#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1id2 n ASP 2 N 0.00 0.00 -0.04 1.08 2.03 -1.18 -4.80 116.55 113.64 1id2 n ASP 2 Ca 0.00 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.44 1id2 n ASP 2 Cb 0.00 0.00 0.46 0.00 -0.72 0.00 0.00 41.12 40.86 1id2 n ASP 2 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1id2 n LYS 3 N 0.00 0.22 -4.30 -0.67 5.02 -0.78 -4.96 118.16 112.69 1id2 n LYS 3 Ca 0.00 -0.09 -0.16 0.00 -2.02 0.00 0.00 58.31 56.05 1id2 n LYS 3 Cb 0.00 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.41 1id2 n LYS 3 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1id2 s ILE 4 N -2.84 0.87 -0.14 -0.18 -4.36 -1.26 -0.71 121.20 112.58 1id2 s ILE 4 Ca 0.17 -2.01 -0.00 0.00 -0.26 0.00 0.00 60.65 58.55 1id2 s ILE 4 Cb 0.19 -2.30 0.03 0.00 1.25 0.00 0.00 42.46 41.62 1id2 s ILE 4 CO 0.58 -0.34 -0.10 -0.89 0.24 0.00 0.00 174.94 174.43 1id2 s THR 5 N -3.53 1.29 -1.05 8.37 2.01 -0.61 -4.94 115.64 117.19 1id2 s THR 5 Ca 0.28 -0.49 -0.15 0.00 0.31 0.00 0.00 61.69 61.63 1id2 s THR 5 Cb 0.06 -1.28 0.17 0.00 0.01 0.00 0.00 72.50 71.47 1id2 s THR 5 CO 0.08 0.38 1.21 -0.69 -0.69 0.00 0.00 174.62 174.90 1id2 s VAL 6 N 1.60 5.08 0.00 3.82 1.01 -1.26 -1.54 120.40 129.11 1id2 s VAL 6 Ca 0.04 -2.29 0.00 0.00 0.00 0.00 0.00 61.98 59.73 1id2 s VAL 6 Cb -0.13 -4.78 0.00 0.00 0.00 0.00 0.00 36.38 31.47 1id2 s VAL 6 CO -0.09 -1.47 0.00 0.41 0.00 0.00 0.00 175.10 173.95 1id2 n THR 7 N 4.68 0.00 -4.74 3.92 -1.04 -1.26 -4.48 114.28 111.37 1id2 n THR 7 Ca 0.28 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 62.04 1id2 n THR 7 Cb 0.45 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.80 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 1.97 0.25 8.00 0.15 -1.26 -5.02 113.70 117.79 1id2 s SER 8 Ca 0.00 -0.32 0.07 0.00 0.70 0.00 0.00 55.95 56.39 1id2 s SER 8 Cb 0.00 -0.61 0.29 0.00 -1.71 0.00 0.00 66.02 63.99 1id2 s SER 8 CO 0.00 0.12 1.58 -0.08 1.20 0.00 0.00 173.24 176.06 1id2 h GLU 9 N 6.39 0.15 -6.62 5.44 4.57 -1.94 -3.44 114.58 119.13 1id2 h GLU 9 Ca -0.32 -0.11 -0.51 0.00 -1.18 0.00 0.00 59.36 57.24 1id2 h GLU 9 Cb 1.18 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.76 1id2 h GLU 9 CO 0.48 0.72 0.06 0.21 -1.18 0.00 0.00 179.01 179.29 1id2 s LYS 10 N -3.70 4.04 0.64 1.92 2.20 -1.26 -4.23 119.74 119.35 1id2 s LYS 10 Ca -0.03 0.66 -0.17 0.00 -0.36 0.00 0.00 55.97 56.07 1id2 s LYS 10 Cb 0.12 -2.61 -0.01 0.00 -1.51 0.00 0.00 37.83 33.82 1id2 s LYS 10 CO 0.79 0.26 1.17 -2.14 -0.36 0.00 0.00 175.35 175.06 1id2 s PRO 11 N -2.62 2.77 0.36 4.03 0.02 -1.26 -4.97 135.00 133.32 1id2 s PRO 11 Ca 0.49 1.65 0.08 0.00 0.02 0.00 0.00 61.00 63.24 1id2 s PRO 11 Cb -0.12 -1.92 -0.03 0.00 0.02 0.00 0.00 34.50 32.44 1id2 s PRO 11 CO 0.19 -1.33 0.23 0.14 -0.33 0.00 0.00 177.00 175.91 1id2 s VAL 12 N -1.93 3.03 0.44 3.83 -7.23 -0.15 -4.88 120.40 113.51 1id2 s VAL 12 Ca 0.73 -1.53 -0.24 0.00 -1.81 0.00 0.00 61.98 59.13 1id2 s VAL 12 Cb -0.26 -3.05 -0.08 0.00 0.56 0.00 0.00 36.38 33.55 1id2 s VAL 12 CO 0.38 -0.13 1.16 0.00 -0.31 0.00 0.00 175.10 176.20 1id2 s ALA 13 N -2.42 3.04 0.57 1.32 0.00 -1.26 0.71 121.76 123.73 1id2 s ALA 13 Ca 0.41 0.93 0.27 0.00 0.00 0.00 0.00 51.96 53.57 1id2 s ALA 13 Cb -0.03 -3.37 1.55 0.00 0.00 0.00 0.00 23.12 21.26 1id2 s ALA 13 CO 0.25 -0.58 2.03 0.00 0.00 0.00 0.00 175.76 177.46 1id2 h ALA 14 N 2.27 2.04 0.00 0.00 0.00 -1.75 0.40 119.26 122.22 1id2 h ALA 14 Ca -0.49 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1id2 h ALA 14 Cb 1.24 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 1id2 h ALA 14 CO 0.61 -0.45 -0.12 0.00 0.00 0.00 0.00 179.25 179.29 1id2 h ALA 15 N 1.70 1.16 0.00 0.00 0.00 -1.90 -2.26 119.26 117.95 1id2 h ALA 15 Ca 0.14 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1id2 h ALA 15 Cb 0.73 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1id2 h ALA 15 CO -0.00 0.15 -0.07 -0.44 0.00 0.00 0.00 179.25 178.89 1id2 h ASP 16 N 0.00 0.00 -2.75 0.00 3.45 -1.28 -3.45 116.42 112.38 1id2 h ASP 16 Ca -0.00 -0.02 -0.52 0.00 0.43 0.00 0.00 57.03 56.92 1id2 h ASP 16 Cb 0.43 0.00 0.05 0.00 -0.56 0.00 0.00 39.33 39.25 1id2 h ASP 16 CO 0.02 0.01 0.94 -0.69 -1.57 0.00 0.00 179.24 177.94 1id2 s VAL 17 N -3.13 2.41 0.60 -1.35 1.01 -0.85 -4.99 120.40 114.10 1id2 s VAL 17 Ca 0.09 0.28 -0.19 0.00 0.00 0.00 0.00 61.98 62.16 1id2 s VAL 17 Cb 0.11 -3.18 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 1id2 s VAL 17 CO 0.62 0.02 1.28 -2.16 0.00 0.00 0.00 175.10 174.86 1id2 s PRO 18 N 1.24 2.89 0.40 2.72 0.04 -1.26 -4.93 135.00 136.10 1id2 s PRO 18 Ca 0.72 2.01 0.28 0.00 0.04 0.00 0.00 61.00 64.06 1id2 s PRO 18 Cb -0.46 -2.00 1.32 0.00 0.04 0.00 0.00 34.50 33.40 1id2 s PRO 18 CO 0.32 -1.32 1.86 0.00 0.04 0.00 0.00 177.00 177.89 1id2 h ALA 19 N 0.95 1.00 -0.14 8.56 0.00 -1.97 -2.90 119.26 124.75 1id2 h ALA 19 Ca -0.51 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.19 1id2 h ALA 19 Cb 1.31 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.11 1id2 h ALA 19 CO 0.55 0.00 -0.75 -0.44 0.00 0.00 0.00 179.25 178.61 1id2 h ASP 20 N 0.00 0.81 -4.00 0.00 3.45 -2.03 -3.49 116.42 111.16 1id2 h ASP 20 Ca 0.00 -0.52 -0.49 0.00 0.43 0.00 0.00 57.03 56.44 1id2 h ASP 20 Cb 0.26 -0.24 0.18 0.00 -0.56 0.00 0.00 39.33 38.98 1id2 h ASP 20 CO 0.00 1.31 0.19 0.00 -1.57 0.00 0.00 179.24 179.17 1id2 s ALA 21 N -3.74 1.13 -0.25 3.45 0.00 -1.10 -4.99 121.76 116.25 1id2 s ALA 21 Ca -0.09 0.26 -0.21 0.00 0.00 0.00 0.00 51.96 51.92 1id2 s ALA 21 Cb 0.09 -3.33 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 1id2 s ALA 21 CO 0.89 -2.81 0.66 0.54 0.00 0.00 0.00 175.76 175.03 1id2 s VAL 22 N -2.69 4.96 -0.07 0.00 0.11 -1.26 -5.04 120.40 116.41 1id2 s VAL 22 Ca 0.66 1.19 0.05 0.00 -2.93 0.00 0.00 61.98 60.95 1id2 s VAL 22 Cb -0.22 -3.96 -0.01 0.00 -1.53 0.00 0.00 36.38 30.66 1id2 s VAL 22 CO 0.59 0.01 -0.23 -0.69 -3.33 0.00 0.00 175.10 171.45 1id2 s VAL 23 N 2.56 1.91 -0.31 2.04 1.01 -1.26 -1.31 120.40 125.04 1id2 s VAL 23 Ca 0.27 -0.97 -0.05 0.00 0.00 0.00 0.00 61.98 61.23 1id2 s VAL 23 Cb -0.15 -1.63 0.03 0.00 0.00 0.00 0.00 36.38 34.62 1id2 s VAL 23 CO 0.08 0.53 0.06 -0.69 0.00 0.00 0.00 175.10 175.09 1id2 s VAL 24 N 0.03 3.61 0.59 2.92 1.01 0.90 -4.95 120.40 124.52 1id2 s VAL 24 Ca -0.08 -1.01 -0.15 0.00 0.00 0.00 0.00 61.98 60.74 1id2 s VAL 24 Cb -0.15 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1id2 s VAL 24 CO 0.05 -0.04 1.05 -0.83 0.00 0.00 0.00 175.10 175.33 1id2 s GLY 25 N 1.40 2.09 -0.14 4.51 0.00 -1.26 -1.06 107.32 112.86 1id2 s GLY 25 Ca -0.01 0.34 -0.00 0.00 0.00 0.00 0.00 44.72 45.05 1id2 s GLY 25 CO 0.01 0.65 -0.06 -0.42 0.00 0.00 0.00 173.10 173.28 1id2 s ILE 26 N -2.52 1.07 -0.19 0.90 1.01 0.46 -0.55 121.20 121.38 1id2 s ILE 26 Ca 0.63 -0.47 -0.19 0.00 0.00 0.00 0.00 60.65 60.62 1id2 s ILE 26 Cb -0.15 -1.17 0.05 0.00 0.01 0.00 0.00 42.46 41.20 1id2 s ILE 26 CO 0.37 0.24 0.53 -0.70 0.00 0.00 0.00 174.94 175.39 1id2 s GLU 27 N 1.67 0.63 -1.23 2.79 2.56 -0.73 -1.10 118.70 123.29 1id2 s GLU 27 Ca 0.03 0.70 -0.01 0.00 0.00 0.00 0.00 54.97 55.69 1id2 s GLU 27 Cb -0.14 0.31 -0.00 0.00 2.00 0.00 0.00 34.13 36.29 1id2 s GLU 27 CO -0.08 -0.08 0.87 1.63 -0.56 0.00 0.00 175.26 177.04 1id2 n LYS 28 N 2.70 -5.60 -3.75 4.30 4.76 -1.26 -2.95 118.16 116.37 1id2 n LYS 28 Ca -0.14 0.75 -0.28 0.00 -2.87 0.00 0.00 58.31 55.78 1id2 n LYS 28 Cb 0.56 -5.56 0.04 0.00 -1.84 0.00 0.00 35.03 28.24 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 -4.14 -6.08 -3.53 1.97 2.81 -1.26 -4.98 117.12 101.90 1id2 n MET 29 Ca -0.28 0.68 -0.17 0.00 -1.81 0.00 0.00 57.70 56.11 1id2 n MET 29 Cb 0.67 -5.61 -0.06 0.00 -0.71 0.00 0.00 33.22 27.51 1id2 n MET 29 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 1id2 s LYS 30 N -6.46 1.03 0.00 0.03 -2.85 -1.15 -4.76 119.74 105.58 1id2 s LYS 30 Ca 0.61 0.35 -0.30 0.00 -1.00 0.00 0.00 55.97 55.63 1id2 s LYS 30 Cb -0.30 0.49 -0.05 0.00 -2.06 0.00 0.00 37.83 35.91 1id2 s LYS 30 CO 0.76 -0.30 1.26 0.71 0.10 0.00 0.00 175.35 177.87 1id2 s TYR 31 N -1.00 3.19 -0.63 1.78 2.02 -1.26 -1.77 117.35 119.67 1id2 s TYR 31 Ca -0.10 1.13 0.25 0.00 -0.37 0.00 0.00 57.07 57.99 1id2 s TYR 31 Cb -0.01 -3.49 0.62 0.00 -0.40 0.00 0.00 41.96 38.68 1id2 s TYR 31 CO 0.09 -1.63 1.67 -0.07 -1.57 0.00 0.00 175.55 174.04 1id2 h LEU 32 N 7.74 0.00 -6.92 -1.29 3.38 -1.16 -3.34 115.31 113.72 1id2 h LEU 32 Ca -0.38 -0.02 -0.61 0.00 0.09 0.00 0.00 57.88 56.97 1id2 h LEU 32 Cb 1.18 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.53 1id2 h LEU 32 CO 0.86 0.01 -0.75 -0.89 0.09 0.00 0.00 178.44 177.77 1id2 s THR 33 N -3.14 1.46 0.13 0.22 2.01 -1.26 -4.97 115.64 110.09 1id2 s THR 33 Ca 0.09 -2.79 0.34 0.00 0.31 0.00 0.00 61.69 59.64 1id2 s THR 33 Cb 0.10 -2.01 0.38 0.00 0.01 0.00 0.00 72.50 70.98 1id2 s THR 33 CO 0.63 -0.95 2.02 -0.65 -0.69 0.00 0.00 174.62 174.98 1id2 h PRO 34 N 6.41 0.00 -3.89 4.92 0.11 -1.88 -3.40 132.00 134.27 1id2 h PRO 34 Ca 0.05 0.00 -0.44 0.00 0.11 0.00 0.00 66.00 65.71 1id2 h PRO 34 Cb 0.90 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.65 1id2 h PRO 34 CO 0.50 0.00 -0.77 -2.00 -0.21 0.00 0.00 178.00 175.51 1id2 s GLU 35 N -3.72 0.84 0.04 1.05 2.12 -1.26 0.50 118.70 118.27 1id2 s GLU 35 Ca 0.00 -0.02 0.05 0.00 0.36 0.00 0.00 54.97 55.36 1id2 s GLU 35 Cb 0.10 -1.04 -0.02 0.00 0.26 0.00 0.00 34.13 33.42 1id2 s GLU 35 CO 0.48 -0.23 -0.14 0.54 -0.54 0.00 0.00 175.26 175.38 1id2 s VAL 36 N 1.60 1.07 -0.18 3.70 0.11 -0.77 -5.00 120.40 120.93 1id2 s VAL 36 Ca 0.00 -1.05 0.00 0.00 -2.93 0.00 0.00 61.98 58.00 1id2 s VAL 36 Cb -0.13 -0.99 0.04 0.00 -1.53 0.00 0.00 36.38 33.77 1id2 s VAL 36 CO -0.04 -0.06 -0.07 0.28 -3.33 0.00 0.00 175.10 171.88 1id2 s THR 37 N -0.95 1.31 0.50 5.04 -1.32 -1.26 -0.77 115.64 118.20 1id2 s THR 37 Ca 0.00 -0.77 0.00 0.00 -1.21 0.00 0.00 61.69 59.72 1id2 s THR 37 Cb -0.08 -1.45 0.00 0.00 -1.51 0.00 0.00 72.50 69.46 1id2 s THR 37 CO 0.01 0.15 0.02 2.30 -2.21 0.00 0.00 174.62 174.89 1id2 n ILE 38 N 4.80 0.00 -3.98 5.08 -5.35 0.26 -4.97 119.36 115.20 1id2 n ILE 38 Ca -0.13 -2.34 -0.30 0.00 -0.27 0.00 0.00 62.75 59.71 1id2 n ILE 38 Cb 0.47 0.44 -0.05 0.00 -1.74 0.00 0.00 39.64 38.77 1id2 n ILE 38 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1id2 s LYS 39 N -3.82 3.20 0.35 6.28 -0.14 -1.26 -0.06 119.74 124.29 1id2 s LYS 39 Ca 0.02 -0.56 -0.27 0.00 -1.36 0.00 0.00 55.97 53.80 1id2 s LYS 39 Cb -0.00 -2.90 -0.12 0.00 -1.68 0.00 0.00 37.83 33.13 1id2 s LYS 39 CO 0.01 0.59 1.10 0.00 -0.76 0.00 0.00 175.35 176.28 1id2 n ALA 40 N 0.31 0.38 -0.08 5.17 0.00 -1.26 -1.85 120.51 123.19 1id2 n ALA 40 Ca -0.07 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.70 1id2 n ALA 40 Cb 0.51 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.85 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 1.07 1.29 3.89 0.00 0.00 0.24 -4.96 105.19 106.71 1id2 n GLY 41 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.53 3.72 -0.18 1.61 2.02 -0.77 -4.75 118.70 119.82 1id2 s GLU 42 Ca 0.00 0.15 -0.07 0.00 0.02 0.00 0.00 54.97 55.08 1id2 s GLU 42 Cb 0.00 -2.64 -0.04 0.00 0.10 0.00 0.00 34.13 31.55 1id2 s GLU 42 CO 0.00 0.25 0.04 0.99 0.02 0.00 0.00 175.26 176.56 1id2 s THR 43 N -1.97 4.59 -0.15 3.63 2.01 -1.26 -1.13 115.64 121.35 1id2 s THR 43 Ca 0.46 -0.11 -0.09 0.00 0.31 0.00 0.00 61.69 62.26 1id2 s THR 43 Cb -0.11 -3.06 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 1id2 s THR 43 CO 0.26 0.47 0.15 -0.69 -0.69 0.00 0.00 174.62 174.11 1id2 s VAL 44 N 0.37 5.45 -0.08 3.82 1.01 -0.82 -4.30 120.40 125.85 1id2 s VAL 44 Ca 0.01 0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.21 1id2 s VAL 44 Cb -0.13 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 1id2 s VAL 44 CO 0.01 0.53 0.00 -0.31 0.00 0.00 0.00 175.10 175.34 1id2 s TYR 45 N -0.39 3.16 -0.07 5.22 1.51 -0.43 -2.39 117.35 123.97 1id2 s TYR 45 Ca 0.12 0.19 0.01 0.00 -1.01 0.00 0.00 57.07 56.38 1id2 s TYR 45 Cb -0.12 -1.78 -0.03 0.00 -0.11 0.00 0.00 41.96 39.92 1id2 s TYR 45 CO 0.02 0.47 -0.08 -1.58 -1.11 0.00 0.00 175.55 173.27 1id2 s TRP 46 N -0.90 2.90 -0.11 2.71 0.51 0.74 -0.07 118.94 124.72 1id2 s TRP 46 Ca 0.14 -0.05 0.01 0.00 -2.12 0.00 0.00 56.10 54.07 1id2 s TRP 46 Cb -0.11 -1.72 0.02 0.00 -0.81 0.00 0.00 33.47 30.85 1id2 s TRP 46 CO 0.03 0.26 -0.12 0.08 -0.51 0.00 0.00 176.95 176.69 1id2 s VAL 47 N -0.68 1.30 -0.26 4.03 1.01 -0.22 -0.85 120.40 124.72 1id2 s VAL 47 Ca 0.10 -0.50 -0.23 0.00 0.00 0.00 0.00 61.98 61.36 1id2 s VAL 47 Cb -0.11 -1.22 -0.01 0.00 0.00 0.00 0.00 36.38 35.03 1id2 s VAL 47 CO 0.02 0.41 0.75 0.21 0.00 0.00 0.00 175.10 176.48 1id2 s ASN 48 N 1.24 6.71 0.00 3.32 2.47 -0.73 -0.40 114.94 127.55 1id2 s ASN 48 Ca -0.02 0.84 0.24 0.00 0.42 0.00 0.00 52.86 54.34 1id2 s ASN 48 Cb -0.14 -2.40 0.34 0.00 -1.45 0.00 0.00 41.25 37.61 1id2 s ASN 48 CO -0.04 -0.49 1.31 0.61 -3.72 0.00 0.00 177.10 174.77 1id2 n GLY 49 N 3.99 -0.32 3.48 1.21 0.00 -0.26 0.63 105.19 113.92 1id2 n GLY 49 Ca 0.03 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.52 1.66 0.46 1.61 -1.05 -1.26 -4.72 118.70 112.88 1id2 s GLU 50 Ca 0.21 -1.86 0.26 0.00 -0.15 0.00 0.00 54.97 53.43 1id2 s GLU 50 Cb 0.19 -1.32 0.66 0.00 -0.44 0.00 0.00 34.13 33.22 1id2 s GLU 50 CO 0.56 0.04 1.73 -0.39 0.95 0.00 0.00 175.26 178.15 1id2 h VAL 51 N 2.16 0.00 -2.42 1.83 -1.51 -1.94 -2.91 116.25 111.46 1id2 h VAL 51 Ca -0.41 -0.82 -0.54 0.00 -1.23 0.00 0.00 66.70 63.70 1id2 h VAL 51 Cb 1.24 1.82 0.04 0.00 -2.13 0.00 0.00 31.29 32.25 1id2 h VAL 51 CO 0.69 0.00 1.10 0.80 -1.23 0.00 0.00 177.57 178.93 1id2 n MET 52 N -3.04 2.69 -2.50 5.19 0.00 -1.26 -4.66 117.12 113.54 1id2 n MET 52 Ca 0.03 0.98 -0.39 0.00 0.00 0.00 0.00 57.70 58.32 1id2 n MET 52 Cb 0.46 -2.86 -0.04 0.00 0.00 0.00 0.00 33.22 30.77 1id2 n MET 52 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 175.97 173.83 1id2 s PRO 53 N 2.87 4.50 0.03 2.12 0.02 -1.26 -4.77 135.00 138.51 1id2 s PRO 53 Ca 0.83 1.71 -0.09 0.00 0.02 0.00 0.00 61.00 63.48 1id2 s PRO 53 Cb -0.52 -3.00 0.00 0.00 0.02 0.00 0.00 34.50 31.01 1id2 s PRO 53 CO 0.39 0.11 0.17 -1.01 -0.33 0.00 0.00 177.00 176.34 1id2 s HIS 54 N -1.31 0.07 0.05 6.54 3.76 -0.80 -4.96 115.29 118.63 1id2 s HIS 54 Ca 0.48 -0.27 0.01 0.00 -0.15 0.00 0.00 55.06 55.14 1id2 s HIS 54 Cb -0.29 -0.05 -0.00 0.00 1.11 0.00 0.00 32.58 33.35 1id2 s HIS 54 CO 0.37 -0.39 0.03 0.27 -0.85 0.00 0.00 174.74 174.17 1id2 n ASN 55 N 0.85 0.08 -3.95 1.40 6.94 -1.26 -0.88 115.26 118.44 1id2 n ASN 55 Ca -0.20 -1.29 -0.26 0.00 -0.02 0.00 0.00 54.58 52.82 1id2 n ASN 55 Cb 0.58 0.21 -0.17 0.00 -2.36 0.00 0.00 39.78 38.04 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 -2.11 1.04 0.04 3.53 1.01 -1.26 -4.53 120.40 118.12 1id2 s VAL 56 Ca 0.05 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.70 1id2 s VAL 56 Cb 0.00 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 1id2 s VAL 56 CO 0.03 0.36 -0.08 0.00 0.00 0.00 0.00 175.10 175.41 1id2 s ALA 57 N 1.27 0.61 0.07 5.51 0.00 -0.29 0.64 121.76 129.56 1id2 s ALA 57 Ca -0.03 -0.69 0.07 0.00 0.00 0.00 0.00 51.96 51.30 1id2 s ALA 57 Cb -0.14 0.00 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 1id2 s ALA 57 CO -0.03 0.02 -0.18 -0.06 0.00 0.00 0.00 175.76 175.51 1id2 s PHE 58 N -1.15 1.53 0.71 0.00 0.08 0.14 -1.93 117.98 117.35 1id2 s PHE 58 Ca -0.07 -0.41 -0.11 0.00 0.12 0.00 0.00 56.93 56.46 1id2 s PHE 58 Cb -0.09 -0.87 0.02 0.00 -0.57 0.00 0.00 43.02 41.52 1id2 s PHE 58 CO 0.00 0.11 1.09 0.15 -0.10 0.00 0.00 175.22 176.48 1id2 s LYS 59 N -1.60 2.76 0.19 0.44 1.02 -1.26 -1.17 119.74 120.13 1id2 s LYS 59 Ca 0.03 0.38 -0.30 0.00 0.02 0.00 0.00 55.97 56.10 1id2 s LYS 59 Cb -0.09 -2.03 -0.17 0.00 -0.52 0.00 0.00 37.83 35.02 1id2 s LYS 59 CO 0.03 -1.07 0.77 1.63 -0.92 0.00 0.00 175.35 175.78 1id2 n LYS 60 N -3.01 0.43 -0.98 1.68 5.02 -1.26 -2.62 118.16 117.41 1id2 n LYS 60 Ca 0.07 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1id2 n LYS 60 Cb 0.58 -1.35 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1id2 n LYS 60 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1id2 n GLY 61 N 1.78 0.45 0.13 0.72 0.00 0.75 -4.91 105.19 104.11 1id2 n GLY 61 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.67 1.53 0.26 -0.61 -0.00 -1.08 -4.59 119.36 112.21 1id2 n ILE 62 Ca 0.00 -0.34 0.06 0.00 -0.00 0.00 0.00 62.75 62.47 1id2 n ILE 62 Cb 0.09 -1.90 0.09 0.00 -0.00 0.00 0.00 39.64 37.92 1id2 n ILE 62 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.55 177.88 1id2 n VAL 63 N -4.27 0.36 -1.37 1.39 0.24 -1.26 -4.94 118.33 108.48 1id2 n VAL 63 Ca -0.52 -0.68 0.00 0.00 -2.04 0.00 0.00 64.34 61.10 1id2 n VAL 63 Cb 0.86 0.98 0.00 0.00 -1.47 0.00 0.00 33.84 34.21 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 0.67 -1.72 0.09 7.63 0.00 -1.26 -1.86 105.19 108.74 1id2 n GLY 64 Ca 0.09 -1.10 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 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 0.03 -6.74 1.61 4.81 -1.91 0.21 114.58 112.59 1id2 h GLU 65 Ca 0.00 -0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.77 1id2 h GLU 65 Cb 0.00 -0.01 0.03 0.00 0.63 0.00 0.00 28.75 29.41 1id2 h GLU 65 CO 0.00 0.02 -0.07 -0.51 -0.73 0.00 0.00 179.01 177.71 1id2 s ASP 66 N -5.22 5.71 0.65 1.04 -0.00 -1.26 -1.94 116.67 115.65 1id2 s ASP 66 Ca -0.13 0.24 -0.15 0.00 -0.00 0.00 0.00 52.55 52.51 1id2 s ASP 66 Cb 0.09 -1.40 -0.01 0.00 -0.00 0.00 0.00 42.92 41.60 1id2 s ASP 66 CO 0.68 -0.81 1.09 0.00 -0.00 0.00 0.00 175.17 176.13 1id2 s ALA 67 N -2.61 2.56 -0.08 5.23 0.00 -1.26 -4.09 121.76 121.50 1id2 s ALA 67 Ca 0.50 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.92 1id2 s ALA 67 Cb -0.10 -3.27 0.01 0.00 0.00 0.00 0.00 23.12 19.76 1id2 s ALA 67 CO 0.38 -1.16 -0.14 0.12 0.00 0.00 0.00 175.76 174.97 1id2 s PHE 68 N -2.48 1.69 -0.32 0.00 2.19 -0.31 -4.81 117.98 113.94 1id2 s PHE 68 Ca 0.65 -0.69 -0.01 0.00 0.33 0.00 0.00 56.93 57.20 1id2 s PHE 68 Cb -0.18 -1.23 0.06 0.00 -1.31 0.00 0.00 43.02 40.36 1id2 s PHE 68 CO 0.42 -0.35 0.03 0.50 1.83 0.00 0.00 175.22 177.64 1id2 s ARG 69 N 0.78 2.29 0.70 10.12 6.06 -1.26 0.25 118.95 137.89 1id2 s ARG 69 Ca -0.12 -1.40 -0.13 0.00 -2.50 0.00 0.00 55.73 51.59 1id2 s ARG 69 Cb -0.16 -3.22 0.02 0.00 0.06 0.00 0.00 34.95 31.65 1id2 s ARG 69 CO 0.02 -0.70 1.10 0.20 -2.50 0.00 0.00 175.30 173.41 1id2 s GLY 70 N 1.31 1.93 0.48 8.12 0.00 0.21 -4.99 107.32 114.38 1id2 s GLY 70 Ca -0.02 0.39 -0.20 0.00 0.00 0.00 0.00 44.72 44.89 1id2 s GLY 70 CO -0.02 0.74 1.03 -0.54 0.00 0.00 0.00 173.10 174.31 1id2 s GLU 71 N -4.47 3.82 0.01 2.90 2.02 -1.26 -4.59 118.70 117.12 1id2 s GLU 71 Ca 0.64 1.35 -0.30 0.00 0.02 0.00 0.00 54.97 56.68 1id2 s GLU 71 Cb -0.18 -2.10 -0.06 0.00 0.10 0.00 0.00 34.13 31.89 1id2 s GLU 71 CO 0.48 -0.41 1.40 -1.64 0.02 0.00 0.00 175.26 175.10 1id2 s MET 72 N -3.23 4.29 0.17 1.61 -1.94 -1.26 -4.69 119.30 114.25 1id2 s MET 72 Ca 0.67 1.98 -0.20 0.00 -1.71 0.00 0.00 55.69 56.43 1id2 s MET 72 Cb -0.16 -3.55 -0.08 0.00 2.01 0.00 0.00 34.83 33.06 1id2 s MET 72 CO 0.20 -0.56 0.69 -1.64 -0.01 0.00 0.00 175.02 173.69 1id2 s MET 73 N 2.29 4.28 0.00 2.03 1.00 -0.06 -4.79 119.30 124.05 1id2 s MET 73 Ca 0.64 0.87 0.00 0.00 0.00 0.00 0.00 55.69 57.20 1id2 s MET 73 Cb -0.32 -3.04 0.00 0.00 0.00 0.00 0.00 34.83 31.47 1id2 s MET 73 CO 0.27 0.49 0.00 0.25 0.00 0.00 0.00 175.02 176.03 1id2 n THR 74 N 1.12 0.00 -2.16 2.05 -2.24 -1.26 -1.91 114.28 109.88 1id2 n THR 74 Ca -0.05 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.31 1id2 n THR 74 Cb 0.51 -0.72 -0.03 0.00 -2.10 0.00 0.00 70.33 67.99 1id2 n THR 74 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1id2 s LYS 75 N 2.62 4.33 -1.39 -0.78 2.20 -1.10 -2.29 119.74 123.34 1id2 s LYS 75 Ca 0.00 2.10 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 1id2 s LYS 75 Cb 0.00 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.11 1id2 s LYS 75 CO 0.00 -0.38 0.00 -0.25 -0.36 0.00 0.00 175.35 174.36 1id2 n ASP 76 N 3.30 -4.63 -4.88 1.43 10.43 0.21 -4.99 116.55 117.40 1id2 n ASP 76 Ca 0.09 0.12 -0.22 0.00 2.57 0.00 0.00 54.79 57.35 1id2 n ASP 76 Cb 0.42 -3.66 -0.03 0.00 1.84 0.00 0.00 41.12 39.68 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 -4.25 3.14 0.15 -1.24 -0.21 -0.97 -2.29 119.66 113.99 1id2 s GLN 77 Ca 0.00 -0.92 0.05 0.00 0.02 0.00 0.00 55.36 54.51 1id2 s GLN 77 Cb 0.00 -2.70 -0.04 0.00 1.00 0.00 0.00 33.01 31.26 1id2 s GLN 77 CO 0.00 0.42 -0.11 0.00 -2.12 0.00 0.00 175.29 173.48 1id2 s ALA 78 N -2.05 1.50 -0.08 6.09 0.00 0.22 -1.77 121.76 125.67 1id2 s ALA 78 Ca 0.33 -1.50 -0.04 0.00 0.00 0.00 0.00 51.96 50.75 1id2 s ALA 78 Cb -0.08 0.03 0.04 0.00 0.00 0.00 0.00 23.12 23.11 1id2 s ALA 78 CO 0.27 -0.08 0.19 -0.47 0.00 0.00 0.00 175.76 175.67 1id2 s TYR 79 N -3.26 -0.24 -0.07 0.00 6.14 -0.03 -0.98 117.35 118.92 1id2 s TYR 79 Ca 0.17 0.60 0.04 0.00 0.64 0.00 0.00 57.07 58.52 1id2 s TYR 79 Cb 0.02 -0.00 0.00 0.00 0.42 0.00 0.00 41.96 42.40 1id2 s TYR 79 CO 0.01 -0.18 -0.19 0.00 0.64 0.00 0.00 175.55 175.84 1id2 s ALA 80 N 0.98 1.70 -0.07 3.97 0.00 -1.26 -0.18 121.76 126.89 1id2 s ALA 80 Ca -0.07 -0.73 0.02 0.00 0.00 0.00 0.00 51.96 51.18 1id2 s ALA 80 Cb -0.09 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.42 1id2 s ALA 80 CO -0.06 0.25 -0.11 0.42 0.00 0.00 0.00 175.76 176.26 1id2 s ILE 81 N 0.28 1.08 -0.17 0.00 1.01 -1.00 -4.14 121.20 118.25 1id2 s ILE 81 Ca -0.11 -0.44 -0.20 0.00 0.00 0.00 0.00 60.65 59.91 1id2 s ILE 81 Cb -0.15 -1.00 -0.03 0.00 0.01 0.00 0.00 42.46 41.29 1id2 s ILE 81 CO 0.05 0.35 0.56 -0.89 0.00 0.00 0.00 174.94 175.00 1id2 s THR 82 N 0.77 5.09 -0.39 2.92 2.01 -0.59 -1.95 115.64 123.51 1id2 s THR 82 Ca -0.13 1.07 -0.17 0.00 0.31 0.00 0.00 61.69 62.77 1id2 s THR 82 Cb -0.15 -3.89 0.01 0.00 0.01 0.00 0.00 72.50 68.48 1id2 s THR 82 CO 0.02 0.19 0.43 -0.36 -0.69 0.00 0.00 174.62 174.21 1id2 s PHE 83 N 1.48 3.18 -0.06 4.92 0.40 -0.28 -1.57 117.98 126.04 1id2 s PHE 83 Ca 0.27 -0.18 0.14 0.00 -0.60 0.00 0.00 56.93 56.56 1id2 s PHE 83 Cb -0.16 -2.83 -0.20 0.00 0.51 0.00 0.00 43.02 40.34 1id2 s PHE 83 CO 0.11 -0.59 0.71 0.09 0.70 0.00 0.00 175.22 176.24 1id2 n ASN 84 N 5.56 0.88 -4.62 1.36 3.02 0.11 0.83 115.26 122.40 1id2 n ASN 84 Ca -0.07 0.41 -0.29 0.00 -0.03 0.00 0.00 54.58 54.60 1id2 n ASN 84 Cb 0.48 -0.01 -0.09 0.00 -0.61 0.00 0.00 39.78 39.55 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 -2.69 2.26 0.83 3.52 2.02 -1.22 -4.09 118.70 119.33 1id2 s GLU 85 Ca -0.04 -1.03 -0.11 0.00 0.02 0.00 0.00 54.97 53.82 1id2 s GLU 85 Cb 0.08 -2.35 0.09 0.00 0.10 0.00 0.00 34.13 32.06 1id2 s GLU 85 CO 0.82 0.50 1.10 0.00 0.02 0.00 0.00 175.26 177.70 1id2 s ALA 86 N -1.39 1.90 0.00 5.21 0.00 -1.26 -4.82 121.76 121.40 1id2 s ALA 86 Ca 0.24 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.50 1id2 s ALA 86 Cb -0.11 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1id2 s ALA 86 CO 0.16 -2.15 0.00 0.41 0.00 0.00 0.00 175.76 174.17 1id2 n GLY 87 N -0.78 1.00 3.55 0.00 0.00 -0.25 -4.93 105.19 103.78 1id2 n GLY 87 Ca 0.09 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.79 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 -0.31 4.68 -0.35 1.61 0.01 -1.26 0.30 113.70 118.38 1id2 s SER 88 Ca 0.00 -0.07 0.01 0.00 1.31 0.00 0.00 55.95 57.21 1id2 s SER 88 Cb 0.00 -1.42 0.11 0.00 0.21 0.00 0.00 66.02 64.92 1id2 s SER 88 CO 0.00 0.29 0.11 -0.31 0.41 0.00 0.00 173.24 173.74 1id2 s TYR 89 N -0.36 2.44 0.21 2.43 2.02 0.12 -4.97 117.35 119.25 1id2 s TYR 89 Ca 0.05 -2.28 -0.30 0.00 -0.37 0.00 0.00 57.07 54.17 1id2 s TYR 89 Cb -0.12 -2.16 -0.09 0.00 -0.40 0.00 0.00 41.96 39.19 1id2 s TYR 89 CO 0.02 -0.88 1.27 -0.51 -1.57 0.00 0.00 175.55 173.88 1id2 s ASP 90 N 1.15 6.95 0.19 2.29 -0.00 -1.26 -1.10 116.67 124.89 1id2 s ASP 90 Ca 0.12 2.38 0.02 0.00 -0.00 0.00 0.00 52.55 55.07 1id2 s ASP 90 Cb -0.19 -2.61 -0.05 0.00 -0.00 0.00 0.00 42.92 40.07 1id2 s ASP 90 CO -0.15 -0.47 0.00 -0.72 -0.00 0.00 0.00 175.17 173.83 1id2 s TYR 91 N -0.13 1.29 0.29 4.23 -0.85 0.11 -4.63 117.35 117.65 1id2 s TYR 91 Ca 0.54 -1.01 -0.01 0.00 -0.52 0.00 0.00 57.07 56.07 1id2 s TYR 91 Cb -0.36 -0.73 -0.02 0.00 0.38 0.00 0.00 41.96 41.23 1id2 s TYR 91 CO 0.39 -0.18 0.34 -0.59 -1.52 0.00 0.00 175.55 173.99 1id2 s PHE 92 N -3.62 1.15 -0.18 -3.49 -0.71 -0.81 -0.45 117.98 109.87 1id2 s PHE 92 Ca 0.25 -1.32 -0.12 0.00 -1.04 0.00 0.00 56.93 54.71 1id2 s PHE 92 Cb 0.06 -0.32 -0.05 0.00 -1.21 0.00 0.00 43.02 41.50 1id2 s PHE 92 CO 0.05 -0.92 0.20 0.00 -1.34 0.00 0.00 175.22 173.22 1id2 h THR 94 N 4.64 0.30 0.00 0.00 2.02 -1.92 -2.39 112.91 115.56 1id2 h THR 94 Ca -0.42 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 66.73 1id2 h THR 94 Cb 1.16 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1id2 h THR 94 CO 0.75 0.00 -0.13 1.55 0.37 0.00 0.00 175.52 178.05 1id2 h PRO 95 N -0.73 0.00 -2.17 6.66 0.13 -1.96 -3.36 132.00 130.58 1id2 h PRO 95 Ca -0.03 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.51 1id2 h PRO 95 Cb 0.65 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.36 1id2 h PRO 95 CO -0.04 0.13 -0.68 0.72 -0.23 0.00 0.00 178.00 177.90 1id2 n HIS 96 N -3.22 3.05 0.28 1.56 8.25 -0.94 -4.93 115.22 119.27 1id2 n HIS 96 Ca 0.01 -4.05 0.12 0.00 -0.26 0.00 0.00 57.72 53.54 1id2 n HIS 96 Cb 0.44 -0.52 0.56 0.00 1.12 0.00 0.00 29.99 31.59 1id2 n HIS 96 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1id2 h PRO 97 N 4.03 0.00 0.00 -0.41 0.11 -1.61 -0.15 132.00 133.97 1id2 h PRO 97 Ca 0.17 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.26 1id2 h PRO 97 Cb 0.68 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.79 1id2 h PRO 97 CO 0.78 0.00 -0.13 0.27 -0.21 0.00 0.00 178.00 178.71 1id2 h PHE 98 N 0.00 0.00 -2.87 0.65 -5.15 -1.92 -3.42 116.94 104.23 1id2 h PHE 98 Ca 0.00 0.00 -0.56 0.00 -0.20 0.00 0.00 57.97 57.21 1id2 h PHE 98 Cb 0.19 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.33 1id2 h PHE 98 CO 0.00 0.13 0.98 -1.64 -2.00 0.00 0.00 178.31 175.78 1id2 s MET 99 N -3.83 4.11 0.04 6.09 -1.94 -0.07 -5.03 119.30 118.68 1id2 s MET 99 Ca -0.01 1.70 0.02 0.00 -1.71 0.00 0.00 55.69 55.69 1id2 s MET 99 Cb 0.11 -3.87 -0.02 0.00 2.01 0.00 0.00 34.83 33.06 1id2 s MET 99 CO 0.58 -0.88 -0.07 1.03 -0.01 0.00 0.00 175.02 175.67 1id2 s ARG 100 N 3.88 0.51 0.34 2.03 0.52 -1.26 -1.99 118.95 122.98 1id2 s ARG 100 Ca 0.61 -0.77 -0.06 0.00 -0.52 0.00 0.00 55.73 54.98 1id2 s ARG 100 Cb -0.24 -0.21 0.03 0.00 0.52 0.00 0.00 34.95 35.05 1id2 s ARG 100 CO 0.21 0.03 0.56 0.41 0.02 0.00 0.00 175.30 176.52 1id2 n GLY 101 N 1.38 1.74 3.28 -3.53 0.00 0.40 -4.75 105.19 103.71 1id2 n GLY 101 Ca -0.22 -1.45 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 1id2 n GLY 101 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1id2 s LYS 102 N -2.47 0.48 -0.18 1.61 2.20 0.18 -0.71 119.74 120.85 1id2 s LYS 102 Ca 0.22 0.48 -0.02 0.00 -0.36 0.00 0.00 55.97 56.29 1id2 s LYS 102 Cb -0.02 0.23 -0.01 0.00 -1.51 0.00 0.00 37.83 36.52 1id2 s LYS 102 CO 0.16 -0.07 -0.09 0.08 -0.36 0.00 0.00 175.35 175.07 1id2 s VAL 103 N 0.07 3.14 -0.23 4.02 1.01 -0.26 -1.85 120.40 126.30 1id2 s VAL 103 Ca -0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 61.98 61.29 1id2 s VAL 103 Cb -0.03 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1id2 s VAL 103 CO 0.01 0.48 0.10 -0.63 0.00 0.00 0.00 175.10 175.05 1id2 s ILE 104 N 0.99 4.75 -0.15 2.22 1.01 0.05 0.15 121.20 130.23 1id2 s ILE 104 Ca -0.01 -0.03 -0.00 0.00 0.00 0.00 0.00 60.65 60.61 1id2 s ILE 104 Cb -0.15 -3.20 -0.01 0.00 0.01 0.00 0.00 42.46 39.11 1id2 s ILE 104 CO -0.01 0.36 -0.13 -0.69 0.00 0.00 0.00 174.94 174.47 1id2 s VAL 105 N 1.16 2.91 -2.95 2.92 1.01 0.15 -0.58 120.40 125.02 1id2 s VAL 105 Ca 0.05 -0.70 0.24 0.00 0.00 0.00 0.00 61.98 61.58 1id2 s VAL 105 Cb -0.14 -2.23 0.23 0.00 0.00 0.00 0.00 36.38 34.24 1id2 s VAL 105 CO 0.04 0.51 1.31 -0.62 0.00 0.00 0.00 175.10 176.35