#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1id2 s ASP 2 N 0.00 5.62 0.00 1.08 1.11 -1.26 -4.59 116.67 118.63 1id2 s ASP 2 Ca 0.00 0.07 0.09 0.00 0.18 0.00 0.00 52.55 52.89 1id2 s ASP 2 Cb 0.00 -1.57 0.44 0.00 1.07 0.00 0.00 42.92 42.86 1id2 s ASP 2 CO 0.00 0.22 1.17 0.29 1.18 0.00 0.00 175.17 178.03 1id2 n LYS 3 N 0.79 0.11 -4.26 8.23 4.01 0.11 -4.86 118.16 122.29 1id2 n LYS 3 Ca -0.10 0.22 -0.14 0.00 -0.51 0.00 0.00 58.31 57.77 1id2 n LYS 3 Cb 0.52 -1.50 -0.10 0.00 -0.51 0.00 0.00 35.03 33.44 1id2 n LYS 3 CO 0.00 0.00 0.00 0.96 -1.11 0.00 0.00 177.40 177.25 1id2 s ILE 4 N -2.62 0.96 -0.09 -0.18 -4.36 -1.26 -1.35 121.20 112.30 1id2 s ILE 4 Ca 0.08 -2.02 0.02 0.00 -0.26 0.00 0.00 60.65 58.47 1id2 s ILE 4 Cb 0.06 -2.00 0.01 0.00 1.25 0.00 0.00 42.46 41.78 1id2 s ILE 4 CO 0.14 -0.60 -0.13 -0.89 0.24 0.00 0.00 174.94 173.69 1id2 s THR 5 N -3.47 1.31 -0.90 8.37 2.01 0.99 -4.92 115.64 119.03 1id2 s THR 5 Ca 0.20 -0.54 -0.04 0.00 0.31 0.00 0.00 61.69 61.62 1id2 s THR 5 Cb 0.04 -1.20 0.23 0.00 0.01 0.00 0.00 72.50 71.57 1id2 s THR 5 CO 0.02 0.40 0.81 -0.69 -0.69 0.00 0.00 174.62 174.47 1id2 s VAL 6 N 0.91 4.71 0.00 3.82 1.01 -1.26 -0.74 120.40 128.85 1id2 s VAL 6 Ca -0.09 -3.58 0.00 0.00 0.00 0.00 0.00 61.98 58.31 1id2 s VAL 6 Cb -0.15 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.32 1id2 s VAL 6 CO 0.00 -1.08 0.00 0.41 0.00 0.00 0.00 175.10 174.43 1id2 n THR 7 N 2.65 0.00 -4.19 3.92 -1.04 -1.26 -4.54 114.28 109.82 1id2 n THR 7 Ca 0.20 0.00 -0.29 0.00 -2.04 0.00 0.00 64.05 61.92 1id2 n THR 7 Cb 0.38 0.00 -0.17 0.00 -1.82 0.00 0.00 70.33 68.73 1id2 n THR 7 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1id2 s SER 8 N 0.00 2.49 0.28 8.00 0.15 -1.26 -4.97 113.70 118.39 1id2 s SER 8 Ca 0.00 -0.43 0.02 0.00 0.70 0.00 0.00 55.95 56.24 1id2 s SER 8 Cb 0.00 -1.08 0.67 0.00 -1.71 0.00 0.00 66.02 63.89 1id2 s SER 8 CO 0.00 -0.04 1.72 -0.08 1.20 0.00 0.00 173.24 176.04 1id2 h GLU 9 N 7.79 0.45 -6.66 5.44 4.81 -1.96 -3.43 114.58 121.02 1id2 h GLU 9 Ca -0.34 -0.03 -0.50 0.00 -0.13 0.00 0.00 59.36 58.36 1id2 h GLU 9 Cb 1.15 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.40 1id2 h GLU 9 CO 0.49 0.30 0.24 0.21 -0.73 0.00 0.00 179.01 179.53 1id2 s LYS 10 N -5.91 4.59 0.32 1.92 2.20 -1.26 -4.41 119.74 117.18 1id2 s LYS 10 Ca -0.12 1.23 -0.29 0.00 -0.36 0.00 0.00 55.97 56.43 1id2 s LYS 10 Cb 0.24 -3.10 -0.12 0.00 -1.51 0.00 0.00 37.83 33.34 1id2 s LYS 10 CO 0.78 0.47 1.37 -2.30 -0.36 0.00 0.00 175.35 175.31 1id2 n PRO 11 N 1.19 2.24 -3.46 4.03 -0.02 -1.26 -4.94 135.00 132.79 1id2 n PRO 11 Ca -0.03 0.79 -0.19 0.00 -2.02 0.00 0.00 63.50 62.05 1id2 n PRO 11 Cb 0.49 -2.43 -0.01 0.00 -0.02 0.00 0.00 33.50 31.53 1id2 n PRO 11 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1id2 s VAL 12 N -0.74 3.66 0.43 -1.45 -7.23 -0.74 -4.89 120.40 109.44 1id2 s VAL 12 Ca 0.59 -1.10 -0.23 0.00 -1.81 0.00 0.00 61.98 59.43 1id2 s VAL 12 Cb -0.57 -3.26 -0.09 0.00 0.56 0.00 0.00 36.38 33.03 1id2 s VAL 12 CO 0.58 -0.12 1.05 0.00 -0.31 0.00 0.00 175.10 176.30 1id2 s ALA 13 N -2.25 3.01 0.50 1.32 0.00 -1.26 -0.30 121.76 122.78 1id2 s ALA 13 Ca 0.46 0.67 0.23 0.00 0.00 0.00 0.00 51.96 53.33 1id2 s ALA 13 Cb -0.08 -3.27 1.46 0.00 0.00 0.00 0.00 23.12 21.22 1id2 s ALA 13 CO 0.30 -0.26 2.14 0.00 0.00 0.00 0.00 175.76 177.94 1id2 h ALA 14 N 2.16 1.59 0.00 0.00 0.00 -1.49 0.25 119.26 121.78 1id2 h ALA 14 Ca -0.49 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1id2 h ALA 14 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1id2 h ALA 14 CO 0.61 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.95 1id2 h ALA 15 N 1.93 1.00 -0.01 0.00 0.00 -1.91 -1.81 119.26 118.47 1id2 h ALA 15 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1id2 h ALA 15 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1id2 h ALA 15 CO 0.01 0.00 -0.27 -0.25 0.00 0.00 0.00 179.25 178.74 1id2 n ASP 16 N -2.80 0.90 -4.72 0.00 10.43 0.87 -4.92 116.55 116.31 1id2 n ASP 16 Ca -0.02 -0.77 -0.42 0.00 2.57 0.00 0.00 54.79 56.15 1id2 n ASP 16 Cb 0.10 0.12 -0.03 0.00 1.84 0.00 0.00 41.12 43.15 1id2 n ASP 16 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1id2 s VAL 17 N -2.56 3.98 0.57 2.53 1.01 -0.68 -5.01 120.40 120.24 1id2 s VAL 17 Ca 0.23 1.52 -0.15 0.00 0.00 0.00 0.00 61.98 63.58 1id2 s VAL 17 Cb 0.19 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.55 1id2 s VAL 17 CO 0.53 0.17 1.02 -2.16 0.00 0.00 0.00 175.10 174.67 1id2 s PRO 18 N 0.50 3.59 0.51 2.72 0.04 -1.26 -4.92 135.00 136.17 1id2 s PRO 18 Ca 0.55 1.02 0.25 0.00 0.04 0.00 0.00 61.00 62.86 1id2 s PRO 18 Cb -0.29 -2.08 1.36 0.00 0.04 0.00 0.00 34.50 33.53 1id2 s PRO 18 CO 0.32 -0.58 2.05 0.00 0.04 0.00 0.00 177.00 178.83 1id2 h ALA 19 N 0.44 1.34 -0.70 8.56 0.00 -1.99 -2.45 119.26 124.47 1id2 h ALA 19 Ca -0.46 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1id2 h ALA 19 Cb 1.20 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1id2 h ALA 19 CO 0.60 0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.62 1id2 n ASP 20 N -3.75 3.94 -4.78 0.00 3.85 -1.26 -5.00 116.55 109.55 1id2 n ASP 20 Ca -0.02 -2.08 -0.33 0.00 -0.71 0.00 0.00 54.79 51.65 1id2 n ASP 20 Cb 0.24 -0.49 0.02 0.00 -1.35 0.00 0.00 41.12 39.55 1id2 n ASP 20 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1id2 s ALA 21 N -1.19 2.62 -0.23 2.12 0.00 -0.92 -5.01 121.76 119.14 1id2 s ALA 21 Ca 0.48 0.52 -0.23 0.00 0.00 0.00 0.00 51.96 52.72 1id2 s ALA 21 Cb 0.26 -3.29 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 1id2 s ALA 21 CO 0.31 -0.99 0.76 0.14 0.00 0.00 0.00 175.76 175.98 1id2 s VAL 22 N -2.30 4.90 -0.11 0.00 -7.23 -1.26 -5.03 120.40 109.36 1id2 s VAL 22 Ca 0.66 1.43 0.03 0.00 -1.81 0.00 0.00 61.98 62.29 1id2 s VAL 22 Cb -0.19 -4.06 0.00 0.00 0.56 0.00 0.00 36.38 32.70 1id2 s VAL 22 CO 0.37 -0.01 -0.23 -0.69 -0.31 0.00 0.00 175.10 174.23 1id2 s VAL 23 N 2.53 2.05 -0.31 1.32 1.01 -1.26 -1.46 120.40 124.27 1id2 s VAL 23 Ca 0.33 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 1id2 s VAL 23 Cb -0.16 -1.79 -0.01 0.00 0.00 0.00 0.00 36.38 34.43 1id2 s VAL 23 CO 0.09 0.55 0.17 -0.69 0.00 0.00 0.00 175.10 175.22 1id2 s VAL 24 N 0.53 4.75 0.44 2.92 1.01 0.18 -4.95 120.40 125.28 1id2 s VAL 24 Ca -0.14 -0.36 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1id2 s VAL 24 Cb -0.17 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 1id2 s VAL 24 CO 0.05 0.06 0.88 -0.83 0.00 0.00 0.00 175.10 175.26 1id2 s GLY 25 N 1.64 2.13 -0.20 4.51 0.00 -1.26 -1.11 107.32 113.02 1id2 s GLY 25 Ca 0.05 0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.87 1id2 s GLY 25 CO 0.07 0.33 -0.11 -0.42 0.00 0.00 0.00 173.10 172.97 1id2 s ILE 26 N -2.38 1.69 -0.02 0.90 1.01 -0.04 -0.02 121.20 122.35 1id2 s ILE 26 Ca 0.56 -1.05 -0.06 0.00 0.00 0.00 0.00 60.65 60.11 1id2 s ILE 26 Cb -0.10 -1.76 0.01 0.00 0.01 0.00 0.00 42.46 40.62 1id2 s ILE 26 CO 0.26 0.17 0.13 -1.61 0.00 0.00 0.00 174.94 173.89 1id2 s GLU 27 N 1.37 0.31 -1.31 2.79 0.41 -0.74 -0.96 118.70 120.58 1id2 s GLU 27 Ca -0.01 -0.12 -0.10 0.00 -0.41 0.00 0.00 54.97 54.33 1id2 s GLU 27 Cb -0.16 0.14 0.00 0.00 -1.78 0.00 0.00 34.13 32.32 1id2 s GLU 27 CO -0.08 -0.06 0.55 1.63 -0.49 0.00 0.00 175.26 176.80 1id2 n LYS 28 N 2.23 -2.28 -2.44 1.61 4.76 -1.26 -1.79 118.16 118.98 1id2 n LYS 28 Ca -0.18 0.38 -0.18 0.00 -2.87 0.00 0.00 58.31 55.47 1id2 n LYS 28 Cb 0.57 -4.19 -0.01 0.00 -1.84 0.00 0.00 35.03 29.57 1id2 n LYS 28 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1id2 n MET 29 N -4.40 -2.00 -4.14 1.97 2.81 -1.26 -4.99 117.12 105.11 1id2 n MET 29 Ca -0.22 0.84 -0.15 0.00 -1.81 0.00 0.00 57.70 56.35 1id2 n MET 29 Cb 0.65 -5.49 -0.12 0.00 -0.71 0.00 0.00 33.22 27.55 1id2 n MET 29 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1id2 s LYS 30 N -5.07 0.63 -0.05 0.03 1.02 -0.74 -4.76 119.74 110.81 1id2 s LYS 30 Ca 0.01 -0.70 -0.27 0.00 0.02 0.00 0.00 55.97 55.03 1id2 s LYS 30 Cb -0.01 -0.51 -0.03 0.00 -0.52 0.00 0.00 37.83 36.77 1id2 s LYS 30 CO 0.01 0.11 0.86 0.71 -0.92 0.00 0.00 175.35 176.13 1id2 s TYR 31 N -1.07 3.60 -0.45 3.18 2.02 -1.26 -1.79 117.35 121.57 1id2 s TYR 31 Ca -0.05 1.49 0.23 0.00 -0.37 0.00 0.00 57.07 58.37 1id2 s TYR 31 Cb -0.08 -3.00 0.35 0.00 -0.40 0.00 0.00 41.96 38.83 1id2 s TYR 31 CO 0.01 -0.00 1.56 -0.07 -1.57 0.00 0.00 175.55 175.47 1id2 h LEU 32 N 6.98 0.00 -7.37 -1.29 3.38 -0.77 -3.35 115.31 112.90 1id2 h LEU 32 Ca -0.39 -0.00 -0.63 0.00 0.09 0.00 0.00 57.88 56.94 1id2 h LEU 32 Cb 1.20 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.55 1id2 h LEU 32 CO 0.76 0.00 -0.71 -0.89 0.09 0.00 0.00 178.44 177.70 1id2 s THR 33 N -3.21 1.90 -0.51 0.22 2.01 -1.26 -4.97 115.64 109.81 1id2 s THR 33 Ca 0.07 -2.43 0.25 0.00 0.31 0.00 0.00 61.69 59.89 1id2 s THR 33 Cb 0.06 -2.37 0.28 0.00 0.01 0.00 0.00 72.50 70.49 1id2 s THR 33 CO 0.68 -0.72 1.76 -0.65 -0.69 0.00 0.00 174.62 174.99 1id2 h PRO 34 N 7.26 0.00 -2.64 4.92 0.11 -1.91 -3.41 132.00 136.34 1id2 h PRO 34 Ca -0.06 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.76 1id2 h PRO 34 Cb 0.97 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 31.73 1id2 h PRO 34 CO 0.54 0.00 -0.60 -2.00 -0.21 0.00 0.00 178.00 175.74 1id2 s GLU 35 N -3.27 0.17 -0.01 1.05 2.12 -1.26 -0.07 118.70 117.44 1id2 s GLU 35 Ca 0.06 0.39 0.07 0.00 0.36 0.00 0.00 54.97 55.85 1id2 s GLU 35 Cb 0.10 -0.79 -0.02 0.00 0.26 0.00 0.00 34.13 33.68 1id2 s GLU 35 CO 0.50 -0.53 -0.23 0.54 -0.54 0.00 0.00 175.26 175.00 1id2 s VAL 36 N 2.35 1.84 -0.09 3.70 0.11 -0.57 -5.00 120.40 122.73 1id2 s VAL 36 Ca 0.05 -1.05 0.01 0.00 -2.93 0.00 0.00 61.98 58.06 1id2 s VAL 36 Cb -0.14 -1.54 0.02 0.00 -1.53 0.00 0.00 36.38 33.18 1id2 s VAL 36 CO -0.11 0.47 -0.11 0.28 -3.33 0.00 0.00 175.10 172.31 1id2 s THR 37 N -0.59 1.14 0.43 5.04 -1.32 -1.26 -0.20 115.64 118.89 1id2 s THR 37 Ca 0.09 -0.42 0.03 0.00 -1.21 0.00 0.00 61.69 60.18 1id2 s THR 37 Cb -0.09 -1.09 -0.02 0.00 -1.51 0.00 0.00 72.50 69.78 1id2 s THR 37 CO -0.00 0.37 0.09 0.27 -2.21 0.00 0.00 174.62 173.14 1id2 s ILE 38 N 1.18 0.80 0.11 5.08 -4.36 -0.19 -4.97 121.20 118.84 1id2 s ILE 38 Ca -0.04 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.36 1id2 s ILE 38 Cb -0.14 -2.33 -0.04 0.00 1.25 0.00 0.00 42.46 41.20 1id2 s ILE 38 CO -0.03 0.00 0.23 -0.54 0.24 0.00 0.00 174.94 174.84 1id2 s LYS 39 N -3.76 3.35 0.37 0.37 1.02 -1.26 -1.35 119.74 118.48 1id2 s LYS 39 Ca 0.20 -0.56 -0.26 0.00 0.02 0.00 0.00 55.97 55.37 1id2 s LYS 39 Cb 0.03 -2.95 -0.12 0.00 -0.52 0.00 0.00 37.83 34.26 1id2 s LYS 39 CO 0.12 0.56 1.01 0.00 -0.92 0.00 0.00 175.35 176.11 1id2 n ALA 40 N -0.11 0.06 0.00 5.17 0.00 -1.26 -1.34 120.51 123.03 1id2 n ALA 40 Ca -0.06 0.29 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1id2 n ALA 40 Cb 0.53 -2.06 0.00 0.00 0.00 0.00 0.00 19.45 17.92 1id2 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1id2 n GLY 41 N 1.19 3.26 3.82 0.00 0.00 0.22 -4.96 105.19 108.73 1id2 n GLY 41 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1id2 n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1id2 s GLU 42 N -0.54 3.61 -0.09 1.61 2.02 -0.45 -4.76 118.70 120.10 1id2 s GLU 42 Ca 0.00 1.07 -0.01 0.00 0.02 0.00 0.00 54.97 56.05 1id2 s GLU 42 Cb 0.00 -2.08 -0.03 0.00 0.10 0.00 0.00 34.13 32.12 1id2 s GLU 42 CO 0.00 -0.56 -0.03 0.99 0.02 0.00 0.00 175.26 175.68 1id2 s THR 43 N -2.57 4.03 -0.10 3.63 2.01 -1.26 -1.65 115.64 119.73 1id2 s THR 43 Ca 0.61 -0.35 -0.01 0.00 0.31 0.00 0.00 61.69 62.25 1id2 s THR 43 Cb -0.13 -2.68 -0.03 0.00 0.01 0.00 0.00 72.50 69.67 1id2 s THR 43 CO 0.35 0.59 -0.03 -0.69 -0.69 0.00 0.00 174.62 174.15 1id2 s VAL 44 N -0.70 4.01 -0.03 3.82 1.01 -0.26 -4.41 120.40 123.83 1id2 s VAL 44 Ca 0.11 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.75 1id2 s VAL 44 Cb -0.11 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 1id2 s VAL 44 CO 0.02 0.57 -0.05 -0.31 0.00 0.00 0.00 175.10 175.33 1id2 s TYR 45 N -0.53 2.96 -0.07 5.22 1.51 -0.54 -2.10 117.35 123.80 1id2 s TYR 45 Ca 0.08 0.02 0.01 0.00 -1.01 0.00 0.00 57.07 56.18 1id2 s TYR 45 Cb -0.12 -1.67 -0.03 0.00 -0.11 0.00 0.00 41.96 40.03 1id2 s TYR 45 CO 0.02 0.38 -0.08 -1.58 -1.11 0.00 0.00 175.55 173.18 1id2 s TRP 46 N -0.93 2.91 -0.10 2.71 0.51 0.38 0.52 118.94 124.94 1id2 s TRP 46 Ca 0.15 -0.03 -0.00 0.00 -2.12 0.00 0.00 56.10 54.10 1id2 s TRP 46 Cb -0.11 -1.71 0.02 0.00 -0.81 0.00 0.00 33.47 30.86 1id2 s TRP 46 CO 0.05 0.29 -0.07 0.08 -0.51 0.00 0.00 176.95 176.79 1id2 s VAL 47 N -0.72 0.95 -0.22 4.03 1.01 -0.27 -0.44 120.40 124.75 1id2 s VAL 47 Ca 0.11 -0.26 -0.25 0.00 0.00 0.00 0.00 61.98 61.58 1id2 s VAL 47 Cb -0.11 -0.98 -0.01 0.00 0.00 0.00 0.00 36.38 35.28 1id2 s VAL 47 CO 0.01 0.35 0.87 0.21 0.00 0.00 0.00 175.10 176.54 1id2 s ASN 48 N 1.63 6.91 0.00 3.32 2.47 -0.65 -0.86 114.94 127.77 1id2 s ASN 48 Ca 0.03 1.13 0.25 0.00 0.42 0.00 0.00 52.86 54.69 1id2 s ASN 48 Cb -0.13 -2.46 0.47 0.00 -1.45 0.00 0.00 41.25 37.68 1id2 s ASN 48 CO -0.07 -0.51 1.39 0.61 -3.72 0.00 0.00 177.10 174.80 1id2 n GLY 49 N 3.60 -1.18 3.56 1.21 0.00 -0.14 0.14 105.19 112.38 1id2 n GLY 49 Ca 0.06 -0.37 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 1id2 n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1id2 s GLU 50 N -2.96 1.85 0.44 1.61 -1.05 -1.26 -4.65 118.70 112.68 1id2 s GLU 50 Ca 0.12 -2.04 0.24 0.00 -0.15 0.00 0.00 54.97 53.14 1id2 s GLU 50 Cb 0.18 -1.39 0.75 0.00 -0.44 0.00 0.00 34.13 33.23 1id2 s GLU 50 CO 0.70 -0.09 1.75 -0.39 0.95 0.00 0.00 175.26 178.18 1id2 h VAL 51 N 1.89 0.37 -2.65 1.83 -1.51 -1.94 -3.16 116.25 111.07 1id2 h VAL 51 Ca -0.43 -1.15 -0.53 0.00 -1.23 0.00 0.00 66.70 63.37 1id2 h VAL 51 Cb 1.24 1.87 0.04 0.00 -2.13 0.00 0.00 31.29 32.31 1id2 h VAL 51 CO 0.77 0.17 1.02 -0.32 -1.23 0.00 0.00 177.57 177.98 1id2 s MET 52 N -3.45 4.16 0.38 5.19 0.00 -1.26 -4.70 119.30 119.63 1id2 s MET 52 Ca 0.03 2.49 -0.24 0.00 0.00 0.00 0.00 55.69 57.96 1id2 s MET 52 Cb 0.08 -3.42 -0.10 0.00 0.00 0.00 0.00 34.83 31.40 1id2 s MET 52 CO 0.64 -0.75 0.98 -2.14 0.00 0.00 0.00 175.02 173.74 1id2 s PRO 53 N 2.13 4.36 0.01 4.11 0.02 -1.26 -4.83 135.00 139.53 1id2 s PRO 53 Ca 0.76 1.33 -0.00 0.00 0.02 0.00 0.00 61.00 63.10 1id2 s PRO 53 Cb -0.45 -2.55 -0.01 0.00 0.02 0.00 0.00 34.50 31.51 1id2 s PRO 53 CO 0.34 0.07 -0.01 -1.01 -0.33 0.00 0.00 177.00 176.06 1id2 s HIS 54 N -1.78 0.10 0.31 6.54 3.76 -0.87 -4.93 115.29 118.42 1id2 s HIS 54 Ca 0.56 -0.20 0.02 0.00 -0.15 0.00 0.00 55.06 55.29 1id2 s HIS 54 Cb -0.17 -0.07 -0.01 0.00 1.11 0.00 0.00 32.58 33.44 1id2 s HIS 54 CO 0.22 -0.08 0.07 0.27 -0.85 0.00 0.00 174.74 174.37 1id2 n ASN 55 N 2.47 1.74 -4.12 1.40 6.94 -1.26 -0.60 115.26 121.83 1id2 n ASN 55 Ca -0.17 -2.56 -0.32 0.00 -0.02 0.00 0.00 54.58 51.51 1id2 n ASN 55 Cb 0.58 0.58 -0.16 0.00 -2.36 0.00 0.00 39.78 38.42 1id2 n ASN 55 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1id2 s VAL 56 N -2.53 1.93 0.06 3.53 1.01 -1.26 -4.42 120.40 118.71 1id2 s VAL 56 Ca 0.10 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.22 1id2 s VAL 56 Cb 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1id2 s VAL 56 CO 0.07 0.52 -0.09 0.00 0.00 0.00 0.00 175.10 175.60 1id2 s ALA 57 N 1.07 0.78 -0.05 5.51 0.00 -0.10 0.07 121.76 129.03 1id2 s ALA 57 Ca -0.02 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.06 1id2 s ALA 57 Cb -0.14 0.03 0.00 0.00 0.00 0.00 0.00 23.12 23.01 1id2 s ALA 57 CO -0.06 -0.02 -0.14 -0.06 0.00 0.00 0.00 175.76 175.47 1id2 s PHE 58 N -1.74 1.53 1.21 0.00 0.08 0.13 -1.61 117.98 117.59 1id2 s PHE 58 Ca -0.04 -0.48 -0.16 0.00 0.12 0.00 0.00 56.93 56.36 1id2 s PHE 58 Cb -0.07 -1.07 0.29 0.00 -0.57 0.00 0.00 43.02 41.59 1id2 s PHE 58 CO 0.00 -0.20 1.03 0.15 -0.10 0.00 0.00 175.22 176.10 1id2 s LYS 59 N 0.28 -1.23 0.41 0.44 -0.14 -1.26 -1.65 119.74 116.58 1id2 s LYS 59 Ca -0.08 0.39 -0.27 0.00 -1.36 0.00 0.00 55.97 54.65 1id2 s LYS 59 Cb -0.13 -1.55 -0.10 0.00 -1.68 0.00 0.00 37.83 34.37 1id2 s LYS 59 CO 0.03 -3.82 1.45 0.15 -0.76 0.00 0.00 175.35 172.40 1id2 s LYS 60 N -4.91 3.94 0.00 1.68 1.02 -1.26 -3.20 119.74 117.00 1id2 s LYS 60 Ca 0.68 2.49 0.00 0.00 0.02 0.00 0.00 55.97 59.16 1id2 s LYS 60 Cb -0.18 -2.84 0.00 0.00 -0.52 0.00 0.00 37.83 34.30 1id2 s LYS 60 CO 0.60 -0.64 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 1id2 n GLY 61 N 0.52 0.73 0.14 -3.33 0.00 -0.54 -4.93 105.19 97.78 1id2 n GLY 61 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1id2 n GLY 61 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1id2 n ILE 62 N -2.42 1.48 0.49 -0.61 2.08 -1.20 -4.67 119.36 114.52 1id2 n ILE 62 Ca 0.00 0.03 0.09 0.00 0.56 0.00 0.00 62.75 63.43 1id2 n ILE 62 Cb 0.00 -2.22 0.11 0.00 -0.75 0.00 0.00 39.64 36.78 1id2 n ILE 62 CO 0.00 0.00 0.00 1.33 0.56 0.00 0.00 176.55 178.44 1id2 n VAL 63 N -4.37 0.23 -3.93 1.39 0.24 -1.26 -4.93 118.33 105.69 1id2 n VAL 63 Ca -0.22 -0.61 0.01 0.00 -2.04 0.00 0.00 64.34 61.48 1id2 n VAL 63 Cb 0.58 1.16 0.00 0.00 -1.47 0.00 0.00 33.84 34.12 1id2 n VAL 63 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1id2 n GLY 64 N 0.99 0.45 0.22 7.63 0.00 -1.26 0.08 105.19 113.29 1id2 n GLY 64 Ca 0.12 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 1id2 n GLY 64 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1id2 h GLU 65 N 0.00 0.64 -7.20 1.61 4.81 -1.91 -1.44 114.58 111.09 1id2 h GLU 65 Ca -0.06 -0.44 -0.46 0.00 -0.13 0.00 0.00 59.36 58.28 1id2 h GLU 65 Cb 0.33 0.06 0.07 0.00 0.63 0.00 0.00 28.75 29.85 1id2 h GLU 65 CO 0.09 1.05 0.19 -0.51 -0.73 0.00 0.00 179.01 179.10 1id2 s ASP 66 N -6.96 5.07 0.46 1.04 -0.00 -1.26 -2.90 116.67 112.13 1id2 s ASP 66 Ca -0.08 0.48 -0.20 0.00 -0.00 0.00 0.00 52.55 52.75 1id2 s ASP 66 Cb 0.11 -1.24 -0.10 0.00 -0.00 0.00 0.00 42.92 41.68 1id2 s ASP 66 CO 0.86 -1.41 0.97 0.00 -0.00 0.00 0.00 175.17 175.60 1id2 s ALA 67 N -3.13 3.02 -0.11 5.23 0.00 -1.26 -3.94 121.76 121.57 1id2 s ALA 67 Ca 0.58 0.37 0.01 0.00 0.00 0.00 0.00 51.96 52.92 1id2 s ALA 67 Cb -0.11 -3.16 0.02 0.00 0.00 0.00 0.00 23.12 19.88 1id2 s ALA 67 CO 0.44 -0.04 -0.12 0.12 0.00 0.00 0.00 175.76 176.15 1id2 s PHE 68 N -2.28 1.77 -0.22 0.00 2.19 -0.66 -4.96 117.98 113.82 1id2 s PHE 68 Ca 0.62 -0.84 0.02 0.00 0.33 0.00 0.00 56.93 57.06 1id2 s PHE 68 Cb -0.10 -1.33 0.04 0.00 -1.31 0.00 0.00 43.02 40.32 1id2 s PHE 68 CO 0.19 -0.47 -0.15 0.50 1.83 0.00 0.00 175.22 177.12 1id2 s ARG 69 N 1.18 2.59 0.73 10.12 3.52 -1.26 0.20 118.95 136.03 1id2 s ARG 69 Ca -0.04 -1.10 -0.11 0.00 -0.13 0.00 0.00 55.73 54.35 1id2 s ARG 69 Cb -0.14 -2.74 0.03 0.00 -1.56 0.00 0.00 34.95 30.54 1id2 s ARG 69 CO -0.04 -0.40 1.07 0.20 -0.81 0.00 0.00 175.30 175.33 1id2 s GLY 70 N 1.19 1.66 0.55 8.12 0.00 0.11 -4.99 107.32 113.96 1id2 s GLY 70 Ca -0.02 0.10 -0.18 0.00 0.00 0.00 0.00 44.72 44.62 1id2 s GLY 70 CO -0.09 0.44 1.09 -0.54 0.00 0.00 0.00 173.10 174.01 1id2 s GLU 71 N -5.01 3.38 0.16 2.90 2.02 -1.26 -4.55 118.70 116.33 1id2 s GLU 71 Ca 0.59 1.46 -0.31 0.00 0.02 0.00 0.00 54.97 56.74 1id2 s GLU 71 Cb -0.15 -2.02 -0.09 0.00 0.10 0.00 0.00 34.13 31.97 1id2 s GLU 71 CO 0.55 -0.80 1.39 -1.64 0.02 0.00 0.00 175.26 174.78 1id2 s MET 72 N -3.50 4.32 -0.08 1.61 -1.94 -1.26 -4.60 119.30 113.85 1id2 s MET 72 Ca 0.69 2.13 -0.12 0.00 -1.71 0.00 0.00 55.69 56.67 1id2 s MET 72 Cb -0.20 -3.21 -0.05 0.00 2.01 0.00 0.00 34.83 33.38 1id2 s MET 72 CO 0.29 -0.40 0.31 -1.64 -0.01 0.00 0.00 175.02 173.56 1id2 s MET 73 N 0.59 3.90 0.26 2.03 1.00 0.23 -4.81 119.30 122.50 1id2 s MET 73 Ca 0.62 0.18 0.03 0.00 0.00 0.00 0.00 55.69 56.52 1id2 s MET 73 Cb -0.38 -3.28 0.05 0.00 0.00 0.00 0.00 34.83 31.22 1id2 s MET 73 CO 0.34 0.57 0.36 0.25 0.00 0.00 0.00 175.02 176.54 1id2 n THR 74 N 2.41 0.00 -1.67 2.05 -2.24 -1.26 -2.06 114.28 111.51 1id2 n THR 74 Ca -0.15 -0.78 -0.46 0.00 -2.27 0.00 0.00 64.05 60.40 1id2 n THR 74 Cb 0.53 -0.89 -0.04 0.00 -2.10 0.00 0.00 70.33 67.83 1id2 n THR 74 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1id2 n LYS 75 N -1.60 2.05 -3.06 -0.78 4.81 -1.20 -1.62 118.16 116.77 1id2 n LYS 75 Ca 0.07 0.74 -0.18 0.00 -0.87 0.00 0.00 58.31 58.06 1id2 n LYS 75 Cb 0.25 -2.45 -0.01 0.00 0.02 0.00 0.00 35.03 32.85 1id2 n LYS 75 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1id2 n ASP 76 N 2.81 -3.43 -4.94 3.14 10.43 0.37 -4.99 116.55 119.94 1id2 n ASP 76 Ca 0.15 -0.17 -0.24 0.00 2.57 0.00 0.00 54.79 57.10 1id2 n ASP 76 Cb 0.30 -2.88 -0.01 0.00 1.84 0.00 0.00 41.12 40.36 1id2 n ASP 76 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1id2 s GLN 77 N -5.68 3.50 0.23 -1.24 -0.21 -0.64 -1.35 119.66 114.27 1id2 s GLN 77 Ca 0.26 -0.31 0.05 0.00 0.02 0.00 0.00 55.36 55.39 1id2 s GLN 77 Cb -0.14 -2.66 -0.05 0.00 1.00 0.00 0.00 33.01 31.15 1id2 s GLN 77 CO 0.33 0.16 -0.06 0.00 -2.12 0.00 0.00 175.29 173.60 1id2 s ALA 78 N -2.29 1.95 -0.13 6.09 0.00 0.59 -1.64 121.76 126.33 1id2 s ALA 78 Ca 0.40 -1.75 -0.11 0.00 0.00 0.00 0.00 51.96 50.51 1id2 s ALA 78 Cb -0.10 0.24 0.04 0.00 0.00 0.00 0.00 23.12 23.30 1id2 s ALA 78 CO 0.36 -0.13 0.34 -0.47 0.00 0.00 0.00 175.76 175.86 1id2 s TYR 79 N -3.22 -0.40 -0.03 0.00 6.14 0.42 -1.79 117.35 118.48 1id2 s TYR 79 Ca 0.26 0.94 0.07 0.00 0.64 0.00 0.00 57.07 58.98 1id2 s TYR 79 Cb 0.04 0.14 -0.02 0.00 0.42 0.00 0.00 41.96 42.54 1id2 s TYR 79 CO 0.08 -0.20 -0.24 0.00 0.64 0.00 0.00 175.55 175.83 1id2 s ALA 80 N 0.43 1.99 -0.04 3.97 0.00 -1.26 -0.47 121.76 126.38 1id2 s ALA 80 Ca -0.02 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 50.93 1id2 s ALA 80 Cb -0.04 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.57 1id2 s ALA 80 CO -0.02 0.46 -0.02 0.42 0.00 0.00 0.00 175.76 176.60 1id2 s ILE 81 N -0.46 0.38 -0.19 0.00 1.01 -0.89 -4.59 121.20 116.45 1id2 s ILE 81 Ca 0.06 -0.03 -0.14 0.00 0.00 0.00 0.00 60.65 60.54 1id2 s ILE 81 Cb -0.10 -0.44 -0.04 0.00 0.01 0.00 0.00 42.46 41.89 1id2 s ILE 81 CO 0.00 0.19 0.32 -0.89 0.00 0.00 0.00 174.94 174.56 1id2 s THR 82 N 0.99 5.26 -0.35 2.92 2.01 0.08 -1.10 115.64 125.45 1id2 s THR 82 Ca -0.10 0.56 -0.11 0.00 0.31 0.00 0.00 61.69 62.35 1id2 s THR 82 Cb -0.14 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.72 1id2 s THR 82 CO -0.01 0.32 0.20 -0.36 -0.69 0.00 0.00 174.62 174.08 1id2 s PHE 83 N 0.97 3.22 -0.07 4.92 0.40 -0.66 -0.00 117.98 126.75 1id2 s PHE 83 Ca 0.16 -0.69 0.14 0.00 -0.60 0.00 0.00 56.93 55.94 1id2 s PHE 83 Cb -0.14 -2.42 -0.22 0.00 0.51 0.00 0.00 43.02 40.75 1id2 s PHE 83 CO 0.06 -0.53 0.62 0.09 0.70 0.00 0.00 175.22 176.15 1id2 n ASN 84 N 5.02 0.77 -4.53 1.36 3.02 -0.46 0.72 115.26 121.16 1id2 n ASN 84 Ca -0.13 0.36 -0.33 0.00 -0.03 0.00 0.00 54.58 54.45 1id2 n ASN 84 Cb 0.48 0.10 -0.12 0.00 -0.61 0.00 0.00 39.78 39.62 1id2 n ASN 84 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1id2 s GLU 85 N -2.63 2.62 0.36 3.52 2.02 -1.20 -4.11 118.70 119.27 1id2 s GLU 85 Ca -0.05 -0.62 -0.27 0.00 0.02 0.00 0.00 54.97 54.05 1id2 s GLU 85 Cb 0.08 -2.49 -0.12 0.00 0.10 0.00 0.00 34.13 31.70 1id2 s GLU 85 CO 0.82 0.64 1.15 0.00 0.02 0.00 0.00 175.26 177.90 1id2 n ALA 86 N 2.24 0.65 0.00 5.21 0.00 -1.26 -4.77 120.51 122.58 1id2 n ALA 86 Ca -0.17 0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1id2 n ALA 86 Cb 0.53 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1id2 n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1id2 n GLY 87 N 0.99 -0.89 3.15 0.00 0.00 0.18 -4.94 105.19 103.69 1id2 n GLY 87 Ca 0.07 -1.47 -0.33 0.00 0.00 0.00 0.00 46.02 44.30 1id2 n GLY 87 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1id2 s SER 88 N -3.00 3.11 -0.20 1.61 0.01 -1.26 -0.62 113.70 113.35 1id2 s SER 88 Ca 0.00 -0.62 0.01 0.00 1.31 0.00 0.00 55.95 56.65 1id2 s SER 88 Cb 0.00 -1.45 0.04 0.00 0.21 0.00 0.00 66.02 64.82 1id2 s SER 88 CO 0.00 0.05 -0.12 -0.31 0.41 0.00 0.00 173.24 173.27 1id2 s TYR 89 N 0.96 2.60 0.10 2.43 2.02 -0.05 -4.98 117.35 120.44 1id2 s TYR 89 Ca -0.03 -1.70 -0.21 0.00 -0.37 0.00 0.00 57.07 54.75 1id2 s TYR 89 Cb -0.15 -1.73 -0.07 0.00 -0.40 0.00 0.00 41.96 39.61 1id2 s TYR 89 CO -0.05 -0.77 0.64 -0.51 -1.57 0.00 0.00 175.55 173.28 1id2 s ASP 90 N 1.33 7.17 0.27 2.29 1.11 -1.26 -0.32 116.67 127.26 1id2 s ASP 90 Ca -0.01 1.39 0.02 0.00 0.18 0.00 0.00 52.55 54.13 1id2 s ASP 90 Cb -0.16 -2.41 -0.05 0.00 1.07 0.00 0.00 42.92 41.37 1id2 s ASP 90 CO -0.09 0.25 0.07 -0.72 1.18 0.00 0.00 175.17 175.86 1id2 s TYR 91 N -1.10 1.63 0.26 4.23 -0.85 -0.31 -4.64 117.35 116.58 1id2 s TYR 91 Ca 0.31 -1.08 -0.11 0.00 -0.52 0.00 0.00 57.07 55.68 1id2 s TYR 91 Cb -0.21 -0.99 -0.00 0.00 0.38 0.00 0.00 41.96 41.14 1id2 s TYR 91 CO 0.21 -0.20 0.47 -0.59 -1.52 0.00 0.00 175.55 173.93 1id2 s PHE 92 N -3.58 0.48 -0.23 -3.49 -0.71 -0.63 -1.34 117.98 108.48 1id2 s PHE 92 Ca 0.35 -0.83 -0.09 0.00 -1.04 0.00 0.00 56.93 55.32 1id2 s PHE 92 Cb 0.08 0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.99 1id2 s PHE 92 CO 0.13 -1.02 0.12 0.00 -1.34 0.00 0.00 175.22 173.11 1id2 h THR 94 N 5.15 0.76 -0.00 0.00 2.02 -1.92 -1.56 112.91 117.35 1id2 h THR 94 Ca -0.37 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 66.77 1id2 h THR 94 Cb 1.17 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1id2 h THR 94 CO 0.63 0.02 -0.13 -0.81 0.37 0.00 0.00 175.52 175.61 1id2 n PRO 95 N -5.17 0.09 -3.26 6.66 -0.04 -1.26 -4.30 135.00 127.72 1id2 n PRO 95 Ca 0.01 -0.02 -0.25 0.00 -0.04 0.00 0.00 63.50 63.20 1id2 n PRO 95 Cb 0.17 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.06 1id2 n PRO 95 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1id2 n HIS 96 N -1.44 1.08 0.48 0.54 8.25 -0.63 -4.97 115.22 118.53 1id2 n HIS 96 Ca 0.08 -3.78 0.06 0.00 -0.26 0.00 0.00 57.72 53.82 1id2 n HIS 96 Cb 0.33 -0.42 0.27 0.00 1.12 0.00 0.00 29.99 31.28 1id2 n HIS 96 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1id2 n PRO 97 N 1.16 0.07 0.22 -0.41 -0.02 -0.96 -0.50 135.00 134.57 1id2 n PRO 97 Ca 0.24 0.24 0.14 0.00 -2.02 0.00 0.00 63.50 62.11 1id2 n PRO 97 Cb 0.49 -1.50 0.42 0.00 -0.02 0.00 0.00 33.50 32.89 1id2 n PRO 97 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1id2 h PHE 98 N 0.00 0.00 -3.15 6.00 -5.15 -1.93 -3.42 116.94 109.29 1id2 h PHE 98 Ca 0.00 0.00 -0.58 0.00 -0.20 0.00 0.00 57.97 57.19 1id2 h PHE 98 Cb 0.16 0.00 -0.06 0.00 0.22 0.00 0.00 35.95 36.28 1id2 h PHE 98 CO 0.00 0.00 0.84 -1.64 -2.00 0.00 0.00 178.31 175.51 1id2 s MET 99 N -3.39 4.17 0.04 6.09 -1.94 0.34 -5.04 119.30 119.57 1id2 s MET 99 Ca 0.05 1.29 -0.01 0.00 -1.71 0.00 0.00 55.69 55.30 1id2 s MET 99 Cb 0.08 -3.70 -0.03 0.00 2.01 0.00 0.00 34.83 33.19 1id2 s MET 99 CO 0.59 -0.76 -0.02 1.03 -0.01 0.00 0.00 175.02 175.86 1id2 s ARG 100 N 3.44 0.47 0.27 2.03 0.52 -1.26 -2.10 118.95 122.32 1id2 s ARG 100 Ca 0.46 -0.90 -0.09 0.00 -0.52 0.00 0.00 55.73 54.68 1id2 s ARG 100 Cb -0.15 0.17 0.04 0.00 0.52 0.00 0.00 34.95 35.53 1id2 s ARG 100 CO 0.11 -0.09 0.51 0.41 0.02 0.00 0.00 175.30 176.26 1id2 n GLY 101 N 0.84 1.46 3.24 -3.53 0.00 -0.45 -4.75 105.19 102.00 1id2 n GLY 101 Ca -0.19 -1.23 -0.13 0.00 0.00 0.00 0.00 46.02 44.47 1id2 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1id2 s LYS 102 N -2.13 0.66 -0.18 1.61 -2.85 0.90 -1.16 119.74 116.59 1id2 s LYS 102 Ca 0.12 -0.16 -0.02 0.00 -1.00 0.00 0.00 55.97 54.91 1id2 s LYS 102 Cb -0.03 0.29 -0.01 0.00 -2.06 0.00 0.00 37.83 36.02 1id2 s LYS 102 CO 0.09 -0.18 -0.10 0.08 0.10 0.00 0.00 175.35 175.34 1id2 s VAL 103 N -1.26 3.08 -0.32 1.79 1.01 0.56 -1.52 120.40 123.73 1id2 s VAL 103 Ca -0.13 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.12 1id2 s VAL 103 Cb -0.05 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1id2 s VAL 103 CO 0.04 0.48 0.20 -0.63 0.00 0.00 0.00 175.10 175.20 1id2 s ILE 104 N 0.97 5.04 -0.15 2.22 1.01 0.72 -0.88 121.20 130.14 1id2 s ILE 104 Ca -0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.34 1id2 s ILE 104 Cb -0.15 -3.56 -0.03 0.00 0.01 0.00 0.00 42.46 38.73 1id2 s ILE 104 CO -0.01 0.04 -0.00 -0.69 0.00 0.00 0.00 174.94 174.28 1id2 s VAL 105 N 1.69 4.23 0.00 2.92 1.01 0.21 -1.03 120.40 129.43 1id2 s VAL 105 Ca 0.06 -0.24 0.00 0.00 0.00 0.00 0.00 61.98 61.79 1id2 s VAL 105 Cb -0.17 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1id2 s VAL 105 CO 0.09 0.50 0.06 -1.84 0.00 0.00 0.00 175.10 173.91