#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 6.78 0.91 1.61 0.15 -1.26 -4.65 113.70 117.23 2k25 s SER 2 Ca 0.00 0.93 -0.11 0.00 0.70 0.00 0.00 55.95 57.47 2k25 s SER 2 Cb 0.00 -2.28 0.13 0.00 -1.71 0.00 0.00 66.02 62.15 2k25 s SER 2 CO 0.00 0.15 1.06 0.00 1.20 0.00 0.00 173.24 175.65 2k25 n LEU 3 N 2.78 3.01 -4.18 3.45 -0.00 -1.26 -5.00 117.00 115.81 2k25 n LEU 3 Ca -0.10 0.43 -0.29 0.00 -0.00 0.00 0.00 56.01 56.06 2k25 n LEU 3 Cb 0.52 -1.45 -0.16 0.00 -0.00 0.00 0.00 43.42 42.32 2k25 n LEU 3 CO 0.41 -2.29 -0.53 0.54 -0.00 0.00 0.00 177.39 175.52 2k25 s VAL 4 N -2.54 1.71 -0.28 1.47 0.11 -1.26 -5.02 120.40 114.59 2k25 s VAL 4 Ca 0.67 -0.85 -0.29 0.00 -2.93 0.00 0.00 61.98 58.58 2k25 s VAL 4 Cb -0.24 -1.47 -0.02 0.00 -1.53 0.00 0.00 36.38 33.12 2k25 s VAL 4 CO 0.58 0.48 1.65 -2.16 -3.33 0.00 0.00 175.10 172.33 2k25 s PRO 5 N 0.15 3.61 0.08 1.54 0.04 -1.26 -4.99 135.00 134.18 2k25 s PRO 5 Ca -0.09 1.49 0.02 0.00 0.04 0.00 0.00 61.00 62.46 2k25 s PRO 5 Cb -0.14 -4.09 -0.04 0.00 0.04 0.00 0.00 34.50 30.27 2k25 s PRO 5 CO 0.04 -1.51 -0.07 1.03 0.04 0.00 0.00 177.00 176.53 2k25 s ARG 6 N 5.03 0.76 0.00 4.56 0.52 -1.26 -5.15 118.95 123.41 2k25 s ARG 6 Ca 0.73 -1.19 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 2k25 s ARG 6 Cb -0.23 -0.23 0.00 0.00 0.52 0.00 0.00 34.95 35.02 2k25 s ARG 6 CO 0.31 -0.00 0.00 0.41 0.02 0.00 0.00 175.30 176.04 2k25 n GLY 7 N 0.33 -2.08 0.04 -3.53 0.00 -1.26 -5.01 105.19 93.68 2k25 n GLY 7 Ca -0.15 -1.26 -0.03 0.00 0.00 0.00 0.00 46.02 44.59 2k25 n GLY 7 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k25 n SER 8 N 2.83 3.01 -4.47 1.61 7.64 -1.26 -4.99 113.62 117.99 2k25 n SER 8 Ca 0.00 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.55 2k25 n SER 8 Cb 0.00 0.78 -0.13 0.00 -1.01 0.00 0.00 64.21 63.85 2k25 n SER 8 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2k25 s MET 9 N -2.24 3.24 0.05 1.43 -1.94 -1.26 -5.08 119.30 113.49 2k25 s MET 9 Ca -0.04 -0.60 0.05 0.00 -1.71 0.00 0.00 55.69 53.40 2k25 s MET 9 Cb 0.03 -2.69 -0.02 0.00 2.01 0.00 0.00 34.83 34.16 2k25 s MET 9 CO 0.33 0.37 -0.16 -0.65 -0.01 0.00 0.00 175.02 174.91 2k25 s GLN 10 N -0.04 1.01 0.27 2.03 1.11 -1.26 -4.33 119.66 118.47 2k25 s GLN 10 Ca -0.01 -0.83 -0.07 0.00 0.01 0.00 0.00 55.36 54.46 2k25 s GLN 10 Cb -0.14 -1.05 -0.01 0.00 -1.01 0.00 0.00 33.01 30.80 2k25 s GLN 10 CO 0.03 0.26 0.41 -1.50 0.01 0.00 0.00 175.29 174.50 2k25 s ILE 11 N -0.90 0.00 -0.24 1.08 2.07 -0.97 -4.87 121.20 117.38 2k25 s ILE 11 Ca 0.02 -1.59 -0.08 0.00 -1.41 0.00 0.00 60.65 57.59 2k25 s ILE 11 Cb -0.08 -2.42 -0.04 0.00 0.13 0.00 0.00 42.46 40.05 2k25 s ILE 11 CO 0.02 0.00 0.09 0.12 -1.91 0.00 0.00 174.94 173.26 2k25 s PHE 12 N -3.68 3.15 -0.05 3.50 5.36 -1.26 -4.11 117.98 120.88 2k25 s PHE 12 Ca 0.29 -0.19 0.01 0.00 -0.96 0.00 0.00 56.93 56.07 2k25 s PHE 12 Cb 0.01 -2.23 0.02 0.00 -0.34 0.00 0.00 43.02 40.48 2k25 s PHE 12 CO 0.14 -0.20 -0.07 0.08 -1.46 0.00 0.00 175.22 173.71 2k25 s VAL 13 N 1.37 0.71 -0.20 3.12 1.01 -1.25 -3.16 120.40 121.99 2k25 s VAL 13 Ca 0.06 -0.22 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2k25 s VAL 13 Cb -0.15 -0.70 0.03 0.00 0.00 0.00 0.00 36.38 35.57 2k25 s VAL 13 CO 0.05 0.26 -0.17 -0.54 0.00 0.00 0.00 175.10 174.70 2k25 s LYS 14 N 0.86 2.78 1.09 2.72 -0.14 -1.26 -3.31 119.74 122.48 2k25 s LYS 14 Ca -0.12 -0.98 -0.18 0.00 -1.36 0.00 0.00 55.97 53.33 2k25 s LYS 14 Cb -0.15 -2.67 0.27 0.00 -1.68 0.00 0.00 37.83 33.60 2k25 s LYS 14 CO 0.01 -0.31 1.13 0.25 -0.76 0.00 0.00 175.35 175.67 2k25 n THR 15 N 4.57 0.00 0.14 2.17 -2.24 -0.29 -4.87 114.28 113.76 2k25 n THR 15 Ca -0.19 -0.64 0.01 0.00 -2.27 0.00 0.00 64.05 60.96 2k25 n THR 15 Cb 0.48 -1.34 0.12 0.00 -2.10 0.00 0.00 70.33 67.49 2k25 n THR 15 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 2k25 h LEU 16 N 0.00 0.00 0.00 3.22 -0.00 -1.88 -3.23 115.31 113.42 2k25 h LEU 16 Ca -0.40 0.00 -0.26 0.00 -0.00 0.00 0.00 57.88 57.22 2k25 h LEU 16 Cb 1.18 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.80 2k25 h LEU 16 CO 0.27 0.58 -1.47 0.00 -0.00 0.00 0.00 178.44 177.83 2k25 h THR 17 N 0.00 1.05 0.00 0.15 1.03 -1.99 -3.48 112.91 109.68 2k25 h THR 17 Ca -0.01 -2.83 0.00 0.00 -0.01 0.00 0.00 66.41 63.56 2k25 h THR 17 Cb 1.27 2.50 0.00 0.00 -1.07 0.00 0.00 68.15 70.85 2k25 h THR 17 CO 0.08 0.60 0.00 0.61 -0.01 0.00 0.00 175.52 176.79 2k25 n GLY 18 N 1.48 0.94 3.75 2.99 0.00 -1.22 -5.12 105.19 108.00 2k25 n GLY 18 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 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 3.03 -0.07 1.61 3.01 -1.26 -4.65 119.74 121.40 2k25 s LYS 19 Ca 0.00 1.96 0.05 0.00 -1.01 0.00 0.00 55.97 56.98 2k25 s LYS 19 Cb 0.00 -2.05 -0.01 0.00 -1.01 0.00 0.00 37.83 34.77 2k25 s LYS 19 CO 0.00 -1.20 -0.24 0.99 0.51 0.00 0.00 175.35 175.41 2k25 s THR 20 N -1.48 2.04 -0.02 2.17 2.01 -1.26 -1.13 115.64 117.97 2k25 s THR 20 Ca 0.75 -1.04 0.02 0.00 0.31 0.00 0.00 61.69 61.73 2k25 s THR 20 Cb -0.34 -1.74 0.00 0.00 0.01 0.00 0.00 72.50 70.43 2k25 s THR 20 CO 0.38 0.56 -0.07 0.27 -0.69 0.00 0.00 174.62 175.07 2k25 s ILE 21 N 0.01 0.64 -0.18 1.82 -0.00 -1.21 -5.04 121.20 117.25 2k25 s ILE 21 Ca -0.09 -0.30 -0.29 0.00 -0.00 0.00 0.00 60.65 59.97 2k25 s ILE 21 Cb -0.15 -0.57 -0.00 0.00 -0.00 0.00 0.00 42.46 41.74 2k25 s ILE 21 CO 0.05 0.20 1.13 -0.89 -0.00 0.00 0.00 174.94 175.43 2k25 s THR 22 N 0.10 4.51 0.06 8.37 2.01 -1.26 -3.81 115.64 125.62 2k25 s THR 22 Ca -0.01 1.82 0.04 0.00 0.31 0.00 0.00 61.69 63.85 2k25 s THR 22 Cb -0.06 -4.17 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 2k25 s THR 22 CO 0.00 -0.13 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.03 2k25 s LEU 23 N 3.09 3.41 0.22 4.42 2.01 -1.26 -4.27 118.68 126.31 2k25 s LEU 23 Ca 0.49 -0.14 -0.11 0.00 0.01 0.00 0.00 54.13 54.39 2k25 s LEU 23 Cb -0.19 -2.08 -0.07 0.00 0.01 0.00 0.00 46.19 43.86 2k25 s LEU 23 CO 0.12 0.22 0.56 -0.70 1.01 0.00 0.00 176.35 177.55 2k25 s GLU 24 N -1.99 3.84 0.04 1.70 2.12 -1.26 -2.29 118.70 120.86 2k25 s GLU 24 Ca 0.23 0.33 -0.05 0.00 0.36 0.00 0.00 54.97 55.83 2k25 s GLU 24 Cb -0.12 -2.69 -0.01 0.00 0.26 0.00 0.00 34.13 31.57 2k25 s GLU 24 CO 0.15 0.34 0.09 0.08 -0.54 0.00 0.00 175.26 175.38 2k25 s VAL 25 N -1.76 0.13 -0.29 3.70 1.01 -1.26 -4.83 120.40 117.10 2k25 s VAL 25 Ca 0.46 -1.10 -0.31 0.00 0.00 0.00 0.00 61.98 61.02 2k25 s VAL 25 Cb -0.12 -0.90 0.19 0.00 0.00 0.00 0.00 36.38 35.55 2k25 s VAL 25 CO 0.21 -0.61 1.38 -1.61 0.00 0.00 0.00 175.10 174.47 2k25 s GLU 26 N -2.63 0.03 0.37 2.72 2.02 -1.25 -4.86 118.70 115.10 2k25 s GLU 26 Ca -0.05 0.00 0.16 0.00 0.02 0.00 0.00 54.97 55.10 2k25 s GLU 26 Cb -0.01 0.01 0.71 0.00 0.10 0.00 0.00 34.13 34.94 2k25 s GLU 26 CO -0.05 -0.01 1.78 -1.00 0.02 0.00 0.00 175.26 176.00 2k25 h PRO 27 N 2.02 0.00 -0.00 0.39 0.13 -1.99 -3.11 132.00 129.45 2k25 h PRO 27 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2k25 h PRO 27 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k25 h PRO 27 CO 0.21 0.40 -0.48 -1.13 -0.23 0.00 0.00 178.00 176.77 2k25 n SER 28 N -3.80 0.82 -4.37 1.44 3.41 -1.26 -2.79 113.62 107.07 2k25 n SER 28 Ca -0.01 -0.91 -0.41 0.00 -0.26 0.00 0.00 58.87 57.28 2k25 n SER 28 Cb 0.47 0.84 -0.11 0.00 -0.26 0.00 0.00 64.21 65.15 2k25 n SER 28 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k25 s ASP 29 N -1.98 5.77 0.75 4.04 2.15 -1.17 -4.90 116.67 121.33 2k25 s ASP 29 Ca 0.06 -1.04 -0.08 0.00 0.43 0.00 0.00 52.55 51.92 2k25 s ASP 29 Cb 0.10 -2.04 0.09 0.00 -0.30 0.00 0.00 42.92 40.76 2k25 s ASP 29 CO 0.44 -0.41 1.07 0.28 -0.17 0.00 0.00 175.17 176.38 2k25 s THR 30 N 1.55 2.20 0.60 1.71 -1.32 -1.26 -3.84 115.64 115.27 2k25 s THR 30 Ca 0.02 -0.23 0.29 0.00 -1.21 0.00 0.00 61.69 60.56 2k25 s THR 30 Cb -0.20 -2.96 0.37 0.00 -1.51 0.00 0.00 72.50 68.20 2k25 s THR 30 CO 0.07 0.00 1.96 0.40 -2.21 0.00 0.00 174.62 174.83 2k25 h ILE 31 N -0.77 0.37 -0.20 5.08 5.03 -1.94 -1.97 117.51 123.11 2k25 h ILE 31 Ca -0.44 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.36 2k25 h ILE 31 Cb 1.30 0.69 -0.07 0.00 -3.03 0.00 0.00 36.82 35.71 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 -0.32 0.10 2.37 4.81 -1.94 -0.11 114.58 119.49 2k25 h GLU 32 Ca 0.16 0.02 -0.27 0.00 -0.13 0.00 0.00 59.36 59.14 2k25 h GLU 32 Cb 0.94 0.07 0.01 0.00 0.63 0.00 0.00 28.75 30.40 2k25 h GLU 32 CO -0.00 -0.21 -1.17 -0.91 -0.73 0.00 0.00 179.01 175.98 2k25 h ASN 33 N -0.33 0.60 -0.80 1.04 4.21 -1.74 -3.25 115.58 115.30 2k25 h ASN 33 Ca 0.12 -0.57 0.17 0.00 1.21 0.00 0.00 56.30 57.23 2k25 h ASN 33 Cb 0.52 -0.19 -0.05 0.00 -1.12 0.00 0.00 38.32 37.47 2k25 h ASN 33 CO -0.38 1.41 0.54 0.58 -1.29 0.00 0.00 177.43 178.28 2k25 h VAL 34 N 0.18 0.74 -0.57 2.81 2.07 -1.03 0.11 116.25 120.56 2k25 h VAL 34 Ca -0.14 -0.13 0.16 0.00 0.82 0.00 0.00 66.70 67.41 2k25 h VAL 34 Cb 1.85 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.93 2k25 h VAL 34 CO 0.21 0.07 0.47 0.11 0.02 0.00 0.00 177.57 178.45 2k25 h LYS 35 N 0.38 0.00 -0.05 1.57 1.57 -1.06 0.33 116.57 119.30 2k25 h LYS 35 Ca 0.40 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.08 2k25 h LYS 35 Cb 1.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 2k25 h LYS 35 CO -0.13 0.00 -0.44 0.00 -0.57 0.00 0.00 179.45 178.31 2k25 h ALA 36 N 1.59 1.17 0.05 3.86 0.00 -0.97 0.12 119.26 125.08 2k25 h ALA 36 Ca 0.27 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 2k25 h ALA 36 Cb 1.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2k25 h ALA 36 CO -0.00 0.59 -0.02 0.87 0.00 0.00 0.00 179.25 180.68 2k25 h LYS 37 N 0.10 -0.06 -0.35 0.00 6.56 -0.47 -3.25 116.57 119.10 2k25 h LYS 37 Ca 0.01 0.00 -0.11 0.00 -1.06 0.00 0.00 60.65 59.50 2k25 h LYS 37 Cb 0.82 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.48 2k25 h LYS 37 CO 0.06 0.56 -0.22 0.97 -2.06 0.00 0.00 179.45 178.76 2k25 h ILE 38 N -0.80 1.27 -0.99 1.86 6.09 -1.49 -2.90 117.51 120.56 2k25 h ILE 38 Ca -0.01 -1.29 0.20 0.00 -1.37 0.00 0.00 64.86 62.39 2k25 h ILE 38 Cb 0.65 1.23 -0.10 0.00 0.47 0.00 0.00 36.82 39.08 2k25 h ILE 38 CO 0.01 0.42 0.62 -0.61 -3.07 0.00 0.00 178.15 175.52 2k25 h GLN 39 N 0.59 0.63 0.00 2.19 4.15 -0.84 0.37 115.11 122.19 2k25 h GLN 39 Ca 0.09 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.34 2k25 h GLN 39 Cb 0.69 -0.14 -0.02 0.00 0.21 0.00 0.00 27.48 28.22 2k25 h GLN 39 CO 0.05 0.41 -0.61 0.22 -1.93 0.00 0.00 178.83 176.98 2k25 h ASP 40 N 0.64 0.00 0.14 -0.69 3.58 -1.54 0.82 116.42 119.36 2k25 h ASP 40 Ca 0.56 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 58.00 2k25 h ASP 40 Cb 1.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.08 2k25 h ASP 40 CO -0.32 0.61 -0.07 0.11 -2.88 0.00 0.00 179.24 176.69 2k25 h LYS 41 N 0.00 -0.18 0.00 0.28 6.56 -0.27 -3.43 116.57 119.53 2k25 h LYS 41 Ca -0.01 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 2k25 h LYS 41 Cb 1.36 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 33.06 2k25 h LYS 41 CO 0.08 0.28 -0.75 -0.85 -2.06 0.00 0.00 179.45 176.14 2k25 n GLU 42 N -4.90 1.21 -2.04 3.15 0.28 0.30 -4.72 120.64 113.92 2k25 n GLU 42 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 2k25 n GLU 42 Cb 0.27 -0.88 0.00 0.00 1.43 0.00 0.00 31.44 32.26 2k25 n GLU 42 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2k25 n GLY 43 N 2.76 0.89 3.76 -1.84 0.00 0.28 -4.81 105.19 106.23 2k25 n GLY 43 Ca 0.00 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.67 4.51 -0.27 -0.61 -1.09 -1.26 -4.97 121.20 114.83 2k25 s ILE 44 Ca 0.00 1.75 -0.29 0.00 -2.23 0.00 0.00 60.65 59.88 2k25 s ILE 44 Cb 0.00 -4.16 -0.02 0.00 -1.58 0.00 0.00 42.46 36.70 2k25 s ILE 44 CO 0.00 0.43 1.64 -2.16 -1.23 0.00 0.00 174.94 173.63 2k25 s PRO 45 N -0.57 3.65 0.47 2.79 0.04 -1.26 -4.82 135.00 135.30 2k25 s PRO 45 Ca 0.39 1.53 0.31 0.00 0.04 0.00 0.00 61.00 63.26 2k25 s PRO 45 Cb -0.22 -4.08 1.30 0.00 0.04 0.00 0.00 34.50 31.54 2k25 s PRO 45 CO 0.26 -1.47 1.92 -1.00 0.04 0.00 0.00 177.00 176.74 2k25 h PRO 46 N 11.30 0.00 -0.94 0.56 0.13 -1.94 -1.31 132.00 139.80 2k25 h PRO 46 Ca -0.33 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.86 2k25 h PRO 46 Cb 1.15 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.22 2k25 h PRO 46 CO 1.02 0.00 0.61 0.38 -0.23 0.00 0.00 178.00 179.78 2k25 h ASP 47 N 0.00 0.96 0.00 1.44 3.04 -2.03 -3.00 116.42 116.83 2k25 h ASP 47 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 2k25 h ASP 47 Cb 0.45 -0.20 0.00 0.00 -1.04 0.00 0.00 39.33 38.53 2k25 h ASP 47 CO 0.00 0.63 -1.39 1.67 -2.04 0.00 0.00 179.24 178.11 2k25 n GLN 48 N -4.48 0.85 -1.09 4.15 -0.06 -1.16 -5.02 117.38 110.57 2k25 n GLN 48 Ca 0.14 -0.09 -0.35 0.00 -2.00 0.00 0.00 57.00 54.70 2k25 n GLN 48 Cb 0.18 -1.25 0.10 0.00 -4.06 0.00 0.00 30.24 25.20 2k25 n GLN 48 CO 0.00 0.00 0.00 0.94 -0.20 0.00 0.00 177.06 177.80 2k25 n GLN 49 N -1.81 0.10 -3.65 3.69 7.27 -0.50 -4.97 117.38 117.50 2k25 n GLN 49 Ca -0.01 0.09 -0.23 0.00 0.07 0.00 0.00 57.00 56.92 2k25 n GLN 49 Cb 0.30 -1.97 -0.02 0.00 2.41 0.00 0.00 30.24 30.96 2k25 n GLN 49 CO 0.00 0.00 0.00 -0.98 0.07 0.00 0.00 177.06 176.15 2k25 s ARG 50 N -3.32 2.40 -0.07 3.69 1.70 -1.26 -4.95 118.95 117.15 2k25 s ARG 50 Ca 0.65 -1.72 0.03 0.00 -0.47 0.00 0.00 55.73 54.22 2k25 s ARG 50 Cb -0.29 -2.29 0.01 0.00 -0.57 0.00 0.00 34.95 31.80 2k25 s ARG 50 CO 0.59 -0.39 -0.15 -0.51 -1.08 0.00 0.00 175.30 173.77 2k25 s LEU 51 N -4.21 1.76 -0.11 -1.89 1.02 -1.26 -4.35 118.68 109.64 2k25 s LEU 51 Ca 0.45 -0.36 -0.01 0.00 0.02 0.00 0.00 54.13 54.23 2k25 s LEU 51 Cb -0.03 -0.95 0.03 0.00 0.02 0.00 0.00 46.19 45.26 2k25 s LEU 51 CO 0.26 0.07 -0.04 -0.63 0.02 0.00 0.00 176.35 176.04 2k25 s ILE 52 N 0.54 0.75 -0.20 -0.59 1.09 -1.15 -3.09 121.20 118.55 2k25 s ILE 52 Ca -0.14 -0.18 -0.01 0.00 -1.10 0.00 0.00 60.65 59.21 2k25 s ILE 52 Cb -0.16 -0.87 0.05 0.00 -1.06 0.00 0.00 42.46 40.42 2k25 s ILE 52 CO 0.05 0.26 -0.03 0.12 -0.10 0.00 0.00 174.94 175.24 2k25 s PHE 53 N 1.81 1.77 -1.34 3.97 5.36 0.82 -2.59 117.98 127.78 2k25 s PHE 53 Ca 0.04 -1.26 -0.03 0.00 -0.96 0.00 0.00 56.93 54.72 2k25 s PHE 53 Cb -0.13 -1.33 0.02 0.00 -0.34 0.00 0.00 43.02 41.24 2k25 s PHE 53 CO -0.07 -0.67 0.27 0.00 -1.46 0.00 0.00 175.22 173.29 2k25 n ALA 54 N 4.85 -0.87 0.00 11.12 0.00 -1.26 -0.08 120.51 134.27 2k25 n ALA 54 Ca -0.11 0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2k25 n ALA 54 Cb 0.46 -2.49 0.00 0.00 0.00 0.00 0.00 19.45 17.42 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 -1.10 3.25 3.66 0.00 0.00 -1.26 -5.01 105.19 104.72 2k25 n GLY 55 Ca -0.12 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.54 4.10 0.53 1.61 2.47 0.89 -5.05 119.74 123.74 2k25 s LYS 56 Ca 0.00 -0.14 -0.14 0.00 -1.56 0.00 0.00 55.97 54.14 2k25 s LYS 56 Cb 0.00 -3.54 -0.06 0.00 -1.46 0.00 0.00 37.83 32.76 2k25 s LYS 56 CO 0.00 0.03 0.96 1.14 0.16 0.00 0.00 175.35 177.63 2k25 s GLN 57 N 1.15 3.81 0.04 4.03 0.00 -1.26 -0.13 119.66 127.30 2k25 s GLN 57 Ca 0.11 0.79 -0.00 0.00 -0.00 0.00 0.00 55.36 56.26 2k25 s GLN 57 Cb -0.14 -2.17 0.00 0.00 0.00 0.00 0.00 33.01 30.70 2k25 s GLN 57 CO 0.06 -0.32 0.05 1.47 0.00 0.00 0.00 175.29 176.55 2k25 n LEU 58 N -1.89 0.00 0.00 2.60 -0.00 -1.18 -4.90 117.00 111.63 2k25 n LEU 58 Ca 0.06 -0.30 -0.14 0.00 -0.00 0.00 0.00 56.01 55.62 2k25 n LEU 58 Cb 0.54 0.28 -0.01 0.00 -0.00 0.00 0.00 43.42 44.22 2k25 n LEU 58 CO 0.50 -0.07 -0.02 -0.62 -0.00 0.00 0.00 177.39 177.18 2k25 n GLU 59 N -0.06 1.20 -4.48 1.47 1.02 -1.26 -4.35 120.64 114.17 2k25 n GLU 59 Ca 0.00 -1.77 -0.23 0.00 -0.02 0.00 0.00 57.16 55.14 2k25 n GLU 59 Cb 0.06 0.30 -0.14 0.00 -0.02 0.00 0.00 31.44 31.65 2k25 n GLU 59 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 2k25 s ASP 60 N -2.53 2.08 0.00 1.62 2.15 -1.26 -4.92 116.67 113.80 2k25 s ASP 60 Ca 0.10 -0.50 0.00 0.00 0.43 0.00 0.00 52.55 52.58 2k25 s ASP 60 Cb -0.01 -0.15 0.00 0.00 -0.30 0.00 0.00 42.92 42.46 2k25 s ASP 60 CO 0.06 0.09 0.00 0.61 -0.17 0.00 0.00 175.17 175.76 2k25 n GLY 61 N 1.84 1.33 3.58 2.66 0.00 -1.26 -5.10 105.19 108.24 2k25 n GLY 61 Ca -0.18 -0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.48 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 1.88 0.95 1.61 1.81 -1.26 -5.01 118.95 118.93 2k25 s ARG 62 Ca 0.00 -2.04 -0.16 0.00 -1.72 0.00 0.00 55.73 51.82 2k25 s ARG 62 Cb 0.00 -1.58 0.19 0.00 -0.45 0.00 0.00 34.95 33.11 2k25 s ARG 62 CO 0.00 -0.00 1.29 0.95 -0.68 0.00 0.00 175.30 176.85 2k25 s THR 63 N -2.74 1.98 0.11 0.02 -4.23 -1.26 -4.61 115.64 104.91 2k25 s THR 63 Ca 0.34 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.71 2k25 s THR 63 Cb 0.08 -2.97 -0.06 0.00 1.34 0.00 0.00 72.50 70.89 2k25 s THR 63 CO 0.17 0.00 1.47 -0.07 -0.54 0.00 0.00 174.62 175.66 2k25 h LEU 64 N -1.61 0.77 -1.27 4.79 3.38 -1.72 -1.43 115.31 118.22 2k25 h LEU 64 Ca -0.45 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.05 2k25 h LEU 64 Cb 1.25 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 2k25 h LEU 64 CO 0.42 1.02 -0.07 -1.28 0.09 0.00 0.00 178.44 178.62 2k25 h SER 65 N 0.52 0.39 0.06 -0.43 0.87 -1.75 0.21 113.55 113.41 2k25 h SER 65 Ca 0.07 -0.08 -0.23 0.00 -1.23 0.00 0.00 61.79 60.32 2k25 h SER 65 Cb 0.75 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2k25 h SER 65 CO 0.06 0.51 -0.90 -0.33 -0.53 0.00 0.00 176.83 175.64 2k25 h GLU 66 N 0.39 0.63 -0.09 2.24 4.39 -1.75 -3.10 114.58 117.30 2k25 h GLU 66 Ca 0.08 -0.60 0.00 0.00 0.34 0.00 0.00 59.36 59.18 2k25 h GLU 66 Cb 0.38 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.18 2k25 h GLU 66 CO 0.02 1.21 0.00 0.66 -1.16 0.00 0.00 179.01 179.74 2k25 n TYR 67 N -3.86 0.10 -2.96 4.33 4.01 -0.55 -4.91 117.16 113.32 2k25 n TYR 67 Ca -0.08 -0.05 -0.20 0.00 -0.16 0.00 0.00 57.90 57.41 2k25 n TYR 67 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.84 2k25 n TYR 67 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2k25 n ASN 68 N 0.09 -4.38 -4.72 7.72 4.13 0.56 -4.96 115.26 113.70 2k25 n ASN 68 Ca 0.17 -0.17 -0.23 0.00 1.68 0.00 0.00 54.58 56.04 2k25 n ASN 68 Cb 0.30 -3.63 -0.06 0.00 -1.54 0.00 0.00 39.78 34.85 2k25 n ASN 68 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2k25 s ILE 69 N -2.89 3.89 -0.77 2.41 -4.36 -0.23 -5.02 121.20 114.23 2k25 s ILE 69 Ca 0.24 -1.67 0.03 0.00 -0.26 0.00 0.00 60.65 58.98 2k25 s ILE 69 Cb -0.12 -3.09 0.23 0.00 1.25 0.00 0.00 42.46 40.73 2k25 s ILE 69 CO 0.29 -0.35 0.79 0.00 0.24 0.00 0.00 174.94 175.91 2k25 n GLN 70 N -0.99 2.64 -0.36 0.37 10.64 -1.26 -4.51 117.38 123.91 2k25 n GLN 70 Ca -0.07 -4.57 0.06 0.00 -1.83 0.00 0.00 57.00 50.58 2k25 n GLN 70 Cb 0.58 -2.33 0.21 0.00 -0.86 0.00 0.00 30.24 27.84 2k25 n GLN 70 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2k25 n LYS 71 N 1.50 2.61 -0.86 2.61 5.02 -1.26 -4.12 118.16 123.66 2k25 n LYS 71 Ca 0.25 -1.69 -0.12 0.00 -2.02 0.00 0.00 58.31 54.74 2k25 n LYS 71 Cb 0.38 -1.63 0.18 0.00 -0.02 0.00 0.00 35.03 33.94 2k25 n LYS 71 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2k25 n GLU 72 N 0.57 2.46 0.00 1.97 0.28 -1.26 -4.54 120.64 120.13 2k25 n GLU 72 Ca 0.15 -2.29 0.00 0.00 -0.16 0.00 0.00 57.16 54.87 2k25 n GLU 72 Cb 0.57 -1.94 0.00 0.00 1.43 0.00 0.00 31.44 31.51 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 -0.42 0.00 -3.72 -1.84 2.88 -1.26 -5.07 113.62 104.19 2k25 n SER 73 Ca 0.39 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.65 2k25 n SER 73 Cb 1.27 0.00 -0.17 0.00 -0.75 0.00 0.00 64.21 64.57 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 -0.15 0.44 0.02 2.46 2.01 -1.26 -4.43 115.64 114.73 2k25 s THR 74 Ca 0.00 -0.50 0.04 0.00 0.31 0.00 0.00 61.69 61.55 2k25 s THR 74 Cb 0.00 -0.96 -0.02 0.00 0.01 0.00 0.00 72.50 71.53 2k25 s THR 74 CO 0.00 -0.21 -0.13 -0.76 -0.69 0.00 0.00 174.62 172.82 2k25 s LEU 75 N 1.90 2.12 -0.19 4.42 2.01 -1.19 -4.04 118.68 123.71 2k25 s LEU 75 Ca -0.00 -0.38 -0.03 0.00 0.01 0.00 0.00 54.13 53.72 2k25 s LEU 75 Cb -0.17 -0.61 0.06 0.00 0.01 0.00 0.00 46.19 45.48 2k25 s LEU 75 CO -0.08 0.07 0.04 -2.28 1.01 0.00 0.00 176.35 175.12 2k25 s HIS 76 N -0.67 0.91 -0.40 0.29 5.65 -1.07 -3.83 115.29 116.17 2k25 s HIS 76 Ca 0.02 -0.79 0.01 0.00 0.25 0.00 0.00 55.06 54.56 2k25 s HIS 76 Cb -0.07 -0.99 0.13 0.00 -1.18 0.00 0.00 32.58 30.47 2k25 s HIS 76 CO 0.01 -0.60 0.19 -0.51 -0.65 0.00 0.00 174.74 173.18 2k25 s LEU 77 N 1.90 2.65 -0.15 8.88 1.02 -1.26 -2.94 118.68 128.78 2k25 s LEU 77 Ca -0.00 -2.36 -0.07 0.00 0.02 0.00 0.00 54.13 51.72 2k25 s LEU 77 Cb -0.17 -1.01 0.06 0.00 0.02 0.00 0.00 46.19 45.09 2k25 s LEU 77 CO -0.09 -0.31 0.34 -0.69 0.02 0.00 0.00 176.35 175.63 2k25 s VAL 78 N 0.69 -0.15 -0.26 -1.59 1.01 -1.26 -4.89 120.40 113.94 2k25 s VAL 78 Ca 0.15 0.14 -0.01 0.00 0.00 0.00 0.00 61.98 62.27 2k25 s VAL 78 Cb -0.23 -0.52 0.04 0.00 0.00 0.00 0.00 36.38 35.67 2k25 s VAL 78 CO -0.06 0.06 -0.05 -0.22 0.00 0.00 0.00 175.10 174.83 2k25 s LEU 79 N 1.63 3.40 -0.96 3.92 2.96 -1.26 -4.75 118.68 123.62 2k25 s LEU 79 Ca -0.07 -1.03 -0.11 0.00 -0.22 0.00 0.00 54.13 52.70 2k25 s LEU 79 Cb -0.10 -1.66 -0.00 0.00 0.50 0.00 0.00 46.19 44.93 2k25 s LEU 79 CO -0.11 -0.17 0.71 -1.14 -1.32 0.00 0.00 176.35 174.32 2k25 n ARG 80 N 4.63 -1.28 -0.70 1.98 0.63 -1.26 -4.90 116.66 115.75 2k25 n ARG 80 Ca -0.15 0.76 -0.33 0.00 -0.92 0.00 0.00 57.85 57.21 2k25 n ARG 80 Cb 0.46 -3.86 0.16 0.00 0.45 0.00 0.00 32.46 29.66 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 -3.22 -2.32 0.02 6.15 -0.00 -1.26 -5.00 117.00 111.37 2k25 n LEU 81 Ca -0.14 -0.10 0.00 0.00 -0.00 0.00 0.00 56.01 55.77 2k25 n LEU 81 Cb 0.60 -0.93 0.00 0.00 -0.00 0.00 0.00 43.42 43.09 2k25 n LEU 81 CO 0.63 -3.07 0.00 -1.14 -0.00 0.00 0.00 177.39 173.81 2k25 n ARG 82 N -1.68 0.00 0.00 1.47 3.00 -1.26 -5.10 116.66 113.08 2k25 n ARG 82 Ca 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.86 2k25 n ARG 82 Cb 0.63 -0.03 0.00 0.00 0.00 0.00 0.00 32.46 33.06 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 2.34 -0.91 3.32 5.14 0.00 -1.26 -5.17 105.19 108.64 2k25 n GLY 83 Ca 0.00 -0.11 -0.20 0.00 0.00 0.00 0.00 46.02 45.71 2k25 n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k25 s TYR 84 N -4.00 1.70 0.14 1.61 1.51 -1.26 -4.63 117.35 112.42 2k25 s TYR 84 Ca 0.00 -0.52 -0.20 0.00 -1.01 0.00 0.00 57.07 55.35 2k25 s TYR 84 Cb 0.00 -0.84 0.05 0.00 -0.11 0.00 0.00 41.96 41.06 2k25 s TYR 84 CO 0.00 0.30 0.50 0.00 -1.11 0.00 0.00 175.55 175.24 2k25 s ALA 85 N -2.34 -1.25 1.43 3.71 0.00 -1.26 -5.14 121.76 116.91 2k25 s ALA 85 Ca 0.16 0.23 -0.23 0.00 0.00 0.00 0.00 51.96 52.12 2k25 s ALA 85 Cb -0.04 0.77 0.36 0.00 0.00 0.00 0.00 23.12 24.20 2k25 s ALA 85 CO 0.06 -0.69 0.87 -0.40 0.00 0.00 0.00 175.76 175.60 2k25 n ASP 86 N -0.26 -3.77 -4.40 0.00 5.75 -1.26 -4.48 116.55 108.12 2k25 n ASP 86 Ca -0.17 -0.89 -0.21 0.00 -0.01 0.00 0.00 54.79 53.51 2k25 n ASP 86 Cb 0.64 -0.96 -0.10 0.00 -1.03 0.00 0.00 41.12 39.67 2k25 n ASP 86 CO 0.00 0.00 0.00 -1.48 -0.11 0.00 0.00 177.20 175.61 2k25 s LEU 87 N 0.00 2.57 0.00 -2.12 0.05 -1.26 -4.86 118.68 113.06 2k25 s LEU 87 Ca 0.65 -1.02 0.00 0.00 0.05 0.00 0.00 54.13 53.81 2k25 s LEU 87 Cb -0.11 -0.86 0.00 0.00 -2.05 0.00 0.00 46.19 43.18 2k25 s LEU 87 CO 0.54 -0.08 0.00 0.54 -0.55 0.00 0.00 176.35 176.80 2k25 n ARG 88 N -0.46 0.00 -0.03 1.48 1.74 -1.26 -4.99 116.66 113.13 2k25 n ARG 88 Ca -0.07 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 56.98 2k25 n ARG 88 Cb 0.60 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.99 2k25 n ARG 88 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2k25 n GLU 89 N -2.40 2.69 -1.25 5.56 2.13 -1.26 -5.13 120.64 120.98 2k25 n GLU 89 Ca 0.00 0.00 0.15 0.00 0.66 0.00 0.00 57.16 57.97 2k25 n GLU 89 Cb 0.00 -1.17 -0.08 0.00 0.27 0.00 0.00 31.44 30.46 2k25 n GLU 89 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2k25 n ASP 90 N -2.29 -6.80 -4.67 4.31 9.92 -1.26 -4.75 116.55 111.01 2k25 n ASP 90 Ca -0.11 1.26 -0.42 0.00 -0.53 0.00 0.00 54.79 54.98 2k25 n ASP 90 Cb 0.71 -4.30 -0.03 0.00 -0.64 0.00 0.00 41.12 36.87 2k25 n ASP 90 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 2k25 s PRO 91 N -4.10 4.23 -0.29 -0.24 0.04 -1.26 -4.99 135.00 128.38 2k25 s PRO 91 Ca 0.00 2.02 -0.15 0.00 0.04 0.00 0.00 61.00 62.91 2k25 s PRO 91 Cb 0.00 -3.78 0.10 0.00 0.04 0.00 0.00 34.50 30.86 2k25 s PRO 91 CO 0.00 -0.72 0.72 0.34 0.04 0.00 0.00 177.00 177.38 2k25 s ASP 92 N 2.51 -0.94 0.02 6.66 2.15 -1.26 -4.94 116.67 120.87 2k25 s ASP 92 Ca 0.66 1.45 0.00 0.00 0.43 0.00 0.00 52.55 55.09 2k25 s ASP 92 Cb -0.31 1.56 -0.00 0.00 -0.30 0.00 0.00 42.92 43.87 2k25 s ASP 92 CO 0.26 -0.22 0.02 0.54 -0.17 0.00 0.00 175.17 175.60 2k25 n ARG 93 N 4.50 0.03 -3.20 4.34 1.74 -1.26 -5.18 116.66 117.64 2k25 n ARG 93 Ca -0.18 -0.21 -0.19 0.00 -0.77 0.00 0.00 57.85 56.50 2k25 n ARG 93 Cb 0.57 0.18 0.01 0.00 -1.02 0.00 0.00 32.46 32.20 2k25 n ARG 93 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2k25 s GLN 94 N -2.08 2.61 -0.30 5.56 -0.21 -1.26 -5.13 119.66 118.86 2k25 s GLN 94 Ca 0.02 -1.45 -0.12 0.00 0.02 0.00 0.00 55.36 53.83 2k25 s GLN 94 Cb 0.00 -2.61 0.18 0.00 1.00 0.00 0.00 33.01 31.58 2k25 s GLN 94 CO 0.02 -0.41 1.00 0.34 -2.12 0.00 0.00 175.29 174.12 2k25 s ASP 95 N -4.37 -0.56 -0.08 5.90 2.15 -1.26 -5.17 116.67 113.28 2k25 s ASP 95 Ca 0.54 0.43 -0.12 0.00 0.43 0.00 0.00 52.55 53.83 2k25 s ASP 95 Cb -0.07 1.50 0.03 0.00 -0.30 0.00 0.00 42.92 44.08 2k25 s ASP 95 CO 0.32 -0.10 0.30 -2.28 -0.17 0.00 0.00 175.17 173.24 2k25 s HIS 96 N 2.81 -0.27 0.26 -5.34 2.46 -1.26 -5.17 115.29 108.78 2k25 s HIS 96 Ca 0.01 0.61 0.10 0.00 0.47 0.00 0.00 55.06 56.25 2k25 s HIS 96 Cb -0.10 0.10 -0.05 0.00 -0.13 0.00 0.00 32.58 32.41 2k25 s HIS 96 CO -0.13 -0.23 -0.09 -1.01 -2.47 0.00 0.00 174.74 170.81 2k25 s HIS 97 N -0.33 2.54 1.18 3.88 3.76 -1.26 -5.14 115.29 119.92 2k25 s HIS 97 Ca -0.05 -0.26 -0.20 0.00 -0.15 0.00 0.00 55.06 54.40 2k25 s HIS 97 Cb -0.03 -1.13 0.29 0.00 1.11 0.00 0.00 32.58 32.82 2k25 s HIS 97 CO 0.02 0.64 1.05 -0.35 -0.85 0.00 0.00 174.74 175.25 2k25 n PRO 98 N -0.70 -3.07 0.00 8.40 -0.04 -1.26 -5.05 135.00 133.28 2k25 n PRO 98 Ca -0.06 -1.68 0.00 0.00 -0.04 0.00 0.00 63.50 61.71 2k25 n PRO 98 Cb 0.59 -1.58 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2k25 n PRO 98 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k25 n GLY 99 N -4.50 -0.09 3.65 0.55 0.00 -1.26 -5.18 105.19 98.36 2k25 n GLY 99 Ca 0.15 0.27 0.01 0.00 0.00 0.00 0.00 46.02 46.45 2k25 n GLY 99 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2k25 s SER 100 N 0.00 -0.22 0.32 1.61 1.04 -1.26 -5.18 113.70 110.00 2k25 s SER 100 Ca 0.00 0.36 0.09 0.00 0.48 0.00 0.00 55.95 56.88 2k25 s SER 100 Cb 0.00 1.08 -0.05 0.00 0.10 0.00 0.00 66.02 67.15 2k25 s SER 100 CO 0.00 -0.06 0.02 -0.83 0.98 0.00 0.00 173.24 173.36 2k25 s GLY 101 N 1.13 1.93 -0.30 7.32 0.00 -1.26 -5.14 107.32 111.01 2k25 s GLY 101 Ca -0.08 -1.85 -0.16 0.00 0.00 0.00 0.00 44.72 42.62 2k25 s GLY 101 CO -0.12 -1.83 1.20 0.00 0.00 0.00 0.00 173.10 172.35 2k25 s ALA 102 N -2.45 -2.55 -1.46 3.20 0.00 -1.26 -5.37 121.76 111.86 2k25 s ALA 102 Ca 0.34 2.02 0.12 0.00 0.00 0.00 0.00 51.96 54.44 2k25 s ALA 102 Cb -0.02 -1.91 0.09 0.00 0.00 0.00 0.00 23.12 21.28 2k25 s ALA 102 CO 0.20 -0.31 0.87 1.04 0.00 0.00 0.00 175.76 177.56