Cb 0.99 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1daf h VAL 17 CO 0.10 0.25 -0.16 0.00 0.02 0.00 0.00 177.57 177.78 1daf h ALA 18 N 1.00 1.08 -0.57 1.67 0.00 -0.89 -2.22 119.26 119.33 1daf h ALA 18 Ca 0.14 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1daf h ALA 18 Cb 0.24 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1daf h ALA 18 CO -0.01 0.56 0.13 0.77 0.00 0.00 0.00 179.25 180.70 1daf h SER 19 N 0.56 0.83 -0.51 0.00 0.02 -0.78 -0.56 113.55 113.12 1daf h SER 19 Ca 0.09 -0.16 -0.12 0.00 -0.84 0.00 0.00 61.79 60.77 1daf h SER 19 Cb 0.59 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.90 1daf h SER 19 CO 0.04 0.82 -0.14 0.00 -1.14 0.00 0.00 176.83 176.41 1daf h ALA 21 N 0.94 0.66 -0.77 0.00 0.00 -1.01 -0.80 119.26 118.28 1daf h ALA 21 Ca 0.13 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1daf h ALA 21 Cb 0.71 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1daf h ALA 21 CO 0.05 0.26 0.27 -0.07 0.00 0.00 0.00 179.25 179.77 1daf h LEU 22 N 0.68 1.09 -0.54 0.00 3.38 -0.88 -1.29 115.31 117.74 1daf h LEU 22 Ca 0.17 -0.19 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 1daf h LEU 22 Cb 0.19 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1daf h LEU 22 CO -0.01 0.98 -0.13 -0.07 0.09 0.00 0.00 178.44 179.30 1daf h LEU 23 N 1.13 1.04 -0.47 1.67 3.38 -0.87 -1.62 115.31 119.58 1daf h LEU 23 Ca 0.25 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1daf h LEU 23 Cb 0.26 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1daf h LEU 23 CO -0.01 1.16 0.15 1.56 0.09 0.00 0.00 178.44 181.38 1daf h GLN 24 N 0.91 0.73 -0.68 1.13 4.20 -0.86 -1.45 115.11 119.08 1daf h GLN 24 Ca 0.14 -0.16 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 1daf h GLN 24 Cb 0.70 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 1daf h GLN 24 CO 0.05 0.69 0.28 0.00 -0.67 0.00 0.00 178.83 179.18 1daf h ALA 25 N 1.00 1.20 -0.39 3.87 0.00 -1.05 -1.68 119.26 122.21 1daf h ALA 25 Ca 0.15 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1daf h ALA 25 Cb 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1daf h ALA 25 CO -0.00 0.58 -0.31 0.00 0.00 0.00 0.00 179.25 179.51 1daf h ALA 26 N 1.32 0.70 -0.56 0.00 0.00 -0.95 -0.86 119.26 118.93 1daf h ALA 26 Ca 0.23 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1daf h ALA 26 Cb 0.18 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1daf h ALA 26 CO -0.02 0.67 0.23 -0.22 0.00 0.00 0.00 179.25 179.90 1daf h LYS 27 N 0.73 0.83 0.00 0.00 3.64 -1.14 -2.06 116.57 118.57 1daf h LYS 27 Ca 0.08 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.26 1daf h LYS 27 Cb 0.88 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1daf h LYS 27 CO 0.08 0.72 -0.22 0.00 -2.27 0.00 0.00 179.45 177.76 1daf h ALA 28 N 1.07 1.55 0.00 5.00 0.00 -0.86 -0.22 119.26 125.81 1daf h ALA 28 Ca 0.19 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1daf h ALA 28 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1daf h ALA 28 CO -0.02 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.51 1daf n ALA 29 N -2.46 2.06 0.00 0.00 0.00 -0.37 -4.90 120.51 114.85 1daf n ALA 29 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1daf n ALA 29 Cb 0.28 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.36 1daf n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1daf n GLY 30 N 0.88 0.93 3.82 0.00 0.00 -0.09 -5.09 105.19 105.64 1daf n GLY 30 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 1daf n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1daf s TYR 31 N -2.00 3.28 -0.59 1.61 2.02 -0.83 -5.01 117.35 115.83 1daf s TYR 31 Ca 0.00 1.54 -0.23 0.00 -0.37 0.00 0.00 57.07 58.01 1daf s TYR 31 Cb 0.00 -2.88 0.05 0.00 -0.40 0.00 0.00 41.96 38.74 1daf s TYR 31 CO 0.00 -0.41 0.91 1.03 -1.57 0.00 0.00 175.55 175.51 1daf s ARG 32 N -3.60 3.22 0.12 -0.62 0.52 -1.26 -4.46 118.95 112.87 1daf s ARG 32 Ca 0.62 -0.55 0.02 0.00 -0.52 0.00 0.00 55.73 55.29 1daf s ARG 32 Cb -0.11 -4.12 -0.04 0.00 0.52 0.00 0.00 34.95 31.20 1daf s ARG 32 CO 0.23 -1.58 0.26 0.95 0.02 0.00 0.00 175.30 175.18 1daf s THR 33 N 3.83 5.32 -0.13 0.02 -4.23 -1.26 -1.17 115.64 118.03 1daf s THR 33 Ca 0.25 -0.61 -0.08 0.00 -1.18 0.00 0.00 61.69 60.08 1daf s THR 33 Cb -0.15 -3.69 0.05 0.00 1.34 0.00 0.00 72.50 70.04 1daf s THR 33 CO 0.15 -0.02 0.32 0.00 -0.54 0.00 0.00 174.62 174.53 1daf s ALA 34 N -1.67 -0.77 0.04 3.99 0.00 -0.85 -2.68 121.76 119.82 1daf s ALA 34 Ca 0.35 1.16 -0.06 0.00 0.00 0.00 0.00 51.96 53.41 1daf s ALA 34 Cb -0.12 -0.71 -0.05 0.00 0.00 0.00 0.00 23.12 22.25 1daf s ALA 34 CO 0.28 -0.21 0.28 0.20 0.00 0.00 0.00 175.76 176.32 1daf s GLY 35 N 1.08 2.24 -0.06 0.00 0.00 -1.26 -1.56 107.32 107.77 1daf s GLY 35 Ca -0.07 -0.60 -0.02 0.00 0.00 0.00 0.00 44.72 44.03 1daf s GLY 35 CO -0.08 -0.45 0.05 -0.47 0.00 0.00 0.00 173.10 172.15 1daf s TYR 36 N -1.39 0.22 -0.54 1.90 5.04 0.03 -4.69 117.35 117.93 1daf s TYR 36 Ca 0.31 0.12 0.04 0.00 -2.44 0.00 0.00 57.07 55.10 1daf s TYR 36 Cb -0.13 -0.57 0.13 0.00 0.35 0.00 0.00 41.96 41.74 1daf s TYR 36 CO 0.19 -0.24 0.28 0.21 -1.34 0.00 0.00 175.55 174.65 1daf s LYS 37 N 2.12 2.02 0.38 4.97 2.20 0.01 -0.51 119.74 130.92 1daf s LYS 37 Ca 0.05 -2.69 0.08 0.00 -0.36 0.00 0.00 55.97 53.05 1daf s LYS 37 Cb -0.12 -3.31 0.75 0.00 -1.51 0.00 0.00 37.83 33.63 1daf s LYS 37 CO -0.04 -1.13 1.92 -1.00 -0.36 0.00 0.00 175.35 174.74 1daf h PRO 38 N 6.39 0.34 -5.25 4.03 0.13 -1.75 -3.37 132.00 132.51 1daf h PRO 38 Ca -0.06 -0.07 -0.59 0.00 -0.87 0.00 0.00 66.00 64.42 1daf h PRO 38 Cb 0.88 -0.05 -0.32 0.00 0.13 0.00 0.00 31.00 31.64 1daf h PRO 38 CO 0.69 0.42 -0.85 0.08 -0.23 0.00 0.00 178.00 178.11 1daf s VAL 39 N -4.86 1.55 -0.03 1.56 1.01 -1.26 -1.98 120.40 116.39 1daf s VAL 39 Ca -0.06 -0.76 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 1daf s VAL 39 Cb 0.16 -1.34 0.01 0.00 0.00 0.00 0.00 36.38 35.20 1daf s VAL 39 CO 0.74 0.44 0.07 0.00 0.00 0.00 0.00 175.10 176.35 1daf s ALA 40 N 0.17 -0.17 0.00 5.51 0.00 -0.36 -4.58 121.76 122.33 1daf s ALA 40 Ca -0.08 0.19 0.03 0.00 0.00 0.00 0.00 51.96 52.11 1daf s ALA 40 Cb -0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.86 1daf s ALA 40 CO 0.04 -0.03 -0.11 -1.54 0.00 0.00 0.00 175.76 174.12 1daf s SER 41 N 0.03 1.26 0.00 0.00 1.04 -1.26 -1.13 113.70 113.65 1daf s SER 41 Ca -0.00 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.18 1daf s SER 41 Cb -0.01 -0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.00 1daf s SER 41 CO 0.00 0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.92 1daf n GLY 42 N 2.59 0.70 3.02 7.32 0.00 -0.46 -4.62 105.19 113.74 1daf n GLY 42 Ca -0.15 -0.65 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 1daf n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1daf s SER 43 N -0.22 0.39 0.16 1.61 0.01 -0.28 -4.48 113.70 110.88 1daf s SER 43 Ca 0.00 -0.65 -0.02 0.00 1.31 0.00 0.00 55.95 56.59 1daf s SER 43 Cb 0.00 0.12 -0.05 0.00 0.21 0.00 0.00 66.02 66.30 1daf s SER 43 CO 0.00 -0.37 0.36 -1.61 0.41 0.00 0.00 173.24 172.02 1daf s GLU 44 N -2.17 3.55 0.18 12.44 0.41 0.23 -4.68 118.70 128.66 1daf s GLU 44 Ca -0.09 -0.26 -0.29 0.00 -0.41 0.00 0.00 54.97 53.93 1daf s GLU 44 Cb -0.05 -2.87 -0.08 0.00 -1.78 0.00 0.00 34.13 29.35 1daf s GLU 44 CO -0.03 0.46 0.90 -1.59 -0.49 0.00 0.00 175.26 174.51 1daf s LYS 45 N -2.93 4.74 0.26 1.61 -2.85 -1.26 -1.22 119.74 118.09 1daf s LYS 45 Ca 0.39 1.39 0.02 0.00 -1.00 0.00 0.00 55.97 56.77 1daf s LYS 45 Cb -0.12 -3.31 -0.04 0.00 -2.06 0.00 0.00 37.83 32.31 1daf s LYS 45 CO 0.27 0.43 0.17 0.95 0.10 0.00 0.00 175.35 177.27 1daf s THR 46 N -0.77 0.09 0.62 3.79 -4.23 -0.85 -4.93 115.64 109.35 1daf s THR 46 Ca 0.42 -2.00 0.30 0.00 -1.18 0.00 0.00 61.69 59.23 1daf s THR 46 Cb -0.24 -2.51 0.35 0.00 1.34 0.00 0.00 72.50 71.44 1daf s THR 46 CO 0.30 0.00 2.00 -0.65 -0.54 0.00 0.00 174.62 175.73 1daf h PRO 47 N 2.40 0.00 -0.13 3.99 0.11 -2.02 -2.40 132.00 133.95 1daf h PRO 47 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1daf h PRO 47 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1daf h PRO 47 CO 0.49 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.67 1daf n GLU 48 N -3.45 2.20 0.00 1.05 1.02 -1.26 -5.07 120.64 115.14 1daf n GLU 48 Ca 0.02 -1.77 0.00 0.00 -0.02 0.00 0.00 57.16 55.39 1daf n GLU 48 Cb 0.43 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1daf n GLU 48 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1daf n GLY 49 N 1.34 -0.12 3.77 0.62 0.00 -0.90 -5.05 105.19 104.85 1daf n GLY 49 Ca 0.16 -2.28 -0.39 0.00 0.00 0.00 0.00 46.02 43.52 1daf n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1daf s LEU 50 N 0.00 4.37 -0.03 0.99 1.43 -1.26 -2.01 118.68 122.16 1daf s LEU 50 Ca 0.00 2.18 0.01 0.00 -1.03 0.00 0.00 54.13 55.29 1daf s LEU 50 Cb 0.00 -3.88 0.02 0.00 0.03 0.00 0.00 46.19 42.36 1daf s LEU 50 CO 0.00 -0.31 -0.04 -0.13 0.23 0.00 0.00 176.35 176.10 1daf s ARG 51 N -1.92 0.60 -0.16 1.70 1.81 -0.35 -4.96 118.95 115.68 1daf s ARG 51 Ca 0.51 -0.09 -0.09 0.00 -1.72 0.00 0.00 55.73 54.33 1daf s ARG 51 Cb -0.28 -0.64 -0.05 0.00 -0.45 0.00 0.00 34.95 33.54 1daf s ARG 51 CO 0.35 -0.03 0.16 1.21 -0.68 0.00 0.00 175.30 176.31 1daf s ASN 52 N 0.62 6.33 0.33 0.23 2.47 -1.26 -0.60 114.94 123.05 1daf s ASN 52 Ca -0.07 0.38 0.04 0.00 0.42 0.00 0.00 52.86 53.63 1daf s ASN 52 Cb -0.11 -2.10 0.57 0.00 -1.45 0.00 0.00 41.25 38.17 1daf s ASN 52 CO -0.00 0.27 1.86 0.77 -3.72 0.00 0.00 177.10 176.28 1daf h SER 53 N 5.92 0.52 -0.29 -4.21 4.64 -1.99 -1.62 113.55 116.52 1daf h SER 53 Ca -0.47 -0.10 -0.17 0.00 -0.47 0.00 0.00 61.79 60.58 1daf h SER 53 Cb 1.19 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1daf h SER 53 CO 0.68 0.59 -0.48 0.44 -0.87 0.00 0.00 176.83 177.19 1daf h ASP 54 N 0.53 0.92 -0.76 4.97 3.32 -1.95 -0.58 116.42 122.86 1daf h ASP 54 Ca 0.11 -0.52 -0.04 0.00 0.02 0.00 0.00 57.03 56.60 1daf h ASP 54 Cb 0.34 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.60 1daf h ASP 54 CO 0.01 1.27 0.31 0.00 -1.72 0.00 0.00 179.24 179.11 1daf h ALA 55 N 0.68 1.09 -0.46 3.45 0.00 -1.92 -1.34 119.26 120.76 1daf h ALA 55 Ca 0.02 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1daf h ALA 55 Cb 1.09 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1daf h ALA 55 CO 0.11 0.65 0.06 -0.07 0.00 0.00 0.00 179.25 180.00 1daf h LEU 56 N 1.12 0.68 -0.99 0.00 3.38 -1.12 0.03 115.31 118.40 1daf h LEU 56 Ca 0.26 -0.13 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1daf h LEU 56 Cb 0.21 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1daf h LEU 56 CO -0.02 0.71 0.01 0.00 0.09 0.00 0.00 178.44 179.23 1daf h ALA 57 N 1.37 1.17 -0.20 1.53 0.00 -0.15 -1.35 119.26 121.65 1daf h ALA 57 Ca 0.15 -0.25 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 1daf h ALA 57 Cb 0.34 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 17.95 1daf h ALA 57 CO 0.01 0.54 -0.69 -0.07 0.00 0.00 0.00 179.25 179.03 1daf h LEU 58 N 0.69 0.92 -0.18 0.00 3.38 -0.79 -1.88 115.31 117.45 1daf h LEU 58 Ca 0.14 -0.56 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 1daf h LEU 58 Cb 0.42 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1daf h LEU 58 CO 0.02 1.36 0.09 -0.61 0.09 0.00 0.00 178.44 179.38 1daf h GLN 59 N 0.57 0.25 0.00 1.13 4.15 -0.79 -1.97 115.11 118.45 1daf h GLN 59 Ca -0.03 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.36 1daf h GLN 59 Cb 1.31 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.95 1daf h GLN 59 CO 0.14 0.28 0.00 2.89 -1.93 0.00 0.00 178.83 180.21 1daf n ARG 60 N -4.89 0.21 0.00 1.69 1.85 -0.53 -2.63 116.66 112.37 1daf n ARG 60 Ca -0.04 0.23 0.13 0.00 -1.00 0.00 0.00 57.85 57.17 1daf n ARG 60 Cb 0.09 -1.77 0.28 0.00 -1.05 0.00 0.00 32.46 30.01 1daf n ARG 60 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1daf n ASN 61 N -2.15 1.76 -4.81 2.89 3.02 -0.71 -4.95 115.26 110.31 1daf n ASN 61 Ca 0.05 -1.41 -0.33 0.00 -0.03 0.00 0.00 54.58 52.86 1daf n ASN 61 Cb 0.38 0.15 -0.02 0.00 -0.61 0.00 0.00 39.78 39.67 1daf n ASN 61 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1daf s SER 62 N -2.26 6.26 0.18 6.41 0.01 -0.77 -4.59 113.70 118.94 1daf s SER 62 Ca 0.28 1.81 0.14 0.00 1.31 0.00 0.00 55.95 59.49 1daf s SER 62 Cb 0.20 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.83 1daf s SER 62 CO 0.44 -0.84 1.20 0.77 0.41 0.00 0.00 173.24 175.22 1daf h SER 63 N 1.12 0.00 -3.99 2.44 4.64 -1.84 -3.45 113.55 112.47 1daf h SER 63 Ca -0.48 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.38 1daf h SER 63 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1daf h SER 63 CO 0.59 0.62 0.28 -0.76 -0.87 0.00 0.00 176.83 176.69 1daf s LEU 64 N -6.27 3.91 -0.31 5.97 1.43 -1.21 -4.95 118.68 117.25 1daf s LEU 64 Ca 0.01 1.56 -0.28 0.00 -1.03 0.00 0.00 54.13 54.39 1daf s LEU 64 Cb 0.08 -4.41 0.01 0.00 0.03 0.00 0.00 46.19 41.90 1daf s LEU 64 CO 0.78 -0.36 1.02 -1.10 0.23 0.00 0.00 176.35 176.92 1daf s GLN 65 N -3.31 4.06 0.07 1.70 -1.52 -1.26 -5.01 119.66 114.39 1daf s GLN 65 Ca 0.59 1.01 0.09 0.00 -1.95 0.00 0.00 55.36 55.10 1daf s GLN 65 Cb -0.09 -3.73 -0.03 0.00 -0.22 0.00 0.00 33.01 28.94 1daf s GLN 65 CO 0.18 -0.84 -0.23 -0.51 -0.25 0.00 0.00 175.29 173.63 1daf s LEU 66 N 3.50 2.22 0.42 2.90 1.43 -1.26 -5.13 118.68 122.76 1daf s LEU 66 Ca 0.43 -0.61 -0.23 0.00 -1.03 0.00 0.00 54.13 52.69 1daf s LEU 66 Cb -0.13 -1.07 -0.09 0.00 0.03 0.00 0.00 46.19 44.93 1daf s LEU 66 CO 0.14 0.16 1.03 -1.81 0.23 0.00 0.00 176.35 176.10 1daf s ASP 67 N -1.49 6.71 0.16 2.29 1.01 -1.26 -4.98 116.67 119.11 1daf s ASP 67 Ca 0.09 1.95 -0.16 0.00 0.71 0.00 0.00 52.55 55.14 1daf s ASP 67 Cb -0.10 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.35 1daf s ASP 67 CO 0.03 -0.52 1.71 0.22 0.21 0.00 0.00 175.17 176.81 1daf h TYR 68 N 2.21 0.01 0.00 4.23 3.20 -2.00 -2.11 116.97 122.52 1daf h TYR 68 Ca -0.49 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.40 1daf h TYR 68 Cb 1.21 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 39.53 1daf h TYR 68 CO 0.58 -0.05 -0.05 0.00 -1.64 0.00 0.00 178.16 177.00 1daf h ALA 69 N 1.32 1.18 -0.07 1.82 0.00 -1.94 0.63 119.26 122.20 1daf h ALA 69 Ca 0.18 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 1daf h ALA 69 Cb 0.25 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1daf h ALA 69 CO -0.29 0.06 -0.68 1.15 0.00 0.00 0.00 179.25 179.49 1daf h THR 70 N 0.00 1.39 0.20 0.00 2.02 -1.78 -2.73 112.91 112.01 1daf h THR 70 Ca -0.00 -2.10 -0.31 0.00 0.77 0.00 0.00 66.41 64.77 1daf h THR 70 Cb 0.21 2.08 0.02 0.00 -1.74 0.00 0.00 68.15 68.73 1daf h THR 70 CO 0.01 0.63 -1.38 0.58 0.37 0.00 0.00 175.52 175.72 1daf h VAL 71 N 0.23 1.37 -2.39 3.16 2.07 -0.93 -3.43 116.25 116.33 1daf h VAL 71 Ca -0.02 -2.86 -0.54 0.00 0.82 0.00 0.00 66.70 64.11 1daf h VAL 71 Cb 1.23 3.00 -0.37 0.00 -1.52 0.00 0.00 31.29 33.63 1daf h VAL 71 CO 0.11 0.85 -0.84 0.21 0.02 0.00 0.00 177.57 177.91 1daf s ASN 72 N -7.40 2.21 0.39 0.57 2.47 0.04 -0.80 114.94 112.41 1daf s ASN 72 Ca -0.07 -2.27 0.11 0.00 0.42 0.00 0.00 52.86 51.05 1daf s ASN 72 Cb 0.05 -0.19 0.78 0.00 -1.45 0.00 0.00 41.25 40.44 1daf s ASN 72 CO 0.92 -0.26 1.89 1.55 -3.72 0.00 0.00 177.10 177.47 1daf h PRO 73 N 6.67 0.12 -4.78 0.43 0.13 -1.57 -3.41 132.00 129.59 1daf h PRO 73 Ca 0.11 -0.03 -0.68 0.00 -0.87 0.00 0.00 66.00 64.52 1daf h PRO 73 Cb 0.97 -0.01 -0.33 0.00 0.13 0.00 0.00 31.00 31.76 1daf h PRO 73 CO 0.27 0.36 -0.71 0.71 -0.23 0.00 0.00 178.00 178.40 1daf s TYR 74 N -4.50 3.27 -0.15 1.56 2.02 -0.84 -5.06 117.35 113.66 1daf s TYR 74 Ca -0.04 -1.93 0.02 0.00 -0.37 0.00 0.00 57.07 54.74 1daf s TYR 74 Cb 0.15 -2.12 0.01 0.00 -0.40 0.00 0.00 41.96 39.61 1daf s TYR 74 CO 0.73 -0.82 -0.20 0.99 -1.57 0.00 0.00 175.55 174.68 1daf s THR 75 N 1.23 1.96 0.02 -0.71 2.01 -1.26 -1.22 115.64 117.67 1daf s THR 75 Ca -0.05 -0.91 0.08 0.00 0.31 0.00 0.00 61.69 61.12 1daf s THR 75 Cb -0.20 -1.75 -0.02 0.00 0.01 0.00 0.00 72.50 70.54 1daf s THR 75 CO -0.02 0.53 -0.23 -0.36 -0.69 0.00 0.00 174.62 173.86 1daf s PHE 76 N 0.98 2.01 0.04 4.92 0.08 -0.28 -4.99 117.98 120.73 1daf s PHE 76 Ca -0.04 -0.38 -0.18 0.00 0.12 0.00 0.00 56.93 56.45 1daf s PHE 76 Cb -0.15 -1.23 -0.19 0.00 -0.57 0.00 0.00 43.02 40.88 1daf s PHE 76 CO -0.05 0.05 1.20 0.00 -0.10 0.00 0.00 175.22 176.33 1daf h ALA 77 N 5.11 0.17 -2.51 5.36 0.00 -1.87 -1.20 119.26 124.32 1daf h ALA 77 Ca -0.43 -0.52 -0.53 0.00 0.00 0.00 0.00 54.91 53.43 1daf h ALA 77 Cb 1.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 1daf h ALA 77 CO 0.45 0.38 0.46 -2.00 0.00 0.00 0.00 179.25 178.54 1daf s GLU 78 N -3.59 4.54 -1.26 0.00 2.12 -1.26 -1.12 118.70 118.14 1daf s GLU 78 Ca -0.13 1.61 -0.14 0.00 0.36 0.00 0.00 54.97 56.67 1daf s GLU 78 Cb 0.05 -3.37 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 1daf s GLU 78 CO 0.83 -0.05 2.28 -0.35 -0.54 0.00 0.00 175.26 177.42 1daf n PRO 79 N 3.40 2.58 -3.28 4.30 -0.04 -1.26 -2.82 135.00 137.88 1daf n PRO 79 Ca 0.06 -2.21 -0.13 0.00 -0.04 0.00 0.00 63.50 61.18 1daf n PRO 79 Cb 0.48 -3.01 -0.04 0.00 -0.04 0.00 0.00 33.50 30.89 1daf n PRO 79 CO 0.00 0.00 0.00 -2.37 -0.04 0.00 0.00 175.50 173.09 1daf n THR 80 N 4.94 0.00 -1.77 0.52 5.66 -1.26 -4.91 114.28 117.46 1daf n THR 80 Ca 0.55 -1.29 -0.42 0.00 -3.05 0.00 0.00 64.05 59.85 1daf n THR 80 Cb 0.33 0.50 -0.03 0.00 -1.55 0.00 0.00 70.33 69.59 1daf n THR 80 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1daf s SER 81 N -2.33 6.40 0.35 1.09 0.15 -1.26 -4.80 113.70 113.30 1daf s SER 81 Ca 0.13 2.86 0.09 0.00 0.70 0.00 0.00 55.95 59.73 1daf s SER 81 Cb 0.01 -2.61 0.81 0.00 -1.71 0.00 0.00 66.02 62.52 1daf s SER 81 CO 0.09 -0.94 1.87 -0.65 1.20 0.00 0.00 173.24 174.82 1daf h PRO 82 N 6.19 0.68 0.00 5.44 0.11 -1.94 -1.54 132.00 140.94 1daf h PRO 82 Ca -0.44 -0.04 -0.05 0.00 0.11 0.00 0.00 66.00 65.58 1daf h PRO 82 Cb 1.21 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1daf h PRO 82 CO 0.90 0.45 -0.24 1.12 -0.21 0.00 0.00 178.00 180.02 1daf h HIS 83 N 0.70 0.00 0.06 0.65 2.07 -1.66 -0.30 115.15 116.67 1daf h HIS 83 Ca 0.45 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.96 1daf h HIS 83 Cb 0.70 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.68 1daf h HIS 83 CO -0.00 0.24 -0.03 0.82 -3.07 0.00 0.00 177.93 175.89 1daf h ILE 84 N 0.00 1.26 -0.05 6.12 2.04 -1.60 -2.93 117.51 122.34 1daf h ILE 84 Ca -0.00 -1.46 -0.13 0.00 1.00 0.00 0.00 64.86 64.27 1daf h ILE 84 Cb 0.52 2.16 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 1daf h ILE 84 CO 0.03 0.34 -0.55 -0.29 0.00 0.00 0.00 178.15 177.68 1daf h ILE 85 N -0.78 1.38 -0.16 -0.67 6.09 -1.49 -1.50 117.51 120.38 1daf h ILE 85 Ca -0.01 -1.87 0.04 0.00 -1.37 0.00 0.00 64.86 61.65 1daf h ILE 85 Cb 0.63 1.95 -0.04 0.00 0.47 0.00 0.00 36.82 39.83 1daf h ILE 85 CO 0.01 0.55 -0.07 -1.28 -3.07 0.00 0.00 178.15 174.29 1daf h SER 86 N 0.12 -0.24 -0.74 2.19 0.87 -1.14 -0.82 113.55 113.78 1daf h SER 86 Ca -0.00 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 1daf h SER 86 Cb 1.01 0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 63.08 1daf h SER 86 CO 0.08 -0.10 0.34 0.00 -0.53 0.00 0.00 176.83 176.62 1daf h ALA 87 N 1.09 0.95 -0.58 6.23 0.00 -1.31 -1.49 119.26 124.16 1daf h ALA 87 Ca 0.09 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1daf h ALA 87 Cb 0.18 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1daf h ALA 87 CO -0.20 0.53 0.14 0.37 0.00 0.00 0.00 179.25 180.09 1daf h GLN 88 N 1.04 0.90 0.00 0.00 5.75 -0.89 -2.94 115.11 118.96 1daf h GLN 88 Ca 0.25 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1daf h GLN 88 Cb 0.14 -0.13 0.00 0.00 1.07 0.00 0.00 27.48 28.56 1daf h GLN 88 CO -0.03 0.80 -0.53 0.39 -2.65 0.00 0.00 178.83 176.81 1daf n GLU 89 N -4.26 0.25 -2.34 1.69 1.02 -0.35 -4.96 120.64 111.68 1daf n GLU 89 Ca 0.04 0.09 -0.07 0.00 -0.02 0.00 0.00 57.16 57.20 1daf n GLU 89 Cb 0.23 -1.67 0.01 0.00 -0.02 0.00 0.00 31.44 29.99 1daf n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1daf n GLY 90 N 1.36 0.21 2.94 0.62 0.00 -0.64 -5.02 105.19 104.67 1daf n GLY 90 Ca 0.04 -0.54 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1daf n GLY 90 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1daf s ARG 91 N -4.66 1.65 0.34 1.61 3.52 -0.75 -5.05 118.95 115.61 1daf s ARG 91 Ca 0.06 -2.20 -0.28 0.00 -0.13 0.00 0.00 55.73 53.18 1daf s ARG 91 Cb -0.02 -3.12 -0.12 0.00 -1.56 0.00 0.00 34.95 30.12 1daf s ARG 91 CO 0.07 -1.04 1.30 -2.30 -0.81 0.00 0.00 175.30 172.52 1daf n PRO 92 N 3.69 2.14 -3.28 5.12 -0.02 -1.26 -4.68 135.00 136.71 1daf n PRO 92 Ca 0.05 0.75 -0.43 0.00 -2.02 0.00 0.00 63.50 61.85 1daf n PRO 92 Cb 0.37 -2.34 -0.08 0.00 -0.02 0.00 0.00 33.50 31.42 1daf n PRO 92 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1daf s ILE 93 N -1.04 5.04 -0.18 4.25 1.01 -1.26 -5.03 121.20 123.98 1daf s ILE 93 Ca 0.56 -0.23 -0.14 0.00 0.00 0.00 0.00 60.65 60.84 1daf s ILE 93 Cb -0.57 -4.07 -0.05 0.00 0.01 0.00 0.00 42.46 37.79 1daf s ILE 93 CO 0.62 -0.45 0.29 -0.70 0.00 0.00 0.00 174.94 174.70 1daf s GLU 94 N 2.28 4.23 0.31 2.79 2.56 -1.26 -4.92 118.70 124.68 1daf s GLU 94 Ca 0.14 0.07 0.02 0.00 0.00 0.00 0.00 54.97 55.20 1daf s GLU 94 Cb -0.16 -3.46 0.58 0.00 2.00 0.00 0.00 34.13 33.09 1daf s GLU 94 CO 0.15 0.17 1.89 1.03 -0.56 0.00 0.00 175.26 177.94 1daf h SER 95 N 6.89 0.87 -0.58 -1.70 0.87 -1.99 -1.35 113.55 116.55 1daf h SER 95 Ca -0.40 0.02 -0.06 0.00 -1.23 0.00 0.00 61.79 60.12 1daf h SER 95 Cb 1.16 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.94 1daf h SER 95 CO 0.74 0.52 0.13 -0.07 -0.53 0.00 0.00 176.83 177.62 1daf h LEU 96 N 0.97 0.93 -0.28 2.23 4.07 -1.99 -1.20 115.31 120.04 1daf h LEU 96 Ca 0.42 -0.19 -0.10 0.00 0.08 0.00 0.00 57.88 58.09 1daf h LEU 96 Cb 0.35 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 41.84 1daf h LEU 96 CO -0.18 0.91 -0.21 0.58 -1.08 0.00 0.00 178.44 178.46 1daf h VAL 97 N 0.93 1.30 -0.66 1.22 2.07 -1.69 -0.67 116.25 118.75 1daf h VAL 97 Ca 0.19 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.36 1daf h VAL 97 Cb 0.37 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.67 1daf h VAL 97 CO 0.00 0.43 0.41 0.24 0.02 0.00 0.00 177.57 178.67 1daf h MET 98 N 0.37 0.89 -0.52 1.57 2.86 -1.11 -1.81 114.93 117.18 1daf h MET 98 Ca 0.05 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.50 1daf h MET 98 Cb 0.76 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 1daf h MET 98 CO 0.06 0.62 -0.13 0.77 1.06 0.00 0.00 176.91 179.29 1daf h SER 99 N 0.89 1.00 -0.83 1.22 0.02 -1.15 -2.82 113.55 111.89 1daf h SER 99 Ca 0.24 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.81 1daf h SER 99 Cb -0.04 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.19 1daf h SER 99 CO -0.05 1.12 0.36 0.00 -1.14 0.00 0.00 176.83 177.13 1daf h ALA 100 N 0.96 1.07 -0.82 3.77 0.00 -0.96 -1.96 119.26 121.32 1daf h ALA 100 Ca 0.13 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1daf h ALA 100 Cb 0.69 -0.33 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 1daf h ALA 100 CO 0.05 0.67 0.42 0.78 0.00 0.00 0.00 179.25 181.17 1daf h GLY 101 N 1.19 1.25 1.00 0.00 0.00 -1.23 -0.85 103.07 104.44 1daf h GLY 101 Ca 0.28 -0.60 -0.02 0.00 0.00 0.00 0.00 47.33 46.99 1daf h GLY 101 CO -0.03 0.57 0.33 -2.00 0.00 0.00 0.00 176.54 175.41 1daf h LEU 102 N 1.16 0.87 -0.77 3.11 5.85 -1.19 -2.38 115.31 121.96 1daf h LEU 102 Ca 0.29 -0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.81 1daf h LEU 102 Cb 0.08 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.86 1daf h LEU 102 CO -0.04 0.75 0.13 0.03 -0.34 0.00 0.00 178.44 178.98 1daf h ARG 103 N 0.93 1.06 -0.93 1.25 2.47 -0.76 -2.31 114.38 116.09 1daf h ARG 103 Ca 0.23 -0.26 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1daf h ARG 103 Cb 0.11 -0.14 -0.05 0.00 -1.65 0.00 0.00 29.97 28.25 1daf h ARG 103 CO -0.03 0.96 0.60 0.00 0.56 0.00 0.00 179.97 182.05 1daf h ALA 104 N 1.13 1.30 -0.18 0.04 0.00 -0.98 -2.48 119.26 118.09 1daf h ALA 104 Ca 0.21 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.89 1daf h ALA 104 Cb 0.39 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1daf h ALA 104 CO 0.01 0.63 -0.50 -0.07 0.00 0.00 0.00 179.25 179.32 1daf h LEU 105 N 1.27 0.54 -0.31 0.00 3.38 -0.91 -2.75 115.31 116.54 1daf h LEU 105 Ca 0.34 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1daf h LEU 105 Cb -0.12 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.48 1daf h LEU 105 CO -0.07 0.95 0.00 -0.62 0.09 0.00 0.00 178.44 178.79 1daf n GLU 106 N -3.98 0.04 0.15 1.13 1.02 -0.92 -0.44 120.64 117.64 1daf n GLU 106 Ca -0.02 0.45 0.02 0.00 -0.02 0.00 0.00 57.16 57.59 1daf n GLU 106 Cb 0.57 -1.61 0.15 0.00 -0.02 0.00 0.00 31.44 30.52 1daf n GLU 106 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1daf h GLN 107 N 0.00 0.00 0.00 3.49 4.20 -1.34 -3.37 115.11 118.09 1daf h GLN 107 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1daf h GLN 107 Cb 0.10 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 1daf h GLN 107 CO 0.00 0.52 -1.21 0.00 -0.67 0.00 0.00 178.83 177.47 1daf n GLN 108 N -3.41 1.19 -4.38 1.46 10.64 -0.47 -5.05 117.38 117.36 1daf n GLN 108 Ca 0.01 -0.03 -0.30 0.00 -1.83 0.00 0.00 57.00 54.85 1daf n GLN 108 Cb 0.66 -1.10 -0.11 0.00 -0.86 0.00 0.00 30.24 28.83 1daf n GLN 108 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1daf s ALA 109 N -2.22 2.75 -1.75 2.61 0.00 0.42 -4.94 121.76 118.62 1daf s ALA 109 Ca -0.02 -1.27 0.15 0.00 0.00 0.00 0.00 51.96 50.83 1daf s ALA 109 Cb 0.02 -0.76 0.20 0.00 0.00 0.00 0.00 23.12 22.58 1daf s ALA 109 CO 0.17 0.60 1.09 -0.40 0.00 0.00 0.00 175.76 177.22 1daf n ASP 110 N 1.00 2.55 -3.58 0.00 5.68 -0.31 -4.50 116.55 117.39 1daf n ASP 110 Ca -0.15 -1.74 -0.25 0.00 -0.50 0.00 0.00 54.79 52.15 1daf n ASP 110 Cb 0.52 -0.09 -0.16 0.00 -1.14 0.00 0.00 41.12 40.26 1daf n ASP 110 CO 0.00 0.00 0.00 0.86 -1.33 0.00 0.00 177.20 176.73 1daf s TRP 111 N -1.21 0.13 -0.10 2.11 -0.00 -0.99 -1.82 118.94 117.07 1daf s TRP 111 Ca 0.22 -0.29 0.04 0.00 -0.00 0.00 0.00 56.10 56.07 1daf s TRP 111 Cb 0.14 -0.66 -0.00 0.00 -0.00 0.00 0.00 33.47 32.95 1daf s TRP 111 CO 0.20 -0.56 -0.23 0.08 -0.00 0.00 0.00 176.95 176.44 1daf s VAL 112 N 2.17 2.14 -0.19 5.86 1.01 -0.52 -2.01 120.40 128.86 1daf s VAL 112 Ca 0.03 -0.99 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 1daf s VAL 112 Cb -0.16 -1.82 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 1daf s VAL 112 CO -0.13 0.56 -0.06 -0.22 0.00 0.00 0.00 175.10 175.25 1daf s LEU 113 N 0.33 2.90 -0.23 3.92 0.20 -0.60 -1.67 118.68 123.52 1daf s LEU 113 Ca -0.18 -0.34 -0.07 0.00 0.69 0.00 0.00 54.13 54.23 1daf s LEU 113 Cb -0.18 -1.71 -0.03 0.00 -0.43 0.00 0.00 46.19 43.84 1daf s LEU 113 CO 0.09 0.05 0.06 -0.69 -0.29 0.00 0.00 176.35 175.56 1daf s VAL 114 N 1.07 4.36 -0.17 1.68 1.01 0.24 -0.79 120.40 127.80 1daf s VAL 114 Ca 0.01 -0.16 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 1daf s VAL 114 Cb -0.15 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.18 1daf s VAL 114 CO -0.01 0.38 0.05 -0.70 0.00 0.00 0.00 175.10 174.82 1daf s GLU 115 N 1.24 3.90 0.18 2.72 2.12 0.33 -0.04 118.70 129.15 1daf s GLU 115 Ca 0.04 -0.36 -0.03 0.00 0.36 0.00 0.00 54.97 54.99 1daf s GLU 115 Cb -0.14 -3.17 0.04 0.00 0.26 0.00 0.00 34.13 31.12 1daf s GLU 115 CO 0.03 0.30 0.25 0.41 -0.54 0.00 0.00 175.26 175.71 1daf n GLY 116 N 3.44 -1.22 3.22 -1.50 0.00 -0.95 -4.29 105.19 103.89 1daf n GLY 116 Ca -0.17 -1.67 -0.30 0.00 0.00 0.00 0.00 46.02 43.87 1daf n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1daf s ALA 117 N -3.98 2.03 0.00 4.61 0.00 -1.26 -5.00 121.76 118.16 1daf s ALA 117 Ca 0.14 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1daf s ALA 117 Cb -0.00 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.43 1daf s ALA 117 CO 0.10 0.34 0.00 0.41 0.00 0.00 0.00 175.76 176.61 1daf n GLY 118 N 3.19 1.24 0.00 0.00 0.00 -1.26 -4.68 105.19 103.68 1daf n GLY 118 Ca -0.18 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1daf n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1daf n GLY 119 N 0.00 0.82 0.14 -0.02 0.00 -1.26 -4.27 105.19 100.60 1daf n GLY 119 Ca 0.00 -1.85 -0.11 0.00 0.00 0.00 0.00 46.02 44.06 1daf n GLY 119 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 1daf h TRP 120 N 0.00 0.41 -0.49 1.61 2.91 -1.89 -3.21 115.95 115.29 1daf h TRP 120 Ca 0.00 -0.05 -0.08 0.00 1.13 0.00 0.00 58.89 59.89 1daf h TRP 120 Cb 0.00 -0.12 -0.05 0.00 -0.51 0.00 0.00 29.16 28.49 1daf h TRP 120 CO 0.00 0.48 0.10 1.19 -1.03 0.00 0.00 178.44 179.18 1daf n PHE 121 N -4.73 1.70 -1.65 2.65 3.72 -1.26 -3.33 117.46 114.56 1daf n PHE 121 Ca -0.03 -0.74 -0.48 0.00 -0.05 0.00 0.00 57.45 56.15 1daf n PHE 121 Cb 0.17 -0.48 -0.05 0.00 -0.94 0.00 0.00 39.48 38.18 1daf n PHE 121 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1daf n THR 122 N 0.22 0.52 -2.15 4.37 -1.04 -1.22 -4.66 114.28 110.33 1daf n THR 122 Ca 0.25 -0.15 -0.41 0.00 -2.04 0.00 0.00 64.05 61.71 1daf n THR 122 Cb 1.04 -1.89 -0.03 0.00 -1.82 0.00 0.00 70.33 67.63 1daf n THR 122 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1daf s PRO 123 N 4.49 4.36 -0.11 -2.82 0.02 -1.26 -0.82 135.00 138.87 1daf s PRO 123 Ca 0.95 2.16 0.16 0.00 0.02 0.00 0.00 61.00 64.29 1daf s PRO 123 Cb -0.69 -3.13 -0.23 0.00 0.02 0.00 0.00 34.50 30.47 1daf s PRO 123 CO 0.51 -0.24 0.18 1.28 -0.33 0.00 0.00 177.00 178.40 1daf n LEU 124 N 1.80 0.00 0.00 -5.54 4.77 0.67 -2.72 117.00 115.98 1daf n LEU 124 Ca 0.04 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.95 1daf n LEU 124 Cb 0.42 0.25 -0.02 0.00 -2.33 0.00 0.00 43.42 41.74 1daf n LEU 124 CO 0.59 0.25 0.05 -1.54 -1.33 0.00 0.00 177.39 175.40 1daf n SER 125 N -2.41 -0.52 0.12 -1.43 3.41 -0.63 -4.06 113.62 108.11 1daf n SER 125 Ca -0.17 -1.81 0.12 0.00 -0.26 0.00 0.00 58.87 56.74 1daf n SER 125 Cb 0.81 0.99 0.48 0.00 -0.26 0.00 0.00 64.21 66.23 1daf n SER 125 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1daf n ASP 126 N -2.02 0.68 0.00 4.04 8.00 -1.26 -3.39 116.55 122.59 1daf n ASP 126 Ca 0.01 0.65 0.00 0.00 0.71 0.00 0.00 54.79 56.16 1daf n ASP 126 Cb 0.25 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 1daf n ASP 126 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1daf n THR 127 N -2.23 0.56 -3.74 -3.53 -2.24 -1.26 -5.05 114.28 96.79 1daf n THR 127 Ca 0.03 -0.69 -0.15 0.00 -2.27 0.00 0.00 64.05 60.97 1daf n THR 127 Cb 0.26 0.78 -0.15 0.00 -2.10 0.00 0.00 70.33 69.11 1daf n THR 127 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1daf s PHE 128 N -0.56 -0.08 0.41 4.78 5.36 -1.22 -5.10 117.98 121.57 1daf s PHE 128 Ca 0.00 0.36 0.07 0.00 -0.96 0.00 0.00 56.93 56.41 1daf s PHE 128 Cb 0.00 -0.18 -0.04 0.00 -0.34 0.00 0.00 43.02 42.46 1daf s PHE 128 CO 0.00 -0.15 0.27 0.95 -1.46 0.00 0.00 175.22 174.83 1daf s THR 129 N 1.34 2.49 0.30 0.12 -4.23 -1.26 -0.24 115.64 114.16 1daf s THR 129 Ca -0.07 -1.53 -0.00 0.00 -1.18 0.00 0.00 61.69 58.91 1daf s THR 129 Cb -0.12 -3.00 0.19 0.00 1.34 0.00 0.00 72.50 70.91 1daf s THR 129 CO -0.05 -0.01 1.89 0.15 -0.54 0.00 0.00 174.62 176.06 1daf h PHE 130 N 1.24 0.84 -0.64 3.99 3.04 -1.20 -1.69 116.94 122.53 1daf h PHE 130 Ca -0.42 -0.04 0.06 0.00 3.98 0.00 0.00 57.97 61.55 1daf h PHE 130 Cb 1.26 -0.26 -0.04 0.00 2.56 0.00 0.00 35.95 39.47 1daf h PHE 130 CO 0.57 0.65 0.42 0.00 -2.02 0.00 0.00 178.31 177.93 1daf h ALA 131 N 1.43 1.79 -0.76 2.41 0.00 -1.82 -1.47 119.26 120.83 1daf h ALA 131 Ca 0.20 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1daf h ALA 131 Cb 0.16 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 1daf h ALA 131 CO -0.02 0.11 0.39 -0.44 0.00 0.00 0.00 179.25 179.29 1daf h ASP 132 N 0.63 0.98 -0.35 0.00 3.32 -1.67 -1.48 116.42 117.86 1daf h ASP 132 Ca 0.27 -0.12 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1daf h ASP 132 Cb 0.28 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1daf h ASP 132 CO -0.08 0.82 -0.17 -0.25 -1.72 0.00 0.00 179.24 177.84 1daf h TRP 133 N 1.07 0.83 -0.90 4.55 7.01 -1.27 -1.53 115.95 125.71 1daf h TRP 133 Ca 0.27 -0.21 0.01 0.00 2.11 0.00 0.00 58.89 61.07 1daf h TRP 133 Cb 0.08 -0.19 -0.05 0.00 -2.10 0.00 0.00 29.16 26.90 1daf h TRP 133 CO 0.01 0.93 0.60 0.28 -2.79 0.00 0.00 178.44 177.46 1daf h VAL 134 N 0.50 1.23 -0.46 2.65 2.07 -1.18 -0.69 116.25 120.37 1daf h VAL 134 Ca 0.08 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 67.07 1daf h VAL 134 Cb 0.71 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1daf h VAL 134 CO 0.05 0.22 -0.15 0.74 0.02 0.00 0.00 177.57 178.45 1daf h THR 135 N 1.22 1.27 -0.35 2.57 2.02 -1.11 0.43 112.91 118.96 1daf h THR 135 Ca 0.33 -1.29 0.02 0.00 0.77 0.00 0.00 66.41 66.25 1daf h THR 135 Cb -0.13 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.39 1daf h THR 135 CO -0.07 0.44 0.19 -0.61 0.37 0.00 0.00 175.52 175.83 1daf h GLN 136 N 0.76 0.37 0.00 6.66 4.15 -0.77 -1.96 115.11 124.32 1daf h GLN 136 Ca 0.11 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1daf h GLN 136 Cb 0.71 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.31 1daf h GLN 136 CO 0.05 0.25 0.00 0.39 -1.93 0.00 0.00 178.83 177.59 1daf n GLU 137 N -4.92 0.10 -3.87 1.69 -0.58 -0.31 -4.94 120.64 107.81 1daf n GLU 137 Ca 0.00 0.10 -0.28 0.00 -0.42 0.00 0.00 57.16 56.56 1daf n GLU 137 Cb 0.07 -1.62 0.02 0.00 -0.57 0.00 0.00 31.44 29.35 1daf n GLU 137 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 1daf n GLN 138 N -1.79 -5.18 -2.62 3.49 1.13 0.12 -4.97 117.38 107.57 1daf n GLN 138 Ca 0.06 0.59 -0.41 0.00 -1.94 0.00 0.00 57.00 55.30 1daf n GLN 138 Cb 0.36 -5.35 -0.04 0.00 0.11 0.00 0.00 30.24 25.32 1daf n GLN 138 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1daf s LEU 139 N -7.11 4.49 0.49 1.08 1.43 -1.15 -5.01 118.68 112.91 1daf s LEU 139 Ca 0.46 1.94 -0.21 0.00 -1.03 0.00 0.00 54.13 55.29 1daf s LEU 139 Cb -0.23 -3.60 -0.07 0.00 0.03 0.00 0.00 46.19 42.32 1daf s LEU 139 CO 0.83 -0.15 1.13 -2.16 0.23 0.00 0.00 176.35 176.23 1daf s PRO 140 N -0.13 3.64 -0.08 1.29 0.04 -1.26 -4.63 135.00 133.86 1daf s PRO 140 Ca 0.49 1.64 0.04 0.00 0.04 0.00 0.00 61.00 63.20 1daf s PRO 140 Cb -0.26 -2.22 -0.01 0.00 0.04 0.00 0.00 34.50 32.04 1daf s PRO 140 CO 0.32 -0.62 -0.19 0.08 0.04 0.00 0.00 177.00 176.63 1daf s VAL 141 N -1.69 2.56 -0.18 -0.36 1.01 -0.30 -0.74 120.40 120.71 1daf s VAL 141 Ca 0.67 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 1daf s VAL 141 Cb -0.25 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 1daf s VAL 141 CO 0.29 0.56 -0.02 -0.63 0.00 0.00 0.00 175.10 175.30 1daf s ILE 142 N -0.09 3.89 -0.26 2.22 1.01 0.07 -0.98 121.20 127.07 1daf s ILE 142 Ca -0.04 -0.35 -0.12 0.00 0.00 0.00 0.00 60.65 60.14 1daf s ILE 142 Cb -0.14 -2.73 -0.05 0.00 0.01 0.00 0.00 42.46 39.55 1daf s ILE 142 CO 0.04 0.46 0.23 -0.22 0.00 0.00 0.00 174.94 175.45 1daf s LEU 143 N 0.68 4.06 -0.18 2.97 2.96 -0.44 -1.29 118.68 127.44 1daf s LEU 143 Ca -0.01 0.12 -0.17 0.00 -0.22 0.00 0.00 54.13 53.85 1daf s LEU 143 Cb -0.14 -2.20 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 1daf s LEU 143 CO 0.02 -0.04 0.43 -0.69 -1.32 0.00 0.00 176.35 174.75 1daf s VAL 144 N 1.55 5.19 -0.26 1.68 1.01 0.29 -1.22 120.40 128.64 1daf s VAL 144 Ca 0.09 0.80 -0.06 0.00 0.00 0.00 0.00 61.98 62.81 1daf s VAL 144 Cb -0.15 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 1daf s VAL 144 CO 0.08 0.27 0.04 -0.69 0.00 0.00 0.00 175.10 174.81 1daf s VAL 145 N 1.12 3.88 -0.20 2.92 1.01 0.08 -1.95 120.40 127.26 1daf s VAL 145 Ca 0.21 -0.50 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 1daf s VAL 145 Cb -0.15 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1daf s VAL 145 CO 0.08 0.25 1.09 -0.83 0.00 0.00 0.00 175.10 175.69 1daf s GLY 146 N 1.52 1.75 -0.45 4.51 0.00 -1.26 -0.84 107.32 112.55 1daf s GLY 146 Ca 0.04 0.27 -0.28 0.00 0.00 0.00 0.00 44.72 44.76 1daf s GLY 146 CO 0.01 2.24 1.05 0.14 0.00 0.00 0.00 173.10 176.53 1daf s VAL 147 N 3.14 4.34 0.14 1.40 1.01 -0.34 -4.75 120.40 125.35 1daf s VAL 147 Ca 0.47 1.11 -0.24 0.00 0.00 0.00 0.00 61.98 63.32 1daf s VAL 147 Cb -0.17 -4.51 0.07 0.00 0.00 0.00 0.00 36.38 31.76 1daf s VAL 147 CO 0.09 -0.88 0.73 -1.59 0.00 0.00 0.00 175.10 173.46 1daf s LYS 148 N 4.09 1.24 0.18 2.72 -2.85 -1.26 -4.47 119.74 119.40 1daf s LYS 148 Ca 0.43 -0.54 -0.33 0.00 -1.00 0.00 0.00 55.97 54.54 1daf s LYS 148 Cb -0.09 0.52 -0.13 0.00 -2.06 0.00 0.00 37.83 36.08 1daf s LYS 148 CO 0.28 -0.55 1.68 -0.11 0.10 0.00 0.00 175.35 176.75 1daf n LEU 149 N -0.37 3.66 0.00 2.77 7.94 -1.26 -1.52 117.00 128.22 1daf n LEU 149 Ca -0.11 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 55.85 1daf n LEU 149 Cb 0.63 -1.51 0.00 0.00 0.53 0.00 0.00 43.42 43.06 1daf n LEU 149 CO 0.12 0.01 0.00 0.61 -1.11 0.00 0.00 177.39 177.02 1daf n GLY 150 N 3.80 0.42 0.23 -3.96 0.00 -1.26 -4.98 105.19 99.45 1daf n GLY 150 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 1daf n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1daf h ILE 152 N 0.00 1.23 0.01 0.00 2.04 -1.94 0.11 117.51 118.96 1daf h ILE 152 Ca -0.00 -0.79 -0.00 0.00 1.00 0.00 0.00 64.86 65.07 1daf h ILE 152 Cb 0.87 1.09 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1daf h ILE 152 CO 0.00 0.27 -0.01 -1.13 0.00 0.00 0.00 178.15 177.28 1daf h ASN 153 N 0.40 -0.01 0.22 1.72 -1.24 -1.97 -0.58 115.58 114.11 1daf h ASN 153 Ca 0.11 -0.06 -0.09 0.00 0.71 0.00 0.00 56.30 56.96 1daf h ASN 153 Cb 0.33 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.37 1daf h ASN 153 CO 0.00 0.05 -0.35 0.45 -1.29 0.00 0.00 177.43 176.29 1daf h HIS 154 N -0.08 0.23 -0.37 0.67 3.86 -1.40 -1.48 115.15 116.58 1daf h HIS 154 Ca -0.00 -0.05 -0.16 0.00 -1.16 0.00 0.00 60.37 58.99 1daf h HIS 154 Cb 0.07 -0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 1daf h HIS 154 CO -0.06 0.54 -0.40 0.00 0.86 0.00 0.00 177.93 178.87 1daf h ALA 155 N 1.46 0.59 -0.21 2.45 0.00 -0.61 -2.47 119.26 120.47 1daf h ALA 155 Ca 0.02 -0.46 -0.16 0.00 0.00 0.00 0.00 54.91 54.31 1daf h ALA 155 Cb 0.71 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1daf h ALA 155 CO 0.05 0.68 -0.53 0.52 0.00 0.00 0.00 179.25 179.97 1daf h MET 156 N 0.74 0.62 -0.11 0.00 2.07 -0.83 -1.47 114.93 115.95 1daf h MET 156 Ca 0.06 -0.39 0.00 0.00 -2.07 0.00 0.00 59.70 57.30 1daf h MET 156 Cb 0.99 0.04 -0.01 0.00 -1.87 0.00 0.00 31.60 30.75 1daf h MET 156 CO 0.10 1.00 0.07 -0.07 1.07 0.00 0.00 176.91 179.07 1daf h LEU 157 N 0.48 0.12 -0.42 1.22 3.38 -1.27 -2.08 115.31 116.74 1daf h LEU 157 Ca 0.01 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1daf h LEU 157 Cb 1.09 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1daf h LEU 157 CO 0.10 0.10 -0.05 0.74 0.09 0.00 0.00 178.44 179.42 1daf h THR 158 N 0.14 1.27 -0.37 0.22 2.02 -1.36 -2.46 112.91 112.36 1daf h THR 158 Ca 0.04 -1.12 0.04 0.00 0.77 0.00 0.00 66.41 66.14 1daf h THR 158 Cb -0.01 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.51 1daf h THR 158 CO -0.01 0.38 0.14 0.00 0.37 0.00 0.00 175.52 176.40 1daf h ALA 159 N 0.87 0.44 -0.72 6.16 0.00 -1.21 -2.26 119.26 122.54 1daf h ALA 159 Ca 0.11 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1daf h ALA 159 Cb 0.56 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1daf h ALA 159 CO 0.03 -0.25 0.40 1.96 0.00 0.00 0.00 179.25 181.39 1daf h GLN 160 N 0.30 0.99 -0.46 0.00 4.20 -1.25 -2.44 115.11 116.46 1daf h GLN 160 Ca 0.17 -0.11 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 1daf h GLN 160 Cb 0.13 -0.20 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 1daf h GLN 160 CO -0.16 0.73 -0.16 0.28 -0.67 0.00 0.00 178.83 178.85 1daf h VAL 161 N 0.99 1.27 -0.53 -0.54 2.07 -1.24 -0.58 116.25 117.68 1daf h VAL 161 Ca 0.25 -1.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 1daf h VAL 161 Cb 0.02 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1daf h VAL 161 CO -0.04 0.44 0.16 0.40 0.02 0.00 0.00 177.57 178.55 1daf h ILE 162 N 0.78 1.23 -0.50 4.57 2.04 -1.30 -2.20 117.51 122.13 1daf h ILE 162 Ca 0.12 -0.79 -0.10 0.00 1.00 0.00 0.00 64.86 65.08 1daf h ILE 162 Cb 0.70 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 1daf h ILE 162 CO 0.05 0.29 -0.09 1.56 0.00 0.00 0.00 178.15 179.96 1daf h GLN 163 N 0.73 0.95 0.00 2.37 4.20 -1.25 -2.14 115.11 119.97 1daf h GLN 163 Ca 0.17 -0.35 -0.03 0.00 0.06 0.00 0.00 58.65 58.50 1daf h GLN 163 Cb 0.28 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 1daf h GLN 163 CO -0.00 1.01 -0.13 0.45 -0.67 0.00 0.00 178.83 179.49 1daf h HIS 164 N 0.81 0.00 0.00 2.96 3.86 -0.84 -0.76 115.15 121.18 1daf h HIS 164 Ca 0.13 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1daf h HIS 164 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1daf h HIS 164 CO 0.05 0.13 0.00 0.00 0.86 0.00 0.00 177.93 178.97 1daf n ALA 165 N -2.28 2.40 -0.99 2.45 0.00 -0.83 -4.88 120.51 116.37 1daf n ALA 165 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1daf n ALA 165 Cb 0.25 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.28 1daf n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1daf n GLY 166 N 0.73 0.46 3.92 0.00 0.00 -0.29 -5.03 105.19 104.98 1daf n GLY 166 Ca 0.17 -0.36 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 1daf n GLY 166 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1daf s LEU 167 N 0.00 3.59 -0.14 0.99 1.43 -1.07 -5.04 118.68 118.44 1daf s LEU 167 Ca 0.00 0.68 -0.17 0.00 -1.03 0.00 0.00 54.13 53.61 1daf s LEU 167 Cb 0.00 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 1daf s LEU 167 CO 0.00 -0.68 0.43 -0.89 0.23 0.00 0.00 176.35 175.44 1daf s THR 168 N -2.71 5.21 -0.56 5.49 2.01 -1.26 -4.41 115.64 119.42 1daf s THR 168 Ca 0.48 0.83 -0.20 0.00 0.31 0.00 0.00 61.69 63.11 1daf s THR 168 Cb -0.10 -3.77 0.07 0.00 0.01 0.00 0.00 72.50 68.71 1daf s THR 168 CO 0.42 0.32 0.75 -0.22 -0.69 0.00 0.00 174.62 175.21 1daf s LEU 169 N 0.72 4.83 0.28 4.42 2.96 -1.26 -1.15 118.68 129.49 1daf s LEU 169 Ca 0.23 -0.96 0.12 0.00 -0.22 0.00 0.00 54.13 53.30 1daf s LEU 169 Cb -0.15 -2.47 0.36 0.00 0.50 0.00 0.00 46.19 44.43 1daf s LEU 169 CO 0.08 -1.09 1.60 0.00 -1.32 0.00 0.00 176.35 175.62 1daf h ALA 170 N 9.19 0.92 0.00 5.97 0.00 -1.41 -3.45 119.26 130.48 1daf h ALA 170 Ca -0.28 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.08 1daf h ALA 170 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1daf h ALA 170 CO 1.05 0.76 0.00 0.41 0.00 0.00 0.00 179.25 181.47 1daf n GLY 171 N 0.37 -0.94 3.15 0.00 0.00 -1.23 -4.35 105.19 102.18 1daf n GLY 171 Ca -0.01 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.73 1daf n GLY 171 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1daf s TRP 172 N -2.00 0.90 -0.07 1.61 1.48 -0.42 -1.33 118.94 119.12 1daf s TRP 172 Ca 0.00 -0.72 0.04 0.00 -1.06 0.00 0.00 56.10 54.35 1daf s TRP 172 Cb 0.00 -0.51 0.00 0.00 -1.16 0.00 0.00 33.47 31.80 1daf s TRP 172 CO 0.00 -0.08 -0.18 0.08 -4.06 0.00 0.00 176.95 172.71 1daf s VAL 173 N -2.66 1.59 -0.19 -0.66 1.01 -0.35 -0.50 120.40 118.64 1daf s VAL 173 Ca 0.04 -0.76 -0.17 0.00 0.00 0.00 0.00 61.98 61.10 1daf s VAL 173 Cb -0.01 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1daf s VAL 173 CO -0.02 0.46 0.43 0.00 0.00 0.00 0.00 175.10 175.96 1daf s ALA 174 N 0.38 3.54 -0.16 5.51 0.00 -0.76 -0.74 121.76 129.53 1daf s ALA 174 Ca -0.14 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1daf s ALA 174 Cb -0.16 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.31 1daf s ALA 174 CO 0.05 -0.25 -0.16 1.21 0.00 0.00 0.00 175.76 176.61 1daf s ASN 175 N 0.96 3.57 -0.79 0.00 2.47 -0.02 -0.81 114.94 120.31 1daf s ASN 175 Ca 0.21 -0.50 -0.20 0.00 0.42 0.00 0.00 52.86 52.79 1daf s ASN 175 Cb -0.15 -1.55 0.11 0.00 -1.45 0.00 0.00 41.25 38.21 1daf s ASN 175 CO 0.08 0.07 1.00 -1.81 -3.72 0.00 0.00 177.10 172.72 1daf s ASP 176 N 0.91 6.43 0.37 -4.21 1.01 -0.15 -1.20 116.67 119.82 1daf s ASP 176 Ca -0.04 -1.66 0.19 0.00 0.71 0.00 0.00 52.55 51.75 1daf s ASP 176 Cb -0.15 -2.38 0.54 0.00 1.01 0.00 0.00 42.92 41.94 1daf s ASP 176 CO -0.02 -1.17 1.66 -0.37 0.21 0.00 0.00 175.17 175.49 1daf h VAL 177 N 5.85 0.73 -2.00 -1.27 -1.51 -1.88 -3.21 116.25 112.96 1daf h VAL 177 Ca -0.05 -1.60 -0.57 0.00 -1.23 0.00 0.00 66.70 63.25 1daf h VAL 177 Cb 1.05 2.04 -0.10 0.00 -2.13 0.00 0.00 31.29 32.15 1daf h VAL 177 CO 1.11 0.35 -0.62 0.42 -1.23 0.00 0.00 177.57 177.60 1daf s THR 178 N -3.39 2.87 1.02 7.19 -4.23 -1.26 -5.00 115.64 112.85 1daf s THR 178 Ca 0.02 -1.94 -0.18 0.00 -1.18 0.00 0.00 61.69 58.41 1daf s THR 178 Cb 0.09 -2.81 -0.01 0.00 1.34 0.00 0.00 72.50 71.12 1daf s THR 178 CO 0.69 -0.25 -0.22 -2.65 -0.54 0.00 0.00 174.62 171.65 1daf n PRO 179 N -0.95 -0.62 -1.68 3.99 -0.02 -1.26 -4.62 135.00 129.83 1daf n PRO 179 Ca -0.05 -0.16 -0.51 0.00 -2.02 0.00 0.00 63.50 60.76 1daf n PRO 179 Cb 0.61 -1.53 -0.06 0.00 -0.02 0.00 0.00 33.50 32.51 1daf n PRO 179 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1daf n PRO 180 N -0.47 1.78 -3.69 0.52 -0.02 -1.26 -5.00 135.00 126.87 1daf n PRO 180 Ca 0.02 0.65 -0.21 0.00 -2.02 0.00 0.00 63.50 61.94 1daf n PRO 180 Cb 0.60 -2.42 -0.04 0.00 -0.02 0.00 0.00 33.50 31.62 1daf n PRO 180 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1daf s GLY 181 N 3.39 2.07 0.24 -1.23 0.00 -1.26 -5.08 107.32 105.46 1daf s GLY 181 Ca 0.93 -1.86 -0.07 0.00 0.00 0.00 0.00 44.72 43.72 1daf s GLY 181 CO 0.55 -1.70 1.88 1.70 0.00 0.00 0.00 173.10 175.53 1daf h LYS 182 N 1.13 1.27 -0.75 2.90 3.64 -2.05 -3.08 116.57 119.64 1daf h LYS 182 Ca -0.42 -0.13 -0.45 0.00 -1.27 0.00 0.00 60.65 58.38 1daf h LYS 182 Cb 1.26 -0.26 -0.25 0.00 -0.41 0.00 0.00 32.23 32.57 1daf h LYS 182 CO 0.59 0.90 0.27 0.54 -2.27 0.00 0.00 179.45 179.49 1daf n ARG 183 N -4.35 2.38 -0.09 1.90 5.12 -1.26 -4.71 116.66 115.65 1daf n ARG 183 Ca 0.10 -3.29 -0.09 0.00 -1.93 0.00 0.00 57.85 52.65 1daf n ARG 183 Cb 0.07 -2.09 -0.01 0.00 -1.16 0.00 0.00 32.46 29.27 1daf n ARG 183 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1daf h HIS 184 N 1.38 0.36 -0.87 -1.55 -0.00 -1.97 -1.24 115.15 111.26 1daf h HIS 184 Ca 0.46 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.83 1daf h HIS 184 Cb 1.81 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 29.06 1daf h HIS 184 CO 1.28 0.22 0.51 0.00 -0.00 0.00 0.00 177.93 179.94 1daf h ALA 185 N 1.13 1.11 -0.29 5.26 0.00 -1.87 -1.49 119.26 123.11 1daf h ALA 185 Ca 0.12 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.78 1daf h ALA 185 Cb -0.02 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1daf h ALA 185 CO -0.04 0.59 -0.38 0.93 0.00 0.00 0.00 179.25 180.34 1daf h GLU 186 N 1.21 0.67 -0.41 0.00 3.07 -1.87 -0.88 114.58 116.36 1daf h GLU 186 Ca 0.31 -0.34 -0.04 0.00 -0.50 0.00 0.00 59.36 58.79 1daf h GLU 186 Cb -0.02 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1daf h GLU 186 CO -0.06 0.94 0.09 1.88 -1.40 0.00 0.00 179.01 180.47 1daf h TYR 187 N 0.56 0.70 -0.65 4.33 -1.99 -1.02 -1.70 116.97 117.19 1daf h TYR 187 Ca 0.05 -0.09 0.00 0.00 2.00 0.00 0.00 58.73 60.70 1daf h TYR 187 Cb 0.91 -0.20 -0.03 0.00 2.00 0.00 0.00 36.73 39.41 1daf h TYR 187 CO 0.04 0.67 0.42 0.52 -0.00 0.00 0.00 178.16 179.82 1daf h MET 188 N 0.53 0.86 -0.52 4.88 2.86 -1.06 -1.17 114.93 121.32 1daf h MET 188 Ca 0.13 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1daf h MET 188 Cb 0.33 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.78 1daf h MET 188 CO 0.00 0.58 0.18 1.15 1.06 0.00 0.00 176.91 179.89 1daf h THR 189 N 0.88 1.23 -0.36 2.22 2.02 -1.06 -0.82 112.91 117.02 1daf h THR 189 Ca 0.24 -0.73 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 1daf h THR 189 Cb -0.08 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.04 1daf h THR 189 CO -0.05 0.27 0.14 0.74 0.37 0.00 0.00 175.52 176.99 1daf h THR 190 N 0.70 1.19 -0.74 3.16 2.02 -1.03 -1.81 112.91 116.40 1daf h THR 190 Ca 0.17 -0.59 -0.06 0.00 0.77 0.00 0.00 66.41 66.70 1daf h THR 190 Cb 0.24 0.91 -0.03 0.00 -1.74 0.00 0.00 68.15 67.53 1daf h THR 190 CO -0.01 0.21 0.24 -0.07 0.37 0.00 0.00 175.52 176.26 1daf h LEU 191 N 0.44 1.07 -0.70 2.58 3.38 -1.08 -0.28 115.31 120.73 1daf h LEU 191 Ca 0.12 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1daf h LEU 191 Cb 0.19 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1daf h LEU 191 CO -0.01 0.99 0.40 0.74 0.09 0.00 0.00 178.44 180.65 1daf h THR 192 N 1.10 1.21 -0.54 0.22 2.02 -0.96 -1.56 112.91 114.39 1daf h THR 192 Ca 0.24 -0.50 -0.07 0.00 0.77 0.00 0.00 66.41 66.85 1daf h THR 192 Cb 0.30 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1daf h THR 192 CO -0.01 0.22 0.06 -0.09 0.37 0.00 0.00 175.52 176.07 1daf h ARG 193 N 0.95 0.92 0.00 6.66 2.43 -0.83 -3.34 114.38 121.17 1daf h ARG 193 Ca 0.25 -0.26 -0.19 0.00 -0.81 0.00 0.00 59.98 58.97 1daf h ARG 193 Cb 0.01 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 1daf h ARG 193 CO -0.04 0.91 -1.37 0.52 -1.51 0.00 0.00 179.97 178.48 1daf h MET 194 N 0.80 0.00 -5.80 0.20 2.86 -0.78 -3.45 114.93 108.76 1daf h MET 194 Ca 0.16 0.00 -0.59 0.00 -2.06 0.00 0.00 59.70 57.22 1daf h MET 194 Cb 0.45 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.03 1daf h MET 194 CO 0.02 0.38 0.25 0.42 1.06 0.00 0.00 176.91 179.03 1daf s ILE 195 N -2.86 4.95 -1.52 -1.22 1.01 -0.61 -4.95 121.20 116.01 1daf s ILE 195 Ca -0.02 1.40 -0.09 0.00 0.00 0.00 0.00 60.65 61.93 1daf s ILE 195 Cb 0.08 -4.04 -0.01 0.00 0.01 0.00 0.00 42.46 38.51 1daf s ILE 195 CO 0.81 0.07 2.68 -0.81 0.00 0.00 0.00 174.94 177.69 1daf n PRO 196 N 5.11 3.80 -3.54 2.79 -0.04 -1.26 -4.79 135.00 137.07 1daf n PRO 196 Ca 0.01 -2.61 -0.08 0.00 -0.04 0.00 0.00 63.50 60.78 1daf n PRO 196 Cb 0.49 -2.83 -0.03 0.00 -0.04 0.00 0.00 33.50 31.10 1daf n PRO 196 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1daf s ALA 197 N 1.44 -1.91 0.39 0.55 0.00 -1.26 -4.93 121.76 116.04 1daf s ALA 197 Ca 0.62 1.28 -0.26 0.00 0.00 0.00 0.00 51.96 53.60 1daf s ALA 197 Cb 0.17 0.03 -0.09 0.00 0.00 0.00 0.00 23.12 23.24 1daf s ALA 197 CO -0.07 -0.58 1.26 -1.25 0.00 0.00 0.00 175.76 175.12 1daf s PRO 198 N -2.52 4.04 -0.27 0.00 0.04 -1.26 -4.69 135.00 130.35 1daf s PRO 198 Ca 0.05 2.06 -0.29 0.00 0.04 0.00 0.00 61.00 62.85 1daf s PRO 198 Cb -0.01 -2.77 -0.00 0.00 0.04 0.00 0.00 34.50 31.76 1daf s PRO 198 CO -0.06 -0.40 1.26 -1.17 0.04 0.00 0.00 177.00 176.68 1daf s LEU 199 N -2.37 3.96 0.18 -3.56 2.96 -1.26 -1.30 118.68 117.30 1daf s LEU 199 Ca 0.56 1.31 0.25 0.00 -0.22 0.00 0.00 54.13 56.04 1daf s LEU 199 Cb -0.36 -3.54 0.63 0.00 0.50 0.00 0.00 46.19 43.42 1daf s LEU 199 CO 0.46 -0.97 1.61 0.18 -1.32 0.00 0.00 176.35 176.30 1daf n LEU 200 N 7.27 0.79 0.00 -0.68 4.77 0.35 -4.94 117.00 124.56 1daf n LEU 200 Ca 0.14 0.45 0.00 0.00 -0.03 0.00 0.00 56.01 56.57 1daf n LEU 200 Cb 0.46 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1daf n LEU 200 CO 0.61 -0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1daf n GLY 201 N 1.32 1.96 2.96 -0.72 0.00 -1.26 -0.84 105.19 108.61 1daf n GLY 201 Ca 0.05 -1.28 -0.26 0.00 0.00 0.00 0.00 46.02 44.53 1daf n GLY 201 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1daf s GLU 202 N -1.97 1.61 -0.18 1.61 2.12 -1.24 -1.83 118.70 118.83 1daf s GLU 202 Ca 0.00 -0.33 -0.15 0.00 0.36 0.00 0.00 54.97 54.85 1daf s GLU 202 Cb 0.00 -1.51 -0.04 0.00 0.26 0.00 0.00 34.13 32.84 1daf s GLU 202 CO 0.00 -0.14 0.34 0.42 -0.54 0.00 0.00 175.26 175.34 1daf s ILE 203 N 1.23 5.26 0.84 -3.70 1.01 0.01 -4.87 121.20 120.98 1daf s ILE 203 Ca -0.04 0.61 -0.12 0.00 0.00 0.00 0.00 60.65 61.10 1daf s ILE 203 Cb -0.14 -3.67 0.09 0.00 0.01 0.00 0.00 42.46 38.75 1daf s ILE 203 CO -0.03 0.32 1.11 -2.16 0.00 0.00 0.00 174.94 174.18 1daf s PRO 204 N 0.89 1.75 -0.03 2.79 0.04 -1.26 -0.98 135.00 138.21 1daf s PRO 204 Ca 0.17 0.55 -0.30 0.00 0.04 0.00 0.00 61.00 61.47 1daf s PRO 204 Cb -0.14 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 1daf s PRO 204 CO 0.06 -1.83 1.64 -0.46 0.04 0.00 0.00 177.00 176.45 1daf s TRP 205 N -3.17 2.09 -0.42 0.56 -0.00 -1.21 -4.59 118.94 112.20 1daf s TRP 205 Ca 0.62 0.24 0.02 0.00 -0.00 0.00 0.00 56.10 56.99 1daf s TRP 205 Cb -0.15 -3.91 0.12 0.00 -0.00 0.00 0.00 33.47 29.53 1daf s TRP 205 CO 0.54 -3.79 0.18 -0.51 -0.00 0.00 0.00 176.95 173.38 1daf s LEU 206 N 3.72 3.45 0.22 5.86 1.43 -1.26 -5.02 118.68 127.07 1daf s LEU 206 Ca 0.73 -2.48 -0.15 0.00 -1.03 0.00 0.00 54.13 51.21 1daf s LEU 206 Cb -0.34 -1.28 0.26 0.00 0.03 0.00 0.00 46.19 44.85 1daf s LEU 206 CO 0.30 -0.30 1.59 0.00 0.23 0.00 0.00 176.35 178.16 1daf h ALA 207 N 7.06 0.31 -2.30 4.21 0.00 -1.98 -3.38 119.26 123.17 1daf h ALA 207 Ca -0.06 0.26 -0.69 0.00 0.00 0.00 0.00 54.91 54.43 1daf h ALA 207 Cb 0.95 0.72 -0.18 0.00 0.00 0.00 0.00 17.79 19.27 1daf h ALA 207 CO 0.54 -0.52 -0.13 -2.00 0.00 0.00 0.00 179.25 177.15 1daf s GLU 208 N -6.13 3.12 -1.09 0.00 -6.30 -1.26 -4.78 118.70 102.26 1daf s GLU 208 Ca -0.14 -0.75 -0.20 0.00 -2.50 0.00 0.00 54.97 51.39 1daf s GLU 208 Cb 0.20 -3.99 -0.00 0.00 0.00 0.00 0.00 34.13 30.34 1daf s GLU 208 CO 0.73 -0.93 0.76 0.09 0.02 0.00 0.00 175.26 175.92 1daf n ASN 209 N 5.76 -5.32 0.00 -1.70 4.13 -1.26 -4.83 115.26 112.04 1daf n ASN 209 Ca -0.07 -0.99 0.06 0.00 1.68 0.00 0.00 54.58 55.27 1daf n ASN 209 Cb 0.47 -3.12 0.30 0.00 -1.54 0.00 0.00 39.78 35.89 1daf n ASN 209 CO 0.00 0.00 0.00 -0.81 0.28 0.00 0.00 177.26 176.73 1daf n PRO 210 N -3.99 0.18 0.10 3.52 -0.04 -1.26 -0.94 135.00 132.57 1daf n PRO 210 Ca -0.11 0.16 -0.04 0.00 -0.04 0.00 0.00 63.50 63.48 1daf n PRO 210 Cb 0.59 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.54 1daf n PRO 210 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1daf h GLU 211 N 0.00 0.00 0.00 0.54 3.07 -1.92 -3.28 114.58 112.99 1daf h GLU 211 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1daf h GLU 211 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1daf h GLU 211 CO 0.00 0.80 -0.96 0.09 -1.40 0.00 0.00 179.01 177.55 1daf n ASN 212 N -3.44 0.63 -4.78 1.42 5.03 -0.12 -4.97 115.26 109.03 1daf n ASN 212 Ca 0.00 -0.27 -0.33 0.00 0.87 0.00 0.00 54.58 54.85 1daf n ASN 212 Cb 0.81 0.73 0.04 0.00 -1.02 0.00 0.00 39.78 40.34 1daf n ASN 212 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1daf s ALA 213 N -3.16 2.54 -0.78 5.41 0.00 -1.22 -4.96 121.76 119.58 1daf s ALA 213 Ca 0.05 0.54 -0.22 0.00 0.00 0.00 0.00 51.96 52.32 1daf s ALA 213 Cb 0.15 -3.30 0.08 0.00 0.00 0.00 0.00 23.12 20.04 1daf s ALA 213 CO 0.79 -1.15 1.10 0.00 0.00 0.00 0.00 175.76 176.50 1daf s ALA 214 N -2.32 3.08 -0.88 0.00 0.00 -1.26 -4.77 121.76 115.60 1daf s ALA 214 Ca 0.67 -2.07 0.09 0.00 0.00 0.00 0.00 51.96 50.65 1daf s ALA 214 Cb -0.20 -4.04 0.00 0.00 0.00 0.00 0.00 23.12 18.89 1daf s ALA 214 CO 0.40 -3.00 0.62 0.25 0.00 0.00 0.00 175.76 174.03 1daf n THR 215 N 5.99 0.00 -0.25 0.00 -2.24 -1.26 -4.66 114.28 111.85 1daf n THR 215 Ca 0.09 -0.41 0.20 0.00 -2.27 0.00 0.00 64.05 61.65 1daf n THR 215 Cb 0.47 1.12 0.51 0.00 -2.10 0.00 0.00 70.33 70.34 1daf n THR 215 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1daf h GLY 216 N 1.99 0.89 2.00 3.38 0.00 -1.87 -1.65 103.07 107.81 1daf h GLY 216 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 47.14 1daf h GLY 216 CO 0.00 -0.02 0.00 0.07 0.00 0.00 0.00 176.54 176.59 1daf h LYS 217 N 0.40 0.00 -0.00 4.80 2.10 -1.89 -1.89 116.57 120.09 1daf h LYS 217 Ca 0.48 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.13 1daf h LYS 217 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 1daf h LYS 217 CO -0.19 0.00 -0.17 0.66 -2.00 0.00 0.00 179.45 177.75 1daf n TYR 218 N -2.82 0.00 -4.13 0.07 4.01 -0.62 -4.84 117.16 108.83 1daf n TYR 218 Ca -0.02 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.37 1daf n TYR 218 Cb 0.10 -0.41 -0.09 0.00 -0.31 0.00 0.00 39.34 38.63 1daf n TYR 218 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1daf s ILE 219 N -2.99 4.72 -0.58 -0.72 -1.09 -0.71 -3.59 121.20 116.24 1daf s ILE 219 Ca 0.13 -0.08 -0.12 0.00 -2.23 0.00 0.00 60.65 58.35 1daf s ILE 219 Cb 0.19 -3.06 0.15 0.00 -1.58 0.00 0.00 42.46 38.15 1daf s ILE 219 CO 0.59 0.55 0.49 0.21 -1.23 0.00 0.00 174.94 175.55 1daf s ASN 220 N -0.38 6.06 0.49 3.58 3.04 -0.02 -4.93 114.94 122.77 1daf s ASN 220 Ca 0.09 -2.10 0.32 0.00 0.04 0.00 0.00 52.86 51.21 1daf s ASN 220 Cb -0.12 -2.11 1.45 0.00 -1.54 0.00 0.00 41.25 38.93 1daf s ASN 220 CO 0.02 -0.70 1.96 0.25 -3.04 0.00 0.00 177.10 175.59 1daf h LEU 221 N 8.36 0.00 -1.91 3.21 5.85 -1.94 -2.85 115.31 126.03 1daf h LEU 221 Ca -0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1daf h LEU 221 Cb 1.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1daf h LEU 221 CO 0.89 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.99 1daf h ALA 222 N 2.06 1.00 -0.00 1.25 0.00 -1.98 -1.61 119.26 119.98 1daf h ALA 222 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1daf h ALA 222 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1daf h ALA 222 CO 0.00 0.00 -0.41 1.28 0.00 0.00 0.00 179.25 180.12 1daf n LEU 223 N -2.53 0.45 -0.46 0.00 4.77 -1.08 -5.25 117.00 112.90 1daf n LEU 223 Ca -0.02 0.06 0.14 0.00 -0.03 0.00 0.00 56.01 56.16 1daf n LEU 223 Cb 0.06 -0.28 0.54 0.00 -2.33 0.00 0.00 43.42 41.41 1daf n LEU 223 CO 0.14 0.11 0.88 0.18 -1.33 0.00 0.00 177.39 177.37