#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b8x s PRO 2 N 0.00 4.24 -0.32 -1.46 0.04 -1.23 -4.53 135.00 131.74 1b8x s PRO 2 Ca 0.00 0.76 0.03 0.00 0.04 0.00 0.00 61.00 61.83 1b8x s PRO 2 Cb 0.00 -3.26 0.09 0.00 0.04 0.00 0.00 34.50 31.38 1b8x s PRO 2 CO 0.00 0.59 0.03 0.42 0.04 0.00 0.00 177.00 178.08 1b8x s ILE 3 N -0.97 1.96 -0.12 0.56 1.09 -0.89 -2.15 121.20 120.68 1b8x s ILE 3 Ca 0.30 -2.00 -0.29 0.00 -1.10 0.00 0.00 60.65 57.55 1b8x s ILE 3 Cb -0.20 -2.39 -0.02 0.00 -1.06 0.00 0.00 42.46 38.80 1b8x s ILE 3 CO 0.19 -0.50 1.18 -0.22 -0.10 0.00 0.00 174.94 175.49 1b8x s LEU 4 N 1.09 4.22 0.04 2.97 2.96 -1.24 -3.28 118.68 125.44 1b8x s LEU 4 Ca 0.07 1.68 0.05 0.00 -0.22 0.00 0.00 54.13 55.71 1b8x s LEU 4 Cb -0.19 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 42.92 1b8x s LEU 4 CO -0.10 -0.64 -0.10 -0.83 -1.32 0.00 0.00 176.35 173.35 1b8x s GLY 5 N 1.57 1.73 0.00 7.98 0.00 -0.59 0.19 107.32 118.20 1b8x s GLY 5 Ca 0.53 -1.12 0.00 0.00 0.00 0.00 0.00 44.72 44.13 1b8x s GLY 5 CO 0.17 -1.03 0.00 2.98 0.00 0.00 0.00 173.10 175.22 1b8x n TYR 6 N 1.30 0.00 -2.40 1.90 9.36 -1.20 -1.12 117.16 125.01 1b8x n TYR 6 Ca -0.15 0.00 -0.25 0.00 3.32 0.00 0.00 57.90 60.82 1b8x n TYR 6 Cb 0.52 0.00 0.04 0.00 -0.63 0.00 0.00 39.34 39.28 1b8x n TYR 6 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 1b8x s TRP 7 N -2.67 3.09 -1.21 2.98 0.52 -1.26 -1.26 118.94 119.12 1b8x s TRP 7 Ca 0.00 0.47 -0.09 0.00 0.02 0.00 0.00 56.10 56.50 1b8x s TRP 7 Cb 0.00 -2.87 -0.12 0.00 -1.15 0.00 0.00 33.47 29.33 1b8x s TRP 7 CO 0.00 -1.00 3.10 1.17 0.02 0.00 0.00 176.95 180.24 1b8x n LYS 8 N -2.64 3.32 -4.14 4.98 3.00 0.85 -4.57 118.16 118.97 1b8x n LYS 8 Ca 0.06 -1.96 -0.12 0.00 -0.00 0.00 0.00 58.31 56.29 1b8x n LYS 8 Cb 0.59 -2.59 -0.08 0.00 0.00 0.00 0.00 35.03 32.95 1b8x n LYS 8 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.40 178.36 1b8x s ILE 9 N 1.70 0.00 0.01 3.15 -4.36 -1.26 -4.33 121.20 116.11 1b8x s ILE 9 Ca 0.69 -1.78 -0.25 0.00 -0.26 0.00 0.00 60.65 59.04 1b8x s ILE 9 Cb 0.22 -2.43 -0.17 0.00 1.25 0.00 0.00 42.46 41.33 1b8x s ILE 9 CO -0.05 0.00 1.27 0.50 0.24 0.00 0.00 174.94 176.91 1b8x h LYS 10 N 2.42 -0.30 0.00 0.37 1.63 -1.33 -3.45 116.57 115.92 1b8x h LYS 10 Ca -0.31 0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.51 1b8x h LYS 10 Cb 1.25 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 32.94 1b8x h LYS 10 CO 0.45 0.03 0.00 0.41 -3.45 0.00 0.00 179.45 176.89 1b8x n GLY 11 N -0.27 1.66 0.07 5.01 0.00 -0.98 -1.91 105.19 108.78 1b8x n GLY 11 Ca -0.09 -0.07 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1b8x n GLY 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1b8x n LEU 12 N 0.00 0.50 -0.60 0.99 7.99 -1.26 -4.33 117.00 120.29 1b8x n LEU 12 Ca 0.00 0.19 0.13 0.00 -0.01 0.00 0.00 56.01 56.31 1b8x n LEU 12 Cb 0.00 -0.04 0.41 0.00 -0.11 0.00 0.00 43.42 43.69 1b8x n LEU 12 CO 0.00 -0.11 0.80 0.55 -1.51 0.00 0.00 177.39 177.13 1b8x n VAL 13 N -2.49 0.09 0.35 4.08 3.14 -1.23 -4.47 118.33 117.81 1b8x n VAL 13 Ca -0.02 -0.34 -0.17 0.00 -2.96 0.00 0.00 64.34 60.85 1b8x n VAL 13 Cb 0.56 0.60 -0.09 0.00 -1.06 0.00 0.00 33.84 33.85 1b8x n VAL 13 CO 0.00 0.00 0.00 -0.61 -6.46 0.00 0.00 176.83 169.76 1b8x h GLN 14 N 2.70 -0.85 -0.29 1.45 5.75 -1.57 -2.32 115.11 119.98 1b8x h GLN 14 Ca 0.00 0.06 0.08 0.00 -0.15 0.00 0.00 58.65 58.64 1b8x h GLN 14 Cb 0.58 0.19 -0.01 0.00 1.07 0.00 0.00 27.48 29.31 1b8x h GLN 14 CO 0.00 -0.54 0.26 -1.35 -2.65 0.00 0.00 178.83 174.55 1b8x h PRO 15 N -0.96 0.00 0.00 -2.39 0.11 -1.78 0.67 132.00 127.64 1b8x h PRO 15 Ca -0.09 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.94 1b8x h PRO 15 Cb 0.70 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.80 1b8x h PRO 15 CO 0.15 0.00 -0.36 1.79 -0.21 0.00 0.00 178.00 179.36 1b8x h THR 16 N 0.00 0.72 -0.02 -1.15 1.35 -1.79 -2.42 112.91 109.61 1b8x h THR 16 Ca 0.14 -1.68 -0.13 0.00 -0.55 0.00 0.00 66.41 64.18 1b8x h THR 16 Cb 0.67 2.11 -0.02 0.00 -1.73 0.00 0.00 68.15 69.18 1b8x h THR 16 CO -0.00 0.36 -0.61 0.03 -0.25 0.00 0.00 175.52 175.05 1b8x h ARG 17 N 0.00 0.05 0.00 4.72 3.08 0.87 -2.15 114.38 120.96 1b8x h ARG 17 Ca -0.00 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 1b8x h ARG 17 Cb 1.08 0.01 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 1b8x h ARG 17 CO 0.05 0.64 -0.32 -0.07 -1.07 0.00 0.00 179.97 179.20 1b8x h LEU 18 N 0.04 0.00 0.13 3.04 4.07 -1.01 -2.80 115.31 118.77 1b8x h LEU 18 Ca -0.01 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.69 1b8x h LEU 18 Cb 1.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.83 1b8x h LEU 18 CO 0.08 0.08 -1.28 0.25 -1.08 0.00 0.00 178.44 176.49 1b8x h LEU 19 N 0.00 0.42 -0.45 1.67 5.85 -1.32 -2.21 115.31 119.27 1b8x h LEU 19 Ca -0.01 -0.88 0.02 0.00 0.84 0.00 0.00 57.88 57.86 1b8x h LEU 19 Cb 1.07 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1b8x h LEU 19 CO 0.01 1.57 0.26 -0.07 -0.34 0.00 0.00 178.44 179.87 1b8x h LEU 20 N -0.30 0.42 0.47 2.25 3.38 -1.49 0.16 115.31 120.19 1b8x h LEU 20 Ca -0.27 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.70 1b8x h LEU 20 Cb 1.75 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.41 1b8x h LEU 20 CO 0.09 0.30 -0.38 -0.08 0.09 0.00 0.00 178.44 178.45 1b8x h GLU 21 N 0.52 -0.81 -0.07 1.13 4.57 -1.59 -0.65 114.58 117.68 1b8x h GLU 21 Ca 0.18 0.06 0.02 0.00 -1.18 0.00 0.00 59.36 58.44 1b8x h GLU 21 Cb 0.03 0.19 -0.00 0.00 -0.16 0.00 0.00 28.75 28.80 1b8x h GLU 21 CO -0.09 -0.54 0.10 -0.92 -1.18 0.00 0.00 179.01 176.38 1b8x h TYR 22 N -0.85 0.00 -0.72 0.92 5.03 -0.90 -0.83 116.97 119.61 1b8x h TYR 22 Ca -0.05 0.00 -0.20 0.00 2.58 0.00 0.00 58.73 61.06 1b8x h TYR 22 Cb 0.73 0.00 -0.12 0.00 1.55 0.00 0.00 36.73 38.89 1b8x h TYR 22 CO -0.17 0.00 0.25 1.28 -1.32 0.00 0.00 178.16 178.20 1b8x n LEU 23 N -3.60 6.05 -3.74 2.82 4.77 0.53 -4.91 117.00 118.91 1b8x n LEU 23 Ca -0.01 -3.22 -0.27 0.00 -0.03 0.00 0.00 56.01 52.48 1b8x n LEU 23 Cb 0.19 -0.74 -0.04 0.00 -2.33 0.00 0.00 43.42 40.50 1b8x n LEU 23 CO 0.25 0.81 -0.09 -0.62 -1.33 0.00 0.00 177.39 176.41 1b8x n GLU 24 N -0.14 -1.85 -2.74 3.23 1.02 -0.32 -4.86 120.64 114.99 1b8x n GLU 24 Ca 0.40 0.15 -0.36 0.00 -0.02 0.00 0.00 57.16 57.32 1b8x n GLU 24 Cb 1.37 -4.72 -0.06 0.00 -0.02 0.00 0.00 31.44 28.01 1b8x n GLU 24 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1b8x s GLU 25 N -6.37 4.46 -0.24 3.49 2.12 -0.30 -5.05 118.70 116.82 1b8x s GLU 25 Ca 0.52 1.34 -0.16 0.00 0.36 0.00 0.00 54.97 57.03 1b8x s GLU 25 Cb -0.30 -2.68 -0.04 0.00 0.26 0.00 0.00 34.13 31.38 1b8x s GLU 25 CO 0.63 0.16 0.42 0.21 -0.54 0.00 0.00 175.26 176.14 1b8x s LYS 26 N -2.27 4.09 -0.02 4.30 2.20 -1.26 -4.81 119.74 121.97 1b8x s LYS 26 Ca 0.53 0.17 -0.29 0.00 -0.36 0.00 0.00 55.97 56.03 1b8x s LYS 26 Cb -0.18 -3.61 0.10 0.00 -1.51 0.00 0.00 37.83 32.63 1b8x s LYS 26 CO 0.23 -0.20 0.84 1.52 -0.36 0.00 0.00 175.35 177.38 1b8x s TYR 27 N 1.82 -0.43 -0.16 4.03 1.13 -1.26 -4.27 117.35 118.21 1b8x s TYR 27 Ca 0.18 0.47 -0.02 0.00 -1.41 0.00 0.00 57.07 56.29 1b8x s TYR 27 Cb -0.15 0.50 0.05 0.00 -1.10 0.00 0.00 41.96 41.26 1b8x s TYR 27 CO 0.09 -0.55 0.00 -1.83 -2.51 0.00 0.00 175.55 170.75 1b8x s GLU 28 N -2.44 0.86 0.67 -3.49 -1.05 -0.91 -5.01 118.70 107.32 1b8x s GLU 28 Ca 0.00 -0.35 -0.13 0.00 -0.15 0.00 0.00 54.97 54.35 1b8x s GLU 28 Cb -0.01 -1.86 -0.00 0.00 -0.44 0.00 0.00 34.13 31.82 1b8x s GLU 28 CO -0.04 -0.52 1.06 -1.21 0.95 0.00 0.00 175.26 175.50 1b8x s GLU 29 N 1.81 3.01 -0.79 -4.83 2.02 -1.26 -3.62 118.70 115.04 1b8x s GLU 29 Ca 0.01 1.06 0.02 0.00 0.02 0.00 0.00 54.97 56.08 1b8x s GLU 29 Cb -0.16 -2.00 0.23 0.00 0.10 0.00 0.00 34.13 32.30 1b8x s GLU 29 CO -0.07 -1.04 0.78 0.72 0.02 0.00 0.00 175.26 175.67 1b8x n HIS 30 N -2.77 3.60 -2.04 1.61 8.25 0.13 -4.88 115.22 119.12 1b8x n HIS 30 Ca 0.08 -4.01 -0.40 0.00 -0.26 0.00 0.00 57.72 53.13 1b8x n HIS 30 Cb 0.53 -0.85 -0.01 0.00 1.12 0.00 0.00 29.99 30.79 1b8x n HIS 30 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1b8x s LEU 31 N -1.91 4.25 -0.04 2.41 1.02 -1.26 -3.21 118.68 119.94 1b8x s LEU 31 Ca 0.31 2.69 0.03 0.00 0.02 0.00 0.00 54.13 57.19 1b8x s LEU 31 Cb 0.02 -3.85 0.00 0.00 0.02 0.00 0.00 46.19 42.38 1b8x s LEU 31 CO -0.08 -0.82 -0.12 -0.31 0.02 0.00 0.00 176.35 175.04 1b8x s TYR 32 N -1.23 1.28 0.52 0.29 2.02 -0.39 -4.89 117.35 114.93 1b8x s TYR 32 Ca 0.56 -0.37 0.06 0.00 -0.37 0.00 0.00 57.07 56.95 1b8x s TYR 32 Cb -0.39 -0.90 0.03 0.00 -0.40 0.00 0.00 41.96 40.30 1b8x s TYR 32 CO 0.51 -0.15 0.41 -1.21 -1.57 0.00 0.00 175.55 173.53 1b8x s GLU 33 N 0.24 2.30 0.11 -0.62 0.41 -1.26 -0.11 118.70 119.78 1b8x s GLU 33 Ca -0.05 -1.90 -0.31 0.00 -0.41 0.00 0.00 54.97 52.29 1b8x s GLU 33 Cb -0.11 -2.17 -0.11 0.00 -1.78 0.00 0.00 34.13 29.96 1b8x s GLU 33 CO 0.02 -0.53 1.51 0.00 -0.49 0.00 0.00 175.26 175.76 1b8x h ARG 34 N 0.81 -0.44 0.00 1.61 3.08 -2.01 -2.99 114.38 114.43 1b8x h ARG 34 Ca -0.37 0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.71 1b8x h ARG 34 Cb 1.29 0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.44 1b8x h ARG 34 CO 0.57 -0.29 0.00 -0.25 -1.07 0.00 0.00 179.97 178.93 1b8x n ASP 35 N -5.18 0.00 -3.25 7.04 8.00 -1.26 -2.45 116.55 119.45 1b8x n ASP 35 Ca -0.05 0.79 -0.28 0.00 0.71 0.00 0.00 54.79 55.97 1b8x n ASP 35 Cb 0.33 -0.38 -0.02 0.00 -0.02 0.00 0.00 41.12 41.03 1b8x n ASP 35 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1b8x n GLU 36 N -2.66 2.43 0.17 -1.24 0.00 -1.13 -4.30 120.64 113.92 1b8x n GLU 36 Ca 0.00 -1.68 0.11 0.00 0.00 0.00 0.00 57.16 55.59 1b8x n GLU 36 Cb 0.00 -2.58 0.09 0.00 0.00 0.00 0.00 31.44 28.95 1b8x n GLU 36 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.13 177.91 1b8x h GLY 37 N 8.41 0.00 1.52 -1.84 0.00 -1.61 -3.11 103.07 106.43 1b8x h GLY 37 Ca 0.58 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.86 1b8x h GLY 37 CO 1.57 0.00 -0.66 1.29 0.00 0.00 0.00 176.54 178.74 1b8x h ASP 38 N 0.00 0.00 0.79 0.19 3.04 -1.88 -3.31 116.42 115.26 1b8x h ASP 38 Ca -0.01 0.00 -0.04 0.00 -3.24 0.00 0.00 57.03 53.75 1b8x h ASP 38 Cb 1.04 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 39.33 1b8x h ASP 38 CO 0.00 0.20 -0.38 0.50 -2.04 0.00 0.00 179.24 177.52 1b8x h LYS 39 N 0.00 -1.02 -6.32 4.15 3.64 -1.87 -3.11 116.57 112.04 1b8x h LYS 39 Ca -0.03 0.07 -0.54 0.00 -1.27 0.00 0.00 60.65 58.89 1b8x h LYS 39 Cb 1.18 0.23 -0.07 0.00 -0.41 0.00 0.00 32.23 33.16 1b8x h LYS 39 CO 0.02 -0.68 1.10 -0.46 -2.27 0.00 0.00 179.45 177.16 1b8x s TRP 40 N -5.27 2.21 0.00 1.91 -0.11 -1.23 -2.25 118.94 114.20 1b8x s TRP 40 Ca -0.16 0.13 0.00 0.00 1.22 0.00 0.00 56.10 57.29 1b8x s TRP 40 Cb 0.02 -4.53 0.00 0.00 -1.50 0.00 0.00 33.47 27.45 1b8x s TRP 40 CO 0.47 -2.07 0.00 0.54 -4.62 0.00 0.00 176.95 171.26 1b8x n ARG 41 N 9.25 0.00 -0.17 5.86 5.12 -1.25 -4.81 116.66 130.66 1b8x n ARG 41 Ca 0.06 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 56.09 1b8x n ARG 41 Cb 0.49 0.00 0.27 0.00 -1.16 0.00 0.00 32.46 32.06 1b8x n ARG 41 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1b8x n ASN 42 N 0.00 2.85 0.00 0.55 2.85 -0.95 -4.22 115.26 116.34 1b8x n ASN 42 Ca 0.00 -1.91 0.00 0.00 -0.11 0.00 0.00 54.58 52.56 1b8x n ASN 42 Cb 0.00 -0.22 0.00 0.00 1.24 0.00 0.00 39.78 40.80 1b8x n ASN 42 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 1b8x n LYS 43 N 1.09 0.20 -0.17 1.20 4.81 -1.18 -4.77 118.16 119.34 1b8x n LYS 43 Ca 0.18 0.00 -0.03 0.00 -0.87 0.00 0.00 58.31 57.59 1b8x n LYS 43 Cb 0.51 -0.78 -0.01 0.00 0.02 0.00 0.00 35.03 34.76 1b8x n LYS 43 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1b8x n LYS 44 N -1.99 -0.15 0.11 1.64 4.81 -1.26 0.11 118.16 121.43 1b8x n LYS 44 Ca 0.00 0.66 0.12 0.00 -0.87 0.00 0.00 58.31 58.21 1b8x n LYS 44 Cb 0.28 -0.97 0.12 0.00 0.02 0.00 0.00 35.03 34.48 1b8x n LYS 44 CO 0.00 0.00 0.00 0.74 1.17 0.00 0.00 177.40 179.31 1b8x h PHE 45 N 0.00 0.00 -0.18 5.64 0.04 -1.90 -3.33 116.94 117.20 1b8x h PHE 45 Ca 0.11 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.78 1b8x h PHE 45 Cb 0.21 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.31 1b8x h PHE 45 CO -0.41 0.00 0.12 0.39 -0.60 0.00 0.00 178.31 177.81 1b8x n GLU 46 N -2.54 1.24 0.00 1.51 -0.58 0.12 -3.44 120.64 116.94 1b8x n GLU 46 Ca 0.02 -0.55 0.03 0.00 -0.42 0.00 0.00 57.16 56.24 1b8x n GLU 46 Cb 0.50 -1.22 0.02 0.00 -0.57 0.00 0.00 31.44 30.17 1b8x n GLU 46 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1b8x n LEU 47 N 0.32 1.39 -2.24 -4.62 4.77 -1.21 -4.97 117.00 110.45 1b8x n LEU 47 Ca 0.11 -0.97 -0.20 0.00 -0.03 0.00 0.00 56.01 54.92 1b8x n LEU 47 Cb 0.69 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.76 1b8x n LEU 47 CO 0.12 0.29 -0.25 0.61 -1.33 0.00 0.00 177.39 176.83 1b8x n GLY 48 N 0.35 -0.30 3.67 -0.72 0.00 -1.22 -4.92 105.19 102.05 1b8x n GLY 48 Ca 0.03 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1b8x n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b8x s LEU 49 N -5.68 4.16 0.09 0.99 1.02 -1.26 -4.86 118.68 113.13 1b8x s LEU 49 Ca 0.00 1.18 -0.30 0.00 0.02 0.00 0.00 54.13 55.02 1b8x s LEU 49 Cb 0.00 -3.25 -0.15 0.00 0.02 0.00 0.00 46.19 42.81 1b8x s LEU 49 CO 0.00 -0.43 1.64 -0.33 0.02 0.00 0.00 176.35 177.25 1b8x h GLU 50 N 7.37 -0.64 -2.56 1.70 5.08 -1.92 -3.32 114.58 120.29 1b8x h GLU 50 Ca -0.28 0.04 -0.61 0.00 -1.00 0.00 0.00 59.36 57.52 1b8x h GLU 50 Cb 1.12 0.15 -0.42 0.00 0.50 0.00 0.00 28.75 30.10 1b8x h GLU 50 CO 0.85 -0.43 -0.61 1.19 -1.00 0.00 0.00 179.01 179.01 1b8x n PHE 51 N -5.41 3.27 -0.76 4.33 3.72 -1.26 -5.09 117.46 116.25 1b8x n PHE 51 Ca -0.10 -4.19 -0.26 0.00 -0.05 0.00 0.00 57.45 52.85 1b8x n PHE 51 Cb 0.31 -0.56 -0.01 0.00 -0.94 0.00 0.00 39.48 38.28 1b8x n PHE 51 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1b8x n PRO 52 N 1.36 0.00 -3.87 -1.08 -0.02 -1.25 -4.68 135.00 125.46 1b8x n PRO 52 Ca 0.26 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1b8x n PRO 52 Cb 0.39 -0.56 0.00 0.00 -0.02 0.00 0.00 33.50 33.31 1b8x n PRO 52 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1b8x n ASN 53 N 1.18 0.00 -3.84 2.55 2.85 -1.26 -4.98 115.26 111.76 1b8x n ASN 53 Ca 0.09 0.00 -0.14 0.00 -0.11 0.00 0.00 54.58 54.42 1b8x n ASN 53 Cb 0.17 0.00 -0.15 0.00 1.24 0.00 0.00 39.78 41.04 1b8x n ASN 53 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 1b8x s LEU 54 N 0.00 1.55 0.41 1.20 1.43 -1.26 -4.18 118.68 117.82 1b8x s LEU 54 Ca 0.00 0.00 -0.24 0.00 -1.03 0.00 0.00 54.13 52.86 1b8x s LEU 54 Cb 0.00 -0.08 -0.09 0.00 0.03 0.00 0.00 46.19 46.05 1b8x s LEU 54 CO 0.00 -0.06 1.07 -2.16 0.23 0.00 0.00 176.35 175.44 1b8x s PRO 55 N 0.53 4.10 0.52 1.29 0.04 -1.26 -4.73 135.00 135.48 1b8x s PRO 55 Ca -0.05 1.57 0.02 0.00 0.04 0.00 0.00 61.00 62.58 1b8x s PRO 55 Cb -0.07 -2.53 -0.00 0.00 0.04 0.00 0.00 34.50 31.94 1b8x s PRO 55 CO -0.01 -0.21 0.10 1.52 0.04 0.00 0.00 177.00 178.44 1b8x s TYR 56 N -1.63 1.83 -0.28 0.56 -0.85 -0.27 -3.71 117.35 113.00 1b8x s TYR 56 Ca 0.58 -0.92 -0.19 0.00 -0.52 0.00 0.00 57.07 56.03 1b8x s TYR 56 Cb -0.23 -1.69 0.12 0.00 0.38 0.00 0.00 41.96 40.54 1b8x s TYR 56 CO 0.29 0.07 0.93 -0.47 -1.52 0.00 0.00 175.55 174.85 1b8x s TYR 57 N -2.84 -0.64 -0.18 -3.49 5.04 -0.49 -1.54 117.35 113.22 1b8x s TYR 57 Ca 0.14 1.35 -0.01 0.00 -2.44 0.00 0.00 57.07 56.10 1b8x s TYR 57 Cb 0.01 0.39 0.05 0.00 0.35 0.00 0.00 41.96 42.76 1b8x s TYR 57 CO 0.08 -0.31 -0.01 0.42 -1.34 0.00 0.00 175.55 174.38 1b8x s ILE 58 N 1.03 0.87 -2.48 3.14 1.01 -1.21 -1.26 121.20 122.31 1b8x s ILE 58 Ca -0.05 -0.61 0.23 0.00 0.00 0.00 0.00 60.65 60.22 1b8x s ILE 58 Cb -0.04 -1.18 0.43 0.00 0.01 0.00 0.00 42.46 41.68 1b8x s ILE 58 CO -0.13 -0.02 1.41 -0.67 0.00 0.00 0.00 174.94 175.54 1b8x n ASP 59 N 4.94 3.48 0.00 3.58 -0.08 -0.74 -2.09 116.55 125.64 1b8x n ASP 59 Ca -0.10 -1.99 0.00 0.00 -1.51 0.00 0.00 54.79 51.18 1b8x n ASP 59 Cb 0.47 -0.26 0.00 0.00 2.34 0.00 0.00 41.12 43.68 1b8x n ASP 59 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1b8x n GLY 60 N 1.52 2.25 0.10 0.27 0.00 -1.26 -4.55 105.19 103.53 1b8x n GLY 60 Ca 0.20 -0.68 0.14 0.00 0.00 0.00 0.00 46.02 45.68 1b8x n GLY 60 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1b8x n ASP 61 N 1.74 0.44 -4.05 1.61 5.68 -1.26 -4.59 116.55 116.13 1b8x n ASP 61 Ca 0.00 -0.51 -0.33 0.00 -0.50 0.00 0.00 54.79 53.44 1b8x n ASP 61 Cb 0.00 -0.08 -0.13 0.00 -1.14 0.00 0.00 41.12 39.77 1b8x n ASP 61 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1b8x s VAL 62 N -2.51 2.96 -1.00 2.12 1.01 -1.26 -5.01 120.40 116.71 1b8x s VAL 62 Ca 0.28 -2.65 -0.13 0.00 0.00 0.00 0.00 61.98 59.48 1b8x s VAL 62 Cb 0.20 -3.04 0.22 0.00 0.00 0.00 0.00 36.38 33.76 1b8x s VAL 62 CO 0.48 -0.74 1.04 -0.54 0.00 0.00 0.00 175.10 175.35 1b8x s LYS 63 N 0.45 3.89 0.37 2.72 -0.14 -1.26 -1.80 119.74 123.97 1b8x s LYS 63 Ca 0.13 -2.65 0.08 0.00 -1.36 0.00 0.00 55.97 52.17 1b8x s LYS 63 Cb -0.22 -4.64 -0.06 0.00 -1.68 0.00 0.00 37.83 31.24 1b8x s LYS 63 CO -0.04 -1.41 0.07 -0.48 -0.76 0.00 0.00 175.35 172.73 1b8x s LEU 64 N 0.22 3.03 0.00 3.17 0.05 -0.39 -4.27 118.68 120.49 1b8x s LEU 64 Ca 0.28 -1.04 0.00 0.00 0.05 0.00 0.00 54.13 53.43 1b8x s LEU 64 Cb -0.08 -1.36 0.00 0.00 -2.05 0.00 0.00 46.19 42.70 1b8x s LEU 64 CO -0.07 -0.35 0.00 0.35 -0.55 0.00 0.00 176.35 175.73 1b8x n THR 65 N -1.05 0.00 -2.27 5.48 -2.24 -1.26 -1.39 114.28 111.55 1b8x n THR 65 Ca -0.03 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.72 1b8x n THR 65 Cb 0.63 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.84 1b8x n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b8x n GLN 66 N 0.00 -4.09 0.00 -0.78 1.13 -1.24 -4.10 117.38 108.29 1b8x n GLN 66 Ca 0.00 3.11 0.00 0.00 -1.94 0.00 0.00 57.00 58.17 1b8x n GLN 66 Cb 0.00 -4.22 0.00 0.00 0.11 0.00 0.00 30.24 26.13 1b8x n GLN 66 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1b8x n SER 67 N 1.47 0.00 -0.40 1.08 7.64 -1.26 -0.73 113.62 121.42 1b8x n SER 67 Ca -0.19 0.00 0.09 0.00 1.01 0.00 0.00 58.87 59.78 1b8x n SER 67 Cb 0.29 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1b8x n SER 67 CO 0.00 0.00 0.00 0.80 -3.01 0.00 0.00 175.04 172.83 1b8x n MET 68 N -3.76 1.58 0.18 1.43 1.56 -1.26 -4.30 117.12 112.55 1b8x n MET 68 Ca 0.00 -0.87 0.05 0.00 -0.27 0.00 0.00 57.70 56.61 1b8x n MET 68 Cb 0.00 -1.32 0.26 0.00 2.15 0.00 0.00 33.22 34.31 1b8x n MET 68 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1b8x h ALA 69 N 3.04 0.90 0.13 -5.12 0.00 -1.12 -3.06 119.26 114.03 1b8x h ALA 69 Ca 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 1b8x h ALA 69 Cb 0.60 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1b8x h ALA 69 CO 0.00 0.49 -0.06 0.82 0.00 0.00 0.00 179.25 180.49 1b8x h ILE 70 N 0.00 0.84 -0.58 0.00 2.04 -1.70 -1.99 117.51 116.11 1b8x h ILE 70 Ca -0.00 -1.24 0.13 0.00 1.00 0.00 0.00 64.86 64.75 1b8x h ILE 70 Cb 1.02 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 38.52 1b8x h ILE 70 CO 0.05 0.23 0.40 -0.29 0.00 0.00 0.00 178.15 178.54 1b8x h ILE 71 N -0.90 0.79 0.06 -0.67 2.10 -1.76 0.29 117.51 117.43 1b8x h ILE 71 Ca -0.02 -0.06 -0.16 0.00 1.08 0.00 0.00 64.86 65.70 1b8x h ILE 71 Cb 0.52 0.59 0.02 0.00 -1.09 0.00 0.00 36.82 36.86 1b8x h ILE 71 CO 0.03 0.03 -0.66 0.03 -1.08 0.00 0.00 178.15 176.51 1b8x h ARG 72 N 0.19 0.33 -0.19 2.19 3.08 -1.60 -1.78 114.38 116.59 1b8x h ARG 72 Ca 0.27 -0.44 0.05 0.00 0.07 0.00 0.00 59.98 59.93 1b8x h ARG 72 Cb 0.83 0.15 -0.05 0.00 0.08 0.00 0.00 29.97 30.98 1b8x h ARG 72 CO -0.05 1.15 -0.11 -0.92 -1.07 0.00 0.00 179.97 178.97 1b8x h TYR 73 N -0.28 -0.27 -0.50 3.04 3.20 -0.30 0.84 116.97 122.70 1b8x h TYR 73 Ca -0.10 0.02 0.01 0.00 3.14 0.00 0.00 58.73 61.80 1b8x h TYR 73 Cb 1.43 0.15 -0.03 0.00 1.54 0.00 0.00 36.73 39.83 1b8x h TYR 73 CO 0.18 -0.17 0.33 0.82 -1.64 0.00 0.00 178.16 177.68 1b8x h ILE 74 N -0.10 1.12 0.00 1.81 2.04 -0.57 0.21 117.51 122.02 1b8x h ILE 74 Ca 0.11 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.74 1b8x h ILE 74 Cb 0.26 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1b8x h ILE 74 CO -0.26 0.12 0.00 0.00 0.00 0.00 0.00 178.15 178.01 1b8x n ALA 75 N -2.46 2.31 -0.09 1.87 0.00 0.44 -3.36 120.51 119.23 1b8x n ALA 75 Ca 0.05 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.20 1b8x n ALA 75 Cb 0.07 -1.45 -0.11 0.00 0.00 0.00 0.00 19.45 17.95 1b8x n ALA 75 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1b8x h ASP 76 N 0.00 0.00 -1.01 0.00 3.58 0.37 0.36 116.42 119.73 1b8x h ASP 76 Ca 0.00 -0.61 0.29 0.00 0.42 0.00 0.00 57.03 57.13 1b8x h ASP 76 Cb 0.41 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.42 1b8x h ASP 76 CO 0.00 1.28 0.94 0.11 -2.88 0.00 0.00 179.24 178.69 1b8x h LYS 77 N -1.00 0.00 -0.23 0.28 1.57 -1.26 0.14 116.57 116.07 1b8x h LYS 77 Ca -0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 1b8x h LYS 77 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1b8x h LYS 77 CO -0.13 0.00 0.00 0.72 -0.57 0.00 0.00 179.45 179.47 1b8x n HIS 78 N -3.67 0.57 -3.19 -1.35 8.25 -1.25 -4.99 115.22 109.59 1b8x n HIS 78 Ca 0.22 -0.73 -0.16 0.00 -0.26 0.00 0.00 57.72 56.79 1b8x n HIS 78 Cb 1.27 -0.17 0.05 0.00 1.12 0.00 0.00 29.99 32.26 1b8x n HIS 78 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1b8x n ASN 79 N -0.28 -4.99 -0.01 0.41 4.13 0.50 -4.95 115.26 110.06 1b8x n ASN 79 Ca 0.15 -0.35 0.09 0.00 1.68 0.00 0.00 54.58 56.16 1b8x n ASN 79 Cb 0.64 -3.62 -0.14 0.00 -1.54 0.00 0.00 39.78 35.12 1b8x n ASN 79 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1b8x n MET 80 N -3.53 0.64 0.38 3.52 2.81 0.12 -4.66 117.12 116.41 1b8x n MET 80 Ca -0.00 -0.14 -0.18 0.00 -1.81 0.00 0.00 57.70 55.57 1b8x n MET 80 Cb 0.55 -1.42 -0.09 0.00 -0.71 0.00 0.00 33.22 31.55 1b8x n MET 80 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1b8x h LEU 81 N 0.00 -0.81 0.00 4.03 4.07 -1.79 -3.44 115.31 117.37 1b8x h LEU 81 Ca 0.00 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.97 1b8x h LEU 81 Cb 0.78 0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.73 1b8x h LEU 81 CO 0.00 -0.54 0.00 0.61 -1.08 0.00 0.00 178.44 177.43 1b8x n GLY 82 N -1.31 1.22 0.09 0.83 0.00 -1.26 -4.56 105.19 100.20 1b8x n GLY 82 Ca -0.14 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.18 1b8x n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b8x n GLY 83 N -0.20 -1.00 3.08 -0.02 0.00 -1.26 -4.90 105.19 100.88 1b8x n GLY 83 Ca 0.00 -0.32 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 1b8x n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8x h PRO 85 N 4.03 0.00 0.52 0.00 0.11 -1.97 0.43 132.00 135.12 1b8x h PRO 85 Ca -0.35 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.73 1b8x h PRO 85 Cb 1.19 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.30 1b8x h PRO 85 CO 0.49 0.00 -0.25 0.87 -0.21 0.00 0.00 178.00 178.89 1b8x h LYS 86 N 0.00 -0.68 0.00 1.05 6.56 -2.00 -2.98 116.57 118.53 1b8x h LYS 86 Ca 0.00 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.64 1b8x h LYS 86 Cb 0.40 0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.21 1b8x h LYS 86 CO 0.00 -0.38 -0.15 1.49 -2.06 0.00 0.00 179.45 178.35 1b8x h GLU 87 N -1.06 0.00 0.00 3.15 4.81 -1.84 -2.94 114.58 116.70 1b8x h GLU 87 Ca -0.07 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1b8x h GLU 87 Cb 0.61 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.99 1b8x h GLU 87 CO 0.12 0.00 -0.01 -0.09 -0.73 0.00 0.00 179.01 178.29 1b8x h ARG 88 N 0.00 0.00 0.02 1.92 2.43 -1.00 -2.05 114.38 115.70 1b8x h ARG 88 Ca 0.00 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 58.96 1b8x h ARG 88 Cb 0.93 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.46 1b8x h ARG 88 CO 0.00 0.01 -0.98 0.00 -1.51 0.00 0.00 179.97 177.50 1b8x h ALA 89 N 1.99 0.41 0.03 2.80 0.00 -1.35 -3.06 119.26 120.07 1b8x h ALA 89 Ca -0.00 -0.83 -0.00 0.00 0.00 0.00 0.00 54.91 54.08 1b8x h ALA 89 Cb 0.59 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1b8x h ALA 89 CO 0.00 1.08 -0.01 0.93 0.00 0.00 0.00 179.25 181.25 1b8x h GLU 90 N 0.04 -0.03 -0.83 0.00 4.39 -1.40 -1.79 114.58 114.94 1b8x h GLU 90 Ca -0.04 0.00 0.07 0.00 0.34 0.00 0.00 59.36 59.73 1b8x h GLU 90 Cb 1.68 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 30.28 1b8x h GLU 90 CO 0.14 0.38 0.51 0.82 -1.16 0.00 0.00 179.01 179.70 1b8x h ILE 91 N -0.46 1.01 0.00 3.13 1.08 -1.57 0.35 117.51 121.05 1b8x h ILE 91 Ca -0.00 -0.31 -0.06 0.00 -0.39 0.00 0.00 64.86 64.09 1b8x h ILE 91 Cb 0.43 0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.19 1b8x h ILE 91 CO 0.01 0.17 -0.29 0.28 -0.69 0.00 0.00 178.15 177.63 1b8x h SER 92 N 0.91 0.00 1.01 1.72 0.02 -1.53 0.40 113.55 116.08 1b8x h SER 92 Ca 0.37 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 61.12 1b8x h SER 92 Cb 0.21 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 1b8x h SER 92 CO -0.19 0.29 -1.01 -0.03 -1.14 0.00 0.00 176.83 174.74 1b8x h MET 93 N 0.00 0.00 0.08 3.45 1.85 -0.05 0.13 114.93 120.38 1b8x h MET 93 Ca -0.00 0.00 -0.23 0.00 -0.61 0.00 0.00 59.70 58.86 1b8x h MET 93 Cb 0.77 0.00 0.02 0.00 0.43 0.00 0.00 31.60 32.83 1b8x h MET 93 CO 0.04 0.85 -0.93 -0.07 -0.40 0.00 0.00 176.91 176.39 1b8x h LEU 94 N 0.00 0.69 0.31 3.39 3.38 -0.11 -1.52 115.31 121.45 1b8x h LEU 94 Ca -0.04 -0.82 -0.01 0.00 0.09 0.00 0.00 57.88 57.10 1b8x h LEU 94 Cb 1.73 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 1b8x h LEU 94 CO 0.11 1.44 -0.41 -0.08 0.09 0.00 0.00 178.44 179.59 1b8x h GLU 95 N 0.03 -0.72 -0.39 1.13 4.81 -0.18 -0.52 114.58 118.74 1b8x h GLU 95 Ca -0.14 0.05 0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1b8x h GLU 95 Cb 1.65 0.16 -0.02 0.00 0.63 0.00 0.00 28.75 31.17 1b8x h GLU 95 CO 0.18 -0.48 0.26 0.78 -0.73 0.00 0.00 179.01 179.02 1b8x h GLY 96 N -0.75 0.52 2.00 1.92 0.00 -0.81 0.71 103.07 106.67 1b8x h GLY 96 Ca -0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 1b8x h GLY 96 CO -0.10 0.18 -0.10 0.00 0.00 0.00 0.00 176.54 176.51 1b8x h ALA 97 N 1.76 1.01 0.16 3.60 0.00 -0.96 -2.72 119.26 122.12 1b8x h ALA 97 Ca 0.15 -0.09 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 1b8x h ALA 97 Cb 0.02 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.81 1b8x h ALA 97 CO -0.03 0.13 -1.21 0.28 0.00 0.00 0.00 179.25 178.41 1b8x h VAL 98 N 0.00 1.28 0.00 0.00 2.07 0.75 -3.30 116.25 117.05 1b8x h VAL 98 Ca -0.00 -2.53 0.00 0.00 0.82 0.00 0.00 66.70 64.98 1b8x h VAL 98 Cb 0.64 3.00 0.00 0.00 -1.52 0.00 0.00 31.29 33.41 1b8x h VAL 98 CO 0.01 0.75 0.00 -0.07 0.02 0.00 0.00 177.57 178.28 1b8x h LEU 99 N -0.20 0.00 -0.68 2.57 3.38 -0.91 -0.99 115.31 118.48 1b8x h LEU 99 Ca -0.23 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.60 1b8x h LEU 99 Cb 1.83 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.57 1b8x h LEU 99 CO 0.16 0.00 -0.59 0.44 0.09 0.00 0.00 178.44 178.54 1b8x h ASP 100 N 0.00 0.26 0.09 -0.43 3.32 -1.57 0.54 116.42 118.63 1b8x h ASP 100 Ca 0.00 -0.14 -0.36 0.00 0.02 0.00 0.00 57.03 56.54 1b8x h ASP 100 Cb 0.09 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1b8x h ASP 100 CO 0.00 0.79 -2.05 -0.38 -1.72 0.00 0.00 179.24 175.88 1b8x n ILE 101 N -3.88 1.71 -0.31 0.35 5.41 -0.70 -1.46 119.36 120.48 1b8x n ILE 101 Ca -0.02 -0.60 -0.03 0.00 1.00 0.00 0.00 62.75 63.10 1b8x n ILE 101 Cb 0.61 -1.70 0.13 0.00 -0.71 0.00 0.00 39.64 37.97 1b8x n ILE 101 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1b8x h ARG 102 N -0.02 1.20 0.00 0.38 9.65 -1.26 -2.07 114.38 122.26 1b8x h ARG 102 Ca -0.45 -0.12 -0.13 0.00 -1.10 0.00 0.00 59.98 58.18 1b8x h ARG 102 Cb 1.96 -0.25 -0.02 0.00 -1.39 0.00 0.00 29.97 30.27 1b8x h ARG 102 CO 0.03 0.85 -1.00 1.88 2.80 0.00 0.00 179.97 184.53 1b8x h TYR 103 N 1.22 0.00 -0.18 2.20 -1.99 -1.04 -3.09 116.97 114.09 1b8x h TYR 103 Ca 0.31 0.00 0.05 0.00 2.00 0.00 0.00 58.73 61.10 1b8x h TYR 103 Cb -0.03 0.00 -0.07 0.00 2.00 0.00 0.00 36.73 38.63 1b8x h TYR 103 CO 0.01 0.51 -0.32 0.78 -0.00 0.00 0.00 178.16 179.14 1b8x h GLY 104 N 3.63 -0.41 0.74 3.88 0.00 -0.54 -2.28 103.07 108.09 1b8x h GLY 104 Ca -0.09 0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 1b8x h GLY 104 CO 0.05 -0.22 -0.02 -0.39 0.00 0.00 0.00 176.54 175.97 1b8x h VAL 105 N -0.37 1.28 0.00 4.60 -1.51 -1.62 -3.28 116.25 115.36 1b8x h VAL 105 Ca 0.11 -0.92 -0.52 0.00 -1.23 0.00 0.00 66.70 64.14 1b8x h VAL 105 Cb 0.54 1.66 0.02 0.00 -2.13 0.00 0.00 31.29 31.39 1b8x h VAL 105 CO -0.39 0.26 3.16 -1.54 -1.23 0.00 0.00 177.57 177.83 1b8x n SER 106 N -4.76 6.49 0.00 4.19 3.41 -0.86 0.13 113.62 122.22 1b8x n SER 106 Ca -0.06 -2.45 0.00 0.00 -0.26 0.00 0.00 58.87 56.10 1b8x n SER 106 Cb 0.23 -1.31 0.00 0.00 -0.26 0.00 0.00 64.21 62.87 1b8x n SER 106 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1b8x n ARG 107 N 4.07 0.00 0.01 4.33 1.74 -1.21 -4.85 116.66 120.74 1b8x n ARG 107 Ca 0.60 0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.79 1b8x n ARG 107 Cb 0.19 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 31.51 1b8x n ARG 107 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 1b8x n ILE 108 N -0.79 0.09 0.06 0.55 -0.00 -0.16 -4.31 119.36 114.80 1b8x n ILE 108 Ca 0.00 -0.41 -0.02 0.00 -0.00 0.00 0.00 62.75 62.32 1b8x n ILE 108 Cb 0.00 0.11 0.25 0.00 -0.00 0.00 0.00 39.64 40.00 1b8x n ILE 108 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1b8x h ALA 109 N 2.19 1.19 -0.02 -1.39 0.00 0.73 -3.14 119.26 118.82 1b8x h ALA 109 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1b8x h ALA 109 Cb 0.91 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1b8x h ALA 109 CO 0.00 0.52 -0.07 0.66 0.00 0.00 0.00 179.25 180.37 1b8x n TYR 110 N -4.12 0.00 -1.15 0.00 4.02 -1.26 -1.32 117.16 113.33 1b8x n TYR 110 Ca -0.01 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.59 1b8x n TYR 110 Cb 0.40 0.00 0.17 0.00 -0.02 0.00 0.00 39.34 39.89 1b8x n TYR 110 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1b8x s SER 111 N -1.86 2.77 -0.01 7.72 0.15 -1.19 -4.69 113.70 116.60 1b8x s SER 111 Ca 0.24 1.29 -0.04 0.00 0.70 0.00 0.00 55.95 58.14 1b8x s SER 111 Cb 0.18 -1.96 -0.02 0.00 -1.71 0.00 0.00 66.02 62.51 1b8x s SER 111 CO 0.31 -3.05 0.49 0.11 1.20 0.00 0.00 173.24 172.29 1b8x h LYS 112 N -1.84 -0.12 -3.07 5.44 6.56 -1.95 -3.33 116.57 118.26 1b8x h LYS 112 Ca -0.53 0.01 -0.68 0.00 -1.06 0.00 0.00 60.65 58.38 1b8x h LYS 112 Cb 1.32 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 33.01 1b8x h LYS 112 CO 0.56 -0.08 3.59 -0.25 -2.06 0.00 0.00 179.45 181.21 1b8x n ASP 113 N -2.69 8.12 -0.11 0.86 9.92 -1.26 -4.48 116.55 126.90 1b8x n ASP 113 Ca -0.02 -2.68 -0.13 0.00 -0.53 0.00 0.00 54.79 51.44 1b8x n ASP 113 Cb 0.05 -1.55 -0.03 0.00 -0.64 0.00 0.00 41.12 38.96 1b8x n ASP 113 CO 0.00 0.00 0.00 0.15 0.13 0.00 0.00 177.20 177.48 1b8x h PHE 114 N 5.07 1.03 -1.05 1.24 3.57 -1.79 -2.03 116.94 122.98 1b8x h PHE 114 Ca 0.82 -0.30 0.30 0.00 3.53 0.00 0.00 57.97 62.32 1b8x h PHE 114 Cb 0.33 -0.22 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1b8x h PHE 114 CO 1.80 1.10 0.75 0.93 -2.23 0.00 0.00 178.31 180.67 1b8x h GLU 115 N 0.66 0.01 0.05 1.11 3.07 -1.90 0.72 114.58 118.29 1b8x h GLU 115 Ca 0.06 -0.00 -0.35 0.00 -0.50 0.00 0.00 59.36 58.57 1b8x h GLU 115 Cb 0.92 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.79 1b8x h GLU 115 CO 0.08 0.01 -1.95 2.41 -1.40 0.00 0.00 179.01 178.16 1b8x n THR 116 N -4.23 1.62 0.46 1.13 -1.04 -1.09 -4.00 114.28 107.13 1b8x n THR 116 Ca 0.22 -0.41 0.06 0.00 -2.04 0.00 0.00 64.05 61.88 1b8x n THR 116 Cb 1.11 -1.80 0.27 0.00 -1.82 0.00 0.00 70.33 68.09 1b8x n THR 116 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1b8x n LEU 117 N -3.85 0.00 -0.05 -4.42 4.77 -0.69 -2.29 117.00 110.46 1b8x n LEU 117 Ca -0.38 0.44 -0.14 0.00 -0.03 0.00 0.00 56.01 55.90 1b8x n LEU 117 Cb 0.90 -0.44 -0.07 0.00 -2.33 0.00 0.00 43.42 41.48 1b8x n LEU 117 CO 0.26 -0.26 0.51 0.50 -1.33 0.00 0.00 177.39 177.07 1b8x h LYS 118 N 0.00 0.46 -0.31 3.23 3.64 0.28 -2.79 116.57 121.09 1b8x h LYS 118 Ca 0.00 -0.30 -0.06 0.00 -1.27 0.00 0.00 60.65 59.03 1b8x h LYS 118 Cb 0.18 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1b8x h LYS 118 CO 0.00 0.90 -0.05 -0.39 -2.27 0.00 0.00 179.45 177.63 1b8x h VAL 119 N 0.08 1.21 0.00 2.00 -1.51 -1.63 -2.51 116.25 113.89 1b8x h VAL 119 Ca 0.01 -0.86 0.00 0.00 -1.23 0.00 0.00 66.70 64.61 1b8x h VAL 119 Cb 0.88 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1b8x h VAL 119 CO 0.06 0.29 -0.12 0.44 -1.23 0.00 0.00 177.57 177.01 1b8x h ASP 120 N 0.47 0.00 0.18 4.19 3.32 -1.63 -2.88 116.42 120.07 1b8x h ASP 120 Ca 0.10 -0.02 -0.28 0.00 0.02 0.00 0.00 57.03 56.84 1b8x h ASP 120 Cb 0.39 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.96 1b8x h ASP 120 CO 0.02 0.01 -1.31 0.15 -1.72 0.00 0.00 179.24 176.39 1b8x h PHE 121 N 0.00 0.69 0.00 4.55 3.04 -1.18 -3.24 116.94 120.81 1b8x h PHE 121 Ca 0.00 -0.51 0.00 0.00 3.98 0.00 0.00 57.97 61.44 1b8x h PHE 121 Cb 0.84 -0.03 0.00 0.00 2.56 0.00 0.00 35.95 39.32 1b8x h PHE 121 CO 0.00 1.51 0.00 -0.07 -2.02 0.00 0.00 178.31 177.73 1b8x h LEU 122 N -0.11 0.00 -0.45 0.59 3.38 -1.51 -1.77 115.31 115.44 1b8x h LEU 122 Ca -0.25 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.57 1b8x h LEU 122 Cb 1.91 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.64 1b8x h LEU 122 CO 0.18 0.00 -0.73 0.77 0.09 0.00 0.00 178.44 178.74 1b8x h SER 123 N 0.00 0.00 0.25 -0.43 4.64 -1.53 -3.25 113.55 113.23 1b8x h SER 123 Ca 0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1b8x h SER 123 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1b8x h SER 123 CO 0.00 0.73 -1.82 0.29 -0.87 0.00 0.00 176.83 175.16 1b8x n LYS 124 N -3.58 0.65 -0.11 4.77 5.02 -1.01 -4.51 118.16 119.39 1b8x n LYS 124 Ca -0.00 -0.08 -0.08 0.00 -2.02 0.00 0.00 58.31 56.13 1b8x n LYS 124 Cb 0.73 -1.60 -0.00 0.00 -0.02 0.00 0.00 35.03 34.14 1b8x n LYS 124 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1b8x h LEU 125 N 0.00 0.41 -0.55 -0.35 5.85 -1.37 -1.79 115.31 117.51 1b8x h LEU 125 Ca -0.09 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1b8x h LEU 125 Cb 1.22 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1b8x h LEU 125 CO 0.01 0.30 0.00 -2.65 -0.34 0.00 0.00 178.44 175.75 1b8x n PRO 126 N -4.84 0.08 -0.02 5.25 -0.02 -1.25 0.13 135.00 134.32 1b8x n PRO 126 Ca -0.00 0.48 -0.02 0.00 -2.02 0.00 0.00 63.50 61.95 1b8x n PRO 126 Cb 0.03 -1.70 -0.13 0.00 -0.02 0.00 0.00 33.50 31.68 1b8x n PRO 126 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1b8x n GLU 127 N -1.85 0.65 0.08 -0.52 1.02 -0.75 -4.00 120.64 115.27 1b8x n GLU 127 Ca 0.01 0.07 -0.22 0.00 -0.02 0.00 0.00 57.16 56.99 1b8x n GLU 127 Cb 0.08 -1.65 -0.15 0.00 -0.02 0.00 0.00 31.44 29.70 1b8x n GLU 127 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1b8x h MET 128 N 0.00 0.38 0.00 3.49 2.86 -0.24 -3.29 114.93 118.14 1b8x h MET 128 Ca -0.26 -0.66 0.00 0.00 -2.06 0.00 0.00 59.70 56.72 1b8x h MET 128 Cb 1.71 0.24 0.00 0.00 0.06 0.00 0.00 31.60 33.61 1b8x h MET 128 CO 0.03 1.31 0.00 1.28 1.06 0.00 0.00 176.91 180.60 1b8x n LEU 129 N -3.92 0.00 -0.08 1.22 4.77 0.12 -1.14 117.00 117.96 1b8x n LEU 129 Ca -0.17 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.74 1b8x n LEU 129 Cb 0.95 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.88 1b8x n LEU 129 CO 0.52 0.00 -1.09 2.29 -1.33 0.00 0.00 177.39 177.78 1b8x n LYS 130 N -0.82 0.68 0.24 3.23 -0.00 -1.24 -3.07 118.16 117.19 1b8x n LYS 130 Ca 0.05 -0.04 0.11 0.00 -0.00 0.00 0.00 58.31 58.44 1b8x n LYS 130 Cb 0.03 -1.52 0.59 0.00 -0.00 0.00 0.00 35.03 34.12 1b8x n LYS 130 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.40 177.92 1b8x h MET 131 N 0.00 0.00 0.01 -1.58 2.86 -1.27 0.26 114.93 115.21 1b8x h MET 131 Ca -0.45 0.00 -0.36 0.00 -2.06 0.00 0.00 59.70 56.82 1b8x h MET 131 Cb 2.03 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 33.63 1b8x h MET 131 CO 0.02 0.18 -2.28 1.19 1.06 0.00 0.00 176.91 177.08 1b8x n PHE 132 N -3.48 0.27 0.09 -0.22 3.72 -1.21 -3.65 117.46 112.98 1b8x n PHE 132 Ca -0.01 0.08 -0.13 0.00 -0.05 0.00 0.00 57.45 57.34 1b8x n PHE 132 Cb 0.34 -1.04 -0.08 0.00 -0.94 0.00 0.00 39.48 37.76 1b8x n PHE 132 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 1b8x h GLU 133 N 0.01 -0.25 -1.00 -1.08 4.57 -1.44 -3.01 114.58 112.38 1b8x h GLU 133 Ca -0.51 0.02 0.17 0.00 -1.18 0.00 0.00 59.36 57.86 1b8x h GLU 133 Cb 2.09 0.06 -0.10 0.00 -0.16 0.00 0.00 28.75 30.64 1b8x h GLU 133 CO 0.01 0.10 0.61 -0.44 -1.18 0.00 0.00 179.01 178.11 1b8x h ASP 134 N -0.64 0.82 0.78 1.04 5.19 -0.70 -0.37 116.42 122.54 1b8x h ASP 134 Ca -0.03 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1b8x h ASP 134 Cb 0.47 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1b8x h ASP 134 CO 0.04 0.34 0.00 -0.09 -3.12 0.00 0.00 179.24 176.41 1b8x h ARG 135 N 0.83 0.00 -0.00 3.56 9.65 -1.61 -3.06 114.38 123.75 1b8x h ARG 135 Ca 0.55 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.43 1b8x h ARG 135 Cb 0.77 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1b8x h ARG 135 CO -0.35 0.00 -0.18 1.28 2.80 0.00 0.00 179.97 183.52 1b8x n LEU 136 N -2.88 0.58 -4.58 3.80 4.77 -0.15 -4.79 117.00 113.75 1b8x n LEU 136 Ca 0.00 -0.03 -0.47 0.00 -0.03 0.00 0.00 56.01 55.48 1b8x n LEU 136 Cb 0.25 -0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 41.09 1b8x n LEU 136 CO 0.24 0.11 1.72 0.00 -1.33 0.00 0.00 177.39 178.13 1b8x n HIS 138 N 9.45 -1.73 -3.63 0.00 8.25 -1.26 -5.04 115.22 121.26 1b8x n HIS 138 Ca 0.31 0.66 -0.02 0.00 -0.26 0.00 0.00 57.72 58.41 1b8x n HIS 138 Cb 0.33 -3.95 -0.05 0.00 1.12 0.00 0.00 29.99 27.44 1b8x n HIS 138 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1b8x s LYS 139 N -4.45 0.58 0.01 -0.41 1.02 0.14 -4.93 119.74 111.70 1b8x s LYS 139 Ca 0.19 1.33 -0.25 0.00 0.02 0.00 0.00 55.97 57.26 1b8x s LYS 139 Cb -0.02 0.65 -0.16 0.00 -0.52 0.00 0.00 37.83 37.78 1b8x s LYS 139 CO 0.54 -0.18 1.17 1.15 -0.92 0.00 0.00 175.35 177.12 1b8x h THR 140 N 5.70 0.51 -2.04 2.17 2.02 -1.80 -3.46 112.91 116.02 1b8x h THR 140 Ca -0.21 -0.53 -0.61 0.00 0.77 0.00 0.00 66.41 65.83 1b8x h THR 140 Cb 1.13 0.73 -0.13 0.00 -1.74 0.00 0.00 68.15 68.14 1b8x h THR 140 CO 0.12 0.08 -0.70 -0.31 0.37 0.00 0.00 175.52 175.08 1b8x s TYR 141 N -4.59 2.40 0.34 3.16 2.02 0.19 -4.86 117.35 116.02 1b8x s TYR 141 Ca -0.14 -0.42 0.14 0.00 -0.37 0.00 0.00 57.07 56.28 1b8x s TYR 141 Cb 0.02 -1.26 1.12 0.00 -0.40 0.00 0.00 41.96 41.44 1b8x s TYR 141 CO 0.50 0.62 1.60 -0.07 -1.57 0.00 0.00 175.55 176.62 1b8x h LEU 142 N 2.07 0.14 -4.08 -1.29 3.38 -1.87 0.29 115.31 113.95 1b8x h LEU 142 Ca -0.42 0.25 -0.67 0.00 0.09 0.00 0.00 57.88 57.13 1b8x h LEU 142 Cb 1.25 0.30 -0.30 0.00 0.09 0.00 0.00 40.66 42.00 1b8x h LEU 142 CO 0.66 -0.35 0.70 -3.20 0.09 0.00 0.00 178.44 176.34 1b8x n ASN 143 N -5.28 7.38 0.00 -0.43 4.05 -1.26 -4.93 115.26 114.79 1b8x n ASN 143 Ca 0.32 -3.79 0.00 0.00 0.45 0.00 0.00 54.58 51.56 1b8x n ASN 143 Cb 1.07 -0.92 0.00 0.00 1.23 0.00 0.00 39.78 41.16 1b8x n ASN 143 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1b8x n GLY 144 N -0.86 0.63 0.07 8.20 0.00 0.10 -4.28 105.19 109.06 1b8x n GLY 144 Ca 0.60 -1.06 0.13 0.00 0.00 0.00 0.00 46.02 45.69 1b8x n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1b8x n ASP 145 N 3.45 0.61 -4.72 1.61 8.00 -1.26 -0.64 116.55 123.60 1b8x n ASP 145 Ca 0.00 0.44 -0.23 0.00 0.71 0.00 0.00 54.79 55.71 1b8x n ASP 145 Cb 0.00 -0.51 -0.06 0.00 -0.02 0.00 0.00 41.12 40.52 1b8x n ASP 145 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 1b8x s HIS 146 N -3.09 2.76 0.04 1.24 -3.43 -1.26 -4.89 115.29 106.65 1b8x s HIS 146 Ca 0.11 -0.30 -0.12 0.00 -0.80 0.00 0.00 55.06 53.95 1b8x s HIS 146 Cb 0.14 -1.48 -0.06 0.00 -1.43 0.00 0.00 32.58 29.76 1b8x s HIS 146 CO 0.61 0.44 0.39 0.08 -2.00 0.00 0.00 174.74 174.26 1b8x s VAL 147 N -2.36 5.09 0.20 -5.38 1.01 -1.26 -4.57 120.40 113.13 1b8x s VAL 147 Ca 0.35 0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.99 1b8x s VAL 147 Cb -0.04 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.63 1b8x s VAL 147 CO 0.22 0.42 -0.10 0.42 0.00 0.00 0.00 175.10 176.07 1b8x s THR 148 N -1.25 1.42 0.40 3.92 -4.23 -1.26 -5.03 115.64 109.61 1b8x s THR 148 Ca 0.28 -2.12 0.08 0.00 -1.18 0.00 0.00 61.69 58.76 1b8x s THR 148 Cb -0.15 -2.06 0.29 0.00 1.34 0.00 0.00 72.50 71.92 1b8x s THR 148 CO 0.15 -0.58 2.01 1.12 -0.54 0.00 0.00 174.62 176.79 1b8x h HIS 149 N 2.59 0.57 0.00 3.99 2.07 -1.94 -0.92 115.15 121.51 1b8x h HIS 149 Ca -0.38 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.16 1b8x h HIS 149 Cb 1.21 -0.19 0.00 0.00 2.57 0.00 0.00 27.41 31.00 1b8x h HIS 149 CO 0.67 0.32 0.00 -0.35 -3.07 0.00 0.00 177.93 175.50 1b8x n PRO 150 N -4.47 0.55 0.06 5.12 -0.04 -1.26 -2.29 135.00 132.67 1b8x n PRO 150 Ca 0.07 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.36 1b8x n PRO 150 Cb 0.19 -1.11 -0.14 0.00 -0.04 0.00 0.00 33.50 32.40 1b8x n PRO 150 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1b8x h ASP 151 N 0.00 0.39 0.88 3.54 3.32 -1.58 -1.45 116.42 121.52 1b8x h ASP 151 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 57.03 56.49 1b8x h ASP 151 Cb 0.00 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.42 1b8x h ASP 151 CO 0.00 1.47 -0.31 0.49 -1.72 0.00 0.00 179.24 179.17 1b8x n PHE 152 N -3.44 0.28 0.01 4.55 3.72 -0.97 -0.99 117.46 120.62 1b8x n PHE 152 Ca -0.18 0.08 -0.19 0.00 -0.05 0.00 0.00 57.45 57.12 1b8x n PHE 152 Cb 1.05 -0.53 -0.14 0.00 -0.94 0.00 0.00 39.48 38.92 1b8x n PHE 152 CO 0.00 0.00 0.00 0.52 -0.05 0.00 0.00 176.76 177.23 1b8x h MET 153 N 0.00 0.21 -0.35 -1.08 2.86 -1.55 -1.33 114.93 113.71 1b8x h MET 153 Ca 0.00 -0.36 -0.17 0.00 -2.06 0.00 0.00 59.70 57.11 1b8x h MET 153 Cb 0.60 0.14 -0.00 0.00 0.06 0.00 0.00 31.60 32.39 1b8x h MET 153 CO 0.00 1.17 -0.45 1.25 1.06 0.00 0.00 176.91 179.95 1b8x h LEU 154 N -0.54 0.99 -0.11 1.22 6.46 -1.21 0.14 115.31 122.26 1b8x h LEU 154 Ca -0.12 -0.48 -0.00 0.00 -0.12 0.00 0.00 57.88 57.15 1b8x h LEU 154 Cb 1.48 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 41.13 1b8x h LEU 154 CO 0.10 1.28 0.06 0.22 -0.62 0.00 0.00 178.44 179.48 1b8x h TYR 155 N 0.73 0.14 -0.11 1.25 3.20 -1.16 0.73 116.97 121.75 1b8x h TYR 155 Ca 0.04 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.91 1b8x h TYR 155 Cb 1.05 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 39.27 1b8x h TYR 155 CO 0.07 0.13 0.06 0.22 -1.64 0.00 0.00 178.16 176.99 1b8x h ASP 156 N 0.11 0.14 -0.65 -2.11 3.58 -1.16 0.24 116.42 116.57 1b8x h ASP 156 Ca 0.04 -0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.41 1b8x h ASP 156 Cb 0.03 -0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.00 1b8x h ASP 156 CO -0.01 0.22 0.39 0.00 -2.88 0.00 0.00 179.24 176.96 1b8x h ALA 157 N 0.93 0.86 -0.65 -0.78 0.00 -0.41 -0.76 119.26 118.45 1b8x h ALA 157 Ca 0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 1b8x h ALA 157 Cb 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1b8x h ALA 157 CO -0.01 0.13 0.08 -0.07 0.00 0.00 0.00 179.25 179.38 1b8x h LEU 158 N 0.76 1.05 0.66 0.00 3.38 0.75 -1.66 115.31 120.26 1b8x h LEU 158 Ca 0.27 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 1b8x h LEU 158 Cb 0.07 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1b8x h LEU 158 CO -0.13 1.06 -0.49 -0.78 0.09 0.00 0.00 178.44 178.19 1b8x h ASP 159 N 1.01 -1.30 -0.17 -0.43 1.82 0.23 -2.12 116.42 115.47 1b8x h ASP 159 Ca 0.19 0.09 0.05 0.00 -0.39 0.00 0.00 57.03 56.97 1b8x h ASP 159 Cb 0.47 0.40 -0.05 0.00 0.68 0.00 0.00 39.33 40.82 1b8x h ASP 159 CO 0.02 -0.71 -0.18 0.58 -1.61 0.00 0.00 179.24 177.33 1b8x h VAL 160 N -1.12 0.53 -0.99 2.25 2.07 -1.11 -2.04 116.25 115.84 1b8x h VAL 160 Ca -0.09 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.62 1b8x h VAL 160 Cb 0.92 0.53 -0.11 0.00 -1.52 0.00 0.00 31.29 31.11 1b8x h VAL 160 CO 0.03 0.00 0.59 0.58 0.02 0.00 0.00 177.57 178.79 1b8x h VAL 161 N -0.21 0.70 0.00 2.57 2.07 -1.23 0.35 116.25 120.49 1b8x h VAL 161 Ca 0.11 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1b8x h VAL 161 Cb 0.37 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.03 1b8x h VAL 161 CO -0.29 0.14 0.00 0.18 0.02 0.00 0.00 177.57 177.62 1b8x n LEU 162 N -4.78 0.00 -0.08 2.57 4.32 -0.77 -1.09 117.00 117.17 1b8x n LEU 162 Ca 0.23 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 56.16 1b8x n LEU 162 Cb 0.57 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.22 1b8x n LEU 162 CO 0.21 0.00 -1.03 -1.22 -1.22 0.00 0.00 177.39 174.13 1b8x n TYR 163 N -0.85 0.00 0.10 -1.77 4.01 0.12 -3.71 117.16 115.06 1b8x n TYR 163 Ca 0.04 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.67 1b8x n TYR 163 Cb 0.02 -0.81 -0.07 0.00 -0.31 0.00 0.00 39.34 38.17 1b8x n TYR 163 CO 0.00 0.00 0.00 1.98 -0.46 0.00 0.00 176.86 178.38 1b8x h MET 164 N 0.00 -0.31 -3.08 -0.72 4.05 -1.13 -3.43 114.93 110.31 1b8x h MET 164 Ca -0.41 0.02 -0.48 0.00 -0.28 0.00 0.00 59.70 58.55 1b8x h MET 164 Cb 1.90 0.07 -0.41 0.00 -0.80 0.00 0.00 31.60 32.37 1b8x h MET 164 CO 0.02 0.05 -0.76 0.34 0.23 0.00 0.00 176.91 176.79 1b8x s ASP 165 N -5.28 2.65 0.00 1.39 -1.08 -1.09 -4.79 116.67 108.47 1b8x s ASP 165 Ca -0.12 -0.77 0.00 0.00 -0.52 0.00 0.00 52.55 51.13 1b8x s ASP 165 Cb 0.01 -0.32 0.00 0.00 -1.46 0.00 0.00 42.92 41.15 1b8x s ASP 165 CO 0.46 -0.36 0.47 -2.65 0.52 0.00 0.00 175.17 173.61 1b8x n PRO 166 N 5.24 0.70 0.00 4.34 -0.02 -1.24 -2.05 135.00 141.96 1b8x n PRO 166 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1b8x n PRO 166 Cb 0.47 -1.28 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 1b8x n PRO 166 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1b8x n MET 167 N 0.33 4.01 0.00 -0.52 2.81 -1.26 -4.81 117.12 117.68 1b8x n MET 167 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 1b8x n MET 167 Cb 0.24 -0.49 0.00 0.00 -0.71 0.00 0.00 33.22 32.25 1b8x n MET 167 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1b8x n LEU 169 N 0.47 0.00 -0.11 0.00 7.94 -1.26 -4.87 117.00 119.17 1b8x n LEU 169 Ca 0.00 -0.05 -0.07 0.00 -1.11 0.00 0.00 56.01 54.78 1b8x n LEU 169 Cb 0.20 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.15 1b8x n LEU 169 CO 0.00 0.00 0.68 0.44 -1.11 0.00 0.00 177.39 177.40 1b8x h ASP 170 N 0.00 -0.87 0.00 1.96 5.19 -1.85 0.88 116.42 121.73 1b8x h ASP 170 Ca 0.00 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1b8x h ASP 170 Cb 0.00 0.43 0.00 0.00 0.18 0.00 0.00 39.33 39.94 1b8x h ASP 170 CO 0.00 -0.28 0.00 0.00 -3.12 0.00 0.00 179.24 175.84 1b8x n ALA 171 N -2.93 1.87 -3.03 3.45 0.00 -1.26 -3.54 120.51 115.07 1b8x n ALA 171 Ca 0.01 -0.05 -0.25 0.00 0.00 0.00 0.00 53.44 53.16 1b8x n ALA 171 Cb 0.31 -1.13 -0.04 0.00 0.00 0.00 0.00 19.45 18.59 1b8x n ALA 171 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1b8x n PHE 172 N -0.90 3.06 -2.58 0.00 3.72 0.30 -5.01 117.46 116.06 1b8x n PHE 172 Ca 0.06 -3.96 -0.42 0.00 -0.05 0.00 0.00 57.45 53.08 1b8x n PHE 172 Cb 0.03 -0.47 -0.02 0.00 -0.94 0.00 0.00 39.48 38.08 1b8x n PHE 172 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1b8x s PRO 173 N -3.14 3.77 0.00 -1.08 0.04 -1.23 -1.90 135.00 131.45 1b8x s PRO 173 Ca 0.46 -1.52 0.00 0.00 0.04 0.00 0.00 61.00 59.98 1b8x s PRO 173 Cb 0.29 -5.43 0.00 0.00 0.04 0.00 0.00 34.50 29.40 1b8x s PRO 173 CO -0.12 -2.22 0.00 1.17 0.04 0.00 0.00 177.00 175.87 1b8x n LYS 174 N 8.63 0.00 -0.10 4.56 4.81 -1.26 -4.86 118.16 129.94 1b8x n LYS 174 Ca 0.40 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.73 1b8x n LYS 174 Cb 0.49 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.39 1b8x n LYS 174 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1b8x n LEU 175 N 0.00 0.36 0.08 3.14 4.77 -0.80 -3.00 117.00 121.55 1b8x n LEU 175 Ca 0.00 -0.02 -0.05 0.00 -0.03 0.00 0.00 56.01 55.91 1b8x n LEU 175 Cb 0.00 0.32 -0.03 0.00 -2.33 0.00 0.00 43.42 41.38 1b8x n LEU 175 CO 0.00 0.54 0.25 0.58 -1.33 0.00 0.00 177.39 177.44 1b8x h VAL 176 N 0.00 1.63 -0.11 4.08 2.07 -1.81 -1.75 116.25 120.36 1b8x h VAL 176 Ca -0.54 -3.02 -0.10 0.00 0.82 0.00 0.00 66.70 63.86 1b8x h VAL 176 Cb 2.18 2.63 0.00 0.00 -1.52 0.00 0.00 31.29 34.58 1b8x h VAL 176 CO 0.02 0.86 -0.32 0.00 0.02 0.00 0.00 177.57 178.15 1b8x h PHE 178 N -0.01 -0.49 0.36 0.00 3.04 -1.45 0.14 116.94 118.52 1b8x h PHE 178 Ca -0.01 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.96 1b8x h PHE 178 Cb 0.94 0.25 -0.01 0.00 2.56 0.00 0.00 35.95 39.69 1b8x h PHE 178 CO 0.11 -0.27 -0.25 -0.22 -2.02 0.00 0.00 178.31 175.66 1b8x h LYS 179 N -0.21 -0.58 0.00 1.11 3.64 -1.34 -1.22 116.57 117.97 1b8x h LYS 179 Ca 0.12 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1b8x h LYS 179 Cb 0.39 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1b8x h LYS 179 CO -0.32 -0.39 0.16 -0.22 -2.27 0.00 0.00 179.45 176.41 1b8x h LYS 180 N -0.60 0.00 0.04 1.90 3.64 -0.92 -0.83 116.57 119.80 1b8x h LYS 180 Ca -0.03 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.07 1b8x h LYS 180 Cb 0.52 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1b8x h LYS 180 CO 0.01 0.00 -1.52 0.07 -2.27 0.00 0.00 179.45 175.74 1b8x h ARG 181 N 0.00 0.09 -0.14 1.90 0.11 0.41 -2.63 114.38 114.12 1b8x h ARG 181 Ca 0.00 -0.15 -0.16 0.00 0.10 0.00 0.00 59.98 59.77 1b8x h ARG 181 Cb 0.31 0.06 0.01 0.00 1.11 0.00 0.00 29.97 31.46 1b8x h ARG 181 CO 0.00 0.84 -0.52 0.82 0.10 0.00 0.00 179.97 181.20 1b8x h ILE 182 N 0.02 1.34 0.00 0.08 1.08 -0.39 -2.80 117.51 116.84 1b8x h ILE 182 Ca -0.22 -1.79 -0.03 0.00 -0.39 0.00 0.00 64.86 62.43 1b8x h ILE 182 Cb 1.96 2.05 -0.00 0.00 -3.07 0.00 0.00 36.82 37.76 1b8x h ILE 182 CO 0.11 0.55 -0.13 -0.33 -0.69 0.00 0.00 178.15 177.66 1b8x h GLU 183 N 0.26 0.00 -0.92 2.37 5.08 -1.46 -1.26 114.58 118.65 1b8x h GLU 183 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1b8x h GLU 183 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1b8x h GLU 183 CO 0.11 0.13 0.00 0.00 -1.00 0.00 0.00 179.01 178.25 1b8x n ALA 184 N -2.43 2.69 -2.95 3.43 0.00 -0.99 -4.02 120.51 116.25 1b8x n ALA 184 Ca -0.02 -0.27 -0.37 0.00 0.00 0.00 0.00 53.44 52.78 1b8x n ALA 184 Cb 0.21 -1.02 -0.12 0.00 0.00 0.00 0.00 19.45 18.52 1b8x n ALA 184 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1b8x s ILE 185 N -1.27 4.54 0.08 0.00 1.01 -0.48 -4.95 121.20 120.13 1b8x s ILE 185 Ca 0.08 -0.14 -0.15 0.00 0.00 0.00 0.00 60.65 60.44 1b8x s ILE 185 Cb 0.06 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 1b8x s ILE 185 CO 0.02 0.29 0.98 -2.65 0.00 0.00 0.00 174.94 173.58 1b8x n PRO 186 N 4.96 -0.21 0.27 2.79 -0.02 -1.26 0.35 135.00 141.88 1b8x n PRO 186 Ca -0.15 0.97 0.18 0.00 -2.02 0.00 0.00 63.50 62.47 1b8x n PRO 186 Cb 0.51 -1.43 0.94 0.00 -0.02 0.00 0.00 33.50 33.50 1b8x n PRO 186 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1b8x h GLN 187 N 0.00 0.00 0.00 -0.52 4.20 -1.93 0.66 115.11 117.52 1b8x h GLN 187 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1b8x h GLN 187 Cb 0.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1b8x h GLN 187 CO -0.45 0.00 -1.53 -0.89 -0.67 0.00 0.00 178.83 175.29 1b8x n ILE 188 N -3.54 0.03 0.10 2.54 2.08 0.32 -4.00 119.36 116.89 1b8x n ILE 188 Ca -0.01 -0.30 0.03 0.00 0.56 0.00 0.00 62.75 63.03 1b8x n ILE 188 Cb 0.22 0.37 -0.01 0.00 -0.75 0.00 0.00 39.64 39.47 1b8x n ILE 188 CO 0.00 0.00 0.00 -0.78 0.56 0.00 0.00 176.55 176.33 1b8x h ASP 189 N 0.00 0.00 -0.45 4.38 1.82 1.12 -3.19 116.42 120.10 1b8x h ASP 189 Ca 0.00 0.00 -0.13 0.00 -0.39 0.00 0.00 57.03 56.51 1b8x h ASP 189 Cb 0.79 0.00 -0.08 0.00 0.68 0.00 0.00 39.33 40.72 1b8x h ASP 189 CO 0.00 0.45 0.08 1.17 -1.61 0.00 0.00 179.24 179.33 1b8x n LYS 190 N -3.05 2.84 0.00 0.28 3.00 0.16 -4.12 118.16 117.28 1b8x n LYS 190 Ca -0.02 -3.02 0.00 0.00 -0.00 0.00 0.00 58.31 55.27 1b8x n LYS 190 Cb 0.74 -1.96 0.00 0.00 0.00 0.00 0.00 35.03 33.81 1b8x n LYS 190 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.40 178.38 1b8x n TYR 191 N -0.60 0.00 0.98 5.64 9.36 -1.24 -4.21 117.16 127.08 1b8x n TYR 191 Ca 0.32 0.00 0.10 0.00 3.32 0.00 0.00 57.90 61.64 1b8x n TYR 191 Cb 1.11 0.00 0.53 0.00 -0.63 0.00 0.00 39.34 40.35 1b8x n TYR 191 CO 0.00 0.00 0.00 1.28 0.22 0.00 0.00 176.86 178.36 1b8x n LEU 192 N -2.36 0.00 -0.32 2.98 4.32 -1.20 -2.07 117.00 118.34 1b8x n LEU 192 Ca 0.00 0.30 0.03 0.00 -0.02 0.00 0.00 56.01 56.33 1b8x n LEU 192 Cb 0.43 -0.30 0.06 0.00 -1.62 0.00 0.00 43.42 41.98 1b8x n LEU 192 CO 0.00 -0.09 0.45 0.29 -1.22 0.00 0.00 177.39 176.82 1b8x n LYS 193 N -1.30 1.14 -3.62 3.23 5.02 -1.26 -4.95 118.16 116.42 1b8x n LYS 193 Ca 0.10 -1.28 -0.25 0.00 -2.02 0.00 0.00 58.31 54.86 1b8x n LYS 193 Cb 0.18 -1.15 0.02 0.00 -0.02 0.00 0.00 35.03 34.06 1b8x n LYS 193 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1b8x n SER 194 N 0.29 2.60 0.07 4.39 3.41 -0.88 -5.03 113.62 118.48 1b8x n SER 194 Ca 0.05 -2.82 -0.09 0.00 -0.26 0.00 0.00 58.87 55.75 1b8x n SER 194 Cb 0.25 -0.16 0.02 0.00 -0.26 0.00 0.00 64.21 64.06 1b8x n SER 194 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1b8x h SER 195 N 0.50 0.38 -0.82 4.04 4.64 -1.94 -3.21 113.55 117.14 1b8x h SER 195 Ca -0.33 -0.27 0.20 0.00 -0.47 0.00 0.00 61.79 60.92 1b8x h SER 195 Cb 1.29 -0.11 -0.13 0.00 -0.31 0.00 0.00 62.40 63.13 1b8x h SER 195 CO 0.51 1.02 0.17 0.11 -0.87 0.00 0.00 176.83 177.77 1b8x h LYS 196 N 0.20 0.19 -6.19 4.77 1.57 -1.96 -3.41 116.57 111.74 1b8x h LYS 196 Ca -0.04 -0.01 -0.70 0.00 -1.87 0.00 0.00 60.65 58.03 1b8x h LYS 196 Cb 1.37 -0.04 0.06 0.00 0.08 0.00 0.00 32.23 33.70 1b8x h LYS 196 CO 0.13 0.13 0.26 0.98 -0.57 0.00 0.00 179.45 180.38 1b8x n TYR 197 N -5.24 1.14 -3.74 -1.35 9.36 -1.21 -4.92 117.16 111.18 1b8x n TYR 197 Ca 0.18 0.78 -0.34 0.00 3.32 0.00 0.00 57.90 61.84 1b8x n TYR 197 Cb 0.58 -2.24 -0.09 0.00 -0.63 0.00 0.00 39.34 36.97 1b8x n TYR 197 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1b8x s ILE 198 N 0.15 3.71 -2.00 2.97 1.01 -1.26 -4.96 121.20 120.83 1b8x s ILE 198 Ca 0.83 -3.67 0.12 0.00 0.00 0.00 0.00 60.65 57.93 1b8x s ILE 198 Cb -1.02 -3.37 0.35 0.00 0.01 0.00 0.00 42.46 38.42 1b8x s ILE 198 CO 0.51 -0.99 1.25 0.00 0.00 0.00 0.00 174.94 175.72 1b8x n ALA 199 N 2.62 2.27 -3.65 9.38 0.00 -1.26 -4.37 120.51 125.50 1b8x n ALA 199 Ca 0.16 -0.08 -0.02 0.00 0.00 0.00 0.00 53.44 53.51 1b8x n ALA 199 Cb 0.36 -1.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.57 1b8x n ALA 199 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1b8x s TRP 200 N -2.00 -0.02 0.78 0.00 -0.11 -1.26 -4.80 118.94 111.52 1b8x s TRP 200 Ca 0.18 0.04 -0.10 0.00 1.22 0.00 0.00 56.10 57.45 1b8x s TRP 200 Cb 0.08 0.50 0.09 0.00 -1.50 0.00 0.00 33.47 32.64 1b8x s TRP 200 CO 0.14 -0.02 1.12 -1.25 -4.62 0.00 0.00 176.95 172.32 1b8x s PRO 201 N -0.81 1.88 0.04 5.86 0.04 -1.26 -4.60 135.00 136.14 1b8x s PRO 201 Ca 0.09 -0.18 -0.22 0.00 0.04 0.00 0.00 61.00 60.73 1b8x s PRO 201 Cb -0.02 -2.05 -0.15 0.00 0.04 0.00 0.00 34.50 32.32 1b8x s PRO 201 CO -0.10 -1.54 1.42 -0.07 0.04 0.00 0.00 177.00 176.75 1b8x h LEU 202 N -0.90 0.21 0.00 -3.56 4.07 -0.28 -0.97 115.31 113.87 1b8x h LEU 202 Ca -0.45 -0.37 0.00 0.00 0.08 0.00 0.00 57.88 57.14 1b8x h LEU 202 Cb 1.31 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.99 1b8x h LEU 202 CO 0.59 0.53 0.00 0.00 -1.08 0.00 0.00 178.44 178.48 1b8x n GLN 203 N -4.76 0.00 -3.99 1.13 3.00 -0.90 -2.31 117.38 109.54 1b8x n GLN 203 Ca -0.06 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.82 1b8x n GLN 203 Cb 0.24 0.00 -0.12 0.00 0.00 0.00 0.00 30.24 30.37 1b8x n GLN 203 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1b8x s GLY 204 N -0.38 0.28 0.11 1.08 0.00 -1.26 -4.09 107.32 103.06 1b8x s GLY 204 Ca 0.00 -0.55 0.04 0.00 0.00 0.00 0.00 44.72 44.21 1b8x s GLY 204 CO 0.00 -0.60 0.93 0.79 0.00 0.00 0.00 173.10 174.22 1b8x n TRP 205 N 1.80 0.14 -1.19 1.90 8.01 -1.26 0.11 117.44 126.95 1b8x n TRP 205 Ca -0.22 0.07 -0.03 0.00 -1.31 0.00 0.00 57.50 56.01 1b8x n TRP 205 Cb 0.56 -0.38 0.25 0.00 -2.01 0.00 0.00 31.31 29.73 1b8x n TRP 205 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 1b8x n GLN 206 N -1.52 2.72 -3.78 -0.99 6.02 -1.26 -3.36 117.38 115.21 1b8x n GLN 206 Ca -0.00 -3.04 -0.36 0.00 -0.01 0.00 0.00 57.00 53.58 1b8x n GLN 206 Cb 0.28 -1.97 -0.13 0.00 1.02 0.00 0.00 30.24 29.45 1b8x n GLN 206 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1b8x s ALA 207 N -3.06 3.15 0.57 -1.58 0.00 0.29 -4.88 121.76 116.25 1b8x s ALA 207 Ca 0.48 -1.12 0.36 0.00 0.00 0.00 0.00 51.96 51.68 1b8x s ALA 207 Cb 0.40 -2.06 1.45 0.00 0.00 0.00 0.00 23.12 22.92 1b8x s ALA 207 CO 0.07 -0.46 1.69 1.15 0.00 0.00 0.00 175.76 178.21 1b8x h THR 208 N 5.53 0.25 -4.03 0.00 2.02 -1.48 -2.30 112.91 112.90 1b8x h THR 208 Ca -0.38 0.00 -0.60 0.00 0.77 0.00 0.00 66.41 66.20 1b8x h THR 208 Cb 1.17 0.30 -0.23 0.00 -1.74 0.00 0.00 68.15 67.65 1b8x h THR 208 CO 0.58 0.00 -0.84 0.12 0.37 0.00 0.00 175.52 175.75 1b8x s PHE 209 N -4.77 1.92 -1.50 3.16 5.36 -0.91 -4.64 117.98 116.59 1b8x s PHE 209 Ca -0.04 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 55.53 1b8x s PHE 209 Cb 0.20 -1.09 0.00 0.00 -0.34 0.00 0.00 43.02 41.80 1b8x s PHE 209 CO 0.71 0.19 0.00 0.41 -1.46 0.00 0.00 175.22 175.06 1b8x n GLY 210 N 1.35 1.35 3.74 13.12 0.00 -1.26 -4.48 105.19 119.00 1b8x n GLY 210 Ca -0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.60 1b8x n GLY 210 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b8x s GLY 211 N -2.31 1.56 0.00 -0.02 0.00 -0.86 0.48 107.32 106.17 1b8x s GLY 211 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.25 1b8x s GLY 211 CO 0.00 -1.52 0.00 0.61 0.00 0.00 0.00 173.10 172.19 1b8x n GLY 212 N -0.86 2.06 0.18 0.20 0.00 -1.21 -4.78 105.19 100.77 1b8x n GLY 212 Ca -0.08 -2.17 0.12 0.00 0.00 0.00 0.00 46.02 43.90 1b8x n GLY 212 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1b8x n ASP 213 N 0.00 1.02 -3.95 1.61 9.92 -1.26 -4.33 116.55 119.56 1b8x n ASP 213 Ca 0.00 -0.81 -0.12 0.00 -0.53 0.00 0.00 54.79 53.33 1b8x n ASP 213 Cb 0.00 0.32 -0.13 0.00 -0.64 0.00 0.00 41.12 40.68 1b8x n ASP 213 CO 0.00 0.00 0.00 -1.38 0.13 0.00 0.00 177.20 175.95 1b8x s HIS 214 N -2.70 0.27 -0.40 1.24 -3.43 -1.26 -4.97 115.29 104.03 1b8x s HIS 214 Ca 0.18 -0.27 0.01 0.00 -0.80 0.00 0.00 55.06 54.17 1b8x s HIS 214 Cb 0.18 -0.18 0.43 0.00 -1.43 0.00 0.00 32.58 31.59 1b8x s HIS 214 CO 0.62 -0.08 1.83 -0.35 -2.00 0.00 0.00 174.74 174.76 1b8x n PRO 215 N 2.30 2.07 -0.43 -0.38 -0.04 -1.26 -4.96 135.00 132.30 1b8x n PRO 215 Ca -0.18 -2.33 -0.29 0.00 -0.04 0.00 0.00 63.50 60.66 1b8x n PRO 215 Cb 0.57 -1.91 0.26 0.00 -0.04 0.00 0.00 33.50 32.38 1b8x n PRO 215 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 1b8x n PRO 216 N -0.56 -3.04 0.08 0.54 -0.04 -1.26 -4.93 135.00 125.79 1b8x n PRO 216 Ca 0.46 -0.87 -0.16 0.00 -0.04 0.00 0.00 63.50 62.88 1b8x n PRO 216 Cb 1.07 -2.04 -0.14 0.00 -0.04 0.00 0.00 33.50 32.36 1b8x n PRO 216 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1b8x h LYS 217 N -2.89 0.26 0.00 0.54 1.63 -2.02 -3.45 116.57 110.63 1b8x h LYS 217 Ca -0.57 -0.44 0.00 0.00 -0.85 0.00 0.00 60.65 58.79 1b8x h LYS 217 Cb 1.33 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 33.12 1b8x h LYS 217 CO 0.43 1.15 0.00 -1.13 -3.45 0.00 0.00 179.45 176.44 1b8x n SER 218 N -3.48 0.00 0.00 4.20 3.41 -1.26 -3.86 113.62 112.63 1b8x n SER 218 Ca -0.14 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.47 1b8x n SER 218 Cb 1.04 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 1b8x n SER 218 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1b8x n ASP 219 N 0.08 0.00 -0.84 4.04 9.92 -1.26 -5.01 116.55 123.47 1b8x n ASP 219 Ca 0.00 0.00 0.08 0.00 -0.53 0.00 0.00 54.79 54.34 1b8x n ASP 219 Cb 0.00 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1b8x n ASP 219 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1b8x n LEU 220 N 0.00 0.00 -3.65 0.64 7.94 -1.25 -4.97 117.00 115.71 1b8x n LEU 220 Ca 0.00 0.60 -0.01 0.00 -1.11 0.00 0.00 56.01 55.50 1b8x n LEU 220 Cb 0.00 -1.79 -0.06 0.00 0.53 0.00 0.00 43.42 42.10 1b8x n LEU 220 CO 0.00 -1.53 0.85 0.68 -1.11 0.00 0.00 177.39 176.28 1b8x s VAL 221 N -1.05 0.00 0.00 1.96 -7.23 -1.26 -5.18 120.40 107.65 1b8x s VAL 221 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 1b8x s VAL 221 Cb 0.00 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.94 1b8x s VAL 221 CO 0.00 0.00 0.00 -0.81 -0.31 0.00 0.00 175.10 173.98 1b8x n PRO 222 N 3.26 1.16 0.13 4.82 -0.04 -1.26 -5.07 135.00 138.00 1b8x n PRO 222 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1b8x n PRO 222 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.03 1b8x n PRO 222 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1b8x n ARG 223 N -0.68 0.00 0.00 0.54 3.00 -1.26 -4.93 116.66 113.33 1b8x n ARG 223 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1b8x n ARG 223 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1b8x n ARG 223 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1b8x n GLY 224 N -1.39 0.00 0.88 5.14 0.00 -1.26 -1.77 105.19 106.79 1b8x n GLY 224 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1b8x n GLY 224 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1b8x n SER 225 N -0.64 2.52 -1.31 1.61 7.64 -1.26 -3.79 113.62 118.37 1b8x n SER 225 Ca 0.00 -2.15 0.10 0.00 1.01 0.00 0.00 58.87 57.83 1b8x n SER 225 Cb 0.00 -0.36 0.31 0.00 -1.01 0.00 0.00 64.21 63.15 1b8x n SER 225 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1b8x n ARG 226 N 0.55 3.07 -0.46 1.43 1.74 -0.73 -4.97 116.66 117.30 1b8x n ARG 226 Ca 0.14 -2.66 0.00 0.00 -0.77 0.00 0.00 57.85 54.56 1b8x n ARG 226 Cb 0.46 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1b8x n ARG 226 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1b8x n ARG 227 N 1.27 1.18 0.00 5.56 0.00 -1.25 -5.16 116.66 118.26 1b8x n ARG 227 Ca 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.08 1b8x n ARG 227 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.15 1b8x n ARG 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1b8x n ALA 228 N -3.00 0.00 -2.54 2.89 0.00 -1.26 -5.04 120.51 111.56 1b8x n ALA 228 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1b8x n ALA 228 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1b8x n ALA 228 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1b8x s SER 229 N -2.09 2.10 0.00 0.00 0.01 -1.26 -4.97 113.70 107.49 1b8x s SER 229 Ca 0.00 -0.76 0.08 0.00 1.31 0.00 0.00 55.95 56.58 1b8x s SER 229 Cb 0.00 -0.09 0.13 0.00 0.21 0.00 0.00 66.02 66.27 1b8x s SER 229 CO 0.00 -0.09 0.95 0.55 0.41 0.00 0.00 173.24 175.06 1b8x n VAL 230 N 0.74 0.00 -2.47 3.43 3.14 -1.26 -5.13 118.33 116.78 1b8x n VAL 230 Ca -0.17 -0.30 -0.25 0.00 -2.96 0.00 0.00 64.34 60.66 1b8x n VAL 230 Cb 0.56 0.55 0.12 0.00 -1.06 0.00 0.00 33.84 34.01 1b8x n VAL 230 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1b8x s GLY 231 N -1.10 1.76 -0.30 7.55 0.00 -1.22 -4.07 107.32 109.95 1b8x s GLY 231 Ca 0.10 -1.65 -0.24 0.00 0.00 0.00 0.00 44.72 42.94 1b8x s GLY 231 CO -0.05 -1.04 1.42 -0.56 0.00 0.00 0.00 173.10 172.87 1b8x s SER 232 N -4.77 -0.06 -0.57 1.64 0.01 -0.24 -4.58 113.70 105.13 1b8x s SER 232 Ca 0.68 0.12 0.05 0.00 1.31 0.00 0.00 55.95 58.10 1b8x s SER 232 Cb -0.05 0.21 0.35 0.00 0.21 0.00 0.00 66.02 66.75 1b8x s SER 232 CO 0.46 -0.02 0.98 -1.14 0.41 0.00 0.00 173.24 173.93 1b8x n ARG 233 N 1.76 3.29 -3.70 12.44 0.63 -1.26 -3.68 116.66 126.14 1b8x n ARG 233 Ca -0.11 -4.82 -0.30 0.00 -0.92 0.00 0.00 57.85 51.71 1b8x n ARG 233 Cb 0.57 -2.24 -0.13 0.00 0.45 0.00 0.00 32.46 31.10 1b8x n ARG 233 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 1b8x s MET 234 N -3.50 1.17 -0.85 -0.14 -1.94 -1.26 -4.85 119.30 107.94 1b8x s MET 234 Ca 0.49 -1.85 -0.05 0.00 -1.71 0.00 0.00 55.69 52.57 1b8x s MET 234 Cb 0.30 -2.23 0.01 0.00 2.01 0.00 0.00 34.83 34.91 1b8x s MET 234 CO -0.15 -1.14 0.60 0.72 -0.01 0.00 0.00 175.02 175.04 1b8x n HIS 235 N 3.73 -1.56 -3.22 -0.03 8.25 -1.26 -4.99 115.22 116.15 1b8x n HIS 235 Ca 0.08 0.52 -0.33 0.00 -0.26 0.00 0.00 57.72 57.72 1b8x n HIS 235 Cb 0.35 -3.31 -0.04 0.00 1.12 0.00 0.00 29.99 28.11 1b8x n HIS 235 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1b8x n TYR 236 N -4.00 3.16 -1.45 4.41 4.01 -1.26 -5.01 117.16 117.02 1b8x n TYR 236 Ca -0.02 -3.54 -0.12 0.00 -0.16 0.00 0.00 57.90 54.06 1b8x n TYR 236 Cb 0.55 -0.82 -0.10 0.00 -0.31 0.00 0.00 39.34 38.66 1b8x n TYR 236 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1b8x n PRO 237 N 0.90 0.19 0.00 -0.72 -0.02 -1.26 -4.80 135.00 129.29 1b8x n PRO 237 Ca 0.29 -0.88 0.00 0.00 -2.02 0.00 0.00 63.50 60.89 1b8x n PRO 237 Cb 0.38 -2.87 0.00 0.00 -0.02 0.00 0.00 33.50 30.99 1b8x n PRO 237 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b8x n GLY 238 N 5.91 0.86 0.00 -1.23 0.00 -1.26 -5.06 105.19 104.40 1b8x n GLY 238 Ca 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.34 1b8x n GLY 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b8x n ALA 239 N -3.00 0.00 -1.00 4.61 0.00 -1.26 -5.08 120.51 114.78 1b8x n ALA 239 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1b8x n ALA 239 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1b8x n ALA 239 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1b8x n PHE 240 N 0.00 0.00 -2.34 0.00 -0.00 -1.26 -5.04 117.46 108.82 1b8x n PHE 240 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.45 57.43 1b8x n PHE 240 Cb 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 39.48 39.51 1b8x n PHE 240 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39 1b8x n THR 241 N 0.00 0.00 -2.50 1.97 5.66 -1.26 -5.03 114.28 113.12 1b8x n THR 241 Ca 0.00 -0.32 -0.40 0.00 -3.05 0.00 0.00 64.05 60.28 1b8x n THR 241 Cb 0.00 0.58 0.02 0.00 -1.55 0.00 0.00 70.33 69.38 1b8x n THR 241 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1b8x n TYR 242 N -0.50 2.92 -0.49 1.09 4.01 -1.26 -5.03 117.16 117.90 1b8x n TYR 242 Ca -0.09 -2.62 -0.19 0.00 -0.16 0.00 0.00 57.90 54.84 1b8x n TYR 242 Cb 0.61 -1.13 -0.03 0.00 -0.31 0.00 0.00 39.34 38.48 1b8x n TYR 242 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1b8x n SER 243 N -0.19 0.33 -0.88 7.72 3.41 -1.26 -4.93 113.62 117.83 1b8x n SER 243 Ca 0.47 0.33 0.00 0.00 -0.26 0.00 0.00 58.87 59.41 1b8x n SER 243 Cb 0.27 -0.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 1b8x n SER 243 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1b8x n PRO 244 N 1.31 3.17 -3.81 4.33 -0.02 -1.24 -3.70 135.00 135.03 1b8x n PRO 244 Ca 0.10 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.60 1b8x n PRO 244 Cb -0.02 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.48 1b8x n PRO 244 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1b8x n THR 245 N 0.00 0.00 -3.45 3.45 -2.24 -1.26 -1.08 114.28 109.71 1b8x n THR 245 Ca 0.00 -0.20 -0.25 0.00 -2.27 0.00 0.00 64.05 61.33 1b8x n THR 245 Cb 0.00 0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 1b8x n THR 245 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1b8x s PRO 246 N -2.02 3.52 0.41 -0.78 0.04 -1.26 -5.00 135.00 129.91 1b8x s PRO 246 Ca 0.27 -0.29 0.09 0.00 0.04 0.00 0.00 61.00 61.12 1b8x s PRO 246 Cb -0.01 -2.70 0.86 0.00 0.04 0.00 0.00 34.50 32.69 1b8x s PRO 246 CO 0.00 0.22 1.98 -0.24 0.04 0.00 0.00 177.00 179.00 1b8x h VAL 247 N 1.03 1.13 0.00 -0.36 3.04 -2.02 -3.45 116.25 115.62 1b8x h VAL 247 Ca -0.49 -0.51 0.00 0.00 -1.01 0.00 0.00 66.70 64.69 1b8x h VAL 247 Cb 1.21 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 31.46 1b8x h VAL 247 CO 0.63 0.17 0.00 0.35 -1.01 0.00 0.00 177.57 177.72 1b8x n THR 248 N -4.37 0.00 0.00 3.17 -2.24 -1.26 -5.03 114.28 104.55 1b8x n THR 248 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1b8x n THR 248 Cb 0.19 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 1b8x n THR 248 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1b8x n SER 249 N -1.75 0.00 0.00 3.42 7.64 -1.26 -5.05 113.62 116.62 1b8x n SER 249 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1b8x n SER 249 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1b8x n SER 249 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1b8x n GLY 250 N 0.00 0.90 2.71 0.23 0.00 -1.26 -5.04 105.19 102.73 1b8x n GLY 250 Ca 0.00 -1.29 -0.17 0.00 0.00 0.00 0.00 46.02 44.57 1b8x n GLY 250 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1b8x n ILE 251 N 0.00 0.00 0.00 -0.61 5.41 -1.26 -5.00 119.36 117.90 1b8x n ILE 251 Ca 0.00 -1.05 0.00 0.00 1.00 0.00 0.00 62.75 62.70 1b8x n ILE 251 Cb 0.00 -1.12 0.00 0.00 -0.71 0.00 0.00 39.64 37.81 1b8x n ILE 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b8x n GLY 252 N -0.45 -2.13 3.29 7.39 0.00 -1.26 -4.82 105.19 107.21 1b8x n GLY 252 Ca 0.12 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.59 1b8x n GLY 252 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1b8x n ILE 253 N -0.63 0.00 0.00 -0.61 2.08 -1.26 -4.98 119.36 113.95 1b8x n ILE 253 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1b8x n ILE 253 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1b8x n ILE 253 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1b8x n GLY 254 N -0.57 0.09 7.00 7.39 0.00 -1.26 -4.85 105.19 113.00 1b8x n GLY 254 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1b8x n GLY 254 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1b8x n MET 255 N 0.00 0.00 -1.45 1.61 2.81 -1.26 -5.00 117.12 113.82 1b8x n MET 255 Ca 0.00 0.00 0.19 0.00 -1.81 0.00 0.00 57.70 56.08 1b8x n MET 255 Cb 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.45 1b8x n MET 255 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1b8x n SER 256 N 5.73 -8.66 0.00 7.83 3.41 -1.26 -5.01 113.62 115.66 1b8x n SER 256 Ca 0.00 0.82 0.00 0.00 -0.26 0.00 0.00 58.87 59.43 1b8x n SER 256 Cb 0.00 -4.56 0.00 0.00 -0.26 0.00 0.00 64.21 59.39 1b8x n SER 256 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b8x n ALA 257 N -2.84 0.00 0.00 7.33 0.00 -1.26 -5.17 120.51 118.56 1b8x n ALA 257 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1b8x n ALA 257 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.13 1b8x n ALA 257 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1b8x n MET 258 N -0.10 0.00 -3.62 0.00 2.81 -1.26 -5.06 117.12 109.89 1b8x n MET 258 Ca 0.00 0.00 -0.04 0.00 -1.81 0.00 0.00 57.70 55.85 1b8x n MET 258 Cb 0.00 0.00 -0.04 0.00 -0.71 0.00 0.00 33.22 32.47 1b8x n MET 258 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1b8x s GLY 259 N -0.88 -0.06 0.00 3.03 0.00 -1.26 -5.34 107.32 102.81 1b8x s GLY 259 Ca 0.00 2.43 0.00 0.00 0.00 0.00 0.00 44.72 47.15 1b8x s GLY 259 CO 0.00 0.99 0.00 -1.14 0.00 0.00 0.00 173.10 172.95