#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mr8 n ARG 3 N 0.00 0.34 0.07 0.00 0.63 -1.26 -4.49 116.66 111.94 3mr8 n ARG 3 Ca 0.00 0.15 -0.13 0.00 -0.92 0.00 0.00 57.85 56.95 3mr8 n ARG 3 Cb 0.00 -1.06 -0.09 0.00 0.45 0.00 0.00 32.46 31.76 3mr8 n ARG 3 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 3mr8 h LYS 4 N -0.57 -0.20 0.00 -0.14 1.63 -2.00 -2.84 116.57 112.45 3mr8 h LYS 4 Ca -0.37 0.01 -0.01 0.00 -0.85 0.00 0.00 60.65 59.44 3mr8 h LYS 4 Cb 1.27 0.04 -0.00 0.00 -0.60 0.00 0.00 32.23 32.95 3mr8 h LYS 4 CO -0.22 0.19 -0.03 0.00 -3.45 0.00 0.00 179.45 175.94 3mr8 h ALA 5 N 0.10 1.20 0.17 5.00 0.00 -2.00 -2.66 119.26 121.07 3mr8 h ALA 5 Ca -0.02 -0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.61 3mr8 h ALA 5 Cb 0.47 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.29 3mr8 h ALA 5 CO 0.03 0.03 -1.12 1.25 0.00 0.00 0.00 179.25 179.45 3mr8 h LEU 6 N 0.00 0.69 -2.01 0.00 6.46 -1.77 -2.42 115.31 116.27 3mr8 h LEU 6 Ca -0.00 -0.90 -0.02 0.00 -0.12 0.00 0.00 57.88 56.83 3mr8 h LEU 6 Cb 0.13 -0.22 -0.00 0.00 -0.73 0.00 0.00 40.66 39.83 3mr8 h LEU 6 CO 0.00 1.54 -0.10 0.16 -0.62 0.00 0.00 178.44 179.42 3mr8 h ILE 7 N -0.05 0.55 0.16 4.05 -0.00 -1.23 -0.30 117.51 120.68 3mr8 h ILE 7 Ca -0.19 -0.44 -0.29 0.00 -0.00 0.00 0.00 64.86 63.94 3mr8 h ILE 7 Cb 1.86 1.29 0.01 0.00 -0.00 0.00 0.00 36.82 39.98 3mr8 h ILE 7 CO 0.21 0.10 -1.33 -0.08 -0.00 0.00 0.00 178.15 177.04 3mr8 h GLU 8 N 0.00 0.34 0.00 0.16 4.57 -1.55 -3.28 114.58 114.82 3mr8 h GLU 8 Ca -0.00 -0.58 -0.07 0.00 -1.18 0.00 0.00 59.36 57.53 3mr8 h GLU 8 Cb 0.28 0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 29.07 3mr8 h GLU 8 CO 0.01 1.27 -0.33 -0.22 -1.18 0.00 0.00 179.01 178.56 3mr8 h LYS 9 N 0.09 0.00 0.00 1.92 3.64 -0.78 -2.91 116.57 118.54 3mr8 h LYS 9 Ca -0.18 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.17 3mr8 h LYS 9 Cb 2.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.84 3mr8 h LYS 9 CO 0.22 0.33 -0.18 0.00 -2.27 0.00 0.00 179.45 177.54 3mr8 h ALA 10 N 1.67 1.12 -0.03 5.00 0.00 -1.15 -2.42 119.26 123.45 3mr8 h ALA 10 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3mr8 h ALA 10 Cb 0.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3mr8 h ALA 10 CO 0.04 0.23 -0.11 1.63 0.00 0.00 0.00 179.25 181.04 3mr8 n LYS 11 N -3.48 2.06 0.12 0.00 5.02 -1.11 -4.56 118.16 116.21 3mr8 n LYS 11 Ca -0.01 -1.69 -0.06 0.00 -2.02 0.00 0.00 58.31 54.54 3mr8 n LYS 11 Cb 0.35 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.87 3mr8 n LYS 11 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3mr8 h ARG 12 N 4.12 -0.37 -6.06 1.97 9.65 -1.33 -3.49 114.38 118.88 3mr8 h ARG 12 Ca 0.00 0.03 -0.38 0.00 -1.10 0.00 0.00 59.98 58.52 3mr8 h ARG 12 Cb 0.93 0.08 0.11 0.00 -1.39 0.00 0.00 29.97 29.70 3mr8 h ARG 12 CO 0.00 -0.25 -0.90 2.41 2.80 0.00 0.00 179.97 184.04 3mr8 n THR 13 N -4.90 -6.62 0.06 0.20 -1.04 -1.25 -4.97 114.28 95.76 3mr8 n THR 13 Ca -0.05 -1.00 -0.03 0.00 -2.04 0.00 0.00 64.05 60.93 3mr8 n THR 13 Cb 0.15 -4.84 -0.02 0.00 -1.82 0.00 0.00 70.33 63.80 3mr8 n THR 13 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 3mr8 h PRO 14 N -1.63 -0.21 0.00 -2.82 0.13 -1.94 -3.47 132.00 122.06 3mr8 h PRO 14 Ca -0.63 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 3mr8 h PRO 14 Cb 1.34 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.52 3mr8 h PRO 14 CO 0.46 -0.14 0.00 1.63 -0.23 0.00 0.00 178.00 179.72 3mr8 n LYS 15 N -4.08 2.97 -0.62 0.86 4.76 -1.26 -5.02 118.16 115.77 3mr8 n LYS 15 Ca -0.03 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.11 3mr8 n LYS 15 Cb 0.09 0.00 0.20 0.00 -1.84 0.00 0.00 35.03 33.47 3mr8 n LYS 15 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 3mr8 n PHE 16 N 0.00 -0.80 0.45 2.13 3.72 -1.26 -4.89 117.46 116.81 3mr8 n PHE 16 Ca 0.00 0.11 0.12 0.00 -0.05 0.00 0.00 57.45 57.63 3mr8 n PHE 16 Cb 0.00 -1.76 0.48 0.00 -0.94 0.00 0.00 39.48 37.26 3mr8 n PHE 16 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 3mr8 h LYS 17 N -2.19 0.00 -1.88 -1.08 2.10 -1.95 -3.25 116.57 108.31 3mr8 h LYS 17 Ca -0.53 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.10 3mr8 h LYS 17 Cb 1.31 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.64 3mr8 h LYS 17 CO 0.42 0.00 0.03 0.28 -2.00 0.00 0.00 179.45 178.18 3mr8 n VAL 18 N -2.30 1.97 -0.18 0.07 0.31 -1.26 -2.47 118.33 114.46 3mr8 n VAL 18 Ca 0.03 -0.53 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 3mr8 n VAL 18 Cb 0.29 -1.44 0.00 0.00 -0.91 0.00 0.00 33.84 31.77 3mr8 n VAL 18 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3mr8 n ARG 19 N 1.34 0.80 -0.74 5.55 1.74 -1.23 -4.87 116.66 119.24 3mr8 n ARG 19 Ca 0.02 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.04 3mr8 n ARG 19 Cb 0.51 -0.07 -0.09 0.00 -1.02 0.00 0.00 32.46 31.79 3mr8 n ARG 19 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3mr8 n ALA 20 N 0.00 5.15 -0.75 7.54 0.00 -1.03 -4.89 120.51 126.53 3mr8 n ALA 20 Ca 0.00 -0.95 -0.32 0.00 0.00 0.00 0.00 53.44 52.17 3mr8 n ALA 20 Cb 0.00 -1.72 0.14 0.00 0.00 0.00 0.00 19.45 17.87 3mr8 n ALA 20 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3mr8 n TYR 21 N 2.05 -1.09 -1.99 0.00 4.11 -1.26 -4.92 117.16 114.07 3mr8 n TYR 21 Ca 0.22 0.24 -0.38 0.00 -0.00 0.00 0.00 57.90 57.98 3mr8 n TYR 21 Cb 0.70 -1.79 0.02 0.00 -0.00 0.00 0.00 39.34 38.27 3mr8 n TYR 21 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.86 177.81 3mr8 s THR 22 N -2.42 2.52 -0.21 -3.48 -4.23 -1.26 -4.98 115.64 101.57 3mr8 s THR 22 Ca 0.59 0.39 -0.07 0.00 -1.18 0.00 0.00 61.69 61.42 3mr8 s THR 22 Cb -0.21 -3.20 0.10 0.00 1.34 0.00 0.00 72.50 70.53 3mr8 s THR 22 CO 0.66 0.00 0.44 -0.60 -0.54 0.00 0.00 174.62 174.58 3mr8 s ARG 23 N -2.77 0.35 0.44 3.99 6.06 -1.26 -4.82 118.95 120.94 3mr8 s ARG 23 Ca 0.67 1.03 -0.25 0.00 -2.50 0.00 0.00 55.73 54.68 3mr8 s ARG 23 Cb -0.36 0.32 -0.09 0.00 0.06 0.00 0.00 34.95 34.88 3mr8 s ARG 23 CO 0.43 -0.29 1.33 0.00 -2.50 0.00 0.00 175.30 174.27 3mr8 h VAL 25 N 2.10 0.62 0.00 0.00 2.07 -1.78 -3.12 116.25 116.14 3mr8 h VAL 25 Ca -0.49 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 65.47 3mr8 h VAL 25 Cb 1.29 1.26 0.00 0.00 -1.52 0.00 0.00 31.29 32.32 3mr8 h VAL 25 CO 0.60 0.21 0.00 0.54 0.02 0.00 0.00 177.57 178.94 3mr8 n ARG 26 N -4.63 0.00 -0.08 1.57 1.74 -1.26 -3.41 116.66 110.58 3mr8 n ARG 26 Ca -0.10 0.05 0.08 0.00 -0.77 0.00 0.00 57.85 57.11 3mr8 n ARG 26 Cb 0.31 -0.60 0.33 0.00 -1.02 0.00 0.00 32.46 31.49 3mr8 n ARG 26 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3mr8 n GLY 28 N 0.99 -1.03 3.83 0.00 0.00 -1.18 -4.97 105.19 102.83 3mr8 n GLY 28 Ca 0.13 0.49 -0.34 0.00 0.00 0.00 0.00 46.02 46.31 3mr8 n GLY 28 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mr8 s ARG 29 N -5.22 4.15 0.18 1.61 3.52 -1.25 -4.78 118.95 117.16 3mr8 s ARG 29 Ca 0.43 0.85 0.04 0.00 -0.13 0.00 0.00 55.73 56.93 3mr8 s ARG 29 Cb -0.11 -2.51 0.03 0.00 -1.56 0.00 0.00 34.95 30.80 3mr8 s ARG 29 CO 0.80 0.18 1.40 0.00 -0.81 0.00 0.00 175.30 176.88 3mr8 h ALA 30 N 2.52 0.57 -4.82 6.12 0.00 -1.93 -2.22 119.26 119.50 3mr8 h ALA 30 Ca -0.48 -0.72 -0.49 0.00 0.00 0.00 0.00 54.91 53.22 3mr8 h ALA 30 Cb 1.18 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.76 3mr8 h ALA 30 CO 0.64 0.93 -0.44 2.89 0.00 0.00 0.00 179.25 183.27 3mr8 n ARG 31 N -3.65 0.51 -1.99 0.00 1.85 -1.26 -4.77 116.66 107.35 3mr8 n ARG 31 Ca -0.03 -3.21 -0.21 0.00 -1.00 0.00 0.00 57.85 53.40 3mr8 n ARG 31 Cb 0.79 2.10 -0.05 0.00 -1.05 0.00 0.00 32.46 34.26 3mr8 n ARG 31 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 3mr8 n SER 32 N -1.64 -5.63 -4.51 2.89 7.64 -1.26 -4.75 113.62 106.36 3mr8 n SER 32 Ca -0.00 0.25 -0.43 0.00 1.01 0.00 0.00 58.87 59.70 3mr8 n SER 32 Cb 0.58 -4.83 -0.05 0.00 -1.01 0.00 0.00 64.21 58.90 3mr8 n SER 32 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3mr8 s VAL 33 N -2.88 4.50 0.28 0.44 1.01 -1.26 -2.19 120.40 120.29 3mr8 s VAL 33 Ca 0.00 0.20 -0.29 0.00 0.00 0.00 0.00 61.98 61.89 3mr8 s VAL 33 Cb 0.00 -4.47 -0.10 0.00 0.00 0.00 0.00 36.38 31.81 3mr8 s VAL 33 CO 0.00 -1.01 1.38 -0.31 0.00 0.00 0.00 175.10 175.16 3mr8 s TYR 34 N 3.66 3.03 0.10 5.22 1.51 -0.30 -4.91 117.35 125.67 3mr8 s TYR 34 Ca 0.28 1.20 -0.11 0.00 -1.01 0.00 0.00 57.07 57.43 3mr8 s TYR 34 Cb -0.13 -3.76 -0.16 0.00 -0.11 0.00 0.00 41.96 37.80 3mr8 s TYR 34 CO 0.19 -2.30 1.27 0.00 -1.11 0.00 0.00 175.55 173.60 3mr8 h ARG 35 N 4.33 0.68 0.58 -0.62 3.08 -1.94 0.33 114.38 120.82 3mr8 h ARG 35 Ca -0.47 -0.65 -0.02 0.00 0.07 0.00 0.00 59.98 58.91 3mr8 h ARG 35 Cb 1.22 0.16 -0.02 0.00 0.08 0.00 0.00 29.97 31.42 3mr8 h ARG 35 CO 0.72 1.25 -0.47 0.35 -1.07 0.00 0.00 179.97 180.75 3mr8 h PHE 36 N 0.42 -1.29 0.00 3.04 3.04 -1.97 -2.97 116.94 117.22 3mr8 h PHE 36 Ca -0.09 0.00 -0.15 0.00 3.98 0.00 0.00 57.97 61.71 3mr8 h PHE 36 Cb 1.55 0.49 -0.02 0.00 2.56 0.00 0.00 35.95 40.53 3mr8 h PHE 36 CO 0.09 -0.66 -0.71 0.74 -2.02 0.00 0.00 178.31 175.74 3mr8 h PHE 37 N -1.03 0.00 -0.01 0.41 0.04 -1.98 -3.47 116.94 110.90 3mr8 h PHE 37 Ca -0.07 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 3mr8 h PHE 37 Cb 0.87 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.02 3mr8 h PHE 37 CO -0.19 0.71 -0.01 0.41 -0.60 0.00 0.00 178.31 178.63 3mr8 n GLY 38 N 1.06 0.33 3.79 -1.45 0.00 0.12 -4.98 105.19 104.06 3mr8 n GLY 38 Ca 0.01 -0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 3mr8 n GLY 38 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mr8 s LEU 39 N -0.07 3.30 0.58 0.99 1.43 -1.20 -2.12 118.68 121.60 3mr8 s LEU 39 Ca 0.00 -0.81 -0.07 0.00 -1.03 0.00 0.00 54.13 52.21 3mr8 s LEU 39 Cb 0.00 -1.81 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 3mr8 s LEU 39 CO 0.00 -0.48 0.92 0.00 0.23 0.00 0.00 176.35 177.01 3mr8 h ARG 41 N -0.14 0.52 0.48 0.00 0.11 -1.73 -0.57 114.38 113.05 3mr8 h ARG 41 Ca -0.46 -0.03 -0.02 0.00 0.10 0.00 0.00 59.98 59.57 3mr8 h ARG 41 Cb 1.23 -0.12 0.00 0.00 1.11 0.00 0.00 29.97 32.19 3mr8 h ARG 41 CO 0.62 0.35 -0.23 0.82 0.10 0.00 0.00 179.97 181.62 3mr8 h ILE 42 N 0.54 0.00 0.00 0.08 1.08 -1.93 -2.75 117.51 114.53 3mr8 h ILE 42 Ca 0.18 -0.32 0.00 0.00 -0.39 0.00 0.00 64.86 64.33 3mr8 h ILE 42 Cb 0.07 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.82 3mr8 h ILE 42 CO -0.04 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.42 3mr8 h LEU 44 N 0.00 -0.31 -0.83 0.00 5.85 -1.03 -2.75 115.31 116.24 3mr8 h LEU 44 Ca 0.00 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.51 3mr8 h LEU 44 Cb 0.16 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3mr8 h LEU 44 CO 0.00 -0.08 -0.27 -0.09 -0.34 0.00 0.00 178.44 177.66 3mr8 h ARG 45 N -0.54 0.57 -0.05 1.25 2.43 -1.11 -2.18 114.38 114.74 3mr8 h ARG 45 Ca -0.04 -0.23 0.03 0.00 -0.81 0.00 0.00 59.98 58.93 3mr8 h ARG 45 Cb 0.40 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.89 3mr8 h ARG 45 CO 0.06 0.79 -0.15 0.93 -1.51 0.00 0.00 179.97 180.08 3mr8 h GLU 46 N 0.50 -0.22 -0.55 0.20 5.08 -1.46 -1.87 114.58 116.26 3mr8 h GLU 46 Ca 0.07 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.40 3mr8 h GLU 46 Cb 0.72 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 3mr8 h GLU 46 CO 0.06 -0.15 0.19 -0.07 -1.00 0.00 0.00 179.01 178.03 3mr8 h LEU 47 N -0.23 0.79 -0.79 1.33 3.38 -1.40 -2.86 115.31 115.52 3mr8 h LEU 47 Ca 0.07 -0.20 0.10 0.00 0.09 0.00 0.00 57.88 57.94 3mr8 h LEU 47 Cb 0.32 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 3mr8 h LEU 47 CO -0.18 0.77 0.42 0.00 0.09 0.00 0.00 178.44 179.54 3mr8 h ALA 48 N 1.04 1.12 -0.47 1.53 0.00 -0.96 0.13 119.26 121.65 3mr8 h ALA 48 Ca 0.18 0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 3mr8 h ALA 48 Cb 0.26 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3mr8 h ALA 48 CO -0.01 0.01 -0.02 0.45 0.00 0.00 0.00 179.25 179.69 3mr8 h HIS 49 N 0.69 0.83 -0.01 0.00 3.86 -1.24 -2.83 115.15 116.45 3mr8 h HIS 49 Ca 0.39 -0.12 -0.09 0.00 -1.16 0.00 0.00 60.37 59.39 3mr8 h HIS 49 Cb 0.41 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 3mr8 h HIS 49 CO -0.08 0.78 -0.40 0.87 0.86 0.00 0.00 177.93 179.96 3mr8 h LYS 50 N 0.72 0.02 0.00 2.45 1.79 -0.62 -3.47 116.57 117.46 3mr8 h LYS 50 Ca 0.14 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 3mr8 h LYS 50 Cb 0.47 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.12 3mr8 h LYS 50 CO 0.02 0.42 0.00 0.41 -1.08 0.00 0.00 179.45 179.22 3mr8 n GLY 51 N -0.37 0.80 0.00 3.86 0.00 -0.06 -4.95 105.19 104.46 3mr8 n GLY 51 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 3mr8 n GLY 51 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3mr8 n GLN 52 N -2.13 0.89 -3.65 1.61 6.02 -1.12 -4.48 117.38 114.52 3mr8 n GLN 52 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.61 3mr8 n GLN 52 Cb 0.00 -1.38 -0.09 0.00 1.02 0.00 0.00 30.24 29.79 3mr8 n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3mr8 s LEU 53 N -1.75 5.51 0.32 1.08 1.43 -1.26 -4.99 118.68 119.01 3mr8 s LEU 53 Ca 0.32 -2.41 -0.29 0.00 -1.03 0.00 0.00 54.13 50.72 3mr8 s LEU 53 Cb 0.15 -1.92 -0.12 0.00 0.03 0.00 0.00 46.19 44.32 3mr8 s LEU 53 CO 0.25 -0.51 1.39 -2.65 0.23 0.00 0.00 176.35 175.05 3mr8 n PRO 54 N 4.15 2.27 -0.03 1.29 -0.02 -1.26 -1.83 135.00 139.57 3mr8 n PRO 54 Ca 0.02 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.30 3mr8 n PRO 54 Cb 0.40 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.44 3mr8 n PRO 54 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mr8 n GLY 55 N 1.21 1.74 3.47 -1.23 0.00 -1.26 -4.92 105.19 104.21 3mr8 n GLY 55 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 3mr8 n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mr8 s VAL 56 N -2.21 4.61 0.32 1.61 1.01 -0.76 -5.01 120.40 119.98 3mr8 s VAL 56 Ca 0.00 -1.52 0.05 0.00 0.00 0.00 0.00 61.98 60.52 3mr8 s VAL 56 Cb 0.00 -4.83 -0.02 0.00 0.00 0.00 0.00 36.38 31.53 3mr8 s VAL 56 CO 0.00 -1.59 0.46 -0.60 0.00 0.00 0.00 175.10 173.38 3mr8 s ARG 57 N 2.99 3.22 -0.03 2.72 3.52 -1.26 -4.90 118.95 125.21 3mr8 s ARG 57 Ca 0.36 -0.85 -0.30 0.00 -0.13 0.00 0.00 55.73 54.81 3mr8 s ARG 57 Cb -0.04 -2.80 -0.06 0.00 -1.56 0.00 0.00 34.95 30.48 3mr8 s ARG 57 CO -0.09 0.14 1.71 0.21 -0.81 0.00 0.00 175.30 176.46 3mr8 s LYS 58 N -4.17 4.17 0.10 5.12 2.36 -1.26 -4.96 119.74 121.11 3mr8 s LYS 58 Ca 0.42 2.27 -0.30 0.00 -2.55 0.00 0.00 55.97 55.81 3mr8 s LYS 58 Cb -0.09 -4.01 -0.06 0.00 -1.05 0.00 0.00 37.83 32.61 3mr8 s LYS 58 CO 0.31 -0.86 1.17 0.00 1.55 0.00 0.00 175.35 177.52 3mr8 s ALA 59 N 4.08 3.38 -0.21 3.13 0.00 -1.26 -5.02 121.76 125.86 3mr8 s ALA 59 Ca 0.76 0.84 -0.08 0.00 0.00 0.00 0.00 51.96 53.48 3mr8 s ALA 59 Cb -0.35 -3.42 0.09 0.00 0.00 0.00 0.00 23.12 19.44 3mr8 s ALA 59 CO 0.32 -0.37 0.46 -1.12 0.00 0.00 0.00 175.76 175.05 3mr8 s SER 60 N 0.71 -0.45 0.00 0.00 0.01 -1.26 -5.34 113.70 107.37 3mr8 s SER 60 Ca 0.56 1.09 0.00 0.00 1.31 0.00 0.00 55.95 58.91 3mr8 s SER 60 Cb -0.29 1.43 0.00 0.00 0.21 0.00 0.00 66.02 67.36 3mr8 s SER 60 CO 0.31 -0.23 0.00 -2.67 0.41 0.00 0.00 173.24 171.07