#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hze s THR 3 N 0.00 4.01 -0.18 0.00 2.01 -1.26 -1.01 115.64 119.21 3hze s THR 3 Ca 0.00 -0.31 -0.03 0.00 0.31 0.00 0.00 61.69 61.65 3hze s THR 3 Cb 0.00 -2.77 -0.02 0.00 0.01 0.00 0.00 72.50 69.72 3hze s THR 3 CO 0.00 0.48 -0.05 -0.31 -0.69 0.00 0.00 174.62 174.05 3hze s TYR 4 N 0.46 2.97 0.10 4.92 2.02 0.32 -4.47 117.35 123.67 3hze s TYR 4 Ca -0.02 -0.60 -0.00 0.00 -0.37 0.00 0.00 57.07 56.07 3hze s TYR 4 Cb -0.14 -2.02 -0.04 0.00 -0.40 0.00 0.00 41.96 39.36 3hze s TYR 4 CO 0.02 -0.28 0.26 0.71 -1.57 0.00 0.00 175.55 174.70 3hze s TYR 5 N 0.87 3.50 0.08 2.71 2.02 0.93 -1.41 117.35 126.05 3hze s TYR 5 Ca -0.01 0.26 -0.20 0.00 -0.37 0.00 0.00 57.07 56.75 3hze s TYR 5 Cb -0.15 -1.78 0.05 0.00 -0.40 0.00 0.00 41.96 39.69 3hze s TYR 5 CO 0.01 0.53 0.48 1.52 -1.57 0.00 0.00 175.55 176.52 3hze s TYR 6 N -1.62 -0.35 0.09 2.71 -0.85 -0.22 -0.99 117.35 116.13 3hze s TYR 6 Ca 0.36 0.26 0.10 0.00 -0.52 0.00 0.00 57.07 57.26 3hze s TYR 6 Cb -0.12 0.32 -0.04 0.00 0.38 0.00 0.00 41.96 42.50 3hze s TYR 6 CO 0.28 -0.67 -0.24 0.96 -1.52 0.00 0.00 175.55 174.36 3hze s ILE 7 N -2.94 2.38 0.00 -3.49 -4.36 -0.68 -1.38 121.20 110.73 3hze s ILE 7 Ca -0.02 -1.54 0.02 0.00 -0.26 0.00 0.00 60.65 58.84 3hze s ILE 7 Cb -0.00 -2.02 -0.01 0.00 1.25 0.00 0.00 42.46 41.69 3hze s ILE 7 CO -0.06 0.21 -0.06 -0.22 0.24 0.00 0.00 174.94 175.05 3hze s LEU 8 N -1.74 2.04 0.00 0.37 2.96 0.12 -2.05 118.68 120.38 3hze s LEU 8 Ca 0.14 -0.15 -0.18 0.00 -0.22 0.00 0.00 54.13 53.72 3hze s LEU 8 Cb -0.10 -0.26 0.07 0.00 0.50 0.00 0.00 46.19 46.39 3hze s LEU 8 CO 0.05 0.03 0.90 0.00 -1.32 0.00 0.00 176.35 176.02 3hze n ALA 9 N 2.77 -2.22 -1.78 5.97 0.00 -0.98 -0.55 120.51 123.72 3hze n ALA 9 Ca -0.14 -1.11 -0.36 0.00 0.00 0.00 0.00 53.44 51.83 3hze n ALA 9 Cb 0.58 0.75 -0.02 0.00 0.00 0.00 0.00 19.45 20.76 3hze n ALA 9 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3hze s SER 10 N -3.22 6.21 0.39 0.00 1.04 -1.26 -1.10 113.70 115.77 3hze s SER 10 Ca 0.19 2.13 0.06 0.00 0.48 0.00 0.00 55.95 58.81 3hze s SER 10 Cb -0.04 -2.58 0.79 0.00 0.10 0.00 0.00 66.02 64.29 3hze s SER 10 CO 0.08 -0.88 2.03 0.50 0.98 0.00 0.00 173.24 175.95 3hze h LYS 11 N 1.80 0.59 -0.12 4.02 3.64 -0.53 -2.20 116.57 123.76 3hze h LYS 11 Ca -0.49 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.84 3hze h LYS 11 Cb 1.24 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.93 3hze h LYS 11 CO 0.59 0.41 0.07 -0.22 -2.27 0.00 0.00 179.45 178.04 3hze h LYS 12 N 0.60 0.17 -0.69 1.90 3.64 -1.91 0.16 116.57 120.44 3hze h LYS 12 Ca 0.16 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 3hze h LYS 12 Cb -0.02 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 3hze h LYS 12 CO -0.03 0.16 0.40 0.35 -2.27 0.00 0.00 179.45 178.06 3hze h PHE 13 N 0.13 0.92 -0.13 1.91 3.04 -1.74 -0.55 116.94 120.52 3hze h PHE 13 Ca 0.04 -0.01 -0.17 0.00 3.98 0.00 0.00 57.97 61.81 3hze h PHE 13 Cb 0.04 -0.30 -0.00 0.00 2.56 0.00 0.00 35.95 38.24 3hze h PHE 13 CO -0.05 0.63 -0.64 -0.07 -2.02 0.00 0.00 178.31 176.16 3hze h LEU 14 N 0.94 0.56 -0.12 0.59 3.38 -1.30 -3.23 115.31 116.13 3hze h LEU 14 Ca 0.25 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3hze h LEU 14 Cb -0.00 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3hze h LEU 14 CO -0.04 1.06 0.01 0.74 0.09 0.00 0.00 178.44 180.29 3hze h THR 15 N 0.36 1.24 -2.96 0.22 2.02 -0.45 -3.41 112.91 109.93 3hze h THR 15 Ca -0.01 -0.76 0.00 0.00 0.77 0.00 0.00 66.41 66.40 3hze h THR 15 Cb 1.20 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 69.12 3hze h THR 15 CO 0.12 0.22 0.00 -0.62 0.37 0.00 0.00 175.52 175.61 3hze n GLU 16 N -4.81 0.86 0.00 6.66 1.02 -0.23 -4.71 120.64 119.43 3hze n GLU 16 Ca -0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.08 3hze n GLU 16 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.61 3hze n GLU 16 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3hze n GLU 17 N -0.81 0.00 -3.86 3.49 4.71 -1.26 -4.81 120.64 118.09 3hze n GLU 17 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 3hze n GLU 17 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 31.44 30.39 3hze n GLU 17 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 3hze s GLU 18 N 0.00 3.48 -1.29 3.49 0.41 -1.26 -4.99 118.70 118.54 3hze s GLU 18 Ca 0.00 -0.38 -0.08 0.00 -0.41 0.00 0.00 54.97 54.10 3hze s GLU 18 Cb 0.00 -2.99 -0.06 0.00 -1.78 0.00 0.00 34.13 29.31 3hze s GLU 18 CO 0.00 0.56 2.91 -0.35 -0.49 0.00 0.00 175.26 177.89 3hze n PRO 19 N 0.13 3.64 -0.31 0.39 -0.04 -1.26 -4.67 135.00 132.88 3hze n PRO 19 Ca -0.05 -2.35 0.06 0.00 -0.04 0.00 0.00 63.50 61.12 3hze n PRO 19 Cb 0.52 -2.62 0.21 0.00 -0.04 0.00 0.00 33.50 31.56 3hze n PRO 19 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3hze h LEU 20 N 6.24 0.70 -0.54 1.53 7.12 -1.91 -1.82 115.31 126.63 3hze h LEU 20 Ca 0.72 0.06 0.03 0.00 0.13 0.00 0.00 57.88 58.83 3hze h LEU 20 Cb 0.47 -0.07 -0.04 0.00 -0.53 0.00 0.00 40.66 40.49 3hze h LEU 20 CO 1.47 0.36 0.32 -0.08 -0.13 0.00 0.00 178.44 180.38 3hze h GLU 21 N 0.79 0.61 -0.63 1.25 4.81 -1.94 -0.99 114.58 118.49 3hze h GLU 21 Ca 0.45 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.59 3hze h GLU 21 Cb 0.50 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 3hze h GLU 21 CO -0.29 0.40 0.19 1.49 -0.73 0.00 0.00 179.01 180.07 3hze h GLU 22 N 0.63 0.98 -0.34 1.92 4.57 -1.77 -0.99 114.58 119.58 3hze h GLU 22 Ca 0.22 -0.21 0.02 0.00 -1.18 0.00 0.00 59.36 58.21 3hze h GLU 22 Cb 0.04 -0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 3hze h GLU 22 CO -0.11 0.87 0.17 0.28 -1.18 0.00 0.00 179.01 179.04 3hze h VAL 23 N 0.90 0.98 -0.01 0.32 2.07 -0.72 -1.11 116.25 118.70 3hze h VAL 23 Ca 0.20 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.60 3hze h VAL 23 Cb 0.30 0.61 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 3hze h VAL 23 CO -0.01 0.06 -0.00 -0.26 0.02 0.00 0.00 177.57 177.39 3hze h PHE 24 N 0.35 0.02 -0.93 1.57 -1.00 -1.00 -2.68 116.94 113.26 3hze h PHE 24 Ca 0.14 -0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.91 3hze h PHE 24 Cb 0.06 -0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.57 3hze h PHE 24 CO -0.10 0.41 0.56 0.00 -1.61 0.00 0.00 178.31 177.57 3hze h ARG 25 N -0.38 1.27 -0.45 1.51 3.08 -1.14 -0.46 114.38 117.81 3hze h ARG 25 Ca 0.00 -0.12 -0.09 0.00 0.07 0.00 0.00 59.98 59.84 3hze h ARG 25 Cb 0.40 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3hze h ARG 25 CO 0.00 0.89 -0.08 1.49 -1.07 0.00 0.00 179.97 181.20 3hze h GLU 26 N 1.29 0.84 -0.38 0.04 4.22 -1.25 -0.40 114.58 118.94 3hze h GLU 26 Ca 0.33 -0.31 -0.13 0.00 0.08 0.00 0.00 59.36 59.34 3hze h GLU 26 Cb -0.05 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 3hze h GLU 26 CO -0.06 0.94 -0.27 -0.09 -2.18 0.00 0.00 179.01 177.34 3hze h ARG 27 N 0.68 0.80 -0.41 1.92 2.43 -1.24 -0.71 114.38 117.85 3hze h ARG 27 Ca 0.12 -0.35 -0.03 0.00 -0.81 0.00 0.00 59.98 58.90 3hze h ARG 27 Cb 0.61 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 3hze h ARG 27 CO 0.04 0.98 0.13 1.96 -1.51 0.00 0.00 179.97 181.57 3hze h GLN 28 N 0.69 0.63 -0.58 0.20 4.20 -0.92 -0.01 115.11 119.31 3hze h GLN 28 Ca 0.08 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.61 3hze h GLN 28 Cb 0.81 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.47 3hze h GLN 28 CO 0.07 0.62 0.18 0.00 -0.67 0.00 0.00 178.83 179.03 3hze h ARG 29 N 0.52 0.91 -0.57 1.46 3.08 -0.92 -1.35 114.38 117.49 3hze h ARG 29 Ca 0.13 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3hze h ARG 29 Cb 0.25 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 3hze h ARG 29 CO -0.01 0.82 0.32 1.25 -1.07 0.00 0.00 179.97 181.28 3hze h HIS 30 N 0.82 0.79 -0.14 3.04 2.76 -0.93 -1.51 115.15 119.98 3hze h HIS 30 Ca 0.19 -0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.34 3hze h HIS 30 Cb 0.29 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 28.99 3hze h HIS 30 CO 0.02 0.57 0.08 1.88 -1.30 0.00 0.00 177.93 179.18 3hze h TYR 31 N 0.77 0.14 -0.50 5.26 -1.99 -0.71 -2.41 116.97 117.53 3hze h TYR 31 Ca 0.20 0.01 0.05 0.00 2.00 0.00 0.00 58.73 60.99 3hze h TYR 31 Cb 0.04 -0.04 -0.03 0.00 2.00 0.00 0.00 36.73 38.70 3hze h TYR 31 CO -0.01 0.09 0.33 0.00 -0.00 0.00 0.00 178.16 178.57 3hze h ARG 32 N 0.16 0.45 0.00 4.88 3.08 -0.94 -0.04 114.38 121.98 3hze h ARG 32 Ca 0.05 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 3hze h ARG 32 Cb -0.00 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 29.94 3hze h ARG 32 CO -0.03 0.30 -0.09 0.93 -1.07 0.00 0.00 179.97 180.01 3hze h GLU 33 N 0.47 0.00 -0.01 0.04 5.08 -0.80 -2.87 114.58 116.48 3hze h GLU 33 Ca 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3hze h GLU 33 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3hze h GLU 33 CO -0.06 0.09 -0.53 1.04 -1.00 0.00 0.00 179.01 178.55 3hze n GLN 34 N -3.21 1.09 -1.35 2.33 6.02 -0.16 -4.96 117.38 117.15 3hze n GLN 34 Ca 0.01 -0.89 -0.07 0.00 -0.01 0.00 0.00 57.00 56.04 3hze n GLN 34 Cb 0.38 -1.48 -0.02 0.00 1.02 0.00 0.00 30.24 30.14 3hze n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hze n GLY 35 N 1.43 0.75 3.79 1.08 0.00 -0.43 -5.01 105.19 106.79 3hze n GLY 35 Ca 0.09 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 45.01 3hze n GLY 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hze s LYS 36 N -2.86 3.99 0.29 1.61 1.02 -0.70 -5.02 119.74 118.06 3hze s LYS 36 Ca 0.00 0.10 -0.29 0.00 0.02 0.00 0.00 55.97 55.80 3hze s LYS 36 Cb 0.00 -3.32 -0.10 0.00 -0.52 0.00 0.00 37.83 33.89 3hze s LYS 36 CO 0.00 0.47 1.20 -1.83 -0.92 0.00 0.00 175.35 174.27 3hze s GLU 37 N -0.24 4.51 0.20 1.68 -1.05 -1.26 -4.31 118.70 118.23 3hze s GLU 37 Ca 0.17 1.98 -0.32 0.00 -0.15 0.00 0.00 54.97 56.65 3hze s GLU 37 Cb -0.14 -3.15 -0.13 0.00 -0.44 0.00 0.00 34.13 30.28 3hze s GLU 37 CO 0.06 0.01 1.66 -0.89 0.95 0.00 0.00 175.26 177.05 3hze n ILE 38 N 1.20 0.13 -1.96 1.83 2.08 -1.26 -4.89 119.36 116.50 3hze n ILE 38 Ca 0.00 -0.03 0.04 0.00 0.56 0.00 0.00 62.75 63.32 3hze n ILE 38 Cb 0.43 -1.83 0.08 0.00 -0.75 0.00 0.00 39.64 37.57 3hze n ILE 38 CO 0.00 0.00 0.00 -0.90 0.56 0.00 0.00 176.55 176.21 3hze n ASP 39 N 3.57 1.13 -3.90 4.38 5.68 -1.26 -5.03 116.55 121.11 3hze n ASP 39 Ca 0.15 -2.61 -0.14 0.00 -0.50 0.00 0.00 54.79 51.69 3hze n ASP 39 Cb 0.33 -0.35 -0.14 0.00 -1.14 0.00 0.00 41.12 39.82 3hze n ASP 39 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 3hze s PHE 40 N -1.19 0.19 0.01 2.11 -0.71 -1.26 -2.12 117.98 115.01 3hze s PHE 40 Ca 0.27 -0.03 -0.06 0.00 -1.04 0.00 0.00 56.93 56.07 3hze s PHE 40 Cb 0.28 -0.13 -0.00 0.00 -1.21 0.00 0.00 43.02 41.96 3hze s PHE 40 CO -0.08 -0.01 0.10 -1.58 -1.34 0.00 0.00 175.22 172.32 3hze s TRP 41 N -0.02 0.11 -0.14 3.49 0.51 0.83 -4.99 118.94 118.72 3hze s TRP 41 Ca 0.00 -0.27 -0.20 0.00 -2.12 0.00 0.00 56.10 53.52 3hze s TRP 41 Cb -0.01 -0.09 -0.04 0.00 -0.81 0.00 0.00 33.47 32.53 3hze s TRP 41 CO -0.00 -0.29 0.57 -1.17 -0.51 0.00 0.00 176.95 175.55 3hze s LEU 42 N -1.55 4.23 -0.43 2.99 2.96 -1.26 -1.29 118.68 124.32 3hze s LEU 42 Ca -0.13 0.87 0.02 0.00 -0.22 0.00 0.00 54.13 54.67 3hze s LEU 42 Cb -0.07 -2.82 0.13 0.00 0.50 0.00 0.00 46.19 43.93 3hze s LEU 42 CO -0.00 -0.12 0.23 -0.69 -1.32 0.00 0.00 176.35 174.45 3hze s VAL 43 N 1.13 1.42 0.42 1.68 1.01 0.67 -4.98 120.40 121.74 3hze s VAL 43 Ca 0.29 -2.50 -0.24 0.00 0.00 0.00 0.00 61.98 59.52 3hze s VAL 43 Cb -0.16 -2.00 -0.08 0.00 0.00 0.00 0.00 36.38 34.14 3hze s VAL 43 CO 0.12 -0.87 1.17 -2.16 0.00 0.00 0.00 175.10 173.36 3hze s PRO 44 N 0.42 3.95 -1.17 2.72 0.04 -1.26 -0.65 135.00 139.05 3hze s PRO 44 Ca 0.17 1.82 -0.30 0.00 0.04 0.00 0.00 61.00 62.74 3hze s PRO 44 Cb -0.24 -2.58 0.03 0.00 0.04 0.00 0.00 34.50 31.75 3hze s PRO 44 CO -0.01 -0.40 0.71 0.39 0.04 0.00 0.00 177.00 177.73 3hze n GLU 45 N -0.12 -0.55 -1.68 4.56 1.02 0.35 -3.89 120.64 120.33 3hze n GLU 45 Ca 0.05 0.21 -0.44 0.00 -0.02 0.00 0.00 57.16 56.96 3hze n GLU 45 Cb 0.47 -2.93 -0.03 0.00 -0.02 0.00 0.00 31.44 28.93 3hze n GLU 45 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 3hze n PRO 46 N -4.70 2.16 0.05 3.49 -0.04 -1.24 -0.75 135.00 133.98 3hze n PRO 46 Ca -0.11 0.77 -0.06 0.00 -0.04 0.00 0.00 63.50 64.05 3hze n PRO 46 Cb 0.57 -2.47 0.11 0.00 -0.04 0.00 0.00 33.50 31.67 3hze n PRO 46 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hze h ALA 47 N 4.60 0.82 -0.38 0.55 0.00 -1.54 -3.17 119.26 120.14 3hze h ALA 47 Ca -0.45 -0.51 0.06 0.00 0.00 0.00 0.00 54.91 54.01 3hze h ALA 47 Cb 1.26 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 3hze h ALA 47 CO 0.79 0.69 0.26 0.27 0.00 0.00 0.00 179.25 181.26 3hze h PHE 48 N 0.28 0.25 0.00 0.00 -5.15 -1.87 -0.23 116.94 110.22 3hze h PHE 48 Ca 0.00 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.78 3hze h PHE 48 Cb 1.06 -0.08 0.00 0.00 0.22 0.00 0.00 35.95 37.15 3hze h PHE 48 CO 0.03 0.13 0.00 1.25 -2.00 0.00 0.00 178.31 177.73 3hze h LEU 49 N 0.25 0.00 -0.35 2.10 5.85 -1.92 -0.65 115.31 120.59 3hze h LEU 49 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3hze h LEU 49 Cb 0.35 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.38 3hze h LEU 49 CO -0.03 0.00 -0.45 -0.62 -0.34 0.00 0.00 178.44 177.00 3hze n GLU 50 N -2.30 0.53 -2.77 1.25 -0.58 -0.10 -4.61 120.64 112.08 3hze n GLU 50 Ca -0.02 -0.35 -0.33 0.00 -0.42 0.00 0.00 57.16 56.04 3hze n GLU 50 Cb 0.04 -1.49 -0.06 0.00 -0.57 0.00 0.00 31.44 29.35 3hze n GLU 50 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3hze s GLN 51 N -2.71 4.15 0.29 3.49 -0.21 -0.25 -4.96 119.66 119.46 3hze s GLN 51 Ca 0.17 1.17 0.04 0.00 0.02 0.00 0.00 55.36 56.76 3hze s GLN 51 Cb 0.18 -2.17 0.67 0.00 1.00 0.00 0.00 33.01 32.70 3hze s GLN 51 CO 0.62 -0.11 1.76 -1.35 -2.12 0.00 0.00 175.29 174.10 3hze h PRO 52 N 1.85 0.67 0.00 2.91 0.11 -1.91 -1.16 132.00 134.48 3hze h PRO 52 Ca -0.49 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3hze h PRO 52 Cb 1.19 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3hze h PRO 52 CO 0.61 0.44 0.00 0.37 -0.21 0.00 0.00 178.00 179.21 3hze h GLN 53 N 0.69 0.00 -0.30 1.05 4.15 -1.92 -1.86 115.11 116.92 3hze h GLN 53 Ca 0.54 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.96 3hze h GLN 53 Cb 0.84 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.53 3hze h GLN 53 CO -0.39 0.00 0.00 1.19 -1.93 0.00 0.00 178.83 177.70 3hze n PHE 54 N -2.71 0.59 -0.31 3.99 3.72 -0.44 -4.71 117.46 117.59 3hze n PHE 54 Ca -0.02 -0.63 0.09 0.00 -0.05 0.00 0.00 57.45 56.84 3hze n PHE 54 Cb 0.06 -0.12 0.30 0.00 -0.94 0.00 0.00 39.48 38.78 3hze n PHE 54 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3hze h ALA 55 N 1.83 1.66 -0.16 4.37 0.00 -1.32 -0.25 119.26 125.39 3hze h ALA 55 Ca 0.00 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 3hze h ALA 55 Cb 0.95 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 3hze h ALA 55 CO 0.07 0.11 -0.53 0.93 0.00 0.00 0.00 179.25 179.83 3hze h GLU 56 N 0.86 0.45 -0.41 0.00 5.08 -1.84 -2.00 114.58 116.72 3hze h GLU 56 Ca 0.46 -0.27 -0.09 0.00 -1.00 0.00 0.00 59.36 58.45 3hze h GLU 56 Cb 0.56 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3hze h GLU 56 CO -0.23 0.87 -0.12 1.96 -1.00 0.00 0.00 179.01 180.50 3hze h GLN 57 N 0.35 0.80 -0.47 2.33 1.08 -1.61 -2.80 115.11 114.80 3hze h GLN 57 Ca 0.01 -0.31 -0.02 0.00 -1.45 0.00 0.00 58.65 56.87 3hze h GLN 57 Cb 1.05 -0.04 -0.02 0.00 -0.05 0.00 0.00 27.48 28.41 3hze h GLN 57 CO 0.09 0.93 0.20 -0.22 -0.95 0.00 0.00 178.83 178.89 3hze h LYS 58 N 0.62 0.66 -0.19 1.46 3.64 -0.94 -2.16 116.57 119.65 3hze h LYS 58 Ca 0.10 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 3hze h LYS 58 Cb 0.65 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 3hze h LYS 58 CO 0.04 0.53 -0.33 0.00 -2.27 0.00 0.00 179.45 177.42 3hze h ALA 59 N 1.57 1.08 -0.01 5.00 0.00 -1.20 -2.97 119.26 122.73 3hze h ALA 59 Ca 0.16 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3hze h ALA 59 Cb 0.11 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3hze h ALA 59 CO -0.02 0.57 -0.05 0.54 0.00 0.00 0.00 179.25 180.30 3hze n ARG 60 N -4.08 1.34 -4.05 0.00 1.74 -0.86 -4.82 116.66 105.93 3hze n ARG 60 Ca -0.01 -0.67 -0.34 0.00 -0.77 0.00 0.00 57.85 56.07 3hze n ARG 60 Cb 0.44 -1.49 -0.15 0.00 -1.02 0.00 0.00 32.46 30.24 3hze n ARG 60 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3hze s PRO 62 N 1.35 3.67 0.07 0.00 0.04 -1.26 -4.91 135.00 133.96 3hze s PRO 62 Ca 0.05 2.16 0.02 0.00 0.04 0.00 0.00 61.00 63.28 3hze s PRO 62 Cb -0.13 -2.55 -0.04 0.00 0.04 0.00 0.00 34.50 31.82 3hze s PRO 62 CO -0.10 -0.74 0.09 -1.14 0.04 0.00 0.00 177.00 175.14 3hze s GLN 63 N -2.53 2.93 0.37 4.56 2.00 -1.26 -3.73 119.66 122.00 3hze s GLN 63 Ca 0.63 -0.65 -0.27 0.00 -2.00 0.00 0.00 55.36 53.07 3hze s GLN 63 Cb -0.38 -2.76 -0.09 0.00 0.80 0.00 0.00 33.01 30.58 3hze s GLN 63 CO 0.48 0.58 1.24 -2.14 -0.50 0.00 0.00 175.29 174.94 3hze s PRO 64 N -2.32 4.16 0.47 1.67 0.02 -1.26 -4.98 135.00 132.77 3hze s PRO 64 Ca 0.29 2.03 0.08 0.00 0.02 0.00 0.00 61.00 63.42 3hze s PRO 64 Cb -0.12 -2.85 0.03 0.00 0.02 0.00 0.00 34.50 31.58 3hze s PRO 64 CO 0.21 -0.29 0.59 0.00 -0.33 0.00 0.00 177.00 177.19 3hze s ALA 65 N -1.27 4.50 -0.08 -1.55 0.00 -1.24 0.12 121.76 122.24 3hze s ALA 65 Ca 0.54 -1.82 -0.19 0.00 0.00 0.00 0.00 51.96 50.48 3hze s ALA 65 Cb -0.35 -1.41 0.04 0.00 0.00 0.00 0.00 23.12 21.40 3hze s ALA 65 CO 0.45 -0.45 0.46 0.00 0.00 0.00 0.00 175.76 176.22 3hze s ALA 66 N -2.49 -1.16 0.13 0.00 0.00 -0.26 -0.50 121.76 117.48 3hze s ALA 66 Ca 0.54 0.90 0.06 0.00 0.00 0.00 0.00 51.96 53.47 3hze s ALA 66 Cb -0.07 -0.22 -0.04 0.00 0.00 0.00 0.00 23.12 22.80 3hze s ALA 66 CO 0.33 -0.28 -0.15 0.00 0.00 0.00 0.00 175.76 175.66 3hze s ALA 67 N -0.79 1.59 -0.17 0.00 0.00 0.18 -2.32 121.76 120.24 3hze s ALA 67 Ca -0.09 -1.31 0.01 0.00 0.00 0.00 0.00 51.96 50.57 3hze s ALA 67 Cb -0.03 -0.11 0.01 0.00 0.00 0.00 0.00 23.12 22.99 3hze s ALA 67 CO 0.05 0.15 -0.19 0.42 0.00 0.00 0.00 175.76 176.19 3hze s ILE 68 N -2.01 2.23 0.06 0.00 1.01 -0.87 -0.24 121.20 121.38 3hze s ILE 68 Ca 0.09 -0.89 0.09 0.00 0.00 0.00 0.00 60.65 59.94 3hze s ILE 68 Cb -0.06 -1.93 -0.03 0.00 0.01 0.00 0.00 42.46 40.45 3hze s ILE 68 CO 0.04 0.53 -0.26 -0.63 0.00 0.00 0.00 174.94 174.62 3hze s ILE 69 N 1.16 2.09 -0.03 2.92 1.01 -0.41 -1.69 121.20 126.25 3hze s ILE 69 Ca 0.02 -1.44 -0.28 0.00 0.00 0.00 0.00 60.65 58.94 3hze s ILE 69 Cb -0.14 -1.81 0.06 0.00 0.01 0.00 0.00 42.46 40.59 3hze s ILE 69 CO -0.09 0.29 0.62 -0.55 0.00 0.00 0.00 174.94 175.21 3hze s SER 70 N -1.40 -0.59 0.00 3.58 0.15 -0.16 -0.12 113.70 115.15 3hze s SER 70 Ca 0.12 0.58 0.27 0.00 0.70 0.00 0.00 55.95 57.62 3hze s SER 70 Cb -0.10 0.51 1.03 0.00 -1.71 0.00 0.00 66.02 65.75 3hze s SER 70 CO 0.03 -0.61 1.73 0.35 1.20 0.00 0.00 173.24 175.93 3hze n THR 71 N 0.87 0.02 -3.71 6.45 -2.24 -0.90 -0.05 114.28 114.72 3hze n THR 71 Ca -0.19 -0.26 -0.38 0.00 -2.27 0.00 0.00 64.05 60.95 3hze n THR 71 Cb 0.57 0.48 -0.11 0.00 -2.10 0.00 0.00 70.33 69.17 3hze n THR 71 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3hze s ASN 72 N -1.96 5.40 0.61 3.42 3.84 -1.26 -4.88 114.94 120.12 3hze s ASN 72 Ca 0.38 -1.46 0.39 0.00 0.21 0.00 0.00 52.86 52.38 3hze s ASN 72 Cb 0.21 -1.90 1.97 0.00 -0.55 0.00 0.00 41.25 40.98 3hze s ASN 72 CO 0.33 -0.45 2.21 -0.61 -2.79 0.00 0.00 177.10 175.79 3hze h GLN 73 N 8.25 0.00 -0.51 0.43 4.15 -1.96 -3.00 115.11 122.47 3hze h GLN 73 Ca -0.21 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.25 3hze h GLN 73 Cb 1.07 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.72 3hze h GLN 73 CO 0.68 0.01 0.26 0.37 -1.93 0.00 0.00 178.83 178.22 3hze h GLN 74 N 0.00 0.50 -0.54 1.69 -0.00 -1.97 -0.61 115.11 114.18 3hze h GLN 74 Ca -0.00 -0.03 -0.04 0.00 -0.00 0.00 0.00 58.65 58.58 3hze h GLN 74 Cb 0.21 -0.11 -0.02 0.00 0.00 0.00 0.00 27.48 27.56 3hze h GLN 74 CO 0.00 0.33 0.17 0.35 0.00 0.00 0.00 178.83 179.68 3hze h PHE 75 N 0.51 0.87 -0.53 3.99 3.57 -1.96 -1.97 116.94 121.42 3hze h PHE 75 Ca 0.22 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 3hze h PHE 75 Cb 0.12 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.59 3hze h PHE 75 CO -0.10 0.74 0.16 0.82 -2.23 0.00 0.00 178.31 177.70 3hze h ILE 76 N 0.75 1.24 -0.47 1.41 1.08 -1.57 -1.38 117.51 118.56 3hze h ILE 76 Ca 0.17 -0.80 -0.02 0.00 -0.39 0.00 0.00 64.86 63.82 3hze h ILE 76 Cb 0.28 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 34.76 3hze h ILE 76 CO -0.01 0.30 0.22 -0.61 -0.69 0.00 0.00 178.15 177.37 3hze h GLN 77 N 0.74 0.69 -0.72 2.37 5.75 -1.01 -0.09 115.11 122.84 3hze h GLN 77 Ca 0.17 -0.10 0.00 0.00 -0.15 0.00 0.00 58.65 58.57 3hze h GLN 77 Cb 0.29 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.68 3hze h GLN 77 CO -0.00 0.58 0.46 2.35 -2.65 0.00 0.00 178.83 179.57 3hze h TRP 78 N 0.62 0.92 -0.43 3.99 7.01 -1.17 -0.67 115.95 126.22 3hze h TRP 78 Ca 0.16 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.14 3hze h TRP 78 Cb 0.13 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 26.86 3hze h TRP 78 CO -0.01 0.59 0.14 -0.07 -2.79 0.00 0.00 178.44 176.31 3hze h LEU 79 N 0.97 0.63 -0.53 0.65 3.38 -0.89 -1.31 115.31 118.22 3hze h LEU 79 Ca 0.26 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hze h LEU 79 Cb -0.08 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.48 3hze h LEU 79 CO -0.05 0.66 0.34 0.50 0.09 0.00 0.00 178.44 179.98 3hze h LYS 80 N 0.56 0.70 -0.56 1.13 1.63 -0.64 0.17 116.57 119.55 3hze h LYS 80 Ca 0.14 -0.05 -0.05 0.00 -0.85 0.00 0.00 60.65 59.85 3hze h LYS 80 Cb 0.26 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 31.71 3hze h LYS 80 CO -0.01 0.47 0.17 -0.07 -3.45 0.00 0.00 179.45 176.56 3hze h LEU 81 N 0.71 0.83 0.10 5.20 3.38 -0.95 0.32 115.31 124.90 3hze h LEU 81 Ca 0.19 -0.21 -0.28 0.00 0.09 0.00 0.00 57.88 57.67 3hze h LEU 81 Cb -0.07 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.47 3hze h LEU 81 CO -0.04 0.82 -1.24 0.03 0.09 0.00 0.00 178.44 178.10 3hze h ARG 82 N 0.79 0.40 0.04 1.13 2.47 -1.03 -3.34 114.38 114.84 3hze h ARG 82 Ca 0.18 -0.61 -0.27 0.00 -1.26 0.00 0.00 59.98 58.02 3hze h ARG 82 Cb 0.30 0.22 -0.03 0.00 -1.65 0.00 0.00 29.97 28.80 3hze h ARG 82 CO -0.00 1.27 -1.42 -0.07 0.56 0.00 0.00 179.97 180.31 3hze h LEU 83 N 0.14 0.12 0.00 3.04 4.07 -0.69 -3.48 115.31 118.51 3hze h LEU 83 Ca -0.16 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.63 3hze h LEU 83 Cb 1.94 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 43.64 3hze h LEU 83 CO 0.22 1.14 0.00 1.21 -1.08 0.00 0.00 178.44 179.93 3hze n GLU 84 N -3.28 0.00 -1.19 1.13 4.07 0.11 -4.56 120.64 116.94 3hze n GLU 84 Ca -0.11 0.00 -0.32 0.00 -0.06 0.00 0.00 57.16 56.67 3hze n GLU 84 Cb 1.01 0.00 -0.06 0.00 -0.06 0.00 0.00 31.44 32.33 3hze n GLU 84 CO 0.00 0.00 0.00 0.66 -0.06 0.00 0.00 177.13 177.73 3hze n TYR 85 N 0.00 1.83 -4.05 4.31 4.01 -1.26 -4.80 117.16 117.19 3hze n TYR 85 Ca 0.00 -2.65 -0.09 0.00 -0.16 0.00 0.00 57.90 54.99 3hze n TYR 85 Cb 0.00 -2.23 -0.09 0.00 -0.31 0.00 0.00 39.34 36.71 3hze n TYR 85 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 3hze s VAL 86 N 2.06 0.11 0.00 -0.72 -7.23 -1.26 -4.96 120.40 108.39 3hze s VAL 86 Ca 0.66 -1.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.17 3hze s VAL 86 Cb 0.20 -1.86 0.00 0.00 0.56 0.00 0.00 36.38 35.28 3hze s VAL 86 CO -0.05 -0.48 0.00 0.18 -0.31 0.00 0.00 175.10 174.45 3hze n LEU 87 N -0.11 0.00 0.00 1.32 4.77 0.29 -4.88 117.00 118.39 3hze n LEU 87 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 3hze n LEU 87 Cb 0.63 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.72 3hze n LEU 87 CO 0.27 -0.38 0.00 0.61 -1.33 0.00 0.00 177.39 176.56 3hze n GLY 89 N 5.00 -0.07 3.53 -0.72 0.00 -0.48 0.15 105.19 112.61 3hze n GLY 89 Ca 0.00 -1.55 -0.10 0.00 0.00 0.00 0.00 46.02 44.37 3hze n GLY 89 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hze s GLN 90 N -2.00 1.40 0.27 1.61 -2.07 -1.26 -1.05 119.66 116.55 3hze s GLN 90 Ca 0.00 -0.68 -0.21 0.00 -1.82 0.00 0.00 55.36 52.65 3hze s GLN 90 Cb 0.00 0.57 0.02 0.00 -1.09 0.00 0.00 33.01 32.51 3hze s GLN 90 CO 0.00 -0.61 0.71 -0.59 -1.32 0.00 0.00 175.29 173.48 3hze s PHE 91 N -3.82 -0.21 0.37 9.60 -0.12 -0.50 -5.00 117.98 118.31 3hze s PHE 91 Ca 0.05 -0.23 0.08 0.00 -0.05 0.00 0.00 56.93 56.78 3hze s PHE 91 Cb -0.02 0.69 -0.06 0.00 -0.63 0.00 0.00 43.02 43.01 3hze s PHE 91 CO -0.07 -1.21 0.09 0.95 -0.05 0.00 0.00 175.22 174.93 3hze s THR 92 N -3.91 2.48 0.38 -4.49 -4.23 -1.26 -0.52 115.64 104.08 3hze s THR 92 Ca 0.10 -1.85 0.06 0.00 -1.18 0.00 0.00 61.69 58.83 3hze s THR 92 Cb -0.06 -2.91 0.29 0.00 1.34 0.00 0.00 72.50 71.16 3hze s THR 92 CO 0.06 -0.10 1.99 0.28 -0.54 0.00 0.00 174.62 176.30 3hze h SER 93 N 1.64 0.61 1.00 3.99 0.02 -1.33 -0.59 113.55 118.89 3hze h SER 93 Ca -0.43 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 3hze h SER 93 Cb 1.25 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.66 3hze h SER 93 CO 0.69 0.40 0.00 -1.84 -1.14 0.00 0.00 176.83 174.95 3hze n GLU 94 N -4.47 0.14 -0.06 3.45 0.00 -1.26 -3.20 120.64 115.24 3hze n GLU 94 Ca 0.09 0.23 -0.09 0.00 0.00 0.00 0.00 57.16 57.38 3hze n GLU 94 Cb 0.19 -1.70 -0.15 0.00 0.00 0.00 0.00 31.44 29.78 3hze n GLU 94 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 3hze n GLU 95 N -1.95 0.66 -3.86 3.44 1.02 -0.31 -4.85 120.64 114.79 3hze n GLU 95 Ca 0.05 0.14 -0.29 0.00 -0.02 0.00 0.00 57.16 57.03 3hze n GLU 95 Cb 0.31 -1.65 -0.16 0.00 -0.02 0.00 0.00 31.44 29.92 3hze n GLU 95 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hze s VAL 96 N -2.55 1.16 0.16 2.62 1.01 -0.73 -4.99 120.40 117.07 3hze s VAL 96 Ca -0.07 -0.98 -0.26 0.00 0.00 0.00 0.00 61.98 60.67 3hze s VAL 96 Cb 0.07 -1.52 0.02 0.00 0.00 0.00 0.00 36.38 34.95 3hze s VAL 96 CO 0.83 -0.15 1.58 -0.65 0.00 0.00 0.00 175.10 176.71 3hze h PRO 97 N 8.06 -0.29 -3.12 2.72 0.11 -1.89 -3.29 132.00 134.31 3hze h PRO 97 Ca -0.17 0.02 -0.62 0.00 0.11 0.00 0.00 66.00 65.33 3hze h PRO 97 Cb 1.09 0.07 -0.41 0.00 0.11 0.00 0.00 31.00 31.85 3hze h PRO 97 CO 0.38 -0.19 -0.62 -0.80 -0.21 0.00 0.00 178.00 176.56 3hze s ASN 98 N -5.07 4.45 0.33 -2.05 -0.87 -1.26 -5.01 114.94 105.46 3hze s ASN 98 Ca -0.15 -3.53 0.11 0.00 -1.57 0.00 0.00 52.86 47.72 3hze s ASN 98 Cb 0.12 -1.54 0.99 0.00 -0.02 0.00 0.00 41.25 40.80 3hze s ASN 98 CO 0.66 -0.14 1.65 1.55 -2.57 0.00 0.00 177.10 178.26 3hze h PRO 99 N 5.76 0.27 -0.67 -0.60 0.13 -1.94 -1.75 132.00 133.19 3hze h PRO 99 Ca 0.09 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 3hze h PRO 99 Cb 0.81 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3hze h PRO 99 CO 0.68 0.18 0.00 1.28 -0.23 0.00 0.00 178.00 179.91 3hze n LEU 100 N -5.11 4.08 -4.71 1.56 4.77 -1.26 -4.80 117.00 111.53 3hze n LEU 100 Ca 0.29 -2.05 -0.43 0.00 -0.03 0.00 0.00 56.01 53.79 3hze n LEU 100 Cb 0.91 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 3hze n LEU 100 CO 0.08 0.85 1.29 0.00 -1.33 0.00 0.00 177.39 178.28 3hze n ALA 101 N 1.31 2.35 -2.47 -1.18 0.00 -0.66 -4.94 120.51 114.91 3hze n ALA 101 Ca 0.24 0.41 -0.33 0.00 0.00 0.00 0.00 53.44 53.76 3hze n ALA 101 Cb 0.71 -2.46 -0.14 0.00 0.00 0.00 0.00 19.45 17.56 3hze n ALA 101 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hze s SER 102 N 0.93 3.88 -0.13 0.00 0.15 -1.26 -1.40 113.70 115.88 3hze s SER 102 Ca 0.73 -0.24 0.18 0.00 0.70 0.00 0.00 55.95 57.32 3hze s SER 102 Cb -0.55 -0.80 0.75 0.00 -1.71 0.00 0.00 66.02 63.70 3hze s SER 102 CO 0.38 0.34 1.66 0.18 1.20 0.00 0.00 173.24 176.99 3hze n LEU 103 N 2.37 4.93 -4.75 3.45 4.77 0.07 -4.88 117.00 122.96 3hze n LEU 103 Ca -0.17 -2.49 -0.38 0.00 -0.03 0.00 0.00 56.01 52.94 3hze n LEU 103 Cb 0.52 -0.60 0.04 0.00 -2.33 0.00 0.00 43.42 41.06 3hze n LEU 103 CO 0.25 0.79 0.97 0.00 -1.33 0.00 0.00 177.39 178.08 3hze s ALA 104 N -1.96 2.75 -0.09 -1.18 0.00 -1.26 -4.93 121.76 115.10 3hze s ALA 104 Ca 0.52 1.31 0.09 0.00 0.00 0.00 0.00 51.96 53.88 3hze s ALA 104 Cb 0.34 -3.56 -0.13 0.00 0.00 0.00 0.00 23.12 19.77 3hze s ALA 104 CO 0.24 -1.40 0.22 0.45 0.00 0.00 0.00 175.76 175.27 3hze n SER 105 N -1.17 2.51 -4.53 0.00 2.88 -1.26 -5.00 113.62 107.05 3hze n SER 105 Ca 0.11 -0.13 -0.33 0.00 -1.33 0.00 0.00 58.87 57.19 3hze n SER 105 Cb 0.46 1.32 -0.12 0.00 -0.75 0.00 0.00 64.21 65.12 3hze n SER 105 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 3hze s VAL 106 N -2.45 3.44 0.41 2.46 0.11 -1.26 -5.12 120.40 117.99 3hze s VAL 106 Ca -0.02 -0.58 -0.04 0.00 -2.93 0.00 0.00 61.98 58.41 3hze s VAL 106 Cb 0.06 -2.38 -0.04 0.00 -1.53 0.00 0.00 36.38 32.48 3hze s VAL 106 CO 0.36 0.59 0.70 -0.22 -3.33 0.00 0.00 175.10 173.20 3hze s LEU 107 N -0.74 3.80 0.00 2.54 1.98 -1.26 -5.20 118.68 119.80 3hze s LEU 107 Ca 0.11 0.81 0.00 0.00 -2.89 0.00 0.00 54.13 52.16 3hze s LEU 107 Cb -0.11 -3.72 0.00 0.00 0.66 0.00 0.00 46.19 43.02 3hze s LEU 107 CO 0.01 -0.44 0.00 1.21 -1.89 0.00 0.00 176.35 175.24