#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dwl n PRO 2 N 0.00 0.00 -2.03 0.03 -0.02 -1.26 -4.85 135.00 126.86 2dwl n PRO 2 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.05 2dwl n PRO 2 Cb 0.00 -0.29 -0.03 0.00 -0.02 0.00 0.00 33.50 33.16 2dwl n PRO 2 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2dwl s VAL 3 N 0.00 3.59 -0.36 -1.45 -7.23 -1.26 -4.99 120.40 108.70 2dwl s VAL 3 Ca 0.00 0.67 -0.16 0.00 -1.81 0.00 0.00 61.98 60.69 2dwl s VAL 3 Cb 0.00 -3.58 -0.01 0.00 0.56 0.00 0.00 36.38 33.36 2dwl s VAL 3 CO 0.00 -0.22 0.38 0.00 -0.31 0.00 0.00 175.10 174.95 2dwl s ALA 4 N 5.21 3.48 -0.40 1.32 0.00 -1.26 -5.02 121.76 125.09 2dwl s ALA 4 Ca 0.75 -1.27 -0.25 0.00 0.00 0.00 0.00 51.96 51.19 2dwl s ALA 4 Cb -0.28 -2.87 0.02 0.00 0.00 0.00 0.00 23.12 20.00 2dwl s ALA 4 CO 0.30 -1.17 0.91 -1.01 0.00 0.00 0.00 175.76 174.79 2dwl s HIS 5 N 2.04 3.02 0.15 0.00 3.76 -1.26 -5.02 115.29 117.98 2dwl s HIS 5 Ca 0.12 0.59 0.08 0.00 -0.15 0.00 0.00 55.06 55.70 2dwl s HIS 5 Cb -0.17 -3.74 -0.04 0.00 1.11 0.00 0.00 32.58 29.74 2dwl s HIS 5 CO 0.12 -0.92 -0.08 0.08 -0.85 0.00 0.00 174.74 173.09 2dwl s VAL 6 N 3.53 3.36 -0.16 -0.90 1.01 -1.26 -5.11 120.40 120.87 2dwl s VAL 6 Ca 0.37 -1.46 -0.08 0.00 0.00 0.00 0.00 61.98 60.80 2dwl s VAL 6 Cb -0.11 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 2dwl s VAL 6 CO 0.21 -0.03 0.13 0.00 0.00 0.00 0.00 175.10 175.42 2dwl s ALA 7 N -1.52 3.77 0.02 5.51 0.00 -1.26 -5.11 121.76 123.17 2dwl s ALA 7 Ca 0.24 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.53 2dwl s ALA 7 Cb -0.10 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 20.96 2dwl s ALA 7 CO 0.15 0.40 -0.03 -0.51 0.00 0.00 0.00 175.76 175.77 2dwl s LEU 8 N -0.36 2.21 -1.51 0.00 1.43 -1.26 -5.05 118.68 114.14 2dwl s LEU 8 Ca 0.11 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 52.66 2dwl s LEU 8 Cb -0.12 0.05 0.00 0.00 0.03 0.00 0.00 46.19 46.15 2dwl s LEU 8 CO 0.01 -0.24 2.52 -2.65 0.23 0.00 0.00 176.35 176.22 2dwl n PRO 9 N 1.79 3.38 -0.87 1.29 -0.02 -1.26 -4.97 135.00 134.34 2dwl n PRO 9 Ca -0.22 -2.56 -0.34 0.00 -2.02 0.00 0.00 63.50 58.36 2dwl n PRO 9 Cb 0.56 -3.02 0.09 0.00 -0.02 0.00 0.00 33.50 31.11 2dwl n PRO 9 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2dwl n VAL 10 N 4.11 0.00 -0.72 -1.45 3.14 -1.26 -4.91 118.33 117.24 2dwl n VAL 10 Ca 0.63 -0.30 -0.32 0.00 -2.96 0.00 0.00 64.34 61.40 2dwl n VAL 10 Cb 0.31 -0.38 0.15 0.00 -1.06 0.00 0.00 33.84 32.87 2dwl n VAL 10 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 2dwl n PRO 11 N -0.09 -0.39 0.00 1.45 -0.02 -1.26 -4.94 135.00 129.75 2dwl n PRO 11 Ca 0.03 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2dwl n PRO 11 Cb 0.56 -2.22 0.00 0.00 -0.02 0.00 0.00 33.50 31.82 2dwl n PRO 11 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2dwl n LEU 12 N -3.31 0.00 -4.53 2.45 0.00 -1.26 -3.84 117.00 106.51 2dwl n LEU 12 Ca 0.10 0.41 -0.41 0.00 0.00 0.00 0.00 56.01 56.11 2dwl n LEU 12 Cb 0.52 -0.05 -0.03 0.00 0.00 0.00 0.00 43.42 43.87 2dwl n LEU 12 CO 0.49 -0.05 1.13 -2.84 0.00 0.00 0.00 177.39 176.13 2dwl s PRO 13 N -1.26 3.24 -0.49 1.96 0.02 -1.26 -4.85 135.00 132.36 2dwl s PRO 13 Ca 0.00 -0.52 -0.28 0.00 0.02 0.00 0.00 61.00 60.22 2dwl s PRO 13 Cb 0.00 -4.38 0.01 0.00 0.02 0.00 0.00 34.50 30.16 2dwl s PRO 13 CO 0.00 -2.09 1.37 0.50 -0.33 0.00 0.00 177.00 176.45 2dwl s ARG 14 N 5.24 3.48 0.30 5.54 3.52 -1.25 -4.98 118.95 130.79 2dwl s ARG 14 Ca 0.34 0.66 0.08 0.00 -0.13 0.00 0.00 55.73 56.68 2dwl s ARG 14 Cb -0.08 -4.05 -0.06 0.00 -1.56 0.00 0.00 34.95 29.20 2dwl s ARG 14 CO 0.10 -1.70 -0.08 0.95 -0.81 0.00 0.00 175.30 173.75 2dwl s THR 15 N 5.56 1.92 -0.15 4.11 -4.23 -1.26 -4.82 115.64 116.77 2dwl s THR 15 Ca 0.55 -2.18 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 2dwl s THR 15 Cb -0.11 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.22 2dwl s THR 15 CO 0.29 -0.28 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.59 2dwl s PHE 16 N -2.83 2.79 0.28 3.99 0.40 -1.26 -5.11 117.98 116.25 2dwl s PHE 16 Ca 0.30 -0.91 -0.29 0.00 -0.60 0.00 0.00 56.93 55.44 2dwl s PHE 16 Cb 0.02 -1.88 -0.09 0.00 0.51 0.00 0.00 43.02 41.58 2dwl s PHE 16 CO 0.14 -0.39 0.98 -0.51 0.70 0.00 0.00 175.22 176.14 2dwl s ASP 17 N 0.68 7.43 -0.06 1.36 1.01 -1.26 -5.07 116.67 120.76 2dwl s ASP 17 Ca -0.07 2.00 -0.09 0.00 0.71 0.00 0.00 52.55 55.10 2dwl s ASP 17 Cb -0.16 -2.60 0.02 0.00 1.01 0.00 0.00 42.92 41.19 2dwl s ASP 17 CO 0.02 -0.01 0.23 -0.31 0.21 0.00 0.00 175.17 175.31 2dwl s TYR 18 N -1.31 -0.19 0.32 4.23 1.51 -1.26 -4.56 117.35 116.09 2dwl s TYR 18 Ca 0.45 0.43 -0.25 0.00 -1.01 0.00 0.00 57.07 56.69 2dwl s TYR 18 Cb -0.25 0.06 -0.10 0.00 -0.11 0.00 0.00 41.96 41.56 2dwl s TYR 18 CO 0.32 -0.19 0.93 -1.17 -1.11 0.00 0.00 175.55 174.32 2dwl s LEU 19 N -0.37 4.31 -0.32 -1.29 2.96 0.19 -4.76 118.68 119.39 2dwl s LEU 19 Ca -0.05 1.79 -0.15 0.00 -0.22 0.00 0.00 54.13 55.51 2dwl s LEU 19 Cb -0.03 -4.03 -0.02 0.00 0.50 0.00 0.00 46.19 42.61 2dwl s LEU 19 CO 0.01 -0.08 0.36 -0.76 -1.32 0.00 0.00 176.35 174.56 2dwl s LEU 20 N -2.14 4.30 1.17 -0.68 1.43 -1.26 -0.83 118.68 120.66 2dwl s LEU 20 Ca 0.51 -0.07 -0.14 0.00 -1.03 0.00 0.00 54.13 53.40 2dwl s LEU 20 Cb -0.18 -2.36 0.26 0.00 0.03 0.00 0.00 46.19 43.94 2dwl s LEU 20 CO 0.23 -0.29 0.83 -2.65 0.23 0.00 0.00 176.35 174.70 2dwl n PRO 21 N 5.37 -2.31 -1.78 1.29 -0.02 -1.26 -4.86 135.00 131.44 2dwl n PRO 21 Ca -0.09 -0.64 -0.41 0.00 -2.02 0.00 0.00 63.50 60.33 2dwl n PRO 21 Cb 0.50 -2.08 -0.01 0.00 -0.02 0.00 0.00 33.50 31.88 2dwl n PRO 21 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2dwl s GLU 22 N -4.22 4.11 0.00 -0.52 -6.30 -1.26 -2.44 118.70 108.08 2dwl s GLU 22 Ca 0.66 2.58 0.00 0.00 -2.50 0.00 0.00 54.97 55.72 2dwl s GLU 22 Cb -0.23 -3.01 0.00 0.00 0.00 0.00 0.00 34.13 30.89 2dwl s GLU 22 CO 0.65 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.73 2dwl n GLY 23 N 1.72 0.95 3.70 -1.50 0.00 -1.26 -4.99 105.19 103.81 2dwl n GLY 23 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2dwl n GLY 23 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dwl s MET 24 N -0.22 4.26 -0.04 1.61 1.75 -1.02 -5.07 119.30 120.58 2dwl s MET 24 Ca 0.00 0.36 0.04 0.00 -1.25 0.00 0.00 55.69 54.84 2dwl s MET 24 Cb 0.00 -3.49 -0.00 0.00 2.84 0.00 0.00 34.83 34.18 2dwl s MET 24 CO 0.00 0.05 -0.17 -0.08 -0.65 0.00 0.00 175.02 174.17 2dwl s THR 25 N 1.01 1.42 -0.06 10.11 -1.32 -1.26 -4.77 115.64 120.76 2dwl s THR 25 Ca 0.23 -0.72 -0.14 0.00 -1.21 0.00 0.00 61.69 59.86 2dwl s THR 25 Cb -0.15 -1.21 0.03 0.00 -1.51 0.00 0.00 72.50 69.66 2dwl s THR 25 CO 0.09 0.41 0.33 0.68 -2.21 0.00 0.00 174.62 173.91 2dwl s VAL 26 N -0.02 0.03 0.47 5.08 -7.23 -1.26 -4.98 120.40 112.49 2dwl s VAL 26 Ca -0.02 -0.27 0.05 0.00 -1.81 0.00 0.00 61.98 59.92 2dwl s VAL 26 Cb -0.11 -0.56 -0.03 0.00 0.56 0.00 0.00 36.38 36.24 2dwl s VAL 26 CO 0.02 -0.15 0.11 -1.59 -0.31 0.00 0.00 175.10 173.17 2dwl s LYS 27 N -0.68 2.15 0.14 4.82 -2.85 -1.26 -4.94 119.74 117.12 2dwl s LYS 27 Ca -0.08 -2.14 -0.33 0.00 -1.00 0.00 0.00 55.97 52.42 2dwl s LYS 27 Cb -0.04 -1.75 -0.13 0.00 -2.06 0.00 0.00 37.83 33.86 2dwl s LYS 27 CO 0.03 -0.27 1.69 0.00 0.10 0.00 0.00 175.35 176.90 2dwl n ALA 28 N -1.26 1.88 -0.12 0.59 0.00 -1.26 -2.71 120.51 117.62 2dwl n ALA 28 Ca -0.09 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2dwl n ALA 28 Cb 0.66 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2dwl n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dwl n GLY 29 N 3.81 0.87 3.88 0.00 0.00 0.77 -4.66 105.19 109.85 2dwl n GLY 29 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 2dwl n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dwl s ARG 31 N -1.49 4.34 -0.05 0.00 0.52 -1.26 -0.78 118.95 120.23 2dwl s ARG 31 Ca 0.21 1.05 -0.09 0.00 -0.52 0.00 0.00 55.73 56.38 2dwl s ARG 31 Cb -0.12 -2.67 0.02 0.00 0.52 0.00 0.00 34.95 32.69 2dwl s ARG 31 CO 0.11 0.25 0.23 0.14 0.02 0.00 0.00 175.30 176.05 2dwl s VAL 32 N -1.73 0.03 -0.23 3.52 -7.23 0.24 -1.71 120.40 113.29 2dwl s VAL 32 Ca 0.50 -0.29 -0.18 0.00 -1.81 0.00 0.00 61.98 60.21 2dwl s VAL 32 Cb -0.15 -0.43 -0.03 0.00 0.56 0.00 0.00 36.38 36.33 2dwl s VAL 32 CO 0.20 -0.16 0.50 -0.60 -0.31 0.00 0.00 175.10 174.73 2dwl s ARG 33 N -0.59 4.12 0.24 4.82 3.52 -0.40 0.01 118.95 130.67 2dwl s ARG 33 Ca -0.07 0.33 0.03 0.00 -0.13 0.00 0.00 55.73 55.89 2dwl s ARG 33 Cb -0.04 -3.61 -0.05 0.00 -1.56 0.00 0.00 34.95 29.69 2dwl s ARG 33 CO 0.01 -0.24 0.03 0.14 -0.81 0.00 0.00 175.30 174.43 2dwl s VAL 34 N 1.96 0.93 0.52 7.11 -7.23 0.13 -0.89 120.40 122.93 2dwl s VAL 34 Ca 0.22 -2.02 -0.18 0.00 -1.81 0.00 0.00 61.98 58.19 2dwl s VAL 34 Cb -0.15 -2.45 -0.07 0.00 0.56 0.00 0.00 36.38 34.27 2dwl s VAL 34 CO 0.09 -0.23 1.02 -2.16 -0.31 0.00 0.00 175.10 173.52 2dwl s PRO 35 N -3.91 3.71 -0.25 4.82 0.04 -1.26 -1.19 135.00 136.96 2dwl s PRO 35 Ca 0.31 1.19 -0.09 0.00 0.04 0.00 0.00 61.00 62.45 2dwl s PRO 35 Cb 0.07 -2.09 0.11 0.00 0.04 0.00 0.00 34.50 32.62 2dwl s PRO 35 CO 0.10 -0.49 0.54 0.12 0.04 0.00 0.00 177.00 177.32 2dwl s PHE 36 N -2.31 -1.05 0.08 0.56 5.36 0.16 -4.85 117.98 115.93 2dwl s PHE 36 Ca 0.64 1.92 0.00 0.00 -0.96 0.00 0.00 56.93 58.52 2dwl s PHE 36 Cb -0.14 0.55 0.00 0.00 -0.34 0.00 0.00 43.02 43.09 2dwl s PHE 36 CO 0.28 -0.56 0.00 0.41 -1.46 0.00 0.00 175.22 173.89 2dwl n GLY 37 N 5.27 -1.98 0.16 13.12 0.00 -1.26 -3.00 105.19 117.50 2dwl n GLY 37 Ca -0.12 -1.44 0.07 0.00 0.00 0.00 0.00 46.02 44.53 2dwl n GLY 37 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2dwl n LYS 38 N -2.66 0.09 0.00 1.61 4.81 -1.26 -4.21 118.16 116.54 2dwl n LYS 38 Ca -0.01 0.56 0.00 0.00 -0.87 0.00 0.00 58.31 58.00 2dwl n LYS 38 Cb 0.12 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.10 2dwl n LYS 38 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2dwl n GLN 39 N -2.04 0.00 -3.74 1.64 7.27 -1.26 -5.15 117.38 114.10 2dwl n GLN 39 Ca -0.01 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.84 2dwl n GLN 39 Cb 0.29 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 32.93 2dwl n GLN 39 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 2dwl s GLN 40 N 0.00 3.43 0.41 3.69 1.11 -1.16 -4.94 119.66 122.20 2dwl s GLN 40 Ca 0.00 -0.64 0.08 0.00 0.01 0.00 0.00 55.36 54.81 2dwl s GLN 40 Cb 0.00 -2.81 -0.01 0.00 -1.01 0.00 0.00 33.01 29.18 2dwl s GLN 40 CO 0.00 0.31 0.45 -1.21 0.01 0.00 0.00 175.29 174.85 2dwl s GLU 41 N -4.11 2.66 -0.13 2.91 2.02 -1.26 -0.66 118.70 120.13 2dwl s GLU 41 Ca 0.37 -1.41 -0.30 0.00 0.02 0.00 0.00 54.97 53.65 2dwl s GLU 41 Cb -0.09 -2.54 0.10 0.00 0.10 0.00 0.00 34.13 31.70 2dwl s GLU 41 CO 0.31 -0.21 0.87 1.03 0.02 0.00 0.00 175.26 177.28 2dwl s ARG 42 N -4.21 0.78 0.16 1.61 0.52 -0.33 -4.85 118.95 112.62 2dwl s ARG 42 Ca 0.51 0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 55.66 2dwl s ARG 42 Cb -0.06 0.37 -0.07 0.00 0.52 0.00 0.00 34.95 35.71 2dwl s ARG 42 CO 0.30 -0.23 0.98 0.42 0.02 0.00 0.00 175.30 176.79 2dwl s ILE 43 N -1.02 4.28 0.32 1.52 1.01 -1.26 -0.69 121.20 125.35 2dwl s ILE 43 Ca -0.05 2.00 0.03 0.00 0.00 0.00 0.00 60.65 62.64 2dwl s ILE 43 Cb -0.01 -4.28 -0.04 0.00 0.01 0.00 0.00 42.46 38.15 2dwl s ILE 43 CO 0.04 0.36 0.14 -0.83 0.00 0.00 0.00 174.94 174.66 2dwl s GLY 44 N -0.34 2.11 -0.16 6.18 0.00 0.10 -4.95 107.32 110.26 2dwl s GLY 44 Ca 0.46 -1.72 0.00 0.00 0.00 0.00 0.00 44.72 43.46 2dwl s GLY 44 CO 0.31 -1.63 -0.08 -0.42 0.00 0.00 0.00 173.10 171.27 2dwl s ILE 45 N -3.54 1.32 -0.12 0.90 1.01 -1.26 -0.59 121.20 118.91 2dwl s ILE 45 Ca 0.34 -0.68 -0.29 0.00 0.00 0.00 0.00 60.65 60.02 2dwl s ILE 45 Cb 0.05 -1.40 -0.05 0.00 0.01 0.00 0.00 42.46 41.08 2dwl s ILE 45 CO 0.17 0.23 1.69 -0.69 0.00 0.00 0.00 174.94 176.34 2dwl s VAL 46 N 1.56 3.57 0.02 2.92 1.01 0.04 -4.89 120.40 124.63 2dwl s VAL 46 Ca 0.02 0.67 -0.07 0.00 0.00 0.00 0.00 61.98 62.59 2dwl s VAL 46 Cb -0.15 -3.50 -0.30 0.00 0.00 0.00 0.00 36.38 32.43 2dwl s VAL 46 CO -0.08 -0.14 0.92 0.58 0.00 0.00 0.00 175.10 176.38 2dwl h VAL 47 N 5.87 1.22 -2.36 2.92 2.07 -1.91 0.22 116.25 124.28 2dwl h VAL 47 Ca -0.38 -2.80 0.14 0.00 0.82 0.00 0.00 66.70 64.48 2dwl h VAL 47 Cb 1.17 2.86 -0.11 0.00 -1.52 0.00 0.00 31.29 33.69 2dwl h VAL 47 CO 0.97 0.84 0.47 -0.94 0.02 0.00 0.00 177.57 178.93 2dwl s SER 48 N -7.19 -0.28 -0.18 0.57 1.04 -1.26 -4.72 113.70 101.69 2dwl s SER 48 Ca -0.09 -0.22 -0.01 0.00 0.48 0.00 0.00 55.95 56.11 2dwl s SER 48 Cb 0.06 0.45 0.05 0.00 0.10 0.00 0.00 66.02 66.68 2dwl s SER 48 CO 0.88 -0.80 -0.02 -0.69 0.98 0.00 0.00 173.24 173.59 2dwl s VAL 49 N -3.25 0.94 0.15 5.02 1.01 -1.26 -4.95 120.40 118.06 2dwl s VAL 49 Ca 0.09 -0.65 0.01 0.00 0.00 0.00 0.00 61.98 61.43 2dwl s VAL 49 Cb -0.01 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 35.14 2dwl s VAL 49 CO -0.03 -0.00 0.07 -1.54 0.00 0.00 0.00 175.10 173.60 2dwl n SER 50 N 4.92 1.82 -0.59 3.32 3.41 -1.26 -5.04 113.62 120.19 2dwl n SER 50 Ca -0.11 -1.58 0.06 0.00 -0.26 0.00 0.00 58.87 56.99 2dwl n SER 50 Cb 0.47 0.03 0.18 0.00 -0.26 0.00 0.00 64.21 64.63 2dwl n SER 50 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2dwl n ASP 51 N -1.65 1.72 -3.69 4.04 8.00 -1.26 -4.99 116.55 118.71 2dwl n ASP 51 Ca -0.03 -3.56 -0.10 0.00 0.71 0.00 0.00 54.79 51.81 2dwl n ASP 51 Cb 0.18 -0.49 -0.10 0.00 -0.02 0.00 0.00 41.12 40.70 2dwl n ASP 51 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dwl s ALA 52 N -2.82 -1.22 0.03 2.24 0.00 -1.26 -5.16 121.76 113.56 2dwl s ALA 52 Ca 0.36 1.65 0.08 0.00 0.00 0.00 0.00 51.96 54.04 2dwl s ALA 52 Cb 0.35 -0.99 -0.02 0.00 0.00 0.00 0.00 23.12 22.46 2dwl s ALA 52 CO -0.06 -0.28 -0.22 0.45 0.00 0.00 0.00 175.76 175.65 2dwl s SER 53 N 1.19 2.64 0.00 0.00 0.15 -1.26 -5.01 113.70 111.41 2dwl s SER 53 Ca -0.08 -0.50 0.05 0.00 0.70 0.00 0.00 55.95 56.13 2dwl s SER 53 Cb -0.07 -0.25 0.32 0.00 -1.71 0.00 0.00 66.02 64.32 2dwl s SER 53 CO -0.11 0.21 0.76 1.21 1.20 0.00 0.00 173.24 176.51 2dwl n GLU 54 N 2.04 0.18 -4.09 5.44 0.00 -1.26 -4.60 120.64 118.35 2dwl n GLU 54 Ca -0.17 0.00 -0.09 0.00 0.00 0.00 0.00 57.16 56.91 2dwl n GLU 54 Cb 0.53 -1.46 -0.10 0.00 0.00 0.00 0.00 31.44 30.41 2dwl n GLU 54 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.13 175.96 2dwl s LEU 55 N -1.92 1.95 0.24 4.31 2.96 -1.26 -5.14 118.68 119.82 2dwl s LEU 55 Ca 0.08 -1.06 -0.30 0.00 -0.22 0.00 0.00 54.13 52.63 2dwl s LEU 55 Cb 0.04 0.39 -0.15 0.00 0.50 0.00 0.00 46.19 46.97 2dwl s LEU 55 CO 0.06 -0.69 1.02 -2.65 -1.32 0.00 0.00 176.35 172.77 2dwl n PRO 56 N -0.03 1.18 0.00 0.98 -0.02 -1.26 -4.83 135.00 131.03 2dwl n PRO 56 Ca -0.10 0.42 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 2dwl n PRO 56 Cb 0.63 -1.80 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 2dwl n PRO 56 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2dwl n LEU 57 N 1.55 0.00 -0.01 2.45 4.32 -1.26 -2.36 117.00 121.69 2dwl n LEU 57 Ca 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.11 2dwl n LEU 57 Cb 0.29 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.07 2dwl n LEU 57 CO 0.60 0.00 -0.56 -3.20 -1.22 0.00 0.00 177.39 173.01 2dwl n ASN 58 N -0.82 4.32 -1.86 -1.43 4.05 -1.26 -4.70 115.26 113.57 2dwl n ASN 58 Ca 0.00 0.00 -0.17 0.00 0.45 0.00 0.00 54.58 54.86 2dwl n ASN 58 Cb 0.00 0.85 0.19 0.00 1.23 0.00 0.00 39.78 42.05 2dwl n ASN 58 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 177.26 175.42 2dwl n GLU 59 N -1.85 2.10 -4.02 1.20 2.13 -0.99 -4.88 120.64 114.32 2dwl n GLU 59 Ca -0.03 -3.08 -0.34 0.00 0.66 0.00 0.00 57.16 54.38 2dwl n GLU 59 Cb 0.33 -2.05 -0.06 0.00 0.27 0.00 0.00 31.44 29.93 2dwl n GLU 59 CO 0.00 0.00 0.00 -0.48 -0.41 0.00 0.00 177.13 176.24 2dwl s LEU 60 N -3.29 4.11 0.63 4.31 2.34 -1.25 -5.01 118.68 120.53 2dwl s LEU 60 Ca 0.53 0.28 -0.06 0.00 0.06 0.00 0.00 54.13 54.93 2dwl s LEU 60 Cb 0.46 -2.27 0.03 0.00 -0.56 0.00 0.00 46.19 43.84 2dwl s LEU 60 CO 0.07 0.31 0.95 -0.54 -1.06 0.00 0.00 176.35 176.08 2dwl s LYS 61 N -1.54 2.65 0.05 1.48 1.02 -1.26 -4.63 119.74 117.51 2dwl s LYS 61 Ca 0.21 -0.09 0.01 0.00 0.02 0.00 0.00 55.97 56.12 2dwl s LYS 61 Cb -0.12 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 34.92 2dwl s LYS 61 CO 0.12 -0.90 0.12 0.00 -0.92 0.00 0.00 175.35 173.77 2dwl s ALA 62 N -3.09 3.71 0.65 5.17 0.00 -1.26 0.53 121.76 127.48 2dwl s ALA 62 Ca 0.56 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 51.43 2dwl s ALA 62 Cb -0.11 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.40 2dwl s ALA 62 CO 0.45 0.76 1.25 0.08 0.00 0.00 0.00 175.76 178.30 2dwl s VAL 63 N -1.37 2.25 -0.19 0.00 1.01 -0.01 -4.51 120.40 117.58 2dwl s VAL 63 Ca 0.29 0.15 -0.06 0.00 0.00 0.00 0.00 61.98 62.35 2dwl s VAL 63 Cb -0.12 -2.97 -0.21 0.00 0.00 0.00 0.00 36.38 33.07 2dwl s VAL 63 CO 0.21 -0.04 0.08 0.52 0.00 0.00 0.00 175.10 175.87 2dwl n VAL 64 N -2.02 1.63 -3.63 2.92 0.31 -0.06 -4.75 118.33 112.73 2dwl n VAL 64 Ca 0.15 -0.52 -0.10 0.00 -0.01 0.00 0.00 64.34 63.85 2dwl n VAL 64 Cb 0.49 -1.68 -0.07 0.00 -0.91 0.00 0.00 33.84 31.67 2dwl n VAL 64 CO 0.00 0.00 0.00 -0.70 -1.32 0.00 0.00 176.83 174.81 2dwl s GLU 65 N -2.52 0.57 -0.02 5.55 2.12 -1.20 -5.00 118.70 118.21 2dwl s GLU 65 Ca -0.29 0.58 -0.23 0.00 0.36 0.00 0.00 54.97 55.38 2dwl s GLU 65 Cb 0.08 0.28 -0.04 0.00 0.26 0.00 0.00 34.13 34.71 2dwl s GLU 65 CO 0.66 -0.09 0.71 0.54 -0.54 0.00 0.00 175.26 176.54 2dwl s VAL 66 N 0.04 4.93 -2.53 3.70 0.11 -1.26 -1.28 120.40 124.10 2dwl s VAL 66 Ca 0.02 1.48 0.24 0.00 -2.93 0.00 0.00 61.98 60.78 2dwl s VAL 66 Cb -0.04 -4.05 0.11 0.00 -1.53 0.00 0.00 36.38 30.87 2dwl s VAL 66 CO -0.04 0.31 1.20 0.18 -3.33 0.00 0.00 175.10 173.43 2dwl n LEU 67 N 3.33 2.49 -3.74 2.54 4.32 -0.70 -4.91 117.00 120.32 2dwl n LEU 67 Ca -0.02 -0.86 -0.13 0.00 -0.02 0.00 0.00 56.01 54.97 2dwl n LEU 67 Cb 0.51 -0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.16 2dwl n LEU 67 CO 0.47 0.43 -0.21 -1.81 -1.22 0.00 0.00 177.39 175.05 2dwl s ASP 68 N -2.22 -0.12 0.13 -1.43 1.01 -1.25 -4.92 116.67 107.86 2dwl s ASP 68 Ca 0.24 0.33 0.00 0.00 0.71 0.00 0.00 52.55 53.83 2dwl s ASP 68 Cb 0.19 0.22 -0.13 0.00 1.01 0.00 0.00 42.92 44.21 2dwl s ASP 68 CO 0.43 -0.15 1.28 0.77 0.21 0.00 0.00 175.17 177.70 2dwl h SER 69 N 7.25 0.30 -4.23 0.27 4.64 -1.96 -3.45 113.55 116.37 2dwl h SER 69 Ca -0.43 -0.28 -0.61 0.00 -0.47 0.00 0.00 61.79 60.01 2dwl h SER 69 Cb 1.14 -0.09 -0.25 0.00 -0.31 0.00 0.00 62.40 62.89 2dwl h SER 69 CO 0.41 1.14 -0.85 -0.70 -0.87 0.00 0.00 176.83 175.97 2dwl s GLU 70 N -2.96 1.41 0.02 4.77 2.56 -1.26 -4.87 118.70 118.36 2dwl s GLU 70 Ca -0.03 -1.05 -0.37 0.00 0.00 0.00 0.00 54.97 53.52 2dwl s GLU 70 Cb 0.09 -1.60 -0.16 0.00 2.00 0.00 0.00 34.13 34.46 2dwl s GLU 70 CO 0.85 0.40 1.50 -2.30 -0.56 0.00 0.00 175.26 175.14 2dwl n PRO 71 N 1.61 1.38 0.00 4.30 -0.02 -1.26 -4.81 135.00 136.20 2dwl n PRO 71 Ca -0.18 0.50 0.09 0.00 -2.02 0.00 0.00 63.50 61.90 2dwl n PRO 71 Cb 0.53 -2.19 0.47 0.00 -0.02 0.00 0.00 33.50 32.30 2dwl n PRO 71 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 2dwl n VAL 72 N 3.25 0.40 -4.85 -1.45 3.14 -0.80 -4.68 118.33 113.34 2dwl n VAL 72 Ca 0.20 0.10 -0.33 0.00 -2.96 0.00 0.00 64.34 61.35 2dwl n VAL 72 Cb 0.20 -0.80 -0.13 0.00 -1.06 0.00 0.00 33.84 32.05 2dwl n VAL 72 CO 0.00 0.00 0.00 -0.36 -6.46 0.00 0.00 176.83 170.01 2dwl s PHE 73 N -2.51 2.73 0.58 1.45 0.40 -1.26 -5.01 117.98 114.36 2dwl s PHE 73 Ca 0.19 -0.14 -0.19 0.00 -0.60 0.00 0.00 56.93 56.18 2dwl s PHE 73 Cb 0.12 -1.63 -0.04 0.00 0.51 0.00 0.00 43.02 41.98 2dwl s PHE 73 CO 0.27 0.21 1.23 0.99 0.70 0.00 0.00 175.22 178.61 2dwl s THR 74 N -0.75 2.57 0.25 0.64 2.01 -1.26 -4.76 115.64 114.34 2dwl s THR 74 Ca 0.12 0.37 -0.04 0.00 0.31 0.00 0.00 61.69 62.45 2dwl s THR 74 Cb -0.11 -3.16 0.21 0.00 0.01 0.00 0.00 72.50 69.46 2dwl s THR 74 CO 0.01 -0.06 1.79 0.45 -0.69 0.00 0.00 174.62 176.12 2dwl h HIS 75 N 1.03 0.79 0.43 4.92 3.86 -1.99 0.29 115.15 124.48 2dwl h HIS 75 Ca -0.50 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 58.72 2dwl h HIS 75 Cb 1.30 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 29.54 2dwl h HIS 75 CO 0.47 0.29 -0.21 1.03 0.86 0.00 0.00 177.93 180.37 2dwl h SER 76 N 0.72 -0.49 -0.74 2.45 0.87 -2.00 -2.34 113.55 112.01 2dwl h SER 76 Ca 0.40 -0.10 0.17 0.00 -1.23 0.00 0.00 61.79 61.03 2dwl h SER 76 Cb 0.43 0.13 -0.13 0.00 -0.44 0.00 0.00 62.40 62.39 2dwl h SER 76 CO -0.28 -0.09 -0.03 0.58 -0.53 0.00 0.00 176.83 176.48 2dwl h VAL 77 N -0.97 0.34 0.72 2.23 2.07 -1.83 -0.42 116.25 118.38 2dwl h VAL 77 Ca -0.06 -0.03 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 2dwl h VAL 77 Cb 0.56 0.24 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2dwl h VAL 77 CO 0.10 0.02 -0.38 -0.25 0.02 0.00 0.00 177.57 177.07 2dwl h TRP 78 N 0.08 -0.99 -0.77 1.57 2.91 -0.44 -0.76 115.95 117.54 2dwl h TRP 78 Ca 0.40 -0.02 0.17 0.00 1.13 0.00 0.00 58.89 60.57 2dwl h TRP 78 Cb 0.69 0.34 -0.11 0.00 -0.51 0.00 0.00 29.16 29.57 2dwl h TRP 78 CO -0.44 -0.60 0.25 -0.09 -1.03 0.00 0.00 178.44 176.52 2dwl h ARG 79 N -1.01 0.32 0.80 2.65 2.43 -0.74 -1.66 114.38 117.17 2dwl h ARG 79 Ca -0.10 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2dwl h ARG 79 Cb 0.79 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.27 2dwl h ARG 79 CO 0.14 0.21 -0.47 1.25 -1.51 0.00 0.00 179.97 179.59 2dwl h LEU 80 N 0.33 -1.18 -0.83 3.80 7.12 -0.88 -2.47 115.31 121.20 2dwl h LEU 80 Ca 0.44 0.06 0.13 0.00 0.13 0.00 0.00 57.88 58.65 2dwl h LEU 80 Cb 0.76 0.34 -0.09 0.00 -0.53 0.00 0.00 40.66 41.14 2dwl h LEU 80 CO -0.49 -0.73 0.43 -0.07 -0.13 0.00 0.00 178.44 177.44 2dwl h LEU 81 N -1.18 0.54 -1.10 2.25 3.38 -0.60 0.81 115.31 119.41 2dwl h LEU 81 Ca -0.11 0.08 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 2dwl h LEU 81 Cb 0.94 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2dwl h LEU 81 CO 0.12 0.25 -0.08 -0.07 0.09 0.00 0.00 178.44 178.75 2dwl h LEU 82 N 0.64 0.52 0.72 1.67 3.38 -1.29 -0.76 115.31 120.18 2dwl h LEU 82 Ca 0.44 -0.12 -0.04 0.00 0.09 0.00 0.00 57.88 58.25 2dwl h LEU 82 Cb 0.57 -0.14 0.01 0.00 0.09 0.00 0.00 40.66 41.19 2dwl h LEU 82 CO -0.33 0.65 -0.34 -0.25 0.09 0.00 0.00 178.44 178.25 2dwl h TRP 83 N 0.50 -0.89 -0.57 1.13 7.01 -0.44 -2.17 115.95 120.51 2dwl h TRP 83 Ca 0.10 -0.02 0.11 0.00 2.11 0.00 0.00 58.89 61.19 2dwl h TRP 83 Cb 0.46 0.30 -0.11 0.00 -2.10 0.00 0.00 29.16 27.70 2dwl h TRP 83 CO 0.02 -0.53 -0.19 0.00 -2.79 0.00 0.00 178.44 174.94 2dwl h ALA 84 N -1.04 0.28 -0.51 2.65 0.00 -0.85 0.72 119.26 120.52 2dwl h ALA 84 Ca -0.10 0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.12 2dwl h ALA 84 Cb 0.76 0.52 -0.10 0.00 0.00 0.00 0.00 17.79 18.97 2dwl h ALA 84 CO 0.16 -0.49 -0.26 0.00 0.00 0.00 0.00 179.25 178.66 2dwl h ALA 85 N 1.44 0.07 -0.11 0.00 0.00 -1.06 -0.44 119.26 119.16 2dwl h ALA 85 Ca 0.27 0.17 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 2dwl h ALA 85 Cb 0.47 0.62 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 2dwl h ALA 85 CO -0.62 -0.60 -0.10 0.22 0.00 0.00 0.00 179.25 178.15 2dwl h ASP 86 N -0.14 0.28 -0.34 0.00 1.82 -0.17 0.23 116.42 118.11 2dwl h ASP 86 Ca 0.23 -0.48 -0.01 0.00 -0.39 0.00 0.00 57.03 56.38 2dwl h ASP 86 Cb 0.50 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.42 2dwl h ASP 86 CO -0.60 0.70 0.17 0.22 -1.61 0.00 0.00 179.24 178.13 2dwl h TYR 87 N -0.13 0.47 -0.47 0.28 3.20 0.66 -3.04 116.97 117.94 2dwl h TYR 87 Ca 0.02 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2dwl h TYR 87 Cb 0.62 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.74 2dwl h TYR 87 CO 0.09 0.39 0.00 0.66 -1.64 0.00 0.00 178.16 177.66 2dwl n TYR 88 N -4.77 0.63 -3.14 -3.82 4.02 -0.20 -4.98 117.16 104.90 2dwl n TYR 88 Ca -0.01 -0.31 -0.14 0.00 -0.01 0.00 0.00 57.90 57.43 2dwl n TYR 88 Cb 0.09 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.48 2dwl n TYR 88 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 2dwl n HIS 89 N 1.04 -2.20 -4.81 -0.72 8.25 -0.89 -5.03 115.22 110.85 2dwl n HIS 89 Ca 0.18 0.80 -0.27 0.00 -0.26 0.00 0.00 57.72 58.17 2dwl n HIS 89 Cb 0.46 -4.17 -0.15 0.00 1.12 0.00 0.00 29.99 27.25 2dwl n HIS 89 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2dwl s HIS 90 N -3.35 1.91 0.29 4.41 3.76 0.76 -5.04 115.29 118.03 2dwl s HIS 90 Ca 0.33 -0.37 -0.29 0.00 -0.15 0.00 0.00 55.06 54.57 2dwl s HIS 90 Cb -0.04 -1.17 -0.10 0.00 1.11 0.00 0.00 32.58 32.38 2dwl s HIS 90 CO 0.67 0.05 1.35 -2.14 -0.85 0.00 0.00 174.74 173.83 2dwl s PRO 91 N -0.95 4.32 0.25 8.40 0.02 -1.26 -4.45 135.00 141.32 2dwl s PRO 91 Ca 0.08 2.24 -0.04 0.00 0.02 0.00 0.00 61.00 63.30 2dwl s PRO 91 Cb -0.09 -3.09 0.46 0.00 0.02 0.00 0.00 34.50 31.80 2dwl s PRO 91 CO 0.01 -0.27 1.75 0.82 -0.33 0.00 0.00 177.00 178.97 2dwl h ILE 92 N 3.26 0.72 -0.25 2.83 1.08 -1.89 -1.13 117.51 122.12 2dwl h ILE 92 Ca -0.48 -0.18 0.02 0.00 -0.39 0.00 0.00 64.86 63.83 2dwl h ILE 92 Cb 1.22 0.14 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 2dwl h ILE 92 CO 0.70 0.10 0.12 1.23 -0.69 0.00 0.00 178.15 179.61 2dwl h GLY 93 N 0.53 0.33 0.99 5.37 0.00 -1.90 -0.11 103.07 108.28 2dwl h GLY 93 Ca 0.42 -0.08 -0.00 0.00 0.00 0.00 0.00 47.33 47.67 2dwl h GLY 93 CO -0.36 0.07 -0.02 -1.80 0.00 0.00 0.00 176.54 174.42 2dwl h ASP 94 N 0.25 -0.04 0.29 0.19 3.58 -1.66 -1.71 116.42 117.32 2dwl h ASP 94 Ca 0.10 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 2dwl h ASP 94 Cb 0.04 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.10 2dwl h ASP 94 CO -0.08 -0.02 -0.14 0.58 -2.88 0.00 0.00 179.24 176.70 2dwl h VAL 95 N -0.05 0.72 -0.42 2.25 2.07 -1.10 -1.95 116.25 117.76 2dwl h VAL 95 Ca -0.00 -0.02 0.08 0.00 0.82 0.00 0.00 66.70 67.57 2dwl h VAL 95 Cb 0.04 0.73 -0.07 0.00 -1.52 0.00 0.00 31.29 30.48 2dwl h VAL 95 CO 0.01 0.00 -0.01 -0.07 0.02 0.00 0.00 177.57 177.52 2dwl h LEU 96 N -0.40 -0.19 -0.09 2.57 3.38 -0.96 0.32 115.31 119.93 2dwl h LEU 96 Ca -0.04 0.10 -0.23 0.00 0.09 0.00 0.00 57.88 57.80 2dwl h LEU 96 Cb 0.31 0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.25 2dwl h LEU 96 CO 0.07 -0.06 -0.86 -0.26 0.09 0.00 0.00 178.44 177.42 2dwl h PHE 97 N 0.10 1.04 0.00 1.13 -1.00 -1.32 -0.54 116.94 116.35 2dwl h PHE 97 Ca 0.21 -0.50 -0.00 0.00 2.81 0.00 0.00 57.97 60.48 2dwl h PHE 97 Cb 0.30 -0.14 -0.00 0.00 3.61 0.00 0.00 35.95 39.71 2dwl h PHE 97 CO -0.28 1.33 -0.01 0.45 -1.61 0.00 0.00 178.31 178.19 2dwl h HIS 98 N 0.46 0.00 0.00 -0.55 3.86 -1.24 -2.84 115.15 114.84 2dwl h HIS 98 Ca -0.08 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.10 2dwl h HIS 98 Cb 1.50 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.96 2dwl h HIS 98 CO 0.10 0.01 -0.89 0.00 0.86 0.00 0.00 177.93 178.01 2dwl h ALA 99 N 1.99 0.60 0.17 2.45 0.00 -0.05 -3.40 119.26 121.03 2dwl h ALA 99 Ca -0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 2dwl h ALA 99 Cb 0.55 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2dwl h ALA 99 CO 0.00 0.14 -0.08 1.25 0.00 0.00 0.00 179.25 180.56 2dwl h LEU 100 N 0.00 -0.20 0.08 0.00 5.85 -0.84 -3.00 115.31 117.20 2dwl h LEU 100 Ca -0.02 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2dwl h LEU 100 Cb 1.09 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.16 2dwl h LEU 100 CO 0.01 -0.09 -0.11 -0.65 -0.34 0.00 0.00 178.44 177.26 2dwl h PRO 101 N -0.28 -0.18 -1.46 5.25 0.11 -1.77 -2.06 132.00 131.61 2dwl h PRO 101 Ca -0.02 0.01 0.47 0.00 0.11 0.00 0.00 66.00 66.57 2dwl h PRO 101 Cb 0.22 0.04 -0.12 0.00 0.11 0.00 0.00 31.00 31.25 2dwl h PRO 101 CO 0.04 -0.12 0.97 0.82 -0.21 0.00 0.00 178.00 179.50 2dwl h ILE 102 N -0.19 0.08 -0.21 4.15 5.03 -1.78 0.35 117.51 124.94 2dwl h ILE 102 Ca -0.01 -0.02 -0.03 0.00 -0.12 0.00 0.00 64.86 64.68 2dwl h ILE 102 Cb 0.17 0.03 -0.01 0.00 -3.03 0.00 0.00 36.82 33.99 2dwl h ILE 102 CO -0.03 0.01 -0.01 -0.07 -0.68 0.00 0.00 178.15 177.37 2dwl h LEU 103 N 0.05 0.36 -0.12 1.44 3.38 -1.24 -3.53 115.31 115.65 2dwl h LEU 103 Ca 0.85 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 58.50 2dwl h LEU 103 Cb 2.87 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 43.52 2dwl h LEU 103 CO -0.34 0.59 0.00 0.18 0.09 0.00 0.00 178.44 178.97