#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f0f n ASP 2 N 0.00 5.01 -4.83 3.17 2.03 -1.26 -4.99 116.55 115.68 3f0f n ASP 2 Ca 0.00 -3.00 -0.33 0.00 0.52 0.00 0.00 54.79 51.98 3f0f n ASP 2 Cb 0.00 -1.57 -0.06 0.00 -0.72 0.00 0.00 41.12 38.77 3f0f n ASP 2 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 3f0f s PHE 3 N 1.68 3.35 -0.02 -0.67 0.08 -1.26 -1.44 117.98 119.71 3f0f s PHE 3 Ca 0.44 1.56 -0.04 0.00 0.12 0.00 0.00 56.93 59.01 3f0f s PHE 3 Cb 0.04 -2.82 0.00 0.00 -0.57 0.00 0.00 43.02 39.67 3f0f s PHE 3 CO 0.01 -0.16 0.08 1.03 -0.10 0.00 0.00 175.22 176.08 3f0f s ARG 4 N -3.38 0.25 0.09 0.44 1.81 -0.11 -4.96 118.95 113.09 3f0f s ARG 4 Ca 0.61 -0.15 0.06 0.00 -1.72 0.00 0.00 55.73 54.53 3f0f s ARG 4 Cb -0.09 0.10 -0.04 0.00 -0.45 0.00 0.00 34.95 34.47 3f0f s ARG 4 CO 0.17 -0.05 -0.08 0.96 -0.68 0.00 0.00 175.30 175.63 3f0f s ILE 5 N -0.61 3.49 0.07 1.52 -4.36 -1.26 -1.36 121.20 118.69 3f0f s ILE 5 Ca -0.07 -1.15 0.02 0.00 -0.26 0.00 0.00 60.65 59.19 3f0f s ILE 5 Cb -0.04 -2.62 -0.03 0.00 1.25 0.00 0.00 42.46 41.02 3f0f s ILE 5 CO 0.00 0.16 -0.08 -0.83 0.24 0.00 0.00 174.94 174.43 3f0f s GLY 6 N -2.09 0.65 0.03 6.27 0.00 0.02 -4.09 107.32 108.12 3f0f s GLY 6 Ca 0.21 -1.03 0.03 0.00 0.00 0.00 0.00 44.72 43.93 3f0f s GLY 6 CO 0.13 -1.11 -0.09 -0.86 0.00 0.00 0.00 173.10 171.18 3f0f s GLN 7 N -2.55 0.59 0.06 2.90 1.03 -1.26 -0.71 119.66 119.73 3f0f s GLN 7 Ca -0.00 -0.63 0.04 0.00 0.04 0.00 0.00 55.36 54.80 3f0f s GLN 7 Cb -0.04 -0.46 -0.03 0.00 0.03 0.00 0.00 33.01 32.52 3f0f s GLN 7 CO -0.01 0.10 -0.10 0.20 -2.54 0.00 0.00 175.29 172.93 3f0f s GLY 8 N -1.17 0.71 0.00 2.60 0.00 0.76 -3.84 107.32 106.38 3f0f s GLY 8 Ca -0.05 -0.95 0.00 0.00 0.00 0.00 0.00 44.72 43.73 3f0f s GLY 8 CO 0.01 -1.00 -0.01 -0.47 0.00 0.00 0.00 173.10 171.63 3f0f s TYR 9 N -1.61 0.11 -0.00 1.90 6.14 -1.26 -0.97 117.35 121.66 3f0f s TYR 9 Ca -0.04 -0.11 -0.21 0.00 0.64 0.00 0.00 57.07 57.35 3f0f s TYR 9 Cb -0.08 -0.08 0.04 0.00 0.42 0.00 0.00 41.96 42.26 3f0f s TYR 9 CO 0.01 -0.04 0.46 0.34 0.64 0.00 0.00 175.55 176.97 3f0f s ASP 10 N -0.30 -0.37 0.00 4.32 2.15 -0.74 -4.60 116.67 117.11 3f0f s ASP 10 Ca -0.03 0.25 -0.06 0.00 0.43 0.00 0.00 52.55 53.15 3f0f s ASP 10 Cb -0.02 0.42 -0.00 0.00 -0.30 0.00 0.00 42.92 43.02 3f0f s ASP 10 CO -0.00 -0.58 0.11 0.54 -0.17 0.00 0.00 175.17 175.06 3f0f s VAL 11 N -1.71 0.08 -0.02 1.11 0.11 -1.26 -1.17 120.40 117.54 3f0f s VAL 11 Ca -0.10 -0.66 -0.06 0.00 -2.93 0.00 0.00 61.98 58.24 3f0f s VAL 11 Cb -0.02 -0.37 0.00 0.00 -1.53 0.00 0.00 36.38 34.46 3f0f s VAL 11 CO 0.04 -0.36 0.13 -1.00 -3.33 0.00 0.00 175.10 170.58 3f0f s HIS 12 N -1.24 -0.01 0.41 1.54 3.76 -0.93 -5.00 115.29 113.82 3f0f s HIS 12 Ca -0.13 0.02 -0.25 0.00 -0.15 0.00 0.00 55.06 54.54 3f0f s HIS 12 Cb -0.07 -0.02 -0.08 0.00 1.11 0.00 0.00 32.58 33.51 3f0f s HIS 12 CO 0.01 -0.21 1.24 -0.65 -0.85 0.00 0.00 174.74 174.27 3f0f s GLN 13 N -0.91 3.95 -0.27 1.40 -0.21 -1.26 -1.55 119.66 120.80 3f0f s GLN 13 Ca -0.10 1.99 -0.14 0.00 0.02 0.00 0.00 55.36 57.13 3f0f s GLN 13 Cb -0.06 -2.67 -0.04 0.00 1.00 0.00 0.00 33.01 31.24 3f0f s GLN 13 CO 0.01 -0.46 0.33 -1.17 -2.12 0.00 0.00 175.29 171.89 3f0f s LEU 14 N -2.55 4.03 0.04 2.90 2.96 0.73 -0.60 118.68 126.19 3f0f s LEU 14 Ca 0.58 0.23 0.03 0.00 -0.22 0.00 0.00 54.13 54.75 3f0f s LEU 14 Cb -0.34 -2.36 -0.02 0.00 0.50 0.00 0.00 46.19 43.96 3f0f s LEU 14 CO 0.43 -0.15 -0.09 0.68 -1.32 0.00 0.00 176.35 175.90 3f0f s VAL 15 N 2.00 0.66 0.80 1.68 -7.23 0.58 -4.79 120.40 114.10 3f0f s VAL 15 Ca 0.13 -1.01 -0.13 0.00 -1.81 0.00 0.00 61.98 59.16 3f0f s VAL 15 Cb -0.16 -0.68 0.08 0.00 0.56 0.00 0.00 36.38 36.18 3f0f s VAL 15 CO 0.10 -0.27 1.20 -2.84 -0.31 0.00 0.00 175.10 172.98 3f0f s PRO 16 N -1.40 1.72 0.00 4.82 0.02 -1.26 -0.19 135.00 138.71 3f0f s PRO 16 Ca -0.06 1.73 0.00 0.00 0.02 0.00 0.00 61.00 62.68 3f0f s PRO 16 Cb -0.09 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.64 3f0f s PRO 16 CO 0.01 -2.14 0.00 0.41 -0.33 0.00 0.00 177.00 174.94 3f0f n GLY 17 N 0.39 2.39 3.77 0.52 0.00 -1.26 -4.82 105.19 106.18 3f0f n GLY 17 Ca 0.13 -0.53 -0.38 0.00 0.00 0.00 0.00 46.02 45.25 3f0f n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3f0f s ARG 18 N 0.00 4.53 0.38 1.61 1.81 -1.24 -4.96 118.95 121.08 3f0f s ARG 18 Ca 0.00 1.47 -0.25 0.00 -1.72 0.00 0.00 55.73 55.23 3f0f s ARG 18 Cb 0.00 -2.86 -0.09 0.00 -0.45 0.00 0.00 34.95 31.55 3f0f s ARG 18 CO 0.00 0.20 1.10 -1.25 -0.68 0.00 0.00 175.30 174.67 3f0f s PRO 19 N -1.95 4.18 -0.44 3.54 0.04 -1.26 -2.05 135.00 137.06 3f0f s PRO 19 Ca 0.50 1.68 -0.24 0.00 0.04 0.00 0.00 61.00 62.98 3f0f s PRO 19 Cb -0.22 -2.68 0.02 0.00 0.04 0.00 0.00 34.50 31.66 3f0f s PRO 19 CO 0.28 -0.17 0.83 -1.17 0.04 0.00 0.00 177.00 176.82 3f0f s LEU 20 N -2.42 4.16 -0.23 -3.56 2.96 -1.25 -3.79 118.68 114.54 3f0f s LEU 20 Ca 0.56 0.02 0.02 0.00 -0.22 0.00 0.00 54.13 54.51 3f0f s LEU 20 Cb -0.27 -3.05 0.05 0.00 0.50 0.00 0.00 46.19 43.43 3f0f s LEU 20 CO 0.34 -0.94 -0.12 -0.63 -1.32 0.00 0.00 176.35 173.68 3f0f s ILE 21 N 3.41 2.01 -0.07 6.68 1.01 -1.26 -0.79 121.20 132.19 3f0f s ILE 21 Ca 0.32 -1.37 0.01 0.00 0.00 0.00 0.00 60.65 59.61 3f0f s ILE 21 Cb -0.12 -2.07 0.02 0.00 0.01 0.00 0.00 42.46 40.31 3f0f s ILE 21 CO 0.23 0.11 -0.07 -0.63 0.00 0.00 0.00 174.94 174.58 3f0f s ILE 22 N 1.21 0.83 -1.54 2.92 1.01 -0.61 -4.33 121.20 120.70 3f0f s ILE 22 Ca -0.05 -0.25 0.00 0.00 0.00 0.00 0.00 60.65 60.36 3f0f s ILE 22 Cb -0.18 -0.83 0.00 0.00 0.01 0.00 0.00 42.46 41.46 3f0f s ILE 22 CO -0.07 0.31 0.00 0.61 0.00 0.00 0.00 174.94 175.78 3f0f n GLY 23 N 4.33 0.00 2.71 6.18 0.00 -1.26 -1.86 105.19 115.29 3f0f n GLY 23 Ca -0.19 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3f0f n GLY 23 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f0f n GLY 24 N -0.99 0.93 3.47 -0.02 0.00 -1.26 -4.40 105.19 102.92 3f0f n GLY 24 Ca -0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 3f0f n GLY 24 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f0f s VAL 25 N -3.72 4.35 -0.24 1.61 1.01 -0.78 -5.06 120.40 117.57 3f0f s VAL 25 Ca 0.00 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.53 3f0f s VAL 25 Cb 0.00 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.36 3f0f s VAL 25 CO 0.00 0.36 1.17 -0.89 0.00 0.00 0.00 175.10 175.74 3f0f s THR 26 N 1.42 4.41 -0.17 3.92 2.01 -1.26 -1.57 115.64 124.41 3f0f s THR 26 Ca 0.05 1.67 -0.03 0.00 0.31 0.00 0.00 61.69 63.70 3f0f s THR 26 Cb -0.15 -4.20 -0.02 0.00 0.01 0.00 0.00 72.50 68.14 3f0f s THR 26 CO 0.03 -0.28 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.00 3f0f s ILE 27 N 3.61 3.58 0.09 1.82 1.01 0.03 -5.02 121.20 126.32 3f0f s ILE 27 Ca 0.50 -0.45 -0.32 0.00 0.00 0.00 0.00 60.65 60.37 3f0f s ILE 27 Cb -0.17 -2.58 -0.11 0.00 0.01 0.00 0.00 42.46 39.61 3f0f s ILE 27 CO 0.14 0.47 1.81 -2.65 0.00 0.00 0.00 174.94 174.71 3f0f n PRO 28 N 3.96 2.58 -3.58 2.79 -0.02 -1.26 -4.16 135.00 135.30 3f0f n PRO 28 Ca -0.18 0.94 -0.09 0.00 -2.02 0.00 0.00 63.50 62.15 3f0f n PRO 28 Cb 0.52 -2.81 -0.05 0.00 -0.02 0.00 0.00 33.50 31.15 3f0f n PRO 28 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3f0f s TYR 29 N 2.76 -0.33 -1.21 6.00 5.04 -1.26 -4.99 117.35 123.36 3f0f s TYR 29 Ca 0.84 0.55 0.24 0.00 -2.44 0.00 0.00 57.07 56.25 3f0f s TYR 29 Cb -0.55 0.46 1.11 0.00 0.35 0.00 0.00 41.96 43.33 3f0f s TYR 29 CO 0.40 -0.32 1.78 -0.85 -1.34 0.00 0.00 175.55 175.22 3f0f n GLU 30 N 0.64 0.17 -4.21 4.97 0.00 -1.26 -4.74 120.64 116.20 3f0f n GLU 30 Ca -0.09 0.08 -0.12 0.00 0.00 0.00 0.00 57.16 57.02 3f0f n GLU 30 Cb 0.58 -1.50 -0.10 0.00 0.00 0.00 0.00 31.44 30.42 3f0f n GLU 30 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 3f0f s ARG 31 N -2.79 0.95 0.17 3.44 0.52 -1.26 -4.24 118.95 115.74 3f0f s ARG 31 Ca 0.17 -1.40 -0.02 0.00 -0.52 0.00 0.00 55.73 53.96 3f0f s ARG 31 Cb 0.16 -0.42 -0.03 0.00 0.52 0.00 0.00 34.95 35.18 3f0f s ARG 31 CO 0.40 0.03 0.13 0.20 0.02 0.00 0.00 175.30 176.08 3f0f s GLY 32 N -3.11 1.11 -0.02 -3.53 0.00 0.73 -3.91 107.32 98.59 3f0f s GLY 32 Ca 0.15 -1.48 -0.28 0.00 0.00 0.00 0.00 44.72 43.11 3f0f s GLY 32 CO -0.02 -1.29 0.90 1.08 0.00 0.00 0.00 173.10 173.77 3f0f s LEU 33 N -3.09 4.36 -0.16 0.66 1.43 -1.25 -0.31 118.68 120.33 3f0f s LEU 33 Ca 0.30 1.52 -0.21 0.00 -1.03 0.00 0.00 54.13 54.71 3f0f s LEU 33 Cb 0.06 -3.43 -0.03 0.00 0.03 0.00 0.00 46.19 42.83 3f0f s LEU 33 CO 0.06 -0.21 0.62 -0.22 0.23 0.00 0.00 176.35 176.84 3f0f s LEU 34 N 0.91 4.20 0.00 1.79 2.96 0.23 -4.61 118.68 124.16 3f0f s LEU 34 Ca 0.48 0.90 -0.01 0.00 -0.22 0.00 0.00 54.13 55.27 3f0f s LEU 34 Cb -0.20 -2.90 0.00 0.00 0.50 0.00 0.00 46.19 43.59 3f0f s LEU 34 CO 0.25 -0.20 0.06 0.61 -1.32 0.00 0.00 176.35 175.75 3f0f n GLY 35 N 3.58 0.89 0.03 7.98 0.00 -1.26 -4.21 105.19 112.20 3f0f n GLY 35 Ca -0.02 -0.88 -0.01 0.00 0.00 0.00 0.00 46.02 45.11 3f0f n GLY 35 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3f0f h HIS 36 N 1.05 -0.06 -0.01 1.61 -0.00 -1.98 -3.45 115.15 112.31 3f0f h HIS 36 Ca -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.36 3f0f h HIS 36 Cb 0.06 0.02 0.00 0.00 -0.00 0.00 0.00 27.41 27.49 3f0f h HIS 36 CO 0.00 -0.04 0.00 -1.13 -0.00 0.00 0.00 177.93 176.76 3f0f n SER 37 N -2.23 0.00 0.00 2.45 3.41 -1.26 -4.83 113.62 111.16 3f0f n SER 37 Ca -0.01 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.66 3f0f n SER 37 Cb 0.02 0.00 0.32 0.00 -0.26 0.00 0.00 64.21 64.29 3f0f n SER 37 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3f0f n ASP 38 N 0.00 0.00 -4.01 4.04 5.68 -1.26 -4.88 116.55 116.12 3f0f n ASP 38 Ca 0.00 -0.12 -0.29 0.00 -0.50 0.00 0.00 54.79 53.88 3f0f n ASP 38 Cb 0.00 -0.14 -0.01 0.00 -1.14 0.00 0.00 41.12 39.82 3f0f n ASP 38 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3f0f n ALA 39 N -1.14 -1.69 -2.28 2.12 0.00 -1.26 -4.65 120.51 111.60 3f0f n ALA 39 Ca 0.07 -0.12 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 3f0f n ALA 39 Cb 0.07 -2.54 -0.04 0.00 0.00 0.00 0.00 19.45 16.94 3f0f n ALA 39 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3f0f s ASP 40 N -3.91 5.76 0.28 0.00 -1.08 -1.26 -4.83 116.67 111.63 3f0f s ASP 40 Ca 0.31 -0.99 0.02 0.00 -0.52 0.00 0.00 52.55 51.38 3f0f s ASP 40 Cb -0.17 -2.56 0.67 0.00 -1.46 0.00 0.00 42.92 39.40 3f0f s ASP 40 CO 0.89 -2.18 1.71 1.62 0.52 0.00 0.00 175.17 177.73 3f0f h VAL 41 N 7.03 0.54 0.13 1.11 3.04 -1.88 -1.89 116.25 124.32 3f0f h VAL 41 Ca 0.13 -0.15 -0.01 0.00 -1.01 0.00 0.00 66.70 65.66 3f0f h VAL 41 Cb 1.01 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.34 3f0f h VAL 41 CO 1.31 0.08 -0.06 0.25 -1.01 0.00 0.00 177.57 178.14 3f0f h LEU 42 N 0.45 -0.15 -1.15 3.16 5.85 -1.90 -2.37 115.31 119.20 3f0f h LEU 42 Ca 0.53 -0.22 -0.05 0.00 0.84 0.00 0.00 57.88 58.98 3f0f h LEU 42 Cb 0.95 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.99 3f0f h LEU 42 CO -0.49 0.15 0.10 -0.07 -0.34 0.00 0.00 178.44 177.79 3f0f h LEU 43 N -0.45 0.65 -0.59 2.25 3.38 -1.85 -1.71 115.31 116.99 3f0f h LEU 43 Ca -0.02 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3f0f h LEU 43 Cb 0.36 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3f0f h LEU 43 CO 0.03 0.65 0.14 0.45 0.09 0.00 0.00 178.44 179.80 3f0f h HIS 44 N 0.68 1.00 -0.38 1.13 3.86 -1.34 -0.10 115.15 119.99 3f0f h HIS 44 Ca 0.15 -0.12 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 3f0f h HIS 44 Cb 0.27 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 3f0f h HIS 44 CO 0.01 0.85 0.15 0.00 0.86 0.00 0.00 177.93 179.80 3f0f h ALA 45 N 1.03 0.50 -0.58 2.45 0.00 -0.93 -0.42 119.26 121.31 3f0f h ALA 45 Ca 0.18 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3f0f h ALA 45 Cb 0.36 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3f0f h ALA 45 CO 0.00 0.11 0.24 0.82 0.00 0.00 0.00 179.25 180.42 3f0f h ILE 46 N 0.47 1.22 -0.35 0.00 2.04 -1.25 -1.49 117.51 118.15 3f0f h ILE 46 Ca 0.13 -0.68 0.05 0.00 1.00 0.00 0.00 64.86 65.35 3f0f h ILE 46 Cb 0.20 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 3f0f h ILE 46 CO -0.01 0.27 0.08 0.74 0.00 0.00 0.00 178.15 179.22 3f0f h THR 47 N 0.79 0.84 -0.79 -0.27 2.02 -0.82 -0.82 112.91 113.86 3f0f h THR 47 Ca 0.19 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.30 3f0f h THR 47 Cb 0.19 0.62 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 3f0f h THR 47 CO -0.02 0.04 0.49 0.44 0.37 0.00 0.00 175.52 176.84 3f0f h ASP 48 N 0.20 0.94 -0.87 4.18 3.45 -0.89 -1.16 116.42 122.27 3f0f h ASP 48 Ca 0.16 -0.05 0.01 0.00 0.43 0.00 0.00 57.03 57.57 3f0f h ASP 48 Cb 0.18 -0.24 -0.04 0.00 -0.56 0.00 0.00 39.33 38.67 3f0f h ASP 48 CO -0.21 0.72 0.57 0.00 -1.57 0.00 0.00 179.24 178.75 3f0f h ALA 49 N 1.26 1.36 -0.08 3.45 0.00 -0.76 0.33 119.26 124.82 3f0f h ALA 49 Ca 0.29 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 3f0f h ALA 49 Cb -0.06 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.38 3f0f h ALA 49 CO -0.06 0.58 -0.21 -0.07 0.00 0.00 0.00 179.25 179.50 3f0f h LEU 50 N 1.18 0.33 -1.34 0.00 3.38 -0.56 -1.13 115.31 117.18 3f0f h LEU 50 Ca 0.32 -0.59 0.01 0.00 0.09 0.00 0.00 57.88 57.71 3f0f h LEU 50 Cb -0.12 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 3f0f h LEU 50 CO -0.07 0.86 0.44 -0.26 0.09 0.00 0.00 178.44 179.50 3f0f h PHE 51 N -0.18 0.84 -0.23 1.13 0.04 -1.15 -2.51 116.94 114.88 3f0f h PHE 51 Ca -0.00 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 3f0f h PHE 51 Cb 0.82 -0.28 -0.01 0.00 2.20 0.00 0.00 35.95 38.67 3f0f h PHE 51 CO 0.12 0.53 0.06 0.78 -0.60 0.00 0.00 178.31 179.19 3f0f h GLY 52 N 0.91 0.40 1.08 -1.45 0.00 -0.77 0.19 103.07 103.42 3f0f h GLY 52 Ca 0.24 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 3f0f h GLY 52 CO -0.05 0.24 0.43 0.00 0.00 0.00 0.00 176.54 177.16 3f0f h ALA 53 N 0.87 1.17 -0.03 3.60 0.00 -1.01 -0.90 119.26 122.96 3f0f h ALA 53 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3f0f h ALA 53 Cb 0.28 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3f0f h ALA 53 CO 0.00 0.65 0.00 0.00 0.00 0.00 0.00 179.25 179.90 3f0f n ALA 54 N -2.42 2.61 -3.87 0.00 0.00 -0.96 -4.59 120.51 111.28 3f0f n ALA 54 Ca 0.09 -0.28 -0.24 0.00 0.00 0.00 0.00 53.44 53.01 3f0f n ALA 54 Cb 0.12 -1.31 -0.00 0.00 0.00 0.00 0.00 19.45 18.26 3f0f n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f0f n ALA 55 N -0.49 -2.03 -1.19 0.00 0.00 -0.34 -4.92 120.51 111.54 3f0f n ALA 55 Ca 0.19 -0.24 0.03 0.00 0.00 0.00 0.00 53.44 53.41 3f0f n ALA 55 Cb 0.18 -1.68 0.23 0.00 0.00 0.00 0.00 19.45 18.17 3f0f n ALA 55 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f0f n LEU 56 N -4.35 3.98 0.00 0.00 4.77 0.58 -5.03 117.00 116.95 3f0f n LEU 56 Ca -0.30 -3.34 0.00 0.00 -0.03 0.00 0.00 56.01 52.34 3f0f n LEU 56 Cb 0.68 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3f0f n LEU 56 CO 0.73 0.92 0.00 0.61 -1.33 0.00 0.00 177.39 178.31 3f0f n GLY 57 N -0.82 0.79 3.50 -0.72 0.00 -1.26 -4.91 105.19 101.77 3f0f n GLY 57 Ca 0.27 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 3f0f n GLY 57 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3f0f s ASP 58 N -4.00 0.57 0.17 1.61 1.47 -1.26 -4.16 116.67 111.07 3f0f s ASP 58 Ca 0.00 -1.32 -0.14 0.00 1.18 0.00 0.00 52.55 52.27 3f0f s ASP 58 Cb 0.00 0.63 0.07 0.00 -0.34 0.00 0.00 42.92 43.28 3f0f s ASP 58 CO 0.00 -1.24 1.83 -0.29 0.68 0.00 0.00 175.17 176.15 3f0f h ILE 59 N 2.18 1.15 -0.14 2.11 2.10 -1.91 -2.03 117.51 120.97 3f0f h ILE 59 Ca -0.28 -0.31 -0.04 0.00 1.08 0.00 0.00 64.86 65.31 3f0f h ILE 59 Cb 1.24 0.38 -0.01 0.00 -1.09 0.00 0.00 36.82 37.35 3f0f h ILE 59 CO 0.39 0.15 -0.10 1.23 -1.08 0.00 0.00 178.15 178.74 3f0f h GLY 60 N 0.73 0.23 2.00 8.18 0.00 -1.98 0.11 103.07 112.35 3f0f h GLY 60 Ca 0.20 -0.13 -0.14 0.00 0.00 0.00 0.00 47.33 47.26 3f0f h GLY 60 CO -0.04 0.13 -0.65 0.07 0.00 0.00 0.00 176.54 176.05 3f0f h ARG 61 N 0.21 0.00 0.08 4.80 -0.00 -1.87 -2.92 114.38 114.68 3f0f h ARG 61 Ca 0.04 0.00 -0.31 0.00 -0.00 0.00 0.00 59.98 59.72 3f0f h ARG 61 Cb 0.32 0.00 -0.02 0.00 -0.00 0.00 0.00 29.97 30.27 3f0f h ARG 61 CO 0.02 0.65 -1.63 0.45 -0.00 0.00 0.00 179.97 179.45 3f0f h HIS 62 N 0.00 0.30 -2.13 4.08 -0.00 -0.94 -3.41 115.15 113.06 3f0f h HIS 62 Ca -0.01 -0.22 -0.58 0.00 -0.00 0.00 0.00 60.37 59.57 3f0f h HIS 62 Cb 1.32 -0.01 -0.41 0.00 -0.00 0.00 0.00 27.41 28.31 3f0f h HIS 62 CO 0.00 1.32 -0.80 1.19 -0.00 0.00 0.00 177.93 179.65 3f0f n PHE 63 N -3.33 2.19 0.06 2.45 3.72 0.36 -5.03 117.46 117.87 3f0f n PHE 63 Ca -0.18 -3.93 -0.12 0.00 -0.05 0.00 0.00 57.45 53.17 3f0f n PHE 63 Cb 1.04 -0.48 -0.08 0.00 -0.94 0.00 0.00 39.48 39.02 3f0f n PHE 63 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3f0f h SER 64 N 3.97 -0.17 0.00 4.37 0.02 -1.75 -3.43 113.55 116.57 3f0f h SER 64 Ca 0.15 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.73 3f0f h SER 64 Cb 0.74 0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.32 3f0f h SER 64 CO 0.70 0.34 0.00 -0.81 -1.14 0.00 0.00 176.83 175.92 3f0f n PRO 68 N -4.94 0.00 -0.22 3.45 -0.04 -1.26 -5.04 135.00 126.95 3f0f n PRO 68 Ca -0.08 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.36 3f0f n PRO 68 Cb 0.27 0.00 0.10 0.00 -0.04 0.00 0.00 33.50 33.82 3f0f n PRO 68 CO 0.00 0.00 0.00 0.07 -0.04 0.00 0.00 175.50 175.53 3f0f h ARG 69 N 0.00 0.57 0.00 0.54 -0.00 -2.02 -2.90 114.38 110.58 3f0f h ARG 69 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.98 59.95 3f0f h ARG 69 Cb 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 29.97 29.84 3f0f h ARG 69 CO 0.00 0.38 0.00 1.19 -0.00 0.00 0.00 179.97 181.54 3f0f n PHE 70 N -4.85 0.00 -2.30 4.08 3.72 -1.26 -4.50 117.46 112.35 3f0f n PHE 70 Ca 0.08 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.05 3f0f n PHE 70 Cb 0.20 -0.08 -0.02 0.00 -0.94 0.00 0.00 39.48 38.64 3f0f n PHE 70 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 3f0f s LYS 71 N -2.15 3.92 0.00 -1.08 3.01 -1.10 -2.80 119.74 119.54 3f0f s LYS 71 Ca 0.23 1.47 0.00 0.00 -1.01 0.00 0.00 55.97 56.66 3f0f s LYS 71 Cb 0.11 -3.92 0.00 0.00 -1.01 0.00 0.00 37.83 33.01 3f0f s LYS 71 CO 0.21 -1.12 0.00 0.41 0.51 0.00 0.00 175.35 175.36 3f0f n GLY 72 N 4.34 0.69 3.78 -3.33 0.00 -1.26 -4.98 105.19 104.43 3f0f n GLY 72 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3f0f n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f0f s ALA 73 N -2.01 3.08 0.71 4.61 0.00 -1.12 -4.98 121.76 122.05 3f0f s ALA 73 Ca 0.00 0.73 -0.11 0.00 0.00 0.00 0.00 51.96 52.58 3f0f s ALA 73 Cb 0.00 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.85 3f0f s ALA 73 CO 0.00 -0.27 1.08 0.16 0.00 0.00 0.00 175.76 176.73 3f0f s ASP 74 N -1.52 5.37 0.43 0.00 -4.77 -1.26 -4.61 116.67 110.31 3f0f s ASP 74 Ca 0.58 1.30 0.21 0.00 -3.30 0.00 0.00 52.55 51.34 3f0f s ASP 74 Cb -0.23 -2.14 0.97 0.00 -1.09 0.00 0.00 42.92 40.43 3f0f s ASP 74 CO 0.29 -1.41 1.87 0.28 0.70 0.00 0.00 175.17 176.90 3f0f h SER 75 N -0.70 0.00 0.42 2.11 0.02 -1.97 -2.50 113.55 110.94 3f0f h SER 75 Ca -0.45 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.39 3f0f h SER 75 Cb 1.24 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.76 3f0f h SER 75 CO 0.61 0.27 -0.50 0.03 -1.14 0.00 0.00 176.83 176.10 3f0f h ARG 76 N 0.00 0.09 -0.11 3.45 3.08 -1.97 -0.94 114.38 117.98 3f0f h ARG 76 Ca -0.00 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 3f0f h ARG 76 Cb 0.65 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.70 3f0f h ARG 76 CO 0.03 0.57 -0.05 0.00 -1.07 0.00 0.00 179.97 179.46 3f0f h ALA 77 N 1.42 0.15 -0.70 0.04 0.00 -1.85 -2.51 119.26 115.82 3f0f h ALA 77 Ca 0.00 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.70 3f0f h ALA 77 Cb 0.91 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 3f0f h ALA 77 CO 0.07 -0.08 0.46 -0.07 0.00 0.00 0.00 179.25 179.63 3f0f h LEU 78 N -0.13 0.73 -0.10 0.00 3.38 -1.35 -1.58 115.31 116.27 3f0f h LEU 78 Ca 0.02 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 3f0f h LEU 78 Cb 0.49 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 3f0f h LEU 78 CO 0.01 0.50 -0.05 0.25 0.09 0.00 0.00 178.44 179.24 3f0f h LEU 79 N 0.84 0.21 -0.77 1.67 5.85 -1.12 0.15 115.31 122.14 3f0f h LEU 79 Ca 0.28 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.60 3f0f h LEU 79 Cb 0.06 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 3f0f h LEU 79 CO -0.08 0.59 0.50 0.03 -0.34 0.00 0.00 178.44 179.14 3f0f h ARG 80 N -0.16 0.95 -0.55 1.25 3.08 -1.31 0.12 114.38 117.77 3f0f h ARG 80 Ca 0.02 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 3f0f h ARG 80 Cb 0.51 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.32 3f0f h ARG 80 CO 0.02 0.63 0.22 1.49 -1.07 0.00 0.00 179.97 181.26 3f0f h GLU 81 N 0.98 0.82 -0.19 0.04 4.57 -1.22 -0.39 114.58 119.19 3f0f h GLU 81 Ca 0.30 -0.15 0.05 0.00 -1.18 0.00 0.00 59.36 58.39 3f0f h GLU 81 Cb -0.02 -0.13 -0.06 0.00 -0.16 0.00 0.00 28.75 28.38 3f0f h GLU 81 CO -0.10 0.71 -0.17 0.00 -1.18 0.00 0.00 179.01 178.27 3f0f h ALA 83 N 0.91 1.12 -0.22 0.00 0.00 -0.68 0.11 119.26 120.50 3f0f h ALA 83 Ca 0.12 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.03 3f0f h ALA 83 Cb 0.37 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3f0f h ALA 83 CO -0.31 0.29 0.10 0.77 0.00 0.00 0.00 179.25 180.10 3f0f h SER 84 N 0.97 0.15 -0.10 0.00 0.02 -0.70 0.90 113.55 114.79 3f0f h SER 84 Ca 0.35 0.01 -0.07 0.00 -0.84 0.00 0.00 61.79 61.24 3f0f h SER 84 Cb 0.11 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.62 3f0f h SER 84 CO -0.15 0.12 -0.15 0.03 -1.14 0.00 0.00 176.83 175.54 3f0f h ARG 85 N 0.23 0.46 -0.25 3.45 3.08 -0.65 0.29 114.38 120.99 3f0f h ARG 85 Ca 0.09 -0.14 -0.05 0.00 0.07 0.00 0.00 59.98 59.95 3f0f h ARG 85 Cb 0.03 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 3f0f h ARG 85 CO -0.07 0.60 -0.04 0.28 -1.07 0.00 0.00 179.97 179.67 3f0f h VAL 86 N 0.42 1.28 -0.54 2.04 2.07 -0.76 -1.51 116.25 119.25 3f0f h VAL 86 Ca 0.08 -1.03 -0.00 0.00 0.82 0.00 0.00 66.70 66.56 3f0f h VAL 86 Cb 0.51 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 3f0f h VAL 86 CO 0.03 0.32 0.32 0.00 0.02 0.00 0.00 177.57 178.26 3f0f h ALA 87 N 0.78 0.69 -0.92 1.67 0.00 -0.53 -2.24 119.26 118.72 3f0f h ALA 87 Ca 0.07 -0.08 0.10 0.00 0.00 0.00 0.00 54.91 55.00 3f0f h ALA 87 Cb 0.50 -0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 3f0f h ALA 87 CO 0.02 0.19 0.56 1.96 0.00 0.00 0.00 179.25 181.97 3f0f h GLN 88 N 0.73 0.89 0.00 0.00 1.08 -0.35 -0.87 115.11 116.59 3f0f h GLN 88 Ca 0.19 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 3f0f h GLN 88 Cb 0.00 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.23 3f0f h GLN 88 CO -0.04 0.59 0.00 0.00 -0.95 0.00 0.00 178.83 178.43 3f0f n ALA 89 N -2.36 2.07 -0.21 3.87 0.00 -0.58 -4.85 120.51 118.45 3f0f n ALA 89 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.50 3f0f n ALA 89 Cb 0.29 -1.32 0.00 0.00 0.00 0.00 0.00 19.45 18.43 3f0f n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f0f n GLY 90 N 0.32 0.87 3.56 0.00 0.00 -0.33 -5.02 105.19 104.59 3f0f n GLY 90 Ca 0.10 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 3f0f n GLY 90 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3f0f s PHE 91 N -2.00 2.84 -0.08 1.61 0.08 -0.86 -0.33 117.98 119.23 3f0f s PHE 91 Ca 0.00 -0.06 -0.01 0.00 0.12 0.00 0.00 56.93 56.98 3f0f s PHE 91 Cb 0.00 -1.62 -0.03 0.00 -0.57 0.00 0.00 43.02 40.79 3f0f s PHE 91 CO 0.00 0.32 -0.02 0.00 -0.10 0.00 0.00 175.22 175.42 3f0f s ALA 92 N -0.90 3.19 -0.01 5.36 0.00 0.52 -3.70 121.76 126.22 3f0f s ALA 92 Ca 0.15 -0.83 -0.29 0.00 0.00 0.00 0.00 51.96 50.98 3f0f s ALA 92 Cb -0.11 -1.40 -0.03 0.00 0.00 0.00 0.00 23.12 21.58 3f0f s ALA 92 CO 0.05 0.58 0.95 0.42 0.00 0.00 0.00 175.76 177.76 3f0f s ILE 93 N -0.86 4.89 -0.27 0.00 1.01 -1.26 -0.82 121.20 123.89 3f0f s ILE 93 Ca 0.13 1.99 -0.09 0.00 0.00 0.00 0.00 60.65 62.67 3f0f s ILE 93 Cb -0.11 -4.29 -0.14 0.00 0.01 0.00 0.00 42.46 37.93 3f0f s ILE 93 CO 0.02 0.17 -0.27 0.54 0.00 0.00 0.00 174.94 175.40 3f0f n ARG 94 N 3.88 0.61 -3.57 2.79 5.12 0.54 -4.95 116.66 121.08 3f0f n ARG 94 Ca 0.05 0.24 -0.11 0.00 -1.93 0.00 0.00 57.85 56.10 3f0f n ARG 94 Cb 0.51 -1.52 -0.03 0.00 -1.16 0.00 0.00 32.46 30.27 3f0f n ARG 94 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 3f0f s ASN 95 N -7.16 -0.42 -0.03 0.55 4.22 -1.12 -4.87 114.94 106.12 3f0f s ASN 95 Ca -0.37 -0.21 0.03 0.00 -2.14 0.00 0.00 52.86 50.17 3f0f s ASN 95 Cb 0.12 0.59 0.00 0.00 1.28 0.00 0.00 41.25 43.24 3f0f s ASN 95 CO 0.54 -1.01 -0.11 -0.69 -2.04 0.00 0.00 177.10 173.80 3f0f s VAL 96 N -3.80 0.90 0.11 3.54 1.01 -0.20 -1.94 120.40 120.01 3f0f s VAL 96 Ca 0.04 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.64 3f0f s VAL 96 Cb -0.01 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 3f0f s VAL 96 CO -0.09 0.27 -0.13 -0.62 0.00 0.00 0.00 175.10 174.54 3f0f s ASP 97 N 0.12 1.82 0.05 3.32 2.15 -0.44 -1.20 116.67 122.49 3f0f s ASP 97 Ca -0.02 -0.80 -0.27 0.00 0.43 0.00 0.00 52.55 51.89 3f0f s ASP 97 Cb -0.09 -0.05 0.08 0.00 -0.30 0.00 0.00 42.92 42.57 3f0f s ASP 97 CO 0.01 -0.17 0.69 -0.94 -0.17 0.00 0.00 175.17 174.59 3f0f s SER 98 N -2.40 -0.55 -0.03 -0.34 1.04 -0.98 -0.61 113.70 109.83 3f0f s SER 98 Ca 0.07 0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.76 3f0f s SER 98 Cb -0.05 0.53 0.01 0.00 0.10 0.00 0.00 66.02 66.61 3f0f s SER 98 CO 0.02 -0.77 -0.08 -0.89 0.98 0.00 0.00 173.24 172.51 3f0f s THR 99 N -2.74 0.67 -0.20 2.02 2.01 0.13 -0.72 115.64 116.82 3f0f s THR 99 Ca -0.02 -0.29 -0.07 0.00 0.31 0.00 0.00 61.69 61.62 3f0f s THR 99 Cb -0.01 -0.61 -0.04 0.00 0.01 0.00 0.00 72.50 71.86 3f0f s THR 99 CO -0.05 0.22 0.05 -0.63 -0.69 0.00 0.00 174.62 173.52 3f0f s ILE 100 N 0.27 4.51 -0.33 1.82 1.01 0.85 -0.22 121.20 129.10 3f0f s ILE 100 Ca -0.04 -0.12 -0.09 0.00 0.00 0.00 0.00 60.65 60.40 3f0f s ILE 100 Cb -0.09 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 39.35 3f0f s ILE 100 CO 0.00 0.43 0.15 -0.63 0.00 0.00 0.00 174.94 174.89 3f0f s ILE 101 N 0.72 4.35 -0.13 2.92 1.01 0.88 -0.13 121.20 130.82 3f0f s ILE 101 Ca 0.03 -0.73 -0.05 0.00 0.00 0.00 0.00 60.65 59.90 3f0f s ILE 101 Cb -0.14 -3.33 0.06 0.00 0.01 0.00 0.00 42.46 39.06 3f0f s ILE 101 CO 0.02 -0.07 0.28 0.00 0.00 0.00 0.00 174.94 175.17 3f0f s ALA 102 N 1.54 -0.63 0.15 9.38 0.00 0.39 -2.07 121.76 130.52 3f0f s ALA 102 Ca 0.02 1.04 -0.12 0.00 0.00 0.00 0.00 51.96 52.91 3f0f s ALA 102 Cb -0.18 -0.89 0.03 0.00 0.00 0.00 0.00 23.12 22.08 3f0f s ALA 102 CO 0.05 -0.45 1.63 0.37 0.00 0.00 0.00 175.76 177.36 3f0f h GLN 103 N 7.78 0.87 -3.72 0.00 5.75 -1.80 -3.35 115.11 120.63 3f0f h GLN 103 Ca -0.26 -0.24 -0.11 0.00 -0.15 0.00 0.00 58.65 57.89 3f0f h GLN 103 Cb 1.13 -0.10 -0.16 0.00 1.07 0.00 0.00 27.48 29.43 3f0f h GLN 103 CO 0.24 0.86 -0.43 0.00 -2.65 0.00 0.00 178.83 176.85 3f0f s ALA 104 N -5.16 -0.21 0.79 3.38 0.00 -1.26 -4.82 121.76 114.48 3f0f s ALA 104 Ca -0.13 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.34 3f0f s ALA 104 Cb 0.12 0.34 0.00 0.00 0.00 0.00 0.00 23.12 23.58 3f0f s ALA 104 CO 0.81 -0.40 0.00 -0.35 0.00 0.00 0.00 175.76 175.82 3f0f n PRO 105 N 0.42 0.22 -1.83 0.00 -0.04 -1.26 -5.06 135.00 127.45 3f0f n PRO 105 Ca -0.17 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.87 3f0f n PRO 105 Cb 0.60 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.03 3f0f n PRO 105 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3f0f s LYS 106 N -2.78 4.17 -0.02 0.54 -0.14 -1.26 -4.91 119.74 115.35 3f0f s LYS 106 Ca 0.00 2.45 0.20 0.00 -1.36 0.00 0.00 55.97 57.26 3f0f s LYS 106 Cb 0.00 -3.54 -0.29 0.00 -1.68 0.00 0.00 37.83 32.32 3f0f s LYS 106 CO 0.00 -0.77 0.53 1.28 -0.76 0.00 0.00 175.35 175.63 3f0f n LEU 107 N 5.43 0.20 -0.26 3.17 4.77 -1.26 -4.65 117.00 124.40 3f0f n LEU 107 Ca 0.16 -0.11 0.03 0.00 -0.03 0.00 0.00 56.01 56.06 3f0f n LEU 107 Cb 0.39 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.59 3f0f n LEU 107 CO 0.64 0.05 0.74 0.00 -1.33 0.00 0.00 177.39 177.49 3f0f h ALA 108 N 2.04 0.59 0.00 -1.18 0.00 -1.99 0.12 119.26 118.84 3f0f h ALA 108 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3f0f h ALA 108 Cb 0.82 0.54 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3f0f h ALA 108 CO 0.00 -0.42 0.00 -2.30 0.00 0.00 0.00 179.25 176.53 3f0f n PRO 109 N -5.46 0.14 0.00 0.00 -0.02 -1.26 -2.77 135.00 125.62 3f0f n PRO 109 Ca 0.12 0.48 0.06 0.00 -2.02 0.00 0.00 63.50 62.14 3f0f n PRO 109 Cb 0.42 -1.83 -0.04 0.00 -0.02 0.00 0.00 33.50 32.03 3f0f n PRO 109 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 3f0f n HIS 110 N -2.10 0.00 -0.03 6.00 8.25 0.00 -4.70 115.22 122.64 3f0f n HIS 110 Ca 0.01 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 3f0f n HIS 110 Cb 0.14 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.20 3f0f n HIS 110 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3f0f h ILE 111 N 0.64 1.09 -0.39 1.59 1.08 -1.31 -2.25 117.51 117.96 3f0f h ILE 111 Ca 0.00 -0.23 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 3f0f h ILE 111 Cb 0.37 0.96 -0.02 0.00 -3.07 0.00 0.00 36.82 35.06 3f0f h ILE 111 CO 0.00 0.08 0.17 0.44 -0.69 0.00 0.00 178.15 178.16 3f0f h ASP 112 N 0.16 0.48 -0.29 1.72 3.32 -1.84 -0.86 116.42 119.11 3f0f h ASP 112 Ca 0.06 -0.04 -0.16 0.00 0.02 0.00 0.00 57.03 56.91 3f0f h ASP 112 Cb 0.05 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 3f0f h ASP 112 CO -0.01 0.42 -0.41 0.00 -1.72 0.00 0.00 179.24 177.53 3f0f h ALA 113 N 1.65 0.63 -0.13 3.45 0.00 -1.81 -2.30 119.26 120.75 3f0f h ALA 113 Ca 0.14 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3f0f h ALA 113 Cb 0.08 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3f0f h ALA 113 CO -0.02 0.67 0.08 0.52 0.00 0.00 0.00 179.25 180.51 3f0f h MET 114 N 0.69 0.17 -0.53 0.00 2.86 -0.82 -2.08 114.93 115.22 3f0f h MET 114 Ca 0.05 -0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.79 3f0f h MET 114 Cb 0.98 -0.04 -0.10 0.00 0.06 0.00 0.00 31.60 32.50 3f0f h MET 114 CO 0.09 0.13 -0.18 -0.09 1.06 0.00 0.00 176.91 177.93 3f0f h ARG 115 N 0.17 -0.05 -0.59 1.72 2.43 -1.11 -1.03 114.38 115.91 3f0f h ARG 115 Ca 0.05 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3f0f h ARG 115 Cb -0.00 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 3f0f h ARG 115 CO -0.01 -0.03 0.38 0.00 -1.51 0.00 0.00 179.97 178.80 3f0f h ALA 116 N 1.41 0.74 -0.16 2.80 0.00 -1.22 -0.16 119.26 122.68 3f0f h ALA 116 Ca 0.25 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.13 3f0f h ALA 116 Cb 0.44 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 3f0f h ALA 116 CO -0.58 0.19 0.06 -0.91 0.00 0.00 0.00 179.25 178.02 3f0f h ASN 117 N 0.79 0.08 -0.38 0.00 2.35 -0.76 -0.19 115.58 117.47 3f0f h ASN 117 Ca 0.21 0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.95 3f0f h ASN 117 Cb -0.07 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 3f0f h ASN 117 CO -0.04 0.07 0.13 0.40 -1.65 0.00 0.00 177.43 176.34 3f0f h ILE 118 N 0.14 1.20 -0.74 2.81 2.04 -1.02 -1.23 117.51 120.72 3f0f h ILE 118 Ca 0.07 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 3f0f h ILE 118 Cb 0.03 0.92 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 3f0f h ILE 118 CO -0.06 0.23 0.34 0.00 0.00 0.00 0.00 178.15 178.66 3f0f h ALA 119 N 0.98 0.96 -0.21 1.87 0.00 -0.91 -1.01 119.26 120.93 3f0f h ALA 119 Ca 0.12 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3f0f h ALA 119 Cb 0.23 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3f0f h ALA 119 CO -0.01 0.54 0.08 0.00 0.00 0.00 0.00 179.25 179.87 3f0f h ALA 120 N 1.17 0.27 0.00 0.00 0.00 -0.90 0.11 119.26 119.91 3f0f h ALA 120 Ca 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3f0f h ALA 120 Cb 0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3f0f h ALA 120 CO -0.03 -0.13 -0.16 -0.44 0.00 0.00 0.00 179.25 178.49 3f0f h ASP 121 N 0.19 0.00 -0.02 0.00 3.32 -0.93 -2.66 116.42 116.31 3f0f h ASP 121 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3f0f h ASP 121 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3f0f h ASP 121 CO -0.01 0.16 -0.13 0.18 -1.72 0.00 0.00 179.24 177.72 3f0f n LEU 122 N -4.12 2.60 -3.76 1.55 4.77 -0.41 -4.32 117.00 113.32 3f0f n LEU 122 Ca -0.02 -0.93 -0.25 0.00 -0.03 0.00 0.00 56.01 54.77 3f0f n LEU 122 Cb 0.24 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.37 3f0f n LEU 122 CO 0.34 0.45 0.09 -0.67 -1.33 0.00 0.00 177.39 176.27 3f0f n ASP 123 N 0.88 -3.89 -4.62 -1.43 2.03 -0.44 -4.99 116.55 104.10 3f0f n ASP 123 Ca 0.12 -0.73 -0.29 0.00 0.52 0.00 0.00 54.79 54.40 3f0f n ASP 123 Cb 0.53 -4.26 -0.09 0.00 -0.72 0.00 0.00 41.12 36.58 3f0f n ASP 123 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3f0f s LEU 124 N -7.05 3.18 0.68 -2.67 1.43 -0.10 -5.04 118.68 109.11 3f0f s LEU 124 Ca 0.41 -0.34 -0.14 0.00 -1.03 0.00 0.00 54.13 53.03 3f0f s LEU 124 Cb -0.20 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.09 3f0f s LEU 124 CO 0.80 0.16 1.12 -2.16 0.23 0.00 0.00 176.35 176.50 3f0f s PRO 125 N -2.35 2.63 0.43 1.29 0.04 -1.26 -4.48 135.00 131.29 3f0f s PRO 125 Ca 0.23 1.42 0.11 0.00 0.04 0.00 0.00 61.00 62.80 3f0f s PRO 125 Cb -0.11 -1.93 0.96 0.00 0.04 0.00 0.00 34.50 33.46 3f0f s PRO 125 CO 0.16 -1.39 2.03 1.25 0.04 0.00 0.00 177.00 179.09 3f0f h LEU 126 N -0.16 0.40 0.00 -3.56 5.85 -1.93 -2.33 115.31 113.58 3f0f h LEU 126 Ca -0.46 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.25 3f0f h LEU 126 Cb 1.25 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.19 3f0f h LEU 126 CO 0.53 0.27 0.00 -0.90 -0.34 0.00 0.00 178.44 178.00 3f0f n ASP 127 N -4.48 0.00 -0.35 1.25 5.75 -1.26 -1.98 116.55 115.48 3f0f n ASP 127 Ca 0.06 -1.33 0.04 0.00 -0.01 0.00 0.00 54.79 53.54 3f0f n ASP 127 Cb 0.20 0.00 0.06 0.00 -1.03 0.00 0.00 41.12 40.34 3f0f n ASP 127 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3f0f n ARG 128 N -0.69 0.96 -5.12 0.11 1.74 -0.88 -4.98 116.66 107.80 3f0f n ARG 128 Ca 0.07 -1.25 -0.30 0.00 -0.77 0.00 0.00 57.85 55.60 3f0f n ARG 128 Cb 0.03 -1.16 -0.17 0.00 -1.02 0.00 0.00 32.46 30.15 3f0f n ARG 128 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 3f0f s VAL 129 N -0.76 1.87 0.00 1.55 1.01 -0.84 -1.03 120.40 122.20 3f0f s VAL 129 Ca 0.11 -0.95 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3f0f s VAL 129 Cb 0.07 -1.60 -0.00 0.00 0.00 0.00 0.00 36.38 34.85 3f0f s VAL 129 CO 0.10 0.52 -0.00 0.21 0.00 0.00 0.00 175.10 175.93 3f0f s ASN 130 N 0.05 0.01 -0.04 3.32 2.47 -0.34 -4.97 114.94 115.43 3f0f s ASN 130 Ca -0.08 -0.01 0.03 0.00 0.42 0.00 0.00 52.86 53.22 3f0f s ASN 130 Cb -0.14 -0.00 0.01 0.00 -1.45 0.00 0.00 41.25 39.66 3f0f s ASN 130 CO 0.05 -0.00 -0.11 -0.69 -3.72 0.00 0.00 177.10 172.63 3f0f s VAL 131 N -0.01 0.94 0.12 -5.21 1.01 -1.26 -2.33 120.40 113.66 3f0f s VAL 131 Ca -0.00 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.66 3f0f s VAL 131 Cb -0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 3f0f s VAL 131 CO -0.00 0.30 -0.26 -0.54 0.00 0.00 0.00 175.10 174.60 3f0f s LYS 132 N 0.36 1.35 -0.08 2.72 1.02 0.10 -4.97 119.74 120.24 3f0f s LYS 132 Ca -0.07 -1.30 0.02 0.00 0.02 0.00 0.00 55.97 54.64 3f0f s LYS 132 Cb -0.11 -1.79 -0.02 0.00 -0.52 0.00 0.00 37.83 35.39 3f0f s LYS 132 CO 0.01 0.42 -0.14 0.00 -0.92 0.00 0.00 175.35 174.72 3f0f s ALA 133 N -1.08 2.63 0.04 5.17 0.00 -1.26 -0.11 121.76 127.15 3f0f s ALA 133 Ca 0.12 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.15 3f0f s ALA 133 Cb -0.10 -1.04 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 3f0f s ALA 133 CO 0.06 0.44 -0.07 0.15 0.00 0.00 0.00 175.76 176.34 3f0f s LYS 134 N -0.33 0.50 0.54 0.00 -0.14 0.82 -4.92 119.74 116.20 3f0f s LYS 134 Ca 0.03 -0.73 0.04 0.00 -1.36 0.00 0.00 55.97 53.95 3f0f s LYS 134 Cb -0.13 -0.24 0.05 0.00 -1.68 0.00 0.00 37.83 35.83 3f0f s LYS 134 CO 0.02 0.04 0.74 0.95 -0.76 0.00 0.00 175.35 176.35 3f0f s THR 135 N -1.37 2.62 -0.33 2.17 -4.23 -1.26 -0.46 115.64 112.78 3f0f s THR 135 Ca -0.11 -0.80 0.09 0.00 -1.18 0.00 0.00 61.69 59.69 3f0f s THR 135 Cb -0.10 -2.82 0.63 0.00 1.34 0.00 0.00 72.50 71.55 3f0f s THR 135 CO 0.00 0.00 1.69 -3.20 -0.54 0.00 0.00 174.62 172.57 3f0f n ASN 136 N -2.25 3.77 -4.20 3.99 5.15 -1.26 -4.80 115.26 115.67 3f0f n ASN 136 Ca 0.10 -3.45 -0.36 0.00 -0.60 0.00 0.00 54.58 50.27 3f0f n ASN 136 Cb 0.60 -0.71 -0.02 0.00 -0.53 0.00 0.00 39.78 39.11 3f0f n ASN 136 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3f0f n GLU 137 N -0.74 -3.37 -1.75 1.20 -0.58 -1.26 -1.12 120.64 113.02 3f0f n GLU 137 Ca 0.41 0.39 -0.18 0.00 -0.42 0.00 0.00 57.16 57.37 3f0f n GLU 137 Cb 1.30 -5.13 -0.06 0.00 -0.57 0.00 0.00 31.44 26.99 3f0f n GLU 137 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3f0f n LYS 138 N -4.41 -1.29 -4.19 3.49 5.02 -1.26 -5.00 118.16 110.52 3f0f n LYS 138 Ca 0.07 1.05 -0.36 0.00 -2.02 0.00 0.00 58.31 57.05 3f0f n LYS 138 Cb 0.50 -5.37 -0.08 0.00 -0.02 0.00 0.00 35.03 30.05 3f0f n LYS 138 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3f0f s LEU 139 N -4.35 3.88 0.00 -0.35 1.43 -0.27 -4.66 118.68 114.36 3f0f s LEU 139 Ca 0.00 0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.36 3f0f s LEU 139 Cb 0.00 -1.91 0.00 0.00 0.03 0.00 0.00 46.19 44.31 3f0f s LEU 139 CO 0.00 0.39 0.00 0.61 0.23 0.00 0.00 176.35 177.58 3f0f n GLY 140 N 2.11 -1.02 0.26 -3.19 0.00 -1.26 -0.66 105.19 101.43 3f0f n GLY 140 Ca -0.19 -1.08 0.07 0.00 0.00 0.00 0.00 46.02 44.82 3f0f n GLY 140 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3f0f h TYR 141 N 0.00 0.07 -0.14 1.61 -0.00 -1.97 -1.73 116.97 114.81 3f0f h TYR 141 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.67 3f0f h TYR 141 Cb 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 36.73 36.70 3f0f h TYR 141 CO 0.00 0.08 -0.13 -0.07 -0.00 0.00 0.00 178.16 178.03 3f0f h LEU 142 N 0.08 0.37 -1.98 0.10 3.38 -1.81 0.07 115.31 115.51 3f0f h LEU 142 Ca 0.02 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.50 3f0f h LEU 142 Cb 0.05 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3f0f h LEU 142 CO -0.00 0.76 -0.08 1.23 0.09 0.00 0.00 178.44 180.44 3f0f h GLY 143 N -0.02 0.00 -0.69 0.83 0.00 -0.37 -2.06 103.07 100.76 3f0f h GLY 143 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3f0f h GLY 143 CO 0.03 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.11 3f0f n ARG 144 N -4.18 1.72 -1.83 4.80 1.74 -0.70 -4.51 116.66 113.70 3f0f n ARG 144 Ca -0.03 -1.07 -0.13 0.00 -0.77 0.00 0.00 57.85 55.86 3f0f n ARG 144 Cb 0.16 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 3f0f n ARG 144 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3f0f n GLY 145 N 1.16 0.56 0.15 -0.13 0.00 -0.77 -4.91 105.19 101.25 3f0f n GLY 145 Ca 0.18 -0.39 0.02 0.00 0.00 0.00 0.00 46.02 45.82 3f0f n GLY 145 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3f0f h GLU 146 N 0.00 0.00 -2.96 1.61 5.08 -1.21 -3.42 114.58 113.68 3f0f h GLU 146 Ca -0.28 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.11 3f0f h GLU 146 Cb 1.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 3f0f h GLU 146 CO 0.37 0.51 0.28 0.20 -1.00 0.00 0.00 179.01 179.37 3f0f s GLY 147 N -4.44 0.18 -0.02 -3.84 0.00 -1.23 -0.19 107.32 97.78 3f0f s GLY 147 Ca 0.01 -0.55 0.03 0.00 0.00 0.00 0.00 44.72 44.20 3f0f s GLY 147 CO 0.73 -0.10 -0.09 -0.42 0.00 0.00 0.00 173.10 173.21 3f0f s ILE 148 N -2.89 0.76 0.07 0.90 1.01 -0.60 -4.57 121.20 115.87 3f0f s ILE 148 Ca 0.14 -0.37 0.07 0.00 0.00 0.00 0.00 60.65 60.49 3f0f s ILE 148 Cb -0.05 -0.66 -0.04 0.00 0.01 0.00 0.00 42.46 41.72 3f0f s ILE 148 CO 0.09 0.23 -0.14 -0.70 0.00 0.00 0.00 174.94 174.42 3f0f s GLU 149 N 0.04 2.09 0.05 2.79 2.12 -0.88 -2.18 118.70 122.73 3f0f s GLU 149 Ca -0.01 -1.00 0.07 0.00 0.36 0.00 0.00 54.97 54.39 3f0f s GLU 149 Cb -0.07 -2.25 -0.03 0.00 0.26 0.00 0.00 34.13 32.05 3f0f s GLU 149 CO 0.00 0.53 -0.20 0.00 -0.54 0.00 0.00 175.26 175.05 3f0f s ALA 150 N -1.07 1.70 0.04 6.30 0.00 -0.32 -0.09 121.76 128.33 3f0f s ALA 150 Ca 0.18 -1.06 0.09 0.00 0.00 0.00 0.00 51.96 51.17 3f0f s ALA 150 Cb -0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 23.12 22.67 3f0f s ALA 150 CO 0.09 0.37 -0.26 -0.65 0.00 0.00 0.00 175.76 175.31 3f0f s GLN 151 N -1.25 1.85 0.04 0.00 -0.21 0.69 -1.80 119.66 118.98 3f0f s GLN 151 Ca 0.07 -1.08 0.01 0.00 0.02 0.00 0.00 55.36 54.37 3f0f s GLN 151 Cb -0.09 -2.00 -0.03 0.00 1.00 0.00 0.00 33.01 31.90 3f0f s GLN 151 CO 0.02 0.52 -0.05 0.00 -2.12 0.00 0.00 175.29 173.66 3f0f s ALA 152 N -0.79 0.43 0.01 6.09 0.00 -0.15 -0.70 121.76 126.66 3f0f s ALA 152 Ca 0.12 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.25 3f0f s ALA 152 Cb -0.10 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.15 3f0f s ALA 152 CO 0.02 -0.17 -0.08 0.00 0.00 0.00 0.00 175.76 175.54 3f0f s ALA 153 N -2.15 0.63 0.00 0.00 0.00 0.22 -0.17 121.76 120.29 3f0f s ALA 153 Ca -0.07 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.48 3f0f s ALA 153 Cb -0.05 -0.12 -0.00 0.00 0.00 0.00 0.00 23.12 22.94 3f0f s ALA 153 CO -0.03 0.12 -0.02 0.00 0.00 0.00 0.00 175.76 175.84 3f0f s ALA 154 N -0.40 0.10 -0.14 0.00 0.00 0.11 -1.33 121.76 120.10 3f0f s ALA 154 Ca 0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 51.96 51.80 3f0f s ALA 154 Cb -0.04 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 3f0f s ALA 154 CO -0.00 -0.01 -0.13 -1.17 0.00 0.00 0.00 175.76 174.45 3f0f s LEU 155 N -0.33 2.68 0.28 0.00 2.96 -0.82 -0.80 118.68 122.65 3f0f s LEU 155 Ca -0.03 -0.36 0.06 0.00 -0.22 0.00 0.00 54.13 53.59 3f0f s LEU 155 Cb -0.02 -1.61 -0.06 0.00 0.50 0.00 0.00 46.19 45.00 3f0f s LEU 155 CO -0.00 0.14 -0.05 0.68 -1.32 0.00 0.00 176.35 175.80 3f0f s VAL 156 N 0.51 1.59 -0.04 1.68 -7.23 -0.46 -0.34 120.40 116.10 3f0f s VAL 156 Ca -0.09 -2.11 0.01 0.00 -1.81 0.00 0.00 61.98 57.98 3f0f s VAL 156 Cb -0.16 -2.46 0.02 0.00 0.56 0.00 0.00 36.38 34.34 3f0f s VAL 156 CO 0.04 -0.29 -0.06 0.54 -0.31 0.00 0.00 175.10 175.02 3f0f s VAL 157 N -3.05 0.61 -0.26 1.32 0.11 -0.00 -0.93 120.40 118.20 3f0f s VAL 157 Ca 0.30 -0.20 -0.29 0.00 -2.93 0.00 0.00 61.98 58.86 3f0f s VAL 157 Cb 0.04 -0.60 -0.01 0.00 -1.53 0.00 0.00 36.38 34.29 3f0f s VAL 157 CO 0.12 0.23 1.38 -0.60 -3.33 0.00 0.00 175.10 172.90 3f0f s ARG 158 N 0.65 3.93 0.00 1.54 3.52 -0.52 -0.36 118.95 127.72 3f0f s ARG 158 Ca -0.09 1.43 0.32 0.00 -0.13 0.00 0.00 55.73 57.25 3f0f s ARG 158 Cb -0.12 -3.90 1.89 0.00 -1.56 0.00 0.00 34.95 31.25 3f0f s ARG 158 CO 0.01 -1.10 2.21 0.39 -0.81 0.00 0.00 175.30 176.00