#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k25 s SER 2 N 0.00 -0.25 0.12 1.61 0.15 -1.26 -5.10 113.70 108.98 2k25 s SER 2 Ca 0.00 -0.17 0.03 0.00 0.70 0.00 0.00 55.95 56.52 2k25 s SER 2 Cb 0.00 0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 64.71 2k25 s SER 2 CO 0.00 -0.76 -0.09 -1.48 1.20 0.00 0.00 173.24 172.11 2k25 s LEU 3 N -2.41 2.50 0.21 3.45 -0.00 -1.26 -3.90 118.68 117.27 2k25 s LEU 3 Ca -0.01 -0.96 0.11 0.00 -0.00 0.00 0.00 54.13 53.26 2k25 s LEU 3 Cb 0.01 -0.26 -0.05 0.00 -0.00 0.00 0.00 46.19 45.89 2k25 s LEU 3 CO -0.07 -0.35 -0.21 0.68 -0.00 0.00 0.00 176.35 176.39 2k25 s VAL 4 N -3.21 2.22 -0.49 1.48 -7.23 -1.26 -5.03 120.40 106.88 2k25 s VAL 4 Ca 0.13 -2.11 -0.27 0.00 -1.81 0.00 0.00 61.98 57.92 2k25 s VAL 4 Cb 0.02 -2.10 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 2k25 s VAL 4 CO -0.01 -0.26 1.79 -2.16 -0.31 0.00 0.00 175.10 174.15 2k25 s PRO 5 N -2.96 2.97 -0.23 4.82 0.04 -1.26 -4.94 135.00 133.44 2k25 s PRO 5 Ca 0.22 0.92 -0.17 0.00 0.04 0.00 0.00 61.00 62.01 2k25 s PRO 5 Cb -0.06 -4.28 0.07 0.00 0.04 0.00 0.00 34.50 30.26 2k25 s PRO 5 CO 0.10 -2.31 0.60 -0.98 0.04 0.00 0.00 177.00 174.45 2k25 s ARG 6 N 6.34 0.65 0.00 4.56 1.70 -1.26 -5.15 118.95 125.79 2k25 s ARG 6 Ca 0.71 0.96 0.00 0.00 -0.47 0.00 0.00 55.73 56.93 2k25 s ARG 6 Cb -0.16 0.21 0.00 0.00 -0.57 0.00 0.00 34.95 34.43 2k25 s ARG 6 CO 0.26 -0.12 0.00 0.41 -1.08 0.00 0.00 175.30 174.77 2k25 n GLY 7 N 3.54 2.79 0.11 3.88 0.00 -1.26 -5.06 105.19 109.19 2k25 n GLY 7 Ca -0.18 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 2k25 n GLY 7 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2k25 h SER 8 N 0.00 -0.14 -3.15 1.61 0.02 -2.00 -3.44 113.55 106.44 2k25 h SER 8 Ca 0.00 -0.38 -0.64 0.00 -0.84 0.00 0.00 61.79 59.93 2k25 h SER 8 Cb 0.00 0.04 -0.14 0.00 0.14 0.00 0.00 62.40 62.44 2k25 h SER 8 CO 0.00 0.47 -0.55 -0.04 -1.14 0.00 0.00 176.83 175.57 2k25 s MET 9 N -2.89 3.66 0.02 3.45 -1.94 -1.26 -5.10 119.30 115.24 2k25 s MET 9 Ca -0.11 -0.30 0.05 0.00 -1.71 0.00 0.00 55.69 53.61 2k25 s MET 9 Cb -0.00 -3.13 -0.02 0.00 2.01 0.00 0.00 34.83 33.69 2k25 s MET 9 CO 0.41 0.48 -0.15 -0.65 -0.01 0.00 0.00 175.02 175.11 2k25 s GLN 10 N -0.21 1.05 0.25 2.03 -0.21 -1.26 -4.26 119.66 117.05 2k25 s GLN 10 Ca 0.08 -0.67 -0.07 0.00 0.02 0.00 0.00 55.36 54.72 2k25 s GLN 10 Cb -0.12 -1.05 -0.02 0.00 1.00 0.00 0.00 33.01 32.82 2k25 s GLN 10 CO 0.01 0.27 0.36 -1.50 -2.12 0.00 0.00 175.29 172.32 2k25 s ILE 11 N -0.63 0.00 -0.23 1.08 2.07 -0.84 -4.85 121.20 117.79 2k25 s ILE 11 Ca 0.04 -1.65 -0.07 0.00 -1.41 0.00 0.00 60.65 57.56 2k25 s ILE 11 Cb -0.07 -2.38 -0.03 0.00 0.13 0.00 0.00 42.46 40.11 2k25 s ILE 11 CO 0.01 0.00 0.06 0.12 -1.91 0.00 0.00 174.94 173.22 2k25 s PHE 12 N -3.89 3.11 -0.03 3.50 2.19 -1.26 -4.17 117.98 117.42 2k25 s PHE 12 Ca 0.30 -0.33 0.02 0.00 0.33 0.00 0.00 56.93 57.25 2k25 s PHE 12 Cb 0.02 -2.19 0.01 0.00 -1.31 0.00 0.00 43.02 39.55 2k25 s PHE 12 CO 0.12 -0.25 -0.06 0.08 1.83 0.00 0.00 175.22 176.94 2k25 s VAL 13 N 1.31 0.62 -0.20 3.12 1.01 -1.25 -3.36 120.40 121.65 2k25 s VAL 13 Ca 0.05 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2k25 s VAL 13 Cb -0.15 -0.59 0.02 0.00 0.00 0.00 0.00 36.38 35.67 2k25 s VAL 13 CO 0.03 0.22 -0.17 -0.54 0.00 0.00 0.00 175.10 174.64 2k25 s LYS 14 N 0.51 2.89 0.83 2.72 -0.14 -1.26 -3.38 119.74 121.90 2k25 s LYS 14 Ca -0.07 -0.91 -0.14 0.00 -1.36 0.00 0.00 55.97 53.49 2k25 s LYS 14 Cb -0.11 -2.67 0.20 0.00 -1.68 0.00 0.00 37.83 33.58 2k25 s LYS 14 CO 0.00 -0.27 0.86 0.25 -0.76 0.00 0.00 175.35 175.43 2k25 n THR 15 N 4.60 0.00 0.09 2.17 -2.24 -0.05 -4.82 114.28 114.03 2k25 n THR 15 Ca -0.20 -0.49 -0.07 0.00 -2.27 0.00 0.00 64.05 61.02 2k25 n THR 15 Cb 0.49 -1.35 0.01 0.00 -2.10 0.00 0.00 70.33 67.37 2k25 n THR 15 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2k25 h LEU 16 N 0.00 0.20 0.00 3.22 4.07 -1.88 -3.24 115.31 117.69 2k25 h LEU 16 Ca -0.31 -0.16 -0.24 0.00 0.08 0.00 0.00 57.88 57.26 2k25 h LEU 16 Cb 0.90 -0.06 -0.03 0.00 1.08 0.00 0.00 40.66 42.54 2k25 h LEU 16 CO 0.21 0.95 -1.22 0.00 -1.08 0.00 0.00 178.44 177.30 2k25 h THR 17 N 0.09 1.45 0.00 0.22 1.03 -1.99 -3.48 112.91 110.23 2k25 h THR 17 Ca -0.03 -3.20 0.00 0.00 -0.01 0.00 0.00 66.41 63.17 2k25 h THR 17 Cb 1.46 2.72 0.00 0.00 -1.07 0.00 0.00 68.15 71.26 2k25 h THR 17 CO 0.13 0.83 0.00 0.61 -0.01 0.00 0.00 175.52 177.08 2k25 n GLY 18 N 1.42 0.94 3.75 2.99 0.00 -1.22 -5.13 105.19 107.94 2k25 n GLY 18 Ca -0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.60 2k25 n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k25 s LYS 19 N 0.00 2.86 -0.07 1.61 -0.14 -1.26 -4.62 119.74 118.13 2k25 s LYS 19 Ca 0.00 1.93 0.05 0.00 -1.36 0.00 0.00 55.97 56.59 2k25 s LYS 19 Cb 0.00 -1.93 -0.01 0.00 -1.68 0.00 0.00 37.83 34.21 2k25 s LYS 19 CO 0.00 -1.32 -0.24 0.99 -0.76 0.00 0.00 175.35 174.02 2k25 s THR 20 N -1.51 1.97 -0.03 2.17 2.01 -1.26 -0.87 115.64 118.12 2k25 s THR 20 Ca 0.79 -1.01 0.03 0.00 0.31 0.00 0.00 61.69 61.81 2k25 s THR 20 Cb -0.33 -1.68 0.00 0.00 0.01 0.00 0.00 72.50 70.50 2k25 s THR 20 CO 0.36 0.55 -0.11 0.27 -0.69 0.00 0.00 174.62 175.00 2k25 s ILE 21 N -0.02 0.97 -0.21 1.82 -0.00 -1.22 -5.03 121.20 117.51 2k25 s ILE 21 Ca -0.07 -0.45 -0.29 0.00 -0.00 0.00 0.00 60.65 59.83 2k25 s ILE 21 Cb -0.14 -0.85 0.01 0.00 -0.00 0.00 0.00 42.46 41.47 2k25 s ILE 21 CO 0.05 0.30 1.05 -0.89 -0.00 0.00 0.00 174.94 175.44 2k25 s THR 22 N 0.20 4.67 0.26 8.37 2.01 -1.26 -3.93 115.64 125.96 2k25 s THR 22 Ca -0.04 2.01 0.11 0.00 0.31 0.00 0.00 61.69 64.08 2k25 s THR 22 Cb -0.10 -4.30 -0.05 0.00 0.01 0.00 0.00 72.50 68.07 2k25 s THR 22 CO 0.01 -0.16 -0.18 -0.76 -0.69 0.00 0.00 174.62 172.84 2k25 s LEU 23 N 3.09 2.66 0.12 4.42 1.43 -1.26 -4.50 118.68 124.64 2k25 s LEU 23 Ca 0.45 -0.94 -0.05 0.00 -1.03 0.00 0.00 54.13 52.56 2k25 s LEU 23 Cb -0.16 -1.21 -0.05 0.00 0.03 0.00 0.00 46.19 44.80 2k25 s LEU 23 CO 0.08 0.05 0.36 -1.83 0.23 0.00 0.00 176.35 175.23 2k25 s GLU 24 N -3.38 3.61 -0.00 1.70 4.04 -1.26 -2.00 118.70 121.41 2k25 s GLU 24 Ca 0.29 -0.09 -0.10 0.00 0.04 0.00 0.00 54.97 55.10 2k25 s GLU 24 Cb -0.06 -2.89 0.01 0.00 0.02 0.00 0.00 34.13 31.21 2k25 s GLU 24 CO 0.15 0.50 0.21 0.14 -1.84 0.00 0.00 175.26 174.42 2k25 s VAL 25 N -1.60 0.07 -0.11 1.83 -7.23 -1.26 -4.82 120.40 107.28 2k25 s VAL 25 Ca 0.39 -0.60 -0.32 0.00 -1.81 0.00 0.00 61.98 59.63 2k25 s VAL 25 Cb -0.12 -0.51 0.12 0.00 0.56 0.00 0.00 36.38 36.43 2k25 s VAL 25 CO 0.24 -0.33 1.06 -1.61 -0.31 0.00 0.00 175.10 174.15 2k25 s GLU 26 N -1.37 0.54 0.37 4.82 2.02 -1.25 -4.94 118.70 118.89 2k25 s GLU 26 Ca -0.14 -0.18 0.16 0.00 0.02 0.00 0.00 54.97 54.83 2k25 s GLU 26 Cb -0.07 0.25 0.73 0.00 0.10 0.00 0.00 34.13 35.14 2k25 s GLU 26 CO 0.03 -0.23 1.78 -1.00 0.02 0.00 0.00 175.26 175.86 2k25 h PRO 27 N 2.03 0.00 0.00 0.39 0.13 -1.98 -3.15 132.00 129.42 2k25 h PRO 27 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2k25 h PRO 27 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k25 h PRO 27 CO 0.27 0.39 -1.13 0.45 -0.23 0.00 0.00 178.00 177.75 2k25 n SER 28 N -3.78 1.20 -4.44 1.44 2.88 -1.26 -1.30 113.62 108.36 2k25 n SER 28 Ca -0.01 -0.42 -0.44 0.00 -1.33 0.00 0.00 58.87 56.67 2k25 n SER 28 Cb 0.46 1.31 -0.07 0.00 -0.75 0.00 0.00 64.21 65.17 2k25 n SER 28 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2k25 s ASP 29 N -2.93 6.20 0.80 -3.46 -1.08 -1.19 -4.92 116.67 110.09 2k25 s ASP 29 Ca 0.00 -0.98 -0.10 0.00 -0.52 0.00 0.00 52.55 50.95 2k25 s ASP 29 Cb 0.10 -2.26 0.10 0.00 -1.46 0.00 0.00 42.92 39.40 2k25 s ASP 29 CO 0.57 -0.80 1.14 -0.89 0.52 0.00 0.00 175.17 175.71 2k25 s THR 30 N 2.34 2.11 0.61 1.71 2.01 -1.26 -3.79 115.64 119.36 2k25 s THR 30 Ca 0.12 -0.13 0.30 0.00 0.31 0.00 0.00 61.69 62.29 2k25 s THR 30 Cb -0.20 -2.97 0.36 0.00 0.01 0.00 0.00 72.50 69.70 2k25 s THR 30 CO 0.11 0.00 2.04 0.40 -0.69 0.00 0.00 174.62 176.48 2k25 h ILE 31 N -0.98 0.35 -0.26 1.82 5.03 -1.95 -2.29 117.51 119.23 2k25 h ILE 31 Ca -0.45 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.36 2k25 h ILE 31 Cb 1.30 0.77 -0.08 0.00 -3.03 0.00 0.00 36.82 35.79 2k25 h ILE 31 CO 0.57 0.00 -0.30 -0.08 -0.68 0.00 0.00 178.15 177.66 2k25 h GLU 32 N 0.00 -0.30 0.02 2.37 4.81 -1.98 0.11 114.58 119.62 2k25 h GLU 32 Ca 0.10 0.02 -0.20 0.00 -0.13 0.00 0.00 59.36 59.14 2k25 h GLU 32 Cb 0.64 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 2k25 h GLU 32 CO -0.00 -0.20 -0.95 -0.97 -0.73 0.00 0.00 179.01 176.17 2k25 h ASN 33 N -0.31 0.10 -0.27 1.04 -0.73 -1.79 -3.23 115.58 110.40 2k25 h ASN 33 Ca 0.13 -0.10 0.00 0.00 1.87 0.00 0.00 56.30 58.21 2k25 h ASN 33 Cb 0.52 -0.03 -0.01 0.00 0.27 0.00 0.00 38.32 39.07 2k25 h ASN 33 CO -0.43 0.99 0.17 0.58 -0.37 0.00 0.00 177.43 178.37 2k25 h VAL 34 N 0.03 1.08 -0.60 2.57 2.07 -1.02 -1.62 116.25 118.76 2k25 h VAL 34 Ca -0.03 -0.16 0.17 0.00 0.82 0.00 0.00 66.70 67.51 2k25 h VAL 34 Cb 1.64 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 2k25 h VAL 34 CO 0.13 0.08 0.52 0.07 0.02 0.00 0.00 177.57 178.39 2k25 h LYS 35 N 0.37 0.00 -0.03 1.57 2.10 -0.82 0.40 116.57 120.16 2k25 h LYS 35 Ca 0.10 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.58 2k25 h LYS 35 Cb -0.03 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.29 2k25 h LYS 35 CO -0.02 0.00 -0.74 0.00 -2.00 0.00 0.00 179.45 176.69 2k25 h ALA 36 N 1.52 0.70 0.02 0.07 0.00 -1.49 -1.85 119.26 118.22 2k25 h ALA 36 Ca 0.29 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.56 2k25 h ALA 36 Cb 1.33 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2k25 h ALA 36 CO -0.00 0.83 -0.01 0.87 0.00 0.00 0.00 179.25 180.93 2k25 h LYS 37 N 0.13 -0.03 -0.40 0.00 6.56 -0.36 -3.10 116.57 119.37 2k25 h LYS 37 Ca -0.02 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.54 2k25 h LYS 37 Cb 1.30 0.01 -0.02 0.00 -0.57 0.00 0.00 32.23 32.95 2k25 h LYS 37 CO 0.11 0.69 0.14 0.97 -2.06 0.00 0.00 179.45 179.30 2k25 h ILE 38 N -0.84 1.16 0.00 1.86 -0.00 -1.37 -1.72 117.51 116.61 2k25 h ILE 38 Ca -0.00 -0.54 -0.04 0.00 -0.00 0.00 0.00 64.86 64.28 2k25 h ILE 38 Cb 0.73 0.71 -0.01 0.00 -0.00 0.00 0.00 36.82 38.26 2k25 h ILE 38 CO 0.01 0.20 -0.21 -0.61 -0.00 0.00 0.00 178.15 177.54 2k25 h GLN 39 N 0.57 0.00 0.00 2.19 4.15 -1.41 -1.94 115.11 118.67 2k25 h GLN 39 Ca 0.14 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 59.46 2k25 h GLN 39 Cb 0.15 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 2k25 h GLN 39 CO -0.01 0.21 -0.47 0.22 -1.93 0.00 0.00 178.83 176.85 2k25 h ASP 40 N 0.00 0.00 0.27 -0.69 3.58 -1.23 0.71 116.42 119.07 2k25 h ASP 40 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.43 2k25 h ASP 40 Cb 0.41 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.46 2k25 h ASP 40 CO 0.03 0.47 -0.13 0.11 -2.88 0.00 0.00 179.24 176.84 2k25 h LYS 41 N 0.00 -0.35 0.00 0.28 1.79 -1.21 -3.44 116.57 113.64 2k25 h LYS 41 Ca -0.00 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2k25 h LYS 41 Cb 1.11 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2k25 h LYS 41 CO 0.06 -0.06 -0.62 -0.85 -1.08 0.00 0.00 179.45 176.90 2k25 n GLU 42 N -5.02 2.09 -0.98 3.15 -0.00 -1.08 -4.44 120.64 114.36 2k25 n GLU 42 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.09 2k25 n GLU 42 Cb 0.23 -0.81 0.00 0.00 -0.00 0.00 0.00 31.44 30.86 2k25 n GLU 42 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k25 n GLY 43 N 2.18 0.68 3.85 -1.84 0.00 0.24 -4.96 105.19 105.35 2k25 n GLY 43 Ca 0.00 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 2k25 n GLY 43 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k25 s ILE 44 N -2.11 4.76 -0.26 -0.61 1.01 -1.26 -4.97 121.20 117.76 2k25 s ILE 44 Ca 0.00 0.82 -0.29 0.00 0.00 0.00 0.00 60.65 61.18 2k25 s ILE 44 Cb 0.00 -3.65 -0.02 0.00 0.01 0.00 0.00 42.46 38.80 2k25 s ILE 44 CO 0.00 -0.07 1.64 -2.16 0.00 0.00 0.00 174.94 174.34 2k25 s PRO 45 N -2.74 3.68 0.49 2.79 0.04 -1.26 -4.69 135.00 133.31 2k25 s PRO 45 Ca 0.50 1.55 0.28 0.00 0.04 0.00 0.00 61.00 63.37 2k25 s PRO 45 Cb -0.12 -4.07 1.18 0.00 0.04 0.00 0.00 34.50 31.54 2k25 s PRO 45 CO 0.19 -1.43 1.93 -1.00 0.04 0.00 0.00 177.00 176.73 2k25 h PRO 46 N 11.16 0.00 0.00 0.56 0.13 -1.92 0.27 132.00 142.21 2k25 h PRO 46 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2k25 h PRO 46 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2k25 h PRO 46 CO 1.01 0.13 -0.03 -0.44 -0.23 0.00 0.00 178.00 178.45 2k25 h ASP 47 N 0.00 0.00 0.00 1.44 3.32 -2.02 -3.30 116.42 115.86 2k25 h ASP 47 Ca -0.00 -0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 2k25 h ASP 47 Cb 0.59 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2k25 h ASP 47 CO 0.02 0.00 -1.71 0.00 -1.72 0.00 0.00 179.24 175.83 2k25 n GLN 48 N -2.89 1.23 -1.63 3.56 1.13 -0.98 -5.01 117.38 112.80 2k25 n GLN 48 Ca 0.04 -0.06 -0.34 0.00 -1.94 0.00 0.00 57.00 54.70 2k25 n GLN 48 Cb 0.51 -1.31 0.07 0.00 0.11 0.00 0.00 30.24 29.62 2k25 n GLN 48 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 2k25 s GLN 49 N -2.59 2.50 0.07 -1.09 -2.07 0.92 -4.95 119.66 112.45 2k25 s GLN 49 Ca -0.05 1.59 0.07 0.00 -1.82 0.00 0.00 55.36 55.15 2k25 s GLN 49 Cb 0.06 -1.90 -0.04 0.00 -1.09 0.00 0.00 33.01 30.05 2k25 s GLN 49 CO 0.51 -1.52 -0.16 -0.98 -1.32 0.00 0.00 175.29 171.83 2k25 s ARG 50 N -3.95 2.05 -0.21 9.60 1.70 -1.26 -4.94 118.95 121.94 2k25 s ARG 50 Ca 0.71 -1.01 -0.15 0.00 -0.47 0.00 0.00 55.73 54.80 2k25 s ARG 50 Cb -0.25 -2.22 -0.04 0.00 -0.57 0.00 0.00 34.95 31.87 2k25 s ARG 50 CO 0.42 0.53 0.38 -0.51 -1.08 0.00 0.00 175.30 175.04 2k25 s LEU 51 N -1.74 4.15 -0.18 -1.89 1.02 -1.26 -4.13 118.68 114.64 2k25 s LEU 51 Ca 0.17 0.47 0.01 0.00 0.02 0.00 0.00 54.13 54.80 2k25 s LEU 51 Cb -0.11 -2.47 0.03 0.00 0.02 0.00 0.00 46.19 43.66 2k25 s LEU 51 CO 0.08 -0.06 -0.14 -0.63 0.02 0.00 0.00 176.35 175.61 2k25 s ILE 52 N 1.30 1.80 -0.19 -0.59 1.09 -1.00 -1.81 121.20 121.79 2k25 s ILE 52 Ca 0.18 -0.93 -0.01 0.00 -1.10 0.00 0.00 60.65 58.79 2k25 s ILE 52 Cb -0.15 -1.74 0.01 0.00 -1.06 0.00 0.00 42.46 39.52 2k25 s ILE 52 CO 0.08 0.35 -0.14 0.12 -0.10 0.00 0.00 174.94 175.25 2k25 s PHE 53 N 1.36 2.84 -1.34 3.97 5.36 0.89 -2.17 117.98 128.89 2k25 s PHE 53 Ca 0.02 -1.28 -0.01 0.00 -0.96 0.00 0.00 56.93 54.70 2k25 s PHE 53 Cb -0.15 -1.98 0.01 0.00 -0.34 0.00 0.00 43.02 40.56 2k25 s PHE 53 CO -0.10 -0.65 0.09 0.00 -1.46 0.00 0.00 175.22 173.10 2k25 n ALA 54 N 4.56 -0.77 0.00 11.12 0.00 -1.26 -0.08 120.51 134.08 2k25 n ALA 54 Ca -0.20 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2k25 n ALA 54 Cb 0.51 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.94 2k25 n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k25 n GLY 55 N -0.96 3.21 3.66 0.00 0.00 -1.26 -5.01 105.19 104.83 2k25 n GLY 55 Ca -0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.49 2k25 n GLY 55 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k25 s LYS 56 N -0.51 4.09 0.41 1.61 2.47 0.89 -5.04 119.74 123.65 2k25 s LYS 56 Ca 0.00 -0.20 -0.24 0.00 -1.56 0.00 0.00 55.97 53.97 2k25 s LYS 56 Cb 0.00 -3.54 -0.09 0.00 -1.46 0.00 0.00 37.83 32.74 2k25 s LYS 56 CO 0.00 0.05 1.07 -1.14 0.16 0.00 0.00 175.35 175.48 2k25 s GLN 57 N 1.09 4.10 0.04 4.03 0.74 -1.26 -0.08 119.66 128.32 2k25 s GLN 57 Ca 0.09 1.54 0.00 0.00 0.05 0.00 0.00 55.36 57.05 2k25 s GLN 57 Cb -0.14 -2.51 -0.00 0.00 1.10 0.00 0.00 33.01 31.46 2k25 s GLN 57 CO 0.05 -0.21 0.01 1.47 -0.55 0.00 0.00 175.29 176.07 2k25 n LEU 58 N -0.16 0.00 0.00 3.68 -0.00 -0.75 -4.88 117.00 114.89 2k25 n LEU 58 Ca 0.05 -0.29 0.00 0.00 -0.00 0.00 0.00 56.01 55.77 2k25 n LEU 58 Cb 0.49 0.09 0.00 0.00 -0.00 0.00 0.00 43.42 44.01 2k25 n LEU 58 CO 0.45 -0.04 0.00 -0.62 -0.00 0.00 0.00 177.39 177.18 2k25 n GLU 59 N -0.09 1.79 -2.20 1.47 -0.58 -1.26 -4.54 120.64 115.23 2k25 n GLU 59 Ca -0.01 0.00 -0.02 0.00 -0.42 0.00 0.00 57.16 56.71 2k25 n GLU 59 Cb 0.06 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 30.92 2k25 n GLU 59 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 2k25 n ASP 60 N -1.64 0.86 0.00 1.62 -0.08 -1.26 -5.00 116.55 111.04 2k25 n ASP 60 Ca 0.00 -1.18 0.00 0.00 -1.51 0.00 0.00 54.79 52.10 2k25 n ASP 60 Cb 0.00 0.09 0.00 0.00 2.34 0.00 0.00 41.12 43.55 2k25 n ASP 60 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k25 n GLY 61 N 1.86 2.23 3.94 0.27 0.00 -1.26 -5.08 105.19 107.15 2k25 n GLY 61 Ca -0.00 -0.68 -0.25 0.00 0.00 0.00 0.00 46.02 45.09 2k25 n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2k25 s ARG 62 N 0.00 2.46 0.66 1.61 1.81 -1.26 -5.05 118.95 119.18 2k25 s ARG 62 Ca 0.00 -0.34 -0.11 0.00 -1.72 0.00 0.00 55.73 53.56 2k25 s ARG 62 Cb 0.00 -2.28 -0.01 0.00 -0.45 0.00 0.00 34.95 32.20 2k25 s ARG 62 CO 0.00 -0.96 1.05 0.95 -0.68 0.00 0.00 175.30 175.65 2k25 s THR 63 N -3.05 4.30 0.31 0.02 -4.23 -1.26 -4.77 115.64 106.96 2k25 s THR 63 Ca 0.58 0.75 0.06 0.00 -1.18 0.00 0.00 61.69 61.90 2k25 s THR 63 Cb -0.11 -3.60 0.30 0.00 1.34 0.00 0.00 72.50 70.44 2k25 s THR 63 CO 0.43 -0.98 1.79 -0.07 -0.54 0.00 0.00 174.62 175.25 2k25 h LEU 64 N -0.55 0.78 -0.68 4.79 3.38 -1.75 0.33 115.31 121.61 2k25 h LEU 64 Ca -0.44 0.09 -0.14 0.00 0.09 0.00 0.00 57.88 57.48 2k25 h LEU 64 Cb 1.20 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 2k25 h LEU 64 CO 0.59 0.30 -0.58 -1.28 0.09 0.00 0.00 178.44 177.55 2k25 h SER 65 N 0.77 0.27 0.43 -0.43 0.87 -1.45 -1.62 113.55 112.39 2k25 h SER 65 Ca 0.56 -0.15 -0.19 0.00 -1.23 0.00 0.00 61.79 60.78 2k25 h SER 65 Cb 0.87 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.75 2k25 h SER 65 CO -0.35 0.79 -0.83 -0.33 -0.53 0.00 0.00 176.83 175.58 2k25 h GLU 66 N 0.18 0.29 -0.00 2.24 4.39 -0.90 -3.05 114.58 117.73 2k25 h GLU 66 Ca -0.00 -0.28 0.00 0.00 0.34 0.00 0.00 59.36 59.41 2k25 h GLU 66 Cb 1.08 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 2k25 h GLU 66 CO 0.09 0.97 -0.18 0.98 -1.16 0.00 0.00 179.01 179.70 2k25 n TYR 67 N -3.74 0.00 -3.00 4.33 4.19 0.85 -4.92 117.16 114.86 2k25 n TYR 67 Ca -0.04 0.00 -0.22 0.00 3.31 0.00 0.00 57.90 60.95 2k25 n TYR 67 Cb 0.77 -0.28 0.02 0.00 0.49 0.00 0.00 39.34 40.33 2k25 n TYR 67 CO 0.00 0.00 0.00 0.09 0.91 0.00 0.00 176.86 177.86 2k25 n ASN 68 N -1.23 -5.25 -4.93 2.98 5.03 -0.65 -4.97 115.26 106.24 2k25 n ASN 68 Ca 0.10 -0.24 -0.21 0.00 0.87 0.00 0.00 54.58 55.09 2k25 n ASN 68 Cb 0.31 -4.29 -0.03 0.00 -1.02 0.00 0.00 39.78 34.76 2k25 n ASN 68 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 2k25 s ILE 69 N -3.05 4.98 -0.39 2.41 -4.36 -0.97 -5.01 121.20 114.82 2k25 s ILE 69 Ca 0.27 -1.09 0.01 0.00 -0.26 0.00 0.00 60.65 59.58 2k25 s ILE 69 Cb -0.13 -3.72 0.43 0.00 1.25 0.00 0.00 42.46 40.29 2k25 s ILE 69 CO 0.34 -0.32 1.80 0.00 0.24 0.00 0.00 174.94 176.99 2k25 n GLN 70 N -1.37 2.03 0.30 0.37 1.13 -1.26 -4.49 117.38 114.09 2k25 n GLN 70 Ca -0.08 -2.27 0.20 0.00 -1.94 0.00 0.00 57.00 52.91 2k25 n GLN 70 Cb 0.57 -1.89 1.05 0.00 0.11 0.00 0.00 30.24 30.09 2k25 n GLN 70 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 2k25 h LYS 71 N 1.09 0.00 -1.97 -1.09 3.64 -1.91 -2.99 116.57 113.33 2k25 h LYS 71 Ca 0.46 0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.49 2k25 h LYS 71 Cb 1.82 0.00 -0.13 0.00 -0.41 0.00 0.00 32.23 33.52 2k25 h LYS 71 CO 0.94 0.00 0.08 -0.85 -2.27 0.00 0.00 179.45 177.34 2k25 n GLU 72 N -2.92 2.16 0.00 1.90 0.28 -1.26 -4.33 120.64 116.47 2k25 n GLU 72 Ca -0.02 -1.70 0.00 0.00 -0.16 0.00 0.00 57.16 55.28 2k25 n GLU 72 Cb 0.09 -2.02 0.00 0.00 1.43 0.00 0.00 31.44 30.94 2k25 n GLU 72 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2k25 n SER 73 N 1.50 0.00 -3.72 -1.84 2.88 -1.13 -4.99 113.62 106.32 2k25 n SER 73 Ca 0.44 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.70 2k25 n SER 73 Cb 0.69 0.05 -0.16 0.00 -0.75 0.00 0.00 64.21 64.04 2k25 n SER 73 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 2k25 s THR 74 N -0.17 0.47 0.10 2.46 2.01 -1.26 -4.34 115.64 114.91 2k25 s THR 74 Ca 0.00 -0.59 0.04 0.00 0.31 0.00 0.00 61.69 61.44 2k25 s THR 74 Cb 0.00 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.44 2k25 s THR 74 CO 0.00 -0.27 -0.10 -0.76 -0.69 0.00 0.00 174.62 172.80 2k25 s LEU 75 N 1.87 2.40 -0.22 4.42 2.01 -1.21 -4.42 118.68 123.52 2k25 s LEU 75 Ca 0.00 -0.80 -0.03 0.00 0.01 0.00 0.00 54.13 53.31 2k25 s LEU 75 Cb -0.17 -0.32 0.07 0.00 0.01 0.00 0.00 46.19 45.78 2k25 s LEU 75 CO -0.10 -0.25 0.06 -2.28 1.01 0.00 0.00 176.35 174.78 2k25 s HIS 76 N -2.38 1.08 -0.35 0.29 5.65 -0.92 -3.95 115.29 114.70 2k25 s HIS 76 Ca 0.05 -1.02 -0.00 0.00 0.25 0.00 0.00 55.06 54.34 2k25 s HIS 76 Cb -0.03 -1.14 0.12 0.00 -1.18 0.00 0.00 32.58 30.34 2k25 s HIS 76 CO 0.00 -0.68 0.16 -0.48 -0.65 0.00 0.00 174.74 173.09 2k25 s LEU 77 N 1.84 1.97 -0.11 8.88 0.05 -1.26 -2.38 118.68 127.67 2k25 s LEU 77 Ca 0.02 -1.99 -0.07 0.00 0.05 0.00 0.00 54.13 52.14 2k25 s LEU 77 Cb -0.17 -0.78 0.04 0.00 -2.05 0.00 0.00 46.19 43.23 2k25 s LEU 77 CO -0.14 -0.36 0.28 -0.69 -0.55 0.00 0.00 176.35 174.89 2k25 s VAL 78 N 1.20 -0.02 -0.28 1.48 1.01 -1.26 -4.88 120.40 117.65 2k25 s VAL 78 Ca 0.13 0.08 -0.01 0.00 0.00 0.00 0.00 61.98 62.18 2k25 s VAL 78 Cb -0.20 -0.41 0.04 0.00 0.00 0.00 0.00 36.38 35.80 2k25 s VAL 78 CO -0.14 0.03 -0.03 -0.22 0.00 0.00 0.00 175.10 174.74 2k25 s LEU 79 N 0.85 3.61 -0.83 3.92 2.96 -1.26 -4.76 118.68 123.17 2k25 s LEU 79 Ca -0.06 -1.14 -0.02 0.00 -0.22 0.00 0.00 54.13 52.69 2k25 s LEU 79 Cb -0.07 -1.68 0.00 0.00 0.50 0.00 0.00 46.19 44.94 2k25 s LEU 79 CO -0.06 -0.21 0.64 -1.14 -1.32 0.00 0.00 176.35 174.27 2k25 n ARG 80 N 4.62 -1.43 -0.69 1.98 0.63 -1.26 -4.86 116.66 115.65 2k25 n ARG 80 Ca -0.14 0.93 -0.33 0.00 -0.92 0.00 0.00 57.85 57.39 2k25 n ARG 80 Cb 0.44 -3.34 0.17 0.00 0.45 0.00 0.00 32.46 30.18 2k25 n ARG 80 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 2k25 n LEU 81 N -2.53 -2.33 -0.01 6.15 -0.00 -1.26 -5.00 117.00 112.02 2k25 n LEU 81 Ca -0.22 -0.12 -0.04 0.00 -0.00 0.00 0.00 56.01 55.63 2k25 n LEU 81 Cb 0.63 -0.94 -0.01 0.00 -0.00 0.00 0.00 43.42 43.10 2k25 n LEU 81 CO 0.61 -3.06 -0.42 -1.14 -0.00 0.00 0.00 177.39 173.38 2k25 n ARG 82 N -1.87 0.14 0.00 1.47 3.00 -1.26 -5.10 116.66 113.03 2k25 n ARG 82 Ca 0.01 0.06 0.00 0.00 -0.00 0.00 0.00 57.85 57.91 2k25 n ARG 82 Cb 0.63 -0.74 0.00 0.00 0.00 0.00 0.00 32.46 32.35 2k25 n ARG 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k25 n GLY 83 N 2.81 0.36 3.68 5.14 0.00 -1.26 -4.99 105.19 110.93 2k25 n GLY 83 Ca -0.08 -1.79 -0.22 0.00 0.00 0.00 0.00 46.02 43.93 2k25 n GLY 83 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2k25 n TYR 84 N 0.51 -1.93 -2.41 1.61 9.36 -1.26 -4.99 117.16 118.06 2k25 n TYR 84 Ca 0.00 0.79 -0.13 0.00 3.32 0.00 0.00 57.90 61.88 2k25 n TYR 84 Cb 0.00 -4.23 0.07 0.00 -0.63 0.00 0.00 39.34 34.55 2k25 n TYR 84 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2k25 n ALA 85 N -4.20 0.07 -3.86 2.98 0.00 -1.26 -5.14 120.51 109.10 2k25 n ALA 85 Ca -0.26 -1.09 -0.09 0.00 0.00 0.00 0.00 53.44 52.00 2k25 n ALA 85 Cb 0.67 0.17 -0.02 0.00 0.00 0.00 0.00 19.45 20.27 2k25 n ALA 85 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2k25 n ASP 86 N -2.97 -1.39 -3.90 0.00 5.75 -1.26 -4.97 116.55 107.81 2k25 n ASP 86 Ca 0.09 -2.61 -0.30 0.00 -0.01 0.00 0.00 54.79 51.96 2k25 n ASP 86 Cb 0.33 2.50 -0.15 0.00 -1.03 0.00 0.00 41.12 42.77 2k25 n ASP 86 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2k25 s LEU 87 N 0.00 3.73 0.00 -2.12 2.01 -1.25 -4.82 118.68 116.23 2k25 s LEU 87 Ca 0.23 -1.98 0.00 0.00 0.01 0.00 0.00 54.13 52.39 2k25 s LEU 87 Cb -0.02 -1.32 0.00 0.00 0.01 0.00 0.00 46.19 44.86 2k25 s LEU 87 CO 0.17 -0.39 0.00 0.54 1.01 0.00 0.00 176.35 177.68 2k25 n ARG 88 N 4.46 0.00 -4.73 1.70 1.74 -1.26 -4.74 116.66 113.83 2k25 n ARG 88 Ca 0.02 0.00 -0.25 0.00 -0.77 0.00 0.00 57.85 56.85 2k25 n ARG 88 Cb 0.42 0.00 -0.15 0.00 -1.02 0.00 0.00 32.46 31.71 2k25 n ARG 88 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 2k25 s GLU 89 N -0.63 1.38 0.20 5.56 2.56 -1.26 -5.15 118.70 121.36 2k25 s GLU 89 Ca 0.00 -0.77 0.07 0.00 0.00 0.00 0.00 54.97 54.26 2k25 s GLU 89 Cb 0.00 -1.40 -0.04 0.00 2.00 0.00 0.00 34.13 34.69 2k25 s GLU 89 CO 0.00 0.37 0.07 -0.51 -0.56 0.00 0.00 175.26 174.63 2k25 s ASP 90 N -0.79 5.08 0.31 -1.70 1.01 -1.26 -4.90 116.67 114.42 2k25 s ASP 90 Ca 0.07 -0.33 0.26 0.00 0.71 0.00 0.00 52.55 53.25 2k25 s ASP 90 Cb -0.08 -1.18 1.07 0.00 1.01 0.00 0.00 42.92 43.74 2k25 s ASP 90 CO 0.00 0.05 1.76 1.55 0.21 0.00 0.00 175.17 178.75 2k25 h PRO 91 N 2.32 0.00 -1.77 8.23 0.13 -1.94 -3.44 132.00 135.53 2k25 h PRO 91 Ca -0.47 0.00 0.03 0.00 -0.87 0.00 0.00 66.00 64.69 2k25 h PRO 91 Cb 1.21 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 32.10 2k25 h PRO 91 CO 0.60 0.00 0.28 -0.51 -0.23 0.00 0.00 178.00 178.14 2k25 s ASP 92 N -4.51 -0.63 1.10 1.44 1.01 -1.26 -5.06 116.67 108.76 2k25 s ASP 92 Ca 0.03 1.14 -0.17 0.00 0.71 0.00 0.00 52.55 54.26 2k25 s ASP 92 Cb 0.09 1.19 0.12 0.00 1.01 0.00 0.00 42.92 45.33 2k25 s ASP 92 CO 0.42 -0.19 0.17 0.54 0.21 0.00 0.00 175.17 176.32 2k25 n ARG 93 N 2.97 -1.50 -0.89 8.23 5.12 -1.26 -4.93 116.66 124.39 2k25 n ARG 93 Ca -0.15 -0.41 -0.09 0.00 -1.93 0.00 0.00 57.85 55.26 2k25 n ARG 93 Cb 0.56 -1.78 0.06 0.00 -1.16 0.00 0.00 32.46 30.15 2k25 n ARG 93 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2k25 n GLN 94 N -2.33 -0.11 -0.09 5.56 10.64 -1.26 -5.07 117.38 124.71 2k25 n GLN 94 Ca 0.02 -0.77 -0.11 0.00 -1.83 0.00 0.00 57.00 54.31 2k25 n GLN 94 Cb 0.60 -0.36 0.10 0.00 -0.86 0.00 0.00 30.24 29.72 2k25 n GLN 94 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 2k25 n ASP 95 N -3.16 -2.71 -0.01 2.61 9.92 -1.26 -5.01 116.55 116.92 2k25 n ASP 95 Ca 0.06 -0.33 -0.01 0.00 -0.53 0.00 0.00 54.79 53.97 2k25 n ASP 95 Cb 0.19 -0.35 -0.01 0.00 -0.64 0.00 0.00 41.12 40.31 2k25 n ASP 95 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2k25 n HIS 96 N -3.98 0.00 -3.65 1.24 1.44 -1.26 -5.11 115.22 103.90 2k25 n HIS 96 Ca 0.05 0.00 -0.02 0.00 -2.01 0.00 0.00 57.72 55.74 2k25 n HIS 96 Cb 0.21 -0.09 -0.03 0.00 0.12 0.00 0.00 29.99 30.21 2k25 n HIS 96 CO 0.00 0.00 0.00 -3.38 -2.81 0.00 0.00 176.34 170.15 2k25 s HIS 97 N -2.04 -0.00 0.12 -1.40 -3.43 -1.26 -5.18 115.29 102.10 2k25 s HIS 97 Ca -0.02 0.00 -0.02 0.00 -0.80 0.00 0.00 55.06 54.22 2k25 s HIS 97 Cb 0.01 0.50 0.03 0.00 -1.43 0.00 0.00 32.58 31.69 2k25 s HIS 97 CO 0.06 -0.00 0.11 -0.35 -2.00 0.00 0.00 174.74 172.56 2k25 n PRO 98 N 0.14 -1.23 -3.09 -0.38 -0.04 -1.26 -5.08 135.00 124.07 2k25 n PRO 98 Ca 0.05 -0.17 -0.04 0.00 -0.04 0.00 0.00 63.50 63.29 2k25 n PRO 98 Cb 0.57 -0.16 -0.01 0.00 -0.04 0.00 0.00 33.50 33.85 2k25 n PRO 98 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k25 s GLY 99 N -2.69 -1.03 0.22 0.55 0.00 -1.26 -5.15 107.32 97.97 2k25 s GLY 99 Ca 0.07 -0.23 0.05 0.00 0.00 0.00 0.00 44.72 44.61 2k25 s GLY 99 CO 0.05 3.50 0.19 1.44 0.00 0.00 0.00 173.10 178.28 2k25 n SER 100 N 3.85 -0.48 0.00 1.64 7.64 -1.26 -5.18 113.62 119.84 2k25 n SER 100 Ca 0.14 -2.48 0.00 0.00 1.01 0.00 0.00 58.87 57.54 2k25 n SER 100 Cb 0.55 1.13 0.00 0.00 -1.01 0.00 0.00 64.21 64.88 2k25 n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2k25 n GLY 101 N -0.43 1.44 3.46 0.23 0.00 -1.26 -5.18 105.19 103.46 2k25 n GLY 101 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 2k25 n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k25 s ALA 102 N -2.39 -1.70 0.00 4.61 0.00 -1.26 -5.30 121.76 115.73 2k25 s ALA 102 Ca 0.00 0.74 0.00 0.00 0.00 0.00 0.00 51.96 52.70 2k25 s ALA 102 Cb 0.00 0.66 0.00 0.00 0.00 0.00 0.00 23.12 23.78 2k25 s ALA 102 CO 0.00 -0.73 0.00 0.94 0.00 0.00 0.00 175.76 175.97